==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR RECEPTOR 12-JAN-05 1YIN . COMPND 2 MOLECULE: ESTROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.M.FITZGERALD,N.SHARMA . 241 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13102.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 73.4 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 2.1 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 . 8 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 56.8 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 1 0 0 1 0 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 27 0, 0.0 174,-0.2 0, 0.0 175,-0.1 0.000 360.0 360.0 360.0 38.6 9.3 13.1 10.2 2 308 A L + 0 0 94 173,-0.1 3,-0.0 3,-0.0 170,-0.0 0.301 360.0 23.0-158.9 -29.7 8.2 16.3 8.4 3 309 A S S S+ 0 0 130 2,-0.1 2,-0.4 0, 0.0 0, 0.0 -0.034 107.1 97.9-129.4 19.5 4.5 15.5 7.8 4 310 A L S S- 0 0 57 1,-0.1 5,-0.1 2,-0.0 0, 0.0 -0.950 78.6-123.7-105.0 123.9 4.6 13.0 10.7 5 311 A T > - 0 0 75 -2,-0.4 4,-2.7 1,-0.1 5,-0.1 -0.052 20.5-108.4 -68.2 175.4 3.2 14.5 13.9 6 312 A A H > S+ 0 0 10 2,-0.2 4,-3.2 1,-0.2 5,-0.1 0.874 124.5 48.7 -71.3 -38.0 5.2 14.6 17.1 7 313 A D H > S+ 0 0 73 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.711 111.5 53.5 -73.1 -18.8 3.0 12.0 18.7 8 314 A Q H > S+ 0 0 93 2,-0.2 4,-1.9 3,-0.1 -2,-0.2 0.885 110.7 43.9 -76.5 -48.2 3.7 10.1 15.5 9 315 A M H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.982 113.7 51.0 -60.6 -51.2 7.4 10.4 15.8 10 316 A V H X S+ 0 0 8 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.848 109.2 51.3 -56.0 -40.3 7.3 9.6 19.5 11 317 A S H X S+ 0 0 63 -4,-1.2 4,-1.3 2,-0.2 -1,-0.2 0.875 107.4 50.4 -66.1 -45.7 5.2 6.4 18.9 12 318 A A H X S+ 0 0 32 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.920 113.5 48.8 -54.9 -42.1 7.5 5.0 16.2 13 319 A L H X S+ 0 0 0 -4,-1.9 4,-0.7 2,-0.2 -2,-0.2 0.906 108.1 49.1 -69.2 -50.1 10.4 5.5 18.5 14 320 A L H < S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.768 116.1 48.2 -59.1 -28.6 9.0 3.9 21.7 15 321 A D H < S+ 0 0 104 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.776 105.4 55.9 -83.6 -31.1 8.1 1.0 19.4 16 322 A A H < S+ 0 0 7 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.514 78.2 132.9 -79.5 -6.3 11.5 0.8 17.8 17 323 A E < - 0 0 61 -4,-0.7 -3,-0.1 -3,-0.1 34,-0.0 -0.152 58.3-121.4 -52.4 131.5 13.2 0.3 21.2 18 324 A P - 0 0 41 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.279 31.2-100.2 -70.4 162.3 15.7 -2.5 21.3 19 325 A P - 0 0 69 0, 0.0 2,-0.4 0, 0.0 31,-0.0 -0.365 32.7-108.8 -79.1 162.0 15.2 -5.4 23.8 20 326 A I - 0 0 113 -2,-0.1 2,-0.3 79,-0.0 79,-0.1 -0.759 38.6-150.5 -91.4 134.7 17.1 -5.7 27.0 21 327 A L - 0 0 33 -2,-0.4 2,-0.2 77,-0.2 26,-0.0 -0.737 5.1-126.7-111.4 159.6 19.7 -8.4 26.9 22 328 A Y - 0 0 139 -2,-0.3 2,-0.3 77,-0.2 77,-0.0 -0.581 26.6-110.3 -94.4 153.3 21.1 -10.7 29.6 23 329 A S - 0 0 6 -2,-0.2 2,-0.9 1,-0.1 17,-0.1 -0.621 33.3-126.6 -79.5 142.6 24.8 -11.2 30.3 24 330 A E + 0 0 134 -2,-0.3 2,-0.3 15,-0.3 18,-0.1 -0.739 60.1 107.5-100.1 114.3 25.9 -14.7 29.3 25 331 A Y S S- 0 0 65 -2,-0.9 -2,-0.1 9,-0.0 9,-0.0 -0.887 73.4 -92.7-171.3 146.3 27.7 -16.6 32.1 26 332 A D > - 0 0 99 -2,-0.3 3,-1.3 1,-0.2 -2,-0.1 -0.535 25.4-158.4 -72.3 117.5 26.7 -19.6 34.3 27 333 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.361 89.3 66.8 -75.8 6.3 25.2 -18.2 37.5 28 334 A T T 3 S+ 0 0 119 2,-0.1 -2,-0.1 0, 0.0 0, 0.0 0.609 93.2 68.9 -97.8 -18.0 26.0 -21.6 39.1 29 335 A R S < S- 0 0 44 -3,-1.3 5,-0.0 1,-0.2 -4,-0.0 -0.701 95.4 -91.1 -99.4 155.0 29.8 -21.0 38.9 30 336 A P - 0 0 85 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.070 24.3-125.5 -57.3 169.1 31.7 -18.3 40.9 31 337 A F S > S+ 0 0 82 1,-0.2 3,-2.4 2,-0.1 -2,-0.0 0.779 97.8 75.2 -89.0 -29.2 32.4 -14.8 39.7 32 338 A S T 3 S+ 0 0 122 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.762 96.3 53.4 -57.6 -24.7 36.2 -14.8 40.1 33 339 A E T 3 S+ 0 0 158 -3,-0.1 2,-0.9 1,-0.1 -1,-0.3 0.535 88.0 92.7 -85.1 -10.9 36.3 -16.9 36.9 34 340 A A S < S- 0 0 25 -3,-2.4 -1,-0.1 -4,-0.1 2,-0.1 -0.785 73.3-138.1 -97.3 102.5 34.2 -14.5 34.8 35 341 A S > - 0 0 81 -2,-0.9 4,-2.6 1,-0.2 5,-0.1 -0.314 11.5-154.7 -51.4 121.0 36.3 -12.0 32.9 36 342 A M H > S+ 0 0 20 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.967 92.8 48.9 -69.8 -46.9 34.3 -8.8 33.3 37 343 A M H > S+ 0 0 45 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.884 112.2 50.0 -61.6 -34.4 35.6 -7.2 30.1 38 344 A G H > S+ 0 0 27 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.956 113.0 47.2 -60.5 -50.8 34.8 -10.4 28.3 39 345 A L H X S+ 0 0 14 -4,-2.6 4,-1.3 1,-0.2 -15,-0.3 0.911 117.4 42.0 -50.6 -52.8 31.4 -10.2 29.9 40 346 A L H X S+ 0 0 21 -4,-3.5 4,-2.2 2,-0.2 -1,-0.2 0.818 115.1 50.7 -69.3 -36.3 31.0 -6.5 28.9 41 347 A T H X S+ 0 0 55 -4,-2.9 4,-2.1 -5,-0.3 -2,-0.2 0.908 109.1 48.2 -71.4 -44.4 32.5 -6.9 25.5 42 348 A N H X S+ 0 0 105 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.862 114.0 50.2 -63.7 -33.1 30.3 -9.8 24.4 43 349 A L H X S+ 0 0 3 -4,-1.3 4,-2.2 -5,-0.3 -2,-0.2 0.935 108.8 49.8 -67.8 -51.3 27.2 -7.8 25.7 44 350 A A H X S+ 0 0 24 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.903 112.4 49.2 -54.0 -44.1 28.1 -4.7 23.8 45 351 A D H X S+ 0 0 90 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.931 109.5 50.0 -66.8 -43.4 28.5 -6.8 20.7 46 352 A R H X S+ 0 0 66 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.830 111.1 51.5 -62.1 -32.1 25.2 -8.5 21.1 47 353 A E H X S+ 0 0 42 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.802 99.5 63.8 -73.4 -32.3 23.6 -5.1 21.6 48 354 A L H X S+ 0 0 9 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.915 98.7 53.0 -60.5 -46.1 25.1 -3.6 18.4 49 355 A V H X S+ 0 0 77 -4,-1.2 4,-1.4 1,-0.2 3,-0.3 0.952 112.0 46.0 -52.8 -50.4 23.2 -6.0 16.2 50 356 A H H X S+ 0 0 71 -4,-1.0 4,-1.7 1,-0.2 -1,-0.2 0.866 107.2 59.8 -63.2 -32.8 20.0 -5.0 17.8 51 357 A M H X S+ 0 0 8 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.865 99.4 55.9 -66.2 -33.6 21.1 -1.3 17.5 52 358 A I H X S+ 0 0 3 -4,-2.1 4,-1.8 -3,-0.3 -1,-0.2 0.947 106.9 49.2 -63.5 -40.5 21.3 -1.6 13.7 53 359 A N H < S+ 0 0 96 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.888 110.6 51.3 -66.5 -33.7 17.7 -2.7 13.5 54 360 A W H >< S+ 0 0 3 -4,-1.7 3,-1.5 1,-0.2 4,-0.3 0.940 106.1 54.5 -62.4 -47.6 16.6 0.1 15.8 55 361 A A H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.786 102.2 56.6 -61.3 -36.7 18.4 2.7 13.6 56 362 A K T 3< S+ 0 0 77 -4,-1.8 -1,-0.3 1,-0.2 6,-0.3 0.688 106.1 53.4 -69.1 -13.4 16.5 1.5 10.6 57 363 A R T < S+ 0 0 139 -3,-1.5 -2,-0.2 -4,-0.4 -1,-0.2 0.588 83.2 102.8 -99.8 0.4 13.4 2.3 12.5 58 364 A V S X S- 0 0 2 -3,-0.9 3,-2.5 -4,-0.3 4,-0.5 -0.698 88.9 -98.6 -80.3 122.7 14.4 5.9 13.4 59 365 A P T 3 S+ 0 0 22 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.115 102.7 5.6 -49.0 125.5 12.4 8.3 11.1 60 366 A G T > S+ 0 0 13 -4,-0.1 3,-0.9 4,-0.0 4,-0.3 0.130 98.4 106.2 89.4 -14.4 14.5 9.5 8.2 61 367 A F G X S+ 0 0 0 -3,-2.5 3,-1.6 1,-0.2 -5,-0.1 0.944 79.6 46.6 -63.4 -44.4 17.4 7.2 8.8 62 368 A V G 3 S+ 0 0 67 -4,-0.5 -1,-0.2 1,-0.3 -6,-0.1 0.528 96.8 70.7 -83.0 2.8 16.8 4.8 6.0 63 369 A D G < S+ 0 0 122 -3,-0.9 -1,-0.3 2,-0.1 -2,-0.2 0.540 87.0 91.1 -87.3 -2.6 16.2 7.5 3.4 64 370 A L S < S- 0 0 9 -3,-1.6 -4,-0.0 -4,-0.3 5,-0.0 -0.449 92.3 -95.0 -79.1 155.2 19.9 8.1 3.8 65 371 A T > - 0 0 34 -2,-0.1 4,-1.8 1,-0.1 -1,-0.2 -0.255 34.7-111.1 -63.6 161.0 22.4 6.4 1.5 66 372 A L H > S+ 0 0 52 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.926 118.1 52.7 -57.2 -47.2 24.1 3.2 2.8 67 373 A H H > S+ 0 0 105 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.944 109.9 48.5 -57.3 -45.9 27.5 4.9 3.2 68 374 A D H > S+ 0 0 11 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.836 110.2 51.2 -68.3 -30.5 25.9 7.7 5.2 69 375 A Q H X S+ 0 0 12 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.921 110.7 48.6 -67.2 -45.7 24.1 5.2 7.5 70 376 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.937 112.7 49.0 -58.8 -46.0 27.3 3.3 8.1 71 377 A H H X S+ 0 0 26 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.909 109.3 50.2 -63.4 -43.1 29.2 6.5 8.9 72 378 A L H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.951 115.3 43.7 -63.5 -42.8 26.6 7.8 11.3 73 379 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.886 109.7 55.3 -67.7 -38.2 26.5 4.6 13.2 74 380 A E H < S+ 0 0 77 -4,-2.7 4,-0.2 1,-0.2 -1,-0.2 0.861 113.4 44.0 -63.7 -33.3 30.3 4.2 13.2 75 381 A C H < S+ 0 0 47 -4,-2.0 -1,-0.2 -5,-0.2 4,-0.2 0.812 125.5 29.8 -79.3 -29.3 30.5 7.6 14.8 76 382 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.2 3,-0.3 0.565 82.3 103.1-112.1 -5.9 27.7 7.1 17.3 77 383 A W H X S+ 0 0 32 -4,-2.5 4,-2.1 1,-0.3 5,-0.1 0.832 88.4 44.1 -52.5 -43.7 27.6 3.4 18.3 78 384 A L H > S+ 0 0 14 -4,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.898 112.3 51.9 -72.7 -37.2 29.3 3.9 21.7 79 385 A E H > S+ 0 0 4 -3,-0.3 4,-2.5 -4,-0.2 5,-0.2 0.891 111.3 48.9 -59.1 -39.1 27.3 7.0 22.6 80 386 A I H X S+ 0 0 8 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.890 111.4 48.5 -71.4 -40.1 24.1 5.1 21.9 81 387 A L H X S+ 0 0 16 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.954 113.6 48.0 -59.9 -50.1 25.2 2.1 23.9 82 388 A M H X S+ 0 0 15 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.879 108.7 50.1 -66.2 -39.2 26.2 4.4 26.8 83 389 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.924 112.6 50.3 -68.6 -30.5 23.0 6.5 26.9 84 390 A G H X S+ 0 0 11 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.951 110.6 48.0 -63.6 -47.5 21.1 3.2 26.9 85 391 A L H X S+ 0 0 10 -4,-2.8 4,-0.7 1,-0.2 12,-0.4 0.933 113.6 48.5 -56.3 -46.5 23.2 1.9 29.8 86 392 A V H >< S+ 0 0 0 -4,-2.7 3,-0.6 1,-0.2 4,-0.5 0.889 109.5 51.9 -57.6 -50.2 22.7 5.1 31.7 87 393 A W H >< S+ 0 0 76 -4,-2.7 3,-1.3 1,-0.3 4,-0.3 0.933 110.0 47.5 -57.9 -47.6 18.9 5.2 31.1 88 394 A R H 3< S+ 0 0 45 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.705 109.8 53.8 -77.3 -7.9 18.4 1.7 32.4 89 395 A S T X< S+ 0 0 0 -4,-0.7 3,-2.0 -3,-0.6 6,-0.3 0.483 78.8 104.6 -99.3 0.9 20.5 2.4 35.5 90 396 A M T < S+ 0 0 19 -3,-1.3 -1,-0.1 -4,-0.5 -2,-0.1 0.904 83.1 40.2 -46.4 -58.0 18.5 5.4 36.4 91 397 A E T 3 S+ 0 0 162 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.045 102.6 80.4 -85.7 34.6 16.6 3.8 39.3 92 398 A H S X S- 0 0 61 -3,-2.0 3,-2.5 3,-0.2 -1,-0.2 -0.446 75.2-153.1-136.5 65.1 19.7 2.0 40.5 93 399 A P T 3 S+ 0 0 86 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 0.004 77.2 3.7 -47.6 130.0 21.8 4.5 42.5 94 400 A G T 3 S+ 0 0 45 1,-0.2 12,-0.5 29,-0.2 2,-0.4 0.490 116.0 97.8 74.8 0.1 25.5 3.9 42.5 95 401 A K < - 0 0 82 -3,-2.5 2,-0.6 -6,-0.3 10,-0.3 -0.923 63.7-145.0-123.7 148.2 25.0 0.9 40.2 96 402 A L E -A 104 0A 0 8,-4.5 8,-2.8 -2,-0.4 2,-1.3 -0.936 14.8-149.0-104.2 122.7 25.3 0.4 36.4 97 403 A L E +A 103 0A 25 -2,-0.6 6,-0.2 -12,-0.4 -7,-0.1 -0.684 29.3 162.5 -94.6 85.0 22.7 -2.0 35.1 98 404 A F E S- 0 0 24 4,-1.4 -77,-0.2 -2,-1.3 -1,-0.2 0.842 75.7 -9.0 -66.4 -40.0 24.6 -3.6 32.2 99 405 A A E > S-A 102 0A 0 3,-1.6 3,-2.3 -3,-0.2 -1,-0.3 -0.956 78.2-100.8-151.0 160.2 22.2 -6.5 32.1 100 406 A P T 3 S+ 0 0 58 0, 0.0 3,-0.1 0, 0.0 -78,-0.1 0.805 129.0 38.4 -55.6 -31.1 19.3 -7.6 34.4 101 407 A N T 3 S+ 0 0 55 1,-0.2 2,-0.3 -4,-0.0 -79,-0.1 0.185 112.3 65.9-104.8 16.0 21.7 -10.2 35.9 102 408 A L E < +A 99 0A 3 -3,-2.3 -3,-1.6 2,-0.0 -4,-1.4 -0.688 56.8 158.0-139.3 84.3 24.7 -7.9 35.7 103 409 A L E -A 97 0A 53 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.932 21.1-174.7-108.1 115.1 24.3 -4.9 38.1 104 410 A L E -A 96 0A 3 -8,-2.8 -8,-4.5 -2,-0.6 2,-0.2 -0.880 18.2-154.3-123.4 149.2 27.7 -3.4 39.0 105 411 A D >> - 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0 0 105 -4,-1.5 -3,-0.2 -5,-0.2 -4,-0.1 0.925 28.2-155.5 61.1 48.6 13.5 12.8 36.0 134 440 A L < - 0 0 4 -5,-2.3 2,-0.3 -6,-0.1 -1,-0.1 -0.299 5.1-138.1 -53.9 138.0 14.1 12.1 32.4 135 441 A Q > - 0 0 80 -3,-0.1 4,-2.6 1,-0.1 3,-0.4 -0.691 17.0-117.8-100.0 153.0 11.1 10.4 30.7 136 442 A G H > S+ 0 0 17 -2,-0.3 4,-2.1 1,-0.2 5,-0.3 0.854 116.4 56.7 -56.2 -38.2 11.1 7.5 28.2 137 443 A E H > S+ 0 0 64 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.935 112.7 41.6 -59.2 -43.5 9.5 9.7 25.6 138 444 A E H > S+ 0 0 11 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.882 110.4 56.5 -65.9 -47.4 12.4 12.2 26.0 139 445 A F H X S+ 0 0 3 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.844 105.5 50.3 -61.8 -38.8 15.1 9.5 26.2 140 446 A V H X S+ 0 0 3 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.875 110.2 50.7 -72.1 -33.4 14.2 8.0 22.8 141 447 A C H X S+ 0 0 0 -4,-1.1 4,-1.9 -5,-0.3 -2,-0.2 0.938 109.0 51.8 -63.7 -45.4 14.3 11.4 21.2 142 448 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.917 108.7 50.8 -55.9 -43.5 17.7 12.0 22.7 143 449 A K H X S+ 0 0 9 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.930 108.4 50.8 -65.0 -42.2 19.0 8.7 21.3 144 450 A S H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.860 108.5 53.1 -63.1 -34.7 17.7 9.5 17.8 145 451 A I H X S+ 0 0 14 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.871 106.6 52.6 -67.3 -40.0 19.5 12.9 18.0 146 452 A I H X S+ 0 0 1 -4,-2.0 4,-1.9 1,-0.2 5,-0.2 0.921 109.9 48.6 -61.0 -46.9 22.8 11.2 18.9 147 453 A L H < S+ 0 0 0 -4,-2.2 4,-0.5 1,-0.2 -2,-0.2 0.953 118.9 38.8 -56.7 -46.0 22.5 8.9 15.9 148 454 A L H < S+ 0 0 3 -4,-2.1 4,-0.4 -5,-0.2 -2,-0.2 0.840 122.1 39.0 -79.3 -28.4 21.7 11.7 13.5 149 455 A N H X S+ 0 0 53 -4,-2.6 4,-0.6 -5,-0.2 -3,-0.2 0.756 95.5 71.8 -94.8 -28.1 24.0 14.4 14.9 150 456 A S T < S+ 0 0 5 -4,-1.9 -1,-0.1 -5,-0.3 3,-0.1 0.866 113.2 24.4 -71.8 -28.9 27.2 12.8 15.9 151 457 A G T >4 S+ 0 0 0 -4,-0.5 3,-3.1 -5,-0.2 -1,-0.2 0.611 93.8 97.4-104.4 -13.3 28.6 12.1 12.4 152 458 A V G >4 S+ 0 0 1 -4,-0.4 3,-0.7 1,-0.3 -2,-0.1 0.788 88.8 45.3 -51.0 -31.7 26.7 14.7 10.4 153 459 A Y G 3< S+ 0 0 182 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.570 103.1 65.2 -92.6 -0.8 29.6 17.1 10.5 154 460 A T G < + 0 0 62 -3,-3.1 2,-1.7 1,-0.1 -1,-0.2 0.207 64.4 111.4-102.4 18.3 32.1 14.3 9.6 155 461 A F < - 0 0 12 -3,-0.7 -1,-0.1 -4,-0.2 11,-0.1 -0.663 56.9-172.2 -81.7 77.0 30.5 13.9 6.2 156 462 A L + 0 0 152 -2,-1.7 -1,-0.2 2,-0.0 0, 0.0 0.866 51.0 45.4 -38.9 -83.9 33.7 15.4 4.7 157 463 A S - 0 0 85 -3,-0.1 2,-0.1 1,-0.1 0, 0.0 0.102 69.5-140.7 -64.5 172.5 33.1 16.0 1.0 158 464 A S + 0 0 63 4,-0.1 -1,-0.1 5,-0.0 -2,-0.0 -0.521 27.0 163.1-149.0 74.9 30.1 17.6 -0.6 159 465 A T > - 0 0 84 -2,-0.1 4,-1.6 1,-0.1 5,-0.2 -0.228 61.6 -93.8 -68.8 174.9 28.8 16.2 -3.8 160 466 A L H > S+ 0 0 132 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.949 129.1 51.9 -60.5 -42.9 25.3 17.2 -4.7 161 467 A K H > S+ 0 0 132 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.862 107.1 50.3 -57.8 -43.4 24.0 14.0 -3.0 162 468 A S H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.844 107.2 54.7 -69.5 -32.7 25.9 14.6 0.3 163 469 A L H X S+ 0 0 87 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.885 108.4 48.9 -68.2 -36.8 24.6 18.1 0.5 164 470 A E H X S+ 0 0 106 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.869 106.5 56.9 -70.0 -36.5 21.1 16.8 0.3 165 471 A E H X S+ 0 0 16 -4,-2.0 4,-3.3 2,-0.2 -2,-0.2 0.959 109.3 46.2 -53.7 -50.1 21.9 14.2 2.9 166 472 A K H X S+ 0 0 56 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.927 112.1 49.5 -64.0 -45.4 22.8 17.0 5.3 167 473 A D H X S+ 0 0 96 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.945 113.3 47.3 -56.9 -50.2 19.8 19.1 4.5 168 474 A H H X S+ 0 0 34 -4,-3.1 4,-2.2 1,-0.2 5,-0.2 0.953 112.3 50.4 -55.4 -50.1 17.6 16.1 5.0 169 475 A I H X S+ 0 0 1 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.890 109.5 47.5 -61.4 -41.7 19.3 15.2 8.3 170 476 A H H X S+ 0 0 68 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.875 109.8 56.5 -68.0 -28.6 19.1 18.7 9.8 171 477 A R H X S+ 0 0 91 -4,-1.9 4,-2.3 -5,-0.3 -2,-0.2 0.930 108.2 46.1 -63.5 -44.3 15.4 18.7 8.8 172 478 A V H X S+ 0 0 2 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.898 110.4 53.0 -68.6 -34.8 14.9 15.5 10.8 173 479 A L H X S+ 0 0 18 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.950 107.4 52.9 -65.4 -41.0 16.8 16.9 13.7 174 480 A D H X S+ 0 0 101 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.899 107.9 49.3 -58.9 -46.2 14.5 20.0 13.6 175 481 A K H X S+ 0 0 36 -4,-2.3 4,-1.9 -174,-0.2 -1,-0.2 0.866 108.6 54.0 -66.2 -28.0 11.3 17.9 13.7 176 482 A I H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.886 106.8 51.3 -72.1 -29.9 12.8 15.9 16.7 177 483 A T H X S+ 0 0 43 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.898 108.8 52.1 -63.2 -40.9 13.3 19.2 18.5 178 484 A D H X S+ 0 0 95 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.888 108.4 51.0 -63.0 -38.7 9.7 20.0 17.7 179 485 A T H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.859 109.6 49.5 -66.2 -42.0 8.8 16.6 19.2 180 486 A L H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.925 110.9 48.5 -67.0 -42.2 10.7 17.2 22.4 181 487 A I H X S+ 0 0 46 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.902 111.3 50.8 -65.2 -36.0 9.2 20.7 23.0 182 488 A H H X S+ 0 0 70 -4,-1.8 4,-3.3 2,-0.2 5,-0.3 0.900 106.5 53.9 -67.8 -40.1 5.7 19.3 22.4 183 489 A L H X S+ 0 0 12 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.913 112.6 44.9 -57.0 -39.1 6.2 16.5 24.9 184 490 A M H <>S+ 0 0 3 -4,-1.7 5,-2.2 2,-0.2 4,-0.3 0.887 113.3 49.6 -72.5 -39.5 7.2 19.1 27.4 185 491 A A H ><5S+ 0 0 42 -4,-2.3 3,-0.9 2,-0.2 -2,-0.2 0.860 110.2 49.9 -65.7 -43.7 4.3 21.4 26.5 186 492 A K H 3<5S+ 0 0 119 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.938 106.2 58.4 -63.1 -39.2 1.9 18.5 26.8 187 493 A A T 3<5S- 0 0 78 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.625 120.0-111.2 -67.9 -11.1 3.4 17.8 30.2 188 494 A G T < 5 + 0 0 55 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.633 63.7 148.4 96.8 5.9 2.5 21.3 31.3 189 495 A L < - 0 0 56 -5,-2.2 -1,-0.2 1,-0.1 2,-0.2 -0.272 49.9-107.4 -62.0 165.8 5.9 23.0 31.6 190 496 A T > - 0 0 72 1,-0.1 4,-3.7 4,-0.0 5,-0.2 -0.554 30.3-100.6 -87.1 164.5 5.9 26.7 30.9 191 497 A L H > S+ 0 0 136 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.917 127.3 44.3 -44.2 -55.7 7.4 28.3 27.7 192 498 A Q H > S+ 0 0 118 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.902 112.7 51.1 -59.2 -44.2 10.5 29.2 29.7 193 499 A Q H > S+ 0 0 87 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.909 107.3 56.9 -62.9 -38.2 10.6 25.8 31.4 194 500 A Q H X S+ 0 0 23 -4,-3.7 4,-2.8 1,-0.2 -2,-0.2 0.979 111.5 38.1 -55.6 -57.5 10.4 24.2 28.0 195 501 A H H X S+ 0 0 106 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.912 116.3 53.2 -69.9 -31.6 13.4 25.9 26.5 196 502 A Q H X S+ 0 0 82 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.911 111.7 46.1 -64.5 -38.0 15.3 25.6 29.7 197 503 A R H X S+ 0 0 37 -4,-3.0 4,-1.7 -5,-0.2 -2,-0.2 0.882 108.7 55.9 -74.5 -30.9 14.6 21.9 29.8 198 504 A L H X S+ 0 0 30 -4,-2.8 4,-2.1 -5,-0.3 5,-0.2 0.950 109.5 46.4 -60.2 -45.5 15.5 21.5 26.1 199 505 A A H X S+ 0 0 51 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.911 108.6 54.1 -65.6 -42.7 18.9 23.0 26.8 200 506 A Q H X S+ 0 0 67 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.879 111.4 47.4 -59.4 -36.2 19.6 20.9 29.9 201 507 A L H X S+ 0 0 0 -4,-1.7 4,-0.7 2,-0.2 -2,-0.2 0.868 112.8 45.7 -73.5 -42.4 18.9 17.8 27.8 202 508 A L H >X S+ 0 0 60 -4,-2.1 4,-0.7 1,-0.2 3,-0.6 0.854 107.8 58.0 -71.6 -34.7 21.1 18.7 24.8 203 509 A L H >X S+ 0 0 114 -4,-2.5 3,-1.0 1,-0.3 4,-0.9 0.863 98.8 58.9 -65.2 -30.2 24.0 19.8 27.0 204 510 A I H >X S+ 0 0 9 -4,-0.9 4,-1.5 1,-0.3 3,-0.7 0.859 94.7 67.7 -63.2 -29.3 24.0 16.3 28.5 205 511 A L H < S+ 0 0 24 -4,-1.3 3,-1.3 -3,-0.4 -2,-0.2 0.881 111.4 58.1 -80.1 -53.0 40.3 2.9 26.6 219 525 A L H 3< S+ 0 0 67 -4,-3.5 -2,-0.2 1,-0.3 -3,-0.2 0.813 117.3 35.4 -50.7 -31.7 38.9 0.4 24.1 220 526 A Y T 3< S+ 0 0 158 -4,-1.5 2,-3.2 -5,-0.2 -1,-0.3 0.501 85.8 106.3-102.9 -2.6 42.0 1.0 22.1 221 527 A S < 0 0 79 -3,-1.3 -1,-0.1 -5,-0.1 -3,-0.1 -0.336 360.0 360.0 -72.4 64.3 44.2 1.4 25.2 222 528 A M 0 0 169 -2,-3.2 -3,-0.0 -3,-0.0 -2,-0.0 -0.869 360.0 360.0-165.0 360.0 45.5 -2.1 24.3 223 ! 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 0.0 224 533 A V 0 0 206 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -52.9 39.8 -7.8 13.3 225 534 A V - 0 0 89 1,-0.1 5,-0.1 0, 0.0 0, 0.0 -0.959 360.0 -94.4-121.7 136.4 37.7 -6.7 10.4 226 535 A P > - 0 0 75 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.021 27.7-122.6 -52.4 162.0 37.1 -2.9 10.3 227 536 A L H > S+ 0 0 46 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.811 110.2 60.8 -80.6 -28.5 33.9 -1.7 12.0 228 537 A Y H > S+ 0 0 62 2,-0.2 4,-4.0 1,-0.2 -1,-0.2 0.931 105.7 48.3 -51.4 -53.2 32.7 0.0 8.8 229 538 A D H > S+ 0 0 67 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.860 112.8 45.5 -61.2 -46.4 32.7 -3.4 7.1 230 539 A L H X S+ 0 0 74 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.946 117.4 45.6 -63.0 -51.1 30.8 -5.1 9.9 231 540 A L H >X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 3,-0.6 0.970 114.2 47.9 -52.6 -56.4 28.4 -2.3 10.1 232 541 A L H 3X S+ 0 0 52 -4,-4.0 4,-2.8 1,-0.3 -1,-0.2 0.857 108.8 54.6 -59.3 -37.9 28.0 -2.1 6.3 233 542 A E H 3< S+ 0 0 155 -4,-2.4 -1,-0.3 2,-0.2 -2,-0.2 0.822 113.8 42.2 -62.0 -36.7 27.5 -5.9 6.1 234 543 A M H << S+ 0 0 49 -4,-1.8 -2,-0.2 -3,-0.6 -1,-0.2 0.862 118.2 44.1 -78.6 -39.7 24.6 -5.6 8.6 235 544 A L H < S+ 0 0 4 -4,-3.1 2,-2.1 1,-0.2 -2,-0.2 0.862 100.9 69.8 -77.0 -33.5 23.1 -2.5 7.2 236 545 A D S < S+ 0 0 100 -4,-2.8 -1,-0.2 -5,-0.3 2,-0.1 -0.477 75.4 161.5 -83.1 67.2 23.3 -3.7 3.6 237 546 A A - 0 0 62 -2,-2.1 2,-0.1 -3,-0.2 -3,-0.1 -0.443 36.2-125.6 -84.5 158.2 20.7 -6.4 4.0 238 547 A H - 0 0 105 -2,-0.1 3,-0.1 1,-0.1 -1,-0.1 -0.330 13.2-129.9 -85.0-175.6 18.9 -8.1 1.2 239 548 A R S > S+ 0 0 230 1,-0.1 3,-1.1 -2,-0.1 -1,-0.1 0.119 79.0 106.1-117.4 19.8 15.1 -8.2 1.1 240 549 A L T 3 S+ 0 0 135 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.769 71.5 61.7 -71.2 -18.8 14.9 -11.9 0.5 241 550 A H T 3 0 0 171 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.005 360.0 360.0-102.4 38.9 13.7 -12.6 4.0 242 551 A A < 0 0 136 -3,-1.1 -1,-0.2 0, 0.0 -2,-0.1 0.909 360.0 360.0 -72.9 360.0 10.5 -10.5 3.6