==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 02-JAN-03 1NJZ . COMPND 2 MOLECULE: DNA PRIMER STRAND; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.JOHNSON,L.S.BEESE . 580 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27951.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 415 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 8.4 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 . 3 0.5 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 . 30 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 242 41.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 3.4 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 3 1 2 1 4 1 3 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 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 2 1 2 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 0 143 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -31.7 9.1 5.4 2.7 2 298 A K - 0 0 84 1,-0.1 2,-0.5 0, 0.0 147,-0.0 -0.094 360.0-122.5 -53.0 148.0 10.6 8.2 0.6 3 299 A M - 0 0 29 1,-0.0 2,-0.2 146,-0.0 -1,-0.1 -0.826 23.5-123.7 -98.3 133.2 8.4 11.3 0.1 4 300 A A + 0 0 71 -2,-0.5 2,-0.3 148,-0.0 43,-0.1 -0.501 44.0 145.0 -77.5 140.3 7.7 12.4 -3.5 5 301 A F - 0 0 59 -2,-0.2 2,-0.6 41,-0.1 43,-0.2 -0.973 47.3-105.3-168.6 158.4 8.6 15.8 -4.7 6 302 A T E -a 48 0A 79 41,-2.7 43,-2.5 -2,-0.3 2,-1.3 -0.823 17.9-156.0 -95.8 120.2 9.8 17.8 -7.7 7 303 A L E -a 49 0A 61 -2,-0.6 2,-0.2 41,-0.2 43,-0.1 -0.782 30.6-159.4 -93.5 89.4 13.4 19.0 -7.7 8 304 A A E -a 50 0A 10 41,-1.3 43,-0.5 -2,-1.3 3,-0.1 -0.445 30.5-162.7 -79.1 145.7 12.8 21.9 -10.1 9 305 A D S S+ 0 0 96 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.539 83.9 25.3 -96.6 -13.3 15.5 23.7 -12.1 10 306 A R S S- 0 0 171 48,-0.0 2,-0.3 44,-0.0 -1,-0.1 -0.969 87.2-100.7-147.6 159.8 13.1 26.6 -12.7 11 307 A V - 0 0 23 -2,-0.3 2,-0.3 43,-0.1 49,-0.1 -0.637 35.8-165.2 -85.8 139.0 10.1 28.2 -11.0 12 308 A T > - 0 0 57 -2,-0.3 3,-1.8 1,-0.1 4,-0.1 -0.881 34.5-115.7-124.3 156.1 6.5 27.5 -12.3 13 309 A E G > S+ 0 0 151 -2,-0.3 3,-2.5 1,-0.3 -1,-0.1 0.849 112.4 70.2 -53.8 -35.3 3.1 29.2 -11.8 14 310 A E G 3 S+ 0 0 95 1,-0.3 3,-0.5 2,-0.1 31,-0.3 0.796 95.6 51.9 -53.3 -34.3 2.1 25.9 -10.1 15 311 A M G < S+ 0 0 2 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.306 96.9 70.7 -90.1 12.8 4.4 26.7 -7.2 16 312 A L < + 0 0 14 -3,-2.5 -1,-0.2 -4,-0.1 -2,-0.1 -0.128 64.8 148.0-119.4 37.2 2.9 30.2 -6.7 17 313 A A - 0 0 12 -3,-0.5 3,-0.0 2,-0.1 -3,-0.0 -0.132 61.9-106.9 -63.7 166.5 -0.6 29.3 -5.3 18 314 A D S S+ 0 0 95 1,-0.1 53,-2.4 52,-0.1 2,-0.3 0.361 104.6 39.6 -82.5 7.4 -2.2 31.6 -2.8 19 315 A K E S+b 71 0A 73 51,-0.2 25,-0.5 2,-0.1 2,-0.3 -0.934 72.2 141.2-153.4 130.7 -1.6 29.2 0.1 20 316 A A E -b 72 0A 0 51,-1.6 53,-2.7 -2,-0.3 2,-0.5 -0.989 50.4-111.6-166.0 157.6 1.4 27.1 0.8 21 317 A A E -bC 73 42A 0 21,-3.0 21,-2.1 -2,-0.3 2,-0.4 -0.852 44.2-162.7 -92.4 128.8 3.8 25.7 3.4 22 318 A L E - C 0 41A 1 51,-3.0 2,-0.5 -2,-0.5 53,-0.4 -0.958 16.7-170.1-123.3 136.1 7.1 27.5 2.8 23 319 A V E + C 0 40A 9 17,-2.8 17,-2.3 -2,-0.4 2,-0.5 -0.987 8.0 175.6-125.6 119.8 10.6 26.6 3.9 24 320 A V E - C 0 39A 10 -2,-0.5 2,-0.4 15,-0.2 15,-0.2 -0.901 30.3-146.2-122.0 92.0 13.5 29.0 3.4 25 321 A E E + C 0 38A 18 13,-2.0 12,-2.2 -2,-0.5 13,-0.6 -0.499 26.9 173.9 -76.5 121.0 16.3 27.2 5.2 26 322 A V - 0 0 5 -2,-0.4 10,-0.1 10,-0.2 5,-0.1 -0.948 4.8-177.3-123.2 105.3 19.1 29.0 7.0 27 323 A V + 0 0 9 -2,-0.5 -1,-0.1 8,-0.3 9,-0.1 0.871 53.9 96.7 -72.7 -39.6 21.3 26.5 8.8 28 324 A E S S- 0 0 117 7,-0.3 6,-0.1 1,-0.1 -2,-0.0 -0.284 75.9-134.9 -52.7 131.4 23.6 29.0 10.6 29 325 A E S S+ 0 0 134 1,-0.2 2,-0.9 2,-0.1 -1,-0.1 0.915 100.4 54.2 -56.2 -45.9 22.4 29.6 14.1 30 326 A N S S- 0 0 30 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.830 76.1-168.0 -92.1 108.9 22.8 33.3 13.7 31 327 A Y > + 0 0 2 -2,-0.9 3,-1.6 3,-0.1 2,-0.4 0.419 41.3 125.1 -81.0 2.5 20.8 34.1 10.6 32 328 A H T 3 S- 0 0 5 1,-0.3 51,-0.1 275,-0.1 -2,-0.1 -0.479 96.1 -17.0 -69.3 120.4 22.1 37.7 10.0 33 329 A D T 3 S+ 0 0 95 -2,-0.4 -1,-0.3 49,-0.3 50,-0.1 0.821 107.6 148.6 54.6 31.6 23.5 38.0 6.5 34 330 A A < - 0 0 9 -3,-1.6 -1,-0.2 1,-0.1 -3,-0.1 -0.561 51.3 -91.0 -95.2 160.5 23.6 34.2 6.5 35 331 A P - 0 0 78 0, 0.0 2,-0.7 0, 0.0 -8,-0.3 -0.354 21.5-140.4 -71.2 145.9 23.1 31.8 3.5 36 332 A I - 0 0 11 -10,-0.1 -10,-0.2 1,-0.1 17,-0.1 -0.946 19.4-170.4-103.7 112.3 19.8 30.4 2.5 37 333 A V - 0 0 36 -12,-2.2 2,-0.3 -2,-0.7 -11,-0.1 0.563 57.0 -19.2 -84.7 -8.7 20.7 26.8 1.5 38 334 A G E -C 25 0A 0 -13,-0.6 -13,-2.0 13,-0.1 2,-0.4 -0.927 53.4-131.1 173.7 161.3 17.5 25.7 -0.1 39 335 A I E -CD 24 50A 1 11,-1.9 11,-2.7 -2,-0.3 2,-0.4 -0.978 14.4-171.4-133.4 142.2 13.8 26.3 -0.5 40 336 A A E -CD 23 49A 0 -17,-2.3 -17,-2.8 -2,-0.4 2,-0.4 -0.997 1.5-172.6-135.2 139.5 10.8 24.0 -0.3 41 337 A V E -CD 22 48A 0 7,-2.5 7,-3.3 -2,-0.4 2,-0.4 -0.996 3.3-176.9-132.8 135.1 7.2 24.7 -1.2 42 338 A V E +CD 21 47A 6 -21,-2.1 -21,-3.0 -2,-0.4 2,-0.2 -0.992 21.7 141.6-133.9 124.3 4.2 22.5 -0.6 43 339 A N E > - D 0 46A 5 3,-2.4 3,-1.6 -2,-0.4 -23,-0.1 -0.775 67.8 -67.9-144.1-170.2 0.7 23.5 -1.8 44 340 A E T 3 S+ 0 0 145 -25,-0.5 3,-0.1 1,-0.3 -24,-0.1 0.748 128.4 55.7 -59.9 -22.6 -2.4 22.0 -3.3 45 341 A H T 3 S- 0 0 87 -31,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.590 118.7 -88.9 -87.5 -12.0 -0.5 21.2 -6.5 46 342 A G E < - D 0 43A 27 -3,-1.6 -3,-2.4 -32,-0.1 2,-0.4 -0.950 51.3 -48.5 142.2-162.2 2.3 19.2 -4.9 47 343 A R E - D 0 42A 89 -2,-0.3 -41,-2.7 -5,-0.2 2,-0.3 -0.948 48.0-176.5-119.0 136.2 5.7 19.4 -3.3 48 344 A F E -aD 6 41A 5 -7,-3.3 -7,-2.5 -2,-0.4 2,-0.4 -0.970 18.4-159.4-137.2 149.3 8.7 21.3 -4.7 49 345 A F E -aD 7 40A 2 -43,-2.5 -41,-1.3 -2,-0.3 2,-0.4 -0.995 17.3-172.8-124.0 129.6 12.4 21.9 -3.9 50 346 A L E -aD 8 39A 1 -11,-2.7 -11,-1.9 -2,-0.4 -41,-0.1 -0.968 26.5-122.3-126.4 138.7 14.1 25.0 -5.4 51 347 A R >> - 0 0 56 -43,-0.5 4,-2.4 -2,-0.4 3,-1.0 -0.604 26.9-130.4 -74.6 135.6 17.8 26.0 -5.4 52 348 A P H 3> S+ 0 0 19 0, 0.0 4,-2.6 0, 0.0 5,-0.3 0.873 104.9 58.3 -56.4 -42.0 18.0 29.4 -3.8 53 349 A E H 34 S+ 0 0 128 1,-0.2 4,-0.1 2,-0.2 -2,-0.0 0.801 114.2 42.1 -60.4 -25.1 20.2 31.0 -6.5 54 350 A T H X4 S+ 0 0 42 -3,-1.0 3,-1.2 2,-0.1 4,-0.5 0.958 118.8 39.1 -82.4 -62.3 17.4 30.1 -8.9 55 351 A A H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 7,-0.3 0.890 114.3 52.9 -56.7 -46.8 14.2 31.0 -6.9 56 352 A L T 3< S+ 0 0 27 -4,-2.6 -1,-0.2 1,-0.3 -3,-0.1 0.548 109.6 49.0 -71.6 -7.0 15.6 34.2 -5.4 57 353 A A T < S+ 0 0 76 -3,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.427 89.0 104.1-106.1 -4.9 16.6 35.5 -8.8 58 354 A D <> - 0 0 34 -3,-1.2 4,-2.6 -4,-0.5 5,-0.3 -0.691 62.7-152.7 -83.5 117.8 13.2 34.7 -10.2 59 355 A P H > S+ 0 0 92 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.873 97.3 49.5 -54.3 -41.1 11.0 37.9 -10.6 60 356 A Q H > S+ 0 0 114 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.921 111.4 47.2 -65.8 -46.7 7.9 35.8 -10.2 61 357 A F H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.943 113.0 48.4 -61.4 -49.4 9.1 34.0 -7.0 62 358 A V H X S+ 0 0 44 -4,-2.6 4,-2.0 -7,-0.3 -1,-0.2 0.871 111.3 50.2 -59.9 -38.7 10.2 37.2 -5.3 63 359 A A H X S+ 0 0 64 -4,-1.8 4,-0.7 -5,-0.3 -1,-0.2 0.921 110.7 50.1 -65.7 -42.1 6.9 38.9 -6.1 64 360 A W H >< S+ 0 0 9 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.909 108.0 53.2 -61.6 -43.1 5.1 35.9 -4.7 65 361 A L H 3< S+ 0 0 1 -4,-2.7 27,-2.8 1,-0.2 -1,-0.2 0.903 114.0 43.0 -59.0 -40.4 7.2 36.1 -1.5 66 362 A G H 3< S+ 0 0 25 -4,-2.0 2,-0.8 25,-0.2 -1,-0.2 0.462 88.4 103.2 -87.1 -0.9 6.3 39.8 -1.2 67 363 A D X< - 0 0 56 -3,-0.9 3,-1.7 -4,-0.7 25,-0.1 -0.741 54.2-163.4 -87.3 109.2 2.6 39.4 -2.0 68 364 A E T 3 S+ 0 0 133 -2,-0.8 -1,-0.2 1,-0.3 4,-0.1 0.655 88.1 62.8 -65.1 -16.6 0.6 39.6 1.3 69 365 A T T 3 S+ 0 0 92 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.601 87.4 80.1 -84.3 -10.9 -2.4 38.0 -0.4 70 366 A K S < S- 0 0 56 -3,-1.7 2,-0.3 -6,-0.2 -51,-0.2 -0.865 83.3-145.6 -97.3 104.2 -0.4 34.9 -1.0 71 367 A K E -b 19 0A 82 -53,-2.4 -51,-1.6 -2,-0.9 2,-0.4 -0.525 15.7-167.8 -79.0 134.5 -0.5 33.1 2.3 72 368 A K E -be 20 94A 0 21,-2.1 23,-1.8 -2,-0.3 24,-1.2 -0.946 12.6-152.5-123.8 142.9 2.4 31.1 3.7 73 369 A S E +be 21 96A 0 -53,-2.7 -51,-3.0 -2,-0.4 2,-0.2 -0.946 33.7 156.9-110.9 131.8 2.7 28.6 6.6 74 370 A M E - e 0 97A 3 22,-3.1 24,-3.4 -2,-0.5 2,-0.4 -0.810 43.7-117.1-144.2-177.4 6.1 28.4 8.1 75 371 A F S S- 0 0 34 -53,-0.4 39,-0.1 22,-0.2 22,-0.1 -0.982 98.5 -5.2-129.6 115.8 8.3 27.5 11.1 76 372 A D S >> S- 0 0 31 -2,-0.4 4,-1.1 3,-0.1 3,-0.7 0.988 71.9-179.6 63.4 60.9 10.3 30.4 12.5 77 373 A S H 3> S+ 0 0 9 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.780 74.1 66.4 -63.6 -26.6 9.3 32.9 9.8 78 374 A K H 3> S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.885 97.2 54.1 -62.5 -38.8 11.4 35.6 11.5 79 375 A R H <> S+ 0 0 56 -3,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.932 114.5 40.6 -60.1 -45.5 14.6 33.7 10.7 80 376 A A H X S+ 0 0 3 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.919 113.6 53.6 -70.0 -44.1 13.6 33.6 7.0 81 377 A A H X S+ 0 0 17 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.907 112.9 43.2 -58.2 -44.5 12.3 37.2 7.0 82 378 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -49,-0.3 0.929 112.0 51.5 -69.6 -44.3 15.6 38.5 8.3 83 379 A A H X S+ 0 0 1 -4,-2.1 4,-0.6 -5,-0.3 -1,-0.2 0.877 114.0 46.9 -60.4 -34.6 17.8 36.4 6.1 84 380 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 3,-0.9 0.878 105.0 58.6 -74.9 -37.0 15.7 37.7 3.2 85 381 A K H ><5S+ 0 0 55 -4,-2.2 3,-2.1 1,-0.3 -2,-0.2 0.907 101.8 55.9 -57.2 -42.0 15.9 41.3 4.4 86 382 A W H 3<5S+ 0 0 52 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.775 108.0 48.8 -61.9 -25.2 19.7 41.1 4.2 87 383 A K T <<5S- 0 0 104 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.271 122.1-108.6 -95.7 8.7 19.3 40.0 0.5 88 384 A G T < 5S+ 0 0 72 -3,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.793 78.1 128.7 70.3 28.2 16.9 42.9 -0.2 89 385 A I < - 0 0 19 -5,-2.6 2,-0.4 -8,-0.1 -1,-0.2 -0.965 50.3-139.4-120.7 133.0 13.9 40.7 -0.4 90 386 A E - 0 0 129 -2,-0.4 2,-0.5 -28,-0.1 -23,-0.1 -0.755 8.0-155.7 -95.0 131.5 10.6 41.2 1.4 91 387 A L + 0 0 27 -2,-0.4 2,-0.3 -10,-0.1 -25,-0.2 -0.916 25.4 161.0-105.9 124.7 8.6 38.3 2.9 92 388 A C + 0 0 25 -27,-2.8 -25,-0.2 -2,-0.5 3,-0.1 -0.867 42.4 48.1-135.5 169.2 4.9 39.0 3.4 93 389 A G + 0 0 8 -2,-0.3 -21,-2.1 1,-0.2 2,-0.9 0.587 55.6 157.9 78.6 10.0 1.7 37.0 3.9 94 390 A V E +e 72 0A 38 -23,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.580 6.5 167.9 -70.5 108.1 2.9 34.6 6.7 95 391 A S E + 0 0 42 -23,-1.8 2,-0.3 -2,-0.9 -1,-0.2 0.554 61.6 32.7 -99.0 -10.1 -0.4 33.6 8.2 96 392 A F E -e 73 0A 0 -24,-1.2 -22,-3.1 -3,-0.1 2,-0.6 -0.943 55.4-172.1-151.9 125.7 0.9 30.7 10.4 97 393 A D E > -e 74 0A 2 -2,-0.3 4,-2.1 -24,-0.2 -22,-0.2 -0.934 8.9-162.3-120.3 107.2 4.1 30.1 12.2 98 394 A L H > S+ 0 0 0 -24,-3.4 4,-2.5 -2,-0.6 5,-0.2 0.786 89.0 57.9 -58.3 -32.1 4.4 26.6 13.7 99 395 A L H > S+ 0 0 19 -25,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.958 110.9 42.0 -64.4 -48.0 7.3 27.6 16.0 100 396 A L H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.844 114.0 52.8 -66.5 -34.1 5.1 30.3 17.6 101 397 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.936 111.6 45.0 -66.8 -46.5 2.1 28.0 17.7 102 398 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.921 110.8 54.9 -62.9 -43.9 4.0 25.2 19.4 103 399 A Y H < S+ 0 0 10 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.894 109.9 45.9 -56.2 -44.5 5.5 27.7 21.9 104 400 A L H < S+ 0 0 1 -4,-2.0 370,-0.4 1,-0.2 -1,-0.2 0.879 109.8 53.9 -68.6 -37.1 2.0 29.0 22.9 105 401 A L H < S- 0 0 3 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.874 137.8 -12.0 -66.1 -36.1 0.6 25.5 23.3 106 402 A D >< - 0 0 28 -4,-2.1 3,-1.6 -5,-0.2 5,-0.3 -0.500 55.1-175.2-167.7 91.7 3.4 24.5 25.7 107 403 A P G > S+ 0 0 9 0, 0.0 3,-1.0 0, 0.0 -3,-0.1 0.731 85.3 69.7 -62.5 -19.2 6.5 26.6 26.2 108 404 A A G 3 S+ 0 0 59 1,-0.2 -5,-0.1 208,-0.1 208,-0.1 0.741 81.7 72.2 -71.0 -23.4 7.9 23.9 28.4 109 405 A Q G < S- 0 0 118 -3,-1.6 -1,-0.2 -7,-0.2 3,-0.1 0.752 92.0-142.4 -64.6 -22.4 8.4 21.5 25.4 110 406 A G < - 0 0 47 -3,-1.0 2,-0.2 -4,-0.3 -2,-0.1 0.869 22.4-167.1 62.8 36.9 11.3 23.6 24.2 111 407 A V + 0 0 13 -5,-0.3 -1,-0.2 1,-0.2 3,-0.1 -0.410 23.4 158.4 -60.4 119.2 10.3 23.1 20.6 112 408 A D + 0 0 123 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.2 0.289 58.9 31.5-126.8 5.2 13.3 24.2 18.4 113 409 A D S > S- 0 0 11 1,-0.1 4,-1.7 -14,-0.1 3,-0.2 -0.973 84.7-101.9-153.9 165.7 12.7 22.4 15.2 114 410 A V H > S+ 0 0 2 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.897 118.2 57.5 -57.2 -41.5 9.8 21.2 13.0 115 411 A A H > S+ 0 0 16 12,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.898 105.7 49.7 -57.4 -42.8 10.3 17.6 14.2 116 412 A A H > S+ 0 0 33 -3,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.871 113.2 46.3 -65.6 -36.9 9.9 18.6 17.8 117 413 A A H >< S+ 0 0 0 -4,-1.7 3,-1.1 1,-0.2 4,-0.3 0.933 111.5 51.7 -70.8 -44.3 6.7 20.5 17.0 118 414 A A H ><>S+ 0 0 0 -4,-3.0 5,-2.2 1,-0.3 3,-2.0 0.849 98.8 64.0 -60.8 -36.5 5.3 17.6 14.9 119 415 A K H ><5S+ 0 0 129 -4,-2.0 3,-1.9 1,-0.3 -1,-0.3 0.812 88.8 70.8 -59.9 -26.5 5.9 15.1 17.7 120 416 A M T <<5S+ 0 0 49 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.758 106.8 37.4 -60.3 -25.2 3.3 17.0 19.7 121 417 A K T < 5S- 0 0 62 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 -0.037 122.1-102.2-117.1 29.3 0.7 15.7 17.3 122 418 A Q T < 5S+ 0 0 156 -3,-1.9 2,-0.6 1,-0.2 -3,-0.2 0.788 77.5 139.7 56.5 30.6 2.1 12.2 16.8 123 419 A Y < + 0 0 47 -5,-2.2 -1,-0.2 -8,-0.1 -2,-0.2 -0.930 14.0 158.0-105.5 119.3 3.5 13.2 13.4 124 420 A E + 0 0 131 -2,-0.6 2,-0.7 -3,-0.1 -1,-0.1 0.198 33.5 112.5-129.1 19.1 7.0 11.7 12.9 125 421 A A S S+ 0 0 43 28,-0.1 2,-0.3 -7,-0.1 32,-0.1 -0.154 71.7 68.8 -85.8 40.9 7.6 11.7 9.2 126 422 A V S S- 0 0 12 -2,-0.7 24,-0.1 -11,-0.1 -8,-0.0 -0.963 78.6-126.5-156.6 139.3 10.3 14.3 9.5 127 423 A R - 0 0 114 -2,-0.3 -12,-0.3 1,-0.1 2,-0.1 -0.572 31.4-103.6 -89.6 152.2 13.8 14.2 11.0 128 424 A P >> - 0 0 61 0, 0.0 4,-1.2 0, 0.0 3,-0.9 -0.489 32.3-118.2 -71.6 147.1 15.1 16.6 13.7 129 425 A D H 3> S+ 0 0 32 1,-0.2 4,-3.2 2,-0.2 5,-0.4 0.849 112.1 60.7 -53.3 -38.2 17.5 19.2 12.2 130 426 A E H 3> S+ 0 0 133 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.864 101.7 52.4 -60.0 -37.4 20.3 18.0 14.4 131 427 A A H <4 S+ 0 0 60 -3,-0.9 -1,-0.2 2,-0.2 -2,-0.2 0.850 117.0 38.6 -68.0 -34.4 20.1 14.5 12.9 132 428 A V H < S+ 0 0 14 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.1 0.939 129.4 28.3 -81.5 -49.6 20.4 16.0 9.4 133 429 A Y H < S- 0 0 6 -4,-3.2 7,-1.4 1,-0.2 -3,-0.2 0.552 98.6-142.5 -90.1 -9.7 22.9 18.8 9.9 134 430 A G < - 0 0 27 -4,-1.9 2,-0.3 -5,-0.4 -1,-0.2 -0.211 24.1 -84.4 74.4-173.1 24.8 17.3 12.9 135 431 A K S > S- 0 0 142 -4,-0.1 3,-1.6 3,-0.0 5,-0.0 -0.914 70.4 -17.0-134.5 160.8 26.0 19.4 15.8 136 432 A G G > S- 0 0 61 -2,-0.3 3,-3.3 1,-0.3 0, 0.0 -0.042 125.7 -1.1 49.5-144.6 29.0 21.6 16.7 137 433 A A G 3 S+ 0 0 119 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.704 137.3 55.0 -48.3 -22.4 32.2 21.3 14.7 138 434 A K G < S+ 0 0 179 -3,-1.6 2,-0.9 2,-0.0 -1,-0.3 0.260 75.6 122.3 -98.7 12.9 30.5 18.6 12.7 139 435 A R < + 0 0 95 -3,-3.3 2,-0.3 -5,-0.2 -5,-0.2 -0.656 36.4 148.8 -81.0 105.5 27.5 20.8 11.7 140 436 A A - 0 0 61 -7,-1.4 -2,-0.0 -2,-0.9 -3,-0.0 -0.911 51.5-102.7-136.1 161.4 27.4 20.8 7.9 141 437 A V - 0 0 67 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.725 42.9-132.2 -84.5 126.7 24.9 21.0 5.0 142 438 A P - 0 0 31 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 -0.091 35.9 -71.1 -71.1 174.8 24.3 17.6 3.4 143 439 A D >> - 0 0 128 1,-0.1 4,-2.8 4,-0.1 3,-0.6 -0.217 55.0 -98.5 -63.0 157.8 24.3 16.8 -0.3 144 440 A E H 3> S+ 0 0 66 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.826 120.9 55.3 -49.7 -41.8 21.4 18.1 -2.3 145 441 A P H 3> S+ 0 0 93 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.926 114.8 38.9 -60.8 -43.3 19.4 14.8 -2.3 146 442 A V H <> S+ 0 0 61 -3,-0.6 4,-1.7 2,-0.2 -2,-0.2 0.892 118.4 48.8 -72.9 -41.0 19.5 14.6 1.5 147 443 A L H X S+ 0 0 9 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.957 110.3 50.6 -62.9 -51.7 18.9 18.3 2.0 148 444 A A H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 5,-0.2 0.873 109.7 49.2 -55.7 -44.7 16.0 18.5 -0.5 149 445 A E H X S+ 0 0 61 -4,-1.5 4,-2.6 -5,-0.3 -1,-0.2 0.905 111.3 51.1 -64.3 -39.5 14.1 15.6 1.1 150 446 A H H X S+ 0 0 3 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.961 111.5 45.6 -62.0 -52.1 14.6 17.1 4.6 151 447 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.866 114.1 49.6 -60.0 -37.9 13.2 20.6 3.5 152 448 A V H X S+ 0 0 1 -4,-2.2 4,-2.7 -5,-0.2 -1,-0.2 0.921 110.3 50.0 -67.8 -43.0 10.3 19.0 1.7 153 449 A R H X S+ 0 0 36 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.863 111.1 49.8 -63.3 -35.1 9.4 16.8 4.7 154 450 A K H X S+ 0 0 10 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.931 112.6 46.2 -68.7 -44.6 9.5 19.9 7.0 155 451 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.885 111.8 52.5 -64.0 -38.1 7.2 21.8 4.6 156 452 A A H X S+ 0 0 7 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.891 108.8 49.5 -65.5 -39.2 4.9 18.8 4.4 157 453 A A H X S+ 0 0 0 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.918 111.4 49.1 -65.7 -43.0 4.7 18.6 8.2 158 454 A I H X S+ 0 0 1 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.940 110.5 50.7 -60.5 -47.6 3.9 22.3 8.4 159 455 A W H < S+ 0 0 92 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.891 117.4 40.4 -56.2 -42.1 1.2 21.9 5.7 160 456 A E H < S+ 0 0 107 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.851 115.4 49.4 -76.9 -37.2 -0.3 18.9 7.6 161 457 A L H X S+ 0 0 3 -4,-3.1 4,-2.5 1,-0.2 5,-0.3 0.637 85.3 85.4 -81.8 -16.8 0.0 20.4 11.1 162 458 A E H X S+ 0 0 20 -4,-1.6 4,-2.9 1,-0.2 5,-0.2 0.940 92.8 44.7 -50.9 -56.3 -1.5 23.8 10.6 163 459 A R H > S+ 0 0 141 -4,-0.4 4,-2.4 -3,-0.2 -1,-0.2 0.924 113.8 48.0 -57.5 -50.2 -5.1 22.8 11.1 164 460 A P H > S+ 0 0 39 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.918 115.4 46.0 -59.1 -42.9 -4.5 20.6 14.2 165 461 A F H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.932 112.6 48.8 -66.5 -45.3 -2.4 23.3 15.9 166 462 A L H X S+ 0 0 31 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.889 109.6 54.7 -61.3 -37.8 -4.9 26.1 15.1 167 463 A D H X S+ 0 0 70 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.911 109.8 44.3 -63.4 -44.2 -7.7 23.9 16.4 168 464 A E H X S+ 0 0 41 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.899 111.3 54.2 -68.8 -38.7 -6.1 23.3 19.8 169 465 A L H <>S+ 0 0 0 -4,-2.3 5,-3.5 1,-0.2 6,-0.6 0.903 108.4 50.3 -59.8 -40.4 -5.1 27.0 20.0 170 466 A R H ><5S+ 0 0 161 -4,-2.2 3,-1.7 4,-0.2 -1,-0.2 0.931 108.7 50.8 -63.6 -44.7 -8.8 27.9 19.5 171 467 A R H 3<5S+ 0 0 166 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.864 111.0 49.4 -59.9 -36.7 -9.9 25.5 22.2 172 468 A N T 3<5S- 0 0 20 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.419 115.5-117.9 -80.9 -1.0 -7.3 27.1 24.6 173 469 A E T < 5S+ 0 0 125 -3,-1.7 -3,-0.2 -4,-0.2 4,-0.1 0.835 85.4 116.8 64.6 33.5 -8.7 30.6 23.6 174 470 A Q >< + 0 0 0 -5,-3.5 4,-1.8 -6,-0.2 -4,-0.2 0.249 33.0 100.6-114.2 8.9 -5.2 31.3 22.2 175 471 A D H > S+ 0 0 48 -6,-0.6 4,-2.6 1,-0.2 5,-0.2 0.937 88.7 43.0 -62.3 -45.8 -6.0 31.8 18.5 176 472 A R H >>S+ 0 0 166 1,-0.2 4,-2.7 2,-0.2 5,-0.8 0.839 107.3 62.7 -68.1 -31.6 -6.0 35.6 18.8 177 473 A L H >>S+ 0 0 7 3,-0.2 5,-2.5 2,-0.2 4,-0.6 0.917 113.0 35.3 -59.6 -41.5 -2.8 35.3 20.9 178 474 A L H <>S+ 0 0 0 -4,-1.8 5,-2.8 3,-0.2 -2,-0.2 0.967 126.2 37.2 -75.0 -54.1 -1.0 33.8 18.0 179 475 A V H <5S+ 0 0 71 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.830 128.0 29.7 -71.2 -36.8 -2.7 35.7 15.1 180 476 A E H <5S+ 0 0 109 -4,-2.7 -3,-0.2 -5,-0.2 -1,-0.2 0.599 133.3 20.9-101.8 -12.9 -3.0 39.2 16.6 181 477 A L T X S+ 0 0 45 0, 0.0 4,-1.3 0, 0.0 3,-0.4 0.905 113.4 52.9 -65.0 -36.4 2.6 40.4 14.1 185 481 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.873 99.6 63.4 -63.8 -36.5 5.2 40.9 16.8 186 482 A S H X S+ 0 0 3 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.887 102.7 48.9 -53.8 -42.5 7.5 38.5 14.9 187 483 A S H X S+ 0 0 69 -4,-1.2 4,-1.5 -3,-0.4 -1,-0.2 0.858 110.5 50.7 -67.2 -36.0 7.6 40.9 11.9 188 484 A I H X S+ 0 0 11 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.907 109.4 49.9 -68.9 -41.7 8.4 43.8 14.2 189 485 A L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.872 106.9 56.0 -64.3 -37.0 11.3 42.0 15.9 190 486 A A H X S+ 0 0 1 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.898 108.7 47.1 -61.4 -41.5 12.6 41.1 12.4 191 487 A E H X S+ 0 0 90 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.894 113.2 49.0 -66.5 -41.5 12.7 44.8 11.5 192 488 A M H X S+ 0 0 5 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.915 113.0 45.8 -64.9 -47.0 14.4 45.6 14.9 193 489 A E H < S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.931 114.3 48.5 -62.4 -46.5 17.1 42.9 14.5 194 490 A F H < S+ 0 0 74 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.881 110.6 50.8 -61.9 -41.0 17.8 43.8 10.9 195 491 A A H < S- 0 0 23 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.908 94.4-175.7 -64.1 -42.3 18.1 47.6 11.7 196 492 A G < - 0 0 4 -4,-2.1 2,-0.4 -5,-0.2 111,-0.2 0.029 28.1 -80.1 70.0 177.0 20.5 46.8 14.5 197 493 A V E -F 306 0B 7 109,-2.1 109,-2.2 -4,-0.1 2,-0.2 -0.983 39.0-121.2-122.3 128.7 22.0 49.3 17.0 198 494 A K E -FG 305 345B 59 147,-0.6 147,-2.2 -2,-0.4 2,-0.4 -0.457 28.5-155.9 -69.1 134.2 25.0 51.5 16.2 199 495 A V E - G 0 344B 2 105,-3.2 2,-1.3 145,-0.2 145,-0.2 -0.929 17.3-138.1-117.8 138.2 28.0 51.0 18.4 200 496 A D > + 0 0 60 143,-3.0 4,-1.9 -2,-0.4 3,-0.2 -0.742 26.0 179.6 -91.4 87.6 30.8 53.5 19.1 201 497 A T H > S+ 0 0 13 -2,-1.3 4,-3.4 1,-0.2 5,-0.2 0.839 76.4 58.1 -61.7 -35.1 33.7 51.0 18.9 202 498 A K H > S+ 0 0 145 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.931 107.0 48.8 -60.5 -44.6 36.3 53.6 19.7 203 499 A R H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.922 114.2 45.9 -60.0 -45.4 34.6 54.4 22.9 204 500 A L H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.935 111.0 51.7 -63.3 -47.7 34.4 50.7 23.8 205 501 A E H X S+ 0 0 86 -4,-3.4 4,-1.1 1,-0.2 -1,-0.2 0.844 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654 A Y E - K 0 568E 2 176,-3.2 2,-0.7 -2,-0.4 3,-0.3 -0.572 30.1-129.9 -74.4 137.2 6.9 51.0 32.6 359 655 A S S S- 0 0 26 208,-3.3 208,-0.4 -2,-0.3 5,-0.1 -0.823 78.8 -27.0 -92.7 112.5 7.0 52.0 36.2 360 656 A Q S > S+ 0 0 70 -2,-0.7 4,-2.0 1,-0.1 -1,-0.2 0.861 78.6 164.7 52.8 45.4 6.3 49.0 38.5 361 657 A I H > S+ 0 0 7 -3,-0.3 4,-2.6 1,-0.2 5,-0.2 0.877 70.2 53.6 -61.1 -36.7 4.3 47.2 35.9 362 658 A E H > S+ 0 0 41 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.915 110.6 45.1 -65.7 -42.2 4.4 43.8 37.7 363 659 A L H > S+ 0 0 4 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.860 113.9 50.7 -68.7 -33.5 3.1 45.2 41.0 364 660 A R H X S+ 0 0 4 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.900 110.1 49.3 -69.2 -40.3 0.4 47.1 39.1 365 661 A V H X S+ 0 0 2 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.928 110.6 51.0 -63.4 -43.2 -0.6 43.9 37.3 366 662 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.919 107.7 52.2 -60.2 -43.1 -0.7 42.1 40.7 367 663 A A H X>S+ 0 0 0 -4,-2.2 4,-1.1 1,-0.2 5,-1.0 0.911 113.4 46.4 -58.3 -42.2 -2.9 44.9 42.1 368 664 A H H <5S+ 0 0 25 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.934 115.8 41.3 -66.0 -51.6 -5.2 44.4 39.1 369 665 A I H <5S+ 0 0 46 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.855 121.4 41.4 -69.4 -34.4 -5.4 40.5 39.1 370 666 A A H <5S- 0 0 11 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.657 95.1-143.5 -86.0 -16.1 -5.7 40.2 42.9 371 667 A E T <5 + 0 0 107 -4,-1.1 2,-0.7 -5,-0.3 -3,-0.2 0.924 30.0 179.1 51.6 47.2 -8.1 43.2 43.1 372 668 A D >< - 0 0 1 -5,-1.0 4,-2.9 -6,-0.2 5,-0.3 -0.734 23.3-151.3 -83.9 116.5 -6.4 44.2 46.4 373 669 A D H > S+ 0 0 129 -2,-0.7 4,-2.2 1,-0.2 5,-0.2 0.903 93.9 46.1 -53.0 -48.6 -8.1 47.4 47.7 374 670 A N H > S+ 0 0 42 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.939 116.1 43.8 -64.3 -47.8 -5.1 48.6 49.5 375 671 A L H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.867 114.2 49.9 -67.5 -36.4 -2.6 48.0 46.7 376 672 A M H X S+ 0 0 9 -4,-2.9 4,-2.1 -9,-0.2 -1,-0.2 0.917 111.0 49.3 -68.1 -41.4 -5.0 49.4 44.0 377 673 A E H X S+ 0 0 73 -4,-2.2 4,-1.6 -5,-0.3 -2,-0.2 0.881 106.6 57.7 -63.0 -38.9 -5.5 52.6 46.0 378 674 A A H <>S+ 0 0 2 -4,-1.9 5,-2.6 1,-0.2 -1,-0.2 0.922 111.5 40.2 -58.4 -45.9 -1.8 52.9 46.4 379 675 A F H ><5S+ 0 0 5 -4,-1.7 3,-1.1 3,-0.2 -1,-0.2 0.809 108.9 60.2 -75.0 -28.4 -1.2 53.0 42.7 380 676 A R H 3<5S+ 0 0 138 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.815 109.9 43.5 -67.4 -27.1 -4.3 55.1 42.1 381 677 A R T 3<5S- 0 0 151 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.357 111.3-129.4 -93.7 2.6 -2.5 57.7 44.3 382 678 A D T < 5 + 0 0 78 -3,-1.1 -3,-0.2 -5,-0.1 -2,-0.1 0.874 46.4 174.9 48.0 44.0 0.7 56.9 42.5 383 679 A L < - 0 0 61 -5,-2.6 2,-1.0 -6,-0.2 -1,-0.1 -0.282 47.1 -93.1 -74.8 162.1 2.4 56.4 45.8 384 680 A D > - 0 0 72 1,-0.2 4,-2.5 2,-0.1 5,-0.2 -0.694 43.4-153.9 -73.9 108.9 6.0 55.3 46.3 385 681 A I H > S+ 0 0 5 -2,-1.0 4,-2.4 1,-0.2 -1,-0.2 0.825 86.6 50.5 -61.2 -33.6 5.0 51.6 46.6 386 682 A H H > S+ 0 0 6 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.929 111.8 46.7 -72.6 -41.6 8.0 50.5 48.7 387 683 A T H > S+ 0 0 21 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.944 114.0 49.8 -62.1 -46.2 7.6 53.3 51.2 388 684 A K H X S+ 0 0 28 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.913 110.3 49.2 -58.9 -44.4 3.9 52.5 51.4 389 685 A T H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.918 110.8 51.2 -62.4 -41.0 4.6 48.8 51.9 390 686 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.923 107.7 52.7 -61.2 -45.3 7.0 49.7 54.7 391 687 A M H X>S+ 0 0 51 -4,-2.6 5,-1.7 1,-0.2 4,-0.5 0.895 114.4 42.6 -57.1 -42.7 4.4 51.9 56.3 392 688 A D H <5S+ 0 0 33 -4,-2.1 3,-0.3 3,-0.2 -2,-0.2 0.944 117.7 40.5 -73.1 -51.1 1.9 49.0 56.4 393 689 A I H <5S+ 0 0 4 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.851 125.2 37.9 -70.2 -30.9 4.1 46.1 57.4 394 690 A F H <5S- 0 0 50 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.459 104.1-130.4 -97.9 -1.2 6.0 48.1 60.0 395 691 A Q T <5 + 0 0 142 -4,-0.5 2,-0.3 -3,-0.3 -3,-0.2 0.958 59.9 124.3 52.6 64.5 2.9 50.1 61.2 396 692 A V < - 0 0 35 -5,-1.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.946 62.0 -99.0-145.9 164.6 4.4 53.6 61.0 397 693 A S > - 0 0 51 -2,-0.3 3,-0.6 1,-0.1 4,-0.5 -0.324 44.7-100.3 -78.6 168.2 3.7 57.0 59.3 398 694 A E G > S+ 0 0 133 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.878 124.7 53.9 -57.6 -39.9 5.5 58.0 56.2 399 695 A D G 3 S+ 0 0 158 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.817 103.8 58.1 -63.7 -30.6 7.9 60.2 58.2 400 696 A E G < S+ 0 0 113 -3,-0.6 2,-0.6 2,-0.1 -1,-0.3 0.528 78.6 107.2 -78.6 -7.6 8.7 57.2 60.3 401 697 A V < - 0 0 26 -3,-1.3 -10,-0.1 -4,-0.5 -14,-0.0 -0.637 57.1-158.8 -77.2 117.4 9.9 55.1 57.4 402 698 A T > - 0 0 68 -2,-0.6 4,-2.2 1,-0.1 3,-0.4 -0.491 31.2-105.2 -90.3 163.4 13.7 54.8 57.6 403 699 A P H > S+ 0 0 117 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.888 122.1 51.3 -56.3 -38.0 16.0 53.9 54.6 404 700 A N H > S+ 0 0 81 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.850 107.4 52.9 -68.9 -33.5 16.5 50.4 56.0 405 701 A M H > S+ 0 0 31 -3,-0.4 4,-2.4 2,-0.2 5,-0.2 0.945 110.3 47.1 -64.8 -47.4 12.7 49.9 56.4 406 702 A R H X S+ 0 0 79 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.917 109.5 54.8 -60.0 -44.1 12.1 50.8 52.8 407 703 A R H X S+ 0 0 121 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.900 111.7 43.3 -57.0 -43.0 15.0 48.6 51.6 408 704 A Q H X S+ 0 0 28 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.863 112.8 51.3 -73.7 -33.5 13.4 45.6 53.4 409 705 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.860 108.9 53.3 -68.9 -33.4 9.9 46.4 52.2 410 706 A K H X S+ 0 0 76 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.932 107.6 49.8 -64.5 -45.3 11.3 46.6 48.7 411 707 A A H X S+ 0 0 13 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.833 109.7 52.0 -62.9 -34.1 12.8 43.1 49.1 412 708 A V H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 -1,-0.2 0.918 106.3 53.6 -68.9 -42.1 9.5 41.9 50.3 413 709 A N H X S+ 0 0 1 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.877 109.1 48.7 -60.3 -38.5 7.7 43.3 47.2 414 710 A F H X S+ 0 0 85 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.908 110.6 50.8 -67.8 -41.3 10.2 41.5 44.9 415 711 A G H X S+ 0 0 14 -4,-1.9 4,-1.1 1,-0.2 -2,-0.2 0.934 105.6 56.7 -60.3 -45.6 9.6 38.3 46.8 416 712 A I H < S+ 0 0 0 -4,-2.8 4,-0.4 1,-0.2 3,-0.3 0.867 110.8 43.1 -53.4 -42.1 5.8 38.7 46.5 417 713 A V H < S+ 0 0 5 -4,-1.5 84,-0.2 1,-0.2 -1,-0.2 0.803 114.1 50.2 -76.5 -29.8 6.1 38.9 42.7 418 714 A Y H < S- 0 0 140 -4,-1.9 79,-0.3 -5,-0.1 -1,-0.2 0.549 133.7 -85.5 -83.1 -8.6 8.6 36.0 42.5 419 715 A G < - 0 0 2 -4,-1.1 -3,-0.2 -3,-0.3 -2,-0.2 0.740 54.8-105.5 97.6 87.0 6.3 33.9 44.6 420 716 A I + 0 0 23 -4,-0.4 2,-0.3 -7,-0.1 -4,-0.1 -0.027 42.2 175.5 -46.0 141.0 7.1 34.6 48.2 421 717 A S > - 0 0 32 1,-0.1 4,-2.5 15,-0.0 5,-0.3 -0.931 31.7-142.4-151.3 122.5 9.1 32.1 50.3 422 718 A D H > S+ 0 0 70 -2,-0.3 4,-1.3 1,-0.2 14,-0.2 0.735 106.3 51.9 -59.8 -19.9 10.3 32.8 53.9 423 719 A Y H > S+ 0 0 145 2,-0.2 4,-2.4 3,-0.1 -1,-0.2 0.935 110.8 43.9 -79.9 -50.8 13.5 30.9 52.9 424 720 A G H > S+ 0 0 26 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.805 116.3 48.0 -64.5 -31.1 14.2 32.9 49.8 425 721 A L H X S+ 0 0 6 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.908 109.9 53.0 -74.6 -42.9 13.4 36.2 51.6 426 722 A A H X>S+ 0 0 5 -4,-1.3 5,-2.5 -5,-0.3 4,-0.6 0.932 110.7 46.3 -55.8 -50.7 15.6 35.2 54.6 427 723 A Q H ><5S+ 0 0 121 -4,-2.4 3,-0.6 3,-0.2 -1,-0.2 0.917 113.8 49.6 -59.0 -46.3 18.6 34.5 52.4 428 724 A N H 3<5S+ 0 0 103 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.886 118.6 36.2 -62.5 -43.4 18.1 37.8 50.5 429 725 A L H 3<5S- 0 0 7 -4,-2.7 -1,-0.2 2,-0.1 -2,-0.2 0.372 108.7-122.0 -92.0 4.3 17.8 40.0 53.5 430 726 A N T <<5S+ 0 0 102 -4,-0.6 2,-0.3 -3,-0.6 -3,-0.2 0.959 73.2 117.5 52.2 55.9 20.4 37.9 55.4 431 727 A I < - 0 0 42 -5,-2.5 -1,-0.2 -6,-0.1 -2,-0.1 -0.821 68.9 -77.2-138.8 176.9 17.9 37.2 58.2 432 728 A S > - 0 0 54 -2,-0.3 4,-2.3 -3,-0.1 5,-0.2 -0.317 35.1-117.5 -79.0 164.3 16.3 34.1 59.7 433 729 A R H > S+ 0 0 174 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.965 114.9 51.9 -62.6 -54.6 13.4 32.2 58.2 434 730 A K H > S+ 0 0 166 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.848 111.9 48.1 -52.0 -37.5 11.0 32.8 61.1 435 731 A E H > S+ 0 0 89 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.923 111.7 47.6 -70.6 -44.4 11.8 36.5 60.7 436 732 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.879 111.0 54.0 -62.2 -36.2 11.2 36.5 57.0 437 733 A A H X S+ 0 0 32 -4,-3.3 4,-2.4 1,-0.2 -1,-0.2 0.883 104.7 53.9 -64.4 -39.3 8.0 34.6 57.8 438 734 A E H X S+ 0 0 112 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.902 107.4 50.3 -61.9 -42.6 7.0 37.4 60.1 439 735 A F H X S+ 0 0 38 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.924 111.1 49.7 -60.7 -45.2 7.5 40.0 57.4 440 736 A I H X S+ 0 0 18 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.896 108.9 50.2 -61.5 -44.6 5.4 37.9 55.0 441 737 A E H X S+ 0 0 126 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.885 111.2 50.5 -62.9 -38.1 2.5 37.5 57.5 442 738 A R H X S+ 0 0 44 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.915 107.7 53.3 -65.9 -42.1 2.5 41.2 58.1 443 739 A Y H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.923 108.4 49.3 -59.0 -45.5 2.4 41.9 54.3 444 740 A F H < S+ 0 0 29 -4,-2.2 7,-0.3 1,-0.2 -1,-0.2 0.784 106.0 55.9 -67.6 -27.0 -0.7 39.7 53.9 445 741 A E H < S+ 0 0 121 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.857 113.8 42.3 -71.3 -32.5 -2.5 41.4 56.8 446 742 A S H < S+ 0 0 21 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.811 125.7 33.9 -80.7 -33.0 -2.0 44.6 54.9 447 743 A F >X + 0 0 0 -4,-2.3 4,-1.8 -5,-0.2 3,-0.6 -0.597 65.4 163.4-124.7 71.6 -2.8 43.2 51.5 448 744 A P H 3> S+ 0 0 82 0, 0.0 4,-2.5 0, 0.0 -1,-0.1 0.787 76.6 58.6 -57.1 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-68.5 -42.4 -2.0 27.7 43.6 459 755 A Q H X S+ 0 0 139 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.926 112.6 49.5 -62.0 -45.5 -5.4 26.0 44.0 460 756 A E H X>S+ 0 0 64 -4,-2.8 4,-3.1 1,-0.2 5,-0.6 0.900 107.5 53.6 -61.2 -43.4 -6.3 26.8 40.4 461 757 A A H X5S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 16,-0.2 0.902 111.6 46.3 -59.8 -41.1 -2.9 25.5 39.1 462 758 A K H <5S+ 0 0 134 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.910 116.1 45.8 -68.6 -40.0 -3.6 22.2 40.8 463 759 A Q H <5S+ 0 0 131 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.952 126.7 24.8 -68.1 -53.8 -7.2 22.0 39.5 464 760 A K H <5S- 0 0 91 -4,-3.1 -3,-0.2 2,-0.2 -2,-0.2 0.751 100.5-124.0 -84.6 -26.4 -6.7 22.9 35.9 465 761 A G S < - 0 0 7 4,-1.8 3,-2.4 -2,-0.3 31,-0.1 -0.556 42.1 -88.5-106.9 173.9 -2.0 35.4 31.7 470 766 A L T 3 S+ 0 0 58 29,-0.4 33,-0.1 1,-0.3 30,-0.0 0.840 129.6 41.3 -49.2 -43.6 -4.2 38.4 30.8 471 767 A L T 3 S- 0 0 47 31,-0.1 -1,-0.3 -294,-0.0 -294,-0.1 0.183 126.3 -98.8 -95.4 18.5 -3.9 37.6 27.0 472 768 A H < + 0 0 83 -3,-2.4 -2,-0.1 1,-0.2 2,-0.1 0.691 65.0 158.5 76.3 23.6 -4.3 33.9 27.7 473 769 A R - 0 0 9 -156,-0.1 -4,-1.8 26,-0.1 2,-0.3 -0.462 30.1-145.4 -69.5 154.1 -0.7 32.7 27.5 474 770 A R E -M 468 0F 25 -370,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.937 23.4-172.5-131.5 147.8 -0.4 29.4 29.4 475 771 A R E -M 467 0F 29 -8,-1.9 -8,-1.9 -2,-0.3 2,-0.3 -0.944 19.3-143.2-139.0 116.3 2.1 27.6 31.6 476 772 A Y E -M 466 0F 65 -2,-0.4 -10,-0.3 -10,-0.2 3,-0.1 -0.577 10.8-167.1 -78.9 138.9 1.6 24.0 32.6 477 773 A L > + 0 0 3 -12,-2.3 3,-2.1 -2,-0.3 4,-0.2 -0.535 20.5 160.8-127.7 69.1 2.7 23.1 36.1 478 774 A P G > S+ 0 0 100 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.816 73.9 65.5 -57.0 -31.9 2.7 19.2 36.5 479 775 A D G > S+ 0 0 82 1,-0.3 3,-1.5 2,-0.2 12,-0.2 0.530 74.4 92.6 -68.8 -5.8 5.1 19.5 39.6 480 776 A I G < S+ 0 0 6 -3,-2.1 -1,-0.3 1,-0.3 -18,-0.1 0.719 90.0 43.0 -62.9 -18.8 2.3 21.3 41.5 481 777 A T G < S+ 0 0 72 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.2 0.347 84.4 130.7-108.0 5.7 1.2 17.9 42.8 482 778 A S < - 0 0 29 -3,-1.5 6,-0.1 1,-0.1 -3,-0.0 -0.267 55.4-143.2 -61.3 142.0 4.6 16.5 43.6 483 779 A R S S+ 0 0 212 4,-0.1 2,-0.6 5,-0.1 -1,-0.1 0.426 78.3 97.3 -85.5 1.6 5.1 15.0 47.1 484 780 A N S > S- 0 0 82 1,-0.2 4,-3.0 -5,-0.1 5,-0.3 -0.835 71.3-146.9 -92.2 119.3 8.6 16.4 47.1 485 781 A F H > S+ 0 0 136 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.900 93.8 44.7 -52.6 -51.4 8.5 19.7 49.0 486 782 A N H > S+ 0 0 122 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.924 116.4 45.7 -63.7 -44.3 11.2 21.5 47.1 487 783 A V H > S+ 0 0 52 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.936 116.9 44.9 -64.2 -46.0 9.9 20.4 43.7 488 784 A R H X S+ 0 0 68 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.882 110.7 54.3 -65.7 -39.6 6.3 21.3 44.6 489 785 A S H X S+ 0 0 13 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.896 105.4 52.4 -62.1 -41.8 7.3 24.6 46.2 490 786 A F H X S+ 0 0 110 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.903 109.3 50.8 -61.1 -40.2 9.0 25.7 43.0 491 787 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 -12,-0.2 -1,-0.2 0.881 108.7 51.7 -63.8 -39.8 5.9 24.9 41.0 492 788 A E H X S+ 0 0 56 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.901 109.1 49.3 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140.6 12.1 50.5 17.7 529 825 A L E - 0 0 2 8,-3.0 2,-0.3 1,-0.4 9,-0.2 0.679 61.6 -1.0-116.2 -49.9 15.6 49.3 18.4 530 826 A L E -L 537 0E 5 7,-1.9 7,-2.7 -334,-0.0 -1,-0.4 -0.933 46.5-152.6-143.6 165.4 15.3 47.1 21.5 531 827 A Q E -L 536 0E 4 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.991 7.7-173.3-136.7 134.1 13.0 45.8 24.2 532 828 A V - 0 0 16 3,-2.5 2,-2.5 -2,-0.4 4,-0.1 -0.509 56.8 -85.8-131.0 65.0 14.2 45.0 27.7 533 829 A H S S+ 0 0 57 1,-0.2 -25,-0.2 -2,-0.1 3,-0.0 -0.310 122.7 18.0 71.3 -59.9 11.3 43.3 29.5 534 830 A D S S+ 0 0 62 -2,-2.5 -176,-3.2 -26,-0.1 2,-0.3 0.262 120.3 64.2-125.1 9.3 9.6 46.5 30.8 535 831 A E E -J 357 0E 30 -178,-0.3 -3,-2.5 33,-0.0 2,-0.4 -0.974 58.8-150.5-137.9 151.9 11.2 49.1 28.5 536 832 A L E -JL 356 531E 0 -180,-3.1 -180,-2.7 -2,-0.3 2,-0.5 -0.962 11.6-160.1-119.5 133.5 11.3 50.0 24.9 537 833 A I E +JL 355 530E 4 -7,-2.7 -8,-3.0 -2,-0.4 -7,-1.9 -0.966 17.2 167.8-118.5 129.5 14.2 51.8 23.3 538 834 A L E -JL 354 528E 0 -184,-3.3 -184,-2.6 -2,-0.5 2,-0.3 -0.758 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360.0 18.3 58.8 31.5