==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 12-JUL-11 3SV3 . COMPND 2 MOLECULE: DNA POLYMERASE I, THERMOSTABLE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR K.BETZ,K.DIEDERICHS,A.MARX . 540 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24420.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 384 71.1 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 . 50 9.3 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 . 20 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 235 43.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 3.0 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 0 1 1 1 4 2 3 1 0 1 1 1 0 1 1 0 1 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 . 3 1 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 1 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 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 1 293 A A 0 0 153 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -77.9 47.1 -60.4 -13.6 2 294 A L - 0 0 56 1,-0.1 2,-0.4 37,-0.1 37,-0.2 -0.292 360.0-114.9 -71.0 147.2 47.4 -58.4 -16.8 3 295 A E E -a 39 0A 114 35,-1.8 37,-2.3 1,-0.1 2,-0.4 -0.648 26.5-123.8 -83.5 128.4 50.0 -59.2 -19.5 4 296 A E E +a 40 0A 128 -2,-0.4 37,-0.2 35,-0.2 -1,-0.1 -0.562 36.5 175.6 -73.6 126.6 52.6 -56.5 -20.1 5 297 A A E -a 41 0A 12 35,-2.7 37,-0.6 -2,-0.4 34,-0.0 -0.953 33.7 -95.2-131.8 153.6 52.7 -55.4 -23.8 6 298 A P - 0 0 108 0, 0.0 37,-0.1 0, 0.0 35,-0.0 -0.316 58.2 -74.1 -66.0 143.0 54.7 -52.7 -25.6 7 299 A W S S+ 0 0 37 35,-0.5 35,-0.1 2,-0.0 26,-0.0 -0.511 97.2 67.8 -63.2 145.2 53.2 -49.3 -26.2 8 300 A P S S- 0 0 79 0, 0.0 34,-0.1 0, 0.0 45,-0.0 0.461 71.1-144.7 -95.8 160.2 51.1 -48.4 -28.1 9 301 A P - 0 0 17 0, 0.0 3,-0.1 0, 0.0 26,-0.1 -0.267 28.0 -96.4 -76.5 164.9 47.8 -49.9 -27.1 10 302 A P > - 0 0 55 0, 0.0 3,-1.3 0, 0.0 2,-0.0 -0.332 56.0 -77.6 -73.4 168.2 45.2 -51.1 -29.6 11 303 A E T 3 S+ 0 0 162 1,-0.2 42,-0.1 42,-0.1 0, 0.0 -0.345 117.6 31.2 -63.3 144.3 42.3 -48.7 -30.4 12 304 A G T 3 S+ 0 0 26 1,-0.3 -1,-0.2 43,-0.1 0, 0.0 0.404 84.6 147.2 88.3 -2.6 39.6 -48.5 -27.8 13 305 A A < - 0 0 10 -3,-1.3 2,-0.4 1,-0.1 44,-0.3 -0.232 50.7-115.6 -62.5 155.1 41.9 -49.2 -24.9 14 306 A F E -B 35 0A 14 21,-2.5 21,-3.0 42,-0.1 2,-0.3 -0.783 30.5-136.5 -92.0 138.4 41.2 -47.6 -21.5 15 307 A V E -B 34 0A 2 42,-3.1 2,-0.3 -2,-0.4 44,-0.3 -0.713 17.2-170.8 -98.2 146.6 43.8 -45.1 -20.3 16 308 A G E +B 33 0A 2 17,-2.6 17,-2.8 -2,-0.3 2,-0.3 -0.958 17.7 171.4-125.4 148.9 45.4 -44.7 -16.9 17 309 A F E -B 32 0A 7 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.988 25.0-141.1-162.7 147.1 47.5 -41.6 -16.1 18 310 A V E -B 31 0A 15 13,-2.3 12,-2.1 -2,-0.3 13,-1.1 -0.949 14.2-162.0-118.6 129.0 49.3 -39.8 -13.2 19 311 A L E -B 29 0A 29 -2,-0.4 10,-0.2 10,-0.2 3,-0.1 -0.816 25.7-132.8-107.4 148.9 49.5 -36.0 -12.8 20 312 A S S S+ 0 0 67 8,-1.7 2,-0.3 -2,-0.3 -1,-0.1 0.700 96.2 7.3 -69.0 -19.0 51.9 -34.1 -10.6 21 313 A R S S- 0 0 109 7,-0.2 -1,-0.1 2,-0.1 6,-0.1 -0.976 82.5-104.2-160.3 164.8 48.9 -32.2 -9.4 22 314 A K S S+ 0 0 127 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.764 93.2 85.4 -71.0 -27.9 45.1 -32.2 -9.8 23 315 A E >> - 0 0 26 1,-0.2 3,-2.1 2,-0.1 4,-1.5 -0.638 65.3-155.6 -82.0 110.0 44.8 -29.3 -12.2 24 316 A P T 34 S+ 0 0 1 0, 0.0 -1,-0.2 0, 0.0 46,-0.1 0.789 92.0 57.3 -56.3 -28.8 45.2 -30.6 -15.8 25 317 A M T 34 S+ 0 0 7 1,-0.2 -2,-0.1 244,-0.1 -3,-0.0 0.668 118.3 31.3 -76.7 -15.2 46.3 -27.2 -17.1 26 318 A W T <4 S+ 0 0 71 -3,-2.1 -1,-0.2 -5,-0.1 2,-0.1 0.501 98.1 108.7-114.8 -8.8 49.1 -27.0 -14.6 27 319 A A < - 0 0 2 -4,-1.5 2,-0.5 -6,-0.1 -5,-0.0 -0.360 61.9-135.2 -80.1 148.2 50.1 -30.7 -14.2 28 320 A D - 0 0 75 -2,-0.1 -8,-1.7 0, 0.0 2,-1.1 -0.860 28.6-123.8 -88.6 130.1 53.1 -32.5 -15.5 29 321 A L E +B 19 0A 2 -2,-0.5 18,-0.2 -10,-0.2 -10,-0.2 -0.673 35.1 177.3 -77.7 101.3 52.0 -35.8 -17.0 30 322 A L E - 0 0 91 -12,-2.1 2,-0.3 -2,-1.1 -1,-0.2 0.841 59.3 -1.3 -79.2 -35.3 54.1 -38.2 -15.0 31 323 A A E -B 18 0A 34 -13,-1.1 -13,-2.3 14,-0.1 2,-0.3 -0.994 54.7-166.2-160.3 153.6 52.9 -41.5 -16.4 32 324 A L E +B 17 0A 2 11,-0.4 11,-2.9 -2,-0.3 2,-0.3 -0.993 13.6 165.4-149.1 129.2 50.5 -43.0 -19.0 33 325 A A E -BC 16 42A 1 -17,-2.8 -17,-2.6 -2,-0.3 2,-0.3 -0.902 17.4-151.5-140.6 163.8 49.3 -46.5 -19.5 34 326 A A E -BC 15 41A 0 7,-2.0 7,-2.9 -2,-0.3 2,-0.4 -0.996 6.5-156.1-145.2 141.3 46.5 -48.2 -21.5 35 327 A A E +BC 14 40A 0 -21,-3.0 -21,-2.5 -2,-0.3 2,-0.3 -0.950 24.3 141.9-123.5 132.0 44.6 -51.5 -20.8 36 328 A R + 0 0 116 3,-2.1 3,-0.5 -2,-0.4 -23,-0.1 -0.926 63.2 4.7-163.6 143.7 42.7 -53.8 -23.2 37 329 A G S S- 0 0 67 -2,-0.3 3,-0.1 1,-0.3 -24,-0.0 0.844 130.2 -49.2 53.9 42.1 42.1 -57.5 -23.8 38 330 A G S S+ 0 0 38 1,-0.3 -35,-1.8 -36,-0.1 2,-0.3 0.858 117.7 111.3 66.3 36.3 44.0 -58.6 -20.7 39 331 A R E -a 3 0A 118 -3,-0.5 -3,-2.1 -37,-0.2 2,-0.4 -0.990 51.1-158.2-137.9 147.3 47.0 -56.4 -21.6 40 332 A V E -aC 4 35A 6 -37,-2.3 -35,-2.7 -2,-0.3 2,-0.5 -0.986 8.0-161.7-122.3 135.9 48.5 -53.3 -20.1 41 333 A H E -aC 5 34A 8 -7,-2.9 -7,-2.0 -2,-0.4 2,-0.6 -0.977 5.3-157.4-119.4 119.5 50.7 -51.0 -22.2 42 334 A R E - C 0 33A 87 -37,-0.6 -35,-0.5 -2,-0.5 -9,-0.2 -0.864 18.1-128.4-102.7 121.9 53.0 -48.6 -20.3 43 335 A A - 0 0 13 -11,-2.9 -11,-0.4 -2,-0.6 4,-0.1 -0.533 8.2-151.7 -70.9 118.8 54.1 -45.5 -22.2 44 336 A P S S+ 0 0 119 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.894 93.8 21.2 -54.7 -45.0 58.0 -45.1 -22.0 45 337 A E S > S- 0 0 79 1,-0.1 4,-2.5 -3,-0.0 5,-0.2 -0.918 78.1-155.6-128.4 104.9 57.6 -41.4 -22.4 46 338 A P H > S+ 0 0 16 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.859 87.4 50.4 -51.0 -48.2 54.1 -40.1 -21.5 47 339 A Y H > S+ 0 0 45 -18,-0.2 4,-0.6 1,-0.2 3,-0.4 0.942 114.5 41.7 -62.4 -51.3 54.1 -36.9 -23.6 48 340 A K H >4 S+ 0 0 148 1,-0.2 3,-1.9 2,-0.2 4,-0.3 0.943 111.5 57.9 -56.5 -47.9 55.1 -38.4 -26.9 49 341 A A H >< S+ 0 0 2 -4,-2.5 3,-2.1 1,-0.3 4,-0.3 0.797 89.7 73.1 -55.1 -32.9 52.8 -41.4 -26.2 50 342 A L H >< S+ 0 0 2 -4,-1.8 3,-1.6 -3,-0.4 -1,-0.3 0.844 87.0 65.3 -47.9 -37.9 49.9 -39.0 -25.9 51 343 A R T << S+ 0 0 125 -3,-1.9 -1,-0.3 -4,-0.6 -2,-0.2 0.707 91.8 61.8 -61.2 -23.0 50.1 -38.6 -29.7 52 344 A D T < S+ 0 0 77 -3,-2.1 2,-0.3 -4,-0.3 -1,-0.3 0.515 85.2 95.2 -85.1 -6.1 49.1 -42.3 -30.3 53 345 A L < - 0 0 24 -3,-1.6 3,-0.1 -4,-0.3 -42,-0.1 -0.635 48.7-173.0 -88.2 145.1 45.7 -42.0 -28.7 54 346 A K S S+ 0 0 162 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.539 77.7 9.7-104.5 -15.6 42.6 -41.3 -30.7 55 347 A E S S- 0 0 82 20,-0.2 2,-0.7 -42,-0.1 -1,-0.4 -0.978 70.3-120.9-161.1 147.9 40.4 -40.8 -27.6 56 348 A A B +d 77 0B 0 20,-2.8 22,-3.4 -2,-0.3 2,-0.5 -0.896 39.4 175.4 -99.4 111.6 40.8 -40.5 -23.9 57 349 A R + 0 0 48 -2,-0.7 -42,-3.1 -44,-0.3 2,-0.3 -0.950 34.9 45.6-127.6 110.1 38.8 -43.4 -22.4 58 350 A G S > S- 0 0 0 21,-2.3 3,-1.6 -2,-0.5 4,-0.2 -0.946 91.8 -13.1 151.8-176.5 38.8 -44.0 -18.7 59 351 A L T 3 S+ 0 0 3 -44,-0.3 58,-0.1 54,-0.3 21,-0.0 -0.323 129.3 2.1 -55.8 134.2 38.5 -42.5 -15.3 60 352 A L T >> S+ 0 0 45 1,-0.1 4,-1.1 3,-0.1 3,-1.0 0.805 80.5 163.9 57.0 34.8 38.8 -38.7 -15.3 61 353 A A H <> + 0 0 1 -3,-1.6 4,-2.1 1,-0.3 3,-0.3 0.841 66.8 60.4 -52.3 -38.4 39.1 -38.8 -19.1 62 354 A K H 3> S+ 0 0 16 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.874 98.8 57.5 -62.7 -36.3 38.3 -35.0 -19.4 63 355 A D H <> S+ 0 0 10 -3,-1.0 4,-1.8 1,-0.2 -1,-0.2 0.899 108.8 45.1 -60.6 -40.8 41.4 -34.2 -17.3 64 356 A L H X S+ 0 0 0 -4,-1.1 4,-2.6 -3,-0.3 -1,-0.2 0.884 111.4 53.8 -70.7 -37.1 43.7 -36.0 -19.7 65 357 A S H X S+ 0 0 3 -4,-2.1 4,-3.0 2,-0.2 10,-0.3 0.886 107.0 51.3 -62.1 -41.3 41.9 -34.4 -22.7 66 358 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.939 111.8 46.7 -62.1 -46.3 42.5 -30.9 -21.2 67 359 A L H X S+ 0 0 0 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.894 111.9 51.4 -62.9 -39.5 46.1 -31.7 -20.8 68 360 A A H ><>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 3,-0.6 0.945 110.9 47.7 -62.0 -47.1 46.2 -33.0 -24.4 69 361 A L H ><5S+ 0 0 35 -4,-3.0 3,-2.1 1,-0.3 -2,-0.2 0.874 105.0 59.9 -61.0 -37.1 44.6 -29.9 -25.7 70 362 A R H 3<5S+ 0 0 35 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.862 105.8 49.0 -59.5 -32.7 47.1 -27.8 -23.7 71 363 A E T <<5S- 0 0 43 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.292 128.0 -99.5 -91.2 7.6 49.8 -29.5 -25.7 72 364 A G T < 5S+ 0 0 67 -3,-2.1 2,-0.5 1,-0.2 -3,-0.2 0.709 81.1 132.5 83.6 21.7 48.0 -28.8 -29.0 73 365 A L < - 0 0 35 -5,-2.4 2,-1.8 -6,-0.1 -1,-0.2 -0.923 54.4-142.1-110.3 126.5 46.5 -32.3 -29.4 74 366 A G + 0 0 73 -2,-0.5 -9,-0.1 -3,-0.1 -5,-0.0 -0.575 42.0 154.2 -83.4 77.2 42.8 -32.8 -30.3 75 367 A L - 0 0 6 -2,-1.8 -6,-0.2 -10,-0.3 -7,-0.2 -0.819 30.1-153.6-110.2 92.0 42.3 -35.8 -28.0 76 368 A P - 0 0 58 0, 0.0 -20,-2.8 0, 0.0 2,-0.2 -0.286 16.3-115.9 -69.6 148.0 38.6 -35.9 -27.1 77 369 A P B +d 56 0B 9 0, 0.0 -20,-0.2 0, 0.0 70,-0.1 -0.557 39.3 173.0 -77.3 147.3 37.4 -37.5 -23.9 78 370 A G + 0 0 1 -22,-3.4 -20,-0.1 1,-0.4 -17,-0.1 -0.199 46.9 3.7-124.9-141.7 35.2 -40.6 -24.3 79 371 A D - 0 0 15 -2,-0.1 -21,-2.3 -22,-0.1 -1,-0.4 -0.175 60.2-177.6 -46.3 137.3 33.7 -43.2 -21.9 80 372 A D >> - 0 0 12 -23,-0.2 3,-1.5 -3,-0.1 4,-1.2 -0.916 25.7-148.8-143.4 110.8 34.4 -42.4 -18.3 81 373 A P H 3> S+ 0 0 0 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.828 97.5 67.0 -49.7 -33.0 33.3 -44.8 -15.5 82 374 A M H 3> S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.890 100.2 48.9 -53.0 -43.5 33.0 -41.7 -13.2 83 375 A L H <> S+ 0 0 3 -3,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.874 110.8 49.9 -66.7 -37.3 30.1 -40.4 -15.3 84 376 A L H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.954 115.2 43.3 -64.6 -47.7 28.4 -43.8 -15.2 85 377 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 7,-0.3 0.879 110.4 55.3 -66.4 -39.0 28.7 -44.0 -11.5 86 378 A Y H < S+ 0 0 3 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.893 109.9 47.3 -62.1 -38.0 27.7 -40.4 -11.0 87 379 A L H < S+ 0 0 1 -4,-1.8 348,-0.6 1,-0.2 -2,-0.2 0.927 109.7 51.5 -70.6 -45.3 24.4 -41.1 -12.9 88 380 A L H < S- 0 0 19 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.897 139.0 -6.8 -53.3 -39.6 23.6 -44.3 -11.0 89 381 A D >< - 0 0 20 -4,-2.1 3,-2.8 -5,-0.2 -1,-0.3 -0.772 61.5-146.9-165.5 106.6 24.1 -42.3 -7.8 90 382 A P T 3 S+ 0 0 6 0, 0.0 -4,-0.1 0, 0.0 190,-0.1 0.493 94.4 76.1 -68.2 1.7 25.4 -38.7 -7.5 91 383 A S T 3 S+ 0 0 78 -6,-0.2 2,-1.2 1,-0.1 3,-0.2 0.526 73.3 92.6 -80.6 -6.7 27.1 -39.4 -4.2 92 384 A N < + 0 0 8 -3,-2.8 -3,-0.1 -7,-0.3 -1,-0.1 -0.739 47.7 136.0 -82.6 93.5 29.7 -41.2 -6.4 93 385 A T + 0 0 56 -2,-1.2 -1,-0.2 1,-0.1 182,-0.2 0.561 49.6 55.2-122.0 -15.8 32.0 -38.2 -6.8 94 386 A T S > S- 0 0 50 -3,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.922 71.8-129.6-122.9 148.9 35.6 -39.4 -6.4 95 387 A P H > S+ 0 0 13 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.866 111.2 57.1 -61.7 -30.5 37.5 -42.1 -8.2 96 388 A E H > S+ 0 0 104 2,-0.2 4,-1.9 1,-0.2 10,-0.2 0.913 111.0 40.9 -66.3 -42.2 38.5 -43.5 -4.7 97 389 A G H > S+ 0 0 32 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.937 117.7 47.4 -69.0 -45.8 34.8 -43.9 -3.7 98 390 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.901 111.9 50.7 -64.1 -42.6 33.7 -45.3 -7.0 99 391 A A H X>S+ 0 0 0 -4,-2.7 5,-2.3 -5,-0.2 4,-1.7 0.955 112.7 45.7 -56.3 -53.2 36.7 -47.7 -7.2 100 392 A R H <5S+ 0 0 219 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.854 117.2 44.8 -63.7 -34.9 35.9 -49.1 -3.7 101 393 A R H <5S+ 0 0 124 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.855 121.5 33.8 -79.0 -34.1 32.2 -49.4 -4.5 102 394 A Y H <5S- 0 0 7 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.333 127.7 -59.2-117.3 6.9 32.4 -50.9 -7.9 103 395 A G T <5S+ 0 0 46 -4,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.760 94.6 34.4 130.8 37.6 35.4 -53.2 -8.1 104 396 A G < - 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0 0 66 -3,-0.6 4,-2.5 1,-0.2 3,-0.2 -0.658 57.3-177.7 -97.1 88.7 18.3 -48.0 -16.9 132 424 A E H > S+ 0 0 127 -2,-1.2 4,-1.7 1,-0.2 -1,-0.2 0.835 79.4 44.8 -58.9 -40.8 17.1 -46.5 -20.2 133 425 A R H > S+ 0 0 123 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.863 113.8 49.3 -76.7 -32.8 16.7 -42.9 -19.0 134 426 A L H > S+ 0 0 2 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.880 110.2 53.5 -68.2 -34.8 20.1 -42.9 -17.2 135 427 A L H X S+ 0 0 5 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.871 106.8 50.8 -65.0 -38.7 21.6 -44.3 -20.4 136 428 A W H X S+ 0 0 96 -4,-1.7 4,-3.2 2,-0.2 5,-0.5 0.907 108.8 51.8 -66.2 -41.9 20.1 -41.5 -22.4 137 429 A L H X>S+ 0 0 0 -4,-2.0 5,-2.4 295,-0.2 4,-1.7 0.933 111.7 46.9 -59.4 -45.0 21.6 -39.0 -20.0 138 430 A Y H <>S+ 0 0 0 -4,-2.2 5,-2.9 3,-0.2 -2,-0.2 0.970 120.9 36.0 -60.9 -52.6 25.0 -40.6 -20.4 139 431 A R H <5S+ 0 0 109 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.896 127.7 32.6 -70.7 -44.1 24.9 -40.8 -24.2 140 432 A E H <5S+ 0 0 98 -4,-3.2 -1,-0.2 -5,-0.2 -3,-0.2 0.638 135.9 11.0 -91.6 -15.3 23.1 -37.6 -25.1 141 433 A V T X5S+ 0 0 1 -4,-1.7 4,-2.8 -5,-0.5 -3,-0.2 0.680 121.8 38.3-127.2 -69.8 24.3 -35.4 -22.2 142 434 A E H >> S+ 0 0 42 0, 0.0 4,-1.5 0, 0.0 3,-1.0 0.914 112.3 60.0 -64.1 -37.0 29.4 -35.4 -25.0 145 437 A L H 3X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.3 5,-0.2 0.876 96.2 62.0 -56.4 -37.2 29.3 -32.6 -22.4 146 438 A S H 3X S+ 0 0 4 -4,-2.2 4,-1.9 -3,-0.2 -1,-0.3 0.856 102.2 50.8 -60.1 -34.6 32.7 -33.8 -21.1 147 439 A A H + 0 0 59 145,-2.9 4,-1.8 -2,-0.4 5,-0.1 -0.608 36.2 173.4 -83.7 89.7 42.9 -7.7 -16.8 161 453 A V H > S+ 0 0 45 -2,-1.5 4,-2.5 2,-0.2 5,-0.2 0.915 73.3 50.8 -68.1 -48.2 45.9 -8.3 -14.5 162 454 A A H > S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.922 110.4 54.0 -56.0 -42.2 47.4 -4.8 -14.4 163 455 A Y H > S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.914 109.4 45.7 -59.0 -45.8 43.9 -3.6 -13.5 164 456 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.858 110.0 53.9 -70.1 -35.6 43.6 -6.0 -10.5 165 457 A R H X S+ 0 0 113 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.948 112.1 44.7 -61.0 -48.4 47.1 -5.2 -9.2 166 458 A A H X S+ 0 0 60 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.894 111.7 53.3 -63.7 -39.9 46.2 -1.5 -9.2 167 459 A L H X S+ 0 0 6 -4,-2.3 4,-2.7 -5,-0.2 5,-0.2 0.926 102.9 59.0 -59.2 -43.2 42.8 -2.3 -7.6 168 460 A S H X S+ 0 0 17 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.911 103.9 50.0 -52.8 -47.1 44.6 -4.3 -4.8 169 461 A L H X S+ 0 0 119 -4,-1.5 4,-1.6 1,-0.2 -1,-0.2 0.904 110.5 50.3 -61.7 -42.4 46.6 -1.2 -3.7 170 462 A E H X S+ 0 0 97 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.950 113.9 44.7 -58.1 -49.4 43.4 0.9 -3.6 171 463 A V H X S+ 0 0 5 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.848 106.6 58.9 -70.5 -33.3 41.6 -1.7 -1.5 172 464 A A H X S+ 0 0 42 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.915 106.7 49.4 -59.1 -41.8 44.6 -2.3 0.9 173 465 A E H X S+ 0 0 131 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.906 111.7 46.9 -67.3 -42.1 44.5 1.4 1.8 174 466 A E H X S+ 0 0 52 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.893 110.2 54.5 -64.4 -41.1 40.8 1.4 2.5 175 467 A I H X S+ 0 0 18 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.932 106.4 51.1 -58.5 -43.8 41.1 -1.8 4.5 176 468 A A H X S+ 0 0 44 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.876 107.8 54.0 -63.0 -36.3 43.8 -0.1 6.7 177 469 A R H X S+ 0 0 140 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.924 111.8 44.5 -59.8 -46.7 41.4 2.8 7.3 178 470 A L H X S+ 0 0 9 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.900 113.9 47.4 -67.7 -43.3 38.7 0.4 8.5 179 471 A E H X S+ 0 0 66 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.905 109.7 54.4 -70.4 -36.3 40.9 -1.7 10.7 180 472 A A H X S+ 0 0 58 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.931 112.1 44.2 -58.5 -46.0 42.4 1.4 12.3 181 473 A E H X S+ 0 0 61 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.931 111.4 52.4 -65.6 -46.1 39.0 2.7 13.2 182 474 A V H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 6,-0.2 0.923 111.6 47.4 -56.6 -44.3 37.8 -0.6 14.4 183 475 A F H X>S+ 0 0 43 -4,-2.5 4,-1.4 2,-0.2 5,-1.3 0.883 110.4 51.7 -66.3 -39.1 40.8 -0.8 16.7 184 476 A R H <5S+ 0 0 147 -4,-2.2 3,-0.4 -5,-0.2 -2,-0.2 0.955 112.9 46.1 -58.8 -47.6 40.3 2.7 17.9 185 477 A L H <5S+ 0 0 33 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.778 112.2 49.7 -69.0 -29.2 36.7 1.8 18.8 186 478 A A H <5S- 0 0 11 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.725 111.0-122.3 -79.4 -21.4 37.6 -1.4 20.5 187 479 A G T <5S+ 0 0 65 -4,-1.4 -3,-0.2 -3,-0.4 -2,-0.1 0.481 83.3 34.1 91.0 4.9 40.2 0.4 22.5 188 480 A H S - 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