==== 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 TRANSCRIPTION RECEPTOR 21-FEB-02 1L2J . COMPND 2 MOLECULE: ESTROGEN RECEPTOR BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.K.SHIAU,D.BARSTAD,J.T.RADEK,M.J.MEYERS,K.W.NETTLES, . 455 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23658.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 357 78.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 12 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 273 60.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 0 0 2 1 2 3 0 2 0 1 1 0 0 1 0 0 2 1 0 0 0 0 2 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 261 A D > 0 0 138 0, 0.0 3,-0.7 0, 0.0 6,-0.2 0.000 360.0 360.0 360.0 4.6 29.2 73.0 24.0 2 262 A A T 3 + 0 0 45 1,-0.3 6,-0.2 5,-0.1 264,-0.0 0.669 360.0 70.3 -75.1 -20.9 27.3 73.2 20.6 3 263 A L T 3 S+ 0 0 49 4,-0.1 -1,-0.3 5,-0.1 166,-0.1 -0.034 74.2 127.1 -85.4 28.6 30.6 73.7 18.9 4 264 A S S <> S- 0 0 46 -3,-0.7 4,-3.0 1,-0.1 5,-0.3 -0.577 73.5-109.9 -83.0 153.5 31.4 70.0 19.7 5 265 A P H > S+ 0 0 40 0, 0.0 4,-3.3 0, 0.0 5,-0.3 0.938 113.4 42.2 -46.1 -70.7 32.4 67.8 16.7 6 266 A E H > S+ 0 0 117 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.872 119.3 46.5 -46.8 -46.3 29.3 65.6 16.4 7 267 A Q H > S+ 0 0 29 2,-0.2 4,-3.1 -6,-0.2 3,-0.4 0.991 114.5 45.2 -61.6 -61.5 27.0 68.5 17.0 8 268 A L H X S+ 0 0 4 -4,-3.0 4,-2.9 1,-0.3 5,-0.3 0.889 111.5 52.1 -49.4 -50.6 28.7 70.9 14.6 9 269 A V H X S+ 0 0 2 -4,-3.3 4,-1.9 -5,-0.3 -1,-0.3 0.888 112.2 47.2 -57.8 -38.1 29.1 68.3 11.8 10 270 A L H X S+ 0 0 106 -4,-1.8 4,-2.3 -3,-0.4 5,-0.3 0.945 110.0 52.8 -67.8 -45.4 25.4 67.6 12.1 11 271 A T H X S+ 0 0 49 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.915 110.6 46.5 -55.3 -46.3 24.6 71.4 12.1 12 272 A L H X S+ 0 0 2 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.883 108.9 57.5 -63.8 -38.1 26.6 71.9 8.9 13 273 A L H < S+ 0 0 62 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.900 114.4 36.3 -58.6 -43.0 24.8 68.8 7.4 14 274 A E H < S+ 0 0 83 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.731 112.2 59.9 -83.6 -22.6 21.4 70.3 8.0 15 275 A A H < S+ 0 0 4 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.719 77.9 111.3 -79.0 -19.7 22.6 73.9 7.2 16 276 A E < - 0 0 53 -4,-1.5 29,-0.0 -5,-0.2 -3,-0.0 -0.310 66.5-135.0 -58.5 123.7 23.6 72.8 3.7 17 277 A P - 0 0 35 0, 0.0 2,-0.2 0, 0.0 3,-0.1 -0.448 23.2 -98.9 -80.7 157.1 21.3 74.4 1.1 18 278 A P - 0 0 102 0, 0.0 26,-0.1 0, 0.0 0, 0.0 -0.479 49.0 -90.9 -75.5 144.6 19.9 72.5 -1.8 19 279 A H - 0 0 72 -2,-0.2 2,-0.2 1,-0.1 74,-0.1 -0.210 43.9-117.4 -54.8 139.1 21.6 72.9 -5.2 20 280 A V - 0 0 14 72,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.512 26.1-139.8 -78.4 147.3 20.1 75.7 -7.2 21 281 A L + 0 0 73 -2,-0.2 2,-0.2 72,-0.1 72,-0.0 -0.837 24.6 168.8-109.7 150.1 18.5 74.8 -10.6 22 282 A I - 0 0 18 -2,-0.3 74,-0.9 74,-0.0 73,-0.1 -0.762 30.6-127.8-165.9 114.4 18.8 76.7 -13.8 23 283 A S 0 0 90 -2,-0.2 -2,-0.0 72,-0.1 72,-0.0 -0.279 360.0 360.0 -59.6 145.8 17.8 75.9 -17.4 24 284 A R 0 0 105 9,-0.0 -1,-0.1 73,-0.0 9,-0.1 0.769 360.0 360.0 -95.4 360.0 20.6 76.4 -20.0 25 ! 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 26 290 A T > 0 0 109 0, 0.0 4,-0.7 0, 0.0 79,-0.1 0.000 360.0 360.0 360.0 35.6 27.3 82.9 -27.1 27 291 A E H > + 0 0 55 2,-0.2 4,-1.1 1,-0.2 3,-0.5 0.950 360.0 33.3 -64.3 -53.4 30.0 84.6 -25.1 28 292 A A H > S+ 0 0 36 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.914 107.9 68.6 -70.8 -43.8 27.7 86.9 -23.1 29 293 A S H > S+ 0 0 68 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.730 101.6 48.6 -49.6 -25.5 24.8 84.5 -22.9 30 294 A M H X S+ 0 0 35 -4,-0.7 4,-2.7 -3,-0.5 5,-0.2 0.939 104.6 55.0 -81.4 -48.1 26.9 82.2 -20.7 31 295 A M H X S+ 0 0 44 -4,-1.1 4,-2.7 1,-0.2 5,-0.3 0.803 105.8 59.3 -52.2 -27.7 28.0 85.0 -18.3 32 296 A M H X S+ 0 0 91 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.987 107.3 40.9 -63.5 -62.6 24.3 85.5 -18.0 33 297 A S H X S+ 0 0 26 -4,-1.3 4,-1.7 1,-0.2 -2,-0.2 0.830 118.7 46.9 -57.9 -36.8 23.4 82.1 -16.8 34 298 A L H X S+ 0 0 21 -4,-2.7 4,-3.9 2,-0.2 5,-0.2 0.967 112.9 46.9 -71.9 -51.2 26.4 81.9 -14.5 35 299 A T H X S+ 0 0 14 -4,-2.7 4,-2.7 1,-0.3 5,-0.2 0.918 112.2 53.2 -54.6 -44.2 25.9 85.4 -13.0 36 300 A K H X S+ 0 0 108 -4,-2.9 4,-1.5 -5,-0.3 -1,-0.3 0.885 114.2 41.1 -58.4 -41.0 22.2 84.4 -12.5 37 301 A L H X S+ 0 0 2 -4,-1.7 4,-1.9 -5,-0.2 5,-0.2 0.944 111.1 56.3 -72.9 -48.0 23.3 81.2 -10.7 38 302 A A H X S+ 0 0 11 -4,-3.9 4,-2.8 1,-0.2 3,-0.4 0.911 108.3 47.6 -47.9 -50.8 26.0 83.0 -8.7 39 303 A D H X S+ 0 0 48 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.933 111.4 51.5 -57.1 -47.7 23.5 85.5 -7.4 40 304 A K H X S+ 0 0 102 -4,-1.5 4,-0.8 -5,-0.2 -1,-0.2 0.733 114.4 43.5 -63.3 -26.0 21.1 82.6 -6.5 41 305 A E H X S+ 0 0 30 -4,-1.9 4,-2.4 -3,-0.4 -1,-0.2 0.819 105.4 60.2 -88.8 -35.5 24.0 80.8 -4.6 42 306 A L H X S+ 0 0 0 -4,-2.8 4,-1.8 -5,-0.2 -2,-0.2 0.885 103.5 53.2 -59.7 -38.3 25.3 83.9 -2.8 43 307 A V H X S+ 0 0 55 -4,-1.7 4,-1.6 1,-0.2 3,-0.4 0.962 110.7 45.9 -59.8 -52.4 21.9 84.3 -1.1 44 308 A H H X S+ 0 0 69 -4,-0.8 4,-3.0 1,-0.2 -1,-0.2 0.861 107.3 60.6 -56.7 -38.3 22.0 80.7 0.1 45 309 A M H X S+ 0 0 11 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.897 102.9 49.4 -58.9 -43.0 25.6 81.2 1.2 46 310 A I H X S+ 0 0 2 -4,-1.8 4,-2.6 -3,-0.4 -1,-0.2 0.882 111.9 47.7 -65.8 -38.6 24.6 84.0 3.6 47 311 A S H X S+ 0 0 51 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.936 112.4 51.3 -64.8 -45.0 21.8 81.8 5.1 48 312 A W H < S+ 0 0 5 -4,-3.0 4,-0.3 2,-0.2 -2,-0.2 0.934 110.5 47.4 -55.3 -51.1 24.3 79.1 5.3 49 313 A A H >< S+ 0 0 0 -4,-2.9 3,-2.1 1,-0.2 6,-0.3 0.939 110.0 53.4 -56.4 -50.5 26.8 81.3 7.1 50 314 A K H 3< S+ 0 0 75 -4,-2.6 6,-0.5 1,-0.3 -1,-0.2 0.860 103.0 57.3 -53.7 -41.1 24.1 82.6 9.5 51 315 A K T 3< S+ 0 0 113 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.452 84.1 104.0 -72.4 -1.6 23.2 79.0 10.4 52 316 A I S X> S- 0 0 5 -3,-2.1 3,-1.7 -4,-0.3 4,-0.5 -0.707 89.3 -96.9 -84.4 131.5 26.8 78.4 11.6 53 317 A P T 34 S- 0 0 36 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.233 103.3 -0.2 -50.1 111.2 27.2 78.4 15.4 54 318 A G T >> S+ 0 0 30 -4,-0.2 3,-1.2 -2,-0.1 4,-0.6 0.114 95.8 112.1 98.5 -21.9 28.4 81.7 16.5 55 319 A F G X4 S+ 0 0 1 -3,-1.7 3,-1.9 1,-0.3 -5,-0.1 0.928 80.9 45.2 -51.4 -55.9 28.6 83.5 13.2 56 320 A V G 3< S+ 0 0 87 -6,-0.5 -1,-0.3 -4,-0.5 -6,-0.1 0.607 107.2 62.1 -67.0 -9.9 25.8 85.9 13.8 57 321 A E G <4 S+ 0 0 59 -3,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.531 86.9 92.0 -89.8 -10.1 27.2 86.6 17.2 58 322 A L S << S- 0 0 6 -3,-1.9 5,-0.1 -4,-0.6 97,-0.0 -0.412 98.1 -77.5 -77.8 163.4 30.4 88.0 15.7 59 323 A S > - 0 0 31 93,-0.2 4,-2.0 1,-0.1 -1,-0.2 -0.244 38.5-118.1 -61.0 149.7 30.6 91.7 15.0 60 324 A L H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.872 116.4 58.3 -57.0 -35.3 28.8 92.9 12.0 61 325 A F H > S+ 0 0 105 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.973 106.0 47.5 -57.1 -55.5 32.1 94.1 10.6 62 326 A D H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.821 108.9 55.3 -57.2 -34.0 33.5 90.5 10.8 63 327 A Q H X S+ 0 0 11 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.965 113.0 39.9 -65.4 -50.1 30.4 89.1 9.2 64 328 A V H X S+ 0 0 28 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.919 116.4 50.5 -63.4 -45.7 30.7 91.3 6.2 65 329 A R H X S+ 0 0 86 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.915 111.5 48.2 -60.1 -45.0 34.5 91.0 6.0 66 330 A L H < S+ 0 0 8 -4,-2.4 4,-0.4 -5,-0.3 -1,-0.2 0.919 116.2 41.9 -65.3 -42.3 34.4 87.3 6.2 67 331 A L H >X S+ 0 0 0 -4,-2.1 4,-1.2 -5,-0.2 3,-1.0 0.885 113.4 52.5 -73.9 -36.8 31.7 86.9 3.5 68 332 A E H 3< S+ 0 0 80 -4,-3.1 4,-0.3 1,-0.2 -1,-0.2 0.888 111.4 48.7 -65.3 -36.6 33.2 89.5 1.3 69 333 A S T 3< S+ 0 0 58 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.446 118.5 34.5 -83.8 0.1 36.5 87.7 1.4 70 334 A C T <> S+ 0 0 1 -3,-1.0 4,-3.0 -4,-0.4 5,-0.3 0.477 78.2 99.6-134.0 -2.4 35.4 84.2 0.7 71 335 A W H X S+ 0 0 19 -4,-1.2 4,-2.8 2,-0.2 5,-0.2 0.901 88.0 49.6 -56.3 -42.6 32.5 84.1 -1.7 72 336 A M H > S+ 0 0 25 -4,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.969 115.1 43.4 -58.8 -55.1 34.7 83.2 -4.7 73 337 A E H > S+ 0 0 12 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.890 114.2 50.0 -59.6 -41.5 36.4 80.4 -3.0 74 338 A V H X S+ 0 0 9 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.906 111.2 49.5 -67.8 -38.1 33.2 79.1 -1.5 75 339 A L H X S+ 0 0 34 -4,-2.8 4,-1.9 -5,-0.3 -2,-0.2 0.945 112.0 49.4 -64.7 -43.9 31.5 79.1 -4.9 76 340 A M H X S+ 0 0 14 -4,-2.8 4,-2.4 -5,-0.2 3,-0.3 0.945 108.9 50.9 -58.8 -50.6 34.5 77.3 -6.3 77 341 A M H X S+ 0 0 3 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.898 111.4 49.8 -53.5 -42.8 34.5 74.6 -3.6 78 342 A G H X S+ 0 0 7 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.848 108.1 52.9 -67.0 -33.8 30.8 74.1 -4.3 79 343 A L H >X S+ 0 0 11 -4,-1.9 4,-2.1 -3,-0.3 3,-0.7 0.992 109.4 48.7 -63.8 -58.0 31.3 73.8 -8.0 80 344 A M H 3< S+ 0 0 6 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.835 107.2 54.6 -50.1 -43.4 34.0 71.1 -7.6 81 345 A W H >< S+ 0 0 64 -4,-2.0 3,-1.0 1,-0.2 4,-0.4 0.885 109.9 46.3 -62.8 -37.6 31.9 69.0 -5.2 82 346 A R H << S+ 0 0 56 -4,-1.4 3,-0.3 -3,-0.7 -1,-0.2 0.877 121.0 39.8 -69.7 -37.0 29.0 68.8 -7.6 83 347 A S T 3< S+ 0 0 2 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.032 85.2 104.1-101.3 26.1 31.4 68.0 -10.4 84 348 A I S < S+ 0 0 11 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.933 86.5 39.3 -73.7 -42.8 33.6 65.7 -8.4 85 349 A D S S+ 0 0 117 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.325 104.9 72.4 -89.6 8.8 32.3 62.5 -9.9 86 350 A H S > S- 0 0 84 -3,-0.4 3,-1.7 3,-0.2 -1,-0.2 -0.560 79.1-148.7-126.7 72.0 31.9 63.8 -13.5 87 351 A P T 3 S+ 0 0 74 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 0.183 76.3 13.7 -36.9 148.5 35.5 64.1 -14.9 88 352 A G T 3 S+ 0 0 41 29,-0.2 12,-0.9 1,-0.1 2,-0.3 0.393 112.1 98.5 62.4 -3.4 36.3 66.8 -17.5 89 353 A K E < -A 99 0A 104 -3,-1.7 2,-0.6 -6,-0.2 -3,-0.2 -0.871 61.4-151.1-118.0 149.5 33.0 68.5 -16.6 90 354 A L E -A 98 0A 3 8,-1.4 2,-1.6 -2,-0.3 8,-1.0 -0.928 14.9-154.4-118.5 102.7 32.0 71.4 -14.3 91 355 A I + 0 0 21 -2,-0.6 6,-0.2 -12,-0.3 -9,-0.1 -0.553 25.4 164.9 -80.8 82.0 28.5 70.9 -13.0 92 356 A F S S- 0 0 30 -2,-1.6 -1,-0.2 4,-0.4 5,-0.2 0.886 76.7 -13.8 -63.2 -36.3 27.3 74.4 -12.3 93 357 A A S S- 0 0 0 3,-2.6 -1,-0.2 -3,-0.2 -72,-0.1 -0.972 77.6 -95.3-159.7 158.7 23.8 73.0 -12.1 94 358 A P S S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -73,-0.1 0.889 128.2 31.4 -46.0 -45.8 21.9 69.8 -13.1 95 359 A D S S+ 0 0 56 1,-0.2 2,-0.6 -73,-0.1 -72,-0.1 0.984 113.9 63.0 -75.5 -66.6 21.0 71.5 -16.4 96 360 A L + 0 0 12 -74,-0.9 -3,-2.6 -5,-0.1 -4,-0.4 -0.483 66.0 154.6 -68.5 110.3 24.0 73.7 -16.9 97 361 A V - 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0 0 109 2,-0.0 2,-0.5 0, 0.0 0, 0.0 -0.879 360.0-171.4-106.9 118.6 44.2 95.0 10.4 148 415 A T - 0 0 105 -2,-0.6 2,-0.3 3,-0.0 5,-0.0 -0.927 12.3-145.4-116.9 126.1 42.4 94.7 13.7 149 416 A A > - 0 0 62 -2,-0.5 3,-1.8 1,-0.1 4,-0.4 -0.642 22.0-123.2 -85.5 141.5 40.5 97.5 15.4 150 417 A T G > S+ 0 0 136 -2,-0.3 3,-1.6 1,-0.3 4,-0.2 0.854 111.9 57.1 -49.8 -43.3 40.4 97.6 19.2 151 418 A Q G 3 S+ 0 0 193 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.761 102.2 56.6 -62.4 -24.5 36.7 97.7 19.2 152 419 A D G <> S+ 0 0 13 -3,-1.8 4,-2.7 1,-0.2 -1,-0.3 0.508 75.7 106.7 -87.2 -3.5 36.7 94.4 17.3 153 420 A A H <> S+ 0 0 49 -3,-1.6 4,-2.3 -4,-0.4 -1,-0.2 0.831 78.7 45.1 -40.5 -53.1 38.8 92.6 19.9 154 421 A D H > S+ 0 0 124 -3,-0.4 4,-2.1 -4,-0.2 -1,-0.2 0.915 112.2 51.2 -63.9 -43.8 36.0 90.5 21.4 155 422 A S H > S+ 0 0 9 -4,-0.3 4,-2.8 -3,-0.2 -2,-0.2 0.945 109.3 51.3 -59.1 -48.2 34.6 89.4 18.0 156 423 A S H X S+ 0 0 38 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.942 106.6 54.6 -52.9 -50.6 38.1 88.4 16.9 157 424 A R H X S+ 0 0 58 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.891 110.7 45.5 -49.8 -46.9 38.5 86.3 20.0 158 425 A K H >X S+ 0 0 105 -4,-2.1 4,-2.1 1,-0.2 3,-0.7 0.957 108.1 55.9 -63.4 -50.9 35.3 84.5 19.2 159 426 A L H 3X S+ 0 0 17 -4,-2.8 4,-2.5 1,-0.3 5,-0.3 0.894 102.6 57.0 -48.3 -46.1 36.2 84.0 15.5 160 427 A A H 3X S+ 0 0 61 -4,-2.6 4,-2.2 1,-0.2 -1,-0.3 0.913 107.8 48.8 -53.2 -44.1 39.4 82.3 16.7 161 428 A H H < S+ 0 0 3 -4,-2.4 3,-1.6 -5,-0.2 4,-0.3 0.908 106.7 55.6 -72.6 -38.0 38.9 62.1 9.9 175 442 A A H >< S+ 0 0 43 -4,-2.6 3,-1.8 1,-0.3 -2,-0.2 0.920 103.8 53.8 -59.4 -44.2 39.5 60.1 13.0 176 443 A K T 3< S+ 0 0 146 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.479 85.4 85.1 -71.0 0.8 36.2 58.2 12.6 177 444 A S T < S- 0 0 59 -3,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.707 98.0-132.5 -73.2 -17.7 37.3 57.3 9.1 178 445 A G < + 0 0 63 -3,-1.8 -1,-0.1 -4,-0.3 -2,-0.1 -0.048 59.2 131.7 94.8 -34.0 39.1 54.4 10.8 179 446 A I - 0 0 66 -5,-0.2 -1,-0.2 1,-0.1 5,-0.1 0.091 66.6 -75.9 -49.2 165.8 42.5 54.7 9.1 180 447 A S > - 0 0 61 1,-0.1 4,-1.7 3,-0.1 3,-0.2 -0.062 43.2-106.3 -61.0 166.4 45.7 54.7 11.2 181 448 A S H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 3,-0.2 0.927 120.2 47.6 -62.2 -48.8 46.9 57.7 13.2 182 449 A Q H > S+ 0 0 143 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.729 108.8 56.8 -67.5 -19.6 49.7 58.7 10.9 183 450 A Q H > S+ 0 0 92 2,-0.2 4,-2.8 -3,-0.2 -1,-0.2 0.867 104.1 52.4 -77.8 -34.8 47.3 58.3 8.0 184 451 A Q H X S+ 0 0 47 -4,-1.7 4,-3.0 2,-0.2 5,-0.2 0.952 110.9 47.9 -61.2 -47.8 45.0 60.8 9.6 185 452 A S H X S+ 0 0 83 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.978 113.4 46.5 -54.6 -59.8 47.9 63.2 9.9 186 453 A M H X S+ 0 0 106 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.873 113.5 50.1 -51.3 -42.1 48.9 62.7 6.3 187 454 A R H X S+ 0 0 40 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.957 108.6 49.8 -65.0 -50.6 45.3 63.1 5.2 188 455 A L H X S+ 0 0 44 -4,-3.0 4,-2.3 1,-0.2 5,-0.2 0.922 110.7 51.5 -53.4 -47.5 44.7 66.3 7.1 189 456 A A H X S+ 0 0 56 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.932 111.0 48.6 -54.9 -48.5 47.9 67.7 5.6 190 457 A N H X S+ 0 0 40 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.937 107.9 52.3 -59.8 -49.4 46.6 66.7 2.1 191 458 A L H X S+ 0 0 1 -4,-3.0 4,-1.7 1,-0.3 -1,-0.2 0.908 112.5 47.2 -54.4 -41.4 43.2 68.3 2.5 192 459 A L H X S+ 0 0 79 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.3 0.835 107.2 56.6 -71.1 -30.9 44.9 71.5 3.5 193 460 A M H X S+ 0 0 99 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.964 108.4 46.4 -63.5 -50.8 47.3 71.3 0.6 194 461 A L H >X S+ 0 0 6 -4,-2.4 4,-1.9 1,-0.2 3,-0.8 0.866 105.6 61.0 -59.1 -37.8 44.5 71.2 -1.9 195 462 A L H 3X S+ 0 0 21 -4,-1.7 4,-2.6 1,-0.3 5,-0.3 0.949 97.5 58.6 -54.7 -48.7 42.7 74.0 -0.1 196 463 A S H 3X S+ 0 0 77 -4,-1.8 4,-1.7 1,-0.2 -1,-0.3 0.824 104.9 52.2 -49.3 -33.7 45.7 76.2 -0.8 197 464 A H H XX S+ 0 0 83 -4,-0.9 4,-2.8 -3,-0.8 3,-0.7 0.991 107.1 48.7 -67.2 -59.0 45.1 75.5 -4.5 198 465 A V H 3X S+ 0 0 1 -4,-1.9 4,-3.0 1,-0.3 5,-0.2 0.871 111.7 52.6 -46.5 -39.8 41.4 76.5 -4.4 199 466 A R H 3X S+ 0 0 126 -4,-2.6 4,-1.3 1,-0.2 -1,-0.3 0.906 109.7 47.5 -65.0 -39.7 42.5 79.6 -2.6 200 467 A H H X S+ 0 0 83 -4,-1.4 4,-0.9 -3,-0.3 3,-0.5 0.988 110.7 45.6 -69.4 -58.8 39.2 87.8 -8.5 207 474 A E H 3< S+ 0 0 128 -4,-2.3 3,-0.3 1,-0.3 -1,-0.2 0.794 109.4 61.1 -54.5 -25.5 42.1 89.7 -10.2 208 475 A H H 3< S+ 0 0 61 -4,-2.1 3,-0.4 -5,-0.3 -1,-0.3 0.957 102.9 47.5 -65.0 -49.4 40.4 88.4 -13.4 209 476 A L H X< S+ 0 0 71 -4,-1.8 3,-1.1 -3,-0.5 -1,-0.2 0.577 93.0 81.8 -67.1 -8.8 37.2 90.4 -12.4 210 477 A L T 3< S+ 0 0 81 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.1 -0.084 107.5 26.2 -88.8 37.7 39.6 93.3 -11.8 211 478 A N T 3 S+ 0 0 89 -3,-0.4 2,-0.3 0, 0.0 -1,-0.3 -0.036 94.4 158.1 170.7 46.9 39.4 93.8 -15.5 212 479 A M < - 0 0 46 -3,-1.1 2,-2.6 1,-0.1 -3,-0.1 -0.698 51.3-115.2 -94.8 142.8 36.0 92.3 -16.2 213 480 A K > - 0 0 67 -2,-0.3 2,-1.7 1,-0.1 3,-0.6 -0.418 35.5-174.2 -72.9 71.8 33.8 93.1 -19.3 214 481 A C T 3 + 0 0 68 -2,-2.6 -1,-0.1 1,-0.2 4,-0.1 -0.550 49.4 99.8 -70.8 91.1 31.0 94.7 -17.3 215 482 A K T 3 S+ 0 0 124 -2,-1.7 -1,-0.2 -187,-0.0 -2,-0.0 0.546 84.3 21.5-142.0 -45.1 28.7 95.2 -20.3 216 483 A N S < S+ 0 0 54 -3,-0.6 2,-0.3 2,-0.0 -2,-0.1 0.019 124.2 45.5-120.8 22.7 25.9 92.6 -20.8 217 484 A V S S- 0 0 26 -4,-0.1 -185,-0.1 -182,-0.0 -186,-0.0 -0.913 81.9-110.7-152.3 174.3 26.0 91.5 -17.2 218 485 A V - 0 0 78 -2,-0.3 2,-0.1 -186,-0.1 5,-0.0 -0.957 42.6-104.6-114.8 132.4 26.1 93.0 -13.7 219 486 A P > - 0 0 51 0, 0.0 4,-1.7 0, 0.0 5,-0.1 -0.352 20.3-136.2 -57.4 130.6 29.2 92.5 -11.7 220 487 A V H > S+ 0 0 20 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.807 102.3 67.3 -56.6 -29.1 28.7 89.8 -9.0 221 488 A Y H >> S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 3,-1.6 0.985 101.3 42.7 -52.1 -68.9 30.5 92.2 -6.6 222 489 A D H 3> S+ 0 0 93 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.851 111.5 58.5 -46.1 -40.8 27.7 94.8 -6.7 223 490 A L H 3X S+ 0 0 32 -4,-1.7 4,-1.6 1,-0.2 -1,-0.3 0.869 110.6 41.3 -60.5 -36.6 25.3 91.9 -6.4 224 491 A L H S+ 0 0 4 -4,-2.7 4,-2.5 2,-0.2 5,-1.9 0.947 108.1 48.1 -68.2 -46.3 24.9 92.2 2.3 229 496 A N H <>S+ 0 0 92 -4,-1.7 5,-2.3 -5,-0.2 -1,-0.2 0.879 119.2 44.0 -58.4 -36.8 23.2 95.5 3.0 230 497 A A H <5S+ 0 0 38 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.978 127.3 22.2 -70.9 -60.6 19.9 93.7 2.7 231 498 A H H <5S+ 0 0 94 -4,-3.7 -3,-0.2 -5,-0.1 -2,-0.2 0.382 130.7 32.5 -97.1 3.6 20.5 90.5 4.6 232 499 A V T <5S+ 0 0 12 -4,-2.5 -3,-0.2 -5,-0.2 -4,-0.1 0.666 128.0 28.1-123.3 -46.0 23.3 91.3 7.1 233 500 A L T < 0 0 87 -5,-1.9 -3,-0.2 -173,-0.0 -4,-0.1 0.944 360.0 360.0 -76.0 -77.3 23.0 94.9 8.0 234 501 A R < 0 0 105 -5,-2.3 -4,-0.0 -6,-0.1 0, 0.0 0.152 360.0 360.0 -56.7 360.0 19.3 95.3 7.5 235 !* 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 0.0 236 255 B M 0 0 135 0, 0.0 4,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 1.4 18.9 75.5 65.1 237 256 B R > + 0 0 174 2,-0.2 4,-1.5 1,-0.1 0, 0.0 0.736 360.0 58.8 -90.4 -27.4 15.3 74.2 65.2 238 257 B E H > S+ 0 0 68 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.911 102.5 53.6 -67.6 -42.9 13.8 77.5 66.3 239 258 B L H > S+ 0 0 69 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.821 105.6 55.6 -61.2 -32.1 15.2 79.3 63.2 240 259 B L H > S+ 0 0 61 -4,-0.4 4,-1.2 2,-0.2 -1,-0.2 0.894 104.4 51.8 -68.9 -42.0 13.5 76.6 61.0 241 260 B L H < S+ 0 0 101 -4,-1.5 -2,-0.2 2,-0.2 3,-0.2 0.919 112.9 43.8 -62.0 -44.8 10.0 77.2 62.4 242 261 B D H >< S+ 0 0 107 -4,-1.7 3,-1.5 1,-0.2 6,-0.3 0.891 110.3 54.5 -69.6 -38.3 10.1 81.0 61.8 243 262 B A H 3< S+ 0 0 28 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.766 108.1 53.7 -64.9 -24.1 11.6 80.6 58.4 244 263 B L T 3< S+ 0 0 21 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.368 79.6 112.8 -93.0 2.9 8.7 78.3 57.6 245 264 B S S <> S- 0 0 30 -3,-1.5 4,-3.0 -4,-0.1 5,-0.3 -0.419 83.3-105.2 -69.7 155.4 5.9 80.7 58.6 246 265 B P H > S+ 0 0 35 0, 0.0 4,-3.3 0, 0.0 5,-0.3 0.934 116.5 41.2 -46.2 -64.4 3.8 81.9 55.6 247 266 B E H > S+ 0 0 91 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.901 117.5 47.1 -54.7 -47.4 5.2 85.4 55.3 248 267 B Q H > S+ 0 0 94 -6,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.939 116.4 44.9 -62.8 -44.5 8.8 84.4 55.9 249 268 B L H X S+ 0 0 1 -4,-3.0 4,-2.8 2,-0.2 5,-0.3 0.931 111.2 50.9 -64.5 -50.1 8.6 81.4 53.5 250 269 B V H X S+ 0 0 5 -4,-3.3 4,-1.7 -5,-0.3 -1,-0.2 0.882 113.3 47.4 -57.9 -37.3 6.8 83.3 50.7 251 270 B L H X S+ 0 0 81 -4,-1.9 4,-2.1 -5,-0.3 5,-0.3 0.945 109.9 52.7 -68.5 -45.6 9.4 86.0 51.0 252 271 B T H X S+ 0 0 29 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.916 110.5 46.6 -55.7 -45.9 12.2 83.4 50.9 253 272 B L H X S+ 0 0 3 -4,-2.8 4,-1.4 1,-0.2 -1,-0.2 0.876 107.9 59.7 -64.1 -36.8 10.8 81.8 47.7 254 273 B L H < S+ 0 0 60 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.895 114.6 32.7 -58.8 -44.2 10.5 85.3 46.2 255 274 B E H < S+ 0 0 131 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.554 112.3 62.8 -92.3 -7.6 14.2 86.1 46.6 256 275 B A H < S+ 0 0 3 -4,-1.2 -2,-0.2 -5,-0.3 -1,-0.2 0.709 78.1 110.1 -85.2 -18.8 15.3 82.5 46.0 257 276 B E < - 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0 0 70 0, 0.0 4,-1.8 0, 0.0 5,-0.1 -0.648 360.0-147.4 -84.6 128.8 20.4 63.1 27.4 451 487 B V H > S+ 0 0 18 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 0.812 97.5 67.3 -56.6 -29.5 19.3 65.7 30.0 452 488 B Y H >> S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 3,-1.4 0.984 101.5 42.7 -52.5 -67.7 19.2 62.7 32.4 453 489 B D H 3> S+ 0 0 97 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.860 111.6 58.3 -46.6 -41.3 23.0 62.2 32.3 454 490 B L H 3X S+ 0 0 39 -4,-1.8 4,-1.7 1,-0.2 -1,-0.3 0.871 110.7 41.2 -59.5 -38.0 23.3 65.9 32.5 455 491 B L H