==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 31-AUG-98 1BSX . COMPND 2 MOLECULE: PROTEIN (THYROID HORMONE RECEPTOR BETA); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.L.WAGNER,B.D.DARIMONT,J.W.APRILETTI,M.R.STALLCUP, . 510 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24781.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 400 78.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 2.4 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 20 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 17.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 272 53.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 2 0 2 4 2 0 0 0 2 4 0 0 2 0 0 0 0 2 2 0 0 0 0 0 2 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 211 A K 0 0 108 0, 0.0 193,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.9 52.9 24.6 37.0 2 212 A P - 0 0 84 0, 0.0 189,-0.2 0, 0.0 190,-0.1 -0.212 360.0-167.8 -53.6 149.2 51.0 23.4 40.1 3 213 A E - 0 0 105 1,-0.2 186,-0.1 188,-0.1 185,-0.1 -0.569 24.9 -59.7-126.7-174.5 47.7 21.5 39.6 4 214 A P - 0 0 23 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.034 38.6-124.9 -70.1 167.7 44.6 20.2 41.6 5 215 A T > - 0 0 63 1,-0.1 4,-3.3 0, 0.0 5,-0.4 -0.859 32.5-106.1-113.6 149.2 44.1 17.9 44.5 6 216 A D H > S+ 0 0 145 -2,-0.3 4,-1.1 1,-0.2 -1,-0.1 0.794 126.2 46.9 -42.8 -30.4 41.9 14.8 44.6 7 217 A E H > S+ 0 0 70 2,-0.2 4,-1.7 1,-0.1 -1,-0.2 0.939 111.8 46.1 -79.3 -49.8 39.7 17.0 46.8 8 218 A E H > S+ 0 0 27 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.877 109.3 56.9 -61.0 -38.8 39.7 20.2 44.7 9 219 A W H X S+ 0 0 103 -4,-3.3 4,-2.7 1,-0.2 -1,-0.2 0.942 105.4 50.7 -55.6 -46.9 39.1 18.1 41.6 10 220 A E H X S+ 0 0 129 -4,-1.1 4,-1.1 -5,-0.4 -1,-0.2 0.867 107.3 54.5 -58.7 -36.8 36.0 16.8 43.3 11 221 A L H >X S+ 0 0 27 -4,-1.7 4,-1.6 2,-0.2 3,-1.1 0.974 109.3 47.5 -61.0 -53.7 35.1 20.4 44.0 12 222 A I H 3X S+ 0 0 3 -4,-2.9 4,-2.5 1,-0.3 5,-0.3 0.962 104.0 58.6 -48.8 -64.0 35.3 21.2 40.3 13 223 A K H 3X S+ 0 0 162 -4,-2.7 4,-1.8 1,-0.2 -1,-0.3 0.759 110.3 49.0 -38.0 -31.5 33.3 18.1 39.2 14 224 A T H X S+ 0 0 1 -4,-2.2 4,-1.2 2,-0.2 3,-1.0 0.995 110.6 42.7 -70.0 -75.5 25.9 22.7 38.3 19 229 A H H 3< S+ 0 0 4 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.766 116.5 52.4 -42.9 -32.6 26.7 25.2 35.5 20 230 A V H >< S+ 0 0 59 -4,-3.0 3,-0.9 -5,-0.2 -1,-0.3 0.878 109.3 44.8 -76.3 -38.6 26.0 22.5 33.0 21 231 A A H << S+ 0 0 74 -4,-1.4 -1,-0.2 -3,-1.0 -2,-0.2 0.531 120.1 45.4 -81.0 -4.6 22.6 21.4 34.2 22 232 A T T 3< S+ 0 0 4 -4,-1.2 2,-0.6 -3,-0.1 -1,-0.2 0.130 89.5 95.1-122.4 17.4 21.8 25.1 34.5 23 233 A N S X S- 0 0 21 -3,-0.9 3,-1.6 -5,-0.2 4,-0.0 -0.962 83.1-109.5-113.8 119.8 23.1 26.5 31.2 24 234 A A T 3 S- 0 0 12 -2,-0.6 5,-0.1 1,-0.3 -2,-0.1 -0.146 88.0 -11.3 -54.0 133.7 20.5 26.7 28.5 25 235 A Q T > S- 0 0 63 2,-0.1 3,-1.2 3,-0.1 -1,-0.3 0.499 92.1-136.5 56.7 6.6 20.6 24.3 25.6 26 236 A G T < - 0 0 25 -3,-1.6 2,-0.7 1,-0.2 3,-0.5 -0.055 65.2 -25.8 46.7-142.8 24.1 23.1 26.6 27 237 A S T 3 S+ 0 0 107 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 -0.415 129.2 76.5 -99.7 56.0 26.5 22.8 23.8 28 238 A H < + 0 0 146 -3,-1.2 3,-0.3 -2,-0.7 -1,-0.2 -0.161 65.8 110.1-149.3 26.3 23.7 22.2 21.3 29 239 A W >> + 0 0 36 -3,-0.5 3,-3.4 1,-0.2 4,-1.2 0.968 54.4 68.8 -76.4 -58.5 22.9 25.9 21.3 30 240 A K T 34 S+ 0 0 137 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.640 99.3 60.6 -39.8 -14.5 23.9 27.2 17.9 31 241 A Q T 34 S+ 0 0 76 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.282 106.7 40.0-100.7 10.6 20.9 25.0 16.6 32 242 A K T <4 S+ 0 0 96 -3,-3.4 2,-0.2 83,-0.2 -2,-0.2 0.311 83.8 126.5-129.0 -9.4 18.2 26.7 18.6 33 243 A R < - 0 0 45 -4,-1.2 2,-0.5 84,-0.1 84,-0.2 -0.377 38.7-174.5 -56.9 114.0 19.7 30.2 18.0 34 244 A K E -a 117 0A 127 82,-3.7 84,-0.9 -2,-0.2 -1,-0.1 -0.885 21.6-131.9-120.5 98.4 16.8 32.2 16.5 35 245 A F E -a 118 0A 113 -2,-0.5 84,-0.2 82,-0.2 3,-0.1 -0.193 21.6-115.6 -54.5 129.5 18.0 35.7 15.3 36 246 A L - 0 0 19 82,-2.0 -1,-0.1 1,-0.1 87,-0.1 -0.335 44.8 -88.5 -65.0 141.4 15.9 38.6 16.4 37 247 A P > - 0 0 64 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.188 30.6-122.7 -53.2 144.2 14.2 40.5 13.6 38 248 A E T 3 S+ 0 0 188 1,-0.2 -2,-0.1 -3,-0.1 85,-0.1 0.815 106.2 61.9 -57.9 -32.9 16.3 43.3 12.0 39 249 A D T 3 S+ 0 0 106 1,-0.1 2,-1.3 3,-0.0 -1,-0.2 0.614 74.8 95.1 -73.1 -17.6 13.5 45.8 12.8 40 250 A I S < S+ 0 0 6 -3,-1.3 87,-0.1 1,-0.2 -1,-0.1 -0.630 95.4 13.2 -84.4 98.5 13.4 45.5 16.5 41 251 A G S S+ 0 0 13 -2,-1.3 -1,-0.2 85,-0.1 82,-0.2 0.682 88.0 132.5 105.6 93.3 15.6 48.4 17.7 42 252 A Q + 0 0 71 -3,-0.1 -2,-0.1 80,-0.1 -3,-0.0 0.157 46.2 5.9-133.1-115.8 16.5 51.0 15.1 43 253 A A 0 0 101 1,-0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.647 360.0 360.0 -93.2 83.4 16.8 54.7 14.2 44 254 A P 0 0 139 0, 0.0 -1,-0.0 0, 0.0 4,-0.0 -0.634 360.0 360.0 -81.5 360.0 16.1 57.2 17.1 45 ! 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 46 263 A K 0 0 117 0, 0.0 82,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-164.7 16.6 56.8 24.5 47 264 A V - 0 0 21 181,-0.1 80,-0.1 80,-0.1 81,-0.1 -0.115 360.0-138.8-111.6-148.1 15.0 53.3 24.8 48 265 A D >> - 0 0 47 79,-0.2 3,-1.9 -2,-0.1 4,-1.9 -0.289 10.9-164.4-179.6 77.4 13.0 51.1 22.4 49 266 A L H 3> S+ 0 0 72 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.752 84.3 65.3 -43.4 -38.0 10.2 49.4 24.3 50 267 A E H 3> S+ 0 0 101 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.888 114.3 35.8 -57.6 -32.9 9.5 46.7 21.6 51 268 A A H <> S+ 0 0 0 -3,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.962 109.7 59.1 -79.8 -60.7 13.0 45.4 22.4 52 269 A F H X S+ 0 0 5 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.818 112.4 46.8 -36.8 -37.9 13.0 46.1 26.1 53 270 A S H X S+ 0 0 41 -4,-2.3 4,-2.3 -5,-0.2 5,-0.3 0.996 104.7 53.5 -70.4 -67.4 10.0 43.8 26.1 54 271 A H H < S+ 0 0 72 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.726 114.7 49.2 -40.4 -23.8 11.3 41.0 23.9 55 272 A F H >X S+ 0 0 25 -4,-2.2 3,-2.0 2,-0.1 4,-1.4 0.951 111.8 41.3 -83.2 -57.0 14.1 41.0 26.4 56 273 A T H 3< S+ 0 0 9 -4,-2.3 4,-0.4 1,-0.3 -2,-0.2 0.612 99.2 78.3 -67.9 -8.6 12.3 40.9 29.7 57 274 A K T 3< S+ 0 0 70 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.1 0.686 112.5 21.4 -71.7 -15.5 9.9 38.4 28.2 58 275 A I T <> S+ 0 0 32 -3,-2.0 4,-0.7 -5,-0.3 -2,-0.2 0.519 97.7 93.1-124.6 -15.5 12.6 35.8 28.8 59 276 A I H X S+ 0 0 32 -4,-1.4 4,-1.5 1,-0.2 -3,-0.1 0.670 80.0 66.5 -55.9 -17.4 14.7 37.4 31.6 60 277 A T H >> S+ 0 0 47 -4,-0.4 4,-1.9 1,-0.2 3,-0.6 0.995 100.3 41.4 -71.4 -60.4 12.6 35.5 34.1 61 278 A P H 3> S+ 0 0 56 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.556 111.0 64.1 -64.0 -6.5 13.6 31.9 33.4 62 279 A A H 3X S+ 0 0 13 -4,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.920 102.1 44.0 -82.1 -47.8 17.1 33.2 33.1 63 280 A I H < S+ 0 0 0 -4,-2.9 3,-0.9 -5,-0.2 4,-0.3 0.959 108.3 43.9 -67.1 -51.4 23.0 27.0 39.7 70 287 A A H >< S+ 0 0 1 -4,-2.0 3,-1.4 1,-0.2 7,-0.2 0.827 106.5 63.9 -63.8 -29.2 23.8 28.4 43.1 71 288 A K H 3< S+ 0 0 46 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.821 97.5 55.3 -65.0 -28.4 21.4 25.9 44.6 72 289 A K T << S+ 0 0 112 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.506 89.3 91.4 -82.0 -3.2 23.6 23.0 43.4 73 290 A L X> - 0 0 1 -3,-1.4 4,-1.5 -4,-0.3 3,-1.1 -0.831 64.6-158.1 -94.0 115.4 26.6 24.5 45.2 74 291 A P H 3> S+ 0 0 79 0, 0.0 4,-1.3 0, 0.0 3,-0.3 0.963 91.1 59.9 -55.7 -55.1 26.9 23.0 48.7 75 292 A M H 34 S+ 0 0 31 1,-0.2 103,-0.1 2,-0.2 -5,-0.0 0.702 105.8 54.4 -48.1 -18.3 29.0 25.9 50.0 76 293 A F H X4 S+ 0 0 0 -3,-1.1 3,-1.2 -6,-0.2 -1,-0.2 0.936 102.9 50.1 -82.1 -51.8 26.0 28.0 49.1 77 294 A C H 3< S+ 0 0 67 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.629 97.3 72.5 -63.5 -11.5 23.3 26.1 51.0 78 295 A E T 3< S+ 0 0 122 -4,-1.3 -1,-0.3 2,-0.1 -2,-0.1 0.068 89.2 83.5 -88.7 22.7 25.6 26.3 54.1 79 296 A L S < S- 0 0 13 -3,-1.2 2,-0.1 1,-0.1 -3,-0.0 -0.780 91.9 -88.5-122.3 162.9 24.7 30.0 54.2 80 297 A P > - 0 0 40 0, 0.0 4,-3.0 0, 0.0 3,-0.4 -0.410 33.2-119.4 -69.9 149.8 21.7 31.9 55.7 81 298 A C H > S+ 0 0 55 1,-0.2 4,-0.6 2,-0.2 5,-0.1 0.743 115.5 58.9 -64.3 -18.0 18.5 32.4 53.6 82 299 A E H > S+ 0 0 133 2,-0.2 4,-1.6 1,-0.1 -1,-0.2 0.894 112.0 37.0 -76.5 -39.7 19.1 36.1 54.0 83 300 A D H > S+ 0 0 1 -3,-0.4 4,-2.7 2,-0.2 5,-0.3 0.909 104.8 66.5 -77.9 -43.4 22.6 36.0 52.5 84 301 A Q H X S+ 0 0 26 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.815 108.5 45.0 -45.7 -29.8 21.8 33.4 49.9 85 302 A I H X S+ 0 0 13 -4,-0.6 4,-2.8 -5,-0.3 5,-0.3 0.972 105.2 56.0 -77.9 -59.8 19.7 36.2 48.5 86 303 A I H X S+ 0 0 31 -4,-1.6 4,-1.9 1,-0.3 -2,-0.2 0.849 111.9 48.2 -37.5 -46.2 22.1 39.1 48.9 87 304 A L H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.4 0.976 110.2 48.3 -62.0 -58.5 24.4 37.0 46.7 88 305 A L H X S+ 0 0 7 -4,-1.6 4,-2.2 -5,-0.3 -2,-0.2 0.946 112.3 50.7 -47.5 -54.5 21.9 36.1 44.1 89 306 A K H < S+ 0 0 69 -4,-2.8 4,-0.4 1,-0.2 -1,-0.2 0.843 116.3 40.0 -53.0 -41.2 20.9 39.8 43.8 90 307 A G H X S+ 0 0 26 -4,-1.9 4,-0.5 -5,-0.3 -1,-0.2 0.913 124.6 33.5 -77.9 -44.2 24.4 41.0 43.4 91 308 A C H X S+ 0 0 0 -4,-3.0 4,-3.3 -5,-0.2 5,-0.3 0.498 92.4 93.3 -91.7 -4.6 25.8 38.4 41.1 92 309 A C H X S+ 0 0 2 -4,-2.2 4,-2.2 -5,-0.4 -1,-0.2 0.942 94.2 35.7 -55.9 -53.1 22.7 37.6 39.1 93 310 A M H > S+ 0 0 17 -4,-0.4 4,-2.6 2,-0.2 5,-0.4 0.965 116.4 56.7 -62.9 -48.7 23.4 40.0 36.3 94 311 A E H X S+ 0 0 7 -4,-0.5 4,-1.5 1,-0.2 -2,-0.2 0.897 111.7 41.4 -48.6 -50.0 27.1 39.3 36.6 95 312 A I H X S+ 0 0 1 -4,-3.3 4,-2.1 2,-0.2 -1,-0.2 0.877 115.8 51.1 -69.3 -36.8 26.6 35.5 36.0 96 313 A M H X S+ 0 0 26 -4,-2.2 4,-1.0 -5,-0.3 -2,-0.2 0.994 111.0 44.2 -63.4 -63.1 24.0 36.1 33.3 97 314 A S H X S+ 0 0 5 -4,-2.6 4,-2.7 1,-0.2 3,-0.4 0.822 111.8 55.7 -52.5 -34.8 25.9 38.5 31.1 98 315 A L H X S+ 0 0 1 -4,-1.5 4,-2.4 -5,-0.4 5,-0.3 0.996 105.0 52.7 -58.0 -58.7 29.0 36.2 31.5 99 316 A R H < S+ 0 0 16 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.666 112.2 46.4 -48.1 -24.4 27.0 33.3 30.2 100 317 A A H >< S+ 0 0 14 -4,-1.0 3,-2.4 -3,-0.4 12,-0.4 0.895 107.5 52.6 -87.8 -48.2 26.0 35.4 27.2 101 318 A A H >< S+ 0 0 2 -4,-2.7 3,-1.9 1,-0.3 -2,-0.2 0.920 101.0 62.0 -52.5 -46.4 29.5 36.8 26.3 102 319 A V T 3< S+ 0 0 51 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.1 0.536 103.7 55.5 -59.0 -3.2 30.9 33.2 26.3 103 320 A R T < S+ 0 0 14 -3,-2.4 2,-0.6 -5,-0.3 -1,-0.3 -0.114 74.2 130.9-121.7 34.7 28.4 32.8 23.5 104 321 A Y < - 0 0 27 -3,-1.9 7,-0.2 7,-0.2 3,-0.1 -0.818 44.9-152.9 -93.4 117.7 29.4 35.6 21.1 105 322 A D B >> -C 110 0B 27 5,-1.8 4,-2.1 -2,-0.6 5,-1.0 -0.790 3.1-161.9 -87.1 109.2 29.8 34.4 17.5 106 323 A P T 45S+ 0 0 61 0, 0.0 -1,-0.2 0, 0.0 5,-0.0 0.861 85.3 57.9 -64.3 -31.1 32.3 36.8 16.0 107 324 A E T 45S+ 0 0 166 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.988 119.9 26.8 -57.5 -73.7 31.3 35.9 12.4 108 325 A S T 45S- 0 0 48 2,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.730 102.4-137.9 -60.8 -21.0 27.6 36.8 12.8 109 326 A E T <5 + 0 0 129 -4,-2.1 12,-0.5 1,-0.2 2,-0.3 0.979 58.7 122.8 60.2 58.4 28.6 39.3 15.5 110 327 A T B < -C 105 0B 9 -5,-1.0 -5,-1.8 10,-0.2 10,-0.2 -0.990 55.4-135.8-151.7 138.7 25.7 38.4 17.8 111 328 A L E -B 119 0A 2 8,-1.7 8,-0.8 -2,-0.3 2,-0.4 -0.333 20.1-132.9 -84.0 175.7 25.2 37.2 21.3 112 329 A T E > -B 118 0A 1 -12,-0.4 3,-1.1 6,-0.2 6,-0.3 -0.763 18.5-158.2-136.0 89.9 22.8 34.4 22.1 113 330 A L E >> S-B 117 0A 34 4,-2.0 3,-2.2 -2,-0.4 4,-1.7 -0.375 75.5 -6.4 -69.5 142.4 20.6 35.1 25.1 114 331 A N T 34 S- 0 0 30 1,-0.3 -1,-0.3 2,-0.2 4,-0.1 0.615 114.0 -84.1 50.9 13.0 18.9 32.2 26.9 115 332 A G T <4 S+ 0 0 0 -3,-1.1 -1,-0.3 2,-0.2 -83,-0.2 0.546 127.2 69.1 70.5 5.3 20.3 30.0 24.2 116 333 A E T <4 S+ 0 0 67 -3,-2.2 -82,-3.7 1,-0.2 2,-0.5 0.720 85.8 59.5-118.1 -48.9 17.3 30.9 22.0 117 334 A M E < -aB 34 113A 24 -4,-1.7 -4,-2.0 -84,-0.2 2,-0.7 -0.760 60.9-156.9 -95.7 126.4 17.6 34.5 21.0 118 335 A A E -aB 35 112A 1 -84,-0.9 -82,-2.0 -2,-0.5 -6,-0.2 -0.861 21.7-177.7-101.4 111.4 20.5 35.9 19.0 119 336 A V E - 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0 0 0 -2,-2.1 3,-0.9 -3,-0.8 13,-0.1 -0.764 31.1-163.8 -86.1 116.1 31.5 37.9 46.6 164 381 A S T 3 S+ 0 0 18 -2,-0.7 -1,-0.2 1,-0.2 5,-0.1 0.633 80.7 68.8 -74.5 -13.6 32.1 38.6 50.3 165 382 A D T 3 + 0 0 103 2,-0.1 -1,-0.2 7,-0.1 3,-0.1 0.642 63.8 118.7 -83.4 -13.5 31.7 42.3 49.6 166 383 A R S X S- 0 0 29 -3,-0.9 3,-0.7 1,-0.1 2,-0.2 -0.144 72.3-109.5 -49.1 145.5 28.0 42.5 48.8 167 384 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.561 96.7 31.5 -82.3 153.0 26.3 44.7 51.4 168 385 A G T 3 S+ 0 0 70 1,-0.3 -82,-0.1 -2,-0.2 -2,-0.1 0.251 82.6 150.9 88.1 -12.4 24.0 43.3 54.1 169 386 A L < - 0 0 24 -3,-0.7 -1,-0.3 1,-0.1 3,-0.1 -0.098 27.5-171.9 -51.3 150.3 25.9 40.0 54.2 170 387 A A S S+ 0 0 63 1,-0.1 2,-3.0 -3,-0.1 3,-0.2 0.739 75.8 44.6-107.0 -76.4 26.0 38.1 57.4 171 388 A C S > S+ 0 0 42 1,-0.2 4,-1.6 2,-0.1 -1,-0.1 -0.318 71.5 153.1 -71.9 62.5 28.4 35.2 57.3 172 389 A V H >> + 0 0 62 -2,-3.0 3,-1.6 1,-0.2 4,-1.2 0.963 64.3 46.4 -54.2 -84.9 31.1 37.2 55.6 173 390 A E H 3> S+ 0 0 70 1,-0.3 4,-1.6 -3,-0.2 -1,-0.2 0.696 110.5 54.8 -25.9 -48.5 34.4 35.4 56.7 174 391 A R H 3> S+ 0 0 122 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.953 111.5 44.6 -56.9 -51.8 32.9 32.0 55.9 175 392 A I H XX S+ 0 0 0 -4,-1.6 4,-2.6 -3,-1.6 3,-1.2 0.954 103.5 61.0 -57.3 -59.3 32.1 33.1 52.3 176 393 A E H 3X S+ 0 0 87 -4,-1.2 4,-3.6 1,-0.3 -1,-0.2 0.861 108.3 46.3 -37.5 -51.3 35.4 34.9 51.6 177 394 A K H 3X S+ 0 0 137 -4,-1.6 4,-4.2 2,-0.3 -1,-0.3 0.848 107.4 57.5 -63.9 -34.3 37.2 31.5 52.1 178 395 A Y H X S+ 0 0 23 -4,-2.6 4,-3.2 1,-0.2 3,-0.7 0.954 115.0 49.8 -56.8 -49.6 35.6 32.2 47.3 180 397 A D H 3X S+ 0 0 64 -4,-3.6 4,-2.0 -5,-0.3 -2,-0.2 0.895 107.9 56.0 -55.0 -39.1 39.2 31.6 48.2 181 398 A S H 3X S+ 0 0 55 -4,-4.2 4,-1.1 2,-0.2 -1,-0.3 0.828 114.3 38.1 -62.9 -35.8 38.4 27.9 48.1 182 399 A F H X S+ 0 0 23 -4,-2.9 4,-2.0 1,-0.3 3,-0.6 0.958 109.7 51.7 -49.3 -58.1 44.9 25.1 39.4 189 406 A Y H 3X S+ 0 0 19 -4,-3.8 4,-2.0 1,-0.3 -1,-0.3 0.843 107.9 56.5 -48.1 -34.4 42.3 23.8 36.9 190 407 A I H 3X S+ 0 0 8 -4,-2.2 4,-2.6 -3,-0.4 5,-0.3 0.932 102.4 52.3 -64.4 -45.4 43.8 26.5 34.7 191 408 A N H << S+ 0 0 35 -4,-2.2 -2,-0.2 -3,-0.6 -1,-0.2 0.932 108.8 49.6 -58.6 -44.7 47.3 25.2 35.0 192 409 A Y H < S+ 0 0 123 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.913 111.7 50.7 -58.6 -40.6 46.1 21.7 34.0 193 410 A R H < S- 0 0 76 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.883 87.7-169.3 -61.6 -40.1 44.3 23.4 31.1 194 411 A K < - 0 0 174 -4,-2.6 -3,-0.1 -5,-0.1 2,-0.1 0.945 11.9-155.1 40.2 76.0 47.5 25.2 30.1 195 412 A H - 0 0 37 -5,-0.3 2,-1.3 2,-0.1 -1,-0.1 -0.342 21.9-116.2 -72.0 156.7 46.0 27.6 27.6 196 413 A H S S+ 0 0 189 -50,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.585 78.7 113.5 -93.9 68.8 48.2 29.1 24.9 197 414 A V - 0 0 31 -2,-1.3 -2,-0.1 -51,-0.0 -1,-0.0 -0.808 65.8-124.4-147.3 102.9 47.7 32.7 26.2 198 415 A T S S+ 0 0 106 -2,-0.3 -2,-0.0 1,-0.1 -3,-0.0 0.173 88.0 7.8 -35.9 154.5 50.7 34.6 27.6 199 416 A H S S+ 0 0 155 3,-0.1 4,-0.3 4,-0.1 -1,-0.1 0.837 94.9 174.2 30.1 80.4 50.6 36.1 31.1 200 417 A F >> + 0 0 28 2,-0.1 3,-4.5 3,-0.1 4,-0.6 0.842 44.9 38.0 -86.5-104.5 47.3 34.3 31.8 201 418 A W H 3> S+ 0 0 35 1,-0.3 4,-3.3 2,-0.2 5,-0.4 0.674 109.9 63.4 -15.8 -59.0 45.2 33.9 35.0 202 419 A P H 3> S+ 0 0 62 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.852 107.3 46.4 -40.4 -41.3 46.0 37.6 35.9 203 420 A K H <> S+ 0 0 61 -3,-4.5 4,-1.6 -4,-0.3 3,-0.4 0.935 109.2 51.8 -63.9 -52.6 44.1 38.4 32.7 204 421 A L H X S+ 0 0 1 -4,-0.6 4,-1.1 1,-0.3 -1,-0.2 0.880 107.7 54.9 -54.3 -39.2 41.2 36.0 33.5 205 422 A L H >X S+ 0 0 65 -4,-3.3 4,-1.4 1,-0.2 3,-0.5 0.885 100.5 58.4 -62.3 -38.5 41.0 37.7 36.9 206 423 A M H 3X S+ 0 0 109 -4,-1.4 4,-2.8 -5,-0.4 -1,-0.2 0.885 98.9 59.9 -60.2 -35.2 40.6 41.0 35.1 207 424 A K H 3X S+ 0 0 19 -4,-1.6 4,-3.0 1,-0.2 -1,-0.3 0.885 96.8 59.2 -59.9 -37.1 37.6 39.5 33.4 208 425 A V H X S+ 0 0 51 -4,-3.1 4,-2.0 1,-0.2 3,-0.5 0.934 103.1 64.7 -70.1 -41.5 26.4 49.5 35.8 218 435 A H H 3X S+ 0 0 8 -4,-2.8 4,-1.6 1,-0.3 -1,-0.2 0.842 98.2 57.0 -49.1 -38.0 23.5 47.4 35.0 219 436 A A H 3X S+ 0 0 51 -4,-1.7 4,-1.5 2,-0.2 3,-0.5 0.950 104.8 50.1 -59.0 -50.1 21.9 48.5 38.2 220 437 A S H XX S+ 0 0 72 -4,-1.0 4,-1.2 -3,-0.5 3,-1.0 0.972 110.5 49.8 -50.8 -58.2 22.2 52.2 37.2 221 438 A R H 3X S+ 0 0 42 -4,-2.0 4,-2.6 1,-0.3 -1,-0.3 0.787 101.2 66.4 -51.5 -29.4 20.6 51.3 33.8 222 439 A F H 3X S+ 0 0 4 -4,-1.6 4,-1.6 -3,-0.5 -1,-0.3 0.947 97.8 52.1 -59.7 -47.9 17.9 49.6 35.8 223 440 A L H << S+ 0 0 96 -4,-1.5 3,-0.3 -3,-1.0 4,-0.3 0.905 110.5 45.5 -55.3 -49.3 16.7 52.9 37.3 224 441 A H H >X S+ 0 0 95 -4,-1.2 4,-3.2 1,-0.2 3,-3.0 0.956 109.6 57.0 -59.8 -46.2 16.4 54.7 33.9 225 442 A M H 3X S+ 0 0 5 -4,-2.6 4,-0.6 1,-0.3 -1,-0.2 0.825 103.5 53.8 -51.7 -34.1 14.6 51.6 32.7 226 443 A K H 3< S+ 0 0 86 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.479 116.4 39.0 -80.2 -3.8 12.1 52.1 35.5 227 444 A V H <4 S+ 0 0 125 -3,-3.0 -2,-0.2 -4,-0.3 -1,-0.2 0.726 120.5 39.8-111.2 -40.6 11.5 55.7 34.3 228 445 A E H < S+ 0 0 83 -4,-3.2 -3,-0.2 -5,-0.1 -2,-0.2 0.391 114.2 64.0 -90.9 2.6 11.6 55.3 30.5 229 446 A C S < S- 0 0 12 -4,-0.6 2,-0.1 -5,-0.4 5,-0.1 -0.939 88.3 -99.6-132.4 151.7 9.6 52.0 30.7 230 447 A P > - 0 0 41 0, 0.0 3,-2.1 0, 0.0 4,-0.3 -0.401 17.8-140.8 -66.3 133.5 6.1 50.8 31.7 231 448 A T T 3 S+ 0 0 116 1,-0.3 3,-0.2 2,-0.2 -5,-0.0 0.504 103.3 76.0 -71.7 2.6 6.0 49.1 35.1 232 449 A E T 3 S+ 0 0 170 1,-0.2 -1,-0.3 3,-0.0 0, 0.0 0.366 92.7 48.4 -90.6 2.1 3.6 47.0 33.1 233 450 A L S < S+ 0 0 45 -3,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.414 85.1 100.1-120.7 -3.2 6.6 45.3 31.4 234 451 A F - 0 0 14 -4,-0.3 5,-0.1 -3,-0.2 -1,-0.1 -0.713 65.5-144.7 -90.4 92.8 8.7 44.5 34.5 235 452 A P > - 0 0 29 0, 0.0 4,-2.1 0, 0.0 5,-0.2 -0.157 24.4-114.2 -50.5 153.1 8.3 40.8 35.5 236 453 A P H > S+ 0 0 87 0, 0.0 4,-4.4 0, 0.0 5,-0.3 0.968 112.4 48.7 -54.2 -67.2 8.4 40.4 39.3 237 454 A L H > S+ 0 0 5 2,-0.3 4,-3.5 1,-0.3 5,-0.3 0.859 108.4 58.5 -42.2 -42.2 11.6 38.4 39.8 238 455 A F H >> S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 3,-0.5 0.982 116.5 32.9 -51.3 -63.4 13.2 41.0 37.5 239 456 A L H 3X S+ 0 0 52 -4,-2.1 4,-2.4 1,-0.3 -2,-0.3 0.910 114.2 60.0 -57.5 -46.1 12.1 43.6 40.0 240 457 A E H 3< S+ 0 0 35 -4,-4.4 -1,-0.3 -5,-0.2 -2,-0.2 0.893 113.3 39.8 -51.9 -38.8 12.5 41.3 42.9 241 458 A V H << S+ 0 0 4 -4,-3.5 -2,-0.2 -3,-0.5 -1,-0.2 0.980 127.4 26.0 -78.7 -57.4 16.2 41.0 42.0 242 459 A F H < S+ 0 0 33 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.820 97.9 96.1 -78.1 -31.0 17.3 44.4 40.9 243 460 A E < 0 0 66 -4,-2.4 -24,-0.0 -5,-0.4 -20,-0.0 -0.305 360.0 360.0 -59.4 142.7 14.8 46.5 42.9 244 461 A D 0 0 165 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.950 360.0 360.0 -59.2 360.0 16.4 47.6 46.2 245 !* 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 0.0 246 687 X H 0 0 173 0, 0.0 3,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0-167.3 11.9 38.5 49.6 247 688 X K > + 0 0 63 1,-0.2 4,-1.4 2,-0.1 -10,-0.0 -0.633 360.0 13.6 78.4-110.9 9.0 36.9 47.8 248 689 X I H >> S+ 0 0 57 -2,-0.4 4,-1.4 2,-0.2 3,-0.5 0.962 118.5 61.6 -57.1 -65.6 9.7 34.6 44.9 249 690 X L H >> S+ 0 0 3 -3,-0.5 4,-2.4 1,-0.3 3,-0.7 0.854 102.7 53.7 -29.6 -59.2 13.4 34.0 45.3 250 691 X H H >> S+ 0 0 38 1,-0.3 3,-1.4 2,-0.2 4,-0.8 0.970 105.7 54.1 -41.9 -58.6 12.6 32.6 48.6 251 692 X R H XX S+ 0 0 52 -4,-1.4 4,-1.1 -3,-0.5 3,-0.7 0.844 109.8 47.0 -45.7 -39.8 10.2 30.3 46.5 252 693 X L H << S+ 0 0 40 -4,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.769 108.3 54.7 -76.0 -26.9 13.1 29.3 44.2 253 694 X L H << S+ 0 0 31 -4,-2.4 -1,-0.2 -3,-1.4 -2,-0.2 0.493 110.4 47.9 -83.6 -4.3 15.4 28.5 47.1 254 695 X Q H << S+ 0 0 136 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.713 79.7 103.4-112.0 -27.5 12.9 26.2 48.7 255 696 X D < - 0 0 95 -4,-1.1 -3,-0.0 1,-0.1 -4,-0.0 -0.403 44.2-171.4 -62.6 127.6 11.7 23.9 45.9 256 697 X S 0 0 120 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.0 0.922 360.0 360.0 -75.6 -85.6 13.3 20.5 46.1 257 698 X S 0 0 151 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.251 360.0 360.0 66.8 360.0 12.0 19.1 42.8 258 !* 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 0.0 259 211 B K 0 0 109 0, 0.0 193,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.9 -21.3 65.7 40.4 260 212 B P - 0 0 85 0, 0.0 189,-0.2 0, 0.0 190,-0.1 -0.212 360.0-167.8 -53.6 149.2 -23.5 68.9 41.1 261 213 B E - 0 0 104 1,-0.2 186,-0.1 188,-0.1 185,-0.1 -0.570 24.9 -59.7-126.7-174.5 -26.8 69.2 39.2 262 214 B P - 0 0 23 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.034 38.6-124.9 -70.1 167.7 -29.6 71.9 38.4 263 215 B T > - 0 0 65 1,-0.1 4,-3.3 0, 0.0 5,-0.4 -0.859 32.5-106.1-113.5 149.2 -31.9 73.9 40.6 264 216 B D H > S+ 0 0 144 -2,-0.3 4,-1.1 1,-0.3 -1,-0.1 0.794 126.2 46.9 -42.9 -30.4 -35.7 74.0 40.3 265 217 B E H > S+ 0 0 69 2,-0.2 4,-1.7 1,-0.1 -1,-0.3 0.939 111.8 46.1 -79.3 -49.8 -35.1 77.4 38.8 266 218 B E H > S+ 0 0 25 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.877 109.3 56.9 -60.9 -38.8 -32.3 76.5 36.4 267 219 B W H X S+ 0 0 102 -4,-3.3 4,-2.7 1,-0.2 -1,-0.2 0.942 105.4 50.7 -55.5 -46.9 -34.3 73.5 35.3 268 220 B E H X S+ 0 0 125 -4,-1.1 4,-1.1 -5,-0.4 -1,-0.2 0.867 107.3 54.5 -58.7 -36.7 -37.1 75.9 34.4 269 221 B L H >X S+ 0 0 25 -4,-1.7 4,-1.6 2,-0.2 3,-1.1 0.974 109.3 47.5 -61.0 -53.7 -34.5 77.9 32.5 270 222 B I H 3X S+ 0 0 4 -4,-2.9 4,-2.5 1,-0.3 5,-0.3 0.962 104.0 58.6 -48.8 -64.0 -33.6 74.8 30.5 271 223 B K H 3X S+ 0 0 163 -4,-2.7 4,-1.8 1,-0.2 -1,-0.3 0.759 110.3 49.0 -38.0 -31.5 -37.2 73.8 29.8 272 224 B T H X S+ 0 0 1 -4,-2.2 4,-1.2 2,-0.2 3,-1.0 0.994 110.6 42.7 -70.0 -75.5 -37.2 77.4 21.8 277 229 B H H 3< S+ 0 0 3 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.766 116.5 52.4 -42.9 -32.6 -34.5 75.4 19.9 278 230 B V H >< S+ 0 0 63 -4,-3.0 3,-0.9 -5,-0.2 -1,-0.3 0.878 109.3 44.8 -76.3 -38.7 -37.1 72.7 19.3 279 231 B A H << S+ 0 0 74 -4,-1.4 -1,-0.2 -3,-1.0 -2,-0.2 0.531 120.1 45.4 -81.0 -4.5 -39.8 74.8 17.8 280 232 B T T 3< S+ 0 0 4 -4,-1.2 2,-0.6 -3,-0.1 -1,-0.2 0.129 89.5 95.1-122.4 17.3 -37.1 76.6 15.8 281 233 B N S X S- 0 0 19 -3,-0.9 3,-1.6 -5,-0.2 4,-0.0 -0.962 83.1-109.6-113.7 119.7 -35.2 73.5 14.5 282 234 B A T 3 S- 0 0 9 -2,-0.6 5,-0.1 1,-0.3 -2,-0.1 -0.147 88.0 -11.3 -54.0 133.7 -36.3 72.4 11.1 283 235 B Q T > S- 0 0 65 2,-0.1 3,-1.2 3,-0.1 -1,-0.3 0.499 92.1-136.5 56.7 6.6 -38.2 69.1 10.7 284 236 B G T < - 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