==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA REPLICATION 22-JUL-98 1XWL . COMPND 2 MOLECULE: DNA POLYMERASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR J.R.KIEFER,C.MAO,L.S.BEESE . 580 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27612.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 408 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 30 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 241 41.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.9 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 1 3 1 4 3 1 0 0 0 3 0 1 1 1 0 0 0 0 0 0 0 1 0 1 0 1 RESIDUES PER ALPHA HELIX . 0 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 PARALLEL BRIDGES PER LADDER . 0 2 2 0 3 1 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 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 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 1 297 A A 0 0 121 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 80.5 12.5 6.6 3.7 2 298 A K - 0 0 173 2,-0.0 2,-0.4 0, 0.0 147,-0.0 -0.970 360.0-164.7-120.9 127.2 11.9 8.6 0.4 3 299 A M - 0 0 32 -2,-0.5 2,-0.2 146,-0.0 150,-0.1 -0.857 27.9-111.1-107.8 143.5 9.1 11.1 -0.2 4 300 A A + 0 0 71 -2,-0.4 2,-0.3 148,-0.1 43,-0.0 -0.512 48.1 141.9 -81.4 142.3 8.2 12.3 -3.7 5 301 A F - 0 0 56 -2,-0.2 2,-0.6 41,-0.1 43,-0.2 -0.971 50.4-101.1-167.0 161.5 8.8 15.8 -5.0 6 302 A T E -a 48 0A 77 41,-3.3 43,-2.3 -2,-0.3 2,-2.0 -0.822 21.0-149.8 -92.9 119.3 9.9 17.7 -8.1 7 303 A L E -a 49 0A 55 -2,-0.6 43,-0.1 41,-0.2 41,-0.1 -0.591 34.8-153.5 -88.1 73.2 13.5 18.8 -7.9 8 304 A A - 0 0 8 -2,-2.0 43,-0.5 41,-0.6 3,-0.1 -0.049 27.6-166.2 -51.6 145.1 12.5 21.8 -10.0 9 305 A D S S+ 0 0 115 1,-0.3 2,-0.3 41,-0.1 -1,-0.1 0.530 78.1 22.8-109.0 -13.1 15.0 23.6 -12.3 10 306 A R S S- 0 0 161 48,-0.0 2,-0.3 44,-0.0 -1,-0.3 -0.983 89.0 -98.2-150.3 153.5 12.8 26.7 -12.9 11 307 A V - 0 0 6 -2,-0.3 2,-0.3 -3,-0.1 49,-0.1 -0.579 41.4-166.5 -75.4 132.1 9.9 28.4 -11.1 12 308 A T > - 0 0 51 -2,-0.3 3,-1.8 1,-0.1 4,-0.5 -0.861 35.7-111.9-119.7 155.0 6.5 27.4 -12.5 13 309 A E G > S+ 0 0 169 -2,-0.3 3,-0.9 1,-0.3 -1,-0.1 0.738 114.9 69.0 -56.1 -22.3 3.1 28.9 -12.0 14 310 A E G > S+ 0 0 95 1,-0.3 3,-0.7 2,-0.1 -1,-0.3 0.838 95.1 53.1 -64.3 -36.3 2.2 25.7 -10.2 15 311 A M G < S+ 0 0 2 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.573 98.9 67.3 -77.1 -10.1 4.6 26.6 -7.3 16 312 A L G < + 0 0 23 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.1 -0.087 67.4 145.0-105.6 36.0 3.0 30.0 -6.9 17 313 A A < - 0 0 11 -3,-0.7 -3,-0.0 2,-0.1 -2,-0.0 -0.229 62.8-106.8 -66.8 160.9 -0.5 28.9 -5.6 18 314 A D S S+ 0 0 93 52,-0.1 53,-1.8 1,-0.1 2,-0.3 0.230 103.4 41.3 -78.6 13.2 -2.2 31.1 -3.0 19 315 A K E S+b 71 0A 66 51,-0.2 25,-0.5 2,-0.1 2,-0.3 -0.862 71.8 144.0-158.1 124.3 -1.6 28.7 -0.1 20 316 A A E -b 72 0A 0 51,-1.6 53,-2.6 -2,-0.3 2,-0.5 -0.992 48.7-119.0-157.9 160.4 1.6 26.8 0.6 21 317 A A E -bC 73 42A 0 21,-2.6 21,-2.3 -2,-0.3 2,-0.4 -0.898 43.3-162.6 -97.9 131.2 3.9 25.4 3.3 22 318 A L E - C 0 41A 1 51,-3.0 2,-0.5 -2,-0.5 53,-0.3 -0.971 18.0-169.4-125.7 138.1 7.2 27.2 2.6 23 319 A V E + C 0 40A 10 17,-2.5 17,-2.1 -2,-0.4 2,-0.6 -0.989 7.0 176.5-125.2 119.4 10.7 26.3 3.7 24 320 A V E - C 0 39A 10 -2,-0.5 2,-0.4 15,-0.2 15,-0.2 -0.924 30.4-146.0-122.5 96.4 13.6 28.9 3.1 25 321 A E E + C 0 38A 15 13,-2.1 12,-2.3 -2,-0.6 13,-0.6 -0.553 28.3 174.1 -80.9 122.9 16.4 27.1 4.8 26 322 A V - 0 0 6 -2,-0.4 10,-0.1 10,-0.2 5,-0.1 -0.978 5.7-175.9-123.7 110.3 19.2 28.9 6.6 27 323 A V + 0 0 7 -2,-0.5 -1,-0.1 8,-0.4 9,-0.1 0.792 55.1 96.2 -79.1 -31.8 21.5 26.4 8.3 28 324 A E S S- 0 0 103 7,-0.3 6,-0.1 1,-0.1 -2,-0.1 -0.382 75.7-135.6 -61.1 136.9 23.7 28.8 10.1 29 325 A E S S+ 0 0 107 1,-0.2 2,-0.9 107,-0.1 -1,-0.1 0.912 99.8 54.0 -62.2 -43.7 22.5 29.3 13.7 30 326 A N S S- 0 0 39 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.841 75.9-169.5 -93.5 108.2 23.0 33.1 13.4 31 327 A Y > + 0 0 3 -2,-0.9 3,-1.6 3,-0.1 2,-0.4 0.410 39.9 125.2 -81.4 2.3 21.0 33.9 10.3 32 328 A H T 3 S- 0 0 6 1,-0.3 51,-0.1 275,-0.1 -2,-0.1 -0.510 96.3 -16.3 -70.5 118.9 22.1 37.5 9.8 33 329 A D T 3 S+ 0 0 98 -2,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.760 107.8 147.0 59.2 26.6 23.4 38.0 6.3 34 330 A A < - 0 0 10 -3,-1.6 -1,-0.2 1,-0.1 -3,-0.1 -0.552 52.6 -89.2 -94.2 159.6 23.7 34.2 6.2 35 331 A P - 0 0 64 0, 0.0 2,-0.7 0, 0.0 -8,-0.4 -0.283 23.4-140.5 -67.2 144.2 23.2 31.8 3.2 36 332 A I - 0 0 10 -10,-0.1 -10,-0.2 1,-0.1 17,-0.1 -0.945 18.8-169.5-102.9 113.8 19.9 30.4 2.2 37 333 A V - 0 0 31 -12,-2.3 2,-0.3 -2,-0.7 -11,-0.1 0.642 56.3 -21.3 -83.1 -15.1 20.7 26.8 1.2 38 334 A G E -C 25 0A 0 -13,-0.6 -13,-2.1 13,-0.1 2,-0.4 -0.956 52.0-132.1 179.2 165.1 17.5 25.6 -0.4 39 335 A I E -CD 24 50A 0 11,-1.8 11,-3.3 -2,-0.3 2,-0.4 -0.994 13.9-169.5-136.2 139.0 13.8 26.2 -0.7 40 336 A A E -CD 23 49A 0 -17,-2.1 -17,-2.5 -2,-0.4 2,-0.4 -0.983 3.1-170.6-128.5 141.2 10.9 23.7 -0.5 41 337 A V E -CD 22 48A 0 7,-2.6 7,-2.9 -2,-0.4 2,-0.5 -0.998 3.1-175.0-134.0 128.9 7.3 24.4 -1.4 42 338 A V E +CD 21 47A 6 -21,-2.3 -21,-2.6 -2,-0.4 2,-0.2 -0.991 23.0 139.3-126.0 125.1 4.3 22.2 -0.7 43 339 A N E > - D 0 46A 5 3,-2.3 3,-1.7 -2,-0.5 -23,-0.1 -0.813 68.8 -68.1-147.0-172.3 0.9 23.1 -2.0 44 340 A E T 3 S+ 0 0 141 -25,-0.5 3,-0.1 1,-0.3 -24,-0.1 0.669 127.3 55.8 -59.6 -17.5 -2.2 21.6 -3.6 45 341 A H T 3 S- 0 0 86 1,-0.3 2,-0.3 -31,-0.3 -1,-0.3 0.539 117.9 -85.3 -94.2 -8.8 -0.2 20.9 -6.7 46 342 A G E < - D 0 43A 29 -3,-1.7 -3,-2.3 -32,-0.1 2,-0.4 -0.944 52.0 -53.0 142.0-164.3 2.6 18.9 -5.3 47 343 A R E - D 0 42A 90 -2,-0.3 -41,-3.3 -5,-0.2 2,-0.3 -0.973 48.2-177.9-120.3 131.1 6.0 19.1 -3.6 48 344 A F E -aD 6 41A 4 -7,-2.9 -7,-2.6 -2,-0.4 2,-0.4 -0.947 17.7-158.7-131.6 149.1 8.9 21.2 -5.0 49 345 A F E -aD 7 40A 2 -43,-2.3 -41,-0.6 -2,-0.3 2,-0.4 -0.982 17.0-165.6-121.4 136.5 12.5 21.9 -4.1 50 346 A L E - D 0 39A 1 -11,-3.3 -11,-1.8 -2,-0.4 -41,-0.1 -0.982 22.9-123.3-128.7 135.5 14.1 25.0 -5.6 51 347 A R > - 0 0 52 -43,-0.5 4,-2.6 -2,-0.4 3,-0.3 -0.565 27.6-130.1 -71.0 138.5 17.8 25.9 -5.7 52 348 A P H > S+ 0 0 16 0, 0.0 4,-3.1 0, 0.0 5,-0.4 0.931 103.1 55.7 -57.5 -51.4 18.1 29.3 -4.0 53 349 A E H 4 S+ 0 0 128 1,-0.2 4,-0.4 2,-0.2 -2,-0.0 0.847 115.5 41.4 -51.1 -36.7 20.1 31.1 -6.7 54 350 A T H >4 S+ 0 0 48 -3,-0.3 3,-1.0 2,-0.2 4,-0.4 0.983 118.0 42.1 -75.4 -60.8 17.4 30.2 -9.1 55 351 A A H >< S+ 0 0 0 -4,-2.6 3,-1.4 1,-0.3 7,-0.3 0.893 115.3 48.9 -53.3 -49.7 14.3 30.9 -7.0 56 352 A L T 3< S+ 0 0 26 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.633 110.5 51.9 -71.7 -12.0 15.6 34.1 -5.5 57 353 A A T < S+ 0 0 78 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.376 88.7 99.8-100.1 0.1 16.6 35.5 -8.9 58 354 A D <> - 0 0 16 -3,-1.4 4,-2.6 -4,-0.4 5,-0.3 -0.792 63.4-153.3 -92.7 119.5 13.2 34.7 -10.3 59 355 A P H > S+ 0 0 87 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.891 94.8 50.5 -57.5 -43.6 10.9 37.8 -10.5 60 356 A Q H > S+ 0 0 113 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.878 112.5 46.9 -64.3 -37.7 7.7 35.9 -10.3 61 357 A F H > S+ 0 0 0 2,-0.2 4,-2.8 -6,-0.2 -1,-0.2 0.947 112.7 47.8 -68.3 -50.3 8.9 33.9 -7.2 62 358 A V H X S+ 0 0 42 -4,-2.6 4,-2.1 -7,-0.3 -2,-0.2 0.920 112.3 51.5 -57.1 -41.3 10.2 37.0 -5.4 63 359 A A H X S+ 0 0 63 -4,-2.5 4,-0.5 -5,-0.3 -1,-0.3 0.870 109.2 50.0 -63.2 -36.6 6.8 38.7 -6.3 64 360 A W H >< S+ 0 0 7 -4,-1.6 3,-0.9 2,-0.2 6,-0.2 0.916 107.2 54.5 -68.2 -43.1 5.0 35.7 -4.8 65 361 A L H 3< S+ 0 0 1 -4,-2.8 27,-3.4 1,-0.2 -2,-0.2 0.907 113.2 42.3 -56.6 -44.0 7.1 35.9 -1.6 66 362 A G H 3< S+ 0 0 26 -4,-2.1 2,-0.9 25,-0.3 -1,-0.2 0.501 86.7 107.2 -84.7 -3.0 6.1 39.5 -1.1 67 363 A D X< - 0 0 55 -3,-0.9 3,-1.7 -4,-0.5 25,-0.1 -0.671 55.2-160.5 -82.5 107.8 2.5 39.1 -2.0 68 364 A E T 3 S+ 0 0 132 -2,-0.9 -1,-0.2 1,-0.3 -4,-0.0 0.683 88.8 60.7 -58.5 -20.9 0.5 39.4 1.2 69 365 A T T 3 S+ 0 0 89 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.648 85.4 81.4 -84.7 -16.1 -2.4 37.6 -0.4 70 366 A K S < S- 0 0 59 -3,-1.7 2,-0.2 -6,-0.2 -51,-0.2 -0.823 83.6-141.0 -90.1 107.0 -0.4 34.4 -1.1 71 367 A K E -b 19 0A 69 -53,-1.8 -51,-1.6 -2,-0.9 2,-0.4 -0.478 18.3-167.1 -75.2 136.9 -0.6 32.6 2.2 72 368 A K E -be 20 94A 0 21,-2.4 23,-1.4 -2,-0.2 24,-1.3 -0.974 12.7-155.5-126.7 139.2 2.4 30.7 3.6 73 369 A S E +be 21 96A 0 -53,-2.6 -51,-3.0 -2,-0.4 2,-0.2 -0.948 33.0 155.5-110.0 129.4 2.8 28.2 6.4 74 370 A M E - e 0 97A 4 22,-2.7 24,-3.4 -2,-0.5 2,-0.4 -0.812 43.4-118.8-142.1-179.3 6.3 28.1 7.9 75 371 A F S S- 0 0 34 -53,-0.3 39,-0.1 22,-0.3 22,-0.1 -0.979 97.4 -3.5-128.7 117.6 8.4 27.2 10.9 76 372 A D S >> S+ 0 0 34 -2,-0.4 4,-1.0 3,-0.1 3,-0.8 0.982 72.6 178.5 64.7 59.0 10.4 30.1 12.4 77 373 A S H 3> S+ 0 0 13 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.767 72.2 68.0 -65.5 -24.1 9.4 32.6 9.7 78 374 A K H 3> S+ 0 0 10 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.901 97.3 53.4 -62.3 -39.2 11.4 35.3 11.4 79 375 A R H <> S+ 0 0 49 -3,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.923 113.9 41.0 -60.6 -45.2 14.6 33.5 10.5 80 376 A A H X S+ 0 0 3 -4,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.926 113.6 54.3 -69.1 -44.8 13.6 33.3 6.8 81 377 A A H X S+ 0 0 16 -4,-3.2 4,-2.0 2,-0.2 -2,-0.2 0.917 112.3 42.7 -55.0 -49.2 12.3 36.9 6.8 82 378 A V H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -49,-0.2 0.950 111.6 53.3 -64.1 -50.5 15.5 38.3 8.2 83 379 A A H < S+ 0 0 1 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.865 113.7 44.9 -53.3 -37.8 17.7 36.2 5.9 84 380 A L H ><>S+ 0 0 0 -4,-2.3 5,-2.8 2,-0.2 3,-1.4 0.838 105.3 60.2 -76.1 -33.0 15.7 37.5 3.0 85 381 A K H ><5S+ 0 0 55 -4,-2.0 3,-1.7 1,-0.3 -2,-0.2 0.897 101.1 55.8 -60.5 -38.0 15.8 41.1 4.3 86 382 A W T 3<5S+ 0 0 62 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.624 109.3 46.8 -68.5 -13.1 19.6 40.9 4.0 87 383 A K T < 5S- 0 0 102 -3,-1.4 -1,-0.3 2,-0.2 -2,-0.2 0.136 122.1-107.2-110.6 12.0 19.1 40.0 0.3 88 384 A G T < 5S+ 0 0 72 -3,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.828 78.5 128.2 66.5 33.2 16.6 42.8 -0.3 89 385 A I < - 0 0 19 -5,-2.8 2,-0.5 -8,-0.2 -2,-0.2 -0.986 49.1-144.2-125.7 131.8 13.6 40.5 -0.5 90 386 A E - 0 0 131 -2,-0.4 2,-0.6 -28,-0.1 -23,-0.1 -0.784 7.5-152.3 -95.7 129.4 10.4 41.0 1.5 91 387 A L + 0 0 25 -2,-0.5 2,-0.3 -10,-0.1 -25,-0.3 -0.884 25.5 168.1-102.1 124.7 8.5 38.0 2.8 92 388 A C + 0 0 24 -27,-3.4 -25,-0.2 -2,-0.6 3,-0.1 -0.813 43.3 43.8-130.2 171.4 4.8 38.6 3.2 93 389 A G + 0 0 11 -2,-0.3 -21,-2.4 1,-0.2 2,-1.1 0.618 55.5 158.5 72.2 15.3 1.6 36.5 3.8 94 390 A V E +e 72 0A 35 -23,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.602 6.9 168.4 -72.5 104.3 2.9 34.2 6.5 95 391 A S E + 0 0 43 -23,-1.4 2,-0.3 -2,-1.1 -1,-0.2 0.585 61.9 32.1 -94.5 -11.9 -0.4 33.2 8.1 96 392 A F E -e 73 0A 1 -24,-1.3 -22,-2.7 87,-0.1 2,-0.5 -0.954 57.7-171.7-150.3 124.4 0.8 30.3 10.2 97 393 A D E > -e 74 0A 2 -2,-0.3 4,-2.2 -24,-0.2 -22,-0.3 -0.968 11.0-158.7-119.4 111.9 4.1 29.7 11.9 98 394 A L H > S+ 0 0 0 -24,-3.4 4,-2.6 -2,-0.5 5,-0.2 0.823 89.9 57.9 -60.0 -35.1 4.5 26.3 13.4 99 395 A L H > S+ 0 0 21 -25,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.941 111.0 41.0 -63.7 -44.9 7.2 27.3 15.9 100 396 A L H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.857 113.5 53.8 -72.5 -33.3 5.0 30.0 17.5 101 397 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.942 111.8 45.1 -64.5 -44.6 2.0 27.7 17.4 102 398 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.929 110.2 55.6 -63.1 -45.2 4.0 25.0 19.3 103 399 A Y H < S+ 0 0 10 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.882 111.0 43.7 -55.1 -42.5 5.3 27.6 21.7 104 400 A L H < S+ 0 0 2 -4,-2.1 370,-0.4 1,-0.2 -1,-0.2 0.807 110.8 55.0 -75.2 -28.8 1.8 28.7 22.6 105 401 A L H < S- 0 0 3 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.835 136.3 -9.8 -74.3 -32.1 0.5 25.1 22.9 106 402 A D >< - 0 0 36 -4,-2.2 3,-1.6 -5,-0.2 4,-0.4 -0.502 56.9-170.5-168.0 93.4 3.2 24.2 25.4 107 403 A P T 3 S+ 0 0 11 0, 0.0 3,-0.1 0, 0.0 -4,-0.1 0.606 85.7 67.7 -62.3 -11.7 6.1 26.5 26.1 108 404 A A T 3 S+ 0 0 52 1,-0.2 -5,-0.1 208,-0.1 208,-0.1 0.691 79.6 81.0 -81.5 -19.7 7.8 23.7 28.1 109 405 A Q S < S- 0 0 97 -3,-1.6 -1,-0.2 -7,-0.2 3,-0.1 0.922 81.2-144.5 -53.7 -54.7 8.4 21.5 25.0 110 406 A G - 0 0 52 -4,-0.4 -1,-0.1 1,-0.2 6,-0.1 0.570 16.3-160.4 96.5 8.5 11.6 23.2 23.7 111 407 A V + 0 0 18 1,-0.2 -1,-0.2 5,-0.1 -8,-0.1 0.079 18.0 173.2 -28.2 91.8 10.6 22.7 20.0 112 408 A D - 0 0 142 -3,-0.1 2,-0.3 1,-0.1 -1,-0.2 0.812 60.6 -0.7 -78.4 -34.2 14.0 23.1 18.4 113 409 A D S > S- 0 0 13 1,-0.1 4,-1.8 -14,-0.0 5,-0.2 -0.832 84.3 -82.9-146.7-177.9 12.9 22.1 14.9 114 410 A V H > S+ 0 0 3 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.898 124.0 57.9 -59.0 -41.5 10.0 21.0 12.7 115 411 A A H > S+ 0 0 14 12,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.923 105.5 50.0 -56.8 -43.5 10.6 17.4 13.9 116 412 A A H > S+ 0 0 33 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.891 113.0 45.1 -63.1 -41.4 10.1 18.4 17.5 117 413 A A H >< S+ 0 0 0 -4,-1.8 3,-1.2 1,-0.2 4,-0.3 0.904 110.2 54.7 -69.4 -39.5 6.8 20.2 16.8 118 414 A A H ><>S+ 0 0 0 -4,-2.7 3,-2.3 1,-0.3 5,-2.1 0.877 98.3 63.3 -61.7 -38.1 5.6 17.4 14.6 119 415 A K H ><5S+ 0 0 128 -4,-2.0 3,-1.4 1,-0.3 -1,-0.3 0.769 88.4 71.4 -58.9 -23.2 6.2 14.9 17.5 120 416 A M T <<5S+ 0 0 51 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.750 107.5 35.0 -65.4 -21.6 3.6 16.9 19.4 121 417 A K T < 5S- 0 0 55 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.009 121.1 -97.9-121.0 27.7 1.0 15.4 17.1 122 418 A Q T < 5S+ 0 0 166 -3,-1.4 2,-0.7 1,-0.2 -3,-0.2 0.778 77.8 141.6 66.8 23.3 2.3 11.9 16.4 123 419 A Y < + 0 0 45 -5,-2.1 -1,-0.2 1,-0.1 -2,-0.2 -0.888 12.1 156.0-102.0 114.2 3.9 13.0 13.1 124 420 A E + 0 0 139 -2,-0.7 2,-1.1 1,-0.1 -1,-0.1 0.387 35.3 107.6-120.3 6.1 7.2 11.4 12.6 125 421 A A S S+ 0 0 44 -7,-0.1 2,-0.3 28,-0.1 -1,-0.1 -0.033 71.7 72.6 -77.3 37.3 7.9 11.4 8.9 126 422 A V S S- 0 0 14 -2,-1.1 24,-0.1 -3,-0.1 28,-0.0 -0.990 76.8-127.6-149.7 142.0 10.5 14.1 9.2 127 423 A R - 0 0 119 -2,-0.3 -12,-0.3 23,-0.1 2,-0.1 -0.611 30.9-103.7 -92.4 152.3 14.0 14.0 10.6 128 424 A P >> - 0 0 60 0, 0.0 4,-1.3 0, 0.0 3,-0.9 -0.472 30.9-119.2 -70.8 144.8 15.4 16.4 13.2 129 425 A D H 3> S+ 0 0 23 1,-0.3 4,-3.0 2,-0.2 5,-0.5 0.871 112.8 58.4 -53.2 -41.0 17.7 19.1 11.8 130 426 A E H 3> S+ 0 0 98 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.851 101.8 55.6 -59.6 -34.2 20.6 17.9 13.9 131 427 A A H <4 S+ 0 0 59 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.876 115.9 37.0 -65.5 -38.5 20.3 14.5 12.3 132 428 A V H < S+ 0 0 15 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.860 132.0 25.1 -82.7 -38.0 20.7 16.0 8.8 133 429 A Y H < S- 0 0 8 -4,-3.0 7,-2.5 1,-0.2 -3,-0.2 0.795 99.6-129.1 -99.2 -35.5 23.2 18.8 9.5 134 430 A G < - 0 0 20 -4,-1.8 2,-0.3 -5,-0.5 -1,-0.2 -0.517 33.3 -58.3 109.2 179.9 25.1 17.7 12.6 135 431 A K S > S- 0 0 137 -2,-0.2 3,-2.3 -4,-0.1 4,-0.5 -0.801 80.7 -44.3-110.8 148.9 25.9 19.5 15.8 136 432 A G T 3 S+ 0 0 50 -2,-0.3 -107,-0.1 1,-0.3 0, 0.0 -0.161 133.4 10.2 45.3 -96.7 27.7 22.7 16.6 137 433 A A T 3 S+ 0 0 108 -2,-0.4 -1,-0.3 1,-0.2 -3,-0.0 0.815 129.2 55.8 -80.0 -35.8 30.8 22.7 14.4 138 434 A K S < S+ 0 0 176 -3,-2.3 2,-1.0 1,-0.1 -2,-0.2 0.746 71.1 123.9 -70.2 -23.2 29.8 19.7 12.3 139 435 A R + 0 0 58 -4,-0.5 2,-0.4 -5,-0.1 -5,-0.3 -0.110 42.1 157.6 -42.0 82.9 26.5 21.5 11.4 140 436 A A - 0 0 59 -7,-2.5 -2,-0.1 -2,-1.0 -1,-0.0 -0.920 47.4-109.2-121.5 142.2 27.1 21.3 7.6 141 437 A V - 0 0 67 -2,-0.4 2,-0.1 1,-0.1 3,-0.1 -0.431 38.3-139.3 -67.1 138.2 24.8 21.4 4.6 142 438 A P - 0 0 34 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 -0.285 34.6 -65.0 -90.4 179.3 24.5 17.9 2.8 143 439 A D >> - 0 0 128 1,-0.1 4,-2.7 -2,-0.1 3,-0.7 -0.274 56.0-100.4 -65.4 152.6 24.4 17.1 -0.9 144 440 A E H 3> S+ 0 0 74 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.826 119.8 53.5 -42.2 -47.6 21.4 18.3 -2.9 145 441 A P H 3> S+ 0 0 90 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.928 114.9 39.5 -58.6 -45.1 19.6 14.9 -2.8 146 442 A V H <> S+ 0 0 62 -3,-0.7 4,-1.5 2,-0.2 -2,-0.2 0.858 119.6 47.0 -72.1 -35.7 19.7 14.6 1.0 147 443 A L H X S+ 0 0 9 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.939 109.8 53.1 -71.2 -45.7 19.0 18.3 1.5 148 444 A A H X S+ 0 0 0 -4,-3.5 4,-2.0 -5,-0.3 -2,-0.2 0.894 110.0 47.3 -56.7 -44.0 16.2 18.4 -1.0 149 445 A E H X S+ 0 0 25 -4,-1.6 4,-2.5 -5,-0.3 -1,-0.2 0.885 111.1 51.2 -67.8 -39.1 14.3 15.5 0.7 150 446 A H H X S+ 0 0 4 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.951 111.6 45.8 -64.3 -47.7 14.7 17.0 4.2 151 447 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.887 113.8 50.5 -63.0 -37.8 13.4 20.4 3.3 152 448 A V H X S+ 0 0 1 -4,-2.0 4,-2.7 -5,-0.3 -1,-0.2 0.921 110.0 48.4 -67.1 -41.2 10.6 18.8 1.4 153 449 A R H X S+ 0 0 34 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.874 112.0 51.2 -66.1 -34.9 9.7 16.5 4.4 154 450 A K H X S+ 0 0 11 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.947 112.5 45.0 -65.2 -46.9 9.8 19.7 6.6 155 451 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.892 112.7 52.4 -63.3 -37.4 7.5 21.5 4.2 156 452 A A H X S+ 0 0 8 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.917 108.0 50.7 -65.8 -41.6 5.2 18.4 4.1 157 453 A A H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.946 110.4 48.6 -61.9 -46.9 5.0 18.2 7.9 158 454 A I H X S+ 0 0 1 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.926 109.5 53.8 -58.1 -43.9 4.0 21.9 8.2 159 455 A W H < S+ 0 0 87 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.907 115.5 39.4 -57.6 -42.1 1.4 21.4 5.5 160 456 A E H < S+ 0 0 109 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.871 115.8 50.0 -77.0 -38.2 -0.1 18.5 7.5 161 457 A L H X S+ 0 0 3 -4,-3.1 4,-2.2 1,-0.2 5,-0.3 0.644 85.4 85.3 -80.4 -16.5 0.3 20.0 11.0 162 458 A E H X S+ 0 0 25 -4,-1.7 4,-2.6 -5,-0.2 5,-0.2 0.926 92.6 44.1 -51.7 -52.1 -1.3 23.4 10.4 163 459 A R H > S+ 0 0 184 -4,-0.4 4,-2.4 -3,-0.3 -1,-0.2 0.940 113.2 48.1 -63.8 -50.8 -4.9 22.3 11.0 164 460 A P H > S+ 0 0 36 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.894 114.7 48.0 -58.7 -36.4 -4.3 20.1 14.1 165 461 A F H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.943 112.3 47.8 -68.0 -45.8 -2.3 22.9 15.7 166 462 A L H X S+ 0 0 42 -4,-2.6 4,-2.6 -5,-0.3 -1,-0.2 0.853 109.0 55.7 -63.2 -34.5 -4.9 25.6 14.9 167 463 A D H X S+ 0 0 33 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.923 110.3 43.4 -66.1 -41.9 -7.6 23.4 16.2 168 464 A E H X S+ 0 0 39 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.922 112.4 52.8 -70.4 -41.6 -6.0 22.9 19.6 169 465 A L H <>S+ 0 0 0 -4,-2.6 5,-3.1 1,-0.2 6,-0.5 0.945 110.3 49.1 -57.0 -43.5 -5.1 26.6 19.8 170 466 A R H ><5S+ 0 0 131 -4,-2.6 3,-2.0 4,-0.2 -2,-0.2 0.953 109.4 51.1 -59.6 -48.3 -8.8 27.4 19.1 171 467 A R H 3<5S+ 0 0 164 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.906 112.1 48.2 -50.8 -47.6 -9.8 24.9 21.8 172 468 A N T 3<5S- 0 0 17 -4,-2.7 -1,-0.3 -5,-0.1 -2,-0.2 0.434 115.0-118.4 -72.7 -4.8 -7.4 26.7 24.2 173 469 A E T < 5S+ 0 0 129 -3,-2.0 -3,-0.2 -4,-0.4 -2,-0.1 0.907 84.4 117.5 63.8 39.6 -8.8 30.1 23.1 174 470 A Q >< + 0 0 0 -5,-3.1 4,-1.5 -6,-0.2 -4,-0.2 0.165 32.9 102.3-121.1 13.2 -5.3 31.0 21.8 175 471 A D H > S+ 0 0 60 -6,-0.5 4,-2.3 1,-0.2 5,-0.2 0.920 87.9 41.8 -67.5 -39.7 -6.1 31.4 18.2 176 472 A R H >>S+ 0 0 165 1,-0.2 4,-2.9 2,-0.2 5,-0.9 0.839 106.9 63.2 -74.7 -30.8 -6.0 35.2 18.4 177 473 A L H >>S+ 0 0 9 3,-0.2 5,-2.7 1,-0.2 4,-0.6 0.897 112.0 38.1 -58.1 -38.4 -2.9 35.0 20.6 178 474 A L H <>S+ 0 0 0 -4,-1.5 5,-2.7 3,-0.2 -2,-0.2 0.955 124.9 35.8 -76.1 -50.9 -1.1 33.5 17.7 179 475 A V H <5S+ 0 0 74 -4,-2.3 -3,-0.2 1,-0.2 -2,-0.2 0.845 128.1 31.5 -75.0 -36.4 -2.7 35.5 14.8 180 476 A E H <5S+ 0 0 98 -4,-2.9 -3,-0.2 -5,-0.2 -1,-0.2 0.642 132.7 18.9 -99.4 -16.9 -3.0 38.9 16.4 181 477 A L T X S+ 0 0 44 0, 0.0 4,-1.4 0, 0.0 3,-0.2 0.896 113.7 52.2 -57.5 -38.1 2.5 40.2 14.0 185 481 A L H X S+ 0 0 0 -4,-2.3 4,-3.2 1,-0.2 5,-0.2 0.888 100.3 62.0 -64.4 -37.8 5.2 40.7 16.6 186 482 A S H X S+ 0 0 3 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.894 103.9 48.5 -55.3 -42.7 7.5 38.2 14.8 187 483 A S H X S+ 0 0 74 -4,-1.3 4,-1.7 -3,-0.2 -1,-0.2 0.879 111.8 49.6 -64.3 -39.8 7.6 40.5 11.8 188 484 A I H X S+ 0 0 10 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.929 109.5 51.0 -66.8 -44.6 8.3 43.5 14.0 189 485 A L H X S+ 0 0 0 -4,-3.2 4,-3.1 1,-0.2 5,-0.2 0.896 107.6 54.1 -59.3 -38.9 11.2 41.6 15.7 190 486 A A H X S+ 0 0 1 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.910 108.4 48.7 -60.9 -44.1 12.6 40.8 12.3 191 487 A E H X S+ 0 0 72 -4,-1.7 4,-2.9 2,-0.2 -1,-0.2 0.923 112.7 48.7 -60.5 -45.9 12.6 44.5 11.4 192 488 A M H X S+ 0 0 4 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.948 113.1 45.7 -60.0 -53.0 14.3 45.3 14.7 193 489 A E H < S+ 0 0 1 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.905 114.9 48.1 -57.1 -45.0 17.0 42.6 14.3 194 490 A F H < S+ 0 0 71 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.935 109.6 51.9 -63.3 -47.2 17.6 43.6 10.7 195 491 A A H < S- 0 0 25 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.934 95.7-172.6 -55.5 -46.9 17.9 47.3 11.5 196 492 A G < - 0 0 3 -4,-2.5 2,-0.4 -5,-0.2 111,-0.2 -0.096 23.9 -86.7 77.0 176.2 20.4 46.5 14.2 197 493 A V E -F 306 0B 6 109,-2.3 109,-2.0 -4,-0.1 2,-0.1 -0.993 33.7-123.4-131.2 125.9 21.9 48.9 16.7 198 494 A K E -FG 305 345B 67 147,-0.6 147,-2.0 -2,-0.4 2,-0.4 -0.431 25.7-152.1 -68.9 138.3 25.0 51.1 16.1 199 495 A V E - G 0 344B 1 105,-2.7 2,-1.4 145,-0.2 145,-0.2 -0.925 15.0-137.8-116.5 137.3 27.8 50.6 18.6 200 496 A D > - 0 0 61 143,-3.2 4,-2.2 -2,-0.4 3,-0.3 -0.722 26.3-179.7 -90.6 85.8 30.3 53.2 19.5 201 497 A T H > S+ 0 0 11 -2,-1.4 4,-2.5 1,-0.2 -1,-0.2 0.769 76.3 59.3 -63.1 -24.9 33.3 50.8 19.5 202 498 A K H > S+ 0 0 151 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.935 110.2 42.6 -68.6 -43.3 35.7 53.6 20.5 203 499 A R H > S+ 0 0 49 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.864 113.8 51.9 -68.1 -38.7 33.7 54.2 23.7 204 500 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.942 110.1 48.4 -65.0 -46.5 33.3 50.4 24.3 205 501 A E H X S+ 0 0 94 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.840 111.0 51.2 -62.9 -33.1 37.1 49.9 23.9 206 502 A Q H X S+ 0 0 94 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.923 110.3 48.9 -68.8 -42.9 37.7 52.8 26.3 207 503 A M H X S+ 0 0 12 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.888 110.5 51.1 -62.9 -39.4 35.3 51.3 28.9 208 504 A G H X S+ 0 0 8 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.868 107.5 53.7 -65.7 -35.3 37.1 47.9 28.4 209 505 A K H X S+ 0 0 151 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.963 111.3 44.2 -62.0 -52.0 40.4 49.7 29.1 210 506 A E H X S+ 0 0 88 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.869 112.1 55.0 -60.1 -37.8 39.2 51.2 32.3 211 507 A L H X S+ 0 0 5 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.897 106.8 48.5 -63.9 -44.0 37.6 47.8 33.2 212 508 A A H X S+ 0 0 48 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.864 111.8 51.4 -64.7 -35.0 40.9 45.9 32.8 213 509 A E H X S+ 0 0 132 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.897 110.3 48.2 -67.8 -42.2 42.5 48.6 34.9 214 510 A Q H X S+ 0 0 46 -4,-2.4 4,-1.8 1,-0.2 3,-0.4 0.938 111.7 50.0 -64.4 -44.5 39.9 48.2 37.6 215 511 A L H X S+ 0 0 13 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.877 104.2 58.9 -61.9 -38.9 40.3 44.4 37.5 216 512 A G H X S+ 0 0 26 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.883 107.0 48.4 -57.7 -39.0 44.1 44.7 37.8 217 513 A T H X S+ 0 0 82 -4,-1.4 4,-2.8 -3,-0.4 -2,-0.2 0.921 110.7 45.6 -68.5 -51.0 43.6 46.5 41.1 218 514 A V H X S+ 0 0 15 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.859 115.7 51.4 -62.2 -32.8 41.1 44.2 42.9 219 515 A E H X S+ 0 0 53 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.904 109.8 45.8 -69.7 -45.4 43.4 41.4 41.7 220 516 A Q H X S+ 0 0 104 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.907 113.5 53.0 -62.2 -41.3 46.5 42.9 43.1 221 517 A R H X S+ 0 0 96 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.921 107.0 49.7 -57.9 -50.3 44.5 43.6 46.2 222 518 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 6,-0.2 0.927 110.4 51.7 -56.9 -45.2 43.4 40.0 46.5 223 519 A Y H X>S+ 0 0 28 -4,-2.3 4,-1.3 1,-0.2 5,-0.8 0.869 109.5 49.8 -60.1 -38.2 47.1 39.0 46.1 224 520 A E H <5S+ 0 0 133 -4,-2.1 3,-0.3 2,-0.2 -2,-0.2 0.945 112.5 46.1 -67.1 -45.7 48.0 41.3 48.9 225 521 A L H <5S+ 0 0 29 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.760 116.0 46.7 -67.2 -25.8 45.4 40.0 51.2 226 522 A A H <5S- 0 0 0 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.667 104.9-130.4 -88.4 -20.0 46.4 36.4 50.4 227 523 A G T <5S+ 0 0 57 -4,-1.3 2,-0.3 -3,-0.3 -3,-0.2 0.477 80.1 49.9 82.2 2.0 50.0 37.1 50.8 228 524 A Q S - 0 0 77 -2,-0.3 3,-1.7 1,-0.2 7,-0.2 -0.670 37.2-168.1 -79.2 105.3 45.1 31.8 39.9 232 528 A I T 3 S+ 0 0 3 -2,-1.1 -1,-0.2 1,-0.3 6,-0.1 0.757 87.0 56.3 -63.5 -25.1 41.9 33.4 41.3 233 529 A N T 3 S+ 0 0 102 -3,-0.1 -1,-0.3 4,-0.0 3,-0.1 0.384 84.4 92.1 -91.0 3.9 40.0 31.6 38.6 234 530 A S <> - 0 0 19 -3,-1.7 4,-2.6 1,-0.1 5,-0.2 -0.879 64.0-158.5 -97.3 108.2 41.2 28.1 39.7 235 531 A P H > S+ 0 0 86 0, 0.0 4,-2.0 0, 0.0 23,-0.2 0.801 92.9 52.6 -57.3 -28.1 38.6 26.8 42.2 236 532 A K H > S+ 0 0 178 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.935 111.4 43.1 -72.5 -49.1 41.3 24.5 43.5 237 533 A Q H > S+ 0 0 88 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.867 115.3 50.5 -65.4 -35.6 43.9 27.2 44.1 238 534 A L H X S+ 0 0 1 -4,-2.6 4,-2.8 -7,-0.2 5,-0.2 0.930 107.5 52.6 -67.3 -47.4 41.3 29.5 45.6 239 535 A G H X S+ 0 0 1 -4,-2.0 4,-2.4 -5,-0.2 5,-0.3 0.871 108.6 51.4 -57.0 -39.3 40.0 26.9 48.0 240 536 A V H X>S+ 0 0 57 -4,-1.8 5,-2.5 2,-0.2 4,-1.6 0.927 111.2 47.3 -64.8 -43.0 43.5 26.3 49.2 241 537 A I H <>S+ 0 0 2 -4,-1.8 5,-2.9 3,-0.2 6,-0.3 0.961 119.4 38.4 -62.3 -51.6 44.0 30.1 49.8 242 538 A L H <5S+ 0 0 0 -4,-2.8 6,-2.8 3,-0.2 -2,-0.2 0.952 127.7 29.0 -65.6 -53.5 40.8 30.6 51.7 243 539 A F H <5S+ 0 0 7 -4,-2.4 -1,-0.2 4,-0.2 -3,-0.2 0.463 133.8 22.9 -94.3 -1.2 40.5 27.4 53.7 244 540 A E T <5S+ 0 0 90 -4,-1.6 -3,-0.2 -5,-0.3 -4,-0.1 0.634 127.1 36.2-126.1 -56.5 44.1 26.4 54.3 245 541 A K T - 0 0 51 1,-0.1 4,-2.8 4,-0.0 5,-0.2 -0.240 64.2-105.9 -69.1 163.3 30.6 29.1 45.0 262 558 A A H > S+ 0 0 58 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.858 121.1 55.4 -59.4 -36.4 29.1 32.6 45.2 263 559 A D H > S+ 0 0 71 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.917 110.8 42.0 -63.2 -46.3 26.7 31.3 47.9 264 560 A V H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.942 114.5 52.0 -66.3 -47.4 29.5 30.0 50.1 265 561 A L H X S+ 0 0 0 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.865 106.0 53.9 -59.0 -36.8 31.6 33.1 49.5 266 562 A E H < S+ 0 0 108 -4,-2.3 -1,-0.2 1,-0.2 3,-0.2 0.916 112.4 44.5 -63.5 -39.6 28.7 35.4 50.5 267 563 A K H < S+ 0 0 101 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.776 113.2 51.3 -73.4 -26.6 28.4 33.5 53.7 268 564 A L H >X S+ 0 0 0 -4,-2.1 3,-2.5 1,-0.2 4,-0.6 0.641 84.2 95.6 -81.9 -19.1 32.2 33.6 54.2 269 565 A A G >< S+ 0 0 31 -4,-1.3 3,-1.1 1,-0.3 7,-0.3 0.838 76.4 56.1 -41.5 -51.3 32.3 37.3 53.6 270 566 A P G 34 S+ 0 0 112 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.646 100.5 63.0 -62.5 -11.6 32.2 38.3 57.3 271 567 A Y G <4 S+ 0 0 134 -3,-2.5 2,-0.3 1,-0.3 -2,-0.2 0.744 115.2 2.8 -87.5 -23.4 35.3 36.3 58.0 272 568 A H X< - 0 0 54 -3,-1.1 3,-1.1 -4,-0.6 4,-0.5 -0.948 58.6-129.4-163.4 141.5 37.9 38.0 55.9 273 569 A E T 3> S+ 0 0 103 -2,-0.3 4,-1.2 1,-0.3 3,-0.1 0.632 101.9 73.2 -70.6 -12.1 38.0 41.1 53.6 274 570 A I H 3> S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.879 86.7 67.5 -67.9 -32.3 39.6 39.1 50.8 275 571 A V H <> S+ 0 0 0 -3,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.916 99.5 44.3 -54.8 -51.7 36.2 37.5 50.2 276 572 A E H > S+ 0 0 97 -4,-0.5 4,-2.7 -7,-0.3 -1,-0.2 0.891 111.3 56.0 -62.6 -36.9 34.3 40.6 49.0 277 573 A N H X S+ 0 0 30 -4,-1.2 4,-2.8 1,-0.2 -1,-0.2 0.921 108.1 48.0 -59.9 -44.0 37.3 41.4 46.8 278 574 A I H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.919 111.6 49.0 -63.2 -44.4 37.1 38.0 45.1 279 575 A L H X S+ 0 0 10 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.905 113.9 46.8 -62.8 -39.6 33.3 38.3 44.6 280 576 A H H X S+ 0 0 47 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.939 110.3 52.7 -65.4 -47.1 33.8 41.8 43.1 281 577 A Y H X S+ 0 0 32 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.866 108.1 51.2 -55.3 -41.9 36.6 40.5 40.9 282 578 A R H X S+ 0 0 48 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.891 110.9 48.8 -65.7 -39.3 34.4 37.7 39.6 283 579 A Q H X S+ 0 0 90 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.942 112.3 46.5 -64.8 -51.0 31.6 40.2 38.7 284 580 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.890 112.0 53.7 -58.9 -38.3 34.0 42.5 36.9 285 581 A G H X S+ 0 0 22 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.868 108.2 47.8 -65.8 -38.4 35.4 39.5 35.1 286 582 A K H X S+ 0 0 133 -4,-2.0 4,-2.1 2,-0.2 5,-0.4 0.840 110.9 52.2 -70.7 -34.8 32.1 38.3 33.9 287 583 A L H X S+ 0 0 2 -4,-2.2 4,-2.6 2,-0.2 5,-0.4 0.932 110.8 47.5 -65.8 -46.1 31.2 41.9 32.7 288 584 A Q H X>S+ 0 0 48 -4,-2.4 5,-2.8 3,-0.2 4,-1.2 0.912 112.4 49.6 -60.8 -46.3 34.5 42.1 30.7 289 585 A S H <>S+ 0 0 71 -4,-2.1 5,-1.6 3,-0.2 -1,-0.2 0.912 124.8 24.5 -63.4 -46.3 34.0 38.7 29.1 290 586 A T H <5S+ 0 0 64 -4,-2.1 5,-0.4 3,-0.2 -2,-0.2 0.886 131.2 33.5 -92.9 -35.9 30.4 39.1 28.0 291 587 A Y H <5S+ 0 0 11 -4,-2.6 -3,-0.2 -5,-0.4 -2,-0.1 0.471 129.3 26.8-103.0 3.0 30.0 42.9 27.6 292 588 A I T X5S+ 0 0 12 -4,-1.2 4,-2.3 -5,-0.4 5,-0.2 0.579 135.8 23.5-116.1 -68.4 33.4 44.1 26.5 293 589 A E H >> S+ 0 0 0 -5,-0.4 3,-1.7 2,-0.2 4,-0.5 0.964 109.6 51.5 -68.9 -51.3 30.0 42.4 22.6 296 592 A L H >< S+ 0 0 52 -4,-2.3 3,-1.1 1,-0.3 -2,-0.2 0.850 104.6 62.6 -53.4 -33.8 33.0 43.6 20.5 297 593 A K H 3< S+ 0 0 176 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.785 104.6 43.2 -64.1 -31.1 32.9 40.1 19.0 298 594 A V H << S+ 0 0 27 -3,-1.7 9,-0.5 -4,-0.7 2,-0.4 0.350 83.9 113.5-101.0 9.2 29.5 40.5 17.5 299 595 A V S << S- 0 0 15 -3,-1.1 7,-0.2 -4,-0.5 -101,-0.1 -0.664 76.0-115.6 -78.5 128.0 29.8 44.0 16.1 300 596 A R > - 0 0 55 5,-3.3 4,-2.5 -2,-0.4 5,-0.2 -0.494 19.0-137.6 -66.0 126.5 29.8 44.0 12.3 301 597 A P T 4 S+ 0 0 113 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.806 97.5 40.3 -55.6 -32.9 33.2 45.1 11.0 302 598 A D T 4 S+ 0 0 130 1,-0.1 -2,-0.0 3,-0.1 -3,-0.0 0.960 128.3 23.6 -84.1 -55.2 31.7 47.3 8.3 303 599 A T T 4 S- 0 0 55 2,-0.1 -104,-0.2 -105,-0.0 3,-0.1 0.626 89.5-134.6 -86.3 -15.8 28.6 49.0 9.8 304 600 A K < + 0 0 65 -4,-2.5 -105,-2.7 1,-0.3 2,-0.2 0.761 61.7 136.6 63.0 25.5 29.7 48.7 13.5 305 601 A K E -F 198 0B 50 -107,-0.2 -5,-3.3 -5,-0.2 2,-0.4 -0.660 50.5-141.4-101.1 160.4 26.2 47.5 14.2 306 602 A V E -F 197 0B 2 -109,-2.0 -109,-2.3 -2,-0.2 2,-0.6 -0.962 9.1-160.3-120.1 134.6 25.1 44.7 16.3 307 603 A H - 0 0 8 -9,-0.5 -275,-0.1 -2,-0.4 -114,-0.1 -0.875 12.4-160.5-121.4 95.9 22.1 42.5 15.2 308 604 A T - 0 0 5 -2,-0.6 2,-0.5 -116,-0.1 16,-0.2 -0.203 9.9-138.1 -68.7 162.6 20.6 40.7 18.1 309 605 A I E -H 323 0C 18 14,-1.9 14,-2.0 16,-0.2 2,-0.3 -0.996 14.5-147.5-124.4 123.2 18.4 37.6 17.5 310 606 A F E -H 322 0C 3 -2,-0.5 2,-0.8 12,-0.2 12,-0.3 -0.689 4.1-146.0 -87.1 141.4 15.3 37.4 19.7 311 607 A N E > +H 321 0C 70 10,-2.9 10,-0.6 -2,-0.3 3,-0.6 -0.910 20.5 177.3-107.6 102.7 14.1 34.0 20.7 312 608 A Q T 3 S+ 0 0 9 -2,-0.8 -1,-0.1 1,-0.2 10,-0.0 0.563 75.4 51.1 -80.5 -9.8 10.4 34.5 20.7 313 609 A A T 3 S+ 0 0 21 -3,-0.1 -1,-0.2 1,-0.1 -203,-0.1 -0.281 89.4 81.4-124.3 48.8 9.7 30.9 21.6 314 610 A L < + 0 0 91 -3,-0.6 -2,-0.1 5,-0.3 6,-0.1 0.784 67.4 71.8-115.1 -58.9 12.0 30.3 24.7 315 611 A T - 0 0 31 4,-0.6 3,-0.1 -4,-0.4 -1,-0.1 -0.289 60.1-146.4 -69.7 145.5 10.6 31.5 28.0 316 612 A Q S S+ 0 0 56 1,-0.2 -1,-0.1 2,-0.1 -208,-0.1 0.496 100.2 61.3 -86.7 -0.8 7.7 29.7 29.7 317 613 A T S S- 0 0 17 2,-0.1 -1,-0.2 -210,-0.1 188,-0.2 0.754 111.8-115.9 -91.5 -27.8 6.6 33.2 31.0 318 614 A G + 0 0 0 1,-0.4 -2,-0.1 -3,-0.1 2,-0.1 0.292 69.3 137.4 108.7 -7.6 6.0 34.6 27.5 319 615 A R - 0 0 28 1,-0.1 -4,-0.6 -6,-0.0 -1,-0.4 -0.381 58.4-107.3 -70.4 149.4 8.8 37.2 27.9 320 616 A L - 0 0 7 213,-0.2 2,-0.3 -6,-0.1 -8,-0.2 -0.331 32.3-162.3 -73.0 160.9 11.1 37.9 25.0 321 617 A S E -H 311 0C 28 -10,-0.6 -10,-2.9 211,-0.1 2,-0.3 -0.951 5.6-168.3-140.3 154.2 14.7 36.6 25.1 322 618 A S E -H 310 0C 10 -2,-0.3 2,-0.3 -12,-0.3 -12,-0.2 -0.976 3.9-172.5-146.8 161.5 17.6 37.7 23.0 323 619 A T E +H 309 0C 67 -14,-2.0 -14,-1.9 -2,-0.3 3,-0.1 -0.970 50.5 60.1-152.2 161.0 21.1 36.6 22.2 324 620 A E S S+ 0 0 82 -2,-0.3 -17,-0.3 -16,-0.2 -1,-0.1 0.886 134.8 16.9 49.3 60.5 24.3 37.6 20.4 325 621 A P S S- 0 0 10 0, 0.0 2,-1.2 0, 0.0 -16,-0.2 0.496 90.1-157.7 -91.2 159.8 24.4 40.0 22.2 326 622 A N > + 0 0 47 1,-0.2 3,-1.0 -3,-0.1 -3,-0.1 -0.772 17.2 176.7 -94.0 93.2 22.0 39.3 25.1 327 623 A L G > + 0 0 2 -2,-1.2 3,-0.9 1,-0.2 -1,-0.2 0.617 67.7 70.9 -78.4 -8.4 21.3 42.9 26.0 328 624 A Q G 3 S+ 0 0 41 1,-0.2 -1,-0.2 -6,-0.1 -2,-0.1 0.722 93.4 57.4 -79.8 -16.0 18.9 42.1 28.7 329 625 A N G < + 0 0 98 -3,-1.0 -1,-0.2 2,-0.1 -2,-0.1 0.268 66.3 134.0 -97.2 13.2 21.6 40.7 30.9 330 626 A I < - 0 0 4 -3,-0.9 2,-0.7 1,-0.1 7,-0.1 -0.521 68.3-116.1 -62.2 112.8 23.7 43.9 31.0 331 627 A P + 0 0 43 0, 0.0 3,-0.2 0, 0.0 7,-0.2 -0.363 38.1 178.7 -58.5 100.0 24.4 44.0 34.8 332 628 A I S S+ 0 0 68 -2,-0.7 6,-0.1 1,-0.2 -2,-0.1 0.412 74.5 66.4 -86.0 1.5 22.7 47.2 36.0 333 629 A R S S+ 0 0 215 1,-0.0 2,-0.4 4,-0.0 -1,-0.2 0.819 93.3 73.1 -83.9 -35.7 23.7 46.7 39.7 334 630 A L S >> S- 0 0 15 -3,-0.2 4,-2.6 1,-0.1 3,-0.8 -0.679 77.2-148.1 -81.4 124.3 27.3 47.2 38.6 335 631 A E H 3> S+ 0 0 107 -2,-0.4 4,-2.2 1,-0.3 5,-0.2 0.913 105.2 49.6 -56.8 -46.1 28.1 50.9 37.6 336 632 A E H 34 S+ 0 0 55 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.674 111.7 54.5 -66.1 -16.8 30.6 49.6 35.0 337 633 A G H X4 S+ 0 0 0 -3,-0.8 3,-1.1 2,-0.2 4,-0.3 0.923 106.9 44.7 -82.9 -49.4 27.7 47.4 34.0 338 634 A R H >< S+ 0 0 54 -4,-2.6 3,-1.8 1,-0.3 -2,-0.2 0.854 106.2 62.3 -64.9 -34.1 25.1 50.1 33.5 339 635 A K G >< S+ 0 0 60 -4,-2.2 3,-2.9 1,-0.3 4,-0.3 0.702 80.7 81.9 -63.8 -19.9 27.6 52.3 31.6 340 636 A I G X S+ 0 0 2 -3,-1.1 3,-1.6 1,-0.3 -1,-0.3 0.813 80.4 69.9 -54.8 -25.6 27.9 49.6 28.9 341 637 A R G X S+ 0 0 21 -3,-1.8 236,-1.4 -4,-0.3 3,-1.0 0.628 80.2 73.2 -68.4 -13.3 24.7 51.2 27.7 342 638 A Q G < S+ 0 0 23 -3,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.717 84.7 68.2 -72.0 -20.6 26.8 54.2 26.6 343 639 A A G < S+ 0 0 0 -3,-1.6 -143,-3.2 -4,-0.3 2,-0.7 0.604 82.2 83.5 -75.2 -12.0 28.1 52.1 23.7 344 640 A F E < +G 199 0B 2 -3,-1.0 232,-2.2 -145,-0.2 233,-0.2 -0.855 61.5 166.2-100.3 115.1 24.7 52.0 21.9 345 641 A V E -G 198 0B 23 -147,-2.0 -147,-0.6 -2,-0.7 230,-0.2 -0.743 41.9 -75.1-125.7 166.1 24.2 55.1 19.8 346 642 A P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 -0.269 36.5-132.5 -61.7 150.9 21.8 56.3 17.0 347 643 A S S S+ 0 0 33 5,-0.1 2,-0.3 -151,-0.1 -148,-0.1 0.489 83.7 42.5 -85.5 -3.1 22.5 54.9 13.6 348 644 A E S > S- 0 0 101 192,-0.1 3,-1.1 -150,-0.1 192,-0.1 -0.953 93.4 -89.6-140.0 159.7 22.4 58.2 11.7 349 645 A S T 3 S+ 0 0 102 -2,-0.3 3,-0.1 1,-0.3 -2,-0.1 -0.376 111.1 16.7 -65.0 142.3 23.7 61.7 12.2 350 646 A D T 3 S+ 0 0 112 1,-0.2 192,-2.8 191,-0.1 193,-0.3 0.820 99.3 121.6 63.5 30.2 21.3 64.0 14.1 351 647 A W E < -I 541 0D 16 -3,-1.1 2,-0.3 190,-0.3 -1,-0.2 -0.784 44.8-156.1-115.7 163.5 19.3 61.1 15.4 352 648 A L E -I 540 0D 21 188,-2.8 188,-1.9 -2,-0.3 2,-0.5 -0.935 19.3-112.3-137.5 161.7 18.6 60.3 19.1 353 649 A I E -IJ 539 573D 3 220,-2.7 220,-1.8 -2,-0.3 2,-0.5 -0.824 27.5-164.9 -94.5 131.8 17.8 57.2 21.2 354 650 A F E -IJ 538 572D 0 184,-2.2 184,-2.9 -2,-0.5 2,-0.4 -0.977 7.5-175.8-118.4 124.3 14.3 57.3 22.8 355 651 A A E -IJ 537 571D 4 216,-2.7 216,-2.4 -2,-0.5 2,-0.4 -0.985 6.0-175.0-126.9 130.8 13.6 54.8 25.6 356 652 A A E -IJ 536 570D 0 180,-2.3 180,-3.2 -2,-0.4 2,-0.4 -0.982 6.9-170.1-124.3 135.8 10.3 54.3 27.4 357 653 A D E -IJ 535 569D 55 212,-3.2 212,-2.8 -2,-0.4 2,-0.3 -0.982 24.0-125.6-131.7 135.2 9.9 51.9 30.4 358 654 A Y E - J 0 568D 3 176,-2.5 2,-0.6 -2,-0.4 3,-0.5 -0.630 30.7-135.9 -75.2 131.1 6.8 50.6 32.2 359 655 A S S S- 0 0 15 208,-2.7 208,-0.5 -2,-0.3 5,-0.1 -0.821 75.8 -18.4 -95.4 127.2 7.2 51.5 35.9 360 656 A Q S > S+ 0 0 63 -2,-0.6 4,-2.0 1,-0.1 -1,-0.2 0.860 80.4 161.1 51.2 43.4 6.3 48.7 38.3 361 657 A I H > + 0 0 0 -3,-0.5 4,-2.4 1,-0.2 5,-0.2 0.895 69.0 53.0 -62.8 -37.7 4.3 46.9 35.6 362 658 A E H > S+ 0 0 45 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.926 110.9 45.5 -65.3 -41.6 4.4 43.5 37.5 363 659 A L H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.862 112.7 51.1 -67.7 -34.7 3.0 45.0 40.7 364 660 A R H X S+ 0 0 4 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.899 110.5 49.3 -68.2 -39.1 0.3 46.9 38.8 365 661 A V H X S+ 0 0 2 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.936 110.7 50.4 -65.1 -43.8 -0.6 43.7 37.0 366 662 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.4 0.948 108.1 52.8 -58.7 -46.3 -0.8 41.9 40.4 367 663 A A H X>S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 5,-0.9 0.928 113.6 44.4 -53.9 -44.4 -3.0 44.7 41.7 368 664 A H H <5S+ 0 0 26 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.957 117.0 42.7 -65.0 -52.8 -5.4 44.2 38.7 369 665 A I H <5S+ 0 0 42 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.891 121.5 39.7 -62.2 -45.1 -5.4 40.4 38.8 370 666 A A H <5S- 0 0 0 -4,-3.0 -1,-0.2 -5,-0.3 -2,-0.2 0.707 93.7-144.2 -79.2 -19.8 -5.8 40.1 42.6 371 667 A E T <5 + 0 0 92 -4,-1.4 2,-0.7 -5,-0.4 -3,-0.2 0.931 29.8 179.7 52.5 45.2 -8.2 43.1 42.8 372 668 A D >< - 0 0 2 -5,-0.9 4,-2.9 -6,-0.3 5,-0.3 -0.719 23.2-150.4 -82.0 114.4 -6.6 44.0 46.1 373 669 A D H > S+ 0 0 131 -2,-0.7 4,-2.5 1,-0.2 5,-0.2 0.880 94.1 47.2 -50.0 -48.8 -8.3 47.2 47.3 374 670 A N H > S+ 0 0 43 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.909 115.4 43.9 -63.9 -45.1 -5.2 48.4 49.2 375 671 A L H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.896 114.2 49.9 -70.2 -38.4 -2.8 47.9 46.3 376 672 A M H X S+ 0 0 12 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.941 110.7 49.9 -64.3 -46.4 -5.2 49.3 43.7 377 673 A E H X S+ 0 0 80 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.898 107.6 55.3 -59.5 -39.6 -5.8 52.4 45.8 378 674 A A H <>S+ 0 0 1 -4,-1.9 5,-2.7 1,-0.2 3,-0.3 0.930 111.5 42.5 -59.8 -45.3 -2.0 52.9 46.2 379 675 A F H ><5S+ 0 0 4 -4,-1.9 3,-0.8 1,-0.2 -1,-0.2 0.830 109.4 57.7 -71.4 -31.5 -1.5 52.9 42.4 380 676 A R H 3<5S+ 0 0 131 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.780 110.6 44.5 -68.8 -23.6 -4.5 55.1 41.8 381 677 A R T 3<5S- 0 0 155 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.442 110.8-129.3 -93.2 -4.5 -2.8 57.6 44.2 382 678 A D T < 5 + 0 0 83 -3,-0.8 -3,-0.2 -4,-0.2 -2,-0.1 0.865 45.6 174.0 54.2 39.8 0.4 56.9 42.3 383 679 A L < - 0 0 59 -5,-2.7 2,-0.8 -6,-0.2 -1,-0.1 -0.331 47.7 -95.8 -72.0 157.6 2.1 56.4 45.7 384 680 A D > - 0 0 66 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.670 42.4-151.3 -71.1 112.7 5.7 55.2 45.9 385 681 A I H > S+ 0 0 2 -2,-0.8 4,-1.9 1,-0.2 -1,-0.2 0.781 88.3 51.8 -66.1 -27.1 4.8 51.6 46.3 386 682 A H H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 110.8 47.6 -77.0 -35.3 7.8 50.5 48.3 387 683 A T H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.905 112.7 51.2 -69.2 -39.5 7.3 53.4 50.9 388 684 A K H X S+ 0 0 34 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.907 109.2 48.6 -64.3 -43.3 3.6 52.4 51.0 389 685 A T H X S+ 0 0 0 -4,-1.9 4,-3.1 1,-0.2 5,-0.3 0.919 111.0 51.0 -64.4 -41.6 4.4 48.7 51.7 390 686 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 6,-0.3 0.907 108.2 53.1 -60.8 -42.4 6.9 49.7 54.4 391 687 A M H <>S+ 0 0 36 -4,-2.3 5,-1.4 2,-0.2 4,-0.4 0.924 116.3 38.4 -58.7 -45.6 4.2 51.9 56.0 392 688 A D H ><5S+ 0 0 37 -4,-2.1 3,-0.5 3,-0.2 -2,-0.2 0.970 120.4 43.8 -68.4 -55.3 1.8 49.1 56.1 393 689 A I H 3<5S+ 0 0 0 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.833 124.9 32.4 -62.8 -39.0 4.2 46.3 57.0 394 690 A F T 3<5S- 0 0 37 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.399 104.7-127.9-101.8 5.2 6.1 48.1 59.7 395 691 A Q T < 5 + 0 0 141 -3,-0.5 2,-0.3 -4,-0.4 -3,-0.2 0.927 60.4 132.2 49.8 58.4 3.1 50.1 60.8 396 692 A V < - 0 0 31 -5,-1.4 -1,-0.2 -6,-0.3 2,-0.1 -0.873 59.7-102.9-132.0 164.3 4.7 53.6 60.6 397 693 A S > - 0 0 53 -2,-0.3 3,-1.2 1,-0.1 4,-0.4 -0.422 42.7-102.3 -80.2 164.9 3.7 56.9 59.1 398 694 A E G > S+ 0 0 131 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.854 124.6 56.7 -55.8 -36.5 5.2 57.9 55.8 399 695 A D G 3 S+ 0 0 160 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.774 102.8 55.8 -65.7 -28.0 7.5 60.3 57.7 400 696 A E G < S+ 0 0 112 -3,-1.2 2,-0.6 2,-0.1 -1,-0.3 0.480 78.5 111.4 -85.8 -3.8 8.7 57.4 59.8 401 697 A V < - 0 0 27 -3,-1.2 -10,-0.0 -4,-0.4 -14,-0.0 -0.620 53.9-160.1 -76.0 119.0 9.9 55.3 56.8 402 698 A T > - 0 0 65 -2,-0.6 4,-2.3 1,-0.1 5,-0.2 -0.501 31.5-106.9 -93.0 163.9 13.6 55.1 56.8 403 699 A P H > S+ 0 0 115 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.920 122.2 52.0 -56.2 -42.1 15.8 54.2 53.8 404 700 A N H > S+ 0 0 83 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.921 109.2 49.8 -61.6 -41.7 16.5 50.8 55.4 405 701 A M H > S+ 0 0 34 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.876 110.5 49.6 -63.2 -40.3 12.8 50.1 55.8 406 702 A R H X S+ 0 0 76 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.889 109.1 52.5 -66.4 -39.3 12.0 51.1 52.2 407 703 A R H X S+ 0 0 124 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.910 111.9 45.2 -63.1 -42.4 14.8 48.8 50.9 408 704 A Q H X S+ 0 0 28 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.888 112.8 49.8 -70.9 -36.4 13.4 45.9 52.9 409 705 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.861 108.6 54.8 -67.7 -35.4 9.8 46.6 51.8 410 706 A K H X S+ 0 0 82 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.943 108.2 47.9 -61.4 -48.5 11.1 46.8 48.2 411 707 A A H X S+ 0 0 24 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.882 111.5 51.5 -60.0 -38.8 12.6 43.3 48.5 412 708 A V H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.925 107.5 51.3 -64.9 -43.9 9.3 42.1 50.0 413 709 A N H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.944 113.0 45.8 -58.2 -48.6 7.3 43.5 47.1 414 710 A F H X S+ 0 0 114 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.896 112.7 51.9 -61.1 -40.2 9.6 41.8 44.6 415 711 A G H X>S+ 0 0 2 -4,-2.4 5,-2.8 2,-0.2 4,-1.0 0.897 106.9 51.4 -64.1 -41.4 9.4 38.6 46.7 416 712 A I H ><5S+ 0 0 9 -4,-2.7 3,-1.0 1,-0.2 -1,-0.2 0.950 112.9 45.6 -61.4 -47.0 5.6 38.5 46.7 417 713 A V H 3<5S+ 0 0 7 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.856 111.5 53.7 -63.5 -35.6 5.5 39.0 43.0 418 714 A Y H 3<5S- 0 0 112 -4,-2.1 79,-0.3 -5,-0.2 -1,-0.3 0.625 109.5-122.8 -73.4 -15.8 8.2 36.3 42.6 419 715 A G T <<5 - 0 0 9 -4,-1.0 -3,-0.2 -3,-1.0 -2,-0.1 0.840 50.1-177.3 71.3 33.3 6.2 33.8 44.7 420 716 A I < - 0 0 24 -5,-2.8 2,-0.2 -6,-0.1 -1,-0.1 -0.192 21.9-124.0 -65.9 152.7 9.2 33.6 47.0 421 717 A S > - 0 0 62 1,-0.1 4,-2.6 -3,-0.1 5,-0.3 -0.516 26.9-108.6 -92.5 166.1 9.6 31.4 50.0 422 718 A D H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.907 124.8 50.7 -58.9 -37.3 10.3 32.6 53.5 423 719 A Y H > S+ 0 0 157 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.870 109.0 50.1 -67.7 -37.0 13.8 31.0 53.0 424 720 A G H > S+ 0 0 20 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.920 113.1 44.8 -67.8 -43.6 14.2 32.8 49.7 425 721 A L H X S+ 0 0 1 -4,-2.6 4,-3.3 2,-0.2 5,-0.3 0.911 110.1 55.9 -65.0 -42.0 13.4 36.2 51.1 426 722 A A H X>S+ 0 0 8 -4,-2.4 5,-2.1 -5,-0.3 4,-0.9 0.902 109.3 47.6 -56.7 -40.8 15.6 35.4 54.1 427 723 A Q H <5S+ 0 0 114 -4,-1.8 -1,-0.2 3,-0.2 -2,-0.2 0.905 112.3 48.4 -68.9 -40.5 18.4 34.9 51.7 428 724 A N H <5S+ 0 0 107 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.913 120.5 36.4 -65.9 -40.8 17.7 38.0 49.8 429 725 A L H <5S- 0 0 11 -4,-3.3 -1,-0.2 -5,-0.1 -2,-0.2 0.444 105.0-125.9 -91.4 -1.1 17.5 40.2 52.9 430 726 A N T <5S+ 0 0 152 -4,-0.9 2,-0.2 -5,-0.3 -3,-0.2 0.956 71.9 115.4 54.0 51.6 20.2 38.3 54.8 431 727 A I S - 0 0 51 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.399 37.4-113.9 -83.5 164.4 16.5 34.5 59.3 433 729 A R H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.873 117.2 50.7 -62.7 -38.3 13.7 32.4 57.9 434 730 A K H > S+ 0 0 114 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.869 110.7 48.8 -68.5 -37.2 11.4 33.3 60.8 435 731 A E H > S+ 0 0 86 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.917 114.1 45.3 -68.1 -44.1 12.0 37.1 60.4 436 732 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.900 111.2 53.4 -65.2 -41.2 11.4 36.9 56.6 437 733 A A H X S+ 0 0 26 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.887 106.4 53.6 -60.5 -38.5 8.3 34.8 57.2 438 734 A E H X S+ 0 0 67 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.868 106.5 51.8 -62.9 -39.4 7.1 37.5 59.6 439 735 A F H X S+ 0 0 30 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.930 110.9 48.2 -62.3 -46.6 7.5 40.1 56.9 440 736 A I H X S+ 0 0 25 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.862 110.9 50.4 -63.3 -37.0 5.5 38.0 54.4 441 737 A E H X S+ 0 0 110 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.904 110.4 48.3 -68.8 -41.8 2.7 37.5 57.0 442 738 A R H X S+ 0 0 91 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.887 111.0 54.3 -65.2 -35.9 2.5 41.2 57.7 443 739 A Y H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.960 108.8 45.4 -61.6 -51.4 2.4 41.8 53.9 444 740 A F H < S+ 0 0 41 -4,-2.5 7,-0.3 1,-0.2 -1,-0.2 0.762 109.9 56.0 -67.2 -21.8 -0.6 39.4 53.4 445 741 A E H < S+ 0 0 128 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.885 113.6 40.0 -74.3 -37.4 -2.3 41.0 56.4 446 742 A S H < S+ 0 0 31 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.727 124.5 40.0 -80.9 -23.8 -2.0 44.4 54.7 447 743 A F X + 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 3,-0.5 -0.545 65.9 161.9-126.3 69.3 -2.8 43.0 51.3 448 744 A P H > S+ 0 0 80 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.783 75.2 56.8 -57.4 -34.9 -5.6 40.4 51.8 449 745 A G H > S+ 0 0 6 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.899 108.4 47.0 -65.4 -40.3 -6.6 40.4 48.1 450 746 A V H > S+ 0 0 0 -3,-0.5 4,-2.6 2,-0.2 5,-0.2 0.884 111.5 52.4 -66.4 -40.5 -3.1 39.5 47.1 451 747 A K H X S+ 0 0 93 -4,-2.0 4,-2.2 -7,-0.3 5,-0.2 0.956 110.6 46.5 -58.9 -51.0 -3.1 36.8 49.8 452 748 A R H X S+ 0 0 104 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.885 112.3 51.5 -59.7 -39.6 -6.3 35.3 48.5 453 749 A Y H X S+ 0 0 18 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.926 110.1 48.0 -63.9 -45.9 -5.0 35.5 44.9 454 750 A M H X S+ 0 0 9 -4,-2.6 4,-1.1 2,-0.2 -1,-0.2 0.872 115.2 45.5 -64.1 -37.5 -1.8 33.6 45.8 455 751 A E H X S+ 0 0 99 -4,-2.2 4,-1.5 -5,-0.2 3,-0.3 0.966 117.4 43.8 -67.9 -52.3 -3.7 31.0 47.7 456 752 A N H X S+ 0 0 93 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.838 107.2 57.2 -64.2 -37.7 -6.3 30.5 45.0 457 753 A I H X S+ 0 0 12 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.879 105.7 52.2 -65.5 -34.3 -3.9 30.5 42.0 458 754 A V H X S+ 0 0 11 -4,-1.1 4,-1.5 -3,-0.3 -1,-0.2 0.914 111.9 44.8 -68.5 -39.5 -2.0 27.6 43.4 459 755 A Q H X S+ 0 0 97 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.855 111.6 53.2 -73.7 -30.3 -5.1 25.5 43.9 460 756 A E H X S+ 0 0 72 -4,-2.2 4,-3.0 2,-0.2 5,-0.4 0.882 106.4 52.9 -68.6 -36.7 -6.4 26.5 40.4 461 757 A A H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 16,-0.2 0.879 110.8 48.7 -63.2 -36.1 -3.1 25.3 39.0 462 758 A K H < S+ 0 0 111 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.872 114.9 44.2 -70.6 -38.4 -3.8 22.0 40.8 463 759 A Q H < S+ 0 0 148 -4,-2.1 -2,-0.2 1,-0.1 -3,-0.2 0.921 126.5 26.6 -73.8 -47.1 -7.3 21.8 39.5 464 760 A K H < S- 0 0 104 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.724 97.3-123.9 -91.4 -25.4 -6.7 22.7 35.9 465 761 A G S < S+ 0 0 28 -4,-1.8 12,-3.0 -5,-0.4 2,-0.3 0.299 83.2 42.7 96.3 -6.6 -3.1 21.6 35.3 466 762 A Y E -L 476 0E 40 -6,-0.4 2,-0.3 10,-0.3 -2,-0.2 -0.960 68.1-132.4-157.0 170.9 -2.0 25.0 34.2 467 763 A V E -L 475 0E 0 8,-2.0 8,-2.2 -2,-0.3 2,-0.3 -0.888 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-0.470 26.0 156.0-126.7 64.3 2.5 22.6 35.7 478 774 A P G > S+ 0 0 98 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.834 73.3 64.3 -56.6 -32.6 2.8 18.8 35.7 479 775 A D G > S+ 0 0 87 1,-0.2 3,-2.1 -3,-0.2 12,-0.1 0.660 76.7 89.1 -66.2 -15.1 5.4 18.9 38.5 480 776 A I G < S+ 0 0 10 -3,-1.9 -1,-0.2 1,-0.3 -18,-0.1 0.732 84.5 53.1 -58.4 -22.1 2.9 20.4 40.9 481 777 A T G < S+ 0 0 124 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.1 0.507 82.2 123.8 -90.8 -3.5 1.7 16.9 42.1 482 778 A S < - 0 0 34 -3,-2.1 6,-0.1 1,-0.1 -3,-0.0 -0.189 58.9-145.3 -56.4 144.8 5.3 15.8 42.9 483 779 A R S S+ 0 0 229 5,-0.1 2,-0.5 4,-0.1 -1,-0.1 0.563 75.4 101.6 -87.5 -7.4 6.0 14.6 46.4 484 780 A N S > S- 0 0 79 1,-0.2 4,-3.0 2,-0.0 5,-0.3 -0.663 71.7-144.2 -78.3 123.2 9.4 16.1 46.2 485 781 A F H > S+ 0 0 135 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.889 96.0 45.2 -55.0 -47.6 9.3 19.4 48.1 486 782 A N H > S+ 0 0 116 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.914 115.3 47.4 -65.7 -41.8 11.7 21.3 45.8 487 783 A V H > S+ 0 0 49 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.952 116.5 43.0 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27.5 508 804 A I H X S+ 0 0 2 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.898 112.3 50.3 -59.2 -40.3 4.7 44.9 26.3 509 805 A K H X S+ 0 0 3 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.925 111.2 46.8 -65.1 -45.1 4.2 42.8 23.2 510 806 A K H X S+ 0 0 69 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.899 109.8 54.6 -64.1 -39.1 0.9 44.4 22.3 511 807 A A H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.899 106.1 52.3 -61.3 -39.9 2.4 47.8 22.9 512 808 A M H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.926 111.9 45.9 -61.5 -44.3 5.2 47.0 20.4 513 809 A I H X S+ 0 0 31 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.937 115.7 45.1 -63.5 -48.3 2.6 46.1 17.8 514 810 A D H X S+ 0 0 52 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.904 114.2 50.3 -62.6 -40.8 0.4 49.1 18.5 515 811 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 -5,-0.2 5,-0.2 0.905 106.0 53.9 -64.8 -44.9 3.4 51.4 18.5 516 812 A N H X S+ 0 0 25 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.915 114.0 44.1 -55.6 -43.7 4.8 50.1 15.2 517 813 A A H X S+ 0 0 46 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.890 112.8 49.2 -69.2 -43.6 1.4 50.9 13.6 518 814 A R 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3,-0.9 0.892 111.4 52.9 -68.0 -38.9 6.2 64.0 19.0 548 844 A L H 3X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.866 98.1 65.9 -64.4 -34.4 7.6 60.8 20.5 549 845 A C H 3< S+ 0 0 34 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.765 114.4 30.9 -59.1 -25.8 7.4 62.2 24.0 550 846 A R H S+ 0 0 4 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.911 113.7 53.3 -58.0 -40.8 3.8 56.8 26.5 554 850 A E H X S+ 0 0 80 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.946 110.8 44.8 -58.4 -49.7 0.3 57.2 25.2 555 851 A V H X S+ 0 0 9 -4,-2.6 4,-0.8 1,-0.2 -1,-0.2 0.957 116.9 46.1 -59.8 -48.5 0.5 54.0 23.1 556 852 A M H >< S+ 0 0 0 -4,-2.6 3,-0.6 1,-0.2 4,-0.3 0.876 112.4 49.6 -61.6 -40.8 2.2 52.1 26.0 557 853 A E H 3< S+ 0 0 73 -4,-2.9 9,-0.3 -5,-0.2 3,-0.3 0.804 116.8 43.5 -68.9 -29.5 -0.3 53.3 28.6 558 854 A Q H 3< S+ 0 0 119 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.460 79.0 102.9 -97.1 0.6 -3.2 52.3 26.3 559 855 A A S << S- 0 0 4 -4,-0.8 2,-0.3 -3,-0.6 -1,-0.2 0.885 100.5 -0.5 -49.5 -43.6 -2.0 48.9 25.2 560 856 A V S S- 0 0 32 -4,-0.3 2,-0.7 -3,-0.3 6,-0.1 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