==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 23-JAN-12 4DF8 . COMPND 2 MOLECULE: DNA POLYMERASE I, THERMOSTABLE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR K.BERGEN,A.STECK,S.STRUETT,A.BACCARO,W.WELTE,K.DIEDERICHS,A. . 539 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24459.0 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 . 1 0.2 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 . 48 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 236 43.8 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 1 1 1 1 4 2 3 0 0 1 1 1 1 1 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 . 3 1 2 2 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 1 294 A L 0 0 113 0, 0.0 2,-0.3 0, 0.0 37,-0.2 0.000 360.0 360.0 360.0 145.1 47.5 -58.1 -16.8 2 295 A E E -a 38 0A 122 35,-1.8 37,-2.1 1,-0.1 2,-0.1 -0.474 360.0-123.7 -61.5 122.8 50.2 -59.2 -19.3 3 296 A E E +a 39 0A 134 -2,-0.3 37,-0.2 35,-0.2 -1,-0.1 -0.459 37.4 175.6 -69.1 140.9 52.7 -56.4 -19.9 4 297 A A E -a 40 0A 13 35,-2.1 37,-0.6 -2,-0.1 34,-0.0 -0.976 33.4 -85.1-146.4 157.1 53.0 -55.4 -23.6 5 298 A P - 0 0 109 0, 0.0 37,-0.1 0, 0.0 35,-0.0 -0.276 59.7 -78.5 -63.9 145.2 54.8 -52.7 -25.7 6 299 A W S S+ 0 0 36 35,-0.4 35,-0.1 2,-0.0 26,-0.0 -0.537 96.0 64.7 -67.0 147.3 53.3 -49.3 -26.2 7 300 A P S S- 0 0 75 0, 0.0 34,-0.1 0, 0.0 45,-0.0 0.555 70.5-146.2 -92.8 163.5 51.2 -48.4 -28.1 8 301 A P - 0 0 20 0, 0.0 3,-0.1 0, 0.0 2,-0.1 -0.331 27.3 -98.2 -78.7 166.1 47.9 -50.0 -27.1 9 302 A P > - 0 0 59 0, 0.0 3,-1.3 0, 0.0 25,-0.0 -0.381 54.7 -74.5 -78.3 168.1 45.2 -51.0 -29.7 10 303 A E T 3 S+ 0 0 128 1,-0.2 42,-0.0 -2,-0.1 0, 0.0 -0.262 117.7 32.5 -58.3 144.4 42.2 -48.7 -30.4 11 304 A G T 3 S+ 0 0 25 1,-0.3 -1,-0.2 -3,-0.1 2,-0.0 0.412 84.1 145.1 89.6 -1.4 39.5 -48.7 -27.7 12 305 A A < - 0 0 13 -3,-1.3 2,-0.4 23,-0.1 44,-0.4 -0.320 50.1-118.8 -69.0 152.5 42.0 -49.2 -24.8 13 306 A F E -B 34 0A 14 21,-2.7 21,-2.7 42,-0.1 2,-0.3 -0.771 28.7-137.3 -93.5 138.8 41.4 -47.6 -21.4 14 307 A V E -B 33 0A 2 42,-2.9 44,-0.4 -2,-0.4 2,-0.3 -0.649 16.5-170.3-100.5 149.1 44.0 -45.1 -20.2 15 308 A G E +B 32 0A 2 17,-2.6 17,-2.9 -2,-0.3 2,-0.3 -0.966 16.8 171.4-126.9 149.6 45.5 -44.6 -16.8 16 309 A F E -B 31 0A 11 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.995 24.8-142.2-158.2 153.3 47.7 -41.6 -15.9 17 310 A V E -B 30 0A 16 13,-1.9 12,-2.3 -2,-0.3 13,-1.2 -0.985 15.3-162.9-125.6 128.1 49.4 -39.7 -13.1 18 311 A L E -B 28 0A 28 -2,-0.4 10,-0.2 10,-0.2 3,-0.1 -0.798 26.4-130.6-107.2 149.2 49.7 -35.9 -12.8 19 312 A S S S+ 0 0 65 8,-1.9 2,-0.3 -2,-0.3 -1,-0.1 0.757 96.3 10.1 -66.4 -25.4 52.1 -34.0 -10.6 20 313 A R S S- 0 0 107 7,-0.2 -1,-0.1 2,-0.1 6,-0.1 -0.970 82.0-107.3-151.8 163.6 49.1 -32.0 -9.4 21 314 A K S S+ 0 0 125 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.776 93.9 84.3 -67.2 -30.0 45.3 -32.2 -9.7 22 315 A E >> - 0 0 28 1,-0.2 3,-1.5 3,-0.1 4,-1.1 -0.657 66.3-155.5 -83.4 112.9 44.9 -29.2 -12.1 23 316 A P T 34 S+ 0 0 1 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.788 91.1 56.3 -61.4 -31.6 45.4 -30.5 -15.7 24 317 A M T 34 S+ 0 0 7 1,-0.2 -2,-0.1 244,-0.1 245,-0.0 0.710 119.2 33.4 -70.3 -20.5 46.4 -27.1 -17.1 25 318 A W T <4 S+ 0 0 74 -3,-1.5 -1,-0.2 -5,-0.1 2,-0.1 0.470 99.3 107.4-111.4 -5.4 49.2 -26.9 -14.5 26 319 A A < - 0 0 3 -4,-1.1 2,-0.5 -3,-0.2 -5,-0.1 -0.397 61.8-133.7 -85.3 149.7 50.2 -30.5 -14.2 27 320 A D - 0 0 70 -2,-0.1 -8,-1.9 0, 0.0 2,-1.1 -0.873 26.4-126.3 -90.0 129.8 53.2 -32.5 -15.3 28 321 A L E +B 18 0A 4 -2,-0.5 18,-0.3 -10,-0.2 -10,-0.2 -0.683 34.5 175.5 -77.7 101.9 52.2 -35.8 -17.0 29 322 A L E - 0 0 96 -12,-2.3 2,-0.3 -2,-1.1 -1,-0.2 0.817 60.5 -2.1 -82.8 -32.1 54.4 -38.1 -14.9 30 323 A A E -B 17 0A 31 -13,-1.2 -13,-1.9 -3,-0.1 2,-0.3 -0.992 55.0-166.5-159.1 158.0 53.1 -41.4 -16.4 31 324 A L E +B 16 0A 2 11,-0.4 11,-2.5 -2,-0.3 2,-0.3 -0.991 14.7 163.7-150.2 133.6 50.7 -42.8 -18.9 32 325 A A E -BC 15 41A 0 -17,-2.9 -17,-2.6 -2,-0.3 2,-0.3 -0.946 17.3-151.0-145.9 167.4 49.4 -46.3 -19.5 33 326 A A E -BC 14 40A 0 7,-2.4 7,-3.8 -2,-0.3 2,-0.4 -0.996 4.7-157.2-144.6 150.1 46.6 -48.2 -21.3 34 327 A A E +BC 13 39A 0 -21,-2.7 -21,-2.7 -2,-0.3 2,-0.3 -0.985 23.6 140.4-132.3 135.8 44.8 -51.5 -20.8 35 328 A R E > + C 0 38A 114 3,-2.1 3,-1.0 -2,-0.4 -23,-0.1 -0.884 63.2 8.2-167.8 142.6 42.8 -53.7 -23.1 36 329 A G T 3 S- 0 0 66 1,-0.3 3,-0.1 -2,-0.3 -24,-0.0 0.867 129.1 -49.7 56.2 44.8 42.3 -57.4 -23.8 37 330 A G T 3 S+ 0 0 41 1,-0.2 -35,-1.8 -36,-0.1 2,-0.3 0.694 117.7 108.4 69.9 20.3 44.2 -58.7 -20.7 38 331 A R E < -aC 2 35A 118 -3,-1.0 -3,-2.1 -37,-0.2 2,-0.4 -0.953 52.9-156.0-127.8 149.1 47.1 -56.5 -21.5 39 332 A V E -aC 3 34A 8 -37,-2.1 -35,-2.1 -2,-0.3 2,-0.5 -0.992 9.0-160.8-122.6 129.3 48.6 -53.4 -20.0 40 333 A H E -aC 4 33A 10 -7,-3.8 -7,-2.4 -2,-0.4 2,-0.5 -0.948 3.9-161.0-113.3 119.6 50.8 -51.0 -22.0 41 334 A R E - C 0 32A 91 -37,-0.6 -35,-0.4 -2,-0.5 -9,-0.2 -0.871 15.8-132.8-104.2 127.5 53.1 -48.6 -20.2 42 335 A A - 0 0 13 -11,-2.5 -11,-0.4 -2,-0.5 4,-0.1 -0.645 7.0-158.7 -83.0 122.3 54.4 -45.5 -22.1 43 336 A P S S+ 0 0 107 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.852 93.6 31.0 -65.5 -35.0 58.2 -44.9 -21.8 44 337 A E S > S- 0 0 118 1,-0.2 4,-2.4 -13,-0.0 5,-0.2 -0.870 75.6-168.3-127.6 96.4 57.7 -41.2 -22.7 45 338 A P H > S+ 0 0 23 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.874 81.8 49.0 -55.7 -51.7 54.2 -40.1 -21.6 46 339 A Y H >4 S+ 0 0 70 -18,-0.3 3,-0.9 1,-0.2 4,-0.5 0.933 116.4 41.2 -56.0 -53.1 54.0 -36.7 -23.4 47 340 A K H >4 S+ 0 0 100 1,-0.2 3,-1.2 2,-0.2 4,-0.2 0.869 108.7 62.6 -63.1 -36.9 55.0 -38.1 -26.8 48 341 A A H >< S+ 0 0 0 -4,-2.4 3,-1.8 1,-0.3 4,-0.4 0.728 85.7 74.7 -61.4 -25.7 52.8 -41.2 -26.2 49 342 A L G X< S+ 0 0 3 -4,-1.1 3,-1.9 -3,-0.9 -1,-0.3 0.870 85.1 65.5 -54.7 -39.2 49.7 -39.0 -26.1 50 343 A R G < S+ 0 0 127 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.697 93.6 61.4 -57.2 -21.8 50.0 -38.7 -29.9 51 344 A D G < S+ 0 0 79 -3,-1.8 2,-0.3 -4,-0.2 -1,-0.3 0.649 86.9 90.4 -82.5 -14.9 49.2 -42.4 -30.2 52 345 A L < - 0 0 25 -3,-1.9 3,-0.1 -4,-0.4 -42,-0.1 -0.624 55.9-163.3 -88.4 141.1 45.8 -42.2 -28.5 53 346 A K S S- 0 0 138 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.706 78.9 -8.7 -88.3 -25.0 42.6 -41.6 -30.5 54 347 A E S S- 0 0 70 20,-0.2 2,-0.9 2,-0.1 -1,-0.3 -0.978 70.9-104.7-162.5 161.7 40.7 -40.6 -27.4 55 348 A A B +d 76 0B 0 20,-3.2 22,-3.7 -2,-0.3 2,-0.6 -0.847 42.4 176.1 -96.3 106.1 41.0 -40.5 -23.6 56 349 A R + 0 0 48 -2,-0.9 -42,-2.9 -44,-0.4 2,-0.3 -0.941 38.9 44.5-116.3 112.9 38.9 -43.4 -22.4 57 350 A G S > S- 0 0 0 21,-2.7 3,-1.5 -2,-0.6 24,-0.1 -0.946 92.0 -9.8 150.6-172.8 38.9 -44.0 -18.6 58 351 A L T 3 S+ 0 0 4 -44,-0.4 58,-0.1 54,-0.3 21,-0.0 -0.327 128.6 1.5 -59.6 133.8 38.7 -42.5 -15.2 59 352 A L T >> S+ 0 0 46 1,-0.1 4,-1.1 3,-0.1 3,-1.1 0.821 80.6 166.7 55.0 35.3 39.0 -38.7 -15.2 60 353 A A H <> + 0 0 1 -3,-1.5 4,-2.1 1,-0.2 3,-0.3 0.838 67.6 60.4 -44.3 -45.1 39.2 -38.7 -19.0 61 354 A K H 3> S+ 0 0 16 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.871 98.5 57.4 -57.3 -39.5 38.5 -35.0 -19.2 62 355 A D H <> S+ 0 0 10 -3,-1.1 4,-1.8 1,-0.2 -1,-0.2 0.911 109.1 44.2 -59.5 -45.0 41.7 -34.2 -17.2 63 356 A L H X S+ 0 0 0 -4,-1.1 4,-2.3 -3,-0.3 -1,-0.2 0.896 113.2 52.8 -66.5 -39.2 43.9 -36.0 -19.6 64 357 A S H X S+ 0 0 1 -4,-2.1 4,-2.9 2,-0.2 10,-0.3 0.912 107.5 50.6 -61.1 -45.4 42.1 -34.4 -22.6 65 358 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.889 111.1 49.0 -60.9 -39.9 42.6 -30.9 -21.1 66 359 A L H X S+ 0 0 0 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.889 111.5 49.7 -67.4 -39.0 46.3 -31.6 -20.7 67 360 A A H <>S+ 0 0 0 -4,-2.3 5,-2.8 2,-0.2 3,-0.4 0.931 110.7 48.8 -62.9 -47.5 46.5 -32.9 -24.3 68 361 A L H ><5S+ 0 0 34 -4,-2.9 3,-1.5 1,-0.2 -2,-0.2 0.861 106.4 58.2 -59.7 -38.0 44.7 -29.8 -25.6 69 362 A R H 3<5S+ 0 0 33 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.857 106.5 48.8 -58.0 -36.6 47.1 -27.7 -23.6 70 363 A E T 3<5S- 0 0 45 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.307 127.1-100.3 -89.9 8.0 49.9 -29.4 -25.6 71 364 A G T < 5S+ 0 0 68 -3,-1.5 2,-0.5 1,-0.3 -3,-0.2 0.649 80.9 131.9 85.4 16.1 48.2 -28.7 -28.9 72 365 A L < - 0 0 32 -5,-2.8 2,-2.2 -6,-0.1 -1,-0.3 -0.897 56.1-139.6-107.0 126.5 46.8 -32.2 -29.3 73 366 A G + 0 0 74 -2,-0.5 -5,-0.1 -3,-0.1 -9,-0.1 -0.431 44.2 153.9 -80.6 67.1 43.1 -32.7 -30.3 74 367 A L - 0 0 6 -2,-2.2 -6,-0.2 -10,-0.3 -7,-0.2 -0.850 28.6-155.7-100.8 107.6 42.6 -35.6 -27.9 75 368 A P - 0 0 53 0, 0.0 -20,-3.2 0, 0.0 2,-0.3 -0.493 16.7-114.8 -83.5 153.2 38.9 -35.9 -26.9 76 369 A P B +d 55 0B 9 0, 0.0 -20,-0.2 0, 0.0 70,-0.1 -0.629 37.9 174.6 -80.9 143.5 37.6 -37.6 -23.8 77 370 A G + 0 0 4 -22,-3.7 -21,-0.1 1,-0.4 -16,-0.1 -0.031 48.4 1.7-119.4-138.2 35.5 -40.7 -24.2 78 371 A D - 0 0 14 -2,-0.1 -21,-2.7 -22,-0.1 -1,-0.4 -0.217 59.6-176.9 -53.5 139.4 34.0 -43.2 -21.8 79 372 A D >> - 0 0 12 -23,-0.2 4,-1.2 -3,-0.1 3,-1.1 -0.937 24.5-149.8-142.4 115.9 34.6 -42.4 -18.1 80 373 A P H 3> S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.774 96.7 67.5 -56.0 -27.1 33.4 -44.7 -15.3 81 374 A M H 3> S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.900 100.0 48.8 -58.8 -42.2 33.1 -41.7 -13.0 82 375 A L H <> S+ 0 0 3 -3,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.875 110.9 49.7 -66.5 -39.6 30.2 -40.4 -15.2 83 376 A L H X S+ 0 0 0 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.934 114.3 44.7 -61.4 -47.3 28.5 -43.8 -15.1 84 377 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 7,-0.3 0.889 110.3 54.8 -66.6 -40.1 28.8 -44.0 -11.3 85 378 A Y H < S+ 0 0 3 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.869 108.1 49.2 -62.0 -39.6 27.7 -40.4 -10.9 86 379 A L H < S+ 0 0 0 -4,-1.8 348,-0.6 1,-0.2 -1,-0.2 0.873 110.4 50.6 -67.5 -39.4 24.5 -41.0 -12.8 87 380 A L H < S- 0 0 16 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.877 139.1 -8.2 -62.3 -37.7 23.8 -44.2 -10.8 88 381 A D >< - 0 0 19 -4,-2.1 3,-2.4 -5,-0.1 -1,-0.3 -0.792 61.4-147.0-166.7 110.1 24.3 -42.2 -7.6 89 382 A P T 3 S+ 0 0 8 0, 0.0 -4,-0.1 0, 0.0 190,-0.1 0.494 93.6 76.5 -71.6 -0.5 25.6 -38.6 -7.4 90 383 A S T 3 S+ 0 0 81 -6,-0.1 2,-1.4 1,-0.1 3,-0.3 0.546 72.4 94.5 -78.1 -7.3 27.3 -39.3 -4.1 91 384 A N < + 0 0 8 -3,-2.4 -3,-0.1 -7,-0.3 -1,-0.1 -0.705 46.9 136.1 -78.9 91.3 29.8 -41.1 -6.3 92 385 A T + 0 0 57 -2,-1.4 -1,-0.2 1,-0.1 182,-0.2 0.577 49.6 54.9-118.6 -16.7 32.1 -38.1 -6.7 93 386 A T > - 0 0 58 -3,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.922 69.8-132.1-123.7 147.8 35.7 -39.4 -6.2 94 387 A P H > S+ 0 0 16 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.821 109.6 60.8 -61.5 -31.4 37.7 -42.1 -8.0 95 388 A E H > S+ 0 0 94 2,-0.2 4,-1.8 1,-0.2 10,-0.3 0.952 111.0 37.5 -58.0 -52.1 38.7 -43.3 -4.5 96 389 A G H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.900 116.8 50.9 -68.2 -43.1 35.1 -44.0 -3.6 97 390 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.903 110.0 50.2 -65.6 -41.8 34.0 -45.3 -7.0 98 391 A A H X>S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 5,-1.5 0.956 112.6 46.4 -57.5 -54.1 36.9 -47.8 -7.2 99 392 A R H <5S+ 0 0 186 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.889 118.2 43.3 -55.7 -43.2 36.2 -49.2 -3.7 100 393 A R H <5S+ 0 0 122 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.837 121.7 34.3 -76.5 -34.8 32.4 -49.4 -4.5 101 394 A Y H <5S- 0 0 6 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.375 129.3 -58.4-115.7 5.3 32.5 -50.9 -8.0 102 395 A G T <5S+ 0 0 42 -4,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.796 95.2 22.7 128.1 56.8 35.5 -53.1 -8.0 103 396 A G < - 0 0 30 -5,-1.5 2,-0.4 -4,-0.1 -1,-0.3 -0.993 69.2 -81.1 167.6-158.7 39.1 -52.0 -7.3 104 397 A E - 0 0 140 -2,-0.3 2,-0.8 7,-0.1 11,-0.1 -0.990 28.2-126.1-144.0 131.0 41.4 -49.5 -5.6 105 398 A W + 0 0 40 -2,-0.4 2,-0.1 -10,-0.3 7,-0.1 -0.669 43.6 169.5 -77.9 108.7 42.6 -46.1 -6.7 106 399 A T - 0 0 26 -2,-0.8 -1,-0.0 2,-0.2 -11,-0.0 -0.354 45.8-107.6-109.6-170.6 46.4 -46.2 -6.6 107 400 A E S S+ 0 0 137 -2,-0.1 2,-0.5 -90,-0.1 -2,-0.1 0.108 85.6 97.5-109.8 20.8 49.2 -44.0 -7.7 108 401 A E > - 0 0 57 1,-0.1 4,-2.1 -92,-0.0 -2,-0.2 -0.948 65.5-145.1-115.7 128.2 50.4 -46.1 -10.6 109 402 A A H > S+ 0 0 1 -2,-0.5 4,-2.4 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129 422 A G T 3 S+ 0 0 66 -2,-0.3 2,-1.7 1,-0.1 -1,-0.2 0.057 99.6 105.2 88.7 -24.3 17.8 -51.6 -18.1 130 423 A E <> + 0 0 57 -3,-0.9 4,-2.5 1,-0.2 5,-0.2 -0.533 44.3 167.5 -86.0 71.2 18.3 -48.0 -16.9 131 424 A E H > + 0 0 119 -2,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.809 69.8 49.4 -61.4 -35.2 17.3 -46.5 -20.2 132 425 A R H > S+ 0 0 125 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.900 112.8 46.6 -73.3 -41.2 16.9 -42.9 -18.9 133 426 A L H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.879 111.6 53.0 -64.6 -39.5 20.3 -42.9 -17.2 134 427 A L H X S+ 0 0 13 -4,-2.5 4,-2.6 -7,-0.2 5,-0.3 0.895 107.5 51.8 -59.9 -41.7 21.7 -44.4 -20.3 135 428 A W H X S+ 0 0 98 -4,-1.9 4,-2.9 1,-0.2 5,-0.4 0.924 108.9 49.7 -61.9 -45.2 20.2 -41.6 -22.3 136 429 A L H X>S+ 0 0 0 -4,-2.1 5,-2.6 295,-0.2 4,-1.4 0.873 112.5 48.5 -61.6 -39.1 21.7 -39.0 -20.0 137 430 A Y H <>S+ 0 0 0 -4,-2.1 5,-2.7 3,-0.2 -2,-0.2 0.970 119.8 34.8 -65.2 -53.3 25.1 -40.6 -20.4 138 431 A R H <5S+ 0 0 110 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.860 129.2 33.4 -72.2 -37.2 25.2 -40.9 -24.2 139 432 A E H <5S+ 0 0 98 -4,-2.9 -3,-0.2 -5,-0.3 -1,-0.2 0.649 135.0 10.7 -97.4 -18.8 23.3 -37.7 -25.0 140 433 A V T X5S+ 0 0 2 -4,-1.4 4,-2.5 -5,-0.4 -3,-0.2 0.676 122.1 37.8-123.8 -71.3 24.4 -35.4 -22.2 141 434 A E H >> S+ 0 0 42 0, 0.0 4,-1.5 0, 0.0 3,-0.8 0.900 111.6 58.8 -62.2 -37.3 29.5 -35.4 -25.0 144 437 A L H 3X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.3 5,-0.2 0.836 94.8 63.5 -60.8 -33.8 29.5 -32.6 -22.4 145 438 A S H 3X S+ 0 0 3 -4,-1.8 4,-1.9 -3,-0.3 -1,-0.3 0.850 102.9 49.7 -61.8 -33.7 32.9 -33.8 -21.0 146 439 A A H + 0 0 61 145,-2.7 4,-1.8 -2,-0.4 5,-0.1 -0.631 35.7 173.8 -82.3 87.3 43.0 -7.5 -16.8 160 453 A V H > S+ 0 0 43 -2,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.911 72.0 54.0 -64.4 -47.3 45.9 -8.2 -14.4 161 454 A A H > S+ 0 0 73 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 108.6 51.4 -54.2 -45.5 47.3 -4.7 -14.3 162 455 A Y H > S+ 0 0 70 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.928 110.6 47.5 -57.4 -49.8 43.9 -3.3 -13.4 163 456 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.884 109.0 54.0 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-68.7 -39.9 40.8 1.6 2.7 174 467 A I H X S+ 0 0 17 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.907 106.2 53.4 -58.5 -42.8 41.1 -1.6 4.7 175 468 A A H X S+ 0 0 41 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.882 107.8 50.5 -60.4 -41.1 43.8 0.1 6.8 176 469 A R H X S+ 0 0 142 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.926 113.1 45.8 -62.2 -46.5 41.4 3.0 7.5 177 470 A L H X S+ 0 0 6 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.927 113.0 48.1 -62.1 -47.5 38.7 0.6 8.6 178 471 A E H X S+ 0 0 66 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.878 109.7 53.3 -66.4 -37.4 40.9 -1.6 10.8 179 472 A A H X S+ 0 0 56 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.905 111.2 46.8 -62.4 -43.5 42.4 1.5 12.5 180 473 A E H X S+ 0 0 67 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.920 111.1 51.2 -62.1 -46.4 38.9 2.7 13.3 181 474 A V H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 6,-0.2 0.911 111.3 48.1 -57.9 -43.4 37.8 -0.7 14.6 182 475 A F H X>S+ 0 0 45 -4,-2.5 4,-1.3 2,-0.2 5,-1.3 0.890 111.3 50.0 -66.5 -40.8 40.9 -0.9 16.8 183 476 A R H <5S+ 0 0 140 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.925 111.8 48.2 -59.1 -46.4 40.3 2.6 18.2 184 477 A L H <5S+ 0 0 35 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.799 111.8 49.3 -68.5 -31.0 36.6 1.7 18.9 185 478 A A H <5S- 0 0 12 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.738 110.6-125.2 -76.5 -24.4 37.7 -1.5 20.6 186 479 A G T <5S+ 0 0 64 -4,-1.3 -3,-0.2 -3,-0.2 -2,-0.1 0.443 83.0 39.0 91.4 2.9 40.2 0.5 22.7 187 480 A H S - 0 0 82 -2,-0.3 3,-1.9 1,-0.2 7,-0.3 -0.699 42.6-171.1 -82.1 101.4 43.6 -9.8 14.9 191 484 A L T 3 S+ 0 0 8 -2,-1.1 -1,-0.2 1,-0.3 6,-0.1 0.667 82.8 64.8 -70.9 -15.0 40.4 -8.6 13.2 192 485 A N T 3 S+ 0 0 113 -3,-0.1 2,-0.7 1,-0.1 -1,-0.3 0.569 86.0 87.1 -78.3 -9.9 40.6 -11.6 10.9 193 486 A S <> - 0 0 28 -3,-1.9 4,-2.3 1,-0.2 5,-0.2 -0.827 59.5-168.0 -95.2 111.6 40.0 -13.8 13.9 194 487 A R H > S+ 0 0 67 -2,-0.7 4,-1.7 1,-0.2 -1,-0.2 0.735 89.5 58.7 -69.3 -20.5 36.3 -14.3 14.6 195 488 A D H > S+ 0 0 52 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.918 108.9 42.1 -71.7 -45.4 37.3 -15.7 18.0 196 489 A Q H > S+ 0 0 58 -6,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.904 114.8 52.1 -65.5 -42.5 39.1 -12.6 19.1 197 490 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 -7,-0.3 5,-0.2 0.853 103.3 58.0 -63.0 -36.7 36.3 -10.4 17.6 198 491 A E H X>S+ 0 0 17 -4,-1.7 4,-2.7 1,-0.2 5,-0.5 0.910 107.3 47.8 -59.7 -42.5 33.6 -12.3 19.5 199 492 A R H X>S+ 0 0 125 -4,-1.3 5,-2.5 1,-0.2 4,-1.5 0.870 112.2 49.7 -69.0 -36.7 35.3 -11.4 22.8 200 493 A V H <>S+ 0 0 2 -4,-1.7 5,-2.8 3,-0.2 -2,-0.2 0.946 117.6 38.7 -66.7 -47.3 35.6 -7.8 21.8 201 494 A L H <5S+ 0 0 0 -4,-2.8 6,-0.9 3,-0.2 -2,-0.2 0.945 131.1 23.6 -68.6 -49.5 32.0 -7.5 20.7 202 495 A F H <5S+ 0 0 18 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.725 132.7 29.9 -99.2 -24.7 30.3 -9.5 23.4 203 496 A D T < - 0 0 38 5,-2.6 4,-0.8 -2,-0.3 7,-0.0 -0.450 28.5-121.0 -84.0 159.8 27.6 -21.2 15.7 214 507 A E T 4 S+ 0 0 169 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.941 96.9 26.0 -69.6 -55.6 26.7 -24.7 14.5 215 508 A K T 4 S+ 0 0 192 1,-0.1 -1,-0.2 2,-0.0 -2,-0.0 0.831 135.7 21.3 -85.2 -36.3 29.6 -27.1 15.5 216 509 A T T 4 S- 0 0 102 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.440 92.9-127.4-118.0 -3.2 31.2 -25.4 18.5 217 510 A G < + 0 0 40 -4,-0.8 -3,-0.1 1,-0.2 2,-0.1 0.801 49.4 157.6 62.9 33.4 28.4 -23.2 19.8 218 511 A K - 0 0 72 1,-0.1 -5,-2.6 -6,-0.1 2,-0.5 -0.421 57.0 -86.8 -77.7 162.9 30.4 -20.0 19.9 219 512 A R B -H 212 0E 58 -7,-0.2 -7,-0.3 -2,-0.1 -1,-0.1 -0.639 55.1-121.1 -72.1 119.7 28.7 -16.6 19.8 220 513 A S - 0 0 18 -9,-2.5 -10,-0.3 -2,-0.5 -9,-0.3 -0.292 29.2-174.7 -69.5 144.9 28.3 -15.9 16.1 221 514 A T + 0 0 6 -12,-0.1 -1,-0.1 -11,-0.1 5,-0.1 -0.047 37.7 144.7-119.5 26.6 29.8 -12.8 14.5 222 515 A S > - 0 0 49 1,-0.1 4,-2.3 3,-0.1 3,-0.4 -0.118 66.9-104.3 -65.5 165.8 28.2 -13.5 11.1 223 516 A A H > S+ 0 0 51 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.863 122.0 57.5 -60.5 -34.8 26.9 -10.8 8.8 224 517 A A H > S+ 0 0 62 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.890 109.1 45.4 -61.8 -41.9 23.3 -11.6 9.8 225 518 A V H > S+ 0 0 11 -3,-0.4 4,-0.9 2,-0.2 -2,-0.2 0.905 112.5 50.3 -68.2 -43.5 24.2 -11.0 13.4 226 519 A L H < S+ 0 0 0 -4,-2.3 3,-0.5 1,-0.2 -2,-0.2 0.873 105.7 55.2 -67.4 -37.5 26.1 -7.8 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60.3 -64.9 -38.9 -0.2 -18.8 -17.1 338 631 A V H <>S+ 0 0 4 -4,-1.3 5,-2.1 1,-0.2 -1,-0.2 0.888 110.7 40.4 -52.9 -42.8 2.1 -16.3 -15.4 339 632 A F H ><5S+ 0 0 3 -4,-1.3 3,-1.4 -3,-0.3 -1,-0.2 0.815 108.9 58.8 -82.6 -32.1 4.9 -17.2 -17.9 340 633 A Q H 3<5S+ 0 0 131 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.752 105.6 52.8 -63.0 -24.4 2.6 -17.3 -20.9 341 634 A E T 3<5S- 0 0 114 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.303 116.1-116.9 -95.8 8.3 1.7 -13.7 -20.1 342 635 A G T < 5 + 0 0 54 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.811 59.8 157.8 62.8 32.6 5.4 -12.7 -20.0 343 636 A R < - 0 0 91 -5,-2.1 2,-0.5 -6,-0.2 -1,-0.2 -0.406 37.7-137.7 -86.1 165.0 5.3 -11.7 -16.3 344 637 A D > - 0 0 40 1,-0.1 4,-2.0 -2,-0.1 5,-0.1 -0.948 11.4-171.1-127.9 110.7 8.3 -11.5 -14.0 345 638 A I H > S+ 0 0 12 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 0.824 88.1 55.0 -73.4 -30.0 7.8 -12.9 -10.5 346 639 A H H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.914 110.2 45.1 -67.9 -43.4 11.1 -11.5 -9.2 347 640 A T H > S+ 0 0 26 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.901 113.9 50.2 -66.8 -40.3 10.2 -8.0 -10.3 348 641 A E H X S+ 0 0 54 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.925 111.8 46.3 -64.7 -46.7 6.7 -8.3 -8.8 349 642 A T H X S+ 0 0 11 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.891 113.0 52.2 -59.5 -39.4 8.0 -9.6 -5.4 350 643 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.914 105.7 52.4 -65.5 -45.0 10.6 -6.8 -5.5 351 644 A S H X>S+ 0 0 23 -4,-2.6 5,-2.0 1,-0.2 4,-0.5 0.876 113.9 45.2 -58.5 -38.4 7.9 -4.2 -6.1 352 645 A W H ><5S+ 0 0 88 -4,-1.8 3,-0.5 3,-0.2 -2,-0.2 0.940 111.3 52.6 -67.8 -51.0 6.1 -5.6 -3.1 353 646 A M H 3<5S+ 0 0 48 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.921 120.7 30.3 -51.4 -54.3 9.2 -5.8 -0.9 354 647 A F H 3<5S- 0 0 99 -4,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.426 106.8-122.8 -93.2 1.2 10.4 -2.2 -1.4 355 648 A G T <<5 + 0 0 64 -4,-0.5 -3,-0.2 -3,-0.5 -4,-0.1 0.938 68.2 119.6 59.0 54.1 6.8 -0.8 -1.8 356 649 A V < - 0 0 51 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.966 69.7 -84.6-142.9 156.3 7.3 0.8 -5.2 357 650 A P >> - 0 0 72 0, 0.0 3,-1.7 0, 0.0 4,-0.6 -0.197 45.9-106.8 -57.3 156.0 5.8 0.4 -8.7 358 651 A R G >4 S+ 0 0 151 1,-0.3 3,-0.6 2,-0.2 -8,-0.0 0.770 120.5 56.7 -58.0 -28.9 7.3 -2.3 -11.0 359 652 A E G 34 S+ 0 0 159 1,-0.2 -1,-0.3 -8,-0.0 -12,-0.0 0.720 99.4 60.1 -74.6 -22.3 9.0 0.3 -13.1 360 653 A A G <4 S+ 0 0 50 -3,-1.7 2,-0.4 2,-0.1 -1,-0.2 0.649 78.6 110.7 -80.3 -16.8 10.8 1.6 -10.0 361 654 A V << - 0 0 24 -4,-0.6 -10,-0.1 -3,-0.6 -14,-0.0 -0.453 54.0-160.5 -64.6 118.0 12.5 -1.7 -9.4 362 655 A D >> - 0 0 77 -2,-0.4 4,-2.1 -12,-0.1 3,-0.6 -0.457 34.4 -97.9 -89.0 169.5 16.3 -1.5 -10.0 363 656 A P H 3> S+ 0 0 110 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.909 122.7 53.3 -54.8 -47.0 18.5 -4.6 -10.6 364 657 A L H 3> S+ 0 0 80 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.786 109.3 50.0 -61.8 -28.7 19.7 -4.8 -7.0 365 658 A M H <> S+ 0 0 18 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.931 110.7 48.5 -70.9 -48.7 16.1 -4.8 -5.8 366 659 A R H X S+ 0 0 56 -4,-2.1 4,-1.0 1,-0.2 -2,-0.2 0.897 109.6 53.4 -56.9 -44.6 15.1 -7.6 -8.2 367 660 A R H >X S+ 0 0 107 -4,-2.7 4,-1.1 1,-0.2 3,-0.9 0.915 106.0 52.8 -57.3 -47.4 18.2 -9.6 -7.1 368 661 A A H 3X S+ 0 0 24 -4,-1.6 4,-1.1 1,-0.2 3,-0.3 0.880 105.6 55.8 -52.8 -41.5 17.1 -9.2 -3.4 369 662 A A H 3X S+ 0 0 0 -4,-1.8 4,-2.9 1,-0.2 -1,-0.2 0.724 95.7 66.2 -67.9 -23.5 13.7 -10.6 -4.4 370 663 A K H S+ 0 0 21 -4,-2.1 5,-2.0 -5,-0.5 -2,-0.2 0.959 111.6 40.1 -52.7 -54.2 13.8 -19.0 -0.2 376 669 A V H ><5S+ 0 0 2 -4,-2.5 3,-1.5 3,-0.2 -2,-0.2 0.898 112.8 56.4 -63.8 -41.8 10.1 -19.3 0.3 377 670 A L H 3<5S+ 0 0 2 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.900 109.3 45.4 -56.7 -43.7 9.7 -21.9 -2.5 378 671 A Y T 3<5S- 0 0 33 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.125 133.8 -77.2 -98.4 21.8 12.2 -24.2 -0.9 379 672 A G T < 5 + 0 0 38 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.726 61.9 172.3 102.9 25.1 10.9 -24.0 2.6 380 673 A M < - 0 0 37 -5,-2.0 2,-0.3 -6,-0.1 -1,-0.2 -0.293 35.1-115.8 -59.2 148.8 12.0 -20.8 4.3 381 674 A S > - 0 0 66 1,-0.1 4,-2.4 19,-0.0 5,-0.2 -0.634 12.9-124.3 -89.4 148.0 10.4 -20.2 7.7 382 675 A A H > S+ 0 0 16 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.849 110.2 58.4 -55.7 -36.4 8.1 -17.3 8.3 383 676 A H H > S+ 0 0 109 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.944 108.4 40.6 -61.4 -53.8 10.4 -16.2 11.2 384 677 A R H > S+ 0 0 141 2,-0.2 4,-3.7 1,-0.2 5,-0.3 0.916 115.0 55.4 -58.5 -47.0 13.6 -15.8 9.1 385 678 A L H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 6,-0.2 0.939 109.8 43.7 -52.0 -54.6 11.5 -14.2 6.4 386 679 A S H X>S+ 0 0 10 -4,-2.9 5,-1.6 1,-0.2 4,-0.8 0.878 116.5 51.0 -57.0 -37.5 10.1 -11.6 8.7 387 680 A Q H <5S+ 0 0 121 -4,-2.0 3,-0.5 -5,-0.2 -2,-0.2 0.937 111.1 43.8 -69.0 -49.6 13.6 -11.2 10.1 388 681 A E H <5S+ 0 0 104 -4,-3.7 -1,-0.2 1,-0.2 -2,-0.2 0.717 120.8 42.4 -72.2 -20.4 15.4 -10.7 6.7 389 682 A L H <5S- 0 0 34 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.506 101.8-134.6 -97.7 -8.4 12.7 -8.4 5.5 390 683 A A T <5 + 0 0 92 -4,-0.8 -3,-0.2 -3,-0.5 -4,-0.1 0.828 63.8 129.0 52.8 35.0 12.5 -6.6 8.9 391 684 A I S > - 0 0 84 0, 0.0 4,-1.7 0, 0.0 3,-0.5 -0.182 39.9-112.9 -57.1 155.2 6.5 -8.1 11.4 393 686 A Y H 3> S+ 0 0 103 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.866 114.7 60.2 -55.3 -41.2 6.1 -11.9 11.7 394 687 A E H 3> S+ 0 0 125 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.871 104.8 47.5 -58.5 -41.3 2.4 -11.7 10.7 395 688 A E H <> S+ 0 0 99 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.934 112.0 49.1 -64.7 -48.6 3.2 -10.1 7.3 396 689 A A H X S+ 0 0 0 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.929 112.5 47.4 -54.7 -51.1 6.0 -12.7 6.5 397 690 A Q H X S+ 0 0 88 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.893 111.6 52.8 -56.3 -43.8 3.7 -15.6 7.4 398 691 A A H X S+ 0 0 23 -4,-1.9 4,-1.6 -5,-0.3 -1,-0.2 0.826 105.2 54.2 -62.4 -41.2 1.0 -13.9 5.2 399 692 A F H X S+ 0 0 13 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.878 107.1 50.8 -61.3 -37.6 3.3 -13.6 2.2 400 693 A I H X S+ 0 0 24 -4,-1.6 4,-1.6 1,-0.2 -2,-0.2 0.860 108.9 49.4 -73.1 -35.3 4.1 -17.4 2.3 401 694 A E H X S+ 0 0 99 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.880 114.5 45.1 -69.4 -43.0 0.6 -18.5 2.4 402 695 A R H X S+ 0 0 103 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.903 107.0 60.6 -67.5 -41.9 -0.3 -16.2 -0.6 403 696 A Y H < S+ 0 0 24 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.891 117.0 30.7 -47.0 -47.7 2.8 -17.3 -2.4 404 697 A F H < S+ 0 0 16 -4,-1.6 3,-0.5 2,-0.2 6,-0.3 0.805 113.0 59.4 -88.0 -32.6 1.5 -20.9 -2.4 405 698 A Q H < S+ 0 0 135 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.781 102.8 58.2 -68.1 -23.9 -2.2 -20.3 -2.5 406 699 A S S < S+ 0 0 48 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.832 113.6 38.3 -67.0 -35.1 -1.5 -18.5 -5.8 407 700 A F S >> S+ 0 0 30 -3,-0.5 3,-1.7 -4,-0.4 4,-0.6 -0.650 73.7 176.5-124.5 74.4 0.0 -21.7 -7.2 408 701 A P H >> S+ 0 0 74 0, 0.0 4,-1.0 0, 0.0 3,-0.7 0.811 74.5 51.7 -45.2 -55.0 -2.1 -24.6 -5.9 409 702 A K H 3> S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.512 92.7 77.5 -71.3 -4.6 -0.5 -27.6 -7.6 410 703 A V H <> S+ 0 0 3 -3,-1.7 4,-2.2 -6,-0.3 -1,-0.2 0.957 98.0 41.5 -70.6 -49.7 3.0 -26.6 -6.4 411 704 A R H - 0 0 4 4,-2.0 3,-1.6 -2,-0.3 31,-0.1 -0.254 50.1 -89.1 -79.5 175.3 14.7 -34.7 -12.5 430 723 A L T 3 S+ 0 0 39 29,-0.5 -1,-0.1 1,-0.3 30,-0.0 0.829 131.2 45.7 -53.2 -36.3 12.5 -34.5 -15.6 431 724 A F T 3 S- 0 0 13 2,-0.0 -1,-0.3 -298,-0.0 -295,-0.2 0.396 125.6-100.0 -93.1 1.1 15.1 -36.6 -17.5 432 725 A G < + 0 0 2 -3,-1.6 2,-0.2 1,-0.3 -2,-0.1 0.603 63.8 156.8 94.1 10.5 15.5 -39.1 -14.8 433 726 A R - 0 0 6 26,-0.1 -4,-2.0 -155,-0.1 2,-0.3 -0.539 34.2-142.5 -63.0 135.9 18.7 -38.0 -13.0 434 727 A R E -M 428 0H 26 -348,-0.6 2,-0.4 -6,-0.2 -6,-0.2 -0.763 25.3-172.8-111.3 149.7 18.5 -39.4 -9.5 435 728 A R E -M 427 0H 47 -8,-2.1 -8,-2.2 -2,-0.3 2,-0.3 -0.968 23.3-136.9-133.0 123.3 19.4 -38.3 -6.0 436 729 A Y E -M 426 0H 97 -2,-0.4 -10,-0.3 -10,-0.2 -11,-0.1 -0.623 21.3-179.9 -78.8 132.3 19.1 -40.8 -3.1 437 730 A V > + 0 0 10 -12,-2.0 3,-1.4 -2,-0.3 -12,-0.1 -0.648 11.1 165.9-134.4 76.0 17.6 -39.3 0.0 438 731 A P G > + 0 0 99 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.754 69.2 73.5 -62.5 -26.3 17.4 -41.9 2.8 439 732 A D G > + 0 0 84 1,-0.3 3,-1.4 2,-0.2 12,-0.2 0.435 68.6 89.9 -75.1 1.1 16.7 -39.3 5.5 440 733 A L G < S+ 0 0 2 -3,-1.4 -1,-0.3 1,-0.2 -18,-0.1 0.721 93.1 45.1 -62.0 -22.0 13.2 -38.8 4.2 441 734 A E G < S+ 0 0 144 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.2 0.166 84.8 136.3-108.4 15.2 12.3 -41.6 6.7 442 735 A A < - 0 0 19 -3,-1.4 -3,-0.0 1,-0.1 6,-0.0 -0.311 52.2-143.9 -58.1 145.8 14.3 -40.2 9.5 443 736 A R S S+ 0 0 232 5,-0.0 2,-0.6 4,-0.0 -1,-0.1 0.632 82.1 84.8 -89.1 -16.9 12.6 -40.3 12.9 444 737 A V S > S- 0 0 81 1,-0.2 4,-3.0 2,-0.0 5,-0.2 -0.796 74.4-148.6 -85.3 122.2 14.2 -37.0 14.0 445 738 A K H > S+ 0 0 127 -2,-0.6 4,-3.4 1,-0.2 5,-0.3 0.898 93.8 50.3 -61.0 -47.7 11.9 -34.2 12.6 446 739 A S H > S+ 0 0 83 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.887 115.3 44.5 -59.5 -41.1 14.7 -31.6 12.0 447 740 A V H > S+ 0 0 59 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.941 116.0 47.2 -66.9 -47.8 16.8 -34.2 10.1 448 741 A R H X S+ 0 0 67 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.908 113.5 47.2 -59.0 -45.9 13.7 -35.5 8.2 449 742 A E H X S+ 0 0 78 -4,-3.4 4,-1.9 2,-0.2 -1,-0.2 0.841 109.4 53.1 -71.4 -35.0 12.6 -32.0 7.2 450 743 A A H X S+ 0 0 24 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.929 110.4 49.6 -58.3 -46.4 16.0 -30.9 6.2 451 744 A A H X S+ 0 0 3 -4,-2.2 4,-2.8 -12,-0.2 -2,-0.2 0.883 106.6 55.6 -59.9 -40.6 16.1 -34.0 3.9 452 745 A E H X S+ 0 0 39 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.898 106.7 49.4 -61.6 -41.4 12.7 -33.0 2.5 453 746 A R H X S+ 0 0 109 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.884 113.6 46.5 -66.0 -39.5 13.9 -29.6 1.4 454 747 A M H X S+ 0 0 88 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.917 113.7 51.2 -62.9 -43.3 16.9 -31.2 -0.2 455 748 A A H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.906 112.7 39.5 -67.1 -47.4 14.7 -33.8 -1.8 456 749 A F H X S+ 0 0 16 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.684 113.1 57.3 -82.4 -14.7 12.0 -31.6 -3.5 457 750 A N H >X S+ 0 0 25 -4,-1.1 4,-2.7 -5,-0.3 3,-0.6 0.861 94.7 68.0 -71.6 -38.8 14.6 -29.0 -4.5 458 751 A M H 3X S+ 0 0 0 -4,-1.5 4,-3.2 1,-0.3 5,-0.3 0.867 94.4 51.5 -58.5 -47.4 16.6 -31.5 -6.5 459 752 A P H 3> S+ 0 0 4 0, 0.0 4,-1.5 0, 0.0 -29,-0.5 0.880 116.7 43.2 -58.1 -33.7 14.2 -32.2 -9.3 460 753 A V H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 3,-0.6 0.870 95.7 72.3 -73.5 -40.2 25.5 -25.2 -28.9 476 769 A F H 3X S+ 0 0 26 -4,-2.3 4,-2.2 1,-0.2 3,-0.3 0.864 97.2 45.7 -49.3 -53.3 29.2 -26.2 -28.9 477 770 A P H 3> S+ 0 0 61 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.865 111.1 55.0 -62.7 -32.7 29.5 -27.5 -32.5 478 771 A R H X>S+ 0 0 0 -4,-1.8 5,-2.5 -3,-0.3 4,-0.8 0.915 106.9 55.0 -71.6 -46.1 30.1 -22.1 -32.1 480 773 A E H ><5S+ 0 0 105 -4,-2.2 3,-1.0 1,-0.3 -1,-0.2 0.906 107.2 52.0 -47.4 -47.3 33.1 -24.0 -33.4 481 774 A E H 3<5S+ 0 0 151 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.752 112.0 45.8 -66.1 -25.0 31.6 -23.5 -36.9 482 775 A M H <<5S- 0 0 46 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.467 114.6-114.7 -95.8 -4.5 31.3 -19.8 -36.3 483 776 A G T <<5S+ 0 0 33 -3,-1.0 2,-0.2 -4,-0.8 -3,-0.2 0.742 72.6 133.7 75.6 23.0 34.8 -19.4 -34.8 484 777 A A < - 0 0 3 -5,-2.5 2,-0.4 14,-0.1 -1,-0.3 -0.656 47.4-132.7-101.5 163.9 33.4 -18.5 -31.4 485 778 A R E -L 497 0G 81 12,-3.0 12,-2.5 -2,-0.2 2,-0.6 -0.925 3.6-141.3-120.7 139.1 34.4 -19.9 -28.0 486 779 A M E +L 496 0G 4 -2,-0.4 10,-0.2 10,-0.2 -332,-0.1 -0.885 31.0 167.3 -93.6 124.8 32.4 -21.2 -25.1 487 780 A L E + 0 0 2 8,-2.6 2,-0.3 -2,-0.6 -332,-0.2 0.859 49.3 6.5-108.2 -51.7 34.3 -19.9 -22.0 488 781 A L E -L 495 0G 6 7,-1.7 7,-2.6 2,-0.0 2,-0.4 -0.969 45.1-155.1-139.6 150.3 32.2 -20.4 -18.8 489 782 A Q E -L 494 0G 4 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.998 7.2-174.7-119.1 133.1 29.1 -21.9 -17.5 490 783 A V - 0 0 18 3,-2.9 2,-2.2 -2,-0.4 4,-0.1 -0.562 59.9 -84.5-125.2 66.1 27.5 -20.4 -14.3 491 784 A H S S+ 0 0 46 1,-0.3 -23,-0.1 -2,-0.2 -210,-0.1 -0.406 121.9 9.4 74.1 -68.2 24.6 -22.7 -13.6 492 785 A D S S+ 0 0 37 -2,-2.2 -174,-2.3 -174,-0.1 2,-0.4 0.103 122.0 79.9-125.5 24.4 22.0 -21.2 -15.9 493 786 A E E -J 317 0G 7 -176,-0.2 -3,-2.9 2,-0.0 2,-0.4 -0.971 56.1-163.1-131.3 142.5 24.4 -18.8 -17.7 494 787 A L E -JL 316 489G 0 -178,-2.5 -178,-2.9 -2,-0.4 2,-0.5 -0.974 5.4-157.3-121.1 141.5 26.9 -19.2 -20.5 495 788 A V E -JL 315 488G 3 -7,-2.6 -8,-2.6 -2,-0.4 -7,-1.7 -0.979 17.9-178.9-117.3 122.1 29.7 -16.8 -21.3 496 789 A L E -JL 314 486G 0 -182,-3.5 -182,-2.7 -2,-0.5 2,-0.4 -0.702 20.6-141.6-113.4 165.5 31.0 -16.9 -24.9 497 790 A E E +JL 313 485G 0 -12,-2.5 -12,-3.0 -184,-0.2 -184,-0.2 -0.990 26.6 174.3-131.1 121.8 33.7 -15.1 -26.7 498 791 A A E -J 312 0G 0 -186,-2.6 -186,-2.8 -2,-0.4 5,-0.1 -0.927 39.8 -96.1-128.9 148.1 33.1 -14.1 -30.3 499 792 A P E >> -J 311 0G 17 0, 0.0 3,-1.5 0, 0.0 4,-1.1 -0.407 43.1-116.7 -55.4 140.9 35.0 -12.1 -33.0 500 793 A K H >> S+ 0 0 87 -190,-2.3 3,-0.7 1,-0.3 4,-0.5 0.871 114.3 55.8 -51.2 -45.5 33.5 -8.5 -33.0 501 794 A E H 34 S+ 0 0 184 -191,-0.3 -1,-0.3 1,-0.2 4,-0.2 0.764 119.4 31.6 -56.7 -29.0 32.2 -8.9 -36.5 502 795 A R H <> S+ 0 0 119 -3,-1.5 4,-2.8 2,-0.1 -1,-0.2 0.432 89.4 99.9-110.6 -1.9 30.3 -12.1 -35.6 503 796 A A H S+ 0 0 37 -4,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.900 111.9 51.3 -62.9 -42.6 25.1 -13.2 -35.0 506 799 A V H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.906 107.4 52.9 -62.2 -43.4 26.5 -15.5 -32.3 507 800 A A H X S+ 0 0 5 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.926 110.5 46.8 -58.9 -46.9 24.4 -14.0 -29.6 508 801 A R H X S+ 0 0 139 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.931 115.1 46.0 -63.3 -45.9 21.2 -14.5 -31.6 509 802 A L H X S+ 0 0 35 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.944 113.5 48.2 -61.4 -50.1 22.0 -18.1 -32.5 510 803 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.875 110.7 52.7 -59.9 -40.5 23.1 -19.0 -28.9 511 804 A K H X S+ 0 0 50 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.932 111.1 46.1 -59.1 -47.8 19.9 -17.5 -27.6 512 805 A E H X S+ 0 0 117 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.873 111.8 51.0 -66.3 -39.0 17.7 -19.5 -30.0 513 806 A V H < S+ 0 0 21 -4,-2.5 4,-0.4 2,-0.2 -1,-0.2 0.939 113.0 45.7 -62.8 -46.6 19.6 -22.8 -29.2 514 807 A M H >< S+ 0 0 0 -4,-2.4 3,-0.6 1,-0.2 4,-0.3 0.883 115.8 45.5 -66.1 -40.2 19.2 -22.3 -25.5 515 808 A E H 3< S+ 0 0 42 -4,-2.4 9,-0.4 1,-0.2 3,-0.2 0.819 118.3 42.8 -71.5 -31.9 15.5 -21.3 -25.8 516 809 A G T 3< S+ 0 0 49 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.308 82.5 107.1 -96.9 7.8 14.7 -24.2 -28.1 517 810 A V S < S- 0 0 8 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.1 0.898 101.2 -13.8 -58.3 -50.5 16.7 -26.9 -26.4 518 811 A Y S S- 0 0 95 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 -0.681 79.5-132.8-157.5 91.6 13.8 -28.9 -24.9 519 812 A P - 0 0 101 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.181 24.7-168.1 -55.4 137.0 10.5 -27.1 -25.0 520 813 A L - 0 0 25 2,-0.7 4,-0.1 0, 0.0 -195,-0.1 -0.419 44.5 -84.8-109.1-171.0 8.4 -27.2 -21.8 521 814 A A S S+ 0 0 49 -2,-0.2 -196,-0.1 -197,-0.1 -197,-0.0 0.596 119.9 44.5 -74.3 -9.9 4.8 -26.3 -20.9 522 815 A V S S- 0 0 4 -198,-0.1 -2,-0.7 -183,-0.0 -185,-0.1 -0.953 101.5 -97.0-129.2 151.9 6.0 -22.7 -20.6 523 816 A P - 0 0 61 0, 0.0 2,-0.5 0, 0.0 -7,-0.1 -0.352 30.8-132.8 -63.8 147.3 8.4 -20.8 -22.9 524 817 A L - 0 0 10 -9,-0.4 2,-0.4 -4,-0.1 -204,-0.1 -0.907 24.4-163.9 -96.0 130.7 12.1 -20.7 -22.0 525 818 A E - 0 0 75 -2,-0.5 -206,-3.3 -206,-0.4 2,-0.4 -0.942 5.2-163.0-118.0 138.3 13.4 -17.2 -22.3 526 819 A V E -K 318 0G 0 -2,-0.4 2,-0.4 -208,-0.3 -208,-0.2 -0.973 9.6-146.7-122.2 128.2 17.1 -16.3 -22.3 527 820 A E E -K 317 0G 128 -210,-2.9 -210,-2.6 -2,-0.4 2,-0.4 -0.782 21.6-168.5 -92.3 138.5 18.5 -12.8 -21.7 528 821 A V E +K 316 0G 53 -2,-0.4 2,-0.3 -212,-0.2 -212,-0.2 -0.984 11.0 177.2-133.4 137.7 21.6 -11.9 -23.7 529 822 A G E -K 315 0G 13 -214,-2.3 -214,-2.2 -2,-0.4 2,-0.4 -0.937 14.3-149.7-132.2 161.3 24.1 -9.1 -23.6 530 823 A I E +K 314 0G 62 -2,-0.3 2,-0.3 6,-0.3 -216,-0.2 -0.994 30.6 138.4-132.3 135.9 27.3 -8.3 -25.4 531 824 A G E -K 313 0G 10 -218,-2.2 -218,-2.8 -2,-0.4 6,-0.1 -0.995 61.3-104.1-168.0 167.1 30.3 -6.4 -24.0 532 825 A E S S+ 0 0 98 -2,-0.3 -225,-2.2 -220,-0.2 2,-0.3 0.643 107.6 26.9 -73.3 -16.3 34.1 -5.9 -23.7 533 826 A D B > S-G 306 0D 21 -227,-0.2 4,-2.5 -220,-0.1 -227,-0.2 -0.960 88.7-104.2-145.4 162.1 33.8 -7.3 -20.1 534 827 A W H > S+ 0 0 3 -229,-2.4 4,-0.9 -232,-0.5 -231,-0.2 0.847 119.1 48.9 -55.0 -41.2 31.6 -9.7 -18.2 535 828 A L H >> S+ 0 0 25 -233,-0.4 3,-0.8 -230,-0.2 4,-0.7 0.946 113.0 46.8 -65.4 -48.6 29.9 -6.9 -16.3 536 829 A S H >4 S+ 0 0 58 1,-0.2 3,-0.7 2,-0.2 -6,-0.3 0.859 108.6 57.2 -59.0 -37.9 29.1 -4.9 -19.4 537 830 A A H 3< S+ 0 0 0 -4,-2.5 -222,-0.4 1,-0.2 -1,-0.2 0.726 105.0 50.3 -69.1 -22.8 27.9 -8.1 -21.1 538 831 A K H << 0 0 82 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.577 360.0 360.0 -93.2 -8.6 25.3 -8.7 -18.4 539 832 A E << 0 0 118 -3,-0.7 -3,-0.1 -4,-0.7 -9,-0.1 0.431 360.0 360.0-105.5 360.0 23.9 -5.2 -18.7