==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 23-JAN-06 2FSZ . COMPND 2 MOLECULE: ESTROGEN RECEPTOR BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR YONG WANG . 450 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22888.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 78.7 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 2.7 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 . 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 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 260 57.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 0 0 0 2 1 1 0 2 0 0 0 2 0 2 0 0 0 1 2 1 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 1 264 A S > 0 0 114 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 151.6 81.1 50.7 4.0 2 265 A P H > + 0 0 39 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.850 360.0 41.7 -37.5 -63.7 79.1 47.8 2.4 3 266 A E H > S+ 0 0 135 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.885 117.9 49.6 -58.0 -41.2 78.9 49.2 -1.2 4 267 A Q H > S+ 0 0 109 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.988 111.6 46.7 -60.4 -62.6 82.5 50.3 -0.9 5 268 A L H X S+ 0 0 15 -4,-3.3 4,-2.6 1,-0.2 5,-0.3 0.890 111.4 51.6 -46.8 -51.3 83.8 46.9 0.3 6 269 A V H X S+ 0 0 5 -4,-2.8 4,-2.9 -5,-0.2 3,-0.3 0.955 110.4 48.8 -52.4 -55.1 81.8 45.0 -2.3 7 270 A L H X S+ 0 0 87 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.898 113.5 47.8 -51.5 -45.7 83.3 47.2 -5.1 8 271 A T H < S+ 0 0 43 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.813 111.6 48.1 -69.1 -32.3 86.8 46.6 -3.6 9 272 A L H >X S+ 0 0 3 -4,-2.6 4,-0.6 -3,-0.3 3,-0.5 0.891 108.6 57.4 -73.9 -37.3 86.4 42.8 -3.3 10 273 A L H >< S+ 0 0 51 -4,-2.9 3,-1.7 -5,-0.3 -2,-0.2 0.978 112.9 36.8 -52.5 -64.2 85.1 42.7 -6.8 11 274 A E T 3< S+ 0 0 132 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.507 107.2 68.8 -71.6 -3.2 88.2 44.3 -8.3 12 275 A A T <4 S+ 0 0 1 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.548 72.7 129.6 -89.7 -9.7 90.4 42.4 -5.8 13 276 A E << - 0 0 51 -3,-1.7 -3,-0.0 -4,-0.6 122,-0.0 -0.109 62.5-115.4 -47.8 136.2 89.6 39.1 -7.6 14 277 A P - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.391 35.4 -99.0 -73.1 150.0 92.6 36.9 -8.5 15 278 A P - 0 0 85 0, 0.0 2,-0.4 0, 0.0 30,-0.1 -0.220 43.9 -96.3 -65.5 163.2 93.3 36.3 -12.2 16 279 A H - 0 0 111 1,-0.0 2,-0.5 78,-0.0 78,-0.1 -0.682 37.3-133.0 -83.7 130.9 92.1 33.0 -13.7 17 280 A V - 0 0 15 -2,-0.4 2,-0.5 76,-0.2 25,-0.0 -0.739 14.9-149.7 -90.4 125.5 94.9 30.4 -13.8 18 281 A L + 0 0 126 -2,-0.5 2,-0.3 76,-0.1 76,-0.1 -0.804 28.9 151.5 -96.7 124.9 95.3 28.6 -17.0 19 282 A I - 0 0 23 -2,-0.5 77,-0.4 0, 0.0 2,-0.3 -0.977 25.0-148.0-146.6 151.8 96.6 25.0 -16.9 20 283 A S - 0 0 65 -2,-0.3 77,-0.1 1,-0.1 -2,-0.0 -0.857 21.3 -99.3-125.8 162.6 96.0 22.1 -19.3 21 284 A R - 0 0 89 75,-0.6 2,-0.1 -2,-0.3 -1,-0.1 -0.168 42.4-111.4 -68.7 167.3 95.8 18.3 -19.1 22 285 A P - 0 0 58 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.412 26.2 -99.7 -97.7 177.7 98.7 16.1 -20.1 23 286 A S S S+ 0 0 132 -2,-0.1 3,-0.1 2,-0.1 -2,-0.0 0.984 94.3 45.1 -56.5 -84.2 99.3 13.7 -23.0 24 287 A A S S- 0 0 67 1,-0.2 3,-0.1 0, 0.0 2,-0.1 0.012 109.2 -64.0 -60.2 167.5 98.6 10.1 -21.9 25 288 A P S S- 0 0 114 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 -0.354 72.3 -89.3 -58.9 128.2 95.6 8.9 -19.8 26 289 A F - 0 0 32 -3,-0.1 2,-0.3 -4,-0.1 3,-0.1 0.016 45.3-160.4 -39.3 136.7 95.7 10.6 -16.4 27 290 A T > - 0 0 84 -3,-0.1 4,-2.9 1,-0.1 5,-0.3 -0.755 36.4-103.2-115.6 164.4 97.6 8.6 -13.8 28 291 A E H > S+ 0 0 100 -2,-0.3 4,-2.4 2,-0.2 5,-0.2 0.958 125.7 44.6 -51.0 -49.6 97.2 9.1 -10.0 29 292 A A H > S+ 0 0 67 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.966 114.2 43.4 -58.5 -65.2 100.6 10.9 -10.3 30 293 A S H > S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.890 114.2 54.1 -50.9 -43.8 100.0 13.1 -13.4 31 294 A M H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 3,-0.3 0.958 112.9 40.3 -55.0 -56.5 96.5 13.9 -12.0 32 295 A M H X S+ 0 0 31 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.690 111.5 60.3 -68.4 -18.5 97.8 15.1 -8.7 33 296 A M H X S+ 0 0 114 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.882 106.3 45.7 -75.4 -39.9 100.6 16.8 -10.5 34 297 A S H X S+ 0 0 10 -4,-2.3 4,-2.4 -3,-0.3 -2,-0.2 0.936 114.3 46.7 -68.7 -45.7 98.2 19.0 -12.4 35 298 A L H X S+ 0 0 24 -4,-2.0 4,-3.2 1,-0.2 5,-0.2 0.908 113.4 49.2 -62.3 -44.2 96.1 19.9 -9.4 36 299 A T H X S+ 0 0 58 -4,-1.7 4,-2.2 2,-0.2 5,-0.2 0.898 110.1 50.5 -64.0 -41.1 99.2 20.7 -7.3 37 300 A K H X S+ 0 0 114 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.963 115.1 44.8 -59.8 -49.6 100.6 22.9 -10.1 38 301 A L H X S+ 0 0 3 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.934 111.9 50.0 -58.3 -54.4 97.3 24.7 -10.3 39 302 A A H X S+ 0 0 22 -4,-3.2 4,-3.4 1,-0.2 5,-0.2 0.908 108.9 51.7 -55.3 -47.6 96.7 25.2 -6.6 40 303 A D H X S+ 0 0 89 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.855 110.1 49.5 -60.6 -35.7 100.2 26.6 -5.9 41 304 A K H X S+ 0 0 70 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.903 114.3 45.4 -69.1 -39.6 99.8 29.1 -8.7 42 305 A E H X S+ 0 0 35 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.897 109.6 54.2 -68.5 -41.0 96.4 30.1 -7.2 43 306 A L H X S+ 0 0 40 -4,-3.4 4,-1.5 2,-0.2 -1,-0.2 0.884 105.3 55.2 -60.0 -37.6 97.9 30.2 -3.7 44 307 A V H X S+ 0 0 99 -4,-1.8 4,-1.0 1,-0.2 3,-0.3 0.940 112.1 42.0 -58.7 -49.9 100.5 32.6 -5.1 45 308 A H H X S+ 0 0 61 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.820 103.9 69.3 -66.7 -32.3 97.7 34.9 -6.3 46 309 A M H X S+ 0 0 11 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.911 94.5 54.6 -54.4 -45.1 95.7 34.4 -3.1 47 310 A I H X S+ 0 0 75 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.960 109.5 46.8 -53.4 -54.3 98.3 36.3 -1.1 48 311 A S H X S+ 0 0 67 -4,-1.0 4,-0.9 1,-0.2 -1,-0.2 0.879 112.2 51.7 -55.8 -40.0 97.9 39.3 -3.4 49 312 A W H >X S+ 0 0 7 -4,-2.4 3,-1.2 1,-0.2 4,-0.7 0.952 109.0 48.6 -61.5 -51.7 94.1 39.0 -3.2 50 313 A A H >< S+ 0 0 0 -4,-3.1 3,-0.6 1,-0.3 -1,-0.2 0.806 105.7 60.0 -60.5 -29.8 94.1 39.0 0.6 51 314 A K H 3< S+ 0 0 119 -4,-1.9 6,-0.5 -5,-0.3 -1,-0.3 0.757 101.8 52.7 -69.7 -26.5 96.4 42.0 0.6 52 315 A K H << S+ 0 0 118 -3,-1.2 -1,-0.2 -4,-0.9 -2,-0.2 0.595 81.6 108.5 -85.3 -12.7 93.8 44.1 -1.3 53 316 A I S X< S- 0 0 1 -4,-0.7 3,-2.5 -3,-0.6 4,-0.4 -0.553 88.3 -99.4 -70.7 117.2 91.1 43.2 1.2 54 317 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.006 102.5 3.7 -37.8 124.9 90.4 46.5 3.1 55 318 A G T >> S+ 0 0 29 -4,-0.1 3,-1.8 -3,-0.1 4,-0.6 0.128 97.6 110.1 83.7 -21.6 92.2 46.5 6.5 56 319 A F G X4 S+ 0 0 2 -3,-2.5 3,-2.3 1,-0.3 -5,-0.1 0.938 73.4 54.4 -51.1 -56.8 94.0 43.2 5.9 57 320 A V G 34 S+ 0 0 87 -6,-0.5 -1,-0.3 -4,-0.4 4,-0.1 0.537 100.8 64.0 -58.2 -5.5 97.5 44.6 5.6 58 321 A E G <4 S+ 0 0 133 -3,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.675 79.8 94.8 -92.6 -18.6 97.0 46.4 8.9 59 322 A L S << S- 0 0 5 -3,-2.3 5,-0.2 -4,-0.6 -4,-0.0 -0.509 99.8 -83.5 -71.8 140.3 96.7 43.2 10.9 60 323 A S >> - 0 0 55 -2,-0.2 4,-1.9 1,-0.2 3,-1.0 -0.070 41.6-111.9 -41.2 142.8 100.1 42.1 12.4 61 324 A L H 3> S+ 0 0 115 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.799 118.6 60.3 -51.2 -27.9 102.1 40.3 9.8 62 325 A F H 3> S+ 0 0 45 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.886 102.2 47.1 -69.1 -42.0 101.6 37.3 12.0 63 326 A D H <> S+ 0 0 22 -3,-1.0 4,-3.0 2,-0.2 5,-0.2 0.867 109.5 55.9 -68.2 -37.2 97.8 37.2 11.9 64 327 A Q H X S+ 0 0 18 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.979 112.1 41.7 -56.0 -57.2 97.9 37.6 8.1 65 328 A V H X S+ 0 0 73 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.896 114.8 51.8 -55.9 -46.0 100.1 34.5 7.8 66 329 A R H X S+ 0 0 76 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.906 111.1 47.5 -59.8 -44.6 98.0 32.7 10.4 67 330 A L H X S+ 0 0 12 -4,-3.0 4,-2.0 2,-0.2 5,-0.2 0.940 116.9 40.9 -63.2 -51.4 94.7 33.5 8.6 68 331 A L H X S+ 0 0 20 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.898 113.1 56.9 -64.3 -40.3 96.0 32.4 5.1 69 332 A E H < S+ 0 0 126 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.859 115.2 36.3 -58.0 -39.4 97.7 29.5 6.7 70 333 A S H < S+ 0 0 37 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.714 124.6 35.8 -90.9 -21.8 94.5 28.2 8.2 71 334 A S H >X S+ 0 0 0 -4,-2.0 4,-2.5 -5,-0.1 3,-0.9 0.561 81.7 100.4-109.4 -9.6 91.9 29.1 5.4 72 335 A W H 3X S+ 0 0 59 -4,-2.0 4,-2.3 1,-0.3 5,-0.2 0.825 83.2 50.9 -49.7 -42.3 93.8 28.6 2.1 73 336 A M H 3> S+ 0 0 24 1,-0.2 4,-2.3 -4,-0.2 -1,-0.3 0.870 113.7 45.2 -65.7 -35.7 92.3 25.1 1.3 74 337 A E H <> S+ 0 0 6 -3,-0.9 4,-2.6 2,-0.2 5,-0.2 0.896 110.7 53.3 -71.3 -43.0 88.7 26.4 1.9 75 338 A V H X S+ 0 0 9 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.941 111.6 47.3 -55.5 -48.0 89.3 29.6 -0.1 76 339 A L H X S+ 0 0 20 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.957 113.5 45.7 -58.2 -54.1 90.5 27.4 -3.0 77 340 A M H X S+ 0 0 16 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.804 111.4 53.8 -63.1 -28.8 87.6 25.0 -2.8 78 341 A M H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.898 109.3 47.7 -70.2 -41.0 85.2 27.9 -2.5 79 342 A G H X S+ 0 0 8 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.870 112.2 50.7 -65.6 -36.6 86.6 29.4 -5.7 80 343 A L H X S+ 0 0 9 -4,-2.3 4,-1.2 2,-0.2 12,-0.4 0.920 109.3 49.5 -66.5 -46.4 86.4 26.1 -7.4 81 344 A M H X S+ 0 0 1 -4,-2.3 4,-1.1 1,-0.2 3,-0.4 0.905 108.0 55.5 -61.1 -41.2 82.7 25.6 -6.4 82 345 A W H < S+ 0 0 61 -4,-2.2 3,-0.4 1,-0.2 4,-0.3 0.906 111.3 41.7 -60.1 -44.2 81.9 29.1 -7.6 83 346 A R H < S+ 0 0 42 -4,-1.7 -1,-0.2 1,-0.2 3,-0.2 0.657 115.4 50.3 -81.2 -10.6 83.2 28.5 -11.1 84 347 A S H >< S+ 0 0 0 -4,-1.2 3,-2.8 -3,-0.4 6,-0.3 0.522 82.0 100.2 -97.3 -9.4 81.7 25.0 -11.3 85 348 A I T 3< S+ 0 0 11 -4,-1.1 -1,-0.1 -3,-0.4 -2,-0.1 0.785 84.7 42.6 -47.3 -38.3 78.3 26.2 -10.2 86 349 A D T 3 S+ 0 0 132 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.251 105.7 69.9 -95.9 15.1 76.8 26.3 -13.8 87 350 A H S X S- 0 0 91 -3,-2.8 3,-2.1 3,-0.2 -1,-0.2 -0.537 74.8-160.3-130.1 67.2 78.4 22.9 -14.7 88 351 A P T 3 S+ 0 0 83 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.130 78.5 19.1 -49.4 137.7 76.5 20.2 -12.7 89 352 A G T 3 S+ 0 0 44 1,-0.2 12,-1.1 29,-0.1 2,-0.3 0.432 114.6 93.4 80.0 -1.7 78.4 16.9 -12.3 90 353 A K E < -A 100 0A 87 -3,-2.1 2,-0.5 -6,-0.3 -1,-0.2 -0.920 62.4-148.6-128.3 153.5 81.6 18.8 -13.1 91 354 A L E -A 99 0A 2 8,-2.3 8,-1.9 -2,-0.3 2,-1.5 -0.968 14.2-153.5-118.1 111.8 84.5 20.5 -11.4 92 355 A I E +A 98 0A 14 -2,-0.5 6,-0.2 -12,-0.4 -9,-0.1 -0.632 26.1 163.7 -87.8 80.5 86.0 23.4 -13.4 93 356 A F E S- 0 0 22 -2,-1.5 -1,-0.2 4,-1.0 5,-0.2 0.847 76.3 -20.7 -64.3 -33.1 89.5 23.5 -12.1 94 357 A A E > S-A 97 0A 0 3,-1.2 3,-0.6 -3,-0.2 -1,-0.3 -0.951 74.7 -93.5-167.7 159.3 90.4 25.7 -15.1 95 358 A P T 3 S+ 0 0 86 0, 0.0 3,-0.2 0, 0.0 -77,-0.1 0.871 129.6 32.6 -48.8 -41.1 89.0 26.3 -18.6 96 359 A D T 3 S+ 0 0 103 -77,-0.4 -75,-0.6 1,-0.2 2,-0.5 0.536 115.7 62.2 -94.4 -11.4 91.2 23.6 -20.1 97 360 A L E < +A 94 0A 1 -3,-0.6 -3,-1.2 -77,-0.1 -4,-1.0 -0.719 62.8 149.8-120.5 82.2 91.2 21.4 -17.0 98 361 A V E -A 92 0A 33 -2,-0.5 2,-0.4 -6,-0.2 -6,-0.2 -0.942 23.1-166.9-112.8 132.5 87.6 20.3 -16.3 99 362 A L E -A 91 0A 0 -8,-1.9 -8,-2.3 -2,-0.5 2,-0.2 -0.952 13.4-137.3-125.2 143.4 87.0 16.9 -14.7 100 363 A D E >> -A 90 0A 65 -2,-0.4 4,-0.8 -10,-0.2 3,-0.7 -0.486 37.1-102.6 -88.3 163.8 83.9 14.7 -14.2 101 364 A R G >4 S+ 0 0 47 -12,-1.1 3,-1.0 1,-0.2 4,-0.2 0.921 121.8 51.9 -51.0 -47.2 83.2 13.0 -11.0 102 365 A D G >4 S+ 0 0 99 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.748 97.4 63.0 -63.4 -29.5 84.4 9.7 -12.5 103 366 A E G X4 S+ 0 0 57 -3,-0.7 3,-1.5 1,-0.3 -1,-0.2 0.743 86.8 76.2 -70.4 -19.9 87.8 10.9 -13.8 104 367 A G G X< S+ 0 0 0 -3,-1.0 3,-1.9 -4,-0.8 -1,-0.3 0.713 72.7 81.7 -62.4 -19.0 88.7 11.6 -10.1 105 368 A K G < + 0 0 106 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.1 0.408 69.7 82.7 -67.9 5.1 89.2 7.9 -9.8 106 369 A S G < S+ 0 0 35 -3,-1.5 2,-0.6 1,-0.2 -1,-0.3 0.769 91.3 51.8 -77.7 -27.1 92.6 8.4 -11.3 107 370 A V S X S- 0 0 1 -3,-1.9 3,-0.9 -4,-0.2 4,-0.4 -0.941 101.0-117.6-114.6 110.5 93.8 9.4 -7.8 108 371 A E T 3 S+ 0 0 151 -2,-0.6 -3,-0.1 1,-0.2 -2,-0.1 -0.233 92.2 6.2 -49.5 109.3 92.9 6.8 -5.2 109 372 A G T >> S+ 0 0 32 -2,-0.2 3,-1.3 -5,-0.0 4,-0.6 -0.198 92.1 101.1 114.9 -45.3 90.6 8.4 -2.7 110 373 A I H <> + 0 0 8 -3,-0.9 4,-2.9 1,-0.2 5,-0.2 0.601 62.5 88.8 -52.8 -13.7 89.7 11.9 -3.9 111 374 A L H 3> S+ 0 0 18 -4,-0.4 4,-2.4 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-0.422 10.6-137.2 -59.5 122.7 74.9 32.8 23.9 360 393 B Q > - 0 0 109 -2,-0.2 4,-2.9 -3,-0.2 3,-0.3 -0.512 15.5-116.8 -87.8 151.7 71.5 32.2 25.4 361 394 B H H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.869 115.9 51.8 -52.0 -39.8 70.1 28.8 26.4 362 395 B K H > S+ 0 0 81 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.893 111.2 45.2 -67.3 -39.4 67.3 29.1 23.8 363 396 B E H > S+ 0 0 6 -3,-0.3 4,-2.6 1,-0.2 3,-0.3 0.915 110.7 56.8 -67.0 -42.3 69.7 29.9 20.9 364 397 B Y H X S+ 0 0 6 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.909 103.5 52.5 -53.2 -48.8 71.9 27.1 22.1 365 398 B L H X S+ 0 0 5 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.839 110.8 47.5 -59.8 -35.7 69.0 24.6 21.8 366 399 B C H X S+ 0 0 1 -4,-1.2 4,-2.5 -3,-0.3 -1,-0.2 0.919 111.9 49.6 -72.7 -42.8 68.4 25.7 18.2 367 400 B V H X S+ 0 0 1 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.890 107.6 53.0 -64.1 -42.0 72.0 25.5 17.2 368 401 B K H X S+ 0 0 11 -4,-2.6 4,-1.8 2,-0.2 3,-0.2 0.973 113.3 43.7 -59.0 -50.7 72.6 22.0 18.7 369 402 B A H X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 5,-0.2 0.896 110.8 56.1 -61.0 -39.3 69.6 20.6 16.7 370 403 B M H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.887 103.6 53.7 -60.7 -37.6 70.8 22.6 13.6 371 404 B I H < S+ 0 0 7 -4,-2.3 -1,-0.2 -3,-0.2 -2,-0.2 0.921 108.2 51.7 -63.4 -39.3 74.1 20.8 13.9 372 405 B L H >< S+ 0 0 0 -4,-1.8 3,-0.7 1,-0.2 -2,-0.2 0.944 117.6 35.7 -60.3 -49.3 72.2 17.6 13.8 373 406 B L H 3< S+ 0 0 13 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.657 115.6 53.9 -80.6 -20.4 70.2 18.4 10.7 374 407 B N T 3< S+ 0 0 4 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.249 79.5 102.9 -97.5 16.0 72.9 20.3 8.9 375 408 B S S < S+ 0 0 10 -3,-0.7 2,-0.3 -4,-0.2 -1,-0.2 0.799 85.1 18.8 -70.1 -31.8 75.3 17.4 9.2 376 409 B S 0 0 38 -3,-0.4 -186,-0.0 -4,-0.1 -79,-0.0 -0.916 360.0 360.0-135.9 162.0 75.1 16.0 5.6 377 410 B M 0 0 102 -2,-0.3 -257,-0.1 -187,-0.0 -258,-0.0 -0.485 360.0 360.0-170.7 360.0 74.0 17.3 2.2 378 ! 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 0.0 379 423 B S >> 0 0 106 0, 0.0 4,-2.3 0, 0.0 5,-0.6 0.000 360.0 360.0 360.0-172.9 65.1 16.4 0.8 380 424 B R H >5 + 0 0 208 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.904 360.0 29.7 -35.5 -71.2 61.5 17.6 1.2 381 425 B K H >5S+ 0 0 75 2,-0.2 4,-3.2 3,-0.2 5,-0.3 0.932 119.6 53.6 -59.6 -54.0 61.2 16.6 4.9 382 426 B L H >5S+ 0 0 51 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.955 113.5 41.5 -45.7 -67.2 64.9 17.0 5.8 383 427 B A H X5S+ 0 0 34 -4,-2.3 4,-3.4 1,-0.2 -1,-0.2 0.863 115.1 51.6 -51.3 -43.5 65.2 20.6 4.5 384 428 B H H X< S+ 0 0 2 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.775 109.8 58.6 -65.3 -24.1 67.0 36.3 18.5 398 442 B A H >< S+ 0 0 39 -4,-1.6 3,-1.4 1,-0.2 -1,-0.2 0.845 94.3 60.1 -74.8 -37.3 64.0 38.4 17.5 399 443 B K T 3< S+ 0 0 101 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.1 0.254 87.3 82.1 -78.0 18.7 62.4 38.5 21.0 400 444 B S T < S- 0 0 75 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.621 93.5-133.8 -94.0 -17.9 65.6 40.1 22.2 401 445 B G < + 0 0 67 -3,-1.4 -3,-0.1 1,-0.3 -2,-0.1 0.037 56.6 137.9 89.6 -29.3 64.6 43.6 21.1 402 446 B I - 0 0 51 -5,-0.2 -1,-0.3 4,-0.1 -2,-0.1 -0.114 62.7 -91.3 -49.5 150.9 67.9 44.5 19.4 403 447 B S - 0 0 63 -3,-0.1 4,-0.3 1,-0.1 -3,-0.1 0.368 38.3 -98.1 -50.0-168.2 67.5 46.3 16.1 404 448 B S S >> S+ 0 0 91 2,-0.2 4,-2.0 1,-0.1 3,-1.0 0.921 120.1 52.0 -84.9 -48.5 67.3 44.5 12.7 405 449 B Q H 3> S+ 0 0 82 1,-0.3 4,-1.4 2,-0.2 -1,-0.1 0.765 111.5 49.4 -60.2 -26.6 70.9 45.0 11.6 406 450 B Q H 3> S+ 0 0 95 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.661 107.1 54.6 -86.5 -17.6 72.1 43.5 15.0 407 451 B Q H <> S+ 0 0 48 -3,-1.0 4,-1.8 -4,-0.3 -2,-0.2 0.828 109.8 47.2 -80.1 -35.0 69.7 40.5 14.6 408 452 B S H X S+ 0 0 22 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.917 112.9 50.7 -69.9 -42.2 71.3 39.8 11.2 409 453 B M H X S+ 0 0 43 -4,-1.4 4,-3.0 -5,-0.2 5,-0.2 0.927 110.3 46.9 -61.0 -49.1 74.7 40.2 12.8 410 454 B R H X S+ 0 0 46 -4,-1.9 4,-3.0 1,-0.2 5,-0.3 0.910 111.4 52.2 -62.2 -40.5 74.1 37.8 15.7 411 455 B L H X S+ 0 0 4 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.950 113.1 45.0 -58.8 -49.1 72.6 35.3 13.3 412 456 B A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.958 115.2 45.7 -59.8 -55.2 75.8 35.5 11.2 413 457 B N H X S+ 0 0 33 -4,-3.0 4,-0.8 2,-0.2 -2,-0.2 0.932 114.0 49.4 -54.5 -51.2 78.2 35.3 14.1 414 458 B L H >< S+ 0 0 0 -4,-3.0 3,-1.1 -5,-0.2 4,-0.3 0.961 115.4 43.3 -53.8 -54.1 76.4 32.5 15.8 415 459 B L H >< S+ 0 0 0 -4,-2.7 3,-1.6 -5,-0.3 4,-0.3 0.831 105.8 60.9 -64.5 -34.7 76.3 30.5 12.5 416 460 B M H >X S+ 0 0 2 -4,-2.8 3,-0.8 1,-0.3 4,-0.6 0.659 94.9 64.0 -66.6 -17.2 79.9 31.2 11.6 417 461 B L H S+ 0 0 6 -3,-1.6 4,-2.3 -4,-0.3 -1,-0.2 0.784 88.9 56.5 -67.7 -25.7 79.5 26.4 13.3 419 463 B S H <> S+ 0 0 3 -3,-0.8 4,-2.5 -4,-0.3 -1,-0.2 0.902 107.2 48.1 -70.3 -41.8 82.6 26.2 11.1 420 464 B H H X S+ 0 0 12 -4,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.837 111.7 49.5 -66.8 -35.3 84.8 26.1 14.2 421 465 B V H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.966 112.7 46.4 -68.0 -52.7 82.6 23.4 15.9 422 466 B R H X S+ 0 0 6 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.914 112.3 52.8 -53.7 -43.7 82.8 21.2 12.8 423 467 B H H X S+ 0 0 45 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.890 108.9 47.1 -61.1 -43.2 86.5 21.9 12.6 424 468 B A H X S+ 0 0 2 -4,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.862 111.2 54.0 -66.9 -35.4 87.1 20.8 16.2 425 469 B S H X S+ 0 0 6 -4,-2.4 4,-3.4 2,-0.2 -2,-0.2 0.934 109.7 46.1 -62.8 -47.7 85.0 17.7 15.5 426 470 B N H X S+ 0 0 20 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.927 114.5 48.1 -61.7 -44.8 87.1 16.8 12.5 427 471 B K H X S+ 0 0 66 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.925 113.9 47.9 -60.5 -44.6 90.3 17.4 14.5 428 472 B G H X S+ 0 0 5 -4,-3.1 4,-2.8 2,-0.2 -2,-0.2 0.933 110.4 50.2 -63.0 -47.8 88.8 15.3 17.4 429 473 B M H X S+ 0 0 67 -4,-3.4 4,-3.3 1,-0.2 5,-0.2 0.934 110.2 50.8 -55.2 -49.1 87.8 12.5 15.1 430 474 B E H X S+ 0 0 65 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.903 113.6 44.8 -55.0 -46.1 91.3 12.4 13.5 431 475 B H H X S+ 0 0 38 -4,-2.1 4,-1.0 2,-0.2 -1,-0.2 0.879 114.1 49.3 -67.9 -39.7 92.9 12.2 16.9 432 476 B L H >< S+ 0 0 67 -4,-2.8 3,-0.6 1,-0.2 -2,-0.2 0.928 109.3 52.1 -64.9 -45.9 90.4 9.6 18.2 433 477 B L H 3< S+ 0 0 139 -4,-3.3 -2,-0.2 2,-0.3 -1,-0.2 0.898 102.0 60.0 -58.3 -42.6 90.9 7.5 15.2 434 478 B N H 3< 0 0 136 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.850 360.0 360.0 -55.0 -35.7 94.7 7.5 15.6 435 479 B M << 0 0 103 -4,-1.0 -2,-0.3 -3,-0.6 -1,-0.2 0.612 360.0 360.0-106.0 360.0 94.2 5.9 19.0 436 ! 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 0.0 437 483 B N 0 0 215 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.6 89.6 -1.6 9.7 438 484 B V - 0 0 134 0, 0.0 3,-0.0 0, 0.0 0, 0.0 -0.785 360.0 -83.0-127.3 171.5 86.5 -2.3 7.7 439 485 B V - 0 0 118 -2,-0.3 2,-0.1 1,-0.1 0, 0.0 -0.656 49.9-110.0 -81.4 123.3 85.6 -2.8 4.0 440 486 B P + 0 0 110 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 -0.291 39.2 175.6 -51.8 120.1 85.1 0.5 2.1 441 487 B V > + 0 0 64 1,-0.1 4,-2.3 2,-0.1 5,-0.2 0.280 44.3 108.0-115.0 10.3 81.4 0.7 1.3 442 488 B Y H > S+ 0 0 90 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.935 83.2 40.6 -52.5 -56.8 81.3 4.2 -0.2 443 489 B D H > S+ 0 0 85 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.914 113.3 54.3 -61.7 -44.3 80.7 3.1 -3.9 444 490 B L H > S+ 0 0 102 1,-0.2 4,-3.4 2,-0.2 -1,-0.2 0.907 105.2 53.3 -57.1 -46.0 78.2 0.3 -3.0 445 491 B L H X S+ 0 0 61 -4,-2.3 4,-3.3 2,-0.2 -1,-0.2 0.899 109.5 48.9 -56.7 -42.3 76.0 2.7 -1.0 446 492 B L H X S+ 0 0 60 -4,-1.5 4,-3.4 2,-0.2 -1,-0.2 0.934 112.0 48.9 -62.5 -45.9 75.8 5.0 -4.1 447 493 B E H X S+ 0 0 118 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.931 113.5 47.5 -58.2 -46.3 75.0 2.0 -6.2 448 494 B M H X>S+ 0 0 64 -4,-3.4 5,-1.4 2,-0.2 4,-1.4 0.924 113.6 45.5 -62.7 -47.1 72.3 1.0 -3.7 449 495 B L H <5S+ 0 0 89 -4,-3.3 3,-0.3 1,-0.2 -2,-0.2 0.944 113.4 52.0 -61.1 -45.0 70.9 4.5 -3.4 450 496 B N H <5S+ 0 0 119 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.855 112.8 43.3 -58.0 -40.0 71.0 4.7 -7.3 451 497 B A H <5S- 0 0 73 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.660 113.6-127.7 -78.9 -18.1 69.1 1.4 -7.6 452 498 B H T <5S+ 0 0 160 -4,-1.4 -3,-0.2 -3,-0.3 -2,-0.1 0.978 75.6 112.9 68.6 62.5 66.8 2.6 -4.8 453 499 B V < + 0 0 100 -5,-1.4 2,-0.7 0, 0.0 -4,-0.2 0.298 35.2 121.6-137.3 -1.8 66.9 -0.2 -2.3 454 500 B L 0 0 36 -6,-0.6 -162,-0.1 -9,-0.1 -9,-0.0 -0.609 360.0 360.0 -74.6 110.4 68.7 1.6 0.6 455 501 B R 0 0 183 -2,-0.7 -1,-0.1 -163,-0.1 -164,-0.0 -0.104 360.0 360.0 39.3 360.0 66.4 1.4 3.6