==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 11-APR-12 4ELT . COMPND 2 MOLECULE: DNA POLYMERASE I, THERMOSTABLE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR A.MARX,K.DIEDERICHS,S.OBEID . 539 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24551.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 386 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 24 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 234 43.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.8 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 2 0 1 1 4 2 3 0 0 1 2 1 1 0 2 0 0 0 0 0 0 0 1 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 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 0 PARALLEL BRIDGES PER LADDER . 2 2 3 1 0 2 1 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 3 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 1 294 A L 0 0 123 0, 0.0 2,-0.5 0, 0.0 37,-0.2 0.000 360.0 360.0 360.0 161.5 47.1 -58.6 -16.9 2 295 A E E -a 38 0A 118 35,-1.7 37,-2.1 38,-0.0 2,-0.1 -0.872 360.0-121.6-104.8 123.2 49.6 -59.4 -19.7 3 296 A E E +a 39 0A 119 -2,-0.5 37,-0.2 35,-0.2 -1,-0.0 -0.367 35.8 176.5 -59.6 131.5 52.2 -56.7 -20.7 4 297 A A E -a 40 0A 12 35,-2.2 37,-0.7 -2,-0.1 2,-0.1 -0.960 32.8 -96.4-134.8 154.3 52.0 -55.8 -24.4 5 298 A P - 0 0 109 0, 0.0 37,-0.1 0, 0.0 35,-0.0 -0.378 55.8 -71.3 -71.3 147.8 53.9 -53.2 -26.3 6 299 A W S S+ 0 0 40 35,-0.5 35,-0.1 -2,-0.1 36,-0.0 -0.469 99.5 60.0 -66.4 146.0 52.6 -49.6 -27.0 7 300 A P S S- 0 0 79 0, 0.0 34,-0.1 0, 0.0 45,-0.0 0.552 74.2-144.7 -90.5 155.0 50.4 -48.6 -28.8 8 301 A P - 0 0 19 0, 0.0 3,-0.1 0, 0.0 26,-0.0 -0.130 28.0 -92.5 -68.7 170.0 47.2 -50.3 -27.7 9 302 A P > - 0 0 68 0, 0.0 3,-1.0 0, 0.0 2,-0.2 -0.159 56.8 -72.2 -72.9 178.4 44.4 -51.4 -30.1 10 303 A E T 3 S+ 0 0 132 1,-0.2 42,-0.0 42,-0.1 0, 0.0 -0.487 118.0 25.4 -71.5 140.7 41.5 -49.2 -30.9 11 304 A G T 3 S+ 0 0 27 1,-0.2 -1,-0.2 -2,-0.2 2,-0.0 0.590 85.7 150.4 83.8 11.1 38.9 -48.7 -28.2 12 305 A A < - 0 0 11 -3,-1.0 2,-0.5 23,-0.1 44,-0.2 -0.295 48.1-112.6 -71.8 162.0 41.3 -49.4 -25.3 13 306 A F E -B 34 0A 10 21,-2.6 21,-1.7 42,-0.1 44,-0.2 -0.841 30.2-137.5 -99.7 129.4 40.8 -47.8 -21.9 14 307 A V E -B 33 0A 2 42,-2.9 44,-0.4 -2,-0.5 2,-0.3 -0.551 18.3-175.4 -89.3 149.8 43.4 -45.2 -20.8 15 308 A G E +B 32 0A 2 17,-2.6 17,-3.1 -2,-0.2 2,-0.3 -0.983 14.1 172.5-133.3 140.1 45.0 -44.7 -17.4 16 309 A F E -B 31 0A 7 -2,-0.3 2,-0.5 15,-0.2 15,-0.2 -0.986 23.9-141.8-147.6 152.1 47.4 -41.8 -16.7 17 310 A V E -B 30 0A 13 13,-2.2 12,-1.8 -2,-0.3 13,-1.3 -0.978 16.8-161.0-120.7 127.3 49.2 -40.2 -13.8 18 311 A L E -B 28 0A 26 -2,-0.5 10,-0.2 10,-0.2 3,-0.1 -0.766 25.8-131.3-105.2 151.4 49.5 -36.4 -13.4 19 312 A S S S+ 0 0 64 8,-2.0 2,-0.3 -2,-0.3 -1,-0.1 0.746 97.0 8.5 -69.6 -24.0 52.0 -34.5 -11.3 20 313 A R S S- 0 0 113 7,-0.3 -1,-0.2 2,-0.1 6,-0.1 -0.975 81.4-108.5-152.1 160.6 49.1 -32.5 -10.0 21 314 A K S S+ 0 0 126 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.778 93.3 87.3 -64.9 -29.5 45.3 -32.6 -10.2 22 315 A E >> - 0 0 29 1,-0.2 3,-1.8 2,-0.1 4,-1.3 -0.632 64.8-157.2 -81.3 112.6 44.9 -29.6 -12.5 23 316 A P T 34 S+ 0 0 1 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.824 91.2 56.5 -57.7 -37.7 45.3 -30.8 -16.2 24 317 A M T 34 S+ 0 0 8 1,-0.2 -2,-0.1 244,-0.1 245,-0.0 0.682 119.1 33.1 -67.7 -15.4 46.3 -27.3 -17.5 25 318 A W T <4 S+ 0 0 75 -3,-1.8 -1,-0.2 -5,-0.1 -4,-0.1 0.526 98.2 106.3-114.0 -10.1 49.2 -27.3 -15.0 26 319 A A < - 0 0 3 -4,-1.3 2,-0.4 -3,-0.2 -5,-0.1 -0.306 62.0-133.0 -81.4 154.7 50.2 -30.9 -14.7 27 320 A D - 0 0 75 -2,-0.1 -8,-2.0 0, 0.0 2,-1.2 -0.856 29.6-123.2 -92.3 135.8 53.2 -32.9 -16.0 28 321 A L E +B 18 0A 3 -2,-0.4 18,-0.3 -10,-0.2 -10,-0.2 -0.727 36.4 176.8 -82.2 96.2 52.0 -36.1 -17.7 29 322 A L E - 0 0 94 -12,-1.8 2,-0.3 -2,-1.2 -1,-0.2 0.940 59.5 -2.6 -72.2 -49.5 54.0 -38.6 -15.6 30 323 A A E -B 17 0A 32 -13,-1.3 -13,-2.2 14,-0.1 2,-0.3 -0.978 56.0-165.5-144.0 158.5 52.8 -41.9 -17.0 31 324 A L E +B 16 0A 2 11,-0.4 11,-2.4 -2,-0.3 2,-0.3 -0.996 15.6 163.4-145.1 135.6 50.3 -43.1 -19.6 32 325 A A E -BC 15 41A 1 -17,-3.1 -17,-2.6 -2,-0.3 2,-0.3 -0.954 17.0-152.9-147.7 164.8 48.9 -46.6 -20.1 33 326 A A E -BC 14 40A 0 7,-2.7 7,-3.6 -2,-0.3 2,-0.4 -0.977 5.1-158.9-144.2 158.3 46.1 -48.5 -21.9 34 327 A A E +BC 13 39A 0 -21,-1.7 -21,-2.6 -2,-0.3 2,-0.3 -0.998 21.3 141.9-144.4 133.7 44.1 -51.7 -21.4 35 328 A R + 0 0 105 3,-1.7 3,-0.4 -2,-0.4 -23,-0.1 -0.855 65.4 10.6-168.6 136.3 42.0 -54.0 -23.5 36 329 A G S S- 0 0 62 -2,-0.3 3,-0.1 1,-0.2 -24,-0.0 0.930 128.5 -51.4 64.5 50.6 41.5 -57.7 -23.9 37 330 A G S S+ 0 0 41 1,-0.2 -35,-1.7 77,-0.1 2,-0.4 0.739 117.2 113.0 58.1 23.6 43.3 -58.9 -20.8 38 331 A R E -a 2 0A 104 -3,-0.4 -3,-1.7 -37,-0.2 2,-0.4 -0.943 51.6-159.2-123.7 148.2 46.3 -56.8 -21.9 39 332 A V E -aC 3 34A 4 -37,-2.1 -35,-2.2 -2,-0.4 2,-0.6 -0.997 6.5-164.0-125.1 126.8 48.0 -53.7 -20.5 40 333 A H E -aC 4 33A 10 -7,-3.6 -7,-2.7 -2,-0.4 2,-0.4 -0.949 5.9-162.6-111.2 117.6 50.1 -51.5 -22.7 41 334 A R E - C 0 32A 89 -37,-0.7 -35,-0.5 -2,-0.6 -9,-0.2 -0.817 17.3-127.0-100.8 141.8 52.4 -49.1 -21.0 42 335 A A - 0 0 16 -11,-2.4 -11,-0.4 -2,-0.4 4,-0.1 -0.760 6.8-155.4 -95.5 127.1 53.9 -46.1 -22.8 43 336 A P S S+ 0 0 122 0, 0.0 -1,-0.2 0, 0.0 -12,-0.0 0.942 94.8 26.3 -59.6 -52.2 57.6 -45.5 -22.8 44 337 A E S > S- 0 0 72 1,-0.2 4,-2.8 -14,-0.0 5,-0.2 -0.894 74.7-163.8-119.6 99.5 57.2 -41.8 -23.5 45 338 A P H > S+ 0 0 14 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.865 86.0 49.1 -48.5 -53.6 53.8 -40.5 -22.3 46 339 A Y H >4 S+ 0 0 48 -18,-0.3 3,-0.7 1,-0.2 4,-0.4 0.921 115.7 41.9 -58.6 -49.0 53.7 -37.2 -24.2 47 340 A K H >4 S+ 0 0 126 1,-0.2 3,-1.5 2,-0.2 4,-0.3 0.889 108.5 62.2 -66.0 -36.7 54.6 -38.8 -27.6 48 341 A A H >< S+ 0 0 3 -4,-2.8 3,-1.6 1,-0.3 -1,-0.2 0.772 88.9 71.0 -59.3 -26.5 52.3 -41.7 -26.8 49 342 A L G X< S+ 0 0 3 -4,-1.2 3,-1.3 -3,-0.7 -1,-0.3 0.802 87.1 63.9 -60.4 -30.6 49.4 -39.2 -26.7 50 343 A R G < S+ 0 0 127 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.676 94.7 63.9 -67.0 -15.8 49.6 -38.8 -30.5 51 344 A D G < S+ 0 0 89 -3,-1.6 2,-0.3 -4,-0.3 -1,-0.2 0.546 85.1 89.9 -86.7 -8.5 48.7 -42.5 -30.8 52 345 A L < - 0 0 30 -3,-1.3 3,-0.1 -4,-0.2 -42,-0.1 -0.671 54.1-162.6 -96.7 146.7 45.2 -42.2 -29.3 53 346 A K S S- 0 0 146 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.714 80.4 -6.8 -92.1 -26.7 41.9 -41.5 -31.2 54 347 A E S S- 0 0 76 20,-0.2 2,-0.8 2,-0.1 -1,-0.4 -0.974 71.5-105.5-163.9 153.7 40.1 -40.6 -28.0 55 348 A A B +d 76 0B 0 20,-2.9 22,-4.0 -2,-0.3 2,-0.5 -0.817 42.8 177.3 -88.6 110.1 40.5 -40.5 -24.3 56 349 A R + 0 0 36 -2,-0.8 -42,-2.9 -44,-0.2 2,-0.3 -0.940 36.8 42.5-121.7 109.9 38.4 -43.3 -22.9 57 350 A G S > S- 0 0 0 21,-2.2 3,-1.5 -2,-0.5 24,-0.1 -0.942 91.9 -8.7 151.4-175.4 38.4 -44.0 -19.2 58 351 A L T 3 S+ 0 0 3 -44,-0.4 58,-0.1 54,-0.3 21,-0.0 -0.308 130.0 1.3 -54.3 129.0 38.3 -42.6 -15.6 59 352 A L T >> S+ 0 0 49 1,-0.1 4,-1.1 3,-0.1 3,-0.8 0.848 80.4 166.1 59.4 38.2 38.6 -38.8 -15.7 60 353 A A H <> + 0 0 1 -3,-1.5 4,-2.0 1,-0.2 3,-0.4 0.865 67.2 60.9 -51.5 -42.5 38.8 -38.8 -19.5 61 354 A K H 3> S+ 0 0 15 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.860 98.4 56.7 -55.3 -42.8 38.2 -35.0 -19.7 62 355 A D H <> S+ 0 0 8 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.894 109.1 44.2 -58.0 -44.9 41.3 -34.2 -17.7 63 356 A L H X S+ 0 0 0 -4,-1.1 4,-2.7 -3,-0.4 -1,-0.2 0.875 113.0 52.9 -69.6 -35.9 43.6 -36.0 -20.2 64 357 A S H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 10,-0.3 0.909 107.9 51.2 -62.3 -42.5 41.7 -34.5 -23.1 65 358 A V H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.936 111.6 47.1 -59.9 -46.6 42.3 -31.0 -21.5 66 359 A L H X S+ 0 0 0 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.900 111.9 50.3 -62.5 -41.8 46.0 -31.8 -21.2 67 360 A A H <>S+ 0 0 0 -4,-2.7 5,-2.8 1,-0.2 3,-0.4 0.909 108.9 51.7 -62.0 -43.8 46.1 -33.1 -24.8 68 361 A L H ><5S+ 0 0 32 -4,-2.8 3,-1.7 1,-0.2 -2,-0.2 0.888 104.7 57.7 -58.7 -40.0 44.4 -29.9 -26.0 69 362 A R H 3<5S+ 0 0 35 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.858 106.2 49.2 -57.8 -35.4 47.0 -27.9 -24.1 70 363 A E T 3<5S- 0 0 50 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.305 126.4-100.4 -91.3 10.4 49.7 -29.6 -26.2 71 364 A G T < 5S+ 0 0 68 -3,-1.7 2,-0.5 1,-0.2 -3,-0.2 0.713 80.5 133.0 80.8 23.0 47.9 -28.9 -29.4 72 365 A L < - 0 0 31 -5,-2.8 2,-2.1 -6,-0.1 -1,-0.2 -0.927 55.0-140.6-110.0 125.5 46.4 -32.3 -29.8 73 366 A G + 0 0 72 -2,-0.5 -5,-0.1 -3,-0.1 -9,-0.1 -0.397 42.4 155.7 -80.6 63.7 42.7 -32.7 -30.7 74 367 A L - 0 0 7 -2,-2.1 -6,-0.2 -10,-0.3 -20,-0.2 -0.816 27.2-157.4 -95.4 105.1 42.1 -35.7 -28.4 75 368 A P - 0 0 52 0, 0.0 -20,-2.9 0, 0.0 2,-0.2 -0.510 18.2-114.4 -80.2 149.0 38.4 -35.8 -27.5 76 369 A P B +d 55 0B 11 0, 0.0 -20,-0.2 0, 0.0 70,-0.1 -0.615 36.8 177.8 -81.3 144.9 37.1 -37.6 -24.3 77 370 A G - 0 0 5 -22,-4.0 -20,-0.1 1,-0.4 -17,-0.1 -0.026 48.7 -0.8-116.4-138.8 34.9 -40.7 -24.7 78 371 A D - 0 0 18 -2,-0.1 -21,-2.2 -22,-0.1 -1,-0.4 -0.225 60.0-175.2 -55.3 141.1 33.4 -43.1 -22.3 79 372 A D >> - 0 0 14 -23,-0.2 4,-1.2 -3,-0.1 3,-1.1 -0.948 24.2-150.1-142.7 117.5 34.1 -42.4 -18.6 80 373 A P H 3> S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.807 97.3 67.0 -56.6 -30.6 33.0 -44.7 -15.8 81 374 A M H 3> S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.897 100.0 50.4 -56.0 -39.9 32.8 -41.7 -13.5 82 375 A L H <> S+ 0 0 2 -3,-1.1 4,-1.7 1,-0.2 -1,-0.2 0.891 109.6 49.7 -66.0 -42.9 29.9 -40.4 -15.6 83 376 A L H X S+ 0 0 0 -4,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.913 113.0 46.5 -59.1 -45.9 28.1 -43.7 -15.4 84 377 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 7,-0.3 0.914 110.0 53.1 -67.3 -39.8 28.4 -43.9 -11.6 85 378 A Y H < S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.844 109.4 48.9 -65.4 -36.3 27.3 -40.3 -11.1 86 379 A L H < S+ 0 0 1 -4,-1.7 348,-0.6 1,-0.2 -1,-0.2 0.870 111.5 49.4 -70.2 -39.1 24.2 -40.9 -13.1 87 380 A L H < S- 0 0 21 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.882 140.3 -7.9 -63.7 -37.9 23.4 -44.1 -11.1 88 381 A D >< - 0 0 21 -4,-2.4 3,-3.3 -5,-0.1 -1,-0.3 -0.736 61.4-148.8-166.7 104.8 23.9 -42.1 -7.8 89 382 A P T 3 S+ 0 0 6 0, 0.0 -4,-0.1 0, 0.0 190,-0.1 0.477 94.3 77.2 -69.3 -0.2 25.3 -38.6 -7.8 90 383 A S T 3 S+ 0 0 80 -6,-0.2 2,-1.3 187,-0.1 3,-0.2 0.582 72.8 93.7 -74.6 -11.4 26.9 -39.3 -4.4 91 384 A N < + 0 0 8 -3,-3.3 -3,-0.1 -7,-0.3 -1,-0.1 -0.690 47.9 135.7 -75.6 93.7 29.5 -41.1 -6.7 92 385 A T + 0 0 58 -2,-1.3 182,-0.2 1,-0.1 -1,-0.2 0.601 48.7 54.9-120.7 -20.9 31.9 -38.1 -7.0 93 386 A T > - 0 0 56 -3,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.920 69.8-131.9-121.7 147.7 35.4 -39.4 -6.6 94 387 A P H > S+ 0 0 16 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.859 111.1 57.4 -63.8 -32.7 37.4 -42.2 -8.5 95 388 A E H > S+ 0 0 105 2,-0.2 4,-2.2 1,-0.2 10,-0.2 0.948 111.5 40.5 -57.9 -50.7 38.4 -43.5 -5.0 96 389 A G H > S+ 0 0 34 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.918 115.5 49.9 -64.5 -45.5 34.8 -43.9 -4.0 97 390 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.898 111.4 49.7 -63.0 -40.6 33.6 -45.3 -7.3 98 391 A A H X>S+ 0 0 0 -4,-2.4 5,-2.4 -5,-0.2 4,-1.9 0.945 111.5 47.7 -61.8 -50.4 36.4 -47.8 -7.4 99 392 A R H <5S+ 0 0 164 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.872 118.4 42.7 -60.5 -36.1 35.7 -49.0 -3.8 100 393 A R H <5S+ 0 0 131 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.872 122.8 33.4 -80.6 -35.7 32.1 -49.3 -4.6 101 394 A Y H <5S- 0 0 17 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.327 125.5 -59.9-116.4 7.8 32.2 -50.9 -8.1 102 395 A G T <5S+ 0 0 46 -4,-1.9 2,-0.3 1,-0.3 -3,-0.2 0.753 93.5 26.5 130.7 30.5 35.2 -53.2 -8.2 103 396 A G < - 0 0 20 -5,-2.4 2,-0.4 -6,-0.1 -1,-0.3 -0.915 69.5 -84.0-172.2-151.9 38.8 -52.1 -7.7 104 397 A E - 0 0 117 -2,-0.3 2,-0.8 7,-0.1 11,-0.1 -0.998 28.1-126.9-141.3 129.6 41.2 -49.6 -6.0 105 398 A W + 0 0 36 -2,-0.4 2,-0.1 -10,-0.2 -10,-0.0 -0.697 44.0 171.4 -77.0 110.0 42.3 -46.2 -7.2 106 399 A T - 0 0 28 -2,-0.8 -1,-0.0 2,-0.2 -11,-0.0 -0.233 44.6-107.0-105.8-164.7 46.1 -46.4 -7.1 107 400 A E S S+ 0 0 134 -2,-0.1 2,-0.4 -90,-0.1 -2,-0.1 0.077 85.4 96.3-113.5 22.3 48.9 -44.2 -8.3 108 401 A E > - 0 0 62 1,-0.1 4,-2.2 -92,-0.1 -2,-0.2 -0.953 66.6-141.9-123.2 132.5 50.0 -46.3 -11.3 109 402 A A H > S+ 0 0 2 -2,-0.4 4,-2.0 1,-0.2 -77,-0.2 0.869 99.2 50.6 -62.9 -43.4 48.9 -45.7 -14.9 110 403 A G H > S+ 0 0 3 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.910 111.8 46.7 -62.1 -44.9 48.6 -49.4 -15.9 111 404 A E H > S+ 0 0 99 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.900 111.5 52.9 -63.8 -39.8 46.5 -50.3 -12.9 112 405 A R H X S+ 0 0 21 -4,-2.2 4,-2.3 2,-0.2 -54,-0.3 0.844 109.1 50.0 -61.7 -36.1 44.3 -47.2 -13.6 113 406 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -79,-0.2 0.948 113.1 44.5 -67.8 -49.0 43.9 -48.4 -17.2 114 407 A A H X S+ 0 0 9 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.874 113.2 53.0 -59.4 -40.3 42.8 -51.9 -16.0 115 408 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.910 105.4 53.8 -62.3 -46.9 40.6 -50.3 -13.4 116 409 A S H X S+ 0 0 1 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.910 111.2 45.7 -53.4 -46.3 38.9 -48.1 -16.0 117 410 A E H X S+ 0 0 52 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.936 114.5 46.5 -65.9 -48.6 38.0 -51.2 -18.1 118 411 A R H X S+ 0 0 121 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.945 115.2 46.7 -55.5 -52.1 36.7 -53.3 -15.2 119 412 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.863 109.8 53.1 -63.3 -37.3 34.7 -50.4 -13.8 120 413 A F H X S+ 0 0 23 -4,-2.1 4,-2.8 -5,-0.3 5,-0.3 0.944 108.8 49.8 -65.7 -45.3 33.2 -49.5 -17.2 121 414 A A H X S+ 0 0 65 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.965 115.7 42.3 -51.6 -57.3 32.0 -53.1 -17.8 122 415 A N H X S+ 0 0 64 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.923 117.3 45.1 -59.3 -49.7 30.4 -53.3 -14.3 123 416 A L H X S+ 0 0 0 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.897 110.3 54.5 -65.8 -39.9 28.8 -49.9 -14.4 124 417 A W H < S+ 0 0 66 -4,-2.8 4,-0.3 -5,-0.3 -1,-0.2 0.879 106.8 52.4 -60.3 -37.7 27.5 -50.3 -18.0 125 418 A G H >< S+ 0 0 37 -4,-1.8 3,-1.0 -5,-0.3 -1,-0.2 0.862 106.9 52.2 -66.5 -34.5 25.8 -53.5 -17.0 126 419 A R H 3< S+ 0 0 136 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.741 103.9 58.5 -74.1 -21.4 24.1 -51.6 -14.1 127 420 A L T >< S+ 0 0 0 -4,-1.3 3,-1.1 -3,-0.2 2,-0.4 0.487 79.6 112.6 -83.9 -4.2 22.9 -49.0 -16.6 128 421 A E T < S+ 0 0 133 -3,-1.0 -3,-0.0 -4,-0.3 3,-0.0 -0.577 82.6 19.5 -74.9 125.9 21.0 -51.7 -18.6 129 422 A G T 3 S+ 0 0 71 -2,-0.4 2,-1.7 1,-0.0 -1,-0.2 -0.004 96.4 105.6 103.3 -25.4 17.3 -51.2 -18.4 130 423 A E <> + 0 0 56 -3,-1.1 4,-2.8 1,-0.2 3,-0.4 -0.451 40.9 165.9 -88.3 64.3 17.8 -47.6 -17.3 131 424 A E H > S+ 0 0 158 -2,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.801 72.9 49.9 -50.8 -38.8 16.7 -46.1 -20.6 132 425 A R H > S+ 0 0 122 2,-0.2 4,-1.5 -3,-0.2 -1,-0.2 0.896 112.7 45.2 -73.6 -39.7 16.3 -42.6 -19.2 133 426 A L H > S+ 0 0 1 -3,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.841 112.7 54.1 -67.9 -33.3 19.7 -42.6 -17.5 134 427 A L H X S+ 0 0 21 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.911 105.4 52.3 -64.4 -43.3 21.1 -44.0 -20.7 135 428 A W H X S+ 0 0 100 -4,-2.2 4,-2.2 1,-0.2 5,-0.4 0.874 109.7 49.8 -59.7 -38.3 19.6 -41.1 -22.7 136 429 A L H X>S+ 0 0 0 -4,-1.5 5,-2.9 3,-0.2 4,-1.2 0.858 111.2 48.9 -70.5 -36.5 21.3 -38.6 -20.3 137 430 A Y H <>S+ 0 0 0 -4,-1.8 5,-3.1 3,-0.2 -2,-0.2 0.970 120.7 33.2 -65.8 -52.5 24.7 -40.3 -20.6 138 431 A R H <5S+ 0 0 112 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.831 128.7 33.9 -76.2 -35.5 24.8 -40.5 -24.4 139 432 A E H <5S+ 0 0 98 -4,-2.2 -3,-0.2 -5,-0.3 -1,-0.2 0.643 134.9 12.1-100.6 -16.9 22.9 -37.3 -25.3 140 433 A V T X5S+ 0 0 1 -4,-1.2 4,-2.1 -5,-0.4 -3,-0.2 0.681 123.7 36.2-120.6 -70.6 24.0 -35.0 -22.5 141 434 A E H >> S+ 0 0 44 0, 0.0 4,-1.6 0, 0.0 3,-0.7 0.863 111.2 62.2 -64.3 -31.2 29.3 -35.2 -25.3 144 437 A L H 3X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.908 95.5 59.8 -58.7 -40.9 29.2 -32.4 -22.6 145 438 A S H 3X S+ 0 0 5 -4,-2.0 4,-1.9 -3,-0.2 -1,-0.2 0.819 102.4 53.2 -58.8 -31.2 32.5 -33.6 -21.4 146 439 A A H + 0 0 63 145,-3.0 4,-1.9 -2,-0.4 3,-0.1 -0.600 35.0 176.8 -80.9 85.9 43.3 -7.7 -16.9 160 453 A V H > S+ 0 0 46 -2,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.862 72.4 50.9 -60.9 -45.4 46.3 -8.4 -14.6 161 454 A A H > S+ 0 0 74 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.859 108.5 54.6 -67.0 -34.1 47.7 -4.9 -14.4 162 455 A Y H > S+ 0 0 67 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.951 108.3 48.1 -61.2 -49.9 44.3 -3.6 -13.5 163 456 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.866 109.0 53.5 -60.5 -39.9 43.9 -6.1 -10.6 164 457 A R H X S+ 0 0 120 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.906 110.4 46.7 -60.1 -43.5 47.4 -5.2 -9.2 165 458 A A H X S+ 0 0 62 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.893 110.9 52.8 -67.8 -37.1 46.5 -1.5 -9.1 166 459 A L H X S+ 0 0 4 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.872 102.8 59.7 -65.3 -37.9 43.2 -2.3 -7.5 167 460 A S H X S+ 0 0 18 -4,-2.1 4,-3.1 1,-0.2 -1,-0.2 0.939 103.4 49.4 -53.3 -51.7 45.1 -4.3 -4.8 168 461 A L H X S+ 0 0 124 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.880 112.3 48.7 -61.1 -39.7 47.1 -1.3 -3.6 169 462 A E H X S+ 0 0 89 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.918 113.7 45.3 -64.4 -47.1 44.0 0.8 -3.4 170 463 A V H X S+ 0 0 6 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.870 106.7 60.2 -69.6 -33.9 42.1 -1.8 -1.4 171 464 A A H X S+ 0 0 42 -4,-3.1 4,-1.8 -5,-0.2 -1,-0.2 0.922 105.7 48.4 -55.6 -44.4 45.1 -2.4 0.9 172 465 A E H X S+ 0 0 118 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.867 110.9 49.2 -66.7 -39.3 45.0 1.3 2.0 173 466 A E H X S+ 0 0 72 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.869 108.8 53.8 -65.0 -38.4 41.2 1.2 2.7 174 467 A I H X S+ 0 0 18 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.909 106.4 52.5 -63.4 -39.3 41.6 -2.0 4.7 175 468 A A H X S+ 0 0 44 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.902 107.7 51.1 -63.7 -44.1 44.3 -0.3 6.8 176 469 A R H X S+ 0 0 135 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.901 112.8 47.0 -55.7 -44.5 41.9 2.7 7.5 177 470 A L H X S+ 0 0 7 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.945 112.9 45.5 -69.2 -47.8 39.2 0.2 8.6 178 471 A E H X S+ 0 0 64 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.916 112.7 52.5 -63.1 -39.5 41.3 -1.9 10.9 179 472 A A H X S+ 0 0 57 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.895 111.9 45.2 -62.0 -43.6 42.9 1.1 12.5 180 473 A E H X S+ 0 0 63 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.908 112.0 53.2 -66.0 -41.3 39.5 2.6 13.2 181 474 A V H X S+ 0 0 0 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.919 110.4 46.4 -60.5 -44.2 38.3 -0.8 14.5 182 475 A F H X>S+ 0 0 42 -4,-2.8 4,-2.0 2,-0.2 5,-1.1 0.898 110.5 53.6 -64.3 -41.8 41.2 -1.1 16.9 183 476 A R H <5S+ 0 0 150 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.925 110.2 46.7 -57.1 -46.1 40.7 2.5 18.1 184 477 A L H <5S+ 0 0 36 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.788 115.1 46.6 -70.8 -27.1 37.1 1.8 18.9 185 478 A A H <5S- 0 0 13 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.733 109.2-126.5 -82.1 -24.9 38.1 -1.5 20.7 186 479 A G T <5S+ 0 0 64 -4,-2.0 -3,-0.2 -5,-0.2 -4,-0.1 0.391 81.8 42.0 92.1 -0.9 40.8 0.3 22.6 187 480 A H S - 0 0 76 -2,-0.3 3,-1.2 1,-0.2 7,-0.3 -0.685 42.9-171.2 -77.8 105.5 43.8 -10.1 14.9 191 484 A L T 3 S+ 0 0 4 -2,-1.1 -1,-0.2 1,-0.2 6,-0.1 0.715 82.7 64.1 -69.4 -20.2 40.6 -8.8 13.2 192 485 A N T 3 S+ 0 0 111 -3,-0.1 2,-0.8 1,-0.1 -1,-0.2 0.662 86.7 86.4 -73.5 -15.6 40.8 -11.8 10.8 193 486 A S <> - 0 0 30 -3,-1.2 4,-2.4 1,-0.2 3,-0.3 -0.779 61.5-164.5 -94.3 110.0 40.3 -14.1 13.8 194 487 A R H > S+ 0 0 66 -2,-0.8 4,-1.6 1,-0.2 -1,-0.2 0.745 89.8 58.2 -65.5 -21.7 36.6 -14.6 14.6 195 488 A D H > S+ 0 0 53 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.904 109.4 43.5 -72.3 -41.9 37.6 -16.1 18.0 196 489 A Q H > S+ 0 0 61 -3,-0.3 4,-2.1 -6,-0.2 -2,-0.2 0.913 113.6 51.3 -67.3 -43.3 39.4 -12.9 19.0 197 490 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 -7,-0.3 5,-0.2 0.848 105.5 55.9 -61.6 -36.8 36.6 -10.7 17.6 198 491 A E H X>S+ 0 0 17 -4,-1.6 4,-2.9 2,-0.2 5,-0.6 0.932 108.0 48.4 -62.2 -45.2 33.9 -12.6 19.5 199 492 A R H X>S+ 0 0 124 -4,-1.5 5,-2.2 2,-0.2 4,-1.7 0.922 113.3 47.6 -61.8 -44.6 35.8 -11.9 22.8 200 493 A V H <>S+ 0 0 2 -4,-2.1 5,-2.8 3,-0.2 6,-0.3 0.959 118.4 39.6 -59.6 -52.1 36.1 -8.2 21.9 201 494 A L H <5S+ 0 0 0 -4,-3.0 6,-2.4 3,-0.2 -2,-0.2 0.932 129.9 23.9 -65.2 -50.4 32.4 -7.8 20.9 202 495 A F H <5S+ 0 0 15 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.740 132.5 32.2 -98.0 -25.2 30.7 -9.8 23.5 203 496 A D T < - 0 0 41 5,-2.9 4,-0.8 -2,-0.3 7,-0.0 -0.399 30.8-120.0 -78.1 159.6 27.8 -21.4 15.7 214 507 A E T 4 S+ 0 0 168 2,-0.2 -1,-0.1 1,-0.1 -2,-0.0 0.936 96.0 26.1 -71.1 -55.8 26.9 -24.9 14.6 215 508 A K T 4 S+ 0 0 195 1,-0.1 -1,-0.1 2,-0.0 -2,-0.0 0.858 133.8 25.5 -84.2 -37.7 29.7 -27.3 15.6 216 509 A T T 4 S- 0 0 99 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.480 92.8-128.2-111.9 -4.4 31.4 -25.6 18.6 217 510 A G < + 0 0 38 -4,-0.8 2,-0.1 1,-0.2 -3,-0.1 0.800 50.6 155.2 65.0 30.8 28.6 -23.4 20.0 218 511 A K - 0 0 71 1,-0.1 -5,-2.9 -6,-0.0 2,-0.5 -0.465 58.0 -87.7 -82.7 162.6 30.5 -20.2 20.0 219 512 A R B -H 212 0D 60 -7,-0.2 -7,-0.3 -2,-0.1 -1,-0.1 -0.613 54.2-120.4 -70.0 119.2 28.8 -16.8 19.9 220 513 A S - 0 0 17 -9,-2.6 -10,-0.4 -2,-0.5 -9,-0.3 -0.341 28.3-174.0 -65.9 139.6 28.5 -16.1 16.1 221 514 A T + 0 0 6 -12,-0.1 -1,-0.1 -11,-0.1 5,-0.1 -0.025 37.1 144.5-114.0 28.4 30.1 -13.1 14.5 222 515 A S > - 0 0 49 1,-0.1 4,-2.7 3,-0.1 5,-0.2 -0.118 66.9-102.4 -65.4 164.2 28.5 -13.6 11.1 223 516 A A H > S+ 0 0 59 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.881 122.8 53.6 -51.2 -43.8 27.4 -10.8 8.8 224 517 A A H > S+ 0 0 73 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.901 110.2 46.4 -64.0 -40.7 23.8 -11.5 9.7 225 518 A V H > S+ 0 0 9 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.949 113.8 48.4 -63.3 -48.4 24.6 -11.1 13.4 226 519 A L H >< S+ 0 0 0 -4,-2.7 3,-0.6 1,-0.2 -2,-0.2 0.878 107.4 56.1 -58.6 -40.1 26.6 -8.0 12.8 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0.605 64.1 157.5 94.7 14.2 15.1 -38.8 -14.9 433 726 A R - 0 0 6 26,-0.1 -4,-1.7 -155,-0.1 2,-0.3 -0.594 33.4-144.1 -67.9 132.1 18.3 -37.7 -13.2 434 727 A R E -M 428 0G 31 -348,-0.6 2,-0.4 -2,-0.3 -6,-0.2 -0.758 24.9-174.8-105.0 149.3 18.1 -39.3 -9.7 435 728 A R E -M 427 0G 46 -8,-2.2 -8,-2.3 -2,-0.3 2,-0.4 -0.975 22.3-138.1-135.0 125.2 19.1 -38.2 -6.2 436 729 A Y E +M 426 0G 96 -2,-0.4 -10,-0.3 -10,-0.2 3,-0.1 -0.642 21.0 178.6 -80.2 130.9 18.8 -40.7 -3.3 437 730 A V > + 0 0 9 -12,-2.1 3,-1.4 -2,-0.4 -12,-0.1 -0.645 10.0 166.3-132.6 79.9 17.4 -39.2 -0.1 438 731 A P G > + 0 0 97 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.817 68.9 75.6 -62.4 -29.5 17.1 -41.9 2.6 439 732 A D G > + 0 0 84 1,-0.3 3,-0.9 2,-0.2 12,-0.3 0.420 69.2 87.3 -70.7 4.1 16.7 -39.3 5.4 440 733 A L G < S+ 0 0 2 -3,-1.4 -1,-0.3 1,-0.2 -18,-0.1 0.674 93.5 46.1 -64.9 -20.4 13.1 -38.8 4.2 441 734 A E G < S+ 0 0 114 -3,-2.0 -1,-0.2 -4,-0.1 -2,-0.2 0.290 84.4 133.9-104.2 5.5 12.3 -41.7 6.5 442 735 A A < - 0 0 19 -3,-0.9 6,-0.1 1,-0.1 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