==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGAND BINDING PROTEIN 04-JUN-07 2Q61 . COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.B.BRUNING,K.W.NETTLES . 515 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24184.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 383 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 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 . 2 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 . 19 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 282 54.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 2 0 2 2 1 1 2 2 0 0 1 0 0 1 0 1 1 2 0 0 2 0 0 0 2 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 209 A A 0 0 86 0, 0.0 5,-0.1 0, 0.0 195,-0.1 0.000 360.0 360.0 360.0 39.4 -6.1 -3.1 30.1 2 210 A D > + 0 0 114 3,-0.1 4,-1.8 1,-0.1 5,-0.1 0.956 360.0 171.8 37.2 69.3 -8.0 -1.9 26.9 3 211 A L H > + 0 0 30 1,-0.2 4,-2.1 2,-0.2 197,-0.1 0.764 68.4 52.9 -77.2 -28.3 -4.8 -2.2 25.0 4 212 A R H > S+ 0 0 106 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.897 109.6 47.6 -72.8 -42.3 -6.3 -1.6 21.5 5 213 A A H > S+ 0 0 50 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.880 113.7 49.5 -63.9 -39.0 -8.1 1.7 22.6 6 214 A L H X S+ 0 0 21 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.920 109.1 51.6 -65.5 -44.7 -4.8 2.8 24.1 7 215 A A H X S+ 0 0 5 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.905 114.6 43.4 -54.6 -45.8 -2.9 1.9 20.9 8 216 A K H X S+ 0 0 113 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.878 110.4 54.1 -71.6 -43.0 -5.4 4.0 18.9 9 217 A H H X S+ 0 0 77 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.918 111.8 46.4 -53.1 -50.6 -5.5 6.9 21.4 10 218 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.917 112.0 50.3 -57.4 -48.1 -1.6 7.1 21.1 11 219 A Y H X S+ 0 0 62 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.902 111.8 48.1 -58.6 -44.8 -1.7 6.9 17.3 12 220 A D H X S+ 0 0 87 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.910 112.8 47.6 -63.7 -42.1 -4.4 9.7 17.1 13 221 A S H X S+ 0 0 10 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.792 111.2 52.0 -66.9 -33.5 -2.4 12.0 19.4 14 222 A Y H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.916 109.9 47.8 -68.2 -45.9 0.8 11.2 17.4 15 223 A I H < S+ 0 0 72 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.892 114.2 48.5 -62.5 -40.5 -1.0 12.2 14.2 16 224 A K H < S+ 0 0 133 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.885 117.6 40.1 -61.9 -40.8 -2.3 15.4 16.0 17 225 A S H < S+ 0 0 6 -4,-1.9 -2,-0.2 1,-0.1 -3,-0.2 0.802 108.6 56.7 -86.1 -34.3 1.2 16.4 17.4 18 226 A F < - 0 0 5 -4,-2.3 -1,-0.1 1,-0.1 3,-0.1 -0.905 61.0-161.3-109.4 119.1 3.6 15.6 14.5 19 227 A P S S+ 0 0 64 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.720 81.3 52.1 -73.3 -23.1 3.0 17.3 11.1 20 228 A L S S- 0 0 21 4,-0.0 2,-0.1 3,-0.0 104,-0.1 -0.912 73.7-170.2-118.6 104.6 5.2 14.9 9.1 21 229 A T > - 0 0 24 -2,-0.6 4,-2.5 1,-0.1 5,-0.1 -0.401 36.3-110.2 -84.6 167.7 4.4 11.2 9.6 22 230 A K H > S+ 0 0 20 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.893 117.8 58.7 -62.5 -42.0 6.5 8.3 8.3 23 231 A A H > S+ 0 0 64 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.948 111.8 40.7 -53.4 -47.2 3.7 7.4 5.8 24 232 A K H > S+ 0 0 79 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 113.4 53.5 -68.7 -43.9 4.1 10.8 4.3 25 233 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.921 112.0 45.3 -51.9 -49.3 7.9 10.8 4.6 26 234 A R H X S+ 0 0 67 -4,-3.2 4,-2.2 2,-0.2 -2,-0.2 0.883 110.3 53.7 -67.8 -39.3 8.0 7.5 2.7 27 235 A A H <>S+ 0 0 15 -4,-2.2 5,-2.5 -5,-0.3 -1,-0.2 0.900 112.2 45.2 -61.6 -39.5 5.5 8.7 0.0 28 236 A I H ><5S+ 0 0 11 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.941 113.6 49.4 -66.3 -46.0 7.8 11.7 -0.6 29 237 A L H 3<5S+ 0 0 34 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.811 113.7 44.6 -64.7 -33.5 11.0 9.7 -0.7 30 238 A T T 3<5S- 0 0 81 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.151 114.2-109.7-101.9 17.3 9.6 7.1 -3.1 31 239 A G T < 5 + 0 0 52 -3,-1.2 -3,-0.2 1,-0.2 2,-0.1 0.812 51.1 174.4 61.2 37.5 8.0 9.5 -5.6 32 240 A K > < - 0 0 113 -5,-2.5 3,-1.3 -6,-0.2 -1,-0.2 -0.449 37.8-128.8 -70.2 148.3 4.3 8.8 -4.9 33 241 A T T 3 S+ 0 0 152 1,-0.3 -1,-0.1 -2,-0.1 -5,-0.1 0.420 101.7 76.7 -83.6 2.4 1.7 11.0 -6.6 34 242 A T T 3 S+ 0 0 108 -7,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.685 105.3 32.4 -73.2 -23.2 0.0 11.7 -3.3 35 243 A D S < S- 0 0 43 -3,-1.3 2,-0.3 -8,-0.2 -11,-0.0 -0.794 87.1 -97.9-135.1 170.1 2.9 14.1 -2.5 36 244 A K - 0 0 179 -2,-0.2 -5,-0.1 1,-0.1 -4,-0.1 -0.663 37.6-110.6 -93.8 147.8 5.3 16.5 -4.1 37 245 A S - 0 0 97 -2,-0.3 2,-0.2 -6,-0.1 -8,-0.1 -0.487 38.3-117.4 -70.2 143.2 9.0 15.7 -5.1 38 246 A P - 0 0 34 0, 0.0 2,-0.3 0, 0.0 88,-0.3 -0.505 14.9-114.3 -83.2 151.6 11.7 17.4 -3.0 39 247 A F E -a 126 0A 89 86,-2.1 88,-2.0 -2,-0.2 2,-0.5 -0.642 39.5-131.9 -71.9 139.5 14.4 19.9 -3.9 40 248 A V E -a 127 0A 62 -2,-0.3 2,-0.7 86,-0.2 88,-0.2 -0.872 16.7-162.2-111.9 122.5 17.8 18.2 -3.4 41 249 A I E +a 128 0A 8 86,-2.8 88,-2.5 -2,-0.5 91,-0.2 -0.909 31.1 145.8 -99.2 114.4 20.7 19.8 -1.6 42 250 A Y + 0 0 133 -2,-0.7 2,-0.3 1,-0.3 -1,-0.1 0.424 62.7 12.7-130.2 -9.0 23.8 17.8 -2.6 43 251 A D S > S- 0 0 45 1,-0.1 4,-2.6 90,-0.0 -1,-0.3 -0.952 87.4 -84.6-158.6 178.5 26.6 20.4 -2.7 44 252 A M H > S+ 0 0 90 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.873 123.8 51.7 -59.4 -41.7 27.4 24.0 -1.6 45 253 A N H > S+ 0 0 121 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.915 113.3 43.0 -60.4 -48.4 25.9 25.4 -4.8 46 254 A S H > S+ 0 0 9 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.813 108.3 60.6 -72.6 -27.8 22.6 23.6 -4.3 47 255 A L H X S+ 0 0 6 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.963 105.6 47.3 -57.6 -51.6 22.6 24.4 -0.6 48 256 A M H X S+ 0 0 97 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.824 114.8 46.7 -60.7 -33.7 22.5 28.1 -1.4 49 257 A M H X S+ 0 0 119 -4,-1.4 4,-1.0 2,-0.2 3,-0.3 0.830 112.0 51.9 -74.0 -34.1 19.7 27.5 -3.9 50 258 A G H < S+ 0 0 16 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.895 101.5 58.5 -67.7 -43.0 17.9 25.4 -1.3 51 259 A E H < S+ 0 0 99 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.734 115.6 37.2 -60.0 -24.1 18.0 28.0 1.4 52 260 A D H < 0 0 90 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.2 0.588 360.0 360.0-102.2 -16.0 16.1 30.4 -1.0 53 261 A K < 0 0 103 -4,-1.0 -14,-0.1 -3,-0.4 -4,-0.0 -0.671 360.0 360.0 -87.6 360.0 13.7 28.0 -2.7 54 ! 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 55 275 A K 0 0 161 0, 0.0 2,-0.4 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -55.6 28.4 33.0 7.7 56 276 A E > - 0 0 78 1,-0.1 4,-2.2 2,-0.0 3,-0.2 -0.628 360.0-141.2 -81.4 130.7 30.0 29.5 7.4 57 277 A V H > S+ 0 0 19 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.827 97.9 54.2 -60.0 -38.5 27.7 26.9 5.9 58 278 A A H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.917 113.0 42.3 -65.3 -44.9 28.7 24.0 8.2 59 279 A I H > S+ 0 0 23 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.875 114.0 53.7 -64.6 -39.9 27.9 26.1 11.4 60 280 A R H X S+ 0 0 75 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.855 110.4 45.5 -66.6 -38.2 24.7 27.4 9.7 61 281 A I H X S+ 0 0 19 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.947 112.9 50.1 -67.4 -51.2 23.4 23.8 8.9 62 282 A F H X S+ 0 0 8 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.890 112.7 48.3 -53.9 -42.3 24.3 22.6 12.4 63 283 A Q H X S+ 0 0 62 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.865 107.9 53.9 -68.1 -36.5 22.4 25.6 13.8 64 284 A G H X S+ 0 0 41 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.922 107.9 50.8 -58.9 -47.0 19.4 24.9 11.5 65 285 A C H X S+ 0 0 49 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.872 108.1 52.8 -57.2 -44.2 19.2 21.4 12.8 66 286 A Q H X S+ 0 0 19 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.902 109.9 48.8 -55.5 -49.5 19.3 22.7 16.4 67 287 A F H X S+ 0 0 117 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.851 110.1 48.3 -64.8 -38.6 16.4 25.0 15.7 68 288 A R H X S+ 0 0 88 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.852 107.7 58.9 -68.3 -33.2 14.2 22.3 14.1 69 289 A S H X S+ 0 0 21 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.792 100.6 55.7 -63.1 -30.1 15.1 20.2 17.1 70 290 A V H X S+ 0 0 4 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.920 108.9 45.1 -68.6 -47.1 13.5 22.9 19.3 71 291 A E H X S+ 0 0 65 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.892 111.1 55.5 -60.0 -41.2 10.2 22.7 17.4 72 292 A A H X S+ 0 0 12 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.909 104.3 52.4 -58.6 -42.2 10.6 18.9 17.7 73 293 A V H X S+ 0 0 9 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.902 109.5 50.5 -59.1 -42.2 10.9 19.2 21.5 74 294 A Q H X S+ 0 0 113 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.907 111.2 47.0 -61.3 -43.8 7.6 21.2 21.5 75 295 A E H X S+ 0 0 33 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.923 112.9 49.6 -63.3 -44.6 5.8 18.5 19.3 76 296 A I H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.864 110.4 50.5 -58.6 -44.2 7.2 15.7 21.6 77 297 A T H X S+ 0 0 48 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.876 110.0 49.3 -66.7 -40.5 6.0 17.6 24.7 78 298 A E H X S+ 0 0 72 -4,-2.0 4,-0.7 2,-0.2 3,-0.4 0.949 112.7 48.5 -61.3 -49.2 2.5 18.1 23.2 79 299 A Y H >< S+ 0 0 0 -4,-2.6 3,-1.6 1,-0.2 4,-0.4 0.924 106.7 56.9 -54.6 -46.7 2.4 14.3 22.4 80 300 A A H >< S+ 0 0 0 -4,-2.7 3,-1.3 1,-0.3 -1,-0.2 0.809 95.2 64.2 -60.9 -34.0 3.5 13.4 25.9 81 301 A K H 3< S+ 0 0 138 -4,-1.4 6,-0.4 -3,-0.4 -1,-0.3 0.788 100.2 54.2 -57.1 -29.1 0.6 15.3 27.5 82 302 A S T << S+ 0 0 22 -3,-1.6 -1,-0.2 -4,-0.7 -2,-0.2 0.556 79.1 106.9 -85.8 -8.2 -1.8 12.8 25.8 83 303 A I S X S- 0 0 1 -3,-1.3 3,-2.8 -4,-0.4 4,-0.4 -0.605 87.4-107.6 -71.3 114.9 0.0 9.7 27.2 84 304 A P T 3 S+ 0 0 66 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.167 100.3 9.6 -55.3 125.2 -2.4 8.5 29.9 85 305 A G T >> S+ 0 0 22 -4,-0.2 3,-0.8 4,-0.0 4,-0.6 0.133 96.7 107.5 96.7 -19.3 -1.1 9.2 33.3 86 306 A F G X4 S+ 0 0 2 -3,-2.8 3,-1.5 1,-0.2 -5,-0.1 0.949 79.6 47.2 -61.1 -48.6 1.8 11.4 32.2 87 307 A V G 34 S+ 0 0 76 -4,-0.4 -1,-0.2 -6,-0.4 -6,-0.1 0.645 105.0 63.1 -70.1 -11.1 0.3 14.8 33.4 88 308 A N G <4 S+ 0 0 130 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.593 84.5 98.7 -86.1 -13.5 -0.6 13.2 36.8 89 309 A L S << S- 0 0 14 -3,-1.5 5,-0.1 -4,-0.6 -4,-0.0 -0.364 94.1 -75.2 -70.7 153.1 3.0 12.6 37.7 90 310 A D > - 0 0 59 1,-0.1 4,-1.9 92,-0.1 3,-0.3 -0.181 45.2-123.0 -40.1 135.4 5.1 14.8 39.9 91 311 A L H > S+ 0 0 128 1,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.803 110.8 53.6 -62.1 -37.6 6.0 17.9 38.0 92 312 A N H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.875 109.4 50.3 -64.8 -37.2 9.7 17.5 38.5 93 313 A D H > S+ 0 0 1 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.869 105.0 55.6 -70.2 -37.6 9.4 14.0 37.1 94 314 A Q H X S+ 0 0 30 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.927 111.1 46.4 -58.0 -45.0 7.5 15.2 34.0 95 315 A V H X S+ 0 0 86 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.926 112.6 49.6 -59.9 -47.4 10.5 17.5 33.4 96 316 A T H X S+ 0 0 22 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.906 109.5 50.1 -62.2 -43.7 13.0 14.7 34.0 97 317 A L H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.894 114.5 45.0 -64.2 -41.5 11.3 12.3 31.6 98 318 A L H X S+ 0 0 29 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.913 109.5 55.2 -64.3 -46.7 11.2 14.9 28.9 99 319 A K H < S+ 0 0 29 -4,-2.9 4,-0.4 1,-0.2 -2,-0.2 0.910 118.7 33.4 -55.6 -46.3 14.8 16.0 29.4 100 320 A Y H < S+ 0 0 27 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.690 122.2 45.0 -83.1 -22.0 16.1 12.4 28.9 101 321 A G H X S+ 0 0 2 -4,-1.6 4,-2.1 -5,-0.2 5,-0.2 0.750 90.2 78.8 -96.9 -23.3 13.6 11.1 26.4 102 322 A V H X S+ 0 0 2 -4,-2.0 4,-2.5 1,-0.2 5,-0.1 0.883 96.2 44.4 -62.4 -43.3 13.3 13.9 23.8 103 323 A H H > S+ 0 0 5 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.896 110.0 55.1 -67.9 -36.5 16.6 13.2 21.9 104 324 A E H > S+ 0 0 4 -4,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.905 113.2 44.8 -62.7 -35.5 15.9 9.4 21.8 105 325 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.880 108.5 54.4 -73.0 -43.5 12.6 10.3 20.2 106 326 A I H X S+ 0 0 17 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.931 112.6 45.6 -52.6 -49.1 14.1 12.9 17.8 107 327 A Y H X S+ 0 0 14 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.864 110.9 51.7 -66.9 -38.9 16.5 10.2 16.6 108 328 A T H X S+ 0 0 0 -4,-1.8 4,-0.5 -5,-0.2 -1,-0.2 0.927 116.7 41.1 -57.1 -47.0 13.7 7.5 16.3 109 329 A M H < S+ 0 0 25 -4,-2.5 3,-0.5 1,-0.2 4,-0.5 0.763 105.0 62.6 -82.3 -26.6 11.6 9.9 14.2 110 330 A L H >< S+ 0 0 33 -4,-2.3 3,-1.7 1,-0.2 4,-0.4 0.864 94.4 65.3 -61.0 -35.1 14.5 11.3 12.2 111 331 A A H >< S+ 0 0 0 -4,-1.4 3,-1.4 1,-0.3 -1,-0.2 0.869 93.5 60.7 -54.0 -34.8 14.9 7.6 10.9 112 332 A S T 3< S+ 0 0 5 -4,-0.5 -1,-0.3 -3,-0.5 -2,-0.2 0.757 106.3 46.1 -62.5 -28.6 11.4 8.1 9.3 113 333 A L T < S+ 0 0 34 -3,-1.7 7,-2.7 -4,-0.5 2,-0.3 0.359 106.2 81.6 -93.5 0.0 12.9 11.0 7.2 114 334 A M E < +B 119 0A 0 -3,-1.4 2,-0.3 -4,-0.4 5,-0.2 -0.828 42.1 171.4-115.7 145.8 16.0 9.0 6.2 115 335 A N E > -B 118 0A 47 3,-2.0 3,-0.8 -2,-0.3 37,-0.1 -0.723 60.1 -83.3-124.9-173.7 17.2 6.5 3.7 116 336 A K T 3 S+ 0 0 134 -2,-0.3 3,-0.1 1,-0.2 36,-0.1 0.721 126.8 49.0 -62.6 -18.7 20.8 5.4 3.1 117 337 A D T 3 S- 0 0 91 1,-0.2 13,-2.6 13,-0.1 14,-0.5 0.541 119.4 -48.0-101.7 -14.3 21.4 8.5 0.8 118 338 A G E < -BC 115 129A 0 -3,-0.8 -3,-2.0 11,-0.3 2,-0.4 -0.993 53.4 -83.8 168.6-164.0 20.0 11.4 2.8 119 339 A V E -BC 114 128A 6 9,-2.4 9,-2.7 -2,-0.3 -5,-0.2 -0.982 30.7-114.0-139.7 137.6 17.4 13.0 4.9 120 340 A L E - C 0 127A 4 -7,-2.7 2,-0.3 -2,-0.4 7,-0.3 -0.503 37.9-171.9 -68.0 136.9 14.1 15.0 4.3 121 341 A I E >> + C 0 126A 47 5,-2.6 5,-2.1 -2,-0.2 4,-0.6 -0.832 55.1 28.6-128.0 165.2 14.3 18.6 5.5 122 342 A S T >45S- 0 0 71 -2,-0.3 3,-2.1 1,-0.2 -1,-0.2 0.935 135.5 -50.1 48.6 62.8 11.7 21.4 5.9 123 343 A E T 345S- 0 0 87 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.886 113.2 -49.5 40.1 47.5 8.8 19.1 6.5 124 344 A G T 345S+ 0 0 5 2,-0.2 -1,-0.3 -3,-0.1 -2,-0.2 0.461 111.6 114.8 81.9 2.7 9.7 17.1 3.5 125 345 A Q T <<5S+ 0 0 146 -3,-2.1 -86,-2.1 -4,-0.6 2,-0.3 0.736 82.0 30.9 -76.3 -24.2 10.1 20.0 0.9 126 346 A G E < -aC 39 121A 6 -5,-2.1 -5,-2.6 -88,-0.3 2,-0.4 -0.833 65.0-150.4-126.1 171.4 13.9 19.3 0.6 127 347 A F E -aC 40 120A 23 -88,-2.0 -86,-2.8 -7,-0.3 2,-0.5 -0.975 10.3-158.8-142.7 119.7 16.2 16.4 0.8 128 348 A M E -aC 41 119A 19 -9,-2.7 -9,-2.4 -2,-0.4 -86,-0.2 -0.904 23.4-123.0-103.3 129.5 19.8 16.8 1.9 129 349 A T E > - C 0 118A 25 -88,-2.5 4,-1.6 -2,-0.5 -11,-0.3 -0.400 5.6-132.3 -78.1 147.4 22.2 14.1 0.8 130 350 A R H > S+ 0 0 44 -13,-2.6 4,-2.1 1,-0.2 -12,-0.2 0.861 107.0 56.2 -57.9 -39.8 24.3 12.1 3.3 131 351 A E H > S+ 0 0 134 -14,-0.5 4,-0.8 1,-0.2 -1,-0.2 0.840 103.9 52.0 -67.5 -36.3 27.4 12.7 1.1 132 352 A F H >4 S+ 0 0 4 -91,-0.2 3,-0.7 2,-0.2 4,-0.4 0.927 109.9 50.1 -62.9 -42.6 27.1 16.4 1.2 133 353 A L H >< S+ 0 0 5 -4,-1.6 3,-1.1 1,-0.3 -2,-0.2 0.881 107.5 53.0 -65.7 -39.8 26.9 16.3 5.0 134 354 A K H 3< S+ 0 0 106 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.730 102.1 62.6 -61.0 -23.8 30.0 14.0 5.2 135 355 A S T << S+ 0 0 81 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.565 80.6 110.7 -84.0 -10.3 31.9 16.7 3.1 136 356 A L S < S- 0 0 11 -3,-1.1 5,-0.3 -4,-0.4 -3,-0.0 -0.306 80.6 -81.6 -67.5 147.3 31.5 19.5 5.7 137 357 A R >> - 0 0 84 3,-0.2 3,-2.0 1,-0.1 4,-0.9 -0.021 68.7 -67.5 -35.0 140.0 34.5 20.9 7.8 138 358 A K T 34 S+ 0 0 81 1,-0.3 -1,-0.1 2,-0.3 -80,-0.0 -0.623 121.3 27.0 -69.5 137.9 35.6 19.0 10.8 139 359 A P T 34 S+ 0 0 18 0, 0.0 3,-0.4 0, 0.0 -1,-0.3 -0.902 125.1 51.7 -94.4 18.9 34.1 18.5 13.4 140 360 A F T X4 S+ 0 0 0 -3,-2.0 3,-0.9 1,-0.2 4,-0.3 0.634 85.7 84.8 -92.3 -14.6 30.8 18.9 11.5 141 361 A G T 3< S+ 0 0 13 -4,-0.9 -1,-0.2 -5,-0.3 -3,-0.1 0.473 101.9 28.0 -67.6 -4.4 31.5 16.4 8.8 142 362 A D T 3 S+ 0 0 95 -3,-0.4 -1,-0.2 2,-0.1 3,-0.2 0.310 81.1 107.0-139.8 12.2 30.3 13.4 10.8 143 363 A F S < S+ 0 0 8 -3,-0.9 4,-0.2 1,-0.2 -2,-0.1 0.763 90.9 40.9 -68.3 -22.2 27.7 14.6 13.3 144 364 A M S >> S+ 0 0 15 -4,-0.3 4,-2.0 2,-0.1 3,-0.9 0.672 92.2 85.0 -96.9 -20.5 24.9 13.0 11.2 145 365 A E H 3> S+ 0 0 22 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.873 87.7 52.7 -50.2 -48.7 26.6 9.7 10.3 146 366 A P H 3> S+ 0 0 20 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.854 110.0 50.7 -56.2 -33.6 25.7 7.9 13.6 147 367 A K H <> S+ 0 0 7 -3,-0.9 4,-2.7 -4,-0.2 -2,-0.2 0.894 110.5 47.6 -73.2 -40.7 22.0 8.9 12.9 148 368 A F H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.886 110.7 51.8 -62.1 -44.0 22.1 7.5 9.3 149 369 A E H X S+ 0 0 118 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.904 113.8 44.4 -63.5 -42.2 23.7 4.3 10.5 150 370 A F H X S+ 0 0 10 -4,-1.8 4,-3.3 -5,-0.2 5,-0.2 0.930 110.6 54.9 -63.2 -46.6 21.0 3.9 13.1 151 371 A A H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.886 105.3 52.9 -56.2 -44.6 18.2 4.8 10.5 152 372 A V H X S+ 0 0 71 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.946 115.9 38.9 -56.2 -52.9 19.3 2.1 8.1 153 373 A K H >< S+ 0 0 91 -4,-1.4 3,-0.9 1,-0.2 4,-0.5 0.950 118.3 48.6 -63.2 -49.5 19.1 -0.6 10.8 154 374 A F H >< S+ 0 0 6 -4,-3.3 3,-1.6 1,-0.2 5,-0.4 0.898 106.9 55.8 -58.6 -43.9 15.9 0.8 12.4 155 375 A N H >< S+ 0 0 27 -4,-3.1 3,-1.6 1,-0.3 -1,-0.2 0.702 91.7 72.1 -65.8 -20.6 14.1 1.1 9.1 156 376 A A T << S+ 0 0 69 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.727 85.9 67.3 -65.4 -22.0 14.7 -2.6 8.4 157 377 A L T < S- 0 0 23 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.627 97.2-144.0 -73.4 -13.3 12.1 -3.3 11.1 158 378 A E < + 0 0 151 -3,-1.6 -3,-0.1 -4,-0.2 -2,-0.1 0.807 31.5 175.1 54.0 36.7 9.5 -1.7 8.7 159 379 A L - 0 0 4 -5,-0.4 2,-0.2 1,-0.1 -1,-0.1 -0.324 16.1-146.7 -64.6 151.7 7.6 -0.1 11.6 160 380 A D > - 0 0 58 1,-0.0 4,-2.8 -138,-0.0 3,-0.4 -0.658 32.7 -90.1-115.3 177.3 4.6 2.2 10.8 161 381 A D H > S+ 0 0 7 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.873 125.4 54.4 -54.3 -38.2 3.3 5.3 12.4 162 382 A S H > S+ 0 0 23 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.863 112.3 43.1 -70.0 -35.6 0.9 3.2 14.6 163 383 A D H > S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 3,-0.4 0.911 113.9 52.3 -67.6 -46.9 3.8 1.0 15.9 164 384 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.870 100.1 62.0 -60.1 -39.4 6.0 4.1 16.4 165 385 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.885 110.4 39.6 -55.1 -43.0 3.4 6.1 18.4 166 386 A I H X S+ 0 0 0 -4,-0.8 4,-2.3 -3,-0.4 -1,-0.2 0.907 113.4 54.8 -74.9 -41.7 3.4 3.4 21.1 167 387 A F H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.891 107.2 50.0 -56.6 -45.4 7.2 2.9 21.0 168 388 A I H X S+ 0 0 0 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.807 109.5 52.0 -62.3 -35.3 7.8 6.7 21.6 169 389 A A H X S+ 0 0 0 -4,-1.0 4,-2.3 -5,-0.3 -2,-0.2 0.911 106.8 52.6 -68.7 -43.0 5.5 6.6 24.6 170 390 A V H < S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.918 108.5 52.7 -55.7 -44.5 7.4 3.6 26.0 171 391 A I H < S+ 0 0 1 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.935 109.2 47.2 -55.8 -52.0 10.6 5.7 25.6 172 392 A I H < S+ 0 0 1 -4,-1.9 2,-1.7 1,-0.3 -1,-0.2 0.915 104.9 60.9 -60.2 -45.8 9.3 8.7 27.5 173 393 A L S < S+ 0 0 0 -4,-2.3 2,-0.7 -5,-0.1 -1,-0.3 -0.330 71.0 145.9 -84.5 56.4 7.9 6.7 30.4 174 394 A S > - 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0 0 84 -2,-0.1 4,-0.2 73,-0.1 -1,-0.1 0.953 40.9-179.2 -53.5 -65.2 45.5 -14.6 48.2 315 264 B F - 0 0 49 1,-0.1 3,-0.4 2,-0.1 14,-0.0 0.831 29.7-143.0 56.6 119.8 45.2 -11.7 45.5 316 265 B K S S+ 0 0 97 1,-0.2 -1,-0.1 13,-0.1 -2,-0.0 0.690 97.3 65.8 -77.6 -18.6 46.9 -12.2 42.2 317 266 B H 0 0 37 8,-0.0 -1,-0.2 9,-0.0 -2,-0.1 0.690 360.0 360.0 -79.2 -21.8 47.8 -8.5 42.2 318 267 B I 0 0 125 -3,-0.4 -7,-0.0 -4,-0.2 0, 0.0 -0.630 360.0 360.0 -81.6 360.0 50.2 -8.6 45.2 319 ! 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 0.0 320 275 B K 0 0 129 0, 0.0 5,-0.1 0, 0.0 187,-0.0 0.000 360.0 360.0 360.0 137.5 52.1 0.9 44.4 321 276 B E > - 0 0 76 1,-0.1 4,-2.2 3,-0.1 3,-0.5 -0.179 360.0-113.6 -59.2 148.7 49.5 3.4 45.7 322 277 B V H > S+ 0 0 24 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.879 110.4 51.1 -53.5 -55.4 46.2 2.0 46.9 323 278 B A H > S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.858 114.6 46.6 -54.3 -39.4 43.7 3.4 44.3 324 279 B I H > S+ 0 0 0 -3,-0.5 4,-2.7 2,-0.2 5,-0.3 0.920 109.0 53.4 -64.7 -51.6 46.0 2.0 41.5 325 280 B R H X S+ 0 0 49 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.840 111.1 47.5 -51.9 -42.6 46.5 -1.4 43.2 326 281 B I H X S+ 0 0 25 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.904 112.8 47.5 -66.8 -44.9 42.7 -1.9 43.4 327 282 B F H X S+ 0 0 6 -4,-1.7 4,-1.7 -5,-0.2 -2,-0.2 0.865 113.8 46.3 -72.4 -37.9 42.0 -0.8 39.8 328 283 B Q H X S+ 0 0 37 -4,-2.7 4,-2.9 2,-0.2 -1,-0.2 0.878 110.3 54.9 -66.2 -41.6 44.7 -3.1 38.4 329 284 B G H X S+ 0 0 18 -4,-1.8 4,-1.7 -5,-0.3 -2,-0.2 0.869 108.2 50.0 -56.3 -39.4 43.5 -6.0 40.6 330 285 B C H X S+ 0 0 55 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.901 110.6 48.0 -66.2 -44.6 40.1 -5.4 39.1 331 286 B Q H X S+ 0 0 24 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.921 109.5 53.1 -62.5 -46.2 41.5 -5.5 35.5 332 287 B F H X S+ 0 0 38 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.877 112.3 45.5 -54.6 -42.5 43.4 -8.7 36.3 333 288 B R H X S+ 0 0 87 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.857 108.3 56.2 -73.2 -37.0 40.2 -10.3 37.5 334 289 B S H X S+ 0 0 19 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.893 104.5 53.7 -60.2 -40.6 38.2 -9.1 34.5 335 290 B V H X S+ 0 0 20 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.875 108.3 49.4 -63.7 -37.0 40.7 -10.8 32.3 336 291 B E H X S+ 0 0 99 -4,-1.3 4,-1.1 1,-0.2 3,-0.5 0.900 107.8 55.4 -62.4 -42.0 40.1 -14.1 34.2 337 292 B A H X S+ 0 0 17 -4,-2.2 4,-2.5 1,-0.2 3,-0.4 0.881 98.0 62.7 -60.3 -41.7 36.4 -13.5 33.7 338 293 B V H X S+ 0 0 11 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.849 101.8 51.0 -51.2 -42.1 36.8 -13.2 29.9 339 294 B Q H X S+ 0 0 124 -4,-1.0 4,-2.0 -3,-0.5 -1,-0.2 0.837 109.8 49.2 -70.4 -31.5 38.0 -16.8 29.8 340 295 B E H X S+ 0 0 48 -4,-1.1 4,-2.4 -3,-0.4 -2,-0.2 0.911 113.2 47.2 -68.1 -41.7 35.0 -18.1 31.8 341 296 B I H X S+ 0 0 2 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.880 110.7 52.8 -65.2 -40.6 32.7 -16.1 29.5 342 297 B T H X S+ 0 0 25 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.924 109.8 47.7 -59.9 -49.0 34.5 -17.6 26.4 343 298 B E H X S+ 0 0 110 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.952 113.7 47.7 -56.9 -52.4 34.1 -21.2 27.7 344 299 B Y H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 4,-0.4 0.932 109.1 54.4 -52.8 -47.7 30.4 -20.5 28.4 345 300 B A H >< S+ 0 0 0 -4,-3.0 3,-2.4 1,-0.3 6,-0.2 0.925 101.4 58.3 -55.2 -45.3 29.9 -18.9 24.9 346 301 B K H 3< S+ 0 0 99 -4,-2.3 6,-0.4 1,-0.3 -1,-0.3 0.683 100.9 57.6 -62.3 -15.1 31.3 -22.0 23.3 347 302 B S T << S+ 0 0 31 -3,-1.7 -1,-0.3 -4,-0.7 -2,-0.2 0.492 77.8 106.1 -92.9 -4.5 28.6 -24.1 24.9 348 303 B I S X S- 0 0 2 -3,-2.4 3,-2.6 -4,-0.4 4,-0.4 -0.666 88.1-107.1 -74.3 118.9 25.8 -22.0 23.4 349 304 B P T 3 S+ 0 0 67 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.245 103.0 15.1 -55.8 132.0 24.4 -24.3 20.7 350 305 B G T > S+ 0 0 27 -4,-0.1 3,-0.8 4,-0.0 4,-0.3 0.042 97.3 103.4 96.1 -25.2 25.5 -23.0 17.2 351 306 B F G X S+ 0 0 0 -3,-2.6 3,-1.5 1,-0.2 -5,-0.1 0.907 78.6 48.5 -59.7 -47.5 28.2 -20.7 18.5 352 307 B V G 3 S+ 0 0 76 -4,-0.4 -1,-0.2 -6,-0.4 -6,-0.1 0.581 106.6 58.9 -75.4 -6.7 31.3 -22.8 17.7 353 308 B N G < S+ 0 0 139 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.463 84.5 103.2 -95.6 -4.9 30.0 -23.4 14.2 354 309 B L S < S- 0 0 12 -3,-1.5 5,-0.1 -4,-0.3 -4,-0.0 -0.406 94.6 -78.2 -71.6 153.8 29.9 -19.7 13.4 355 310 B D >> - 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