==== 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 HORMONE/GROWTH FACTOR RECEPTOR 12-JAN-05 1YIM . COMPND 2 MOLECULE: ESTROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.M.FITZGERALD,N.SHARMA . 245 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13317.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 74.7 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 . 5 2.0 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 . 1 0.4 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 . 9 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 57.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 0 0 1 0 1 0 0 1 0 0 0 1 0 0 0 1 0 1 0 0 1 0 1 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 307 A A 0 0 19 0, 0.0 174,-0.0 0, 0.0 8,-0.0 0.000 360.0 360.0 360.0 -12.4 9.3 12.8 10.2 2 308 A L + 0 0 86 173,-0.0 170,-0.0 3,-0.0 3,-0.0 0.575 360.0 12.4-107.5 -16.1 8.7 15.7 7.8 3 309 A S S S+ 0 0 123 2,-0.1 2,-0.2 0, 0.0 0, 0.0 0.265 106.2 106.7-136.0 -1.7 5.0 15.2 7.6 4 310 A L S S- 0 0 51 1,-0.1 2,-0.0 4,-0.0 3,-0.0 -0.494 73.9-120.0 -68.7 143.8 4.8 12.8 10.5 5 311 A T > - 0 0 64 -2,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.355 21.0-109.3 -82.1 176.1 3.2 14.5 13.6 6 312 A A H > S+ 0 0 13 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.944 124.1 52.6 -64.5 -44.7 5.1 14.8 16.9 7 313 A D H > S+ 0 0 101 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.828 110.5 48.2 -54.3 -37.0 2.7 12.2 18.3 8 314 A Q H > S+ 0 0 97 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.867 109.3 52.1 -74.4 -38.4 3.6 10.0 15.4 9 315 A M H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.978 110.3 48.7 -64.6 -47.8 7.3 10.5 15.9 10 316 A V H X S+ 0 0 17 -4,-3.1 4,-2.4 1,-0.2 5,-0.2 0.927 113.0 45.9 -60.7 -46.5 7.1 9.6 19.5 11 317 A S H X S+ 0 0 59 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.903 111.3 52.9 -64.2 -35.9 5.1 6.4 19.0 12 318 A A H X S+ 0 0 31 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.962 112.6 44.6 -62.4 -43.5 7.3 5.3 16.1 13 319 A L H X S+ 0 0 0 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.868 113.1 50.3 -64.7 -39.3 10.4 5.8 18.3 14 320 A L H >< S+ 0 0 64 -4,-2.4 3,-0.8 -5,-0.3 -1,-0.2 0.890 110.6 50.7 -65.8 -36.7 8.7 4.0 21.2 15 321 A D H 3< S+ 0 0 103 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.741 106.4 56.5 -74.3 -21.4 7.8 1.2 18.9 16 322 A A H 3< S+ 0 0 4 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.555 74.6 133.2 -87.9 -9.0 11.4 0.9 17.7 17 323 A E << - 0 0 66 -3,-0.8 -3,-0.1 -4,-0.5 123,-0.0 -0.094 54.6-127.3 -50.5 131.2 13.0 0.4 21.1 18 324 A P - 0 0 41 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.267 31.8 -96.8 -71.8 165.9 15.5 -2.5 21.1 19 325 A P - 0 0 68 0, 0.0 2,-0.6 0, 0.0 31,-0.1 -0.466 31.1-108.1 -80.5 161.4 15.1 -5.3 23.8 20 326 A I - 0 0 116 -2,-0.1 2,-0.2 79,-0.0 79,-0.1 -0.792 42.5-151.1 -84.0 116.2 17.0 -5.5 27.1 21 327 A L - 0 0 29 -2,-0.6 2,-0.3 77,-0.2 22,-0.0 -0.525 4.7-124.3 -94.8 161.7 19.5 -8.3 26.7 22 328 A Y - 0 0 144 -2,-0.2 2,-0.2 77,-0.2 -1,-0.0 -0.719 24.7-110.7-100.3 150.0 21.0 -10.6 29.3 23 329 A S - 0 0 9 -2,-0.3 2,-0.7 2,-0.0 17,-0.1 -0.546 30.8-129.7 -71.6 148.6 24.6 -11.2 30.1 24 330 A E + 0 0 130 15,-0.2 2,-0.3 -2,-0.2 18,-0.1 -0.885 59.4 113.8-110.1 97.9 25.8 -14.6 29.1 25 331 A Y S S- 0 0 69 -2,-0.7 -2,-0.0 9,-0.0 9,-0.0 -0.912 74.2 -95.5-156.5 141.2 27.6 -16.4 31.9 26 332 A D > - 0 0 98 -2,-0.3 3,-1.7 1,-0.2 -2,-0.1 -0.497 28.7-153.8 -65.3 116.5 26.6 -19.5 33.9 27 333 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.2 0, 0.0 4,-0.0 0.423 91.4 62.4 -77.1 2.4 24.8 -18.2 37.0 28 334 A T T 3 S+ 0 0 126 2,-0.1 -2,-0.1 0, 0.0 0, 0.0 0.453 91.6 83.1-101.2 -2.1 25.8 -21.4 38.9 29 335 A R S < S- 0 0 41 -3,-1.7 5,-0.0 1,-0.2 -4,-0.0 -0.714 88.3 -99.1-101.0 150.5 29.5 -20.6 38.6 30 336 A P - 0 0 85 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.209 25.2-128.6 -53.2-174.1 31.6 -18.3 40.8 31 337 A F S > S+ 0 0 84 2,-0.1 3,-1.2 1,-0.1 -2,-0.0 0.669 94.6 72.9-115.6 -24.9 32.4 -14.8 39.8 32 338 A S T 3 S+ 0 0 121 1,-0.2 -1,-0.1 3,-0.0 0, 0.0 0.729 96.2 58.5 -63.0 -18.4 36.2 -14.5 40.2 33 339 A E T 3 S+ 0 0 159 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.590 86.2 90.3 -86.3 -20.5 36.5 -16.7 37.1 34 340 A A S < S- 0 0 37 -3,-1.2 2,-0.7 -5,-0.0 3,-0.1 -0.599 75.7-129.3 -83.4 140.7 34.6 -14.5 34.7 35 341 A S > - 0 0 77 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 -0.783 13.2-157.0 -83.4 121.2 36.3 -11.8 32.6 36 342 A M H > S+ 0 0 20 -2,-0.7 4,-2.7 2,-0.2 5,-0.2 0.897 96.2 50.2 -65.7 -34.4 34.4 -8.7 33.2 37 343 A M H > S+ 0 0 23 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.848 111.1 49.8 -71.7 -30.2 35.7 -7.3 29.9 38 344 A G H > S+ 0 0 28 2,-0.2 4,-2.1 3,-0.2 -2,-0.2 0.921 112.1 47.6 -64.3 -49.3 34.7 -10.5 28.2 39 345 A L H X S+ 0 0 12 -4,-3.0 4,-1.8 2,-0.2 -15,-0.2 0.906 117.3 42.3 -57.5 -45.9 31.2 -10.3 29.8 40 346 A L H X S+ 0 0 20 -4,-2.7 4,-2.5 -5,-0.2 5,-0.2 0.917 113.3 51.5 -74.6 -38.5 30.9 -6.6 28.7 41 347 A T H X S+ 0 0 30 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.905 111.0 48.6 -63.5 -39.0 32.4 -7.1 25.2 42 348 A N H X S+ 0 0 93 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.913 112.6 48.6 -64.7 -45.3 30.0 -9.9 24.5 43 349 A L H X S+ 0 0 3 -4,-1.8 4,-2.2 1,-0.2 5,-0.2 0.929 111.7 48.4 -58.4 -52.6 27.0 -7.9 25.7 44 350 A A H X S+ 0 0 24 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.876 109.2 52.8 -61.4 -39.1 27.9 -4.8 23.7 45 351 A D H X S+ 0 0 63 -4,-2.0 4,-1.1 -5,-0.2 -1,-0.2 0.888 109.6 49.4 -67.2 -31.7 28.4 -6.9 20.5 46 352 A R H X S+ 0 0 63 -4,-1.6 4,-1.2 1,-0.2 -2,-0.2 0.887 109.4 51.7 -73.1 -34.8 25.0 -8.4 20.9 47 353 A E H X S+ 0 0 36 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.860 100.4 63.5 -64.2 -37.1 23.3 -5.0 21.4 48 354 A L H X S+ 0 0 11 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.913 98.3 54.6 -59.2 -40.9 24.9 -3.6 18.3 49 355 A V H X S+ 0 0 72 -4,-1.1 4,-1.2 1,-0.2 3,-0.3 0.959 112.5 42.7 -57.5 -47.6 23.0 -6.1 16.1 50 356 A H H X S+ 0 0 66 -4,-1.2 4,-2.2 1,-0.2 -2,-0.2 0.823 106.9 63.3 -69.9 -27.0 19.8 -4.9 17.6 51 357 A M H X S+ 0 0 9 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.903 99.9 53.2 -61.4 -39.3 21.0 -1.3 17.4 52 358 A I H X S+ 0 0 2 -4,-1.8 4,-1.9 -3,-0.3 -1,-0.2 0.871 108.8 49.1 -62.8 -39.9 21.1 -1.6 13.6 53 359 A N H X S+ 0 0 80 -4,-1.2 4,-0.6 2,-0.2 -1,-0.2 0.911 111.7 48.8 -66.6 -43.5 17.5 -2.8 13.5 54 360 A W H >X S+ 0 0 6 -4,-2.2 3,-2.2 1,-0.2 4,-0.6 0.956 107.4 55.2 -58.7 -49.5 16.4 0.1 15.7 55 361 A A H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.3 -1,-0.2 0.906 101.8 56.7 -57.6 -41.6 18.2 2.6 13.6 56 362 A K H 3< S+ 0 0 80 -4,-1.9 6,-0.3 1,-0.3 -1,-0.3 0.739 106.2 52.8 -64.8 -14.0 16.4 1.5 10.5 57 363 A R H << S+ 0 0 144 -3,-2.2 -1,-0.3 -4,-0.6 -2,-0.2 0.499 81.0 105.2 -99.5 -2.5 13.2 2.2 12.3 58 364 A V S XX S- 0 0 3 -3,-1.6 3,-1.8 -4,-0.6 4,-0.6 -0.645 88.6-100.9 -71.6 126.1 14.1 5.8 13.3 59 365 A P T 34 S+ 0 0 17 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.257 103.7 10.4 -52.6 129.1 12.0 8.1 11.0 60 366 A G T >4 S+ 0 0 9 -4,-0.1 3,-0.7 -3,-0.0 4,-0.3 0.094 99.4 101.4 93.2 -22.1 14.2 9.4 8.1 61 367 A F G X4 S+ 0 0 0 -3,-1.8 3,-1.8 1,-0.2 -5,-0.1 0.944 80.4 47.5 -62.6 -49.3 17.2 7.1 8.7 62 368 A V G 3< S+ 0 0 76 -4,-0.6 -1,-0.2 -6,-0.3 -6,-0.1 0.559 98.8 70.3 -76.9 -0.4 16.5 4.6 6.0 63 369 A D G < S+ 0 0 116 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.584 86.7 89.2 -84.3 -5.8 15.9 7.4 3.5 64 370 A L S < S- 0 0 9 -3,-1.8 2,-0.0 -4,-0.3 -4,-0.0 -0.399 93.9 -90.6 -77.6 159.2 19.6 8.0 3.7 65 371 A T > - 0 0 31 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.368 34.6-114.1 -67.6 155.8 22.2 6.3 1.5 66 372 A L H > S+ 0 0 57 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.944 118.1 53.4 -54.4 -47.7 23.7 3.1 2.7 67 373 A H H > S+ 0 0 91 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.925 109.5 46.8 -53.7 -47.4 27.1 4.8 3.0 68 374 A D H > S+ 0 0 9 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.834 108.6 55.0 -69.6 -31.7 25.7 7.6 5.1 69 375 A Q H X S+ 0 0 13 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.906 109.3 48.5 -65.3 -40.3 23.8 5.2 7.4 70 376 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.2 5,-0.2 0.917 111.0 50.4 -62.9 -45.7 27.1 3.3 8.0 71 377 A H H X S+ 0 0 24 -4,-2.3 4,-2.2 -5,-0.2 5,-0.2 0.964 110.5 48.3 -60.2 -48.4 29.0 6.6 8.7 72 378 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.929 114.3 45.3 -61.7 -43.0 26.4 7.8 11.3 73 379 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.911 109.9 54.7 -66.3 -38.8 26.3 4.5 13.1 74 380 A E H < S+ 0 0 73 -4,-2.7 4,-0.2 1,-0.2 -1,-0.2 0.853 113.9 42.9 -63.2 -35.3 30.1 4.2 13.1 75 381 A C H < S+ 0 0 41 -4,-2.2 -1,-0.2 -5,-0.2 4,-0.2 0.810 125.6 31.6 -75.4 -31.9 30.3 7.6 14.7 76 382 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.2 5,-0.2 0.551 82.1 101.1-111.1 -5.2 27.5 7.1 17.2 77 383 A W H X S+ 0 0 40 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.837 88.5 44.1 -57.7 -37.9 27.4 3.4 18.2 78 384 A L H > S+ 0 0 14 -4,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.878 112.2 51.6 -77.4 -35.6 29.1 3.8 21.6 79 385 A E H > S+ 0 0 3 -4,-0.2 4,-3.0 -3,-0.2 5,-0.3 0.920 111.5 50.4 -58.6 -43.1 27.2 7.0 22.6 80 386 A I H X S+ 0 0 8 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.923 110.8 46.2 -64.1 -47.0 24.0 5.0 21.8 81 387 A L H X S+ 0 0 18 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.945 114.4 51.5 -56.7 -44.4 25.1 2.0 23.9 82 388 A M H X S+ 0 0 15 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.914 107.9 46.9 -65.9 -44.7 26.0 4.4 26.7 83 389 A I H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.890 111.7 53.8 -68.4 -28.4 22.8 6.5 26.9 84 390 A G H X S+ 0 0 11 -4,-1.8 4,-2.1 -5,-0.3 -1,-0.2 0.918 109.5 48.1 -67.6 -36.2 20.9 3.2 26.9 85 391 A L H X S+ 0 0 8 -4,-1.9 4,-1.0 2,-0.2 12,-0.5 0.914 112.2 47.8 -66.6 -43.0 23.0 2.0 29.8 86 392 A V H X S+ 0 0 0 -4,-2.5 4,-0.8 1,-0.2 3,-0.2 0.899 110.1 54.0 -67.0 -39.1 22.5 5.2 31.8 87 393 A W H >< S+ 0 0 76 -4,-2.3 3,-0.8 1,-0.2 4,-0.3 0.920 111.4 42.9 -59.3 -47.0 18.7 5.1 31.1 88 394 A R H 3< S+ 0 0 47 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.680 112.6 54.4 -82.7 -6.7 18.3 1.6 32.4 89 395 A S H >< S+ 0 0 0 -4,-1.0 3,-2.8 -3,-0.2 6,-0.3 0.568 80.4 99.1 -92.6 -9.3 20.5 2.4 35.4 90 396 A M T << S+ 0 0 18 -3,-0.8 -1,-0.1 -4,-0.8 -2,-0.1 0.851 84.1 43.9 -42.8 -54.3 18.4 5.4 36.4 91 397 A E T 3 S+ 0 0 169 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.244 103.0 74.2 -82.5 14.5 16.4 3.7 39.1 92 398 A H S X S- 0 0 65 -3,-2.8 3,-2.5 3,-0.2 -1,-0.2 -0.558 75.8-153.5-126.4 72.6 19.6 2.0 40.5 93 399 A P T 3 S+ 0 0 83 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.035 80.1 9.3 -48.5 131.6 21.6 4.6 42.4 94 400 A G T 3 S+ 0 0 47 1,-0.2 12,-0.5 29,-0.2 2,-0.3 0.449 116.4 94.1 80.3 -4.9 25.3 3.8 42.5 95 401 A K < - 0 0 84 -3,-2.5 2,-0.6 -6,-0.3 10,-0.2 -0.900 64.1-143.8-126.9 150.8 24.9 1.0 40.0 96 402 A L E -A 104 0A 0 8,-3.2 8,-1.9 -2,-0.3 2,-1.5 -0.949 15.7-147.0-109.0 117.7 25.1 0.4 36.3 97 403 A L E +A 103 0A 23 -2,-0.6 6,-0.2 -12,-0.5 -9,-0.1 -0.636 29.8 163.6 -87.5 85.0 22.5 -2.0 34.9 98 404 A F E S- 0 0 25 -2,-1.5 -1,-0.2 4,-1.3 -77,-0.2 0.896 78.0 -14.9 -66.5 -40.7 24.6 -3.6 32.1 99 405 A A E > S-A 102 0A 0 3,-1.7 3,-3.0 -3,-0.2 -1,-0.3 -0.945 76.0-100.5-154.3 158.7 21.9 -6.3 32.1 100 406 A P T 3 S+ 0 0 58 0, 0.0 3,-0.1 0, 0.0 -78,-0.1 0.754 128.3 41.4 -55.8 -24.7 19.2 -7.4 34.5 101 407 A N T 3 S+ 0 0 48 1,-0.2 2,-0.3 -4,-0.0 -79,-0.1 0.079 111.7 62.4-107.7 20.6 21.6 -10.2 35.7 102 408 A L E < +A 99 0A 4 -3,-3.0 -3,-1.7 2,-0.0 -4,-1.3 -0.714 58.2 162.6-151.9 93.5 24.6 -7.9 35.6 103 409 A L E -A 97 0A 60 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.966 15.3-173.0-116.6 108.9 24.5 -5.0 38.0 104 410 A L E -A 96 0A 2 -8,-1.9 -8,-3.2 -2,-0.5 2,-0.2 -0.899 12.8-159.2-114.1 138.4 27.9 -3.4 38.8 105 411 A D >> - 0 0 45 -2,-0.4 3,-0.8 -10,-0.2 4,-0.5 -0.429 45.3 -91.1 -91.0 174.7 28.9 -0.6 41.3 106 412 A R H >> S+ 0 0 100 -12,-0.5 4,-1.0 1,-0.3 3,-0.9 0.806 123.0 61.1 -69.6 -27.1 32.1 1.4 40.9 107 413 A N H >4 S+ 0 0 91 1,-0.2 3,-0.6 2,-0.2 4,-0.5 0.896 99.7 57.2 -68.1 -27.1 34.3 -0.9 42.9 108 414 A Q H <4 S+ 0 0 51 -3,-0.8 3,-0.3 1,-0.2 -1,-0.2 0.679 101.5 58.2 -70.9 -16.2 33.5 -3.7 40.4 109 415 A G H X< S+ 0 0 0 -3,-0.9 3,-2.1 -4,-0.5 7,-0.3 0.816 89.1 70.9 -82.1 -25.1 34.9 -1.4 37.7 110 416 A K T << S+ 0 0 117 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.783 80.0 78.3 -61.5 -25.7 38.2 -1.2 39.5 111 417 A C T 3 S+ 0 0 97 -4,-0.5 2,-0.5 -3,-0.3 -1,-0.3 0.782 91.1 60.2 -52.2 -30.6 38.7 -4.8 38.4 112 418 A V S X> S- 0 0 22 -3,-2.1 3,-2.5 -4,-0.2 4,-0.6 -0.899 99.2-110.2-107.3 127.1 39.6 -3.4 35.0 113 419 A E T 34 S- 0 0 163 -2,-0.5 -2,-0.1 1,-0.3 -3,-0.0 -0.282 99.8 -2.0 -55.6 131.7 42.6 -1.0 34.6 114 420 A G T 3> S+ 0 0 35 -4,-0.1 4,-0.5 1,-0.1 -1,-0.3 0.524 105.8 107.7 64.0 8.5 41.4 2.5 33.8 115 421 A M H X> + 0 0 10 -3,-2.5 4,-2.1 -6,-0.3 3,-0.7 0.863 59.8 68.2 -89.0 -26.7 37.8 1.4 33.8 116 422 A V H 3X S+ 0 0 21 -4,-0.6 4,-2.6 -7,-0.3 5,-0.2 0.820 94.1 60.8 -59.3 -32.0 36.6 3.0 37.1 117 423 A E H 3> S+ 0 0 110 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.901 107.7 44.0 -60.3 -40.1 37.0 6.5 35.5 118 424 A I H S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 4,-1.1 0.927 112.6 49.2 -58.0 -44.5 18.9 11.8 34.4 130 436 A R H ><5S+ 0 0 83 -4,-2.2 3,-0.7 2,-0.2 -1,-0.2 0.931 111.1 48.9 -56.7 -49.5 17.4 10.8 37.7 131 437 A M H 3<5S+ 0 0 147 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.889 113.1 47.2 -65.2 -35.5 17.5 14.3 39.1 132 438 A M H 3<5S- 0 0 12 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.690 106.4-129.3 -78.8 -13.1 16.0 15.7 35.9 133 439 A N T <<5 - 0 0 108 -4,-1.1 -3,-0.2 -3,-0.7 -2,-0.1 0.896 30.7-156.5 67.2 39.1 13.2 13.0 36.0 134 440 A L < - 0 0 6 -5,-2.3 2,-0.3 -6,-0.1 -1,-0.2 -0.219 6.7-137.7 -52.1 132.8 14.0 12.2 32.4 135 441 A Q >> - 0 0 88 -3,-0.1 4,-2.6 1,-0.1 3,-0.8 -0.679 16.7-115.7-102.7 152.5 10.9 10.5 30.8 136 442 A G H 3> S+ 0 0 21 1,-0.3 4,-1.9 -2,-0.3 5,-0.2 0.829 116.7 53.0 -51.1 -39.7 10.8 7.5 28.5 137 443 A E H 3> S+ 0 0 73 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.870 109.9 47.4 -66.7 -37.5 9.5 9.7 25.7 138 444 A E H <> S+ 0 0 11 -3,-0.8 4,-2.8 1,-0.2 -2,-0.2 0.905 107.8 57.2 -72.5 -41.3 12.4 12.2 26.0 139 445 A F H X S+ 0 0 3 -4,-2.6 4,-2.9 1,-0.2 5,-0.3 0.926 105.0 49.0 -54.4 -49.5 14.9 9.4 26.1 140 446 A V H X S+ 0 0 2 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.889 111.2 51.0 -68.3 -29.5 13.9 8.0 22.8 141 447 A C H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.969 111.1 48.4 -64.3 -48.6 14.1 11.4 21.2 142 448 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.921 109.3 52.1 -56.4 -45.3 17.5 12.0 22.7 143 449 A K H X S+ 0 0 8 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.880 110.2 49.1 -61.4 -36.3 18.8 8.6 21.4 144 450 A S H X S+ 0 0 0 -4,-1.7 4,-2.2 -5,-0.3 -1,-0.2 0.886 107.3 54.1 -73.6 -32.8 17.6 9.4 17.9 145 451 A I H X S+ 0 0 12 -4,-2.1 4,-3.0 2,-0.2 5,-0.3 0.878 107.4 52.0 -62.7 -40.4 19.2 12.9 17.9 146 452 A I H X S+ 0 0 2 -4,-1.9 4,-2.4 -5,-0.2 5,-0.3 0.955 108.4 51.5 -61.8 -48.7 22.6 11.2 18.8 147 453 A L H < S+ 0 0 0 -4,-2.0 4,-0.5 1,-0.2 -2,-0.2 0.934 119.7 34.3 -51.2 -51.0 22.1 8.8 15.9 148 454 A L H < S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.822 123.8 42.0 -78.5 -30.4 21.5 11.6 13.4 149 455 A N H >X S+ 0 0 56 -4,-3.0 3,-1.3 -5,-0.2 4,-0.5 0.859 93.7 71.1 -88.3 -39.7 23.8 14.3 14.9 150 456 A S T 3< S+ 0 0 8 -4,-2.4 3,-0.3 -5,-0.3 -1,-0.1 0.836 112.5 26.5 -61.0 -35.4 27.1 12.7 15.9 151 457 A G T >4 S+ 0 0 0 -4,-0.5 3,-1.1 -5,-0.3 -1,-0.3 0.392 93.2 95.6-103.7 5.8 28.4 12.1 12.5 152 458 A V T <4 S+ 0 0 1 -3,-1.3 3,-0.5 1,-0.3 -1,-0.2 0.789 84.1 51.7 -74.1 -18.1 26.7 14.7 10.4 153 459 A Y T 3< S+ 0 0 182 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.608 105.6 55.2 -90.4 -7.8 29.5 17.2 10.6 154 460 A T < + 0 0 79 -3,-1.1 2,-0.5 -4,-0.1 -1,-0.2 0.163 61.1 130.0-116.3 16.8 32.2 14.8 9.4 155 461 A F - 0 0 18 -3,-0.5 -87,-0.0 -4,-0.2 -3,-0.0 -0.645 53.6-144.5 -65.0 123.5 31.0 13.5 6.1 156 462 A L + 0 0 157 -2,-0.5 -1,-0.1 2,-0.0 0, 0.0 0.942 67.3 40.9 -50.9 -91.9 34.1 14.2 4.0 157 463 A S - 0 0 84 -3,-0.1 -2,-0.0 1,-0.1 0, 0.0 0.177 65.2-141.9 -60.7 170.0 33.0 15.2 0.5 158 464 A S + 0 0 70 4,-0.0 -1,-0.1 5,-0.0 -2,-0.0 -0.488 33.8 161.0-142.8 63.2 30.2 17.5 -0.5 159 465 A T > - 0 0 72 1,-0.1 4,-1.5 4,-0.0 5,-0.1 -0.129 58.9 -99.9 -63.8 172.5 28.7 16.1 -3.6 160 466 A L H > S+ 0 0 128 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.929 128.2 51.9 -62.6 -42.8 25.2 17.2 -4.6 161 467 A K H > S+ 0 0 131 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.866 108.7 48.9 -57.3 -46.7 24.0 14.0 -3.0 162 468 A S H > S+ 0 0 10 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.780 108.9 52.8 -68.9 -31.1 25.8 14.6 0.2 163 469 A L H X S+ 0 0 86 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.943 109.6 49.1 -70.8 -43.4 24.5 18.2 0.5 164 470 A E H X S+ 0 0 119 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.859 109.1 53.5 -59.5 -39.7 21.0 16.8 0.1 165 471 A E H X S+ 0 0 18 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.931 108.5 48.9 -62.7 -46.3 21.7 14.2 2.8 166 472 A K H X S+ 0 0 65 -4,-2.1 4,-2.1 1,-0.2 5,-0.2 0.908 109.4 52.1 -62.4 -42.4 22.8 16.9 5.3 167 473 A D H X S+ 0 0 86 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.918 110.8 48.1 -59.0 -43.3 19.7 19.0 4.6 168 474 A H H X S+ 0 0 28 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.941 110.2 51.0 -60.7 -50.7 17.4 16.0 5.3 169 475 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.885 109.9 49.5 -56.6 -39.0 19.2 15.1 8.5 170 476 A H H X S+ 0 0 68 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.887 109.5 54.0 -71.3 -30.4 18.9 18.6 9.8 171 477 A R H X S+ 0 0 92 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.903 109.0 46.3 -67.4 -40.6 15.3 18.5 8.9 172 478 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.928 110.1 53.9 -68.1 -41.5 14.7 15.4 10.9 173 479 A L H X S+ 0 0 18 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.904 106.9 53.1 -54.3 -43.7 16.6 16.8 13.8 174 480 A D H X S+ 0 0 105 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.853 108.6 49.0 -60.7 -40.7 14.3 19.8 13.7 175 481 A K H X S+ 0 0 37 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.907 108.6 52.0 -69.4 -39.9 11.3 17.6 13.9 176 482 A I H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.863 109.6 51.9 -63.8 -29.8 12.7 15.7 16.8 177 483 A T H X S+ 0 0 42 -4,-1.8 4,-2.5 -5,-0.2 5,-0.2 0.954 108.3 49.6 -65.9 -49.2 13.2 19.1 18.4 178 484 A D H X S+ 0 0 95 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.902 110.6 52.2 -52.2 -43.5 9.5 19.9 17.7 179 485 A T H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.895 108.1 49.1 -63.4 -44.8 8.6 16.6 19.3 180 486 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.902 113.3 47.0 -62.8 -41.7 10.6 17.2 22.5 181 487 A I H X S+ 0 0 47 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.914 110.3 53.9 -68.6 -35.4 9.0 20.6 22.9 182 488 A H H X S+ 0 0 69 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.861 108.1 49.9 -66.5 -33.9 5.6 19.1 22.2 183 489 A L H X S+ 0 0 11 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.946 110.1 48.7 -68.7 -44.3 6.0 16.6 25.0 184 490 A M H <>S+ 0 0 2 -4,-2.1 5,-2.4 1,-0.2 4,-0.3 0.901 111.4 51.3 -62.6 -37.0 7.1 19.1 27.6 185 491 A A H ><5S+ 0 0 44 -4,-2.0 3,-1.4 2,-0.2 -1,-0.2 0.917 109.4 48.1 -66.0 -43.8 4.1 21.3 26.7 186 492 A K H 3<5S+ 0 0 136 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.908 106.3 59.7 -64.2 -33.5 1.7 18.5 27.0 187 493 A A T 3<5S- 0 0 77 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.561 122.8-109.9 -70.9 -10.6 3.4 17.7 30.3 188 494 A G T < 5 + 0 0 58 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.559 63.3 152.3 96.5 5.7 2.4 21.2 31.4 189 495 A L < - 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0 0 60 -2,-2.4 2,-0.1 -3,-0.2 -3,-0.1 -0.488 36.3-127.0 -85.5 155.9 20.5 -6.4 3.8 241 547 A H - 0 0 106 -2,-0.2 3,-0.2 1,-0.1 -1,-0.1 -0.385 16.2-128.1 -81.4 175.9 18.6 -8.1 1.0 242 548 A R S > S+ 0 0 225 1,-0.1 3,-1.2 -2,-0.1 -1,-0.1 0.101 78.7 107.3-113.1 22.6 14.8 -8.1 0.9 243 549 A L T 3 S+ 0 0 138 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.793 74.8 54.3 -70.4 -32.5 14.6 -11.9 0.5 244 550 A H T 3 0 0 170 -3,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.053 360.0 360.0 -91.7 27.3 13.3 -12.5 4.0 245 551 A A < 0 0 125 -3,-1.2 -2,-0.1 0, 0.0 -1,-0.1 0.960 360.0 360.0 -74.5 360.0 10.5 -10.0 3.4