==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 08-SEP-10 3OSA . COMPND 2 MOLECULE: ESTROGEN RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.BRUNING,A.A.PARENT,G.GIL,M.ZHAO,J.NOWAK,M.C.PACE,C.L.SMITH . 934 13 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39247.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 702 75.2 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 . 24 2.6 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 20 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 550 58.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.1 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 2 1 1 4 0 0 4 0 2 0 0 2 2 0 0 6 0 0 1 2 1 2 2 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 4 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 . 4 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 1 306 A L > 0 0 114 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 174.4 13.6 -17.5 -61.2 2 307 A A G > + 0 0 9 1,-0.3 3,-1.3 2,-0.2 60,-0.0 0.829 360.0 61.8 -72.5 -35.1 10.4 -17.3 -63.3 3 308 A L G 3 S+ 0 0 60 1,-0.3 -1,-0.3 58,-0.0 0, 0.0 0.536 98.5 61.6 -67.0 -8.6 10.6 -13.7 -64.4 4 309 A S G < S+ 0 0 100 -3,-1.1 -1,-0.3 2,-0.0 -2,-0.2 0.606 76.7 113.0 -94.2 -17.6 13.9 -14.5 -66.2 5 310 A L < - 0 0 37 -3,-1.3 -3,-0.0 -4,-0.3 2,-0.0 -0.289 64.0-131.3 -56.7 137.0 12.5 -17.1 -68.6 6 311 A T > - 0 0 68 1,-0.1 4,-1.3 174,-0.0 5,-0.1 -0.235 32.5-102.2 -68.5 176.5 12.4 -16.2 -72.3 7 312 A A H > S+ 0 0 17 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.904 125.4 51.7 -67.5 -40.2 9.1 -16.9 -74.2 8 313 A D H > S+ 0 0 78 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.823 110.3 48.2 -64.5 -34.1 10.6 -20.1 -75.6 9 314 A Q H > S+ 0 0 103 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.755 109.6 54.0 -77.9 -26.8 11.6 -21.2 -72.2 10 315 A M H X S+ 0 0 1 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.940 108.3 46.9 -71.4 -45.0 8.2 -20.4 -70.8 11 316 A V H X S+ 0 0 11 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.911 113.8 50.2 -60.3 -44.5 6.3 -22.6 -73.5 12 317 A S H X S+ 0 0 63 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.885 110.1 48.2 -58.9 -47.6 8.8 -25.4 -72.9 13 318 A A H X S+ 0 0 28 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.933 113.9 48.3 -62.5 -40.6 8.3 -25.4 -69.1 14 319 A L H X S+ 0 0 0 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.900 111.3 48.4 -69.5 -43.7 4.6 -25.3 -69.6 15 320 A L H >< S+ 0 0 71 -4,-2.9 3,-1.3 1,-0.2 -2,-0.2 0.969 111.6 50.0 -58.5 -52.6 4.5 -28.1 -72.0 16 321 A D H 3< S+ 0 0 108 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.813 106.7 57.4 -52.7 -31.1 6.7 -30.3 -69.8 17 322 A A H 3< S+ 0 0 7 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.742 77.2 131.2 -77.4 -21.0 4.4 -29.5 -66.8 18 323 A E << - 0 0 67 -3,-1.3 -3,-0.1 -4,-0.9 34,-0.0 0.087 55.2-129.5 -34.2 129.2 1.3 -30.9 -68.6 19 324 A P - 0 0 45 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.359 28.9 -99.7 -76.9 166.5 -0.8 -33.3 -66.4 20 325 A P - 0 0 66 0, 0.0 2,-0.5 0, 0.0 31,-0.1 -0.488 30.7-108.7 -83.6 158.8 -1.8 -36.7 -67.8 21 326 A I - 0 0 98 -2,-0.1 2,-0.2 79,-0.0 79,-0.1 -0.756 39.1-152.2 -79.8 127.8 -5.2 -37.6 -69.2 22 327 A L - 0 0 30 -2,-0.5 2,-0.3 77,-0.2 22,-0.0 -0.641 8.1-122.5-100.2 158.7 -7.1 -39.9 -66.8 23 328 A Y - 0 0 145 -2,-0.2 2,-0.1 77,-0.2 3,-0.1 -0.698 26.5-114.2 -95.6 151.1 -9.7 -42.6 -67.4 24 329 A S - 0 0 4 -2,-0.3 3,-0.1 1,-0.2 17,-0.1 -0.438 58.4 -67.8 -73.8 154.4 -13.1 -42.5 -65.9 25 330 A E S S- 0 0 40 15,-0.3 -1,-0.2 1,-0.1 19,-0.0 -0.254 73.4-104.6 -47.1 123.9 -13.9 -45.3 -63.5 26 331 A Y S S- 0 0 188 1,-0.2 -1,-0.1 -3,-0.1 77,-0.0 -0.253 83.1 -5.4 -67.9 138.2 -14.0 -48.2 -65.9 27 332 A D S S- 0 0 125 75,-0.2 -1,-0.2 -3,-0.1 2,-0.1 0.934 75.5-174.7 54.8 63.3 -17.2 -49.8 -67.0 28 333 A P - 0 0 33 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.400 42.3 -77.2 -78.5 166.2 -19.9 -48.1 -65.0 29 334 A T - 0 0 121 -2,-0.1 4,-0.2 7,-0.0 -2,-0.0 -0.481 61.0-128.7 -57.9 126.6 -23.5 -49.1 -65.2 30 335 A R S S+ 0 0 124 -2,-0.2 2,-0.2 2,-0.1 3,-0.0 -0.953 85.9 52.7-116.7 145.5 -25.0 -47.8 -68.4 31 336 A P S S- 0 0 117 0, 0.0 2,-0.2 0, 0.0 79,-0.1 0.646 93.6-133.1 -63.0 167.7 -27.5 -46.2 -68.9 32 337 A F - 0 0 20 77,-0.3 2,-0.2 -2,-0.2 -2,-0.1 -0.562 10.9-146.7 -90.8 152.5 -26.5 -43.5 -66.4 33 338 A S > - 0 0 70 -2,-0.2 4,-2.2 -4,-0.2 78,-0.5 -0.572 37.9 -98.2-101.5 178.9 -28.7 -42.0 -63.7 34 339 A E H > S+ 0 0 56 1,-0.2 4,-1.5 -2,-0.2 5,-0.0 0.898 124.2 39.0 -68.6 -41.9 -28.3 -38.4 -62.5 35 340 A A H > S+ 0 0 72 2,-0.2 4,-2.7 1,-0.1 -1,-0.2 0.768 110.3 59.2 -76.7 -31.3 -26.2 -39.4 -59.5 36 341 A S H > S+ 0 0 40 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.956 107.6 46.8 -67.9 -45.7 -24.2 -42.1 -61.2 37 342 A M H >X S+ 0 0 16 -4,-2.2 4,-2.4 1,-0.2 3,-0.6 0.973 113.3 48.7 -55.3 -51.3 -22.9 -39.7 -63.7 38 343 A M H 3X S+ 0 0 26 -4,-1.5 4,-2.6 1,-0.3 5,-0.3 0.854 107.1 55.9 -59.5 -32.9 -22.1 -37.2 -60.9 39 344 A G H 3X S+ 0 0 41 -4,-2.7 4,-2.0 1,-0.2 -1,-0.3 0.887 111.2 45.5 -63.5 -35.7 -20.4 -40.0 -59.0 40 345 A L H X S+ 0 0 9 -4,-2.5 4,-1.7 1,-0.2 3,-0.6 0.900 94.3 52.8 -46.2 -52.2 -6.9 -32.8 -58.5 50 355 A V H 3X S+ 0 0 71 -4,-1.0 4,-1.4 1,-0.3 3,-0.4 0.927 111.6 46.3 -53.2 -48.2 -3.7 -34.6 -57.3 51 356 A H H 3X S+ 0 0 60 -4,-0.9 4,-1.8 1,-0.2 -1,-0.3 0.733 104.5 59.9 -68.5 -24.4 -2.2 -34.1 -60.7 52 357 A M H < S+ 0 0 3 -4,-1.8 3,-1.4 2,-0.2 -2,-0.2 0.934 110.0 52.8 -68.8 -46.5 1.2 -29.2 -62.5 56 361 A A H >< S+ 0 0 0 -4,-3.6 3,-2.2 1,-0.3 6,-0.2 0.911 103.3 57.3 -59.1 -45.4 0.6 -26.0 -60.6 57 362 A K T 3< S+ 0 0 59 -4,-2.6 6,-0.3 1,-0.3 -1,-0.3 0.631 106.5 51.3 -59.4 -17.0 3.9 -26.3 -58.7 58 363 A R T < S+ 0 0 135 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.324 79.1 110.4-102.3 7.3 5.7 -26.4 -62.1 59 364 A V S X S- 0 0 2 -3,-2.2 3,-2.9 -4,-0.2 4,-0.5 -0.744 88.2-103.9 -77.8 117.6 4.0 -23.3 -63.5 60 365 A P T 3 S+ 0 0 17 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.214 105.5 13.1 -45.5 120.4 6.8 -20.8 -63.5 61 366 A G T 3 S+ 0 0 4 -4,-0.1 3,-0.5 4,-0.0 4,-0.3 0.097 95.6 103.9 101.3 -22.8 6.3 -18.5 -60.6 62 367 A F S X S+ 0 0 0 -3,-2.9 3,-1.8 -6,-0.2 -5,-0.1 0.951 80.5 51.7 -56.1 -47.8 3.7 -20.5 -58.7 63 368 A V T 3 S+ 0 0 80 -4,-0.5 -1,-0.2 -6,-0.3 7,-0.1 0.753 93.7 71.3 -66.0 -24.1 6.1 -21.8 -56.1 64 369 A D T 3 S+ 0 0 77 -3,-0.5 -1,-0.3 105,-0.0 2,-0.2 0.599 85.0 93.0 -66.0 -7.9 7.4 -18.3 -55.3 65 370 A L S < S- 0 0 7 -3,-1.8 -4,-0.0 -4,-0.3 -3,-0.0 -0.531 89.3-103.8 -86.0 149.9 4.1 -17.7 -53.6 66 371 A T > - 0 0 43 -2,-0.2 4,-2.0 1,-0.1 3,-0.2 -0.332 37.6-110.5 -60.2 158.7 3.4 -18.4 -50.0 67 372 A R H > S+ 0 0 32 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.897 117.3 60.1 -59.6 -43.9 1.5 -21.6 -49.5 68 373 A H H > S+ 0 0 32 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.905 108.6 43.0 -54.1 -42.8 -1.6 -19.7 -48.4 69 374 A D H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.863 109.4 57.1 -75.2 -30.7 -1.7 -17.9 -51.8 70 375 A Q H X S+ 0 0 21 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.921 111.2 44.4 -64.9 -35.4 -1.0 -21.1 -53.7 71 376 A V H X S+ 0 0 0 -4,-2.5 4,-3.2 2,-0.2 3,-0.3 0.938 110.8 51.8 -71.4 -48.2 -4.0 -22.6 -52.0 72 377 A H H X S+ 0 0 24 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.896 109.5 51.6 -55.8 -39.9 -6.3 -19.7 -52.5 73 378 A L H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.837 113.7 43.4 -65.5 -35.3 -5.4 -19.6 -56.2 74 379 A L H X S+ 0 0 1 -4,-1.2 4,-2.2 -3,-0.3 -2,-0.2 0.913 109.3 56.7 -79.7 -41.9 -6.2 -23.3 -56.6 75 380 A E H < S+ 0 0 73 -4,-3.2 4,-0.3 1,-0.2 -2,-0.2 0.896 114.4 39.7 -46.0 -50.8 -9.4 -23.1 -54.6 76 381 A C H < S+ 0 0 42 -4,-1.9 4,-0.3 -5,-0.2 -1,-0.2 0.828 124.9 35.3 -75.5 -32.0 -10.7 -20.4 -56.9 77 382 A A H X S+ 0 0 0 -4,-1.4 4,-2.6 -5,-0.2 5,-0.2 0.532 82.6 98.3-102.8 -11.6 -9.5 -21.9 -60.2 78 383 A W H X S+ 0 0 15 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.874 89.4 41.8 -57.7 -45.3 -9.7 -25.7 -60.0 79 384 A L H > S+ 0 0 22 -4,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.931 113.5 53.2 -68.7 -43.2 -13.0 -26.2 -61.8 80 385 A E H > S+ 0 0 2 -4,-0.3 4,-2.1 1,-0.2 5,-0.2 0.924 110.2 50.2 -50.4 -44.5 -12.1 -23.6 -64.5 81 386 A I H X S+ 0 0 8 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.918 111.2 45.9 -66.4 -46.2 -8.8 -25.5 -65.0 82 387 A L H X S+ 0 0 21 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.2 0.952 112.3 53.9 -56.4 -46.8 -10.6 -28.9 -65.4 83 388 A M H X S+ 0 0 17 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.822 106.8 48.3 -63.7 -33.5 -13.1 -27.3 -67.7 84 389 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.874 109.9 54.8 -75.5 -31.2 -10.5 -25.8 -70.0 85 390 A G H X S+ 0 0 10 -4,-1.9 4,-2.9 -5,-0.2 5,-0.2 0.981 110.3 46.0 -54.5 -60.9 -8.9 -29.3 -70.0 86 391 A L H X S+ 0 0 7 -4,-2.7 4,-2.4 1,-0.2 12,-0.4 0.915 111.3 49.9 -43.0 -60.4 -12.2 -30.8 -71.1 87 392 A V H < S+ 0 0 0 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.874 112.2 49.3 -56.1 -38.8 -12.9 -28.2 -73.8 88 393 A W H >< S+ 0 0 82 -4,-2.3 3,-1.9 1,-0.2 4,-0.3 0.987 111.8 47.8 -61.7 -59.2 -9.4 -28.8 -75.2 89 394 A R H 3< S+ 0 0 41 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.824 111.4 53.0 -42.0 -39.7 -9.8 -32.5 -75.2 90 395 A S T >< S+ 0 0 0 -4,-2.4 3,-1.9 -5,-0.2 6,-0.3 0.463 76.6 103.1 -87.2 0.3 -13.2 -32.2 -76.9 91 396 A M T < S+ 0 0 25 -3,-1.9 -1,-0.2 -4,-0.3 -2,-0.1 0.866 83.8 41.7 -58.0 -45.1 -12.2 -30.0 -79.8 92 397 A E T 3 S+ 0 0 167 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 -0.032 101.5 77.9 -98.6 38.1 -12.1 -32.6 -82.5 93 398 A H S X S- 0 0 60 -3,-1.9 3,-2.3 3,-0.2 -1,-0.2 -0.576 72.7-156.9-138.8 72.3 -15.4 -34.3 -81.2 94 399 A P T 3 S+ 0 0 89 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.235 79.1 13.5 -50.1 126.2 -18.2 -32.0 -82.4 95 400 A G T 3 S+ 0 0 41 1,-0.2 12,-0.5 29,-0.1 2,-0.4 0.343 114.4 89.3 91.7 -7.3 -21.3 -32.5 -80.3 96 401 A K E < -A 106 0A 80 -3,-2.3 2,-0.6 -6,-0.3 10,-0.2 -0.944 63.5-140.9-132.7 147.5 -19.4 -34.4 -77.5 97 402 A L E -A 105 0A 0 8,-2.8 8,-2.1 -2,-0.4 2,-1.6 -0.913 14.4-152.0-105.7 117.6 -17.5 -33.8 -74.3 98 403 A L E +A 104 0A 23 -2,-0.6 6,-0.2 -12,-0.4 -9,-0.1 -0.611 28.4 162.0 -85.8 78.6 -14.5 -36.0 -73.8 99 404 A F E S- 0 0 26 -2,-1.6 -1,-0.2 4,-1.3 -77,-0.2 0.918 78.1 -6.6 -65.7 -41.5 -14.4 -36.1 -70.0 100 405 A A E > S-A 103 0A 0 3,-1.0 3,-2.5 -3,-0.2 -1,-0.3 -0.951 76.7-108.3-145.1 164.0 -12.2 -39.2 -70.3 101 406 A P T 3 S+ 0 0 62 0, 0.0 3,-0.2 0, 0.0 -78,-0.1 0.838 126.6 43.7 -68.8 -24.7 -11.2 -41.3 -73.3 102 407 A N T 3 S+ 0 0 52 1,-0.2 -75,-0.2 -4,-0.0 -79,-0.1 0.042 112.6 58.7 -97.8 24.2 -13.6 -44.0 -72.0 103 408 A L E < +A 100 0A 1 -3,-2.5 -4,-1.3 -77,-0.0 -3,-1.0 -0.413 60.1 157.2-152.0 68.6 -16.3 -41.4 -71.2 104 409 A L E -A 98 0A 47 -3,-0.2 2,-0.4 -6,-0.2 -6,-0.2 -0.855 21.5-171.8-102.7 108.2 -17.3 -39.5 -74.3 105 410 A L E -A 97 0A 1 -8,-2.1 -8,-2.8 -2,-0.7 2,-0.2 -0.816 16.3-153.6-108.9 137.0 -20.8 -38.0 -73.9 106 411 A D E > -A 96 0A 47 -2,-0.4 4,-0.8 -10,-0.2 -10,-0.2 -0.461 46.6 -89.8 -89.4 179.0 -23.2 -36.3 -76.2 107 412 A R T 4 S+ 0 0 141 -12,-0.5 14,-0.1 1,-0.2 13,-0.1 0.636 125.0 39.3 -70.3 -16.4 -25.8 -33.8 -74.9 108 413 A N T 4 S+ 0 0 140 3,-0.1 -1,-0.2 1,-0.0 -3,-0.0 0.778 98.8 74.0-101.5 -31.6 -28.4 -36.6 -74.4 109 414 A Q T 4 S+ 0 0 68 2,-0.1 -77,-0.3 -3,-0.1 -2,-0.1 0.932 84.2 63.2 -53.5 -69.3 -26.4 -39.5 -73.0 110 415 A G < 0 0 21 -4,-0.8 -76,-0.1 1,-0.1 -77,-0.0 -0.165 360.0 360.0 -57.0 152.4 -25.6 -38.5 -69.5 111 416 A K 0 0 49 -78,-0.5 -73,-0.2 -77,-0.0 -74,-0.2 -0.772 360.0 360.0 -93.4 360.0 -28.5 -38.1 -67.0 112 ! 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 0.0 113 418 A V > 0 0 96 0, 0.0 4,-2.2 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 165.3 -30.5 -31.7 -64.7 114 419 A E H > + 0 0 156 1,-0.3 4,-0.8 2,-0.2 5,-0.0 0.770 360.0 52.0 -72.2 -22.0 -31.7 -28.9 -66.9 115 420 A G H > S+ 0 0 33 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.757 108.6 54.4 -73.9 -27.1 -29.2 -26.5 -65.4 116 421 A M H > S+ 0 0 38 -3,-0.4 4,-3.0 2,-0.2 -2,-0.2 0.914 102.6 54.0 -71.4 -44.2 -26.6 -29.1 -66.1 117 422 A V H X S+ 0 0 46 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.805 104.3 55.9 -66.0 -24.5 -27.6 -29.3 -69.8 118 423 A E H X S+ 0 0 113 -4,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.915 110.3 45.3 -68.6 -43.4 -27.1 -25.5 -70.1 119 424 A I H X S+ 0 0 18 -4,-1.3 4,-3.4 2,-0.2 5,-0.2 0.962 112.1 50.9 -62.0 -51.0 -23.5 -25.9 -68.8 120 425 A F H X S+ 0 0 31 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.943 111.1 49.0 -47.6 -57.1 -22.9 -28.9 -71.0 121 426 A D H X S+ 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0.570 81.0-115.6 -22.8 147.3 0.4 -5.7 -45.8 161 466 A L H > S+ 0 0 127 1,-0.3 4,-2.6 2,-0.2 -1,-0.1 0.832 117.7 51.4 -52.4 -40.9 3.4 -5.0 -47.9 162 467 A K H > S+ 0 0 87 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.876 106.2 54.6 -66.4 -37.8 3.9 -8.8 -48.5 163 468 A S H > S+ 0 0 21 -3,-0.4 4,-1.5 1,-0.2 -2,-0.2 0.855 111.8 45.2 -64.2 -34.2 0.2 -9.0 -49.6 164 469 A L H X S+ 0 0 92 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.896 110.3 54.1 -73.5 -42.6 1.0 -6.3 -52.2 165 470 A E H X S+ 0 0 116 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.938 107.4 50.5 -55.4 -50.0 4.3 -8.0 -53.2 166 471 A E H X S+ 0 0 19 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.932 111.5 47.5 -57.3 -47.1 2.5 -11.3 -54.0 167 472 A K H X S+ 0 0 22 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.870 111.7 51.5 -62.2 -31.1 -0.1 -9.5 -56.1 168 473 A D H X S+ 0 0 87 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.868 109.8 49.1 -76.5 -33.4 2.7 -7.7 -57.9 169 474 A H H X S+ 0 0 29 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.923 109.9 50.0 -69.9 -49.1 4.6 -10.8 -58.6 170 475 A I H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 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506 B Q H X S+ 0 0 37 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.873 112.7 48.2 -59.9 -39.5 -10.2 -29.3 -10.7 444 507 B L H X S+ 0 0 0 -4,-2.7 4,-0.9 -5,-0.2 3,-0.3 0.925 113.2 45.8 -65.7 -47.4 -8.4 -26.7 -12.8 445 508 B L H >X S+ 0 0 0 -4,-2.3 4,-0.7 -5,-0.2 3,-0.7 0.888 106.5 58.9 -67.2 -35.6 -8.6 -28.7 -16.0 446 509 B L H >X S+ 0 0 7 -4,-2.9 4,-0.9 1,-0.3 3,-0.6 0.812 99.2 60.3 -61.1 -30.4 -12.3 -29.5 -15.5 447 510 B I H 3X S+ 0 0 0 -4,-1.0 4,-1.9 -3,-0.3 3,-0.4 0.836 92.9 64.8 -68.1 -33.0 -13.0 -25.8 -15.5 448 511 B L H < S+ 0 0 52 -4,-1.7 3,-1.5 1,-0.2 -1,-0.2 0.921 109.5 56.2 -64.5 -48.9 -24.4 -15.5 -30.4 462 525 B L H >< S+ 0 0 22 -4,-2.7 3,-0.7 1,-0.3 5,-0.3 0.800 106.6 51.2 -50.4 -36.2 -21.7 -13.7 -32.5 463 526 B Y T 3< S+ 0 0 155 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.646 98.9 67.7 -80.6 -12.5 -22.8 -15.7 -35.5 464 527 B S T < S+ 0 0 90 -3,-1.5 2,-0.4 -4,-0.5 -1,-0.2 -0.123 84.2 88.5-101.4 37.1 -26.4 -14.7 -35.0 465 528 B M S < S- 0 0 50 -3,-0.7 2,-1.4 0, 0.0 3,-0.5 -0.998 78.5-130.9-127.7 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