==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 19-OCT-11 3U9Q . COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.R.MALAPAKA,H.E.XU . 266 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13621.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 3.0 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 . 9 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 56.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 0 1 3 1 0 0 1 1 0 0 0 0 1 0 0 0 0 2 0 0 1 0 0 1 0 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 . 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 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 1 208 A S > 0 0 110 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -36.3 22.0 -3.1 -12.3 2 209 A A H > + 0 0 80 1,-0.2 4,-2.2 2,-0.2 3,-0.2 0.925 360.0 49.6 -60.4 -40.0 25.5 -2.9 -10.8 3 210 A D H > S+ 0 0 142 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.865 107.2 56.2 -66.8 -33.5 24.6 0.5 -9.2 4 211 A L H > S+ 0 0 26 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.839 108.4 47.0 -63.2 -36.5 21.4 -1.1 -7.9 5 212 A R H X S+ 0 0 82 -4,-1.8 4,-2.6 -3,-0.2 -2,-0.2 0.875 110.6 51.8 -72.7 -37.1 23.4 -3.8 -6.1 6 213 A A H X S+ 0 0 63 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.918 110.6 49.2 -64.7 -37.7 25.9 -1.2 -4.7 7 214 A L H X S+ 0 0 21 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.939 109.6 51.3 -64.0 -45.8 22.9 0.7 -3.4 8 215 A A H X S+ 0 0 6 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.916 112.3 47.1 -56.5 -45.0 21.4 -2.5 -1.8 9 216 A K H X S+ 0 0 109 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.909 109.5 52.7 -64.9 -42.3 24.8 -3.2 -0.1 10 217 A H H X S+ 0 0 77 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.926 110.7 48.1 -56.4 -45.6 25.1 0.4 1.2 11 218 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.903 111.1 49.9 -65.0 -40.4 21.7 0.2 2.7 12 219 A Y H X S+ 0 0 62 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.939 110.7 49.3 -64.2 -43.6 22.4 -3.2 4.3 13 220 A D H X S+ 0 0 82 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.910 113.6 47.3 -62.6 -36.8 25.7 -1.8 5.8 14 221 A S H X S+ 0 0 12 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.868 109.3 53.3 -73.3 -34.5 23.8 1.2 7.1 15 222 A Y H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.918 107.4 51.5 -63.2 -42.4 21.1 -1.0 8.6 16 223 A I H < S+ 0 0 68 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.883 112.1 47.6 -64.6 -35.0 23.7 -3.1 10.4 17 224 A K H < S+ 0 0 182 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.847 117.3 41.6 -71.7 -31.1 25.1 0.2 11.9 18 225 A S H < S+ 0 0 20 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.747 110.4 52.8 -88.8 -30.0 21.7 1.6 12.9 19 226 A F < - 0 0 7 -4,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.906 58.0-167.9-119.2 104.0 19.9 -1.4 14.4 20 227 A P S S+ 0 0 61 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.840 81.7 52.5 -65.1 -31.5 21.7 -3.4 17.1 21 228 A L S S- 0 0 33 4,-0.1 2,-0.1 3,-0.0 105,-0.1 -0.878 77.6-174.1-107.0 103.9 19.3 -6.3 17.0 22 229 A T > - 0 0 6 -2,-0.8 4,-2.6 -3,-0.1 5,-0.1 -0.313 38.8-106.9 -85.2 169.1 18.9 -7.6 13.4 23 230 A K H > S+ 0 0 18 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.898 120.0 56.4 -62.5 -42.0 16.6 -10.3 12.2 24 231 A A H > S+ 0 0 65 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.936 112.1 42.6 -57.0 -46.2 19.5 -12.7 11.8 25 232 A K H > S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.911 114.9 50.6 -68.2 -40.0 20.4 -12.3 15.5 26 233 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.900 108.7 49.6 -64.4 -40.5 16.7 -12.4 16.6 27 234 A R H X S+ 0 0 65 -4,-2.8 4,-2.2 1,-0.2 6,-0.2 0.884 108.3 55.1 -68.5 -35.0 15.9 -15.6 14.7 28 235 A A H <>S+ 0 0 33 -4,-1.7 5,-2.8 -5,-0.2 6,-0.6 0.907 111.4 44.3 -59.6 -46.5 19.0 -17.2 16.3 29 236 A I H ><5S+ 0 0 16 -4,-2.0 3,-1.2 3,-0.2 -2,-0.2 0.938 114.2 49.3 -62.8 -47.6 17.7 -16.3 19.8 30 237 A L H 3<5S+ 0 0 32 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.816 115.6 42.2 -64.9 -32.5 14.1 -17.5 18.9 31 238 A T T 3<5S- 0 0 73 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.304 112.2-118.4 -98.9 5.0 15.2 -20.8 17.5 32 239 A G T < 5S+ 0 0 60 -3,-1.2 -3,-0.2 -4,-0.3 -4,-0.1 0.780 73.1 131.4 66.1 32.9 17.8 -21.4 20.3 33 240 A K < + 0 0 165 -5,-2.8 2,-0.2 -6,-0.2 -4,-0.2 0.294 43.6 96.7-100.3 11.6 20.8 -21.5 18.0 34 241 A T S S- 0 0 48 -6,-0.6 -9,-0.0 2,-0.1 0, 0.0 -0.598 71.3-132.7-102.2 160.3 22.9 -19.0 20.0 35 242 A T S S+ 0 0 144 -2,-0.2 -1,-0.1 3,-0.0 0, 0.0 0.923 90.5 40.1 -73.7 -48.0 25.7 -19.6 22.5 36 243 A D S S+ 0 0 91 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.331 93.8 32.7 -83.0-148.3 24.4 -17.1 25.1 37 244 A K - 0 0 85 1,-0.2 90,-0.1 3,-0.0 -8,-0.0 -0.315 29.4-167.1 62.0-153.1 20.8 -16.3 26.3 38 245 A S - 0 0 108 88,-0.1 -1,-0.2 -9,-0.1 -8,-0.1 0.631 41.1-123.1 -79.2 162.2 18.2 -17.8 26.7 39 246 A P - 0 0 24 0, 0.0 2,-0.4 0, 0.0 89,-0.3 -0.354 26.9-102.8 -65.5 151.8 15.8 -14.9 27.2 40 247 A F E -a 128 0A 72 87,-2.6 89,-2.4 11,-0.1 2,-0.5 -0.597 38.2-132.8 -75.4 126.4 13.7 -14.8 30.3 41 248 A V E -a 129 0A 63 -2,-0.4 2,-0.6 87,-0.2 89,-0.2 -0.728 17.2-165.9 -92.4 122.2 10.2 -15.9 29.5 42 249 A I E +a 130 0A 7 87,-3.1 89,-2.6 -2,-0.5 92,-0.2 -0.926 29.7 143.8-106.6 112.6 7.2 -13.8 30.7 43 250 A Y + 0 0 129 -2,-0.6 2,-0.3 87,-0.2 -1,-0.1 0.398 64.7 11.6-130.0 -6.2 4.0 -15.8 30.4 44 251 A D S > S- 0 0 57 1,-0.0 4,-2.0 89,-0.0 -1,-0.2 -0.934 88.4 -82.9-161.5 179.7 2.0 -14.8 33.4 45 252 A M H > S+ 0 0 98 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.880 123.4 51.9 -66.8 -36.4 1.8 -12.2 36.3 46 253 A N H > S+ 0 0 83 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.927 110.6 45.9 -66.4 -43.6 4.2 -14.1 38.4 47 254 A S H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.846 109.8 56.9 -71.1 -30.2 6.9 -14.4 35.7 48 255 A L H X S+ 0 0 8 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.938 109.3 45.3 -61.3 -44.7 6.4 -10.7 34.9 49 256 A M H < S+ 0 0 109 -4,-2.1 3,-0.3 2,-0.2 4,-0.3 0.940 115.1 47.2 -62.6 -46.7 7.2 -9.9 38.5 50 257 A M H < S+ 0 0 108 -4,-2.6 3,-0.4 1,-0.2 -2,-0.2 0.880 120.7 37.9 -62.5 -38.1 10.2 -12.3 38.6 51 258 A G H < S+ 0 0 0 -4,-2.7 3,-0.5 1,-0.2 -1,-0.2 0.581 79.4 107.4 -92.2 -10.1 11.6 -10.9 35.3 52 259 A E < + 0 0 72 -4,-1.5 2,-0.6 -3,-0.3 -1,-0.2 0.706 66.5 74.7 -48.1 -27.9 10.8 -7.2 35.6 53 260 A D S S+ 0 0 125 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 -0.061 76.5 90.7 -77.5 36.3 14.5 -6.5 36.1 54 261 A K 0 0 78 -2,-0.6 -1,-0.2 -3,-0.5 69,-0.1 -0.462 360.0 360.0-159.7 84.9 15.0 -7.1 32.4 55 262 A I 0 0 162 -3,-0.1 -2,-0.2 73,-0.0 -1,-0.2 0.294 360.0 360.0 -98.2 360.0 14.5 -4.2 31.7 56 ! 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 57 275 A K 0 0 147 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 113.0 0.4 1.6 38.6 58 276 A E >> - 0 0 87 1,-0.1 4,-2.0 3,-0.1 3,-0.7 -0.188 360.0-107.4 -66.6 156.4 -1.3 -1.5 37.3 59 277 A V H 3> S+ 0 0 23 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.866 115.3 55.8 -53.5 -46.7 0.5 -4.0 35.1 60 278 A A H 3> S+ 0 0 6 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.872 111.2 45.3 -57.9 -37.4 -1.1 -3.1 31.8 61 279 A I H <> S+ 0 0 4 -3,-0.7 4,-2.9 2,-0.2 -1,-0.2 0.874 109.7 53.8 -76.2 -36.8 -0.0 0.5 32.2 62 280 A R H X S+ 0 0 88 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.894 111.7 46.4 -62.0 -41.6 3.5 -0.4 33.3 63 281 A I H X S+ 0 0 23 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.932 110.7 52.0 -66.4 -45.3 3.8 -2.5 30.1 64 282 A F H X S+ 0 0 24 -4,-2.1 4,-1.9 -5,-0.3 -2,-0.2 0.930 110.5 49.2 -58.9 -43.6 2.4 0.3 28.0 65 283 A Q H X S+ 0 0 62 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.923 109.8 50.6 -58.9 -47.1 4.9 2.7 29.5 66 284 A G H X S+ 0 0 45 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.903 108.8 52.7 -56.1 -42.1 7.8 0.2 28.8 67 285 A C H X S+ 0 0 59 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.866 103.7 56.4 -66.3 -35.2 6.6 -0.1 25.2 68 286 A Q H X S+ 0 0 17 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.917 107.1 49.5 -61.3 -43.4 6.6 3.7 24.7 69 287 A F H X S+ 0 0 119 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.895 111.2 48.9 -66.1 -36.1 10.3 3.9 25.7 70 288 A R H X S+ 0 0 113 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.911 110.2 51.6 -65.7 -43.2 11.1 1.1 23.3 71 289 A S H X S+ 0 0 28 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.929 108.9 51.2 -58.0 -42.8 9.2 2.9 20.6 72 290 A V H X S+ 0 0 9 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.924 110.1 48.8 -63.6 -43.4 11.2 6.1 21.3 73 291 A E H X S+ 0 0 108 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.915 111.1 50.8 -58.8 -44.3 14.5 4.2 21.1 74 292 A A H X S+ 0 0 9 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.904 105.4 55.7 -63.4 -42.0 13.3 2.7 17.8 75 293 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.922 108.1 49.3 -55.0 -42.4 12.4 6.1 16.4 76 294 A Q H X S+ 0 0 87 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.932 112.2 47.1 -65.3 -40.0 16.0 7.3 17.1 77 295 A E H X S+ 0 0 37 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.917 112.8 49.3 -64.7 -43.7 17.5 4.2 15.3 78 296 A I H X S+ 0 0 4 -4,-3.1 4,-3.0 1,-0.2 -2,-0.2 0.892 107.9 54.3 -65.9 -35.9 15.2 4.6 12.4 79 297 A T H X S+ 0 0 1 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.918 108.7 49.4 -64.1 -44.4 16.1 8.3 12.1 80 298 A E H X S+ 0 0 92 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.927 112.1 48.0 -59.9 -40.9 19.8 7.4 11.9 81 299 A Y H >< S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 4,-0.5 0.932 107.7 54.6 -65.4 -45.8 19.0 4.8 9.2 82 300 A A H >< S+ 0 0 0 -4,-3.0 3,-1.8 1,-0.3 -1,-0.2 0.900 102.2 58.5 -56.0 -38.4 17.0 7.3 7.2 83 301 A K H 3< S+ 0 0 38 -4,-2.0 6,-0.4 1,-0.3 -1,-0.3 0.715 101.1 57.7 -66.4 -18.3 19.9 9.8 7.2 84 302 A S T << S+ 0 0 30 -3,-1.5 -1,-0.3 -4,-0.7 -2,-0.2 0.544 78.8 103.6 -85.8 -8.6 22.0 7.1 5.5 85 303 A I S X S- 0 0 3 -3,-1.8 3,-2.5 -4,-0.5 4,-0.4 -0.622 88.2-105.4 -76.6 121.7 19.6 6.7 2.5 86 304 A P T 3 S+ 0 0 68 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.219 102.8 13.6 -51.6 127.2 21.3 8.5 -0.4 87 305 A G T >> S+ 0 0 32 -4,-0.1 3,-0.6 4,-0.0 4,-0.6 0.106 97.1 104.8 96.9 -22.7 19.6 11.9 -1.0 88 306 A F G X4 S+ 0 0 0 -3,-2.5 3,-1.5 1,-0.2 -5,-0.1 0.926 77.4 48.5 -64.0 -45.4 17.6 12.0 2.2 89 307 A V G 34 S+ 0 0 75 -4,-0.4 -1,-0.2 -6,-0.4 7,-0.1 0.687 106.5 60.2 -69.4 -14.5 19.6 14.6 4.1 90 308 A N G <4 S+ 0 0 143 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.567 85.0 100.7 -87.7 -9.4 19.6 16.9 1.1 91 309 A L S << S- 0 0 15 -3,-1.5 5,-0.1 -4,-0.6 -4,-0.0 -0.363 96.9 -77.5 -65.2 156.9 15.8 17.0 1.1 92 310 A D > - 0 0 75 1,-0.1 4,-2.0 92,-0.1 3,-0.4 -0.236 44.9-125.9 -47.4 133.6 14.1 20.0 2.6 93 311 A L H > S+ 0 0 51 1,-0.3 4,-2.1 2,-0.2 -1,-0.1 0.857 108.7 54.3 -63.3 -37.0 14.4 19.6 6.4 94 312 A N H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.874 107.7 51.6 -64.6 -32.8 10.6 19.9 6.9 95 313 A D H > S+ 0 0 2 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.873 106.2 53.6 -70.8 -35.3 10.0 17.2 4.4 96 314 A Q H X S+ 0 0 8 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.924 109.7 49.1 -59.5 -44.4 12.5 14.9 6.3 97 315 A V H X S+ 0 0 18 -4,-2.1 4,-3.0 1,-0.2 -2,-0.2 0.928 111.2 49.4 -59.2 -48.1 10.5 15.5 9.5 98 316 A T H X S+ 0 0 23 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.907 109.2 51.6 -58.1 -45.0 7.2 14.7 7.6 99 317 A L H X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.908 115.2 42.2 -62.0 -42.4 8.6 11.4 6.2 100 318 A L H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 3,-0.2 0.942 111.7 54.4 -69.8 -44.6 9.7 10.3 9.7 101 319 A K H < S+ 0 0 32 -4,-3.0 4,-0.3 1,-0.2 -2,-0.2 0.910 120.6 30.8 -53.7 -45.9 6.5 11.5 11.4 102 320 A Y H < S+ 0 0 44 -4,-2.3 -1,-0.2 -5,-0.2 4,-0.2 0.619 126.1 42.8 -94.1 -10.4 4.3 9.5 9.1 103 321 A G H X S+ 0 0 1 -4,-1.3 4,-1.8 -5,-0.2 3,-0.2 0.648 88.0 81.6-104.9 -26.1 6.7 6.6 8.3 104 322 A V H X S+ 0 0 1 -4,-2.5 4,-2.8 1,-0.2 5,-0.1 0.874 91.9 48.8 -63.2 -34.5 8.3 5.6 11.5 105 323 A H H > S+ 0 0 9 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.873 107.0 55.5 -73.6 -31.3 5.5 3.4 12.9 106 324 A E H > S+ 0 0 8 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.886 112.4 45.0 -62.3 -38.8 5.2 1.5 9.7 107 325 A I H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.3 0.923 109.3 55.1 -68.7 -42.5 8.9 0.7 10.1 108 326 A I H X S+ 0 0 19 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.917 110.8 45.2 -56.1 -44.4 8.6 -0.1 13.8 109 327 A Y H X S+ 0 0 13 -4,-2.5 4,-1.2 2,-0.2 -1,-0.2 0.865 111.8 52.8 -72.2 -32.3 5.9 -2.8 13.0 110 328 A T H X S+ 0 0 0 -4,-1.6 4,-0.6 -5,-0.2 3,-0.4 0.948 115.2 40.2 -60.9 -49.3 8.0 -4.1 10.1 111 329 A M H >X S+ 0 0 28 -4,-2.8 3,-0.7 1,-0.2 4,-0.5 0.817 106.7 63.6 -75.3 -29.4 11.0 -4.6 12.3 112 330 A L H >< S+ 0 0 33 -4,-2.5 3,-1.3 -5,-0.3 4,-0.4 0.844 93.7 64.0 -60.4 -34.7 8.9 -5.9 15.2 113 331 A A H >< S+ 0 0 0 -4,-1.2 3,-1.5 -3,-0.4 -1,-0.2 0.891 93.5 61.6 -59.6 -31.6 8.0 -8.8 13.0 114 332 A S H << S+ 0 0 7 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.761 106.0 46.7 -63.3 -26.5 11.7 -9.9 13.1 115 333 A L T << S+ 0 0 26 -3,-1.3 7,-2.6 -4,-0.5 2,-0.3 0.358 104.2 83.5 -95.7 1.2 11.4 -10.3 16.8 116 334 A M E < +B 121 0A 1 -3,-1.5 2,-0.2 -4,-0.4 5,-0.2 -0.807 44.2 176.0-113.2 144.2 8.1 -12.3 16.8 117 335 A N E > -B 120 0A 41 3,-2.6 3,-0.6 -2,-0.3 37,-0.1 -0.717 56.5 -85.5-124.0-171.3 7.0 -15.8 16.3 118 336 A K T 3 S+ 0 0 134 -2,-0.2 3,-0.1 1,-0.2 36,-0.1 0.724 126.8 45.4 -70.3 -15.2 3.5 -17.2 16.6 119 337 A D T 3 S- 0 0 91 1,-0.2 13,-2.4 13,-0.1 14,-0.5 0.575 120.8 -39.6-105.0 -11.9 3.9 -17.5 20.4 120 338 A G E < -BC 117 131A 0 -3,-0.6 -3,-2.6 11,-0.3 2,-0.4 -0.991 54.3 -89.6 169.5-170.9 5.5 -14.3 21.5 121 339 A V E -BC 116 130A 6 9,-2.3 9,-2.8 -2,-0.3 2,-0.3 -0.976 28.7-118.5-137.4 134.2 7.9 -11.4 21.1 122 340 A L E - C 0 129A 4 -7,-2.6 2,-0.3 -2,-0.4 7,-0.3 -0.598 38.2-176.5 -70.0 134.4 11.6 -10.7 22.0 123 341 A I E >> + C 0 128A 46 5,-2.4 5,-2.2 -2,-0.3 4,-0.7 -0.853 51.7 30.1-129.8 160.0 11.9 -7.7 24.3 124 342 A S T >45S- 0 0 31 -2,-0.3 3,-1.2 1,-0.2 -1,-0.2 0.921 133.3 -50.7 59.7 53.0 14.8 -5.8 25.9 125 343 A E T 345S- 0 0 129 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.871 111.9 -49.1 47.5 45.2 17.3 -6.4 23.1 126 344 A G T 345S+ 0 0 0 2,-0.2 -1,-0.2 -3,-0.1 -2,-0.2 0.533 114.6 110.3 83.0 9.8 16.6 -10.2 23.2 127 345 A Q T <<5S+ 0 0 104 -3,-1.2 -87,-2.6 -4,-0.7 2,-0.3 0.578 80.0 37.2 -90.7 -14.0 17.0 -10.7 27.0 128 346 A G E < -aC 40 123A 1 -5,-2.2 -5,-2.4 -89,-0.3 2,-0.4 -0.910 61.9-157.4-131.9 162.8 13.2 -11.3 27.5 129 347 A F E -aC 41 122A 26 -89,-2.4 -87,-3.1 -2,-0.3 2,-0.5 -0.968 11.3-161.2-140.7 116.2 10.5 -13.0 25.6 130 348 A M E -aC 42 121A 13 -9,-2.8 -9,-2.3 -2,-0.4 -87,-0.2 -0.902 22.9-120.0-104.3 131.3 6.8 -12.0 26.3 131 349 A T E > - C 0 120A 21 -89,-2.6 4,-2.1 -2,-0.5 -11,-0.3 -0.339 4.8-134.8 -75.2 148.1 4.1 -14.4 25.3 132 350 A R H > S+ 0 0 45 -13,-2.4 4,-2.1 1,-0.2 5,-0.2 0.894 109.0 53.3 -58.1 -42.8 1.4 -13.6 22.8 133 351 A E H > S+ 0 0 148 -14,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.899 107.4 51.1 -64.0 -42.6 -1.2 -15.2 25.2 134 352 A F H > S+ 0 0 6 1,-0.2 4,-0.6 2,-0.2 3,-0.3 0.929 110.6 47.7 -61.1 -46.1 0.0 -13.0 28.1 135 353 A L H >< S+ 0 0 14 -4,-2.1 3,-0.9 1,-0.2 -1,-0.2 0.887 110.3 52.2 -63.1 -37.4 -0.3 -9.8 26.1 136 354 A K H 3< S+ 0 0 122 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.782 101.9 63.1 -68.2 -25.6 -3.8 -10.8 24.9 137 355 A S H 3< S+ 0 0 82 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.617 78.3 107.1 -74.5 -18.0 -4.8 -11.4 28.5 138 356 A L S << S- 0 0 21 -3,-0.9 5,-0.5 -4,-0.6 -3,-0.0 -0.316 83.1 -92.4 -63.8 149.2 -4.3 -7.8 29.6 139 357 A R >> - 0 0 93 3,-0.2 3,-1.1 1,-0.1 4,-1.0 -0.173 66.7 -47.2 -65.7 153.8 -7.4 -5.8 30.2 140 358 A K T 34 S+ 0 0 141 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 -0.333 121.3 11.8 -62.1 145.8 -9.1 -3.7 27.4 141 359 A P T >4 S+ 0 0 11 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.982 124.7 59.7 -84.7 1.2 -7.9 -1.8 25.5 142 360 A F G X4 S+ 0 0 11 -3,-1.1 3,-1.3 1,-0.3 4,-0.5 0.846 99.4 57.5 -61.3 -36.5 -4.4 -2.9 26.3 143 361 A G G 3< S+ 0 0 2 -4,-1.0 4,-0.4 -5,-0.5 -1,-0.3 0.542 102.2 59.6 -69.7 -8.7 -4.9 -6.5 25.4 144 362 A D G < S+ 0 0 59 -3,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.527 86.1 76.2 -95.2 -8.5 -5.9 -5.4 21.9 145 363 A F S < S+ 0 0 13 -3,-1.3 4,-0.4 -4,-0.4 -2,-0.1 0.933 99.5 33.8 -71.0 -47.1 -2.6 -3.5 20.9 146 364 A M S >> S+ 0 0 39 -4,-0.5 4,-2.3 1,-0.2 3,-1.1 0.832 98.3 77.9 -85.6 -31.6 -0.2 -6.3 20.1 147 365 A E H 3> S+ 0 0 38 -4,-0.4 4,-2.5 1,-0.3 -1,-0.2 0.867 95.2 47.7 -49.9 -45.5 -2.5 -9.0 18.6 148 366 A P H 3> S+ 0 0 19 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.819 110.2 54.2 -68.7 -25.2 -2.9 -7.3 15.1 149 367 A K H <> S+ 0 0 7 -3,-1.1 4,-2.6 -4,-0.4 -2,-0.2 0.882 109.0 48.3 -72.4 -39.7 0.9 -6.9 15.0 150 368 A F H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.921 109.9 52.2 -62.0 -42.5 1.3 -10.6 15.7 151 369 A E H X S+ 0 0 119 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.932 112.7 45.4 -58.9 -45.3 -1.2 -11.4 12.9 152 370 A F H X S+ 0 0 15 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.935 111.8 53.2 -59.8 -47.1 0.8 -9.2 10.5 153 371 A A H X S+ 0 0 1 -4,-2.6 4,-3.3 1,-0.2 5,-0.2 0.860 102.9 54.1 -62.5 -40.4 4.0 -10.8 11.6 154 372 A V H X S+ 0 0 61 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.944 115.2 40.9 -63.4 -39.7 3.1 -14.4 11.1 155 373 A K H < S+ 0 0 131 -4,-1.4 4,-0.4 -5,-0.2 -2,-0.2 0.902 117.5 48.0 -71.2 -39.8 2.1 -13.7 7.5 156 374 A F H >< S+ 0 0 3 -4,-2.8 3,-1.7 1,-0.2 5,-0.4 0.916 108.6 53.3 -68.8 -42.9 5.0 -11.4 6.9 157 375 A N H >< S+ 0 0 24 -4,-3.3 3,-1.7 1,-0.3 -1,-0.2 0.746 95.0 70.8 -62.0 -26.3 7.5 -13.8 8.3 158 376 A A T 3< S+ 0 0 73 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.705 86.7 66.8 -65.2 -15.0 6.2 -16.5 6.0 159 377 A L T < S- 0 0 21 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.586 99.0-140.6 -76.8 -15.4 7.9 -14.5 3.1 160 378 A E < + 0 0 150 -3,-1.7 -3,-0.1 -4,-0.2 -2,-0.1 0.801 32.2 176.5 62.9 39.1 11.3 -15.4 4.6 161 379 A L - 0 0 4 -5,-0.4 2,-0.2 1,-0.1 -1,-0.2 -0.376 15.6-147.0 -72.5 150.5 12.9 -12.0 4.0 162 380 A D > - 0 0 59 -2,-0.1 4,-2.7 1,-0.0 5,-0.2 -0.569 32.9 -91.9-107.5 176.4 16.4 -11.5 5.3 163 381 A D H > S+ 0 0 10 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.858 125.0 56.5 -58.9 -33.5 18.1 -8.3 6.6 164 382 A S H > S+ 0 0 31 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.920 111.5 43.2 -64.1 -41.9 19.4 -7.4 3.1 165 383 A D H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.935 113.6 51.6 -66.6 -46.1 15.8 -7.5 1.8 166 384 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.3 0.856 100.2 62.0 -62.3 -36.6 14.5 -5.6 4.8 167 385 A A H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.913 111.1 39.3 -58.8 -40.8 17.0 -2.8 4.6 168 386 A I H X S+ 0 0 0 -4,-1.0 4,-2.5 -3,-0.4 -1,-0.2 0.911 113.4 54.1 -75.6 -43.8 15.7 -1.8 1.1 169 387 A F H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.920 109.7 47.9 -55.1 -47.7 12.0 -2.4 2.0 170 388 A I H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.905 109.9 52.7 -62.2 -37.7 12.3 -0.0 5.0 171 389 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 -5,-0.3 -1,-0.2 0.915 107.1 53.0 -64.2 -42.5 14.0 2.6 2.8 172 390 A V H < S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.914 109.3 48.8 -55.7 -47.0 11.1 2.4 0.2 173 391 A I H >< S+ 0 0 2 -4,-1.9 3,-0.7 1,-0.2 -1,-0.2 0.902 108.6 52.7 -63.2 -41.6 8.6 3.0 3.0 174 392 A I H 3< S+ 0 0 2 -4,-2.2 2,-1.3 1,-0.3 -1,-0.2 0.916 104.1 58.3 -60.7 -39.8 10.4 6.0 4.4 175 393 A L T 3< S+ 0 0 0 -4,-2.1 2,-0.7 -5,-0.2 -1,-0.3 -0.256 72.7 146.5 -90.2 53.4 10.6 7.7 1.0 176 394 A S X - 0 0 7 -2,-1.3 3,-1.1 -3,-0.7 13,-0.1 -0.765 36.1-160.1 -95.7 118.5 6.8 7.8 0.4 177 395 A G T 3 S+ 0 0 12 -2,-0.7 -1,-0.1 1,-0.2 12,-0.1 0.486 80.5 70.0 -79.0 -1.6 5.8 10.8 -1.6 178 396 A D T 3 + 0 0 102 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.312 64.7 126.9 -96.6 8.2 2.1 10.7 -0.5 179 397 A R S X S- 0 0 15 -3,-1.1 3,-1.4 1,-0.1 -80,-0.1 -0.358 73.0 -91.7 -66.0 146.5 2.6 11.7 3.1 180 398 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -78,-0.1 -0.324 103.0 9.8 -66.0 133.4 0.5 14.7 4.1 181 399 A G T 3 S+ 0 0 62 1,-0.3 2,-0.1 -3,-0.1 -83,-0.1 0.563 76.1 161.1 82.8 13.3 2.0 18.1 3.8 182 400 A L < - 0 0 23 -3,-1.4 3,-0.3 1,-0.1 -1,-0.3 -0.467 27.3-155.9 -63.2 133.4 5.2 17.3 1.8 183 401 A L S S+ 0 0 119 1,-0.2 2,-0.4 -2,-0.1 -1,-0.1 0.816 81.8 25.0 -80.4 -37.3 6.5 20.5 0.2 184 402 A N > + 0 0 91 1,-0.1 4,-0.6 -92,-0.1 -1,-0.2 -0.803 63.4 170.0-135.9 93.5 8.5 18.9 -2.7 185 403 A V H > + 0 0 49 -2,-0.4 4,-2.6 -3,-0.3 3,-0.4 0.856 65.0 72.5 -78.2 -32.6 7.3 15.5 -3.7 186 404 A K H > S+ 0 0 122 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.873 97.1 45.9 -55.2 -48.6 9.3 15.0 -6.9 187 405 A P H > S+ 0 0 42 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.858 113.4 52.0 -66.5 -28.0 12.7 14.4 -5.4 188 406 A I H X S+ 0 0 0 -4,-0.6 4,-2.8 -3,-0.4 -2,-0.2 0.935 110.7 46.8 -69.4 -46.4 11.2 12.0 -2.9 189 407 A E H X S+ 0 0 84 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.846 109.6 54.5 -63.5 -33.6 9.5 10.1 -5.6 190 408 A D H X S+ 0 0 77 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.921 110.9 44.8 -68.7 -43.1 12.7 10.0 -7.7 191 409 A I H X S+ 0 0 31 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.953 114.5 50.1 -62.2 -46.3 14.7 8.5 -4.7 192 410 A Q H X S+ 0 0 34 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.886 106.0 55.2 -61.4 -40.1 11.8 6.0 -4.1 193 411 A D H X S+ 0 0 81 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.910 110.3 46.3 -58.5 -42.2 11.7 4.9 -7.7 194 412 A N H X S+ 0 0 71 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.914 112.2 50.3 -67.1 -41.0 15.4 4.1 -7.6 195 413 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.871 108.6 53.1 -61.7 -37.7 14.9 2.2 -4.3 196 414 A L H X S+ 0 0 35 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.897 107.9 50.2 -65.7 -40.0 12.0 0.3 -5.8 197 415 A Q H X S+ 0 0 107 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.912 111.4 49.1 -61.0 -41.4 14.2 -0.8 -8.7 198 416 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.883 111.4 49.6 -66.1 -37.4 16.8 -1.9 -6.2 199 417 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.928 109.3 50.9 -65.2 -44.2 14.2 -3.8 -4.2 200 418 A E H X S+ 0 0 73 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.915 113.1 44.9 -60.3 -45.8 12.9 -5.6 -7.3 201 419 A L H X S+ 0 0 32 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.901 111.4 54.4 -66.6 -43.1 16.4 -6.7 -8.3 202 420 A Q H X S+ 0 0 6 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.924 111.2 44.8 -52.6 -46.5 17.2 -7.8 -4.7 203 421 A L H X S+ 0 0 7 -4,-2.5 4,-1.9 1,-0.2 7,-0.2 0.865 111.3 52.1 -71.3 -35.0 14.1 -10.0 -4.6 204 422 A K H < S+ 0 0 128 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.888 119.2 36.5 -65.0 -40.9 14.7 -11.5 -8.0 205 423 A L H < S+ 0 0 102 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.892 124.6 37.7 -78.8 -41.0 18.3 -12.5 -7.1 206 424 A N H < S+ 0 0 65 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.678 131.4 28.2 -88.7 -19.3 17.9 -13.4 -3.4 207 425 A H >< + 0 0 32 -4,-1.9 3,-1.8 -5,-0.3 -1,-0.2 -0.479 68.8 158.2-136.5 59.3 14.4 -15.2 -3.9 208 426 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.779 76.9 46.5 -63.5 -25.4 14.4 -16.4 -7.4 209 427 A E T 3 S+ 0 0 192 1,-0.1 2,-1.1 0, 0.0 -5,-0.1 0.386 85.7 95.4 -95.8 2.7 11.8 -19.1 -6.8 210 428 A S S X S- 0 0 38 -3,-1.8 3,-1.7 -7,-0.2 4,-0.2 -0.738 70.2-155.3 -97.6 92.7 9.4 -16.7 -4.9 211 429 A S T 3 S+ 0 0 113 -2,-1.1 -1,-0.2 1,-0.3 3,-0.2 0.700 73.6 6.8 -45.1 -59.9 7.2 -15.8 -7.8 212 430 A Q T 3> S+ 0 0 122 1,-0.1 4,-2.1 2,-0.1 -1,-0.3 -0.383 80.3 138.9-120.5 40.4 5.6 -12.4 -7.2 213 431 A L H <> S+ 0 0 4 -3,-1.7 4,-2.6 -6,-0.2 5,-0.2 0.894 70.2 55.2 -63.1 -39.5 7.4 -11.5 -4.0 214 432 A F H > S+ 0 0 38 -4,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.947 108.8 48.5 -57.8 -49.9 7.9 -7.9 -5.1 215 433 A A H > S+ 0 0 44 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.894 109.4 53.0 -53.4 -41.8 4.1 -7.5 -5.6 216 434 A K H X S+ 0 0 101 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.911 108.1 50.2 -63.8 -41.2 3.5 -9.1 -2.2 217 435 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.863 105.5 55.9 -66.1 -36.3 5.8 -6.6 -0.5 218 436 A L H X S+ 0 0 69 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.924 108.9 49.5 -60.1 -38.2 4.0 -3.7 -2.2 219 437 A Q H X S+ 0 0 105 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.895 104.5 56.3 -68.0 -36.7 0.8 -5.1 -0.6 220 438 A K H X S+ 0 0 21 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.844 100.3 59.9 -63.6 -29.2 2.5 -5.3 2.8 221 439 A M H X S+ 0 0 26 -4,-1.7 4,-1.2 2,-0.2 -1,-0.2 0.925 108.8 44.2 -63.5 -41.8 3.2 -1.6 2.5 222 440 A T H X S+ 0 0 67 -4,-1.4 4,-1.5 1,-0.2 3,-0.4 0.921 110.7 54.2 -65.8 -42.2 -0.5 -1.0 2.2 223 441 A D H X S+ 0 0 28 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.898 103.2 57.6 -56.5 -40.0 -1.2 -3.4 5.1 224 442 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.863 101.5 55.3 -63.8 -34.3 1.1 -1.5 7.3 225 443 A R H X S+ 0 0 83 -4,-1.2 4,-2.1 -3,-0.4 -1,-0.2 0.871 107.6 49.6 -66.1 -34.8 -0.9 1.7 6.8 226 444 A Q H X S+ 0 0 143 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.889 107.5 53.7 -70.6 -38.3 -4.0 -0.1 8.0 227 445 A I H X S+ 0 0 13 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.931 109.9 48.6 -59.2 -42.3 -2.1 -1.4 11.1 228 446 A V H X S+ 0 0 25 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.924 109.4 52.0 -65.3 -43.7 -1.2 2.2 11.9 229 447 A T H X S+ 0 0 76 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.930 112.3 45.7 -56.4 -44.9 -4.8 3.4 11.4 230 448 A E H X S+ 0 0 81 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.889 111.5 52.6 -67.2 -40.7 -6.1 0.7 13.8 231 449 A H H X S+ 0 0 26 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.916 107.1 51.5 -61.4 -43.7 -3.3 1.5 16.3 232 450 A V H X S+ 0 0 38 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.895 106.4 55.6 -62.4 -37.1 -4.2 5.2 16.3 233 451 A Q H X S+ 0 0 122 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.908 108.5 47.4 -63.7 -40.3 -7.8 4.3 17.0 234 452 A L H X S+ 0 0 26 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.900 108.7 53.8 -67.3 -39.9 -6.7 2.3 20.1 235 453 A L H X S+ 0 0 17 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.871 105.9 54.6 -56.8 -38.3 -4.6 5.2 21.3 236 454 A Q H X S+ 0 0 108 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.876 104.6 53.3 -64.0 -37.1 -7.7 7.4 20.9 237 455 A V H X S+ 0 0 69 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.913 109.8 48.8 -62.2 -45.0 -9.6 5.0 23.3 238 456 A I H < S+ 0 0 7 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.890 110.6 50.6 -58.1 -44.0 -6.8 5.4 25.8 239 457 A K H < S+ 0 0 153 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.889 112.7 45.6 -63.9 -40.9 -6.9 9.2 25.5 240 458 A K H < S+ 0 0 175 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.924 128.3 23.1 -72.8 -47.5 -10.7 9.3 26.1 241 459 A T S < S+ 0 0 88 -4,-2.6 -3,-0.1 -5,-0.2 0, 0.0 0.186 101.4 66.8 -86.7-144.4 -10.6 6.9 29.0 242 460 A E - 0 0 32 1,-0.1 3,-0.5 2,-0.1 -1,-0.1 0.791 52.9-172.8 23.0 88.6 -7.4 6.3 31.2 243 461 A T S S+ 0 0 149 1,-0.2 -1,-0.1 -3,-0.0 -2,-0.0 0.812 76.0 68.4 -68.4 -33.4 -6.9 9.7 32.9 244 462 A D S S+ 0 0 100 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.804 89.1 77.6 -52.0 -40.3 -3.6 8.5 34.3 245 463 A M + 0 0 32 -3,-0.5 2,-0.3 -7,-0.2 -184,-0.0 -0.358 40.3 162.9-100.3 154.9 -1.6 8.4 31.1 246 464 A S - 0 0 86 -2,-0.1 2,-0.2 0, 0.0 -3,-0.0 -0.958 37.8-102.1-153.2 160.2 0.1 10.6 28.5 247 465 A L - 0 0 38 -2,-0.3 5,-0.1 1,-0.1 -182,-0.0 -0.535 39.2 -94.6 -88.5 151.6 2.6 9.9 25.8 248 466 A H > - 0 0 51 -2,-0.2 4,-2.4 1,-0.1 3,-0.4 -0.292 45.1-109.1 -50.1 143.4 6.4 10.5 25.8 249 467 A P H > S+ 0 0 74 0, 0.0 4,-1.8 0, 0.0 12,-0.1 0.815 118.6 53.8 -54.7 -35.7 7.1 13.9 24.2 250 468 A L H > S+ 0 0 7 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.913 111.9 45.5 -66.6 -38.9 8.7 12.3 21.0 251 469 A L H > S+ 0 0 6 -3,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.858 106.4 59.7 -70.6 -31.0 5.5 10.3 20.6 252 470 A Q H X S+ 0 0 99 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.917 107.3 47.3 -60.4 -41.5 3.3 13.3 21.3 253 471 A E H >< S+ 0 0 39 -4,-1.8 3,-1.0 2,-0.2 -2,-0.2 0.944 112.1 48.8 -62.7 -48.0 5.0 15.0 18.3 254 472 A I H 3< S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.891 117.1 41.1 -62.7 -37.1 4.6 12.0 16.0 255 473 A Y H 3< S+ 0 0 37 -4,-2.8 -1,-0.3 -5,-0.1 2,-0.2 0.436 78.0 131.2 -91.8 1.4 0.9 11.6 16.9 256 474 A K S << S- 0 0 141 -3,-1.0 2,-1.8 -4,-0.6 -3,-0.0 -0.420 100.6 -41.0 -60.6 120.9 0.1 15.4 16.8 257 475 A D 0 0 134 -2,-0.2 -1,-0.1 1,-0.2 -3,-0.1 -0.416 360.0 360.0 49.0 -79.5 -3.0 15.4 14.7 258 476 A L 0 0 63 -2,-1.8 -1,-0.2 -78,-0.0 -2,-0.1 0.123 360.0 360.0 36.8 360.0 -1.5 12.7 12.3 259 !* 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 0.0 260 142 B S > 0 0 100 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -25.4 10.6 19.9 16.9 261 143 B L H > + 0 0 64 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.889 360.0 53.6 -68.3 -37.6 12.2 16.9 18.5 262 144 B L H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.916 107.3 52.0 -61.5 -41.3 12.3 15.1 15.1 263 145 B K H > S+ 0 0 74 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.928 108.1 51.3 -60.9 -41.2 14.1 18.1 13.7 264 146 B K H X S+ 0 0 137 -4,-1.9 4,-1.0 1,-0.2 3,-0.2 0.924 110.4 48.2 -62.8 -42.7 16.7 17.9 16.5 265 147 B L H < S+ 0 0 40 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.892 110.7 52.2 -62.4 -39.0 17.3 14.2 15.8 266 148 B L H < S+ 0 0 9 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.800 108.8 50.0 -65.5 -30.3 17.7 14.9 12.1 267 149 B L H < 0 0 121 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.632 360.0 360.0 -88.1 -15.9 20.3 17.6 12.6 268 150 B A < 0 0 102 -4,-1.0 -3,-0.0 -3,-0.4 -4,-0.0 -0.441 360.0 360.0 -67.7 360.0 22.6 15.7 14.9