==== 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 4IWF . 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 . 483 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19930.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 372 77.0 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 . 12 2.5 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 . 9 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 287 59.4 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 1 1 0 1 2 1 0 0 0 0 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 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 77 0, 0.0 4,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 151.3 17.4 21.3 27.8 2 306 A L >> + 0 0 148 2,-0.2 4,-1.1 1,-0.1 3,-0.5 0.736 360.0 65.9 -83.5 -26.4 18.0 19.0 30.8 3 307 A A G >4 S+ 0 0 7 1,-0.2 3,-1.0 2,-0.2 -1,-0.1 0.955 98.3 51.4 -58.9 -52.2 17.4 15.8 28.7 4 308 A L G 34 S+ 0 0 48 1,-0.2 -1,-0.2 58,-0.0 -2,-0.2 0.711 108.9 55.1 -57.3 -20.1 20.5 16.4 26.6 5 309 A S G <4 S+ 0 0 88 -3,-0.5 -1,-0.2 -4,-0.2 -2,-0.2 0.727 82.8 106.2 -89.6 -24.4 22.5 16.8 29.9 6 310 A L << - 0 0 44 -4,-1.1 2,-0.1 -3,-1.0 -3,-0.0 -0.199 69.2-125.1 -54.8 142.1 21.5 13.4 31.4 7 311 A T > - 0 0 71 1,-0.1 4,-2.0 167,-0.0 5,-0.1 -0.338 29.9-101.7 -75.2 170.3 24.1 10.7 31.5 8 312 A A H > S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.943 124.7 49.5 -57.5 -48.2 23.4 7.3 30.0 9 313 A D H > S+ 0 0 80 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.846 110.5 49.3 -62.1 -36.0 22.8 5.9 33.4 10 314 A Q H > S+ 0 0 100 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.818 108.2 54.9 -73.4 -32.8 20.4 8.7 34.4 11 315 A M H X S+ 0 0 3 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.954 110.2 45.2 -60.8 -51.9 18.5 8.2 31.1 12 316 A V H X S+ 0 0 11 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.911 113.1 51.5 -59.3 -43.9 17.9 4.5 31.9 13 317 A S H X S+ 0 0 60 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.946 109.2 49.4 -61.1 -48.5 16.9 5.4 35.4 14 318 A A H X S+ 0 0 30 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.903 114.4 45.4 -54.9 -44.9 14.4 8.0 34.3 15 319 A L H < S+ 0 0 1 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.885 110.8 51.3 -72.3 -40.0 12.8 5.6 31.8 16 320 A L H >< S+ 0 0 71 -4,-2.7 3,-0.9 1,-0.2 -1,-0.2 0.905 112.6 47.0 -63.8 -38.9 12.7 2.6 34.2 17 321 A D H 3< S+ 0 0 115 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.785 107.0 57.8 -73.9 -26.1 10.9 4.7 36.8 18 322 A A T 3< S+ 0 0 6 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.507 77.7 129.1 -80.8 -6.2 8.5 6.1 34.3 19 323 A E < - 0 0 60 -3,-0.9 -3,-0.1 -4,-0.4 34,-0.0 -0.240 58.6-125.4 -56.7 132.6 7.2 2.7 33.4 20 324 A P - 0 0 41 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.339 29.9 -98.2 -73.5 162.6 3.4 2.3 33.5 21 325 A P - 0 0 72 0, 0.0 2,-0.6 0, 0.0 31,-0.1 -0.357 33.3-106.0 -75.1 157.9 1.7 -0.4 35.6 22 326 A I - 0 0 102 -2,-0.1 2,-0.2 68,-0.0 79,-0.1 -0.794 44.8-150.9 -80.3 121.1 0.5 -3.7 34.2 23 327 A L - 0 0 30 -2,-0.6 2,-0.3 77,-0.2 22,-0.0 -0.586 6.6-122.1 -96.2 155.8 -3.3 -3.3 34.1 24 328 A Y - 0 0 141 -2,-0.2 2,-0.2 77,-0.2 77,-0.0 -0.687 22.9-127.8 -90.4 149.3 -6.0 -6.0 34.4 25 329 A S - 0 0 7 -2,-0.3 17,-0.1 1,-0.1 16,-0.1 -0.486 21.1-117.4 -84.2 166.1 -8.7 -6.5 31.8 26 330 A E + 0 0 74 15,-0.2 -1,-0.1 -2,-0.2 15,-0.0 0.049 56.5 162.4 -90.5 29.0 -12.4 -6.6 32.6 27 331 A Y - 0 0 79 1,-0.1 11,-0.0 14,-0.1 77,-0.0 -0.188 27.9-153.5 -49.6 131.0 -12.5 -10.2 31.4 28 332 A D > - 0 0 72 1,-0.1 3,-1.5 3,-0.1 -1,-0.1 -0.903 11.7-172.2-114.5 105.2 -15.5 -12.1 32.6 29 333 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.451 79.8 73.4 -74.4 -1.4 -15.0 -15.9 32.9 30 334 A T T 3 S+ 0 0 113 2,-0.1 -2,-0.0 1,-0.0 0, 0.0 0.645 97.6 56.5 -81.5 -15.9 -18.7 -16.5 33.6 31 335 A R S < S- 0 0 157 -3,-1.5 -3,-0.1 1,-0.0 2,-0.1 -0.893 85.9-119.7-120.1 142.8 -19.4 -15.8 30.0 32 336 A P - 0 0 102 0, 0.0 2,-0.1 0, 0.0 5,-0.1 -0.412 41.0 -95.9 -75.1 158.2 -18.0 -17.4 26.8 33 337 A F - 0 0 60 -2,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.465 39.2-178.2 -71.2 143.1 -16.2 -15.2 24.3 34 338 A S > - 0 0 48 -2,-0.1 4,-2.3 1,-0.1 5,-0.3 -0.830 44.0-105.5-119.8 171.9 -17.9 -13.7 21.3 35 339 A E H > S+ 0 0 58 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.959 123.9 47.6 -56.4 -49.3 -16.2 -11.6 18.6 36 340 A A H > S+ 0 0 45 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.908 112.4 47.3 -58.1 -45.8 -17.8 -8.6 20.1 37 341 A S H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.879 112.6 47.6 -72.4 -36.7 -16.8 -9.4 23.7 38 342 A M H X S+ 0 0 1 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.934 113.8 47.5 -68.9 -43.7 -13.2 -10.2 23.0 39 343 A M H X S+ 0 0 5 -4,-2.4 4,-2.1 -5,-0.3 5,-0.2 0.878 109.2 56.7 -60.6 -36.5 -12.8 -7.0 20.9 40 344 A G H X S+ 0 0 27 -4,-2.3 4,-2.5 -5,-0.2 5,-0.3 0.919 106.2 49.7 -57.7 -45.4 -14.5 -5.3 23.9 41 345 A L H X S+ 0 0 15 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.948 111.9 46.0 -60.5 -50.7 -11.8 -6.5 26.2 42 346 A L H X S+ 0 0 27 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.872 116.4 44.8 -62.3 -37.9 -8.9 -5.4 24.1 43 347 A T H X S+ 0 0 12 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.863 112.9 49.0 -78.6 -36.9 -10.3 -2.0 23.4 44 348 A N H X S+ 0 0 65 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.911 115.1 47.0 -62.4 -45.7 -11.4 -1.3 27.0 45 349 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 -5,-0.3 -2,-0.2 0.913 111.4 50.2 -60.8 -46.5 -7.9 -2.4 28.1 46 350 A A H X S+ 0 0 14 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.909 108.8 53.8 -60.8 -38.9 -6.2 -0.2 25.4 47 351 A D H X S+ 0 0 37 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.920 110.0 44.7 -63.9 -45.9 -8.3 2.7 26.5 48 352 A R H X S+ 0 0 80 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.871 112.5 53.0 -67.2 -34.8 -7.2 2.4 30.2 49 353 A E H X S+ 0 0 32 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.858 99.4 63.8 -66.9 -33.9 -3.6 1.9 29.1 50 354 A L H X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.897 97.8 54.9 -59.1 -41.7 -3.7 5.1 27.0 51 355 A V H X S+ 0 0 60 -4,-1.1 4,-1.3 1,-0.2 -1,-0.2 0.922 111.9 43.2 -59.0 -43.5 -4.2 7.2 30.0 52 356 A H H X S+ 0 0 66 -4,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.824 108.3 60.3 -69.9 -31.0 -1.1 5.8 31.7 53 357 A M H X S+ 0 0 9 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.900 101.9 53.6 -63.4 -38.3 0.8 6.1 28.4 54 358 A I H X S+ 0 0 5 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.911 108.7 47.3 -64.1 -44.0 0.2 9.8 28.5 55 359 A N H X S+ 0 0 84 -4,-1.3 4,-0.5 1,-0.2 -1,-0.2 0.899 113.7 50.8 -61.7 -40.4 1.7 10.2 32.0 56 360 A W H >X S+ 0 0 5 -4,-2.2 3,-1.8 1,-0.2 4,-0.6 0.929 105.6 52.7 -62.3 -46.5 4.6 8.1 30.8 57 361 A A H >< S+ 0 0 0 -4,-2.9 3,-1.4 1,-0.3 6,-0.2 0.886 101.9 61.6 -62.7 -34.5 5.3 10.1 27.7 58 362 A K H 3< S+ 0 0 55 -4,-1.7 6,-0.3 1,-0.3 -1,-0.3 0.753 104.6 49.2 -62.2 -20.0 5.5 13.2 29.8 59 363 A R H << S+ 0 0 130 -3,-1.8 -1,-0.3 -4,-0.5 -2,-0.2 0.480 81.3 107.3-100.9 -2.4 8.4 11.6 31.7 60 364 A V S X< S- 0 0 2 -3,-1.4 3,-2.5 -4,-0.6 4,-0.4 -0.678 87.9-104.1 -73.7 115.9 10.3 10.6 28.6 61 365 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.094 102.7 15.1 -44.1 131.7 13.2 13.1 28.6 62 366 A G T > S+ 0 0 5 -4,-0.1 3,-0.8 1,-0.0 4,-0.4 0.116 98.0 99.6 91.0 -22.1 12.7 15.9 26.0 63 367 A F G X S+ 0 0 0 -3,-2.5 3,-1.5 1,-0.2 -5,-0.1 0.901 78.1 54.3 -68.8 -39.8 9.0 15.2 25.5 64 368 A V G 3 S+ 0 0 82 -4,-0.4 -1,-0.2 -6,-0.3 -6,-0.1 0.608 96.1 70.1 -69.3 -11.0 7.8 18.0 27.7 65 369 A D G < S+ 0 0 81 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.692 85.8 85.2 -79.6 -17.3 9.9 20.5 25.7 66 370 A L S < S- 0 0 8 -3,-1.5 -4,-0.0 -4,-0.4 2,-0.0 -0.392 89.4 -98.4 -81.5 157.6 7.6 20.1 22.7 67 371 A T > - 0 0 66 1,-0.1 4,-2.7 -2,-0.1 5,-0.2 -0.323 36.1-107.6 -66.6 158.8 4.4 22.1 22.1 68 372 A L H > S+ 0 0 50 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.872 122.2 55.0 -53.9 -39.9 1.1 20.4 22.9 69 373 A H H > S+ 0 0 138 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.889 109.4 46.1 -65.1 -38.8 0.4 20.1 19.2 70 374 A D H > S+ 0 0 34 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.894 113.1 49.1 -67.5 -41.5 3.7 18.2 18.7 71 375 A Q H X S+ 0 0 13 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.947 111.6 49.8 -62.7 -46.5 3.1 16.0 21.7 72 376 A V H X S+ 0 0 6 -4,-3.0 4,-2.9 -5,-0.2 5,-0.2 0.940 111.4 49.1 -54.4 -49.7 -0.4 15.2 20.4 73 377 A H H X S+ 0 0 42 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.934 110.7 48.1 -59.9 -51.6 0.9 14.3 17.0 74 378 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.909 115.8 44.4 -54.4 -45.5 3.7 12.0 18.2 75 379 A L H X S+ 0 0 2 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.902 111.4 53.1 -70.4 -38.5 1.3 10.2 20.5 76 380 A E H < S+ 0 0 16 -4,-2.9 4,-0.2 -5,-0.2 -1,-0.2 0.892 114.7 43.8 -61.2 -37.5 -1.4 10.0 17.8 77 381 A C H < S+ 0 0 13 -4,-2.4 4,-0.2 -5,-0.2 -2,-0.2 0.902 125.0 29.2 -74.6 -38.1 1.1 8.4 15.5 78 382 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.495 83.2 104.2-106.4 -5.5 2.8 6.0 17.9 79 383 A W H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.858 87.3 41.4 -52.4 -45.8 0.1 5.0 20.5 80 384 A L H > S+ 0 0 19 -4,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.892 113.9 52.7 -73.7 -35.5 -0.7 1.5 19.1 81 385 A E H > S+ 0 0 0 -4,-0.2 4,-3.0 2,-0.2 5,-0.2 0.942 111.0 48.2 -56.4 -46.4 3.0 0.7 18.4 82 386 A I H X S+ 0 0 8 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.886 112.2 48.3 -63.8 -41.1 3.7 1.6 22.0 83 387 A L H X S+ 0 0 16 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.922 114.5 47.3 -63.6 -42.1 0.9 -0.6 23.2 84 388 A M H X S+ 0 0 15 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.882 107.5 52.1 -71.7 -41.2 2.1 -3.5 21.1 85 389 A I H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.915 111.2 50.8 -61.4 -36.1 5.7 -3.3 22.0 86 390 A G H X S+ 0 0 9 -4,-1.5 4,-2.5 -5,-0.2 -2,-0.2 0.913 110.1 49.2 -62.9 -43.7 4.6 -3.5 25.6 87 391 A L H X S+ 0 0 6 -4,-1.9 4,-1.6 2,-0.2 12,-0.4 0.931 112.1 47.4 -59.0 -49.0 2.4 -6.5 24.9 88 392 A V H X S+ 0 0 0 -4,-2.7 4,-0.8 1,-0.2 3,-0.3 0.936 111.4 53.4 -60.5 -44.0 5.2 -8.3 23.1 89 393 A W H >< S+ 0 0 76 -4,-2.5 3,-0.9 -5,-0.2 4,-0.3 0.929 111.8 42.0 -58.2 -48.2 7.5 -7.4 26.0 90 394 A R H 3< S+ 0 0 44 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.710 110.5 58.1 -78.5 -13.5 5.3 -8.8 28.7 91 395 A S H >< S+ 0 0 0 -4,-1.6 3,-2.8 -3,-0.3 6,-0.3 0.616 78.7 99.7 -83.0 -11.8 4.4 -11.9 26.6 92 396 A M T << S+ 0 0 5 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.1 0.820 82.0 44.4 -44.5 -48.6 8.2 -12.8 26.4 93 397 A E T 3 S+ 0 0 139 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.197 102.8 73.4 -88.9 19.8 8.1 -15.5 29.1 94 398 A H S X S- 0 0 68 -3,-2.8 3,-2.5 3,-0.2 -1,-0.2 -0.605 75.7-157.0-129.6 72.7 4.9 -17.0 27.8 95 399 A P T 3 S+ 0 0 81 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.221 80.1 12.5 -52.3 132.3 5.9 -18.8 24.5 96 400 A G T 3 S+ 0 0 42 1,-0.2 12,-0.5 29,-0.2 2,-0.3 0.446 115.7 89.6 80.8 1.0 2.9 -19.2 22.3 97 401 A K E < -A 107 0A 87 -3,-2.5 2,-0.5 -6,-0.3 10,-0.2 -0.927 65.4-139.4-132.2 156.3 0.8 -16.7 24.3 98 402 A L E -A 106 0A 0 8,-2.9 8,-2.3 -2,-0.3 2,-1.6 -0.962 13.4-151.9-114.3 116.1 -0.0 -13.0 24.4 99 403 A L E +A 105 0A 24 -2,-0.5 6,-0.2 -12,-0.4 -9,-0.1 -0.613 27.8 162.8 -87.9 77.6 -0.3 -11.6 28.0 100 404 A F E S- 0 0 22 -2,-1.6 -1,-0.2 4,-1.2 -77,-0.2 0.902 78.4 -15.9 -58.3 -39.3 -2.7 -8.8 27.3 101 405 A A E > S-A 104 0A 0 3,-1.5 3,-2.2 -3,-0.2 -1,-0.3 -0.950 76.3 -98.0-156.4 162.0 -3.2 -8.7 31.0 102 406 A P T 3 S+ 0 0 59 0, 0.0 3,-0.2 0, 0.0 -78,-0.1 0.814 128.7 42.0 -56.3 -29.9 -2.4 -11.1 33.9 103 407 A N T 3 S+ 0 0 55 1,-0.2 2,-0.2 -4,-0.0 -79,-0.1 0.133 113.1 57.5-102.8 16.4 -6.1 -12.3 33.7 104 408 A L E < +A 101 0A 4 -3,-2.2 -3,-1.5 2,-0.0 -4,-1.2 -0.626 58.4 157.1-150.5 83.7 -6.1 -12.3 29.9 105 409 A L E -A 99 0A 58 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.953 21.6-173.9-115.1 109.6 -3.5 -14.6 28.4 106 410 A L E -A 98 0A 3 -8,-2.3 -8,-2.9 -2,-0.6 2,-0.2 -0.848 16.1-151.3-117.2 141.1 -4.5 -15.7 24.9 107 411 A D E >> -A 97 0A 55 -2,-0.4 4,-1.3 -10,-0.2 3,-1.1 -0.543 42.3 -94.8 -97.2 171.4 -3.1 -18.1 22.3 108 412 A R H 3> S+ 0 0 93 -12,-0.5 4,-0.8 1,-0.3 13,-0.1 0.838 122.8 61.0 -57.2 -34.2 -3.5 -17.8 18.5 109 413 A N H 34 S+ 0 0 100 1,-0.2 3,-0.3 2,-0.2 -1,-0.3 0.822 102.6 50.1 -65.4 -30.8 -6.5 -20.1 18.6 110 414 A Q H X4 S+ 0 0 67 -3,-1.1 3,-1.7 1,-0.2 -1,-0.2 0.823 101.6 64.3 -72.9 -29.4 -8.4 -17.7 20.8 111 415 A G H >< S+ 0 0 0 -4,-1.3 3,-1.8 1,-0.3 7,-0.3 0.787 87.0 71.2 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0.807 109.2 59.2 -57.8 -30.1 -11.6 -2.4 -6.2 451 531 B K T 3< S- 0 0 139 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.446 96.0-155.6 -77.5 1.0 -12.7 0.8 -7.8 452 532 B N < + 0 0 122 -3,-2.2 2,-1.5 1,-0.1 -1,-0.2 -0.111 58.8 100.5 46.9-153.7 -11.7 -0.5 -11.2 453 533 B V S S+ 0 0 88 -3,-0.1 -1,-0.1 -4,-0.0 -4,-0.1 -0.675 75.1 67.3 80.9 -88.1 -10.9 2.1 -13.8 454 534 B V S S- 0 0 12 -2,-1.5 2,-0.3 -6,-0.2 -2,-0.1 -0.532 84.5-139.8 -67.7 116.8 -7.1 2.0 -13.6 455 535 B P - 0 0 102 0, 0.0 2,-0.3 0, 0.0 -178,-0.1 -0.624 13.6-155.5 -79.2 132.6 -6.0 -1.5 -14.8 456 536 B L - 0 0 22 -2,-0.3 -178,-0.1 -7,-0.1 -182,-0.0 -0.844 23.8-105.7-107.3 147.5 -3.2 -3.1 -12.9 457 537 B S > - 0 0 36 -2,-0.3 4,-2.5 -180,-0.2 5,-0.2 -0.243 30.6-111.4 -63.0 158.9 -0.9 -5.7 -14.4 458 538 B D H > S+ 0 0 117 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.917 120.6 52.0 -56.2 -44.0 -1.4 -9.4 -13.4 459 539 B L H > S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.915 109.3 47.8 -59.1 -46.9 1.9 -9.2 -11.6 460 540 B L H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.923 110.4 52.2 -63.4 -45.1 0.9 -6.1 -9.6 461 541 B L H X S+ 0 0 55 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.890 111.2 48.8 -54.2 -42.4 -2.5 -7.7 -8.7 462 542 B E H X S+ 0 0 64 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.927 111.4 46.6 -68.0 -46.9 -0.6 -10.8 -7.4 463 543 B M H >< S+ 0 0 2 -4,-2.5 3,-0.5 1,-0.2 4,-0.3 0.910 114.5 51.4 -56.9 -42.3 1.9 -8.8 -5.3 464 544 B L H >< S+ 0 0 1 -4,-2.8 3,-1.5 1,-0.2 -2,-0.2 0.897 105.4 53.7 -61.4 -44.7 -1.1 -6.8 -4.1 465 545 B D H >< S+ 0 0 93 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.682 95.9 68.2 -68.8 -19.0 -3.1 -10.0 -3.2 466 546 B A T << S+ 0 0 44 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.643 96.7 55.0 -72.6 -16.2 -0.1 -11.2 -1.0 467 547 B H T < 0 0 24 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.344 360.0 360.0 -97.2 5.3 -0.8 -8.4 1.4 468 548 B R < 0 0 176 -3,-1.1 -2,-0.2 -4,-0.1 -3,-0.1 0.595 360.0 360.0-126.5 360.0 -4.5 -9.4 1.8 469 !* 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 0.0 470 687 C H 0 0 128 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 174.1 -9.8 20.3 21.2 471 688 C K > - 0 0 84 1,-0.1 4,-1.1 -240,-0.0 5,-0.1 -0.289 360.0-124.5 -72.2 156.1 -9.0 16.7 21.4 472 689 C I H > S+ 0 0 58 2,-0.2 4,-2.2 1,-0.2 3,-0.3 0.890 116.0 56.6 -58.8 -39.0 -9.4 14.6 24.5 473 690 C L H > S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.896 101.9 56.3 -60.0 -39.4 -5.8 13.7 24.1 474 691 C H H > S+ 0 0 37 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.848 109.1 45.8 -62.0 -35.5 -4.9 17.4 24.2 475 692 C R H >X S+ 0 0 165 -4,-1.1 4,-2.0 -3,-0.3 3,-1.0 0.903 108.6 54.2 -77.4 -40.6 -6.7 17.8 27.5 476 693 C L H 3< S+ 0 0 47 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.823 100.4 62.4 -60.8 -32.2 -5.1 14.7 29.1 477 694 C L H 3< S+ 0 0 6 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.790 109.4 41.3 -66.2 -24.4 -1.7 16.0 28.3 478 695 C Q H << 0 0 112 -3,-1.0 -2,-0.2 -4,-0.5 -1,-0.2 0.893 360.0 360.0 -87.8 -44.3 -2.3 19.1 30.5 479 696 C D < 0 0 117 -4,-2.0 -4,-0.0 0, 0.0 0, 0.0 -0.196 360.0 360.0 -64.5 360.0 -4.0 17.5 33.5 480 !* 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 0.0 481 688 D K > 0 0 127 0, 0.0 4,-1.5 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 146.6 2.4 -17.2 -9.5 482 689 D I H > + 0 0 27 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.833 360.0 59.5 -56.2 -36.5 4.1 -14.8 -11.9 483 690 D L H > S+ 0 0 3 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 101.2 56.0 -62.5 -40.9 6.7 -13.9 -9.2 484 691 D H H > S+ 0 0 57 -3,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.957 108.8 45.5 -49.8 -56.7 7.7 -17.6 -9.1 485 692 D R H X S+ 0 0 131 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.896 111.0 52.5 -59.9 -42.6 8.5 -17.7 -12.8 486 693 D L H < S+ 0 0 36 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.874 107.4 52.6 -62.7 -37.9 10.4 -14.4 -12.8 487 694 D L H < S+ 0 0 1 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.914 113.0 43.3 -64.9 -42.4 12.7 -15.6 -10.0 488 695 D Q H < 0 0 136 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.874 360.0 360.0 -69.9 -37.3 13.6 -18.8 -11.9 489 696 D D < 0 0 136 -4,-2.5 -3,-0.0 -5,-0.2 0, 0.0 -0.155 360.0 360.0 -92.3 360.0 14.0 -16.9 -15.2