==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR 28-APR-06 2GTK . COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.KUHN,H.HILPERT,J.BENZ,A.BINGGELI,U.GRETHER,R.HUMM,H.- . 268 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13609.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 74.6 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 . 8 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 56.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 2 1 1 0 0 2 0 0 0 0 0 1 0 0 0 2 0 1 0 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 . 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 1 207 A E > 0 0 183 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 159.7 3.0 21.1 57.4 2 208 A S H > + 0 0 71 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.852 360.0 49.5 -56.3 -49.3 6.3 20.2 55.9 3 209 A A H > S+ 0 0 74 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.898 112.3 48.6 -58.7 -46.0 5.7 16.5 55.3 4 210 A D H > S+ 0 0 114 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.887 110.0 52.6 -60.3 -42.6 2.4 17.2 53.5 5 211 A L H X S+ 0 0 15 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.875 111.1 46.7 -63.5 -36.7 4.0 19.9 51.4 6 212 A R H X S+ 0 0 86 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.897 111.6 50.1 -71.9 -39.7 6.7 17.4 50.3 7 213 A A H X S+ 0 0 61 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.872 111.1 50.4 -63.8 -38.2 4.2 14.7 49.6 8 214 A L H X S+ 0 0 20 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.957 110.3 49.8 -59.5 -50.5 2.2 17.3 47.5 9 215 A A H X S+ 0 0 4 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.914 114.3 44.6 -52.9 -47.3 5.4 18.2 45.6 10 216 A K H X S+ 0 0 117 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.892 110.4 53.6 -67.8 -43.1 6.1 14.5 45.0 11 217 A H H X S+ 0 0 79 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.912 111.0 47.6 -57.2 -43.9 2.5 13.8 43.9 12 218 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.924 111.4 49.9 -65.2 -45.6 2.7 16.6 41.4 13 219 A Y H X S+ 0 0 79 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.935 111.5 48.6 -56.6 -48.0 6.1 15.4 40.1 14 220 A D H X S+ 0 0 53 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.914 112.0 49.2 -59.5 -43.6 4.7 11.8 39.6 15 221 A S H X S+ 0 0 4 -4,-2.3 4,-1.1 -5,-0.2 -1,-0.2 0.866 109.8 52.5 -60.8 -38.4 1.6 13.2 37.9 16 222 A Y H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 3,-0.5 0.910 107.9 49.5 -67.3 -43.4 3.9 15.3 35.6 17 223 A I H < S+ 0 0 69 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.890 112.8 48.9 -61.0 -38.0 5.9 12.3 34.6 18 224 A K H < S+ 0 0 172 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.696 118.0 40.0 -72.9 -21.4 2.7 10.4 33.8 19 225 A S H < S+ 0 0 17 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.718 112.1 51.3-101.2 -30.5 1.3 13.3 31.7 20 226 A F < - 0 0 6 -4,-2.3 -1,-0.2 1,-0.1 3,-0.1 -0.898 57.3-170.7-121.2 100.8 4.3 14.6 29.8 21 227 A P S S+ 0 0 112 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.825 80.5 55.8 -61.4 -32.4 6.3 11.9 27.8 22 228 A L S S- 0 0 37 4,-0.1 2,-0.1 3,-0.0 104,-0.1 -0.854 77.3-172.1-107.7 100.5 9.1 14.4 27.0 23 229 A T > - 0 0 22 -2,-0.7 4,-2.5 1,-0.1 5,-0.1 -0.310 38.7-110.3 -83.6 165.9 10.6 16.0 30.2 24 230 A K H > S+ 0 0 16 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.888 119.0 60.1 -59.9 -38.2 13.1 18.8 30.5 25 231 A A H > S+ 0 0 61 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.944 110.5 39.4 -55.3 -48.7 15.6 16.2 31.8 26 232 A K H > S+ 0 0 84 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.918 113.7 55.1 -66.8 -45.1 15.3 14.3 28.5 27 233 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.900 108.9 47.0 -55.1 -45.4 15.2 17.4 26.4 28 234 A R H X S+ 0 0 61 -4,-2.7 4,-1.9 2,-0.2 6,-0.3 0.844 107.3 57.0 -70.1 -35.3 18.5 18.8 27.9 29 235 A A H <>S+ 0 0 12 -4,-1.6 5,-2.5 -5,-0.3 4,-0.4 0.942 111.7 44.3 -56.2 -44.6 20.1 15.4 27.4 30 236 A I H ><5S+ 0 0 16 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.932 112.8 49.2 -65.2 -51.4 19.2 15.7 23.7 31 237 A L H 3<5S+ 0 0 39 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.742 117.5 41.6 -62.5 -26.1 20.3 19.4 23.4 32 238 A T T 3<5S- 0 0 95 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.386 109.4-120.7-101.4 2.7 23.7 18.6 25.0 33 239 A G T < 5S+ 0 0 57 -3,-1.1 -3,-0.2 -4,-0.4 -4,-0.1 0.794 70.9 133.0 63.1 30.7 24.3 15.3 23.2 34 240 A K < + 0 0 141 -5,-2.5 2,-0.3 -6,-0.3 -4,-0.2 -0.228 48.7 89.6-104.1 46.2 24.5 13.3 26.4 35 241 A T S S- 0 0 43 -6,-0.2 4,-0.0 2,-0.2 -9,-0.0 -0.896 74.4-132.4-134.3 156.6 22.1 10.6 25.1 36 242 A T S S+ 0 0 151 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.786 77.8 89.4 -81.8 -30.8 22.8 7.4 23.1 37 243 A D S S- 0 0 78 1,-0.2 -2,-0.2 0, 0.0 -4,-0.0 -0.162 91.7 -65.9 -72.5 164.2 20.2 7.9 20.4 38 244 A K - 0 0 190 1,-0.1 -1,-0.2 3,-0.0 3,-0.1 -0.080 53.4-104.0 -47.5 136.8 20.6 9.7 17.1 39 245 A S - 0 0 101 -3,-0.1 -1,-0.1 1,-0.1 -8,-0.1 -0.352 48.8-100.6 -50.9 140.2 21.3 13.4 16.9 40 246 A P - 0 0 29 0, 0.0 88,-0.3 0, 0.0 2,-0.3 -0.402 37.1-103.8 -67.9 146.9 18.1 15.2 15.9 41 247 A F E -a 128 0A 48 86,-2.1 88,-2.4 -3,-0.1 2,-0.5 -0.566 36.9-130.2 -68.3 133.7 17.7 16.4 12.3 42 248 A V E -a 129 0A 69 -2,-0.3 2,-0.7 86,-0.2 88,-0.2 -0.784 14.0-160.2 -91.4 123.3 18.3 20.1 12.0 43 249 A I E +a 130 0A 4 86,-3.2 88,-2.4 -2,-0.5 91,-0.2 -0.922 34.3 143.8 -98.1 109.7 15.8 22.2 10.1 44 250 A Y + 0 0 137 -2,-0.7 2,-0.3 1,-0.2 -1,-0.1 0.419 64.0 12.0-125.6 -7.4 17.7 25.4 9.2 45 251 A D S > S- 0 0 45 -3,-0.1 4,-2.2 1,-0.1 -1,-0.2 -0.932 87.7 -79.7-160.9-179.7 16.2 26.2 5.7 46 252 A M H > S+ 0 0 119 -2,-0.3 4,-1.1 1,-0.2 -1,-0.1 0.891 124.2 36.3 -60.2 -51.1 13.5 25.4 3.1 47 253 A N H > S+ 0 0 83 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.727 113.7 58.6 -79.5 -22.6 14.9 22.2 1.6 48 254 A S H > S+ 0 0 13 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.877 106.1 50.0 -65.5 -40.2 16.3 21.1 5.0 49 255 A L H X S+ 0 0 16 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.811 105.8 58.6 -61.2 -35.5 12.7 21.4 6.1 50 256 A M H X S+ 0 0 93 -4,-1.1 4,-0.6 2,-0.2 -2,-0.2 0.946 106.7 44.6 -59.1 -54.4 11.8 19.2 3.0 51 257 A M H >X S+ 0 0 120 -4,-1.8 4,-0.9 1,-0.2 3,-0.6 0.851 116.8 46.6 -60.7 -39.0 14.0 16.3 4.0 52 258 A G H 3< S+ 0 0 9 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.822 95.0 73.5 -74.1 -34.1 12.7 16.5 7.6 53 259 A E H 3< S+ 0 0 105 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.715 98.0 53.2 -53.2 -24.0 9.1 16.8 6.6 54 260 A D H << 0 0 147 -3,-0.6 -1,-0.2 -4,-0.6 -2,-0.2 0.981 360.0 360.0 -67.3 -67.6 9.5 13.1 5.8 55 261 A K < 0 0 160 -4,-0.9 -2,-0.1 72,-0.0 -3,-0.1 0.991 360.0 360.0 -67.6 360.0 10.8 11.9 9.1 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 0 140 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 99.8 1.1 25.4 0.6 58 276 A E >> - 0 0 83 1,-0.1 4,-2.2 3,-0.1 3,-0.6 -0.050 360.0-111.4 -59.3 152.5 3.7 28.0 1.5 59 277 A V H 3> S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.881 114.3 51.5 -48.0 -51.0 6.5 27.2 4.1 60 278 A A H 3> S+ 0 0 4 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.829 111.0 48.1 -61.9 -36.2 5.2 29.5 6.8 61 279 A I H <> S+ 0 0 1 -3,-0.6 4,-3.2 2,-0.2 5,-0.2 0.906 109.1 52.9 -68.3 -46.2 1.7 28.1 6.7 62 280 A R H X S+ 0 0 61 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.914 111.8 46.0 -56.9 -45.2 2.9 24.5 6.8 63 281 A I H X S+ 0 0 21 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.934 114.1 48.1 -60.2 -47.9 4.9 25.3 9.9 64 282 A F H X S+ 0 0 18 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.858 113.2 47.7 -64.7 -39.3 2.0 27.1 11.5 65 283 A Q H X S+ 0 0 65 -4,-3.2 4,-1.1 2,-0.2 3,-0.5 0.914 112.0 51.4 -67.2 -41.3 -0.4 24.2 10.7 66 284 A G H X S+ 0 0 39 -4,-2.5 4,-1.4 -5,-0.2 3,-0.4 0.906 103.4 57.0 -60.7 -49.2 2.2 21.8 12.1 67 285 A C H X S+ 0 0 67 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.794 102.1 59.5 -43.3 -39.9 2.5 23.8 15.4 68 286 A Q H X S+ 0 0 16 -4,-0.9 4,-3.0 -3,-0.5 5,-0.2 0.895 100.0 51.8 -67.8 -42.7 -1.3 23.3 15.8 69 287 A F H X S+ 0 0 143 -4,-1.1 4,-1.9 -3,-0.4 -1,-0.2 0.929 115.1 43.0 -60.9 -45.5 -1.3 19.6 15.9 70 288 A R H X S+ 0 0 115 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.888 112.1 55.9 -63.5 -41.7 1.4 19.6 18.6 71 289 A S H X S+ 0 0 18 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.942 108.9 44.8 -57.5 -49.2 -0.4 22.4 20.4 72 290 A V H X S+ 0 0 12 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.896 112.2 52.4 -67.4 -35.5 -3.7 20.4 20.6 73 291 A E H X S+ 0 0 70 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.925 111.0 48.0 -59.4 -44.1 -1.7 17.3 21.7 74 292 A A H X S+ 0 0 7 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.850 106.0 57.3 -66.2 -37.8 -0.1 19.4 24.5 75 293 A V H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.898 107.3 49.5 -55.5 -44.1 -3.5 20.8 25.5 76 294 A Q H X S+ 0 0 85 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.933 111.7 48.3 -61.4 -46.7 -4.6 17.1 26.1 77 295 A E H X S+ 0 0 30 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.913 112.2 48.1 -58.7 -45.5 -1.5 16.5 28.2 78 296 A I H X S+ 0 0 2 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.878 110.0 52.4 -67.8 -38.3 -1.9 19.6 30.3 79 297 A T H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.912 109.3 49.4 -60.4 -46.1 -5.6 18.8 30.9 80 298 A E H < S+ 0 0 82 -4,-2.1 4,-0.3 1,-0.2 -2,-0.2 0.904 112.7 48.0 -62.9 -39.5 -4.7 15.3 32.1 81 299 A Y H >< S+ 0 0 0 -4,-2.2 3,-1.9 1,-0.2 4,-0.4 0.930 107.9 54.5 -63.9 -44.5 -2.1 16.8 34.4 82 300 A A H >< S+ 0 0 0 -4,-2.8 3,-1.4 1,-0.3 -2,-0.2 0.857 101.7 60.2 -58.7 -33.6 -4.6 19.4 35.7 83 301 A K T 3< S+ 0 0 34 -4,-1.8 -1,-0.3 1,-0.3 6,-0.2 0.598 100.6 55.5 -72.8 -9.9 -6.9 16.6 36.7 84 302 A S T < S+ 0 0 51 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.496 79.6 104.3 -98.7 -5.2 -4.3 15.2 38.9 85 303 A I S X S- 0 0 2 -3,-1.4 3,-2.3 -4,-0.4 4,-0.4 -0.680 86.6-108.8 -73.5 119.3 -3.9 18.5 41.0 86 304 A P T 3 S+ 0 0 68 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.217 100.8 15.0 -56.6 131.3 -5.7 17.7 44.3 87 305 A G T > S+ 0 0 33 -4,-0.1 3,-0.6 4,-0.0 4,-0.5 0.052 98.4 103.3 95.4 -21.8 -9.0 19.6 44.5 88 306 A F G X S+ 0 0 0 -3,-2.3 3,-1.5 1,-0.2 -5,-0.1 0.907 77.1 48.5 -64.4 -47.5 -9.1 20.5 40.8 89 307 A V G 3 S+ 0 0 77 -4,-0.4 -1,-0.2 1,-0.3 7,-0.1 0.676 105.8 61.0 -71.0 -14.9 -11.8 18.0 39.6 90 308 A N G < S+ 0 0 146 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.580 83.4 101.8 -85.6 -10.3 -14.0 19.0 42.5 91 309 A L S < S- 0 0 13 -3,-1.5 5,-0.1 -4,-0.5 -4,-0.0 -0.381 96.6 -79.0 -67.1 150.0 -14.2 22.6 41.3 92 310 A D >> - 0 0 62 1,-0.1 4,-1.6 92,-0.1 3,-0.7 -0.293 45.6-124.4 -41.3 130.7 -17.3 23.7 39.5 93 311 A L H 3> S+ 0 0 57 1,-0.3 4,-2.3 2,-0.2 -1,-0.1 0.819 108.9 57.3 -58.6 -37.6 -16.8 22.4 36.0 94 312 A N H 3> S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.859 106.6 50.6 -61.6 -35.3 -17.3 25.8 34.3 95 313 A D H <> S+ 0 0 1 -3,-0.7 4,-2.9 2,-0.2 -2,-0.2 0.847 106.8 53.5 -71.2 -35.1 -14.4 27.1 36.5 96 314 A Q H X S+ 0 0 8 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.924 109.7 49.4 -61.8 -44.7 -12.2 24.2 35.4 97 315 A V H X S+ 0 0 26 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.933 113.3 45.9 -57.3 -48.3 -12.9 25.1 31.8 98 316 A T H X S+ 0 0 23 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.910 112.3 50.4 -60.7 -47.0 -12.1 28.8 32.5 99 317 A L H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.927 116.1 43.2 -56.8 -45.2 -8.9 27.8 34.4 100 318 A L H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 111.0 53.5 -68.0 -50.1 -7.9 25.6 31.5 101 319 A K H < S+ 0 0 28 -4,-3.2 4,-0.4 1,-0.2 -1,-0.2 0.874 119.6 33.5 -50.4 -47.9 -8.8 28.1 28.7 102 320 A Y H < S+ 0 0 18 -4,-2.3 4,-0.3 -5,-0.2 -1,-0.2 0.736 124.6 44.2 -84.2 -25.3 -6.7 30.9 30.3 103 321 A G H X S+ 0 0 1 -4,-1.8 4,-1.8 -5,-0.3 3,-0.3 0.781 91.1 78.8 -89.1 -29.2 -4.0 28.7 31.6 104 322 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 3,-0.2 0.884 96.0 41.9 -59.9 -48.9 -3.2 26.2 28.9 105 323 A H H > S+ 0 0 5 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.831 109.7 59.0 -69.8 -28.5 -1.0 28.3 26.5 106 324 A E H > S+ 0 0 2 -4,-0.3 4,-1.4 -3,-0.3 -1,-0.2 0.907 111.2 43.5 -62.5 -38.1 0.9 29.8 29.5 107 325 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 -3,-0.2 5,-0.3 0.902 109.6 55.4 -72.0 -44.6 1.8 26.2 30.3 108 326 A I H X S+ 0 0 22 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.917 111.6 44.1 -51.2 -46.7 2.6 25.3 26.7 109 327 A Y H X S+ 0 0 14 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.817 110.7 55.1 -72.1 -32.1 5.1 28.1 26.5 110 328 A T H X S+ 0 0 0 -4,-1.4 4,-0.6 -5,-0.2 3,-0.4 0.963 114.7 39.2 -57.9 -54.0 6.6 27.3 29.9 111 329 A M H X S+ 0 0 26 -4,-2.4 4,-0.5 1,-0.2 3,-0.4 0.769 107.3 62.8 -74.7 -28.5 7.3 23.7 28.8 112 330 A L H >< S+ 0 0 40 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A L E - C 0 129A 2 -7,-2.3 2,-0.3 -2,-0.4 7,-0.3 -0.587 36.9-175.0 -69.3 130.9 13.2 20.6 19.6 123 341 A I E >> + C 0 128A 62 5,-2.5 5,-2.2 -2,-0.3 4,-0.8 -0.815 51.0 29.4-125.1 169.7 10.2 19.3 17.5 124 342 A S T >45S- 0 0 50 -2,-0.3 3,-2.0 1,-0.2 -1,-0.2 0.935 135.4 -43.0 40.4 70.0 8.5 15.9 17.0 125 343 A E T 345S- 0 0 139 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.811 112.7 -56.1 55.3 35.1 9.3 14.3 20.3 126 344 A G T 345S+ 0 0 8 2,-0.1 -1,-0.3 -104,-0.1 -2,-0.2 0.566 113.0 113.0 80.5 9.8 12.8 15.6 20.2 127 345 A Q T <<5S+ 0 0 104 -3,-2.0 -86,-2.1 -4,-0.8 2,-0.3 0.631 75.8 43.0 -89.1 -15.0 13.7 14.0 16.8 128 346 A G E < -aC 41 123A 0 -5,-2.2 -5,-2.5 -88,-0.3 2,-0.4 -0.890 64.1-154.6-127.8 158.2 14.1 17.4 15.0 129 347 A F E -aC 42 122A 27 -88,-2.4 -86,-3.2 -2,-0.3 2,-0.6 -0.979 8.5-161.0-135.2 118.1 15.6 20.8 15.9 130 348 A M E -aC 43 121A 13 -9,-3.2 -9,-2.1 -2,-0.4 -86,-0.2 -0.894 22.9-125.4-104.5 119.3 14.3 23.9 14.2 131 349 A T E > - C 0 120A 23 -88,-2.4 4,-1.5 -2,-0.6 -11,-0.3 -0.230 6.9-132.1 -65.2 148.8 16.7 26.8 14.3 132 350 A R H > S+ 0 0 40 -13,-2.3 4,-2.3 1,-0.2 -12,-0.2 0.840 109.2 57.6 -62.3 -38.3 15.5 30.2 15.7 133 351 A E H > S+ 0 0 124 -14,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.884 103.6 50.8 -61.5 -42.6 17.0 31.8 12.6 134 352 A F H 4 S+ 0 0 10 -91,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.904 111.9 47.5 -62.2 -39.9 14.9 29.7 10.2 135 353 A L H >< S+ 0 0 10 -4,-1.5 3,-1.0 1,-0.2 -2,-0.2 0.898 110.0 52.4 -71.7 -36.6 11.7 30.7 12.2 136 354 A K H 3< S+ 0 0 91 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.832 101.5 63.4 -64.9 -31.6 12.8 34.3 12.2 137 355 A S T 3< S+ 0 0 82 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.640 79.0 110.8 -65.6 -19.1 13.2 34.1 8.3 138 356 A L S < S- 0 0 20 -3,-1.0 5,-0.4 -4,-0.5 -3,-0.0 -0.274 77.8 -97.6 -63.1 146.8 9.5 33.4 7.8 139 357 A R >> - 0 0 88 3,-0.2 4,-1.3 1,-0.1 3,-1.1 -0.167 63.2 -47.4 -64.6 154.6 7.4 36.0 6.1 140 358 A K T 34 S+ 0 0 142 1,-0.3 -1,-0.1 2,-0.2 0, 0.0 -0.396 123.2 12.0 -57.9 136.9 5.3 38.6 8.0 141 359 A P T >4 S+ 0 0 12 0, 0.0 3,-1.5 0, 0.0 -1,-0.3 -0.987 123.4 57.1 -96.6 8.9 3.5 37.9 10.1 142 360 A F G X4 S+ 0 0 5 -3,-1.1 3,-1.2 1,-0.3 4,-0.4 0.769 96.8 65.0 -66.8 -28.0 4.6 34.2 10.7 143 361 A G G 3< S+ 0 0 5 -4,-1.3 4,-0.3 -5,-0.4 -1,-0.3 0.543 96.7 58.4 -73.4 -6.6 8.2 35.1 11.5 144 362 A D G < S+ 0 0 64 -3,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.481 85.2 83.4 -97.4 -11.1 7.1 37.0 14.6 145 363 A F S < S+ 0 0 16 -3,-1.2 4,-0.4 -4,-0.3 -2,-0.1 0.961 97.3 29.0 -56.0 -58.5 5.4 34.0 16.3 146 364 A M S >> S+ 0 0 27 -4,-0.4 4,-2.0 1,-0.2 3,-0.8 0.737 98.5 80.7 -86.7 -26.9 8.3 32.2 18.0 147 365 A E H 3> S+ 0 0 35 -4,-0.3 4,-2.5 1,-0.3 -1,-0.2 0.863 91.6 51.0 -53.8 -45.5 10.8 34.9 18.7 148 366 A P H 3> S+ 0 0 23 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.835 110.0 53.1 -61.3 -30.3 9.1 36.2 22.0 149 367 A K H <> S+ 0 0 6 -3,-0.8 4,-3.0 -4,-0.4 -2,-0.2 0.890 108.8 47.5 -71.5 -42.2 9.1 32.6 23.2 150 368 A F H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.927 110.9 52.4 -59.6 -47.1 12.8 32.2 22.6 151 369 A E H X S+ 0 0 105 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.918 115.3 41.4 -56.8 -46.6 13.4 35.6 24.4 152 370 A F H X S+ 0 0 11 -4,-2.2 4,-3.0 -5,-0.2 -2,-0.2 0.937 112.9 54.6 -62.2 -47.3 11.4 34.3 27.4 153 371 A A H X S+ 0 0 1 -4,-3.0 4,-3.6 1,-0.2 5,-0.2 0.877 103.8 53.4 -61.0 -42.5 13.0 30.8 27.2 154 372 A V H X S+ 0 0 64 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.915 116.5 38.6 -60.0 -42.6 16.6 32.0 27.4 155 373 A K H X S+ 0 0 126 -4,-1.2 4,-0.5 -5,-0.2 -2,-0.2 0.905 117.0 50.6 -76.6 -37.9 15.9 34.0 30.5 156 374 A F H >< S+ 0 0 3 -4,-3.0 3,-1.8 1,-0.2 5,-0.4 0.944 108.7 52.3 -62.5 -48.7 13.6 31.4 32.0 157 375 A N H >< S+ 0 0 23 -4,-3.6 3,-1.8 1,-0.3 -1,-0.2 0.765 94.4 70.9 -60.5 -27.9 16.2 28.6 31.4 158 376 A A H 3< S+ 0 0 74 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.765 88.2 65.0 -61.5 -22.1 18.8 30.7 33.3 159 377 A L T << S- 0 0 23 -3,-1.8 -1,-0.3 -4,-0.5 -2,-0.2 0.648 99.2-143.0 -71.1 -16.8 16.8 29.9 36.5 160 378 A E < + 0 0 150 -3,-1.8 -3,-0.1 -4,-0.3 -2,-0.1 0.839 30.5 175.7 57.6 38.9 17.8 26.2 35.9 161 379 A L - 0 0 3 -5,-0.4 2,-0.2 4,-0.1 -1,-0.1 -0.422 15.5-148.8 -66.1 149.4 14.4 24.8 37.1 162 380 A D > - 0 0 57 -2,-0.1 4,-2.6 -138,-0.0 3,-0.2 -0.557 33.1 -87.4-112.9-177.3 14.1 21.0 36.8 163 381 A D H > S+ 0 0 9 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.856 126.3 54.4 -62.5 -36.3 11.0 18.9 36.2 164 382 A S H > S+ 0 0 27 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.890 111.7 44.8 -65.5 -38.5 10.2 18.6 39.9 165 383 A D H > S+ 0 0 0 -3,-0.2 4,-2.5 1,-0.2 3,-0.5 0.937 112.3 53.1 -65.0 -47.9 10.2 22.4 40.2 166 384 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.826 98.7 62.9 -60.2 -35.7 8.2 22.8 37.0 167 385 A A H X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.906 112.1 36.6 -59.9 -42.9 5.4 20.4 38.1 168 386 A I H X S+ 0 0 0 -4,-1.0 4,-2.7 -3,-0.5 -2,-0.2 0.947 114.3 55.1 -71.7 -51.6 4.6 22.7 41.0 169 387 A F H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.892 110.1 48.4 -40.4 -50.6 5.1 26.0 39.0 170 388 A I H X S+ 0 0 0 -4,-3.0 4,-2.0 2,-0.2 -1,-0.2 0.913 109.7 50.9 -63.4 -44.3 2.7 24.6 36.4 171 389 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 -5,-0.2 -2,-0.2 0.920 107.4 53.9 -62.6 -43.5 0.1 23.8 39.0 172 390 A V H < S+ 0 0 1 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.910 109.3 48.7 -54.0 -46.7 0.3 27.3 40.6 173 391 A I H >< S+ 0 0 2 -4,-1.8 3,-0.8 1,-0.2 -1,-0.2 0.911 109.1 51.2 -62.0 -42.9 -0.4 28.9 37.1 174 392 A I H 3< S+ 0 0 2 -4,-2.0 2,-1.0 1,-0.3 -1,-0.2 0.896 105.6 58.0 -65.4 -36.3 -3.4 26.7 36.4 175 393 A L T 3< S+ 0 0 0 -4,-2.0 2,-0.6 -5,-0.2 -1,-0.3 -0.271 73.4 149.7 -90.7 50.3 -4.9 27.5 39.8 176 394 A S X - 0 0 7 -2,-1.0 3,-1.2 -3,-0.8 13,-0.1 -0.764 35.2-159.7 -89.8 117.4 -5.0 31.3 39.2 177 395 A G T 3 S+ 0 0 10 -2,-0.6 -1,-0.1 1,-0.2 5,-0.1 0.604 84.1 65.6 -70.7 -12.0 -7.9 32.9 41.1 178 396 A D T 3 + 0 0 97 3,-0.1 -1,-0.2 2,-0.0 3,-0.1 0.326 65.2 129.7 -98.6 8.3 -7.8 36.0 38.9 179 397 A R S X S- 0 0 6 -3,-1.2 3,-1.2 1,-0.1 -80,-0.1 -0.358 70.7 -95.1 -58.8 138.3 -8.9 34.4 35.5 180 398 A P T 3 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 79,-0.1 -0.314 102.6 13.1 -56.1 133.3 -11.8 36.4 33.9 181 399 A G T 3 S+ 0 0 64 1,-0.2 2,-0.2 -3,-0.1 -83,-0.1 0.624 78.1 161.0 78.6 16.7 -15.2 35.0 34.6 182 400 A L < - 0 0 22 -3,-1.2 3,-0.3 1,-0.1 -1,-0.2 -0.527 28.3-156.3 -69.8 137.0 -14.5 32.6 37.4 183 401 A L S S+ 0 0 103 1,-0.2 2,-0.5 -2,-0.2 -1,-0.1 0.906 83.5 27.6 -78.4 -45.1 -17.6 31.7 39.4 184 402 A N > + 0 0 81 1,-0.1 4,-0.7 -92,-0.1 -1,-0.2 -0.788 63.1 171.0-126.7 87.0 -16.0 30.6 42.7 185 403 A V H > + 0 0 54 -2,-0.5 4,-2.1 -3,-0.3 3,-0.5 0.848 67.6 66.3 -67.0 -36.1 -12.7 32.4 43.3 186 404 A K H > S+ 0 0 128 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.878 97.4 47.1 -59.8 -53.5 -12.1 31.2 46.9 187 405 A P H > S+ 0 0 56 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.752 113.8 52.8 -63.7 -22.4 -11.6 27.5 46.6 188 406 A I H X S+ 0 0 0 -4,-0.7 4,-2.6 -3,-0.5 -2,-0.2 0.907 109.8 45.9 -73.1 -45.2 -9.2 28.2 43.8 189 407 A E H X S+ 0 0 87 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.905 110.5 54.9 -63.0 -42.8 -7.1 30.6 45.8 190 408 A D H X S+ 0 0 76 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.917 111.2 43.8 -54.7 -48.0 -7.1 28.1 48.8 191 409 A I H X S+ 0 0 30 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.939 115.1 49.4 -64.8 -46.0 -5.7 25.4 46.5 192 410 A Q H X S+ 0 0 36 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.814 106.3 56.6 -60.6 -35.1 -3.2 27.8 44.9 193 411 A D H X S+ 0 0 86 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.914 109.2 46.0 -65.1 -43.0 -2.1 29.1 48.4 194 412 A N H X S+ 0 0 71 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.917 112.7 49.7 -63.8 -45.3 -1.2 25.5 49.3 195 413 A L H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.840 109.3 52.7 -62.0 -37.5 0.6 24.9 46.0 196 414 A L H X S+ 0 0 38 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.894 108.3 49.8 -64.5 -42.0 2.6 28.2 46.5 197 415 A Q H X S+ 0 0 100 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.911 111.9 49.0 -59.0 -43.5 3.7 27.0 49.9 198 416 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.881 112.2 48.6 -65.0 -39.2 4.7 23.7 48.3 199 417 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.909 109.1 52.0 -66.0 -44.9 6.6 25.6 45.6 200 418 A E H X S+ 0 0 77 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.952 113.0 44.7 -58.2 -47.9 8.4 27.9 48.1 201 419 A L H X S+ 0 0 41 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.928 112.3 53.3 -63.4 -44.9 9.6 24.8 50.1 202 420 A Q H X S+ 0 0 7 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.884 110.4 45.5 -54.5 -47.3 10.6 23.0 46.8 203 421 A L H X S+ 0 0 4 -4,-2.7 4,-2.1 2,-0.2 7,-0.2 0.874 112.0 52.4 -68.9 -35.5 12.8 25.9 45.6 204 422 A K H < S+ 0 0 142 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.892 117.8 36.5 -65.2 -41.0 14.4 26.4 49.0 205 423 A L H < S+ 0 0 107 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.889 123.6 41.8 -80.1 -41.5 15.4 22.6 49.2 206 424 A N H < S+ 0 0 60 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.755 132.3 21.1 -79.4 -27.7 16.2 22.1 45.5 207 425 A H >< + 0 0 36 -4,-2.1 3,-1.9 -5,-0.3 -1,-0.2 -0.444 68.2 162.7-139.0 65.0 18.1 25.4 45.0 208 426 A P T 3 S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.776 79.8 44.0 -58.2 -27.5 19.2 26.6 48.5 209 427 A E T 3 S+ 0 0 175 -3,-0.1 2,-0.8 2,-0.1 -5,-0.1 0.347 81.8 110.4-100.6 2.5 21.8 29.0 47.0 210 428 A S S X S- 0 0 47 -3,-1.9 3,-1.5 -7,-0.2 2,-0.1 -0.730 73.7-122.8 -87.0 111.1 19.6 30.5 44.2 211 429 A S T 3 S- 0 0 87 -2,-0.8 5,-0.1 1,-0.3 -2,-0.1 -0.293 79.0 -21.3 -61.3 123.1 19.0 34.1 45.2 212 430 A Q T 3> S+ 0 0 133 -2,-0.1 4,-2.3 1,-0.1 -1,-0.3 0.794 83.4 157.7 50.9 35.1 15.3 35.1 45.5 213 431 A L H <> + 0 0 6 -3,-1.5 4,-2.6 1,-0.2 5,-0.2 0.923 67.7 52.3 -54.8 -53.1 14.4 32.2 43.2 214 432 A F H > S+ 0 0 47 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.920 112.0 45.1 -48.2 -52.2 10.8 32.0 44.4 215 433 A A H > S+ 0 0 51 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.875 112.6 52.9 -61.4 -38.7 10.1 35.7 43.8 216 434 A K H X S+ 0 0 94 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.886 110.4 48.0 -64.0 -39.1 11.9 35.4 40.4 217 435 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 3,-0.3 0.900 106.4 54.0 -67.7 -45.3 9.6 32.5 39.4 218 436 A L H X S+ 0 0 55 -4,-2.3 4,-1.0 1,-0.2 3,-0.4 0.896 106.4 55.2 -58.1 -41.2 6.4 34.2 40.5 219 437 A Q H X S+ 0 0 102 -4,-1.7 4,-2.1 1,-0.2 3,-0.4 0.850 102.1 56.2 -56.9 -39.3 7.4 37.1 38.2 220 438 A K H X S+ 0 0 29 -4,-1.2 4,-1.8 -3,-0.3 -1,-0.2 0.833 98.7 62.3 -65.1 -33.1 7.8 34.7 35.2 221 439 A M H X S+ 0 0 23 -4,-1.4 4,-0.6 -3,-0.4 -1,-0.3 0.860 107.4 43.0 -59.2 -39.5 4.2 33.6 35.7 222 440 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-3,-0.4 -4,-0.0 -0.394 360.0 360.0 -67.7 143.0 -12.9 11.8 30.5 270 640 B T 0 0 201 -2,-0.1 -1,-0.1 0, 0.0 -4,-0.0 0.317 360.0 360.0-132.9 360.0 -11.7 8.8 32.6