==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 11-APR-12 4EMA . COMPND 2 MOLECULE: PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.V.LIBERATO,A.S.NASCIMENTO,I.POLIKARPOV . 500 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24363.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 388 77.6 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 3.2 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 . 22 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 266 53.2 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 1 1 3 2 1 0 1 1 2 0 0 0 0 0 2 0 1 1 3 0 1 1 0 1 0 0 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 1 207 A E >> 0 0 119 0, 0.0 4,-2.4 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -13.3 42.4 -16.4 28.0 2 208 A S H 3> + 0 0 75 1,-0.2 4,-1.2 2,-0.2 5,-0.0 0.735 360.0 56.3 -58.8 -20.8 41.0 -17.7 31.3 3 209 A A H 3> S+ 0 0 73 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.777 104.3 52.1 -78.5 -30.7 43.7 -15.4 32.8 4 210 A D H <> S+ 0 0 95 -3,-0.5 4,-4.2 2,-0.2 5,-0.3 0.929 103.6 56.1 -64.9 -49.6 42.1 -12.6 30.9 5 211 A L H X S+ 0 0 9 -4,-2.4 4,-2.3 1,-0.3 -2,-0.2 0.884 110.9 45.4 -53.8 -39.6 38.7 -13.4 32.4 6 212 A R H X S+ 0 0 86 -4,-1.2 4,-2.0 2,-0.2 -1,-0.3 0.889 114.5 46.3 -66.6 -43.6 40.4 -13.0 35.8 7 213 A A H X S+ 0 0 60 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.901 111.9 52.6 -69.3 -39.6 42.1 -9.8 34.8 8 214 A L H X S+ 0 0 28 -4,-4.2 4,-2.8 1,-0.2 5,-0.2 0.938 109.1 50.1 -55.1 -50.2 38.8 -8.6 33.3 9 215 A A H X S+ 0 0 4 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.884 112.1 46.1 -56.3 -43.9 37.1 -9.4 36.6 10 216 A K H X S+ 0 0 115 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.904 112.2 52.3 -69.9 -42.6 39.7 -7.5 38.7 11 217 A H H X S+ 0 0 76 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.940 110.6 46.3 -53.1 -53.7 39.6 -4.6 36.3 12 218 A L H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.933 112.6 51.1 -58.7 -45.6 35.8 -4.3 36.5 13 219 A Y H X S+ 0 0 62 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.860 108.8 50.7 -63.3 -38.3 35.9 -4.5 40.2 14 220 A D H X S+ 0 0 82 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.897 113.1 44.7 -65.8 -41.4 38.5 -1.8 40.6 15 221 A S H X S+ 0 0 9 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.801 110.1 56.1 -72.1 -30.5 36.5 0.7 38.4 16 222 A Y H X S+ 0 0 2 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.941 110.7 44.1 -65.9 -45.9 33.4 -0.3 40.2 17 223 A I H < S+ 0 0 72 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.885 114.8 49.3 -64.4 -42.1 35.1 0.7 43.4 18 224 A K H < S+ 0 0 147 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.908 117.3 42.3 -60.8 -38.9 36.5 3.8 41.7 19 225 A S H < S+ 0 0 6 -4,-2.8 -2,-0.2 1,-0.1 -3,-0.2 0.818 107.6 56.5 -84.8 -33.1 33.0 4.7 40.4 20 226 A F < - 0 0 7 -4,-2.7 -1,-0.1 1,-0.1 3,-0.1 -0.885 58.8-162.0-111.2 114.8 30.6 4.0 43.3 21 227 A P S S+ 0 0 91 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.874 81.7 50.6 -60.4 -41.2 31.2 5.8 46.7 22 228 A L S S- 0 0 28 4,-0.1 2,-0.1 3,-0.0 102,-0.1 -0.834 75.0-166.1-109.1 103.9 29.1 3.4 48.7 23 229 A T > - 0 0 26 -2,-0.7 4,-3.1 1,-0.1 5,-0.2 -0.344 34.1-113.1 -79.3 162.8 29.8 -0.3 48.3 24 230 A K H > S+ 0 0 18 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.870 119.0 55.0 -57.7 -39.4 27.6 -3.3 49.4 25 231 A A H > S+ 0 0 60 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.960 111.9 41.4 -62.7 -48.9 30.4 -4.2 51.8 26 232 A K H > S+ 0 0 112 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.924 116.0 51.1 -64.1 -42.0 30.3 -0.7 53.4 27 233 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 3,-0.5 0.912 108.0 51.4 -60.2 -45.7 26.5 -0.6 53.3 28 234 A R H X S+ 0 0 70 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.852 107.9 54.3 -57.9 -36.5 26.2 -4.0 55.0 29 235 A A H <>S+ 0 0 26 -4,-1.6 5,-2.4 -5,-0.2 6,-0.4 0.748 110.9 43.9 -75.1 -26.2 28.5 -2.8 57.7 30 236 A I H ><5S+ 0 0 11 -4,-1.3 3,-1.1 -3,-0.5 -2,-0.2 0.839 111.2 55.6 -79.6 -35.4 26.3 0.2 58.4 31 237 A L H 3<5S+ 0 0 28 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.629 114.9 38.4 -72.9 -13.6 23.2 -1.9 58.3 32 238 A T T 3<5S- 0 0 80 -4,-0.7 -1,-0.3 -5,-0.2 -2,-0.2 0.116 112.4-111.3-127.9 19.1 24.5 -4.3 60.9 33 239 A G T < 5 + 0 0 51 -3,-1.1 -3,-0.2 1,-0.2 -4,-0.1 0.842 56.3 156.1 55.0 43.8 26.2 -1.8 63.3 34 240 A K < + 0 0 141 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.2 0.445 68.7 54.4 -68.9 4.7 29.8 -2.7 62.8 35 241 A T - 0 0 21 -6,-0.4 0, 0.0 1,-0.2 0, 0.0 -0.932 46.0-172.2-148.9 164.0 30.1 0.9 63.9 36 242 A T S > S+ 0 0 123 -2,-0.3 3,-1.9 2,-0.1 -1,-0.2 0.719 107.5 46.1 -95.7 -65.9 29.7 4.0 66.1 37 243 A D T 3 S+ 0 0 130 1,-0.3 -2,-0.1 0, 0.0 0, 0.0 0.621 119.7 47.7 -56.4 -12.5 31.1 6.5 63.7 38 244 A K T 3 S+ 0 0 83 -9,-0.1 -1,-0.3 2,-0.1 -5,-0.1 0.396 75.3 119.7-116.2 -0.9 29.0 4.7 61.1 39 245 A S < - 0 0 77 -3,-1.9 2,-0.1 -6,-0.1 -8,-0.1 -0.546 56.4-130.9 -74.6 138.9 25.4 4.4 62.5 40 246 A P - 0 0 34 0, 0.0 2,-0.4 0, 0.0 86,-0.3 -0.345 14.4-109.0 -82.3 155.6 22.7 6.2 60.5 41 247 A F E -a 126 0A 94 84,-2.4 86,-2.2 -2,-0.1 2,-0.6 -0.728 38.3-129.7 -82.5 138.7 19.9 8.5 61.5 42 248 A V E -a 127 0A 67 -2,-0.4 2,-0.7 84,-0.2 86,-0.2 -0.815 18.9-167.0-104.2 118.8 16.6 6.7 61.3 43 249 A I E +a 128 0A 11 84,-2.9 86,-2.3 -2,-0.6 89,-0.1 -0.904 29.3 144.5-102.0 114.7 13.7 8.4 59.4 44 250 A Y + 0 0 134 -2,-0.7 2,-0.3 84,-0.2 -1,-0.1 0.364 63.4 20.4-133.6 -5.7 10.6 6.5 60.2 45 251 A D S > S- 0 0 45 -3,-0.1 4,-1.5 1,-0.1 -1,-0.2 -0.949 86.2 -88.7-155.8-179.6 8.1 9.3 60.3 46 252 A M H > S+ 0 0 84 -2,-0.3 4,-2.0 2,-0.2 5,-0.1 0.904 120.2 48.9 -65.3 -42.1 7.2 12.8 59.3 47 253 A N H >> S+ 0 0 105 2,-0.2 4,-3.3 1,-0.2 3,-0.5 0.984 113.5 43.1 -60.9 -61.9 8.8 14.3 62.3 48 254 A S H 3> S+ 0 0 8 1,-0.3 4,-0.6 2,-0.3 -1,-0.2 0.708 110.8 58.4 -59.7 -21.6 12.1 12.5 62.2 49 255 A L H 3< S+ 0 0 31 -4,-1.5 -1,-0.3 2,-0.2 -2,-0.2 0.896 109.7 44.1 -69.7 -41.2 12.1 13.2 58.5 50 256 A M H << S+ 0 0 115 -4,-2.0 -2,-0.3 -3,-0.5 -3,-0.2 0.963 116.6 43.1 -62.4 -53.9 11.9 16.8 59.5 51 257 A M H < S+ 0 0 122 -4,-3.3 2,-1.5 -5,-0.1 -1,-0.2 0.714 91.1 102.5 -67.6 -15.1 14.5 16.4 62.1 52 258 A G < + 0 0 8 -4,-0.6 -1,-0.1 -5,-0.4 -3,-0.1 -0.539 41.4 124.8 -65.0 90.3 16.1 14.3 59.3 53 259 A E 0 0 143 -2,-1.5 -1,-0.1 1,-0.2 -3,-0.1 -0.358 360.0 360.0-155.0 59.0 18.5 17.2 58.6 54 260 A D 0 0 141 -13,-0.0 -1,-0.2 68,-0.0 68,-0.0 0.553 360.0 360.0 -13.4 360.0 21.9 15.5 58.9 55 ! 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 56 276 A E > 0 0 138 0, 0.0 4,-2.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -37.8 4.4 18.0 50.0 57 277 A V H > + 0 0 39 2,-0.3 4,-3.5 1,-0.2 5,-0.4 0.967 360.0 50.5 -76.2 -55.0 6.5 15.3 51.8 58 278 A A H > S+ 0 0 3 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.739 115.3 49.7 -49.0 -25.6 5.6 12.4 49.6 59 279 A I H > S+ 0 0 26 2,-0.2 4,-2.1 3,-0.1 5,-0.3 0.931 108.9 48.8 -81.7 -47.5 6.6 14.9 47.0 60 280 A R H X S+ 0 0 126 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.923 114.3 46.4 -51.3 -50.5 9.9 15.8 48.7 61 281 A I H X S+ 0 0 15 -4,-3.5 4,-2.4 1,-0.2 -1,-0.2 0.860 110.7 52.9 -61.0 -37.8 10.9 12.2 49.1 62 282 A F H X S+ 0 0 5 -4,-0.8 4,-0.9 -5,-0.4 -1,-0.2 0.854 111.7 43.2 -76.0 -33.4 10.0 11.3 45.6 63 283 A Q H X S+ 0 0 65 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.828 108.3 61.1 -76.3 -32.4 12.1 14.1 44.1 64 284 A G H >X S+ 0 0 36 -4,-2.5 4,-1.7 -5,-0.3 3,-0.7 0.952 103.6 50.5 -51.1 -49.8 14.8 13.1 46.6 65 285 A C H 3X S+ 0 0 44 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.803 107.7 53.9 -56.4 -34.3 14.6 9.7 44.8 66 286 A Q H 3X S+ 0 0 12 -4,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.770 105.5 51.3 -75.4 -26.7 15.0 11.5 41.5 67 287 A F H < S+ 0 0 0 -4,-2.4 3,-1.3 1,-0.2 4,-0.3 0.926 105.1 56.9 -65.8 -42.0 31.8 2.9 35.2 80 300 A A H >< S+ 0 0 0 -4,-2.9 3,-2.5 1,-0.3 -1,-0.2 0.891 95.8 66.2 -56.7 -41.2 30.6 2.1 31.7 81 301 A K H 3< S+ 0 0 141 -4,-1.7 6,-0.4 1,-0.3 -1,-0.3 0.854 98.9 53.5 -48.3 -37.1 33.6 4.0 30.3 82 302 A S T << S+ 0 0 31 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.505 77.6 110.3 -79.9 -5.8 35.8 1.3 31.8 83 303 A I S X S- 0 0 2 -3,-2.5 3,-2.4 -4,-0.3 4,-0.4 -0.620 82.2-113.5 -77.0 113.3 34.0 -1.7 30.2 84 304 A P T 3 S+ 0 0 68 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.199 99.6 13.6 -50.7 119.4 36.5 -2.9 27.7 85 305 A G T >> S+ 0 0 23 -4,-0.2 3,-1.5 4,-0.0 4,-0.5 -0.170 98.7 100.8 109.0 -34.3 35.0 -2.3 24.2 86 306 A F G X4 S+ 0 0 4 -3,-2.4 3,-1.7 1,-0.3 -5,-0.1 0.868 80.1 47.9 -54.7 -52.0 32.2 0.1 25.3 87 307 A V G 34 S+ 0 0 76 -4,-0.4 -1,-0.3 -6,-0.4 4,-0.1 0.574 107.4 62.1 -71.2 -6.0 33.7 3.4 24.3 88 308 A N G <4 S+ 0 0 135 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.565 84.2 100.6 -90.5 -13.5 34.6 1.8 21.0 89 309 A L S << S- 0 0 14 -3,-1.7 2,-0.2 -4,-0.5 5,-0.0 -0.332 95.7 -84.8 -66.1 154.2 30.9 1.2 20.2 90 310 A D >> - 0 0 56 1,-0.1 4,-2.1 92,-0.1 3,-1.2 -0.452 45.1-128.4 -46.7 125.7 29.1 3.5 17.8 91 311 A L H 3> S+ 0 0 117 1,-0.3 4,-2.8 2,-0.3 5,-0.2 0.771 107.0 63.5 -69.6 -21.6 28.0 6.2 20.2 92 312 A N H 3> S+ 0 0 100 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.906 110.9 42.7 -56.6 -38.1 24.4 6.1 19.2 93 313 A D H <> S+ 0 0 1 -3,-1.2 4,-2.4 2,-0.2 -2,-0.3 0.876 107.9 56.9 -77.0 -39.2 24.7 2.6 20.7 94 314 A Q H X S+ 0 0 38 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.931 111.7 46.3 -50.1 -44.7 26.7 3.8 23.6 95 315 A V H X S+ 0 0 84 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.903 110.8 49.8 -68.5 -43.6 23.7 6.1 24.3 96 316 A T H X S+ 0 0 23 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.862 109.0 52.4 -62.2 -39.9 21.0 3.4 23.8 97 317 A L H X S+ 0 0 0 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.849 111.0 46.4 -68.4 -37.2 22.8 1.0 26.2 98 318 A L H X S+ 0 0 35 -4,-1.4 4,-2.7 -5,-0.2 -1,-0.2 0.887 110.4 54.8 -68.6 -41.7 23.0 3.5 28.9 99 319 A K H < S+ 0 0 31 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.898 118.1 32.5 -59.1 -48.0 19.4 4.6 28.4 100 320 A Y H < S+ 0 0 24 -4,-2.2 4,-0.3 1,-0.1 -1,-0.2 0.493 122.8 52.6 -87.7 -7.0 18.0 1.0 28.8 101 321 A G H X S+ 0 0 1 -4,-0.5 4,-1.9 -5,-0.2 3,-0.2 0.853 87.0 71.0 -97.2 -42.2 20.7 0.1 31.3 102 322 A V H X S+ 0 0 2 -4,-2.7 4,-3.3 1,-0.2 5,-0.2 0.830 98.7 48.4 -57.3 -40.3 20.8 2.7 34.1 103 323 A H H > S+ 0 0 6 -4,-0.4 4,-2.8 2,-0.2 5,-0.3 0.937 108.5 53.3 -67.4 -41.9 17.5 1.7 35.8 104 324 A E H > S+ 0 0 1 -4,-0.3 4,-1.7 -3,-0.2 -1,-0.2 0.917 115.8 42.7 -56.2 -37.9 18.3 -2.0 35.9 105 325 A I H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.909 109.2 56.0 -77.8 -39.6 21.6 -1.0 37.5 106 326 A I H X S+ 0 0 19 -4,-3.3 4,-2.8 -5,-0.2 -2,-0.2 0.961 112.5 43.1 -52.3 -51.8 20.1 1.6 39.9 107 327 A Y H X S+ 0 0 16 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.869 111.0 54.9 -69.9 -34.3 17.7 -1.1 41.3 108 328 A T H X S+ 0 0 0 -4,-1.7 4,-0.8 -5,-0.3 -1,-0.2 0.949 115.7 38.7 -57.4 -47.0 20.4 -3.8 41.4 109 329 A M H X S+ 0 0 28 -4,-2.6 4,-0.6 1,-0.2 3,-0.4 0.836 106.3 63.5 -81.2 -29.6 22.6 -1.5 43.5 110 330 A L H >< S+ 0 0 37 -4,-2.8 3,-1.4 -5,-0.3 4,-0.4 0.860 96.7 61.9 -53.7 -37.2 19.7 -0.1 45.5 111 331 A A H >< S+ 0 0 1 -4,-1.5 3,-1.9 1,-0.3 -1,-0.2 0.913 95.5 59.3 -56.1 -43.3 19.3 -3.8 46.7 112 332 A S H 3< S+ 0 0 3 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.709 106.5 48.4 -53.2 -24.9 22.8 -3.5 48.3 113 333 A L T << S+ 0 0 30 -3,-1.4 7,-2.2 -4,-0.6 2,-0.3 0.454 103.4 84.7 -98.7 -3.3 21.5 -0.6 50.4 114 334 A M E < +B 119 0A 1 -3,-1.9 2,-0.3 -4,-0.4 5,-0.2 -0.732 43.1 173.0-108.9 146.2 18.3 -2.4 51.5 115 335 A N E > -B 118 0A 40 3,-2.4 3,-1.0 -2,-0.3 37,-0.1 -0.831 56.7 -82.4-125.8 178.6 17.1 -4.8 54.2 116 336 A K T 3 S+ 0 0 117 -2,-0.3 3,-0.1 1,-0.2 36,-0.1 0.744 128.0 43.4 -40.1 -34.1 13.7 -6.1 55.1 117 337 A D T 3 S- 0 0 106 1,-0.2 13,-3.2 13,-0.1 14,-0.5 0.617 121.2 -50.1 -99.2 -18.0 13.1 -3.0 57.2 118 338 A G E < -BC 115 129A 0 -3,-1.0 -3,-2.4 11,-0.3 2,-0.4 -0.988 51.8 -79.9 165.4-174.5 14.4 -0.2 55.0 119 339 A V E -BC 114 128A 7 9,-2.6 9,-3.1 -2,-0.3 -5,-0.2 -0.938 31.6-118.6-130.0 138.6 16.9 1.5 52.8 120 340 A L E - C 0 127A 4 -7,-2.2 2,-0.3 -2,-0.4 7,-0.3 -0.402 35.8-176.6 -66.9 146.2 20.1 3.5 53.4 121 341 A I E >> + C 0 126A 53 5,-3.1 5,-2.1 1,-0.2 4,-1.3 -0.899 50.0 30.8-139.9 172.0 20.2 7.1 52.1 122 342 A S T >45S- 0 0 47 -2,-0.3 3,-1.4 1,-0.3 -1,-0.2 0.919 135.8 -42.9 44.3 64.5 22.6 10.1 51.7 123 343 A E T 345S- 0 0 147 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.825 112.3 -56.0 49.8 38.0 25.7 8.0 51.4 124 344 A G T 345S+ 0 0 4 -3,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.679 114.9 113.8 75.5 16.0 24.6 5.7 54.2 125 345 A Q T <<5S+ 0 0 95 -3,-1.4 -84,-2.4 -4,-1.3 2,-0.3 0.770 76.5 38.2 -88.0 -28.2 24.1 8.5 56.7 126 346 A G E < -aC 41 121A 1 -5,-2.1 -5,-3.1 -86,-0.3 2,-0.4 -0.811 66.0-155.0-118.7 163.1 20.4 8.1 56.8 127 347 A F E -aC 42 120A 24 -86,-2.2 -84,-2.9 -2,-0.3 2,-0.5 -0.977 7.4-157.5-140.2 118.7 18.1 5.1 56.8 128 348 A M E -aC 43 119A 18 -9,-3.1 -9,-2.6 -2,-0.4 -84,-0.2 -0.882 21.2-125.4-102.3 128.5 14.5 5.3 55.7 129 349 A T E > - C 0 118A 15 -86,-2.3 4,-1.8 -2,-0.5 -11,-0.3 -0.405 6.5-132.8 -74.5 146.1 12.1 2.7 57.0 130 350 A R H > S+ 0 0 27 -13,-3.2 4,-2.6 2,-0.2 -12,-0.2 0.840 107.4 53.2 -61.3 -39.0 9.9 0.6 54.7 131 351 A E H 4 S+ 0 0 150 -14,-0.5 4,-0.2 1,-0.2 -1,-0.2 0.912 106.5 53.2 -65.8 -42.5 6.8 1.2 56.7 132 352 A F H >4 S+ 0 0 4 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.923 111.5 44.9 -56.6 -44.8 7.3 4.9 56.5 133 353 A L H >< S+ 0 0 7 -4,-1.8 3,-1.5 1,-0.3 10,-0.2 0.891 108.2 56.2 -71.8 -39.2 7.6 4.6 52.7 134 354 A K T 3< S+ 0 0 116 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.518 102.8 63.4 -58.4 -7.4 4.5 2.3 52.5 135 355 A S T < S+ 0 0 64 -3,-1.2 -1,-0.2 -4,-0.2 -2,-0.2 0.332 72.2 111.0-111.6 6.1 2.8 5.2 54.3 136 356 A L S < S- 0 0 11 -3,-1.5 2,-0.2 4,-0.3 5,-0.1 -0.372 80.5 -91.5 -70.3 160.7 3.0 8.0 51.8 137 357 A R > - 0 0 117 3,-0.1 3,-2.4 1,-0.1 4,-0.3 -0.564 66.3 -53.7 -79.3 140.1 -0.3 8.9 50.2 138 358 A K T 3 S+ 0 0 187 1,-0.4 -1,-0.1 2,-0.3 -3,-0.0 -0.179 125.8 25.0 -38.2 134.3 -1.5 7.3 47.0 139 359 A P T > S+ 0 0 12 0, 0.0 3,-0.7 0, 0.0 -1,-0.4 -0.972 128.7 46.3 -91.4 4.6 0.1 7.1 44.5 140 360 A F G X S+ 0 0 0 -3,-2.4 3,-1.2 1,-0.2 4,-0.3 0.638 91.0 87.1 -82.7 -12.4 3.4 7.4 46.4 141 361 A G G 3 S+ 0 0 14 -4,-0.3 -5,-0.2 1,-0.2 -1,-0.2 0.808 100.1 27.7 -53.2 -35.6 2.3 4.9 48.9 142 362 A D G < S+ 0 0 102 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.1 0.064 83.0 106.6-123.7 30.4 3.5 1.9 46.8 143 363 A F S < S+ 0 0 10 -3,-1.2 4,-0.3 -10,-0.2 -1,-0.1 0.769 88.5 38.6 -82.0 -19.8 6.4 3.2 44.7 144 364 A M S > S+ 0 0 15 -4,-0.3 4,-1.9 -3,-0.2 3,-0.4 0.742 90.5 84.1-100.0 -27.3 9.1 1.4 46.7 145 365 A E H > S+ 0 0 27 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.790 89.2 54.0 -51.9 -42.5 7.6 -2.0 47.7 146 366 A P H > S+ 0 0 30 0, 0.0 4,-2.7 0, 0.0 -1,-0.3 0.953 108.4 51.0 -52.3 -53.5 8.5 -3.7 44.3 147 367 A K H > S+ 0 0 9 -3,-0.4 4,-2.9 -4,-0.3 -2,-0.2 0.887 113.2 45.7 -51.3 -45.8 12.1 -2.6 45.0 148 368 A F H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.902 109.2 53.1 -65.0 -45.5 12.0 -4.1 48.4 149 369 A E H X S+ 0 0 111 -4,-3.0 4,-1.4 1,-0.2 -2,-0.2 0.918 116.4 41.3 -59.7 -42.3 10.3 -7.4 47.3 150 370 A F H X S+ 0 0 12 -4,-2.7 4,-3.6 2,-0.2 5,-0.3 0.927 109.5 56.9 -64.4 -50.8 13.1 -7.8 44.8 151 371 A A H X S+ 0 0 2 -4,-2.9 4,-3.0 -5,-0.2 5,-0.2 0.891 106.0 53.0 -54.0 -37.9 15.9 -6.6 47.1 152 372 A V H < S+ 0 0 59 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.932 113.9 39.9 -66.6 -47.6 14.9 -9.4 49.5 153 373 A K H >< S+ 0 0 73 -4,-1.4 3,-1.4 -5,-0.2 4,-0.5 0.967 117.9 50.6 -61.3 -51.5 15.1 -12.1 46.9 154 374 A F H >< S+ 0 0 1 -4,-3.6 3,-2.2 1,-0.3 5,-0.4 0.894 105.6 52.3 -54.5 -49.5 18.2 -10.6 45.4 155 375 A N G >< S+ 0 0 29 -4,-3.0 3,-0.9 1,-0.3 -1,-0.3 0.651 93.9 75.0 -68.1 -11.8 20.2 -10.3 48.6 156 376 A A G < S+ 0 0 69 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.770 84.3 65.4 -68.3 -27.8 19.4 -13.9 49.2 157 377 A L G < S- 0 0 28 -3,-2.2 -1,-0.2 -4,-0.5 -2,-0.2 0.787 97.7-144.5 -59.6 -28.1 22.0 -14.6 46.5 158 378 A E < + 0 0 146 -3,-0.9 -3,-0.1 -4,-0.4 2,-0.1 0.852 33.6 170.9 59.9 39.4 24.6 -13.2 48.9 159 379 A L - 0 0 2 -5,-0.4 2,-0.2 4,-0.1 -1,-0.2 -0.437 18.1-148.8 -72.8 150.8 26.6 -11.6 46.1 160 380 A D >> - 0 0 64 -2,-0.1 4,-2.5 1,-0.0 3,-1.4 -0.687 33.3 -84.5-117.3 179.0 29.4 -9.3 47.0 161 381 A D H 3> S+ 0 0 8 1,-0.3 4,-2.5 -2,-0.2 5,-0.1 0.814 125.4 53.3 -49.1 -41.9 30.9 -6.3 45.3 162 382 A S H 3> S+ 0 0 25 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.806 112.7 44.7 -69.1 -28.6 33.2 -8.3 43.2 163 383 A D H <> S+ 0 0 0 -3,-1.4 4,-2.1 2,-0.2 3,-0.3 0.891 112.2 52.8 -73.2 -44.6 30.3 -10.4 41.8 164 384 A L H X S+ 0 0 1 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.900 99.8 62.7 -60.4 -42.2 28.1 -7.3 41.3 165 385 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.888 109.5 39.1 -49.3 -49.8 30.8 -5.5 39.3 166 386 A I H >X S+ 0 0 0 -4,-0.7 4,-1.9 -3,-0.3 3,-0.6 0.931 113.4 56.6 -70.4 -42.7 30.7 -8.0 36.5 167 387 A F H 3X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.3 -2,-0.2 0.903 105.5 49.4 -56.0 -45.4 27.0 -8.5 36.8 168 388 A I H 3X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -1,-0.3 0.785 108.1 54.9 -68.7 -23.0 26.3 -4.8 36.1 169 389 A A H - 0 0 4 -2,-2.6 3,-1.1 -3,-0.4 13,-0.1 -0.813 36.8-162.8 -95.1 116.5 22.8 -6.1 26.3 175 395 A G T 3 S+ 0 0 5 -2,-0.7 -1,-0.1 1,-0.2 12,-0.1 0.329 84.6 71.0 -78.0 10.1 22.5 -6.7 22.5 176 396 A D T 3 + 0 0 32 2,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.557 66.1 123.0-103.1 -12.0 18.7 -6.9 23.0 177 397 A R S X S- 0 0 3 -3,-1.1 3,-1.0 1,-0.1 2,-0.2 -0.208 72.9 -98.1 -51.5 139.3 18.1 -3.2 23.6 178 398 A P T 3 S+ 0 0 60 0, 0.0 -1,-0.1 0, 0.0 -78,-0.1 -0.459 100.6 13.9 -55.9 120.0 15.6 -1.5 21.2 179 399 A G T 3 S+ 0 0 63 1,-0.3 2,-0.2 -2,-0.2 -83,-0.1 0.652 76.4 153.4 89.2 17.4 17.2 0.4 18.4 180 400 A L < - 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