==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 23-JAN-13 4IWC . COMPND 2 MOLECULE: ESTROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.C.NWACHUKWU,S.SRINIVASAN,A.A.PARENT,V.CAVETT,J.NOWAK,T.S.H . 495 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20575.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 370 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 0 0.0 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 10 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 288 58.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 2 2 0 1 1 0 0 2 0 0 1 1 0 0 0 1 4 1 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 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 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 1 305 A S >> 0 0 72 0, 0.0 3,-1.3 0, 0.0 4,-0.7 0.000 360.0 360.0 360.0 117.7 16.8 21.3 27.8 2 306 A L H 3> + 0 0 130 1,-0.3 4,-0.8 2,-0.2 0, 0.0 0.660 360.0 76.2 -62.9 -15.5 17.9 19.1 30.7 3 307 A A H >4 S+ 0 0 2 1,-0.2 3,-0.9 2,-0.2 -1,-0.3 0.940 97.8 44.3 -56.7 -47.4 17.0 16.1 28.5 4 308 A L H <4 S+ 0 0 59 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.735 108.1 58.8 -70.3 -24.2 20.2 16.6 26.6 5 309 A S H 3< S+ 0 0 95 -4,-0.7 -1,-0.2 2,-0.0 -2,-0.2 0.611 84.7 108.6 -81.2 -12.9 22.2 17.2 29.8 6 310 A L << - 0 0 31 -3,-0.9 2,-0.2 -4,-0.8 -3,-0.0 -0.328 65.2-134.7 -65.1 143.3 21.2 13.7 31.0 7 311 A T > - 0 0 73 1,-0.1 4,-3.0 -2,-0.0 5,-0.2 -0.491 30.9-100.8 -87.8 168.4 23.8 11.0 31.2 8 312 A A H > S+ 0 0 17 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.920 126.4 47.3 -54.1 -45.9 23.1 7.5 29.9 9 313 A D H > S+ 0 0 96 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.872 112.6 48.1 -65.6 -39.1 22.5 6.3 33.4 10 314 A Q H > S+ 0 0 95 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.863 110.6 53.8 -68.1 -35.9 20.2 9.2 34.2 11 315 A M H X S+ 0 0 1 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.959 111.8 42.9 -60.2 -52.9 18.4 8.5 30.9 12 316 A V H X S+ 0 0 11 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.898 113.9 51.2 -61.0 -43.7 17.8 4.9 31.9 13 317 A S H X S+ 0 0 54 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.885 109.7 49.8 -64.5 -40.2 16.8 5.7 35.5 14 318 A A H X S+ 0 0 31 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.923 113.8 45.8 -62.6 -44.8 14.3 8.3 34.4 15 319 A L H < S+ 0 0 0 -4,-2.0 4,-0.3 1,-0.2 -2,-0.2 0.863 110.9 51.3 -70.0 -38.8 12.7 5.9 31.9 16 320 A L H >< S+ 0 0 69 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.891 111.8 48.2 -63.7 -40.6 12.5 3.0 34.3 17 321 A D H 3< S+ 0 0 115 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.829 105.6 57.8 -68.9 -33.6 10.8 5.2 36.9 18 322 A A T 3< S+ 0 0 4 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.502 78.7 131.1 -77.9 -3.2 8.3 6.5 34.4 19 323 A E < - 0 0 62 -3,-0.9 -3,-0.1 -4,-0.3 34,-0.0 -0.249 56.4-128.1 -57.6 131.9 7.1 3.0 33.6 20 324 A P - 0 0 41 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.371 30.3-101.9 -72.1 157.2 3.3 2.5 33.7 21 325 A P - 0 0 72 0, 0.0 2,-0.7 0, 0.0 31,-0.1 -0.336 32.0-102.1 -77.7 162.4 1.8 -0.3 35.8 22 326 A I - 0 0 99 -2,-0.1 2,-0.2 79,-0.0 79,-0.1 -0.792 46.3-152.1 -82.1 116.5 0.5 -3.6 34.5 23 327 A L - 0 0 26 -2,-0.7 2,-0.3 77,-0.2 22,-0.0 -0.488 6.3-119.7 -91.3 161.6 -3.3 -3.2 34.5 24 328 A Y - 0 0 138 -2,-0.2 2,-0.2 77,-0.1 -1,-0.1 -0.689 21.4-120.1-100.4 154.1 -5.9 -5.9 34.8 25 329 A S - 0 0 8 -2,-0.3 17,-0.1 1,-0.1 16,-0.1 -0.584 19.6-122.5 -88.4 151.6 -8.7 -6.8 32.4 26 330 A E + 0 0 128 15,-0.2 -1,-0.1 -2,-0.2 15,-0.1 0.203 57.8 163.2 -73.3 18.8 -12.4 -6.7 33.1 27 331 A Y - 0 0 85 1,-0.1 11,-0.0 14,-0.1 -2,-0.0 -0.112 24.5-164.1 -48.8 123.6 -12.3 -10.4 32.2 28 332 A D > - 0 0 72 3,-0.1 3,-1.1 1,-0.1 -1,-0.1 -0.941 8.0-164.8-114.7 111.1 -15.3 -12.3 33.4 29 333 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.228 77.4 77.0 -81.3 15.1 -14.8 -16.1 33.4 30 334 A T T 3 S+ 0 0 82 2,-0.1 -2,-0.0 1,-0.0 0, 0.0 0.672 90.3 56.3 -95.4 -19.8 -18.5 -16.8 33.8 31 335 A R S < S- 0 0 169 -3,-1.1 2,-0.1 1,-0.0 -3,-0.1 -0.852 85.3-114.5-113.9 148.3 -19.4 -16.1 30.1 32 336 A P - 0 0 117 0, 0.0 2,-0.2 0, 0.0 5,-0.1 -0.476 43.2 -92.8 -77.5 152.4 -18.0 -17.6 26.9 33 337 A F + 0 0 63 -2,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.401 42.9 177.5 -70.3 134.5 -16.1 -15.4 24.5 34 338 A S > - 0 0 56 -2,-0.2 4,-2.4 1,-0.1 5,-0.3 -0.798 44.8-107.0-120.0 169.4 -17.7 -13.7 21.6 35 339 A E H > S+ 0 0 61 -2,-0.3 4,-2.6 78,-0.2 5,-0.2 0.958 123.1 46.4 -57.8 -49.1 -16.2 -11.3 19.0 36 340 A A H > S+ 0 0 49 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.875 113.6 46.7 -62.4 -41.6 -17.9 -8.4 20.7 37 341 A S H > S+ 0 0 46 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.890 113.9 47.5 -72.2 -38.1 -17.0 -9.5 24.3 38 342 A M H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.937 113.6 47.3 -65.2 -47.4 -13.3 -10.1 23.4 39 343 A M H X S+ 0 0 9 -4,-2.6 4,-2.7 -5,-0.3 5,-0.3 0.848 109.8 56.7 -60.8 -34.0 -13.1 -6.8 21.6 40 344 A G H X S+ 0 0 24 -4,-1.7 4,-2.5 -5,-0.2 5,-0.2 0.944 109.2 43.3 -61.0 -50.3 -14.8 -5.3 24.6 41 345 A L H X S+ 0 0 21 -4,-2.2 4,-2.5 2,-0.2 -15,-0.2 0.921 116.3 48.7 -61.2 -46.3 -12.1 -6.5 27.0 42 346 A L H X S+ 0 0 28 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.919 116.0 41.0 -61.3 -48.3 -9.3 -5.5 24.6 43 347 A T H X S+ 0 0 12 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.834 113.5 53.1 -75.6 -32.7 -10.6 -2.0 24.0 44 348 A N H X S+ 0 0 58 -4,-2.5 4,-1.9 -5,-0.3 -2,-0.2 0.954 113.3 45.8 -59.2 -48.7 -11.6 -1.5 27.6 45 349 A L H X S+ 0 0 4 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.935 112.5 48.4 -59.7 -51.3 -8.0 -2.5 28.5 46 350 A A H X S+ 0 0 15 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.893 108.7 56.4 -56.9 -41.1 -6.4 -0.3 25.9 47 351 A D H X S+ 0 0 41 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.910 109.7 43.3 -58.9 -46.3 -8.5 2.6 27.0 48 352 A R H X S+ 0 0 70 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.882 112.8 52.9 -69.4 -37.1 -7.3 2.4 30.6 49 353 A E H X S+ 0 0 33 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.857 100.3 63.6 -64.2 -35.2 -3.7 1.9 29.4 50 354 A L H X S+ 0 0 3 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.902 98.8 52.8 -56.6 -44.8 -4.0 5.0 27.2 51 355 A V H X S+ 0 0 61 -4,-1.1 4,-1.4 1,-0.2 -1,-0.2 0.910 112.0 46.0 -58.1 -42.9 -4.5 7.3 30.3 52 356 A H H X S+ 0 0 73 -4,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.841 111.2 53.9 -67.0 -34.1 -1.3 5.8 31.8 53 357 A M H X S+ 0 0 9 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.943 104.2 53.1 -65.7 -49.0 0.5 6.2 28.5 54 358 A I H X S+ 0 0 4 -4,-2.9 4,-1.2 1,-0.2 -1,-0.2 0.882 113.8 44.3 -53.1 -40.3 -0.4 9.9 28.2 55 359 A N H < S+ 0 0 87 -4,-1.4 4,-0.3 -5,-0.2 -1,-0.2 0.823 112.4 50.9 -77.3 -31.8 1.1 10.4 31.7 56 360 A W H >X S+ 0 0 6 -4,-2.1 3,-1.5 1,-0.2 4,-0.6 0.892 105.0 58.8 -66.5 -40.5 4.1 8.2 30.9 57 361 A A H >< S+ 0 0 0 -4,-3.2 3,-1.5 1,-0.3 6,-0.2 0.893 98.7 57.0 -56.9 -43.5 4.8 10.2 27.7 58 362 A K T 3< S+ 0 0 51 -4,-1.2 -1,-0.3 1,-0.3 6,-0.3 0.667 105.3 54.3 -62.4 -16.2 5.1 13.5 29.7 59 363 A R T <4 S+ 0 0 145 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.547 80.1 103.7 -96.9 -10.5 7.9 11.7 31.6 60 364 A V S XX S- 0 0 2 -3,-1.5 3,-1.8 -4,-0.6 4,-0.5 -0.649 89.2-103.5 -71.3 118.6 9.9 10.8 28.6 61 365 A P T 34 S+ 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.133 101.7 12.3 -46.8 130.8 12.8 13.3 28.5 62 366 A G T >4 S+ 0 0 6 -4,-0.1 3,-1.3 1,-0.0 4,-0.4 -0.079 98.5 99.6 94.1 -33.0 12.3 16.1 26.0 63 367 A F G X4 S+ 0 0 0 -3,-1.8 3,-1.5 1,-0.3 -5,-0.1 0.864 78.3 56.5 -54.2 -41.7 8.6 15.3 25.3 64 368 A V G 3< S+ 0 0 87 -4,-0.5 -1,-0.3 -6,-0.3 7,-0.1 0.762 95.2 67.9 -63.4 -25.3 7.5 18.1 27.6 65 369 A D G < S+ 0 0 88 -3,-1.3 -1,-0.3 2,-0.0 -2,-0.2 0.656 86.8 88.3 -70.7 -16.5 9.5 20.6 25.5 66 370 A L S < S- 0 0 11 -3,-1.5 -4,-0.0 -4,-0.4 5,-0.0 -0.439 88.8 -95.3 -84.3 156.9 7.2 20.2 22.5 67 371 A T >> - 0 0 79 -2,-0.1 4,-2.4 1,-0.1 3,-0.6 -0.298 34.5-113.5 -61.4 151.9 4.0 22.1 21.7 68 372 A L H 3> S+ 0 0 56 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.889 119.8 57.8 -51.9 -40.8 0.8 20.5 22.8 69 373 A H H 3> S+ 0 0 120 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.843 108.4 44.4 -62.2 -34.6 -0.0 20.2 19.1 70 374 A D H <> S+ 0 0 36 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.857 111.0 52.7 -78.9 -35.8 3.2 18.1 18.6 71 375 A Q H X S+ 0 0 12 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.909 109.3 51.3 -62.9 -42.4 2.6 15.9 21.6 72 376 A V H X S+ 0 0 14 -4,-2.6 4,-2.8 -5,-0.2 -2,-0.2 0.941 110.4 48.8 -57.7 -49.8 -0.9 15.2 20.3 73 377 A H H X S+ 0 0 41 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.940 111.1 48.4 -56.3 -52.8 0.5 14.2 16.9 74 378 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.909 115.8 43.1 -58.2 -46.6 3.2 11.9 18.3 75 379 A L H X S+ 0 0 2 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.925 111.4 54.7 -65.7 -44.8 0.9 10.0 20.6 76 380 A E H < S+ 0 0 40 -4,-2.8 -1,-0.2 -5,-0.3 4,-0.2 0.847 115.5 40.9 -54.2 -36.1 -1.8 9.9 18.0 77 381 A C H < S+ 0 0 22 -4,-2.0 4,-0.3 -5,-0.2 -1,-0.2 0.861 124.2 33.8 -81.0 -37.6 0.7 8.2 15.7 78 382 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.581 83.4 100.7-101.1 -11.7 2.4 5.9 18.2 79 383 A W H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.811 89.3 40.5 -50.8 -43.8 -0.2 4.8 20.7 80 384 A L H > S+ 0 0 19 2,-0.2 4,-2.7 -4,-0.2 -1,-0.2 0.915 114.2 52.5 -74.1 -43.0 -0.9 1.3 19.2 81 385 A E H > S+ 0 0 2 -4,-0.3 4,-2.7 1,-0.2 -2,-0.2 0.920 111.9 48.4 -51.6 -45.6 2.8 0.6 18.5 82 386 A I H X S+ 0 0 8 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.885 110.9 47.9 -68.5 -41.1 3.4 1.5 22.1 83 387 A L H X S+ 0 0 21 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.881 114.0 50.9 -62.3 -37.9 0.6 -0.7 23.4 84 388 A M H X S+ 0 0 11 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.900 108.0 48.0 -69.9 -44.2 2.0 -3.5 21.2 85 389 A I H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.921 112.9 50.3 -65.1 -40.3 5.6 -3.3 22.3 86 390 A G H X S+ 0 0 8 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.948 112.0 47.5 -57.2 -50.4 4.5 -3.3 25.9 87 391 A L H X S+ 0 0 10 -4,-2.2 4,-0.9 1,-0.2 12,-0.4 0.905 112.7 48.2 -56.9 -46.6 2.3 -6.4 25.2 88 392 A V H < S+ 0 0 0 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.864 111.1 52.8 -65.2 -36.3 5.1 -8.1 23.4 89 393 A W H >< S+ 0 0 78 -4,-2.5 3,-1.3 1,-0.2 4,-0.3 0.939 110.3 44.3 -63.2 -50.4 7.5 -7.3 26.2 90 394 A R H 3< S+ 0 0 43 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.593 110.2 57.8 -75.5 -7.6 5.3 -8.7 29.0 91 395 A S T >< S+ 0 0 0 -4,-0.9 3,-2.0 -3,-0.2 6,-0.3 0.436 77.1 98.2 -97.5 -2.4 4.6 -11.8 26.9 92 396 A M T < S+ 0 0 12 -3,-1.3 -1,-0.1 1,-0.3 -2,-0.1 0.901 83.7 46.1 -53.1 -49.0 8.2 -12.8 26.5 93 397 A E T 3 S+ 0 0 149 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.318 103.2 72.5 -81.4 10.9 8.3 -15.4 29.3 94 398 A H S X S- 0 0 62 -3,-2.0 3,-2.3 3,-0.2 -1,-0.2 -0.589 75.2-161.1-123.6 70.6 5.0 -16.8 28.0 95 399 A P T 3 S+ 0 0 78 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.245 77.7 13.7 -55.1 131.1 6.0 -18.7 24.7 96 400 A G T 3 S+ 0 0 45 1,-0.2 12,-0.5 29,-0.1 2,-0.3 0.325 118.0 82.5 86.9 -6.4 2.9 -19.3 22.5 97 401 A K E < -A 107 0A 96 -3,-2.3 2,-0.5 -6,-0.3 10,-0.2 -0.883 66.8-137.4-130.5 159.5 0.8 -16.8 24.5 98 402 A L E -A 106 0A 0 8,-3.1 8,-2.3 -2,-0.3 2,-1.6 -0.971 12.4-149.4-117.6 119.5 0.1 -13.1 24.7 99 403 A L E +A 105 0A 19 -2,-0.5 6,-0.2 -12,-0.4 -9,-0.1 -0.629 28.1 163.2 -87.3 80.9 -0.3 -11.6 28.2 100 404 A F E S- 0 0 29 -2,-1.6 -1,-0.2 4,-1.5 5,-0.2 0.917 80.2 -12.6 -60.9 -42.1 -2.7 -8.8 27.5 101 405 A A E > S-A 104 0A 0 3,-1.8 3,-2.0 -3,-0.3 -1,-0.3 -0.965 76.4-101.4-150.2 161.6 -3.2 -8.8 31.2 102 406 A P T 3 S+ 0 0 53 0, 0.0 3,-0.2 0, 0.0 -78,-0.1 0.805 130.6 37.6 -54.3 -29.0 -2.3 -11.1 34.1 103 407 A N T 3 S+ 0 0 57 1,-0.2 2,-0.2 -4,-0.0 -79,-0.1 0.280 114.3 60.0-105.1 8.7 -5.9 -12.3 34.0 104 408 A L E < +A 101 0A 2 -3,-2.0 -3,-1.8 2,-0.0 -4,-1.5 -0.664 62.1 152.7-134.6 78.9 -6.1 -12.1 30.2 105 409 A L E -A 99 0A 63 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.918 23.5-176.7-113.8 105.6 -3.4 -14.5 28.8 106 410 A L E -A 98 0A 4 -8,-2.3 -8,-3.1 -2,-0.6 2,-0.2 -0.688 22.2-150.5-112.1 154.0 -4.4 -15.7 25.4 107 411 A D E > -A 97 0A 55 -2,-0.3 3,-1.4 -10,-0.2 4,-0.4 -0.706 45.0 -93.0-109.4 171.4 -3.2 -18.1 22.7 108 412 A R G > S+ 0 0 99 -12,-0.5 3,-0.8 1,-0.3 4,-0.1 0.728 119.9 60.8 -60.6 -24.4 -3.9 -17.7 19.0 109 413 A N G > S+ 0 0 100 1,-0.2 3,-1.3 2,-0.2 -1,-0.3 0.811 93.3 63.1 -72.9 -30.2 -7.0 -19.9 19.1 110 414 A Q G < S+ 0 0 70 -3,-1.4 -1,-0.2 1,-0.3 3,-0.2 0.591 100.3 55.1 -73.3 -9.0 -8.9 -17.7 21.5 111 415 A G G X S+ 0 0 0 -3,-0.8 3,-1.5 -4,-0.4 7,-0.4 0.420 75.2 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96.3 70.3 -89.4 -42.3 10.2 8.7 16.0 152 456 A S T 3< S+ 0 0 2 -4,-2.1 -1,-0.1 -5,-0.3 -3,-0.1 0.732 113.2 26.7 -56.9 -28.7 6.9 7.4 14.7 153 457 A G T >4 S+ 0 0 0 -4,-0.4 3,-1.1 -5,-0.2 -1,-0.3 0.502 92.8 94.5-110.8 -6.2 5.3 10.8 14.1 154 458 A V G X4 S+ 0 0 0 -3,-1.0 3,-0.7 -4,-0.3 -2,-0.1 0.768 85.8 51.4 -64.2 -26.1 8.3 13.1 13.6 155 459 A Y G 3< S+ 0 0 16 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.690 99.6 64.2 -84.0 -19.2 8.2 12.8 9.8 156 460 A T G < 0 0 56 -3,-1.1 -1,-0.2 -4,-0.1 -2,-0.2 0.038 360.0 360.0 -91.9 26.1 4.5 13.7 9.6 157 461 A F < 0 0 81 -3,-0.7 -3,-0.1 207,-0.0 -87,-0.0 -0.441 360.0 360.0 -64.2 360.0 5.3 17.2 10.9 158 ! 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 0.0 159 470 A E > 0 0 163 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-152.2 13.4 23.7 15.6 160 471 A E H > + 0 0 29 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.901 360.0 52.6 -68.2 -42.5 11.1 21.2 17.3 161 472 A K H > S+ 0 0 63 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.850 111.1 47.2 -63.0 -35.7 11.9 18.5 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493 A A T 3<5S- 0 0 71 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.456 121.0-112.7 -82.8 -1.7 26.6 -5.7 29.4 183 494 A G T < 5 + 0 0 60 -3,-3.6 2,-0.2 1,-0.3 -3,-0.2 0.699 61.5 154.5 80.1 20.8 30.0 -6.6 28.1 184 495 A L < - 0 0 51 -5,-2.1 -1,-0.3 1,-0.1 -2,-0.1 -0.569 48.7-107.7 -75.0 144.3 29.0 -6.9 24.4 185 496 A T > - 0 0 73 -2,-0.2 4,-2.0 1,-0.1 -1,-0.1 -0.168 31.9-103.9 -64.1 168.6 31.9 -6.3 22.0 186 497 A L H > S+ 0 0 86 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.873 123.9 46.9 -64.8 -38.0 31.9 -3.1 20.0 187 498 A Q H > S+ 0 0 131 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.898 110.1 52.7 -69.5 -41.9 30.8 -4.9 16.9 188 499 A Q H > S+ 0 0 85 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.858 106.0 57.0 -59.8 -36.7 28.1 -6.8 18.8 189 500 A Q H X S+ 0 0 13 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.966 109.1 41.7 -59.8 -55.3 26.9 -3.4 20.0 190 501 A H H X S+ 0 0 14 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.852 116.4 51.1 -66.1 -30.7 26.3 -1.9 16.6 191 502 A Q H X S+ 0 0 36 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.918 111.7 45.9 -68.9 -44.9 24.8 -5.2 15.4 192 503 A 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3,-1.3 -5,-0.2 -2,-0.2 0.821 102.3 59.4 -86.4 -35.9 -0.9 -6.6 -4.2 476 545 B D H >< S+ 0 0 82 -4,-2.0 3,-1.5 1,-0.3 -2,-0.2 0.760 92.7 69.5 -65.3 -25.2 -3.0 -9.6 -3.2 477 546 B A T 3< S+ 0 0 40 -4,-1.1 3,-0.4 1,-0.3 -1,-0.3 0.734 96.3 52.9 -66.7 -22.1 -0.3 -10.8 -0.9 478 547 B H T < S+ 0 0 33 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.394 105.0 57.4 -93.9 2.1 -1.0 -7.9 1.4 479 548 B R < 0 0 48 -3,-1.5 -1,-0.2 1,-0.1 -2,-0.1 -0.469 360.0 360.0-126.3 60.0 -4.7 -8.9 1.5 480 549 B L 0 0 133 -3,-0.4 -1,-0.1 -2,-0.0 -4,-0.0 -0.102 360.0 360.0 42.5 360.0 -4.5 -12.4 2.8 481 !* 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 0.0 482 687 C H 0 0 186 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-168.4 -10.7 20.3 21.8 483 688 C K > - 0 0 16 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.221 360.0-129.2 -53.5 143.7 -9.5 16.7 21.5 484 689 C I H > S+ 0 0 57 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.865 113.7 54.3 -63.7 -35.2 -9.8 14.6 24.6 485 690 C L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.899 105.7 51.9 -63.0 -43.0 -6.1 13.8 24.1 486 691 C H H > S+ 0 0 16 2,-0.2 4,-3.4 1,-0.2 -2,-0.2 0.927 112.3 45.2 -60.0 -47.2 -5.3 17.5 24.0 487 692 C R H X S+ 0 0 157 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.937 111.6 52.3 -61.3 -47.8 -7.2 18.0 27.3 488 693 C L H < S+ 0 0 45 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.862 116.8 39.7 -58.2 -38.5 -5.5 15.0 28.9 489 694 C L H < S+ 0 0 7 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.909 111.4 57.3 -73.6 -45.1 -2.1 16.3 27.9 490 695 C Q H < 0 0 120 -4,-3.4 -2,-0.2 1,-0.3 -3,-0.2 0.802 360.0 360.0 -57.3 -31.0 -3.1 19.9 28.7 491 696 C D < 0 0 132 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.809 360.0 360.0 -66.8 360.0 -3.8 18.7 32.3 492 !* 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 0.0 493 688 D K > 0 0 126 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 153.3 2.5 -17.3 -9.6 494 689 D I H > + 0 0 33 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.901 360.0 56.7 -57.6 -42.8 4.2 -14.8 -12.0 495 690 D L H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.904 103.4 54.3 -57.1 -43.9 6.7 -13.9 -9.3 496 691 D H H > S+ 0 0 62 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.952 109.9 47.6 -50.6 -52.5 7.7 -17.6 -9.0 497 692 D R H X S+ 0 0 155 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.885 111.8 48.1 -60.4 -43.7 8.4 -17.6 -12.8 498 693 D L H < S+ 0 0 27 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.879 111.5 50.9 -66.2 -37.7 10.4 -14.4 -12.8 499 694 D L H < S+ 0 0 8 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.857 113.2 45.7 -67.1 -36.2 12.5 -15.6 -9.8 500 695 D Q H < 0 0 137 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.895 360.0 360.0 -72.6 -42.4 13.2 -18.9 -11.6 501 696 D D < 0 0 150 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.1 0.642 360.0 360.0-123.4 360.0 14.1 -17.2 -14.9