==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 01-JUL-11 3SP6 . COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.RONG,Y.LI . 281 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14118.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 205 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 1 0.4 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 . 6 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 157 55.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 1 0 1 1 1 0 2 1 0 0 0 0 0 0 0 1 1 1 0 0 1 0 0 0 1 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 196 A E > 0 0 181 0, 0.0 4,-2.1 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -42.4 32.2 -3.0 -2.1 2 197 A D H > + 0 0 134 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.800 360.0 61.7 -68.3 -25.1 33.8 -0.6 0.3 3 198 A S H > S+ 0 0 81 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.811 106.6 45.6 -68.6 -28.0 31.1 1.8 -0.9 4 199 A E H > S+ 0 0 124 -3,-0.5 4,-2.4 2,-0.2 3,-0.2 0.947 111.7 45.5 -81.1 -52.4 28.5 -0.7 0.5 5 200 A T H X S+ 0 0 75 -4,-2.1 4,-2.7 1,-0.3 5,-0.2 0.869 112.2 56.1 -62.0 -32.5 30.0 -1.5 3.9 6 201 A A H X S+ 0 0 49 -4,-1.8 4,-2.3 -5,-0.3 -1,-0.3 0.896 109.1 45.5 -61.4 -41.0 30.5 2.2 4.3 7 202 A D H X S+ 0 0 97 -4,-1.0 4,-2.4 -3,-0.2 -2,-0.2 0.821 112.0 51.6 -72.6 -32.1 26.8 2.7 3.6 8 203 A L H X S+ 0 0 31 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.920 112.8 45.0 -67.9 -44.9 25.9 -0.1 6.0 9 204 A K H X S+ 0 0 148 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.936 114.7 49.2 -62.6 -46.4 28.0 1.4 8.8 10 205 A S H X S+ 0 0 50 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.900 109.9 50.6 -58.7 -45.7 26.6 4.9 8.0 11 206 A L H X S+ 0 0 30 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.913 108.1 52.7 -61.9 -42.3 23.0 3.6 8.1 12 207 A A H X S+ 0 0 14 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.920 110.9 48.3 -58.3 -43.2 23.6 1.9 11.5 13 208 A K H X S+ 0 0 126 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.916 109.8 51.4 -62.9 -43.8 24.8 5.3 12.8 14 209 A R H X S+ 0 0 118 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.844 110.1 48.2 -66.1 -33.5 21.9 7.2 11.4 15 210 A I H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.907 110.3 52.5 -72.8 -38.8 19.3 4.9 13.0 16 211 A Y H X S+ 0 0 72 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.916 110.9 48.3 -59.3 -44.2 21.2 5.1 16.3 17 212 A E H X S+ 0 0 76 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.919 109.2 51.2 -62.2 -45.4 21.0 8.9 16.0 18 213 A A H X S+ 0 0 7 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.860 111.2 50.5 -61.1 -33.1 17.3 8.9 15.2 19 214 A Y H X S+ 0 0 3 -4,-1.9 4,-2.0 2,-0.2 3,-0.3 0.918 110.8 47.0 -71.0 -44.9 16.7 6.7 18.2 20 215 A L H < S+ 0 0 78 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.879 115.2 47.7 -64.1 -36.5 18.7 9.0 20.5 21 216 A K H < S+ 0 0 165 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.709 118.6 38.2 -71.5 -25.8 16.8 12.1 19.1 22 217 A N H < S+ 0 0 42 -4,-1.1 2,-0.5 -3,-0.3 -2,-0.2 0.776 98.3 71.6-107.1 -30.7 13.4 10.6 19.4 23 218 A F < - 0 0 9 -4,-2.0 -1,-0.1 -5,-0.2 63,-0.0 -0.804 57.7-155.1 -98.6 131.0 13.1 8.5 22.6 24 219 A N S S+ 0 0 50 -2,-0.5 2,-0.4 1,-0.1 -1,-0.1 0.772 84.4 45.0 -68.6 -29.1 13.0 10.3 26.0 25 220 A M + 0 0 34 -3,-0.1 2,-0.3 4,-0.0 101,-0.1 -0.936 64.8 165.3-121.1 139.6 14.3 7.2 27.7 26 221 A N > - 0 0 19 -2,-0.4 4,-2.8 100,-0.1 5,-0.2 -0.895 50.3 -96.6-141.8 175.5 17.2 4.9 26.6 27 222 A K H > S+ 0 0 14 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.851 121.3 49.9 -68.2 -36.0 19.2 2.2 28.3 28 223 A V H > S+ 0 0 92 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.972 113.5 44.6 -63.8 -55.8 22.1 4.5 29.2 29 224 A K H > S+ 0 0 105 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.915 113.8 52.1 -53.0 -44.8 19.8 7.1 30.8 30 225 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.912 110.4 47.0 -63.3 -41.2 17.9 4.4 32.6 31 226 A R H X S+ 0 0 85 -4,-2.2 4,-4.1 2,-0.2 6,-0.2 0.891 109.0 54.3 -69.1 -40.2 21.1 2.8 34.1 32 227 A V H X S+ 0 0 62 -4,-2.6 4,-0.7 2,-0.2 -2,-0.2 0.996 113.9 41.8 -50.4 -65.1 22.4 6.2 35.2 33 228 A I H < S+ 0 0 31 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.902 122.9 40.5 -46.1 -50.7 19.2 6.8 37.1 34 229 A L H < S+ 0 0 43 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.907 113.9 50.0 -68.6 -44.7 19.1 3.2 38.4 35 230 A S H < S- 0 0 67 -4,-4.1 -1,-0.2 2,-0.2 -2,-0.1 0.714 111.9-138.7 -34.8 -47.7 22.8 2.7 39.2 36 231 A G < + 0 0 42 -4,-0.7 2,-0.4 -3,-0.4 -1,-0.2 -0.371 45.8 158.2-124.1 75.1 22.0 5.1 40.4 37 232 A K - 0 0 149 -6,-0.2 -2,-0.2 1,-0.2 -3,-0.1 -0.833 63.3 -23.7 -95.8 132.3 24.8 7.7 40.0 38 233 A A + 0 0 85 -2,-0.4 -1,-0.2 -5,-0.1 -5,-0.1 -0.909 69.1 134.2-139.2 27.0 24.3 10.4 40.2 39 234 A S - 0 0 67 1,-0.1 -1,-0.1 2,-0.1 -3,-0.0 0.007 52.9-130.0 -36.1 130.7 20.9 12.1 39.6 40 235 A N S S+ 0 0 92 1,-0.2 -1,-0.1 -3,-0.1 -2,-0.0 0.934 97.8 39.7 -52.3 -52.5 20.3 14.6 42.4 41 236 A N S S- 0 0 138 3,-0.0 -1,-0.2 0, 0.0 3,-0.1 -0.831 83.8-147.9-111.4 98.1 16.9 13.3 43.2 42 237 A P - 0 0 95 0, 0.0 -8,-0.1 0, 0.0 3,-0.1 -0.070 37.7 -78.4 -52.5 153.5 16.5 9.4 43.0 43 238 A P - 0 0 26 0, 0.0 2,-0.3 0, 0.0 97,-0.3 -0.319 43.2-114.6 -59.9 134.0 13.2 7.8 41.9 44 239 A F E -a 140 0A 88 95,-2.2 97,-2.4 -3,-0.1 2,-0.5 -0.576 35.3-129.7 -62.9 128.3 10.3 7.7 44.4 45 240 A V E -a 141 0A 73 -2,-0.3 2,-0.7 95,-0.2 97,-0.2 -0.701 17.3-159.2 -85.2 128.4 9.8 3.9 45.0 46 241 A I E +a 142 0A 11 95,-3.3 97,-2.4 -2,-0.5 100,-0.2 -0.925 34.1 142.4-108.1 110.2 6.3 2.7 44.7 47 242 A H + 0 0 97 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 0.396 65.1 11.6-128.9 -3.9 5.8 -0.5 46.6 48 243 A D S > S- 0 0 55 1,-0.0 4,-2.1 98,-0.0 -1,-0.2 -0.945 89.7 -80.1-161.1 180.0 2.4 -0.3 48.1 49 244 A M H > S+ 0 0 78 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.816 123.1 52.5 -60.9 -32.5 -0.8 1.8 48.1 50 245 A E H > S+ 0 0 135 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.929 110.9 44.7 -72.7 -46.5 0.6 4.5 50.3 51 246 A T H > S+ 0 0 20 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.835 112.1 55.7 -65.5 -31.9 3.7 5.1 48.2 52 247 A L H X S+ 0 0 9 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.916 108.1 46.2 -63.4 -45.4 1.5 5.1 45.1 53 248 A C H X S+ 0 0 55 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.892 113.4 50.8 -66.7 -38.8 -0.8 7.8 46.5 54 249 A M H X S+ 0 0 92 -4,-2.1 4,-1.3 2,-0.2 5,-0.2 0.955 111.7 46.1 -59.1 -53.3 2.3 9.8 47.5 55 250 A A H >X S+ 0 0 5 -4,-2.6 4,-3.2 1,-0.2 3,-0.5 0.928 112.4 52.2 -56.9 -46.4 3.9 9.5 44.0 56 251 A E H 3X S+ 0 0 8 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.926 104.5 55.4 -55.4 -48.6 0.5 10.4 42.4 57 252 A K H 3< S+ 0 0 155 -4,-2.3 -1,-0.2 1,-0.2 4,-0.2 0.801 121.4 29.3 -56.4 -31.8 0.1 13.6 44.5 58 253 A T H << S+ 0 0 85 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.754 128.1 36.9 -99.9 -28.4 3.5 14.9 43.3 59 254 A L H < S+ 0 0 58 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.738 135.6 8.2-105.1 -26.9 3.9 13.3 39.9 60 255 A V S >< S+ 0 0 61 -4,-2.1 3,-1.8 -5,-0.4 4,-0.3 -0.204 70.2 161.2-144.7 51.3 0.4 13.3 38.3 61 256 A A G > + 0 0 48 1,-0.3 3,-1.8 -4,-0.2 4,-0.3 0.724 66.7 70.6 -49.5 -29.6 -1.7 15.4 40.7 62 257 A K G > S+ 0 0 171 1,-0.3 3,-1.6 2,-0.2 4,-0.4 0.908 92.5 57.0 -53.2 -46.1 -4.4 16.0 38.1 63 258 A L G < S+ 0 0 24 -3,-1.8 6,-0.3 1,-0.3 -1,-0.3 0.556 117.7 34.3 -66.4 -8.4 -5.5 12.4 38.2 64 259 A V G < S+ 0 0 31 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.175 89.0 92.9-131.6 14.9 -6.1 12.7 42.0 65 260 A A < 0 0 76 -3,-1.6 -2,-0.1 -4,-0.3 -3,-0.1 0.582 360.0 360.0 -83.0 -10.6 -7.3 16.3 42.2 66 261 A N 0 0 131 -4,-0.4 -1,-0.0 0, 0.0 -3,-0.0 -0.353 360.0 360.0 -61.7 360.0 -10.9 15.0 41.9 67 ! 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 68 265 A N 0 0 101 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 149.1 -11.2 9.3 42.1 69 266 A K - 0 0 58 -6,-0.3 5,-0.0 1,-0.2 2,-0.0 -0.285 360.0 -72.7 -86.2 170.4 -11.1 5.9 40.5 70 267 A E >> - 0 0 84 1,-0.1 4,-2.1 -2,-0.1 3,-1.1 -0.339 46.9-113.5 -60.7 142.6 -9.9 2.6 41.9 71 268 A A H 3> S+ 0 0 13 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.839 115.6 53.5 -46.0 -46.0 -6.1 2.3 42.3 72 269 A E H 3> S+ 0 0 20 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.840 110.1 48.4 -63.9 -32.6 -5.7 -0.4 39.6 73 270 A V H <> S+ 0 0 4 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.866 107.8 53.0 -75.5 -39.8 -7.6 1.8 37.1 74 271 A R H X S+ 0 0 22 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.873 110.6 48.9 -60.9 -38.6 -5.5 4.9 37.8 75 272 A I H X S+ 0 0 20 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.881 109.4 52.0 -68.4 -38.2 -2.4 2.8 37.2 76 273 A F H X S+ 0 0 13 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.837 108.0 52.0 -64.8 -36.1 -4.0 1.5 33.9 77 274 A H H X S+ 0 0 76 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.903 109.5 49.2 -64.7 -43.7 -4.7 5.1 32.9 78 275 A C H X S+ 0 0 42 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.917 108.4 53.9 -63.7 -41.8 -1.0 5.9 33.5 79 276 A C H X S+ 0 0 47 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.918 109.2 49.1 -55.6 -45.9 0.0 2.9 31.5 80 277 A Q H X S+ 0 0 14 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.907 108.1 51.9 -62.7 -43.0 -2.1 4.1 28.6 81 278 A C H X S+ 0 0 62 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.872 110.3 50.5 -63.6 -35.9 -0.7 7.6 28.7 82 279 A T H X S+ 0 0 70 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.916 110.9 47.8 -64.7 -45.1 2.8 6.1 28.6 83 280 A S H X S+ 0 0 23 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.886 109.1 53.9 -64.4 -40.2 2.0 4.0 25.6 84 281 A V H X S+ 0 0 26 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.938 111.0 46.0 -60.1 -44.6 0.4 6.9 23.7 85 282 A E H X S+ 0 0 66 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.918 112.6 49.4 -66.3 -42.5 3.6 8.9 24.2 86 283 A T H X S+ 0 0 23 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.878 107.6 55.4 -62.5 -36.6 5.8 6.0 23.1 87 284 A V H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.890 108.2 49.0 -62.4 -38.9 3.6 5.5 20.1 88 285 A T H X S+ 0 0 43 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.927 111.5 49.0 -66.2 -42.6 4.3 9.1 19.2 89 286 A E H X S+ 0 0 20 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.910 110.4 50.5 -63.5 -40.1 8.0 8.7 19.7 90 287 A L H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.833 104.3 59.0 -68.1 -33.7 8.1 5.5 17.5 91 288 A T H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.949 109.6 42.3 -59.9 -49.5 6.2 7.3 14.7 92 289 A E H X S+ 0 0 46 -4,-1.6 4,-0.7 2,-0.2 -2,-0.2 0.880 113.3 51.9 -64.9 -42.7 9.0 9.9 14.4 93 290 A F H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.2 4,-0.4 0.938 108.7 52.8 -57.4 -43.8 11.7 7.3 14.7 94 291 A A H >< S+ 0 0 0 -4,-2.6 3,-1.4 1,-0.3 6,-0.2 0.882 104.1 55.1 -62.3 -38.8 10.0 5.3 12.0 95 292 A K H 3< S+ 0 0 45 -4,-1.8 6,-0.3 1,-0.3 -1,-0.3 0.656 101.4 59.9 -70.5 -14.2 10.0 8.4 9.6 96 293 A A T << S+ 0 0 51 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.509 81.6 99.6 -89.4 -5.2 13.7 8.7 10.1 97 294 A I S X> S- 0 0 2 -3,-1.4 3,-2.7 -4,-0.4 4,-0.5 -0.732 91.0-103.2 -84.3 122.8 14.4 5.2 8.7 98 295 A P T 34 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.146 103.4 9.0 -53.6 121.1 15.4 5.5 5.0 99 296 A G T >> S+ 0 0 24 -4,-0.2 4,-0.5 4,-0.0 3,-0.5 0.124 99.2 100.9 98.4 -21.4 12.5 4.6 2.8 100 297 A F G X4 S+ 0 0 0 -3,-2.7 3,-1.8 1,-0.2 -5,-0.1 0.968 84.3 46.8 -62.1 -51.8 9.8 4.4 5.5 101 298 A A G 3< S+ 0 0 55 -4,-0.5 -1,-0.2 -6,-0.3 -6,-0.1 0.615 105.1 63.2 -67.8 -10.9 8.4 7.9 4.7 102 299 A N G <4 S+ 0 0 144 -3,-0.5 -1,-0.3 2,-0.1 -2,-0.2 0.606 85.8 99.6 -85.3 -14.6 8.4 7.0 0.9 103 300 A L S << S- 0 0 12 -3,-1.8 2,-0.0 -4,-0.5 5,-0.0 -0.250 92.4 -80.3 -70.3 159.0 5.9 4.2 1.5 104 301 A D >> - 0 0 67 1,-0.1 4,-2.3 2,-0.1 3,-1.1 -0.374 43.0-120.0 -53.7 132.5 2.2 4.3 0.8 105 302 A L H 3> S+ 0 0 47 1,-0.3 4,-2.3 2,-0.2 -1,-0.1 0.823 114.9 53.4 -46.9 -38.0 0.6 6.1 3.8 106 303 A N H 3> S+ 0 0 77 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.811 106.9 50.0 -72.1 -31.7 -1.5 2.9 4.4 107 304 A D H <> S+ 0 0 0 -3,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.848 109.7 52.6 -71.1 -34.6 1.6 0.7 4.5 108 305 A Q H X S+ 0 0 14 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.959 108.9 49.4 -63.2 -48.9 3.1 3.1 7.0 109 306 A V H X S+ 0 0 18 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.882 111.9 49.6 -53.5 -42.2 0.0 2.9 9.2 110 307 A T H X S+ 0 0 23 -4,-1.5 4,-2.1 2,-0.2 5,-0.3 0.875 108.7 49.7 -70.9 -40.9 0.2 -0.9 9.0 111 308 A L H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.931 116.9 43.5 -65.1 -41.4 3.8 -1.2 9.9 112 309 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 5,-0.2 0.944 110.3 55.2 -67.1 -48.2 3.2 1.0 12.9 113 310 A K H < S+ 0 0 31 -4,-3.1 4,-0.4 1,-0.2 -2,-0.2 0.927 119.8 31.2 -47.2 -54.4 -0.0 -0.7 13.9 114 311 A Y H < S+ 0 0 20 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.723 123.7 49.1 -81.9 -21.2 1.6 -4.1 14.1 115 312 A G H X S+ 0 0 0 -4,-1.7 4,-2.3 -5,-0.3 3,-0.5 0.831 89.1 74.1 -88.9 -35.1 5.0 -2.8 15.2 116 313 A V H X S+ 0 0 2 -4,-2.9 4,-3.2 1,-0.2 5,-0.2 0.884 97.8 45.2 -55.5 -48.1 4.5 -0.4 18.0 117 314 A Y H > S+ 0 0 5 -4,-0.4 4,-2.0 -5,-0.2 -1,-0.2 0.830 112.4 51.9 -70.4 -28.2 3.7 -2.8 20.8 118 315 A E H > S+ 0 0 5 -3,-0.5 4,-1.9 -4,-0.4 -1,-0.2 0.923 114.7 43.7 -66.7 -41.2 6.6 -5.2 19.9 119 316 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.902 111.8 54.5 -70.6 -40.6 8.9 -2.2 20.0 120 317 A I H X S+ 0 0 12 -4,-3.2 4,-2.0 -5,-0.3 -1,-0.2 0.913 110.3 43.9 -59.6 -45.3 7.4 -0.9 23.2 121 318 A F H X S+ 0 0 12 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.883 112.7 53.6 -72.8 -32.2 7.9 -4.2 25.1 122 319 A A H >< S+ 0 0 0 -4,-1.9 3,-0.5 -5,-0.2 4,-0.3 0.939 114.7 40.5 -57.7 -48.6 11.5 -4.5 23.6 123 320 A M H >< S+ 0 0 24 -4,-2.6 3,-1.3 1,-0.2 4,-0.3 0.754 102.6 69.1 -76.2 -27.9 12.3 -1.0 24.9 124 321 A L H >< S+ 0 0 37 -4,-2.0 3,-1.9 1,-0.3 4,-0.4 0.832 86.7 69.8 -56.8 -33.5 10.5 -1.5 28.2 125 322 A S G X< S+ 0 0 0 -4,-0.9 3,-1.3 -3,-0.5 -1,-0.3 0.830 87.6 65.2 -53.5 -33.2 13.3 -4.0 29.0 126 323 A S G < S+ 0 0 4 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.687 106.3 41.5 -66.0 -19.6 15.7 -1.0 29.3 127 324 A V G < S+ 0 0 15 -3,-1.9 7,-2.4 -4,-0.3 2,-0.4 0.333 103.5 87.9-111.1 7.8 13.9 0.3 32.3 128 325 A M B < +B 133 0A 0 -3,-1.3 2,-0.2 -4,-0.4 5,-0.2 -0.858 42.3 166.6-111.3 136.5 13.2 -3.0 34.0 129 326 A N - 0 0 50 3,-2.7 3,-0.5 -2,-0.4 37,-0.1 -0.759 57.4 -84.3-127.4-173.3 15.3 -5.1 36.5 130 327 A K S S+ 0 0 144 -2,-0.2 3,-0.1 1,-0.2 14,-0.1 0.726 127.0 46.5 -67.6 -20.3 14.3 -8.1 38.6 131 328 A D S S- 0 0 94 1,-0.2 13,-2.7 13,-0.1 14,-0.5 0.717 123.1 -60.0 -92.4 -24.6 12.8 -5.8 41.3 132 329 A G E - C 0 143A 0 -3,-0.5 -3,-2.7 11,-0.3 2,-0.3 -0.971 51.4 -84.4 171.5-160.3 10.8 -3.3 39.2 133 330 A M E -BC 128 142A 15 9,-2.0 9,-2.6 -2,-0.3 -5,-0.2 -1.000 31.6-108.2-145.7 142.8 10.8 -0.7 36.5 134 331 A L E + C 0 141A 8 -7,-2.4 2,-0.3 -2,-0.3 7,-0.3 -0.431 44.2 175.4 -62.2 143.6 11.4 3.1 36.1 135 332 A V E > + C 0 140A 45 5,-2.8 5,-2.1 1,-0.2 4,-0.4 -0.886 46.7 41.9-141.5 172.1 8.2 5.0 35.4 136 333 A A T > 5S- 0 0 36 -2,-0.3 3,-1.9 1,-0.2 -1,-0.2 0.930 131.0 -50.9 54.1 54.4 7.1 8.6 35.0 137 334 A Y T 3 5S- 0 0 130 1,-0.3 -1,-0.2 2,-0.1 -3,-0.0 0.873 111.1 -48.4 51.9 44.5 10.0 9.7 32.9 138 335 A G T 3 5S+ 0 0 8 2,-0.2 -1,-0.3 -3,-0.2 -2,-0.2 0.371 118.9 106.7 83.9 -2.6 12.6 8.3 35.2 139 336 A N T < 5S+ 0 0 80 -3,-1.9 -95,-2.2 -4,-0.4 2,-0.3 0.595 77.3 35.1 -88.5 -12.8 11.0 9.9 38.4 140 337 A G E < -aC 44 135A 0 -5,-2.1 -5,-2.8 -97,-0.3 2,-0.4 -0.931 60.5-151.7-135.9 162.3 9.5 6.8 40.0 141 338 A F E -aC 45 134A 23 -97,-2.4 -95,-3.3 -2,-0.3 2,-0.5 -0.985 13.7-160.1-134.1 119.2 10.3 3.1 40.3 142 339 A I E -aC 46 133A 11 -9,-2.6 -9,-2.0 -2,-0.4 -95,-0.2 -0.887 19.4-122.7-107.8 132.0 7.5 0.7 40.7 143 340 A T E > - C 0 132A 25 -97,-2.4 4,-1.8 -2,-0.5 -11,-0.3 -0.357 6.1-134.8 -75.9 147.8 8.1 -2.8 42.2 144 341 A R H > S+ 0 0 43 -13,-2.7 4,-2.3 1,-0.2 5,-0.2 0.886 107.2 53.9 -61.5 -41.6 7.4 -6.0 40.4 145 342 A E H > S+ 0 0 122 -14,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.906 105.1 52.4 -65.0 -42.8 5.8 -7.4 43.6 146 343 A F H >4 S+ 0 0 9 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.931 110.4 48.9 -57.7 -43.8 3.5 -4.4 44.0 147 344 A L H >< S+ 0 0 18 -4,-1.8 3,-1.3 1,-0.3 -2,-0.2 0.908 109.1 52.0 -62.9 -43.9 2.2 -4.9 40.4 148 345 A K H 3< S+ 0 0 92 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.738 104.2 60.5 -58.4 -25.7 1.7 -8.7 41.0 149 346 A S T << S+ 0 0 80 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.521 79.3 107.0 -86.7 -7.9 -0.3 -7.8 44.0 150 347 A L S < S- 0 0 9 -3,-1.3 5,-0.2 -4,-0.4 2,-0.1 -0.269 82.2 -94.2 -65.0 158.7 -3.0 -5.8 42.2 151 348 A R >> - 0 0 88 1,-0.1 3,-1.1 3,-0.1 4,-0.9 -0.390 65.5 -50.8 -74.4 155.5 -6.4 -7.4 41.8 152 349 A K T 34 S+ 0 0 140 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 -0.376 120.0 17.2 -63.8 144.8 -7.2 -9.5 38.7 153 350 A P T >4 S+ 0 0 16 0, 0.0 3,-2.0 0, 0.0 -1,-0.3 -0.987 120.5 60.3 -90.0 4.4 -6.9 -8.9 35.9 154 351 A F G X4 S+ 0 0 7 -3,-1.1 3,-1.4 1,-0.3 4,-0.5 0.828 96.9 61.9 -65.0 -29.3 -4.6 -5.9 36.4 155 352 A C G 3< S+ 0 0 18 -4,-0.9 4,-0.4 1,-0.2 -1,-0.3 0.548 97.9 61.4 -69.7 -8.5 -1.9 -8.1 38.1 156 353 A D G < S+ 0 0 60 -3,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.516 85.0 78.5 -96.3 -7.9 -1.6 -10.1 34.9 157 354 A I S < S+ 0 0 18 -3,-1.4 4,-0.3 -4,-0.3 -2,-0.1 0.981 101.3 24.9 -64.6 -58.3 -0.5 -7.2 32.7 158 355 A M S >> S+ 0 0 22 -4,-0.5 4,-2.2 1,-0.2 3,-1.6 0.803 98.4 79.5 -88.0 -33.0 3.2 -6.7 33.5 159 356 A E H 3> S+ 0 0 43 -4,-0.4 4,-2.6 1,-0.3 -1,-0.2 0.864 96.2 49.9 -45.7 -50.6 4.6 -10.0 34.8 160 357 A P H 3> S+ 0 0 47 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.806 110.1 52.1 -59.1 -30.4 4.9 -11.5 31.3 161 358 A K H <> S+ 0 0 9 -3,-1.6 4,-2.3 -4,-0.3 -2,-0.2 0.860 108.7 49.8 -74.2 -36.7 6.8 -8.3 30.2 162 359 A F H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.925 109.4 52.0 -61.8 -47.9 9.1 -8.7 33.2 163 360 A D H X S+ 0 0 84 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.908 111.9 46.0 -54.9 -47.9 9.7 -12.4 32.2 164 361 A F H X S+ 0 0 14 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.937 112.7 51.8 -58.8 -45.4 10.6 -11.3 28.6 165 362 A A H X S+ 0 0 0 -4,-2.3 4,-3.4 1,-0.2 5,-0.2 0.860 102.2 56.8 -63.4 -40.8 12.8 -8.5 29.9 166 363 A M H X S+ 0 0 57 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.924 114.9 39.9 -60.3 -41.3 14.9 -10.6 32.2 167 364 A K H < S+ 0 0 125 -4,-1.3 4,-0.5 -5,-0.2 -2,-0.2 0.880 116.4 49.1 -72.7 -39.8 15.8 -12.8 29.2 168 365 A F H >< S+ 0 0 2 -4,-2.6 3,-1.4 1,-0.2 5,-0.4 0.938 110.0 52.5 -65.0 -44.2 16.2 -9.9 26.8 169 366 A N H >< S+ 0 0 18 -4,-3.4 3,-1.7 1,-0.3 -1,-0.2 0.745 96.0 67.0 -62.9 -28.0 18.4 -8.0 29.3 170 367 A A T 3< S+ 0 0 78 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.693 87.5 70.1 -67.7 -18.7 20.8 -11.0 29.7 171 368 A L T < S- 0 0 20 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.644 98.0-142.5 -67.9 -17.8 21.8 -10.5 26.0 172 369 A E < + 0 0 139 -3,-1.7 -3,-0.1 -4,-0.2 -2,-0.1 0.851 32.5 173.7 55.2 44.2 23.5 -7.3 27.3 173 370 A L - 0 0 4 -5,-0.4 2,-0.2 4,-0.0 -1,-0.1 -0.412 19.8-144.6 -73.1 153.9 22.6 -5.2 24.2 174 371 A D >> - 0 0 62 -2,-0.1 4,-2.2 -147,-0.0 3,-0.9 -0.663 35.6 -90.5-107.9 174.7 23.5 -1.4 24.2 175 372 A D H 3> S+ 0 0 2 1,-0.3 4,-2.5 -2,-0.2 5,-0.2 0.775 125.7 59.7 -54.9 -31.1 21.4 1.4 22.6 176 373 A S H 3> S+ 0 0 16 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.884 110.6 42.5 -68.5 -34.0 23.2 1.0 19.3 177 374 A D H <> S+ 0 0 0 -3,-0.9 4,-1.9 2,-0.2 -2,-0.2 0.906 114.6 50.3 -68.9 -46.5 22.0 -2.6 19.2 178 375 A I H X S+ 0 0 1 -4,-2.2 4,-2.7 1,-0.2 5,-0.3 0.869 102.9 58.5 -68.1 -37.9 18.5 -1.8 20.3 179 376 A S H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.902 110.0 45.2 -56.4 -40.2 18.0 1.0 17.8 180 377 A L H X S+ 0 0 0 -4,-0.8 4,-2.2 2,-0.2 -2,-0.2 0.889 110.8 52.6 -72.4 -40.9 18.6 -1.5 15.0 181 378 A F H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.936 110.3 48.2 -57.5 -49.2 16.4 -4.2 16.5 182 379 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.918 110.1 53.1 -61.2 -41.0 13.5 -1.7 16.8 183 380 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.3 -1,-0.2 0.914 109.2 48.4 -58.5 -41.9 14.1 -0.6 13.2 184 381 A A H < S+ 0 0 2 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.822 107.9 55.4 -71.2 -30.6 13.9 -4.3 12.0 185 382 A I H < S+ 0 0 2 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.901 111.7 43.9 -64.0 -43.1 10.7 -4.7 14.0 186 383 A I H < S+ 0 0 2 -4,-2.0 2,-1.6 1,-0.2 -2,-0.2 0.907 106.8 59.9 -68.2 -44.3 9.1 -1.8 12.2 187 384 A C S < S+ 0 0 0 -4,-2.3 2,-0.5 -5,-0.2 -1,-0.2 -0.591 73.4 147.6 -90.3 77.2 10.3 -2.7 8.7 188 385 A C > - 0 0 3 -2,-1.6 3,-0.9 -3,-0.2 13,-0.1 -0.953 38.2-159.4-124.2 115.2 8.6 -6.1 8.5 189 386 A G T 3 S+ 0 0 2 -2,-0.5 12,-0.2 1,-0.3 5,-0.1 0.665 84.2 63.0 -69.5 -17.0 7.3 -7.4 5.1 190 387 A D T 3 + 0 0 89 10,-0.1 -1,-0.3 11,-0.1 3,-0.1 -0.008 65.1 131.6-107.1 31.3 4.9 -9.9 6.6 191 388 A R X - 0 0 9 -3,-0.9 3,-1.1 1,-0.1 -80,-0.1 -0.552 69.8 -93.1 -71.7 146.8 2.4 -7.7 8.4 192 389 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 -78,-0.1 -0.373 103.1 11.3 -61.4 135.7 -1.2 -8.5 7.6 193 390 A G T 3 S+ 0 0 67 1,-0.2 2,-0.1 -3,-0.1 -83,-0.1 0.589 79.0 161.1 80.1 14.7 -2.7 -6.5 4.8 194 391 A L < - 0 0 17 -3,-1.1 3,-0.3 -5,-0.1 -1,-0.2 -0.401 27.0-157.9 -69.2 145.5 0.3 -4.7 3.3 195 392 A L S S+ 0 0 100 1,-0.2 2,-1.6 -2,-0.1 3,-0.2 0.950 85.9 36.7 -83.8 -67.1 0.0 -3.4 -0.3 196 393 A N S > S+ 0 0 89 1,-0.2 4,-1.4 2,-0.1 -1,-0.2 -0.520 70.5 156.8 -91.2 71.5 3.6 -3.1 -1.5 197 394 A V H > + 0 0 51 -2,-1.6 4,-2.4 -3,-0.3 5,-0.2 0.864 65.5 57.2 -65.9 -41.2 4.9 -6.3 0.1 198 395 A G H > S+ 0 0 52 -3,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.882 108.8 45.9 -61.2 -42.0 7.9 -6.9 -2.3 199 396 A H H > S+ 0 0 101 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.830 112.8 49.7 -68.0 -36.2 9.4 -3.4 -1.6 200 397 A I H X S+ 0 0 0 -4,-1.4 4,-3.2 2,-0.2 -11,-0.2 0.863 105.6 56.2 -77.4 -33.5 9.0 -3.7 2.1 201 398 A E H X S+ 0 0 100 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.844 109.4 48.4 -60.4 -35.6 10.6 -7.1 2.2 202 399 A K H X S+ 0 0 139 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.909 111.0 48.6 -72.3 -43.4 13.6 -5.6 0.5 203 400 A M H X S+ 0 0 19 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.932 112.2 50.5 -59.3 -45.8 13.6 -2.7 3.0 204 401 A Q H X S+ 0 0 47 -4,-3.2 4,-2.9 1,-0.2 5,-0.3 0.951 109.1 50.4 -54.6 -54.6 13.4 -5.3 5.8 205 402 A E H X S+ 0 0 119 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.854 108.4 53.4 -54.8 -38.6 16.3 -7.3 4.4 206 403 A G H X S+ 0 0 33 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.948 111.7 44.5 -61.6 -47.8 18.4 -4.1 4.2 207 404 A I H X S+ 0 0 6 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.910 112.2 50.8 -63.5 -45.0 17.8 -3.3 7.8 208 405 A V H X S+ 0 0 25 -4,-2.9 4,-3.2 2,-0.2 -1,-0.2 0.857 107.3 55.6 -62.8 -34.9 18.4 -6.9 9.0 209 406 A H H X S+ 0 0 63 -4,-1.9 4,-2.3 -5,-0.3 5,-0.2 0.948 109.4 46.0 -61.8 -49.0 21.7 -6.8 7.0 210 407 A V H X S+ 0 0 4 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.970 114.3 48.4 -55.6 -54.1 22.8 -3.7 8.9 211 408 A L H X S+ 0 0 4 -4,-2.9 4,-2.6 1,-0.2 5,-0.3 0.937 110.5 51.0 -53.4 -50.7 21.7 -5.3 12.2 212 409 A R H X S+ 0 0 105 -4,-3.2 4,-1.5 1,-0.2 -1,-0.2 0.907 114.2 43.0 -55.8 -46.5 23.5 -8.6 11.5 213 410 A L H X S+ 0 0 50 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.897 112.2 53.7 -68.1 -39.5 26.8 -6.9 10.7 214 411 A H H X S+ 0 0 39 -4,-2.9 4,-3.1 -5,-0.2 5,-0.2 0.924 108.6 49.1 -60.8 -44.2 26.5 -4.5 13.6 215 412 A L H X S+ 0 0 6 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.843 108.5 55.0 -63.1 -35.4 26.0 -7.4 16.1 216 413 A Q H < S+ 0 0 136 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.943 116.2 36.4 -61.8 -49.0 29.1 -9.1 14.5 217 414 A S H < S+ 0 0 97 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.898 123.8 42.1 -65.2 -43.4 31.2 -6.0 15.1 218 415 A N H < S+ 0 0 57 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.706 124.8 30.6 -87.5 -21.9 29.6 -5.0 18.5 219 416 A H >< + 0 0 18 -4,-2.2 3,-1.7 -5,-0.2 -1,-0.2 -0.488 60.2 154.9-134.8 66.0 29.3 -8.5 20.1 220 417 A P T 3 S+ 0 0 99 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.614 73.8 65.3 -70.9 -8.8 32.2 -10.7 18.8 221 418 A D T 3 S+ 0 0 128 1,-0.2 2,-0.5 -3,-0.1 -5,-0.1 0.589 98.0 54.2 -84.2 -14.8 31.9 -12.8 22.0 222 419 A D X + 0 0 31 -3,-1.7 3,-1.7 -7,-0.2 4,-0.2 -0.812 58.9 175.6-127.2 89.1 28.3 -14.0 21.1 223 420 A I T 3 S+ 0 0 150 -2,-0.5 3,-0.3 1,-0.3 -1,-0.1 0.736 81.8 51.6 -74.1 -19.9 28.3 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