==== 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 07-OCT-04 1XP1 . COMPND 2 MOLECULE: ESTROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.M.D.FITZGERALD,N.SHARMA . 245 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13247.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 73.5 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 2.4 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 . 25 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 140 57.1 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 1 0 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 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 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 24 0, 0.0 8,-0.1 0, 0.0 7,-0.0 0.000 360.0 360.0 360.0 -29.6 9.4 12.2 9.7 2 308 A L + 0 0 77 1,-0.1 170,-0.0 173,-0.0 3,-0.0 0.398 360.0 23.3-103.1 -6.3 8.9 15.5 7.9 3 309 A S S S+ 0 0 117 2,-0.1 -1,-0.1 0, 0.0 2,-0.1 0.374 98.5 108.3-132.9 -8.9 5.1 15.2 7.8 4 310 A L S S- 0 0 51 1,-0.1 5,-0.0 4,-0.1 0, 0.0 -0.342 74.5-114.8 -57.6 143.7 4.7 12.8 10.7 5 311 A T > - 0 0 64 1,-0.1 4,-1.8 -2,-0.1 5,-0.1 -0.273 21.8-107.9 -78.1 177.5 3.1 14.5 13.7 6 312 A A H > S+ 0 0 16 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.811 126.6 50.2 -69.2 -32.2 4.9 15.1 17.0 7 313 A D H > S+ 0 0 91 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.814 110.0 50.0 -73.0 -30.9 2.6 12.4 18.4 8 314 A Q H > S+ 0 0 99 2,-0.2 4,-2.1 3,-0.2 -2,-0.2 0.795 109.3 50.7 -75.6 -34.5 3.5 10.1 15.5 9 315 A M H X S+ 0 0 1 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.964 111.1 49.4 -66.6 -46.8 7.2 10.6 16.0 10 316 A V H X S+ 0 0 10 -4,-1.8 4,-2.4 1,-0.2 5,-0.2 0.929 115.0 42.9 -57.7 -51.7 6.8 9.8 19.7 11 317 A S H X S+ 0 0 57 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.878 113.0 52.5 -68.0 -32.1 4.9 6.6 19.0 12 318 A A H X S+ 0 0 29 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.961 112.2 46.7 -66.2 -39.3 7.2 5.6 16.2 13 319 A L H < S+ 0 0 1 -4,-2.9 4,-0.5 1,-0.2 -2,-0.2 0.855 112.5 48.2 -67.8 -37.8 10.2 6.0 18.5 14 320 A L H >< S+ 0 0 66 -4,-2.4 3,-1.0 -5,-0.2 -1,-0.2 0.905 110.9 51.9 -67.1 -40.5 8.6 4.1 21.4 15 321 A D H 3< S+ 0 0 100 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.793 107.0 54.9 -65.5 -30.7 7.6 1.3 19.0 16 322 A A T 3< S+ 0 0 4 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.545 75.6 129.2 -82.3 -11.1 11.2 1.1 17.7 17 323 A E < - 0 0 69 -3,-1.0 -3,-0.0 -4,-0.5 123,-0.0 -0.111 56.9-124.7 -50.4 138.9 12.9 0.6 21.2 18 324 A P - 0 0 45 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.303 30.0 -92.6 -79.8 170.4 15.2 -2.4 21.2 19 325 A P - 0 0 67 0, 0.0 2,-0.6 0, 0.0 31,-0.1 -0.442 33.6-111.2 -79.9 158.6 15.0 -5.3 23.7 20 326 A I - 0 0 116 -2,-0.1 2,-0.1 79,-0.0 79,-0.1 -0.801 40.7-153.4 -86.9 118.5 16.8 -5.5 27.0 21 327 A L - 0 0 32 -2,-0.6 2,-0.3 77,-0.2 22,-0.0 -0.477 4.0-126.4 -94.3 162.2 19.4 -8.2 26.7 22 328 A Y - 0 0 135 77,-0.2 2,-0.2 -2,-0.1 -1,-0.0 -0.774 24.1-105.7-106.5 155.7 21.0 -10.4 29.3 23 329 A S - 0 0 8 -2,-0.3 2,-0.8 1,-0.1 17,-0.1 -0.523 32.7-131.1 -70.7 145.9 24.6 -11.1 30.2 24 330 A E + 0 0 146 15,-0.2 2,-0.3 -2,-0.2 -1,-0.1 -0.858 59.1 111.3-107.7 93.9 25.7 -14.5 29.0 25 331 A Y S S- 0 0 75 -2,-0.8 -2,-0.0 9,-0.0 9,-0.0 -0.956 74.0 -93.0-156.7 153.3 27.5 -16.3 31.9 26 332 A D > - 0 0 98 -2,-0.3 3,-1.5 1,-0.2 -2,-0.1 -0.640 28.7-161.1 -80.1 117.1 26.6 -19.3 34.0 27 333 A P T 3 S+ 0 0 106 0, 0.0 -1,-0.2 0, 0.0 4,-0.0 0.400 87.2 66.6 -79.0 1.2 24.9 -18.1 37.2 28 334 A T T 3 S+ 0 0 121 2,-0.1 -2,-0.1 0, 0.0 0, 0.0 0.346 94.7 75.1-101.0 9.5 25.6 -21.3 39.0 29 335 A R S < S- 0 0 46 -3,-1.5 -4,-0.0 1,-0.1 0, 0.0 -0.835 89.4 -94.4-121.8 155.1 29.4 -20.5 38.9 30 336 A P - 0 0 88 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.037 24.2-132.9 -69.4 173.7 31.5 -18.0 40.9 31 337 A F S > S+ 0 0 82 2,-0.1 3,-2.3 1,-0.1 5,-0.0 0.705 91.9 71.7-103.9 -30.9 32.4 -14.5 39.7 32 338 A S T 3 S+ 0 0 121 1,-0.3 -1,-0.1 3,-0.1 4,-0.1 0.743 97.3 58.7 -58.7 -20.6 36.1 -14.1 40.3 33 339 A E T 3 S+ 0 0 160 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.358 88.0 94.3 -89.1 -6.0 36.6 -16.4 37.3 34 340 A A S < S- 0 0 37 -3,-2.3 2,-0.8 -9,-0.0 3,-0.1 -0.683 76.8-127.5 -89.3 146.5 34.7 -14.2 34.9 35 341 A S > - 0 0 54 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 -0.861 17.5-160.1 -85.8 113.4 36.3 -11.7 32.6 36 342 A M H > S+ 0 0 24 -2,-0.8 4,-2.8 1,-0.2 5,-0.2 0.929 94.3 46.9 -60.5 -42.2 34.4 -8.6 33.4 37 343 A M H > S+ 0 0 15 2,-0.2 4,-3.5 1,-0.2 5,-0.2 0.894 111.2 52.5 -65.0 -39.5 35.6 -7.1 30.1 38 344 A G H > S+ 0 0 13 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.919 111.3 46.8 -56.1 -51.5 34.6 -10.3 28.3 39 345 A L H X S+ 0 0 15 -4,-3.0 4,-1.9 2,-0.2 -2,-0.2 0.937 116.5 43.6 -54.7 -50.4 31.2 -10.1 29.8 40 346 A L H X S+ 0 0 21 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.935 114.2 49.7 -68.2 -41.3 30.7 -6.5 28.9 41 347 A T H X S+ 0 0 21 -4,-3.5 4,-2.4 -5,-0.2 5,-0.2 0.923 109.8 50.1 -63.4 -42.2 32.1 -6.9 25.4 42 348 A N H X S+ 0 0 97 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.901 112.0 49.5 -64.5 -38.2 29.9 -9.8 24.6 43 349 A L H X S+ 0 0 4 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.948 111.4 48.1 -59.6 -55.3 26.9 -7.8 25.8 44 350 A A H X S+ 0 0 26 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.865 108.8 53.5 -58.4 -38.4 27.8 -4.8 23.7 45 351 A D H X S+ 0 0 59 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.895 108.8 49.6 -68.6 -33.5 28.4 -6.8 20.6 46 352 A R H X S+ 0 0 68 -4,-1.5 4,-0.9 1,-0.2 3,-0.4 0.872 107.4 55.5 -72.2 -31.9 24.9 -8.5 20.9 47 353 A E H X S+ 0 0 38 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.819 94.1 70.0 -66.6 -30.0 23.3 -5.1 21.3 48 354 A L H X S+ 0 0 19 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.899 94.6 52.6 -63.3 -36.0 24.8 -3.8 18.1 49 355 A V H X S+ 0 0 74 -4,-0.8 4,-1.7 -3,-0.4 -1,-0.2 0.947 111.8 45.9 -64.6 -42.6 22.6 -6.0 15.9 50 356 A H H X S+ 0 0 62 -4,-0.9 4,-2.7 1,-0.2 -1,-0.2 0.833 107.3 60.0 -65.6 -29.3 19.5 -4.7 17.7 51 357 A M H X S+ 0 0 11 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.903 103.8 49.2 -66.8 -38.9 20.8 -1.1 17.4 52 358 A I H X S+ 0 0 5 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.939 111.3 50.6 -64.3 -40.7 20.9 -1.4 13.6 53 359 A N H X S+ 0 0 83 -4,-1.7 4,-0.7 -5,-0.2 -2,-0.2 0.963 112.1 47.0 -57.6 -51.5 17.3 -2.7 13.7 54 360 A W H >X S+ 0 0 8 -4,-2.7 3,-1.7 1,-0.2 4,-0.6 0.941 108.3 54.3 -57.9 -47.3 16.3 0.2 15.9 55 361 A A H >< S+ 0 0 0 -4,-2.9 3,-1.4 1,-0.3 6,-0.2 0.902 101.8 58.5 -60.0 -37.5 18.0 2.8 13.7 56 362 A K H 3< S+ 0 0 77 -4,-1.9 6,-0.3 1,-0.3 -1,-0.3 0.741 105.5 52.0 -64.4 -18.1 16.2 1.6 10.6 57 363 A R H << S+ 0 0 143 -3,-1.7 -1,-0.3 -4,-0.7 -2,-0.2 0.517 81.9 105.6 -98.6 -3.9 12.9 2.4 12.5 58 364 A V S XX S- 0 0 2 -3,-1.4 3,-1.8 -4,-0.6 4,-0.5 -0.611 88.9-102.1 -69.9 125.2 13.9 5.9 13.4 59 365 A P T 34 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.294 102.9 10.4 -53.6 121.7 11.9 8.2 11.1 60 366 A G T >> S+ 0 0 6 -4,-0.1 3,-0.8 -2,-0.1 4,-0.5 0.063 97.6 102.6 101.7 -24.6 14.1 9.4 8.2 61 367 A F G X4 S+ 0 0 0 -3,-1.8 3,-1.7 1,-0.2 -5,-0.1 0.951 80.9 46.9 -60.4 -51.8 17.1 7.2 8.8 62 368 A V G 3< S+ 0 0 72 -4,-0.5 -1,-0.2 -6,-0.3 -6,-0.1 0.580 98.1 71.4 -73.5 -5.0 16.5 4.7 6.0 63 369 A D G <4 S+ 0 0 115 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.667 86.8 86.6 -79.9 -12.2 15.8 7.5 3.5 64 370 A L S << S- 0 0 8 -3,-1.7 2,-0.1 -4,-0.5 -4,-0.0 -0.354 95.8 -90.6 -70.7 159.8 19.5 8.2 3.7 65 371 A T > - 0 0 30 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.359 35.4-112.3 -67.2 157.1 22.0 6.4 1.5 66 372 A L H > S+ 0 0 61 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.920 118.7 54.2 -59.0 -43.6 23.5 3.1 2.8 67 373 A H H > S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.900 109.3 46.1 -56.7 -42.6 26.9 4.9 3.0 68 374 A D H > S+ 0 0 10 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.870 109.9 54.2 -72.1 -33.9 25.5 7.7 5.1 69 375 A Q H X S+ 0 0 10 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.893 109.1 49.2 -62.1 -40.6 23.7 5.3 7.4 70 376 A V H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.922 110.0 52.0 -63.1 -47.1 27.0 3.4 8.0 71 377 A H H X S+ 0 0 29 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.917 108.7 48.4 -55.9 -49.8 28.7 6.7 8.8 72 378 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.923 114.9 44.7 -64.0 -41.6 26.2 7.9 11.4 73 379 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.894 109.7 55.3 -68.6 -38.5 26.2 4.5 13.2 74 380 A E H < S+ 0 0 74 -4,-2.8 4,-0.2 1,-0.2 -1,-0.2 0.875 115.0 41.6 -60.5 -35.7 30.0 4.3 13.1 75 381 A C H < S+ 0 0 44 -4,-2.0 4,-0.3 -5,-0.2 -2,-0.2 0.857 124.7 32.2 -78.7 -34.1 30.1 7.7 14.8 76 382 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.505 82.6 102.2-104.8 -7.1 27.3 7.2 17.3 77 383 A W H X S+ 0 0 50 -4,-2.1 4,-2.4 1,-0.2 5,-0.1 0.818 88.4 42.0 -59.0 -37.1 27.3 3.6 18.4 78 384 A L H > S+ 0 0 15 -4,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.910 114.1 51.5 -77.9 -38.7 29.1 4.0 21.7 79 385 A E H > S+ 0 0 2 -4,-0.3 4,-2.7 2,-0.2 5,-0.2 0.900 111.4 49.6 -53.6 -43.2 27.1 7.1 22.6 80 386 A I H X S+ 0 0 8 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.943 111.6 46.9 -66.8 -48.2 23.9 5.1 21.8 81 387 A L H X S+ 0 0 19 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.924 113.8 50.1 -57.1 -43.6 25.0 2.2 24.0 82 388 A M H X S+ 0 0 14 -4,-3.0 4,-2.8 2,-0.2 5,-0.3 0.931 108.1 48.5 -68.7 -42.1 25.9 4.5 26.8 83 389 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.885 111.8 53.7 -63.6 -30.9 22.7 6.6 26.9 84 390 A G H X S+ 0 0 11 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.928 110.4 45.8 -62.5 -45.7 20.9 3.3 26.9 85 391 A L H X S+ 0 0 9 -4,-2.2 4,-1.4 2,-0.2 12,-0.5 0.899 112.3 49.4 -65.8 -43.0 23.0 2.1 29.9 86 392 A V H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 -1,-0.2 0.903 109.8 54.3 -66.1 -35.1 22.5 5.4 31.8 87 393 A W H >< S+ 0 0 75 -4,-2.3 3,-0.7 -5,-0.3 4,-0.3 0.929 111.2 41.2 -64.4 -46.4 18.8 5.2 31.1 88 394 A R H 3< S+ 0 0 50 -4,-2.1 3,-0.3 1,-0.2 -1,-0.2 0.685 113.5 56.6 -81.0 -9.3 18.2 1.7 32.6 89 395 A S H >< S+ 0 0 0 -4,-1.4 3,-2.5 -5,-0.2 6,-0.3 0.603 79.7 95.0 -86.9 -11.5 20.6 2.6 35.4 90 396 A M T << S+ 0 0 18 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.1 0.810 84.4 46.7 -49.3 -43.4 18.5 5.6 36.5 91 397 A E T 3 S+ 0 0 164 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.128 102.3 72.2 -87.8 16.2 16.5 3.8 39.2 92 398 A H S X S- 0 0 65 -3,-2.5 3,-2.6 3,-0.2 -1,-0.2 -0.537 76.6-153.1-134.5 68.6 19.6 2.2 40.6 93 399 A P T 3 S+ 0 0 81 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.098 80.4 10.6 -40.1 128.9 21.6 4.9 42.5 94 400 A G T 3 S+ 0 0 49 29,-0.2 12,-0.5 1,-0.2 2,-0.3 0.421 116.4 90.2 77.4 0.5 25.3 4.1 42.6 95 401 A K E < -A 105 0A 84 -3,-2.6 2,-0.5 -6,-0.3 10,-0.2 -0.952 64.9-140.8-131.4 154.3 25.0 1.2 40.1 96 402 A L E -A 104 0A 0 8,-3.2 8,-2.3 -2,-0.3 2,-1.6 -0.947 14.2-148.5-107.6 121.8 25.1 0.6 36.4 97 403 A L E +A 103 0A 24 -2,-0.5 6,-0.2 -12,-0.5 -9,-0.1 -0.623 27.3 165.9 -89.3 80.1 22.5 -1.9 35.1 98 404 A F E S- 0 0 24 -2,-1.6 -1,-0.2 4,-1.3 5,-0.2 0.924 77.6 -15.2 -60.4 -40.6 24.5 -3.3 32.2 99 405 A A E > S-A 102 0A 0 3,-1.5 3,-3.3 -3,-0.2 -1,-0.3 -0.960 77.7 -97.4-155.5 157.2 21.9 -6.1 32.1 100 406 A P T 3 S+ 0 0 56 0, 0.0 3,-0.2 0, 0.0 -78,-0.1 0.765 129.4 39.6 -52.9 -25.6 19.1 -7.2 34.5 101 407 A N T 3 S+ 0 0 50 1,-0.2 2,-0.1 -4,-0.0 -79,-0.1 -0.002 112.7 61.5-111.4 24.9 21.6 -9.9 35.7 102 408 A L E < +A 99 0A 5 -3,-3.3 -3,-1.5 2,-0.0 -4,-1.3 -0.600 58.1 158.2-153.5 85.3 24.6 -7.7 35.6 103 409 A L E -A 97 0A 55 -6,-0.2 2,-0.3 -5,-0.2 -6,-0.2 -0.954 19.2-173.4-111.1 111.8 24.4 -4.7 37.9 104 410 A L E -A 96 0A 2 -8,-2.3 -8,-3.2 -2,-0.6 2,-0.2 -0.859 14.5-152.3-116.8 145.2 27.7 -3.3 38.9 105 411 A D E >> -A 95 0A 55 -2,-0.3 3,-0.7 -10,-0.2 4,-0.6 -0.484 41.7 -92.8 -99.7 176.6 28.9 -0.6 41.3 106 412 A R H >> S+ 0 0 100 -12,-0.5 3,-2.1 1,-0.3 4,-1.1 0.919 123.9 57.0 -65.3 -40.8 32.1 1.6 41.0 107 413 A N H 34 S+ 0 0 97 1,-0.3 4,-0.4 2,-0.2 3,-0.4 0.843 101.3 58.8 -58.3 -29.4 34.2 -0.7 43.0 108 414 A Q H <4 S+ 0 0 53 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.664 101.3 56.7 -72.4 -13.7 33.3 -3.5 40.5 109 415 A G H X< S+ 0 0 0 -3,-2.1 3,-2.3 -4,-0.6 6,-0.4 0.761 88.4 72.3 -87.0 -23.6 34.8 -1.3 37.8 110 416 A K T 3< S+ 0 0 113 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.766 78.2 81.1 -60.9 -22.0 38.2 -1.0 39.5 111 417 A C T 3 S+ 0 0 95 -4,-0.4 2,-0.5 -3,-0.2 -1,-0.3 0.798 91.1 57.2 -53.2 -28.5 38.6 -4.7 38.4 112 418 A V S X> S- 0 0 24 -3,-2.3 3,-2.5 -4,-0.1 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S+ 0 0 115 -4,-2.5 4,-1.0 1,-0.3 3,-0.8 0.829 98.0 60.9 -69.1 -27.7 23.6 19.8 27.0 204 510 A I H 3X S+ 0 0 8 -4,-1.2 4,-1.9 1,-0.2 3,-0.5 0.866 93.2 66.1 -64.2 -29.0 23.8 16.4 28.4 205 511 A L H < S+ 0 0 45 -4,-3.5 2,-2.5 1,-0.2 3,-1.1 0.896 97.2 77.0 -58.4 -40.2 38.8 0.5 24.7 220 526 A Y T 3< S+ 0 0 183 -4,-2.6 -1,-0.2 1,-0.3 3,-0.1 -0.443 92.6 49.4 -74.5 71.9 41.5 1.2 22.1 221 527 A S T 3 S+ 0 0 85 -2,-2.5 2,-0.3 1,-0.3 -1,-0.3 0.235 99.9 77.9 167.6 21.5 44.2 -0.4 24.2 222 528 A M S < S- 0 0 59 -3,-1.1 3,-0.4 1,-0.1 -1,-0.3 -0.938 87.4-100.8-148.9 162.6 42.6 -3.8 25.0 223 529 A K S S+ 0 0 151 -2,-0.3 3,-0.2 1,-0.2 -1,-0.1 0.831 78.6 120.9 -50.5 -47.7 41.8 -7.3 23.7 224 530 A C S S- 0 0 38 1,-0.1 -1,-0.2 2,-0.1 2,-0.1 0.192 80.3 -74.4 26.2 -91.0 38.2 -6.2 23.1 225 531 A K + 0 0 100 -3,-0.4 -1,-0.1 1,-0.0 -2,-0.0 -0.464 53.2 160.7 164.4 123.5 37.8 -6.7 19.3 226 532 A N + 0 0 127 -3,-0.2 2,-0.3 -2,-0.1 -2,-0.1 -0.050 35.0 137.6-142.2 31.8 39.1 -4.9 16.2 227 533 A V + 0 0 109 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.662 69.8 6.1 -83.0 136.3 38.7 -7.7 13.7 228 534 A V S S- 0 0 88 -2,-0.3 5,-0.1 4,-0.0 -1,-0.1 0.793 105.6 -86.1 49.1 121.1 37.2 -6.5 10.3 229 535 A P > - 0 0 74 0, 0.0 4,-1.5 0, 0.0 5,-0.1 -0.047 34.9-116.5 -50.7 152.3 36.9 -2.7 10.4 230 536 A L H > S+ 0 0 44 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.858 110.5 59.7 -64.2 -34.7 33.7 -1.3 11.9 231 537 A Y H > S+ 0 0 66 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.970 106.9 45.4 -56.7 -54.1 32.6 0.2 8.6 232 538 A D H > S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.853 112.8 50.4 -61.7 -32.2 32.5 -3.1 6.8 233 539 A L H X S+ 0 0 48 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.907 113.0 45.9 -75.6 -38.6 30.7 -4.9 9.6 234 540 A L H X S+ 0 0 0 -4,-2.4 4,-3.5 2,-0.2 5,-0.3 0.877 111.4 53.1 -60.7 -44.9 28.0 -2.2 9.8 235 541 A L H X S+ 0 0 54 -4,-2.8 4,-4.5 -5,-0.3 -2,-0.2 0.970 107.2 51.2 -57.8 -51.9 27.7 -2.2 6.0 236 542 A E H < S+ 0 0 150 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.921 115.4 43.1 -44.2 -55.9 27.1 -5.9 6.0 237 543 A M H < S+ 0 0 53 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.856 120.5 39.5 -62.8 -47.5 24.5 -5.5 8.7 238 544 A L H < S+ 0 0 6 -4,-3.5 2,-2.7 1,-0.2 -2,-0.2 0.873 100.5 74.0 -76.8 -38.5 22.8 -2.5 7.1 239 545 A D S < S+ 0 0 100 -4,-4.5 -1,-0.2 -5,-0.3 2,-0.1 -0.358 73.2 164.3 -76.1 65.9 23.1 -3.7 3.4 240 546 A A - 0 0 57 -2,-2.7 2,-0.1 -3,-0.1 -3,-0.1 -0.473 35.5-130.2 -85.8 154.1 20.3 -6.3 3.8 241 547 A H - 0 0 106 -2,-0.1 3,-0.1 1,-0.1 -1,-0.1 -0.353 16.9-129.4 -82.7-178.9 18.5 -8.0 1.0 242 548 A R S > S+ 0 0 225 1,-0.1 3,-1.1 -2,-0.1 -1,-0.1 0.099 74.8 111.1-119.3 33.7 14.8 -8.1 1.1 243 549 A L T 3 S+ 0 0 136 1,-0.3 -1,-0.1 2,-0.1 -3,-0.0 0.856 70.7 59.7 -69.4 -35.8 14.4 -11.8 0.5 244 550 A H T 3 0 0 172 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.113 360.0 360.0 -87.1 30.4 13.1 -12.6 4.0 245 551 A A < 0 0 126 -3,-1.1 -1,-0.2 0, 0.0 -2,-0.1 0.936 360.0 360.0 -79.0 360.0 10.2 -10.2 3.4