==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA, RNA 27-OCT-99 1D9D . COMPND 2 MOLECULE: 5'-D(*TP*CP*GP)-R(AP*(U31)P*(C31))-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.TEPLOVA,S.T.WALLACE,V.TERESHKO,G.MINASOV,A.M.SIMONS, . 601 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27647.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 431 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 9.3 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 . 3 0.5 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 . 32 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 42.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.3 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 2 0 0 4 5 0 0 1 2 2 1 0 1 1 0 0 0 0 0 0 2 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 1 2 0 0 4 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 1 324 A M 0 0 201 0, 0.0 2,-0.6 0, 0.0 147,-0.0 0.000 360.0 360.0 360.0 136.9 65.8 77.6 -18.7 2 325 A I + 0 0 18 3,-0.0 2,-0.1 2,-0.0 171,-0.1 -0.790 360.0 177.7 -87.5 125.0 64.6 74.1 -18.4 3 326 A S - 0 0 43 -2,-0.6 4,-0.5 170,-0.1 3,-0.2 -0.346 47.0 -88.6-110.9-164.0 60.8 74.1 -18.5 4 327 A Y S S+ 0 0 118 1,-0.2 5,-0.1 2,-0.1 -2,-0.0 0.518 118.6 66.6 -86.4 -6.7 58.1 71.4 -18.5 5 328 A D S S+ 0 0 150 1,-0.1 -1,-0.2 3,-0.1 -3,-0.0 0.782 87.0 67.9 -84.0 -28.4 58.3 71.0 -22.2 6 329 A N S S+ 0 0 73 -3,-0.2 2,-0.4 1,-0.1 51,-0.3 0.938 104.9 28.2 -56.6 -55.8 61.9 69.7 -22.4 7 330 A Y S S- 0 0 19 -4,-0.5 51,-0.2 49,-0.1 2,-0.2 -0.871 76.4-122.3-118.4 146.9 61.3 66.3 -20.8 8 331 A V E -a 58 0A 64 49,-1.3 51,-2.1 -2,-0.4 2,-0.6 -0.476 14.4-142.2 -83.2 152.1 58.4 63.9 -20.5 9 332 A T E -a 59 0A 22 49,-0.2 2,-0.6 -2,-0.2 51,-0.2 -0.972 17.1-143.5-114.9 113.2 57.0 62.7 -17.2 10 333 A I + 0 0 0 49,-2.8 63,-0.3 -2,-0.6 3,-0.1 -0.708 35.8 154.4 -84.6 116.5 56.0 59.1 -17.5 11 334 A L + 0 0 64 -2,-0.6 2,-0.4 61,-0.1 -1,-0.2 0.367 55.9 62.5-120.0 -1.9 52.8 58.3 -15.5 12 335 A D S >> S- 0 0 63 1,-0.1 4,-2.2 60,-0.1 3,-0.5 -0.989 73.8-129.6-133.6 142.2 51.5 55.3 -17.3 13 336 A E H 3> S+ 0 0 74 -2,-0.4 4,-3.5 1,-0.2 5,-0.3 0.858 106.3 58.8 -47.6 -50.3 52.7 51.8 -17.9 14 337 A E H 3> S+ 0 0 154 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.914 110.0 43.6 -50.2 -48.0 52.1 51.9 -21.7 15 338 A T H <> S+ 0 0 41 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.911 112.0 53.4 -67.2 -40.6 54.4 54.8 -22.0 16 339 A L H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.950 110.1 48.5 -58.2 -47.9 57.0 53.3 -19.6 17 340 A K H X S+ 0 0 99 -4,-3.5 4,-2.2 1,-0.2 -1,-0.2 0.874 106.0 56.0 -61.2 -37.8 57.0 50.1 -21.8 18 341 A A H X S+ 0 0 55 -4,-2.0 4,-1.4 -5,-0.3 -1,-0.2 0.903 111.6 45.0 -61.5 -38.2 57.4 52.2 -25.0 19 342 A W H X S+ 0 0 20 -4,-2.0 4,-3.2 2,-0.2 5,-0.2 0.884 108.2 55.8 -71.6 -39.5 60.5 53.7 -23.4 20 343 A I H X S+ 0 0 14 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.892 106.8 51.9 -59.6 -38.7 61.8 50.3 -22.2 21 344 A A H X S+ 0 0 41 -4,-2.2 4,-0.7 2,-0.2 -1,-0.2 0.893 112.6 44.4 -65.4 -40.0 61.6 49.1 -25.8 22 345 A K H >X S+ 0 0 83 -4,-1.4 3,-0.9 2,-0.2 4,-0.7 0.921 111.9 51.9 -70.1 -43.6 63.7 52.1 -27.0 23 346 A L H >< S+ 0 0 3 -4,-3.2 3,-0.8 1,-0.3 -2,-0.2 0.872 104.2 59.6 -58.8 -38.3 66.2 51.8 -24.2 24 347 A E H 3< S+ 0 0 118 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.772 111.1 39.3 -64.1 -26.2 66.7 48.1 -25.0 25 348 A K H << S+ 0 0 164 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.459 92.1 107.6-104.7 2.1 67.8 49.0 -28.5 26 349 A A S << S- 0 0 24 -3,-0.8 66,-0.2 -4,-0.7 3,-0.1 -0.504 72.4-130.4 -78.4 145.6 69.9 52.0 -27.6 27 350 A P S S- 0 0 111 0, 0.0 65,-0.4 0, 0.0 2,-0.3 0.909 88.4 -17.3 -60.8 -41.8 73.7 51.7 -27.9 28 351 A V S S- 0 0 27 24,-0.2 2,-0.3 63,-0.1 65,-0.2 -0.939 70.1-162.0-154.2 162.9 74.0 53.2 -24.4 29 352 A F E -b 93 0A 1 63,-1.5 65,-2.2 -2,-0.3 2,-0.3 -0.990 22.7-112.3-154.9 147.7 71.7 55.2 -22.2 30 353 A A E -bC 94 51A 0 21,-2.5 21,-1.5 -2,-0.3 2,-0.4 -0.600 32.8-170.2 -80.4 142.7 71.8 57.5 -19.2 31 354 A F E + C 0 50A 2 63,-2.4 65,-0.3 -2,-0.3 2,-0.3 -0.987 10.9 163.0-133.5 142.3 70.3 56.1 -16.0 32 355 A D E - C 0 49A 20 17,-1.8 17,-2.8 -2,-0.4 2,-0.3 -0.991 18.4-153.2-158.0 151.7 69.6 58.0 -12.7 33 356 A T E - C 0 48A 3 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.879 5.3-151.5-125.2 160.0 67.6 57.6 -9.5 34 357 A E E - C 0 47A 16 13,-2.6 12,-3.2 -2,-0.3 13,-1.7 -0.991 19.2-179.4-130.7 141.3 66.1 60.1 -7.1 35 358 A T E - C 0 45A 17 -2,-0.4 128,-0.6 10,-0.3 10,-0.2 -0.768 39.9-111.8-133.6 177.1 65.5 59.3 -3.4 36 359 A D S S+ 0 0 39 8,-1.5 2,-0.3 -2,-0.2 9,-0.1 0.192 96.4 24.7 -96.2 16.6 64.1 60.9 -0.2 37 360 A S - 0 0 45 7,-0.2 -1,-0.1 1,-0.1 6,-0.1 -0.946 65.6-127.2-173.5 151.7 67.6 60.9 1.5 38 361 A L S S+ 0 0 165 -2,-0.3 2,-0.9 -3,-0.1 -1,-0.1 0.719 86.7 98.0 -76.2 -21.1 71.3 61.0 1.0 39 362 A D > - 0 0 54 1,-0.2 4,-1.5 3,-0.1 3,-0.3 -0.593 63.5-161.1 -73.1 106.9 71.6 58.0 3.3 40 363 A N T 4 S+ 0 0 22 -2,-0.9 -1,-0.2 1,-0.2 3,-0.2 0.884 82.0 50.6 -56.1 -50.1 71.8 55.1 0.8 41 364 A I T 4 S+ 0 0 21 1,-0.2 -1,-0.2 177,-0.1 -2,-0.1 0.817 123.9 29.1 -64.6 -31.3 70.8 52.2 3.1 42 365 A S T 4 S+ 0 0 43 -3,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.482 93.8 114.3-107.5 -3.6 67.7 53.9 4.4 43 366 A A < - 0 0 2 -4,-1.5 2,-0.4 -3,-0.2 -5,-0.0 -0.323 57.8-140.1 -66.7 149.1 66.8 56.0 1.4 44 367 A N - 0 0 66 19,-0.0 -8,-1.5 -2,-0.0 2,-0.3 -0.913 21.4-113.6-111.2 138.0 63.6 55.2 -0.4 45 368 A L E +C 35 0A 0 -2,-0.4 -10,-0.3 -10,-0.2 3,-0.1 -0.555 35.1 174.4 -70.7 131.8 63.5 55.4 -4.2 46 369 A V E - 0 0 1 -12,-3.2 16,-2.8 1,-0.4 17,-2.3 0.663 60.2 -24.3-109.7 -27.3 61.2 58.2 -5.3 47 370 A G E -CD 34 61A 0 -13,-1.7 -13,-2.6 14,-0.2 -1,-0.4 -0.991 49.6-131.4-174.5 169.7 61.8 58.1 -9.0 48 371 A L E -CD 33 60A 0 12,-2.0 12,-3.4 -2,-0.3 2,-0.3 -0.957 15.1-162.3-133.6 152.2 64.0 57.2 -11.9 49 372 A S E -CD 32 59A 0 -17,-2.8 -17,-1.8 -2,-0.3 2,-0.3 -0.954 5.6-173.7-134.4 154.3 65.2 59.0 -15.0 50 373 A F E -CD 31 58A 2 8,-2.0 8,-2.6 -2,-0.3 2,-0.4 -0.970 11.3-161.9-143.3 157.8 66.6 58.0 -18.4 51 374 A A E +CD 30 57A 0 -21,-1.5 -21,-2.5 -2,-0.3 6,-0.2 -0.975 10.1 174.6-142.7 123.5 68.1 59.6 -21.5 52 375 A I E S+ 0 0 24 4,-1.8 -24,-0.2 1,-0.4 5,-0.1 0.628 75.5 8.9-101.7 -19.4 68.4 57.7 -24.7 53 376 A E E > S- D 0 56A 121 3,-1.3 3,-3.1 -27,-0.1 -1,-0.4 -0.979 99.0 -75.8-158.2 149.5 69.6 60.5 -26.9 54 377 A P T 3 S+ 0 0 66 0, 0.0 3,-0.1 0, 0.0 127,-0.1 -0.314 123.5 11.4 -53.7 123.6 70.8 64.1 -26.2 55 378 A G T 3 S+ 0 0 42 1,-0.1 2,-0.6 122,-0.1 125,-0.1 0.384 108.5 98.7 88.9 -5.6 67.6 66.1 -25.5 56 379 A V E < + D 0 53A 49 -3,-3.1 -4,-1.8 124,-0.1 -3,-1.3 -0.888 49.9 131.9-119.3 98.9 65.5 63.0 -25.2 57 380 A A E - D 0 51A 4 -2,-0.6 -49,-1.3 -51,-0.3 2,-0.3 -0.970 33.2-155.1-145.6 160.6 65.0 62.0 -21.6 58 381 A A E -aD 8 50A 0 -8,-2.6 -8,-2.0 -2,-0.3 2,-0.4 -0.961 9.5-145.3-140.6 154.2 62.2 61.0 -19.2 59 382 A Y E -aD 9 49A 0 -51,-2.1 -49,-2.8 -2,-0.3 -10,-0.2 -0.972 9.3-162.6-119.1 135.4 61.4 61.0 -15.5 60 383 A I E - D 0 48A 2 -12,-3.4 -12,-2.0 -2,-0.4 2,-0.3 -0.923 10.1-159.9-119.7 99.8 59.3 58.2 -14.0 61 384 A P E + D 0 47A 0 0, 0.0 12,-0.6 0, 0.0 -14,-0.2 -0.604 23.0 159.6 -79.0 140.1 57.9 59.3 -10.6 62 385 A V + 0 0 13 -16,-2.8 13,-0.5 -2,-0.3 -15,-0.2 0.580 69.1 29.7-132.8 -27.1 56.9 56.4 -8.3 63 386 A A + 0 0 23 -17,-2.3 2,-0.5 11,-0.1 -16,-0.1 -0.038 67.1 136.6-131.0 37.0 56.7 57.7 -4.7 64 387 A H + 0 0 7 -18,-0.2 101,-0.2 1,-0.1 100,-0.1 -0.733 23.1 173.9 -81.1 127.1 55.8 61.4 -4.7 65 388 A D + 0 0 110 99,-1.5 100,-0.1 -2,-0.5 3,-0.1 0.021 20.3 135.8-127.5 31.1 53.3 61.6 -1.9 66 389 A Y S > S- 0 0 64 98,-0.6 3,-2.0 1,-0.2 99,-0.1 -0.250 73.9 -60.9 -72.3 168.2 52.5 65.3 -1.4 67 390 A L T 3 S- 0 0 141 1,-0.3 -1,-0.2 98,-0.1 -2,-0.0 -0.278 123.0 -3.7 -54.0 122.9 48.9 66.4 -0.9 68 391 A D T 3 S+ 0 0 138 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.719 84.4 176.3 64.0 27.3 46.9 65.5 -4.1 69 392 A A < - 0 0 24 -3,-2.0 -1,-0.2 1,-0.1 3,-0.1 -0.380 36.4-106.3 -61.1 136.6 49.9 64.1 -6.0 70 393 A P - 0 0 64 0, 0.0 -6,-0.1 0, 0.0 -1,-0.1 -0.155 46.8 -79.3 -60.9 160.0 48.7 62.7 -9.3 71 394 A D - 0 0 151 -3,-0.1 2,-0.3 1,-0.0 3,-0.0 -0.349 55.1-171.4 -61.1 141.9 48.5 59.0 -9.8 72 395 A Q - 0 0 39 -10,-0.1 -10,-0.1 -3,-0.1 -61,-0.1 -0.906 35.5 -90.3-132.1 158.7 51.9 57.5 -10.6 73 396 A I - 0 0 12 -12,-0.6 -61,-0.1 -63,-0.3 2,-0.0 -0.508 60.4-104.1 -64.5 140.1 53.1 54.0 -11.6 74 397 A S > - 0 0 64 1,-0.1 4,-2.7 -2,-0.1 5,-0.3 -0.350 19.7-120.1 -68.7 151.2 53.8 52.2 -8.3 75 398 A R H > S+ 0 0 69 -13,-0.5 4,-2.4 1,-0.2 5,-0.2 0.931 114.6 48.5 -55.3 -47.6 57.4 51.8 -7.2 76 399 A E H > S+ 0 0 132 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.885 113.8 46.2 -62.3 -38.9 57.0 48.0 -7.2 77 400 A R H > S+ 0 0 65 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.864 112.5 48.7 -73.3 -37.0 55.4 48.0 -10.6 78 401 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.920 112.8 49.4 -68.4 -42.4 57.9 50.3 -12.2 79 402 A L H X S+ 0 0 8 -4,-2.4 4,-2.8 -5,-0.3 -2,-0.2 0.895 108.3 51.1 -64.5 -42.2 60.8 48.3 -10.8 80 403 A E H < S+ 0 0 117 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.858 114.2 45.0 -66.5 -32.0 59.5 44.9 -11.9 81 404 A L H < S+ 0 0 34 -4,-1.4 4,-0.4 1,-0.2 -1,-0.2 0.842 119.9 41.0 -76.5 -34.3 59.1 46.2 -15.5 82 405 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.734 94.0 86.4 -84.3 -25.0 62.5 47.9 -15.4 83 406 A K H X S+ 0 0 72 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.854 85.1 51.6 -44.6 -52.7 64.4 45.1 -13.6 84 407 A P H > S+ 0 0 77 0, 0.0 4,-0.6 0, 0.0 -1,-0.2 0.955 113.3 44.8 -53.6 -51.9 65.2 43.0 -16.7 85 408 A L H >4 S+ 0 0 3 -4,-0.4 3,-0.7 -3,-0.2 6,-0.2 0.897 115.7 48.0 -58.0 -43.3 66.8 46.0 -18.4 86 409 A L H 3< S+ 0 0 0 -4,-2.4 27,-2.3 1,-0.2 -1,-0.2 0.871 113.6 44.9 -66.9 -40.4 68.7 47.1 -15.3 87 410 A E H 3< S+ 0 0 50 -4,-2.8 2,-0.9 25,-0.2 -1,-0.2 0.382 87.8 106.9 -86.5 3.2 70.1 43.6 -14.5 88 411 A D X< - 0 0 69 -3,-0.7 3,-2.1 -4,-0.6 25,-0.1 -0.750 55.3-162.2 -87.9 105.8 71.1 43.0 -18.1 89 412 A E T 3 S+ 0 0 124 -2,-0.9 -1,-0.2 1,-0.3 -4,-0.0 0.755 90.2 60.9 -57.1 -25.5 74.9 43.3 -18.3 90 413 A K T 3 S+ 0 0 165 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.641 86.0 82.2 -78.2 -15.6 74.6 43.8 -22.1 91 414 A A S < S- 0 0 13 -3,-2.1 2,-0.5 -6,-0.2 -63,-0.1 -0.817 81.0-144.2 -92.0 106.6 72.5 46.9 -21.6 92 415 A L - 0 0 64 -2,-0.9 -63,-1.5 -65,-0.4 2,-0.3 -0.603 14.6-161.9 -82.2 124.5 75.1 49.6 -21.1 93 416 A K E -be 29 115A 0 21,-2.9 24,-2.2 -2,-0.5 23,-0.8 -0.772 9.2-159.5-105.4 147.4 74.4 52.5 -18.7 94 417 A V E +be 30 117A 0 -65,-2.2 -63,-2.4 -2,-0.3 2,-0.3 -0.945 27.7 154.1-118.1 140.3 76.0 55.9 -18.3 95 418 A G E - e 0 118A 0 22,-2.0 24,-2.1 -2,-0.4 2,-0.6 -0.976 47.0-109.4-160.1 168.6 75.5 57.7 -15.0 96 419 A Q S S- 0 0 29 -65,-0.3 5,-0.1 -2,-0.3 4,-0.1 -0.941 104.3 -11.1-107.5 112.0 77.0 60.3 -12.6 97 420 A N S >> S- 0 0 52 -2,-0.6 3,-1.3 1,-0.1 4,-0.8 0.986 74.2-174.0 60.1 61.6 78.3 58.5 -9.5 98 421 A L H 3> S+ 0 0 0 -3,-0.3 4,-3.0 1,-0.3 5,-0.3 0.645 71.1 80.4 -60.4 -16.8 76.6 55.1 -10.3 99 422 A K H 3> S+ 0 0 19 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.931 94.0 47.0 -56.8 -45.8 77.7 53.8 -6.9 100 423 A Y H <> S+ 0 0 46 -3,-1.3 4,-1.9 1,-0.2 -1,-0.2 0.940 114.2 45.6 -61.3 -50.0 74.8 55.6 -5.3 101 424 A D H X S+ 0 0 2 -4,-0.8 4,-2.2 1,-0.2 -2,-0.2 0.875 109.1 54.6 -62.6 -41.6 72.3 54.4 -7.9 102 425 A R H X S+ 0 0 9 -4,-3.0 4,-1.4 1,-0.2 10,-0.3 0.923 109.0 51.4 -59.1 -41.5 73.5 50.8 -7.8 103 426 A G H X S+ 0 0 0 -4,-1.9 4,-0.8 -5,-0.3 -2,-0.2 0.905 106.3 51.6 -62.3 -45.2 73.0 50.9 -4.0 104 427 A I H >< S+ 0 0 0 -4,-1.9 3,-1.2 1,-0.2 4,-0.2 0.924 109.0 50.9 -58.9 -46.6 69.4 52.2 -4.2 105 428 A L H ><>S+ 0 0 0 -4,-2.2 5,-1.9 1,-0.3 3,-1.6 0.830 102.7 61.5 -61.4 -30.7 68.4 49.4 -6.6 106 429 A A H ><5S+ 0 0 27 -4,-1.4 3,-1.3 1,-0.3 -1,-0.3 0.744 89.8 68.2 -68.5 -22.9 70.0 46.9 -4.2 107 430 A N T <<5S+ 0 0 46 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.614 105.5 44.6 -69.9 -9.2 67.4 48.0 -1.6 108 431 A Y T < 5S- 0 0 50 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.173 123.2 -98.5-119.4 15.7 64.9 46.3 -3.9 109 432 A G T < 5S+ 0 0 54 -3,-1.3 2,-0.5 1,-0.3 -3,-0.2 0.752 81.7 132.5 74.4 23.8 66.6 43.1 -4.8 110 433 A I < - 0 0 4 -5,-1.9 2,-0.8 -8,-0.1 -1,-0.3 -0.933 45.9-152.7-112.7 127.9 67.8 44.4 -8.1 111 434 A E - 0 0 57 -2,-0.5 2,-0.4 -3,-0.1 -8,-0.1 -0.868 14.9-142.8-102.9 105.6 71.5 44.0 -9.2 112 435 A L + 0 0 6 -2,-0.8 2,-0.2 -10,-0.3 -25,-0.2 -0.518 29.7 170.4 -68.8 121.9 72.5 46.8 -11.5 113 436 A R + 0 0 106 -27,-2.3 -25,-0.2 -2,-0.4 3,-0.2 -0.696 50.4 59.2-122.5 177.0 74.8 45.4 -14.2 114 437 A G + 0 0 14 -2,-0.2 -21,-2.9 1,-0.2 2,-2.3 0.798 60.4 165.5 70.0 25.8 76.1 47.0 -17.4 115 438 A I E +e 93 0A 25 1,-0.2 -1,-0.2 -3,-0.2 96,-0.1 -0.539 14.6 147.1 -75.6 79.3 77.7 49.7 -15.2 116 439 A A E + 0 0 24 -2,-2.3 2,-0.4 -23,-0.8 -1,-0.2 0.877 51.8 29.0 -88.6 -42.7 79.8 50.8 -18.1 117 440 A F E -e 94 0A 22 -24,-2.2 -22,-2.0 -3,-0.3 2,-0.6 -0.980 47.4-177.7-133.2 128.7 80.3 54.6 -17.8 118 441 A D E >> -e 95 0A 0 -2,-0.4 4,-2.3 -24,-0.2 3,-0.6 -0.962 15.9-156.5-119.7 108.3 80.4 57.0 -14.8 119 442 A T H 3> S+ 0 0 0 -24,-2.1 4,-2.4 -2,-0.6 5,-0.2 0.810 94.9 59.7 -55.3 -30.1 80.9 60.6 -16.0 120 443 A M H 3> S+ 0 0 26 -25,-0.4 4,-2.4 1,-0.2 -1,-0.3 0.930 111.6 39.3 -62.9 -44.2 82.3 61.4 -12.6 121 444 A L H <> S+ 0 0 0 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.772 110.5 58.3 -77.7 -26.6 85.0 58.8 -13.1 122 445 A E H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.955 112.4 42.1 -65.8 -46.0 85.5 59.7 -16.8 123 446 A S H X S+ 0 0 3 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.954 112.1 54.0 -61.9 -51.9 86.3 63.3 -15.6 124 447 A Y H < S+ 0 0 2 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.836 113.0 43.0 -51.7 -40.5 88.4 62.1 -12.7 125 448 A I H < S+ 0 0 7 -4,-2.0 371,-0.3 2,-0.2 3,-0.3 0.835 107.7 58.7 -78.3 -34.2 90.6 60.0 -15.0 126 449 A L H < S- 0 0 35 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.954 138.7 -18.8 -59.1 -49.5 90.8 62.6 -17.8 127 450 A N >< - 0 0 45 -4,-2.3 3,-2.6 -5,-0.1 4,-0.4 -0.567 59.1-162.1-163.2 92.7 92.4 65.1 -15.3 128 451 A S T 3 S+ 0 0 11 368,-0.5 3,-0.3 -4,-0.4 -3,-0.1 0.714 95.2 42.4 -48.4 -28.2 92.0 64.5 -11.6 129 452 A V T 3 S+ 0 0 62 1,-0.2 -1,-0.3 210,-0.1 3,-0.1 0.215 78.1 103.3-108.9 18.0 92.9 68.1 -10.8 130 453 A A S < S- 0 0 51 -3,-2.6 2,-0.3 1,-0.3 -1,-0.2 0.790 98.8 -80.3 -66.6 -25.6 90.9 69.9 -13.5 131 454 A G S S- 0 0 33 -4,-0.4 -1,-0.3 -3,-0.3 -4,-0.1 -0.948 78.4 -16.5 152.6-167.8 88.4 70.9 -10.9 132 455 A R - 0 0 172 -2,-0.3 205,-0.1 1,-0.1 -3,-0.0 -0.285 48.9-149.1 -62.7 149.7 85.4 69.3 -9.0 133 456 A H + 0 0 15 203,-0.3 -10,-0.1 4,-0.1 -9,-0.1 0.155 54.8 120.7-109.3 18.8 84.0 66.2 -10.7 134 457 A D S > S- 0 0 40 1,-0.1 4,-2.6 -38,-0.0 3,-0.3 -0.460 77.9-107.0 -77.2 156.2 80.4 66.6 -9.6 135 458 A M H > S+ 0 0 12 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.826 116.7 53.1 -55.0 -37.2 77.8 66.8 -12.4 136 459 A D H > S+ 0 0 57 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.915 111.8 44.2 -67.4 -41.8 77.2 70.6 -11.9 137 460 A S H > S+ 0 0 23 -3,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.928 116.0 49.8 -67.5 -40.9 80.8 71.5 -12.2 138 461 A L H X>S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.6 0.890 107.2 52.2 -64.0 -42.9 81.1 69.1 -15.1 139 462 A A H X5S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 6,-1.4 0.922 112.9 46.1 -60.8 -42.0 78.2 70.5 -17.0 140 463 A E H X5S+ 0 0 103 -4,-1.7 4,-0.9 4,-0.2 -2,-0.2 0.902 116.7 43.7 -67.0 -42.0 79.6 74.0 -16.7 141 464 A R H <5S+ 0 0 76 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.931 128.5 24.2 -71.1 -48.9 83.1 73.0 -17.7 142 465 A W H <5S+ 0 0 58 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.729 135.9 29.6 -91.4 -24.1 82.3 70.8 -20.6 143 466 A L H < - 0 0 35 -2,-0.4 4,-0.9 1,-0.1 3,-0.3 -0.481 11.9-122.2 -85.6 155.6 70.4 72.6 -8.5 150 473 A F H >> S+ 0 0 53 1,-0.2 4,-2.7 2,-0.2 3,-1.0 0.922 116.0 54.7 -60.6 -42.0 68.8 70.4 -5.8 151 474 A E H 3> S+ 0 0 88 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.826 98.8 63.7 -59.0 -33.9 68.4 73.5 -3.7 152 475 A E H 34 S+ 0 0 123 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.817 116.8 26.3 -63.5 -30.5 66.5 75.2 -6.6 153 476 A I H << S+ 0 0 17 -3,-1.0 -2,-0.2 -4,-0.9 -1,-0.2 0.693 132.5 35.4-104.4 -24.3 63.7 72.6 -6.4 154 477 A A H < S- 0 0 6 -4,-2.7 7,-2.7 1,-0.3 -3,-0.2 0.715 98.5-134.2-102.6 -24.2 63.9 71.5 -2.8 155 478 A G < - 0 0 30 -4,-2.1 2,-0.3 -5,-0.4 -1,-0.3 -0.588 25.2 -77.8 101.5-167.8 64.8 74.7 -1.0 156 479 A K S > S+ 0 0 162 -2,-0.2 3,-0.5 -4,-0.1 5,-0.0 -0.884 73.6 12.5-134.9 165.4 67.4 75.2 1.7 157 480 A G G > S- 0 0 59 -2,-0.3 3,-2.5 1,-0.2 0, 0.0 0.018 109.9 -31.4 65.6-174.2 68.0 74.7 5.4 158 481 A K G 3 S+ 0 0 215 1,-0.3 -1,-0.2 0, 0.0 0, 0.0 0.723 135.7 57.9 -49.3 -28.8 66.0 72.7 7.9 159 482 A N G < S+ 0 0 159 -3,-0.5 -1,-0.3 2,-0.0 -2,-0.2 0.230 76.9 133.6 -90.2 15.9 62.8 73.3 6.0 160 483 A Q < - 0 0 70 -3,-2.5 -5,-0.2 -5,-0.1 -6,-0.1 -0.428 57.2-120.1 -66.8 137.5 64.2 71.8 2.8 161 484 A L - 0 0 65 -7,-2.7 2,-0.3 -2,-0.1 -1,-0.1 -0.332 15.7-126.2 -75.6 157.8 61.8 69.4 1.1 162 485 A T > - 0 0 55 1,-0.1 3,-3.1 -2,-0.1 4,-0.4 -0.800 35.5-103.1-100.3 150.8 62.6 65.8 0.5 163 486 A F G > S+ 0 0 1 -128,-0.6 3,-1.3 -2,-0.3 -127,-0.1 0.745 118.8 63.2 -44.7 -35.3 62.2 64.6 -3.1 164 487 A N G 3 S+ 0 0 20 1,-0.3 -99,-1.5 -100,-0.1 -98,-0.6 0.647 100.7 55.0 -67.6 -13.4 58.9 62.9 -2.5 165 488 A Q G < S+ 0 0 86 -3,-3.1 2,-0.3 -101,-0.2 -1,-0.3 0.516 86.8 100.4 -96.2 -6.6 57.4 66.3 -1.6 166 489 A I S < S- 0 0 4 -3,-1.3 -100,-0.2 -4,-0.4 -12,-0.1 -0.589 85.3 -98.0 -84.6 140.1 58.4 68.0 -4.8 167 490 A A >> - 0 0 46 -2,-0.3 4,-2.9 -14,-0.2 3,-0.6 -0.278 34.2-116.2 -56.9 136.6 55.8 68.5 -7.6 168 491 A L H 3> S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.828 112.9 44.5 -38.4 -52.3 56.0 65.9 -10.3 169 492 A E H 3> S+ 0 0 69 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.842 112.8 49.4 -68.8 -37.1 57.0 68.3 -13.0 170 493 A E H <> S+ 0 0 49 -3,-0.6 4,-1.9 2,-0.2 -2,-0.2 0.958 113.9 47.2 -65.7 -49.2 59.5 70.2 -11.0 171 494 A A H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.879 110.7 53.6 -57.7 -39.3 61.1 66.9 -10.0 172 495 A G H X S+ 0 0 2 -4,-2.2 4,-3.0 -5,-0.3 5,-0.5 0.883 104.3 53.2 -64.2 -41.8 61.0 65.8 -13.6 173 496 A R H X S+ 0 0 25 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.962 115.5 41.7 -55.6 -53.8 62.9 68.9 -14.9 174 497 A Y H X S+ 0 0 32 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.926 121.1 40.1 -58.5 -52.9 65.7 68.3 -12.4 175 498 A A H X S+ 0 0 0 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.903 114.9 48.5 -68.6 -47.1 65.8 64.5 -12.8 176 499 A A H X S+ 0 0 0 -4,-3.0 4,-2.5 -5,-0.2 -1,-0.2 0.873 111.2 53.6 -63.3 -34.6 65.4 64.3 -16.6 177 500 A E H X S+ 0 0 1 -4,-1.7 4,-3.3 -5,-0.5 5,-0.4 0.923 103.5 56.5 -64.7 -42.9 68.1 67.0 -16.9 178 501 A D H X S+ 0 0 17 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.931 112.0 42.2 -52.5 -48.0 70.5 64.9 -14.8 179 502 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.909 116.1 47.7 -65.7 -46.7 70.1 62.0 -17.2 180 503 A D H X S+ 0 0 8 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.941 115.1 44.4 -61.7 -50.2 70.3 64.2 -20.3 181 504 A V H X S+ 0 0 1 -4,-3.3 4,-3.2 2,-0.2 5,-0.2 0.907 110.9 55.7 -62.4 -42.8 73.4 66.1 -19.1 182 505 A T H X S+ 0 0 2 -4,-2.2 4,-2.3 -5,-0.4 -1,-0.2 0.935 109.5 45.8 -56.2 -47.2 75.0 62.9 -18.0 183 506 A L H X S+ 0 0 4 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.906 114.3 48.2 -63.8 -41.4 74.6 61.4 -21.4 184 507 A Q H X S+ 0 0 60 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.882 109.7 52.0 -66.4 -38.8 75.9 64.6 -23.1 185 508 A L H X S+ 0 0 0 -4,-3.2 4,-2.9 2,-0.2 3,-0.4 0.933 111.2 49.1 -61.6 -43.3 78.9 64.8 -20.7 186 509 A H H X S+ 0 0 7 -4,-2.3 4,-3.2 -5,-0.2 -2,-0.2 0.945 106.3 54.7 -59.2 -51.9 79.7 61.2 -21.7 187 510 A L H < S+ 0 0 76 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.756 115.6 40.3 -55.3 -28.5 79.4 61.9 -25.4 188 511 A K H X S+ 0 0 111 -4,-1.3 4,-0.9 -3,-0.4 -1,-0.2 0.878 122.5 37.9 -87.9 -43.1 82.0 64.6 -25.0 189 512 A M H X S+ 0 0 0 -4,-2.9 4,-2.7 -5,-0.2 5,-0.2 0.884 105.8 62.2 -77.3 -42.2 84.4 62.9 -22.5 190 513 A W H < S+ 0 0 52 -4,-3.2 -1,-0.2 -5,-0.2 -3,-0.1 0.884 103.9 49.3 -54.7 -43.8 84.4 59.3 -23.7 191 514 A P H >4 S+ 0 0 69 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.950 113.2 49.0 -61.5 -43.0 85.8 60.2 -27.1 192 515 A D H >< S+ 0 0 57 -4,-0.9 3,-2.4 1,-0.3 -2,-0.2 0.890 98.2 66.4 -59.8 -43.8 88.5 62.2 -25.3 193 516 A L T 3< S+ 0 0 3 -4,-2.7 -1,-0.3 1,-0.3 3,-0.2 0.466 95.4 63.1 -59.4 0.8 89.3 59.4 -22.9 194 517 A Q T < S+ 0 0 96 -3,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.488 71.4 87.5-107.2 -3.5 90.6 57.5 -25.9 195 518 A K S < S+ 0 0 138 -3,-2.4 2,-0.3 1,-0.2 -1,-0.2 0.571 99.1 38.6 -70.1 -7.1 93.5 59.8 -26.9 196 519 A H > - 0 0 78 -3,-0.2 4,-1.7 -4,-0.2 -1,-0.2 -0.927 63.7-154.2-151.0 124.8 95.6 57.7 -24.5 197 520 A K H > S+ 0 0 177 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.677 92.5 63.2 -68.9 -19.5 95.7 54.0 -23.6 198 521 A G H > S+ 0 0 18 2,-0.2 4,-2.1 1,-0.1 3,-0.3 0.994 109.0 35.1 -69.3 -62.7 97.0 54.6 -20.1 199 522 A P H > S+ 0 0 8 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.883 116.3 57.5 -57.3 -40.0 94.1 56.6 -18.6 200 523 A L H X S+ 0 0 28 -4,-1.7 4,-2.7 1,-0.2 5,-0.3 0.896 106.3 49.7 -58.4 -41.1 91.7 54.4 -20.7 201 524 A N H X S+ 0 0 45 -4,-1.5 4,-2.8 -3,-0.3 5,-0.4 0.928 112.2 46.5 -64.4 -46.5 93.1 51.3 -19.0 202 525 A V H X>S+ 0 0 0 -4,-2.1 5,-2.8 291,-0.2 4,-1.2 0.903 115.0 46.9 -63.3 -41.5 92.7 52.8 -15.6 203 526 A F H <>S+ 0 0 2 -4,-2.9 5,-2.8 3,-0.2 -2,-0.2 0.961 120.2 38.0 -62.8 -53.0 89.2 54.0 -16.3 204 527 A E H <5S+ 0 0 89 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.864 128.0 26.9 -67.1 -47.3 88.1 50.6 -17.8 205 528 A N H <5S+ 0 0 92 -4,-2.8 -3,-0.2 -5,-0.3 -1,-0.2 0.545 133.8 23.3-102.1 -6.1 89.8 48.0 -15.7 206 529 A I T X5S+ 0 0 2 -4,-1.2 4,-1.2 -5,-0.4 -3,-0.2 0.702 122.4 35.3-121.4 -63.2 90.2 49.8 -12.4 207 530 A E H >4 S+ 0 0 46 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.818 105.5 60.1 -63.8 -26.8 84.8 47.9 -12.1 210 533 A L H 3X S+ 0 0 0 -4,-1.2 4,-2.3 -3,-0.3 5,-0.2 0.664 83.9 84.4 -74.8 -15.1 85.3 49.3 -8.6 211 534 A V H S+ 0 0 21 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.836 114.4 56.8 -65.7 -28.5 79.8 48.2 -7.5 213 536 A V H X S+ 0 0 2 -4,-0.7 4,-2.0 1,-0.2 -2,-0.2 0.879 106.6 49.5 -71.5 -30.7 82.4 46.9 -5.1 214 537 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 -3,-0.3 -1,-0.2 0.860 108.4 55.1 -70.2 -35.0 82.5 50.3 -3.3 215 538 A S H X S+ 0 0 2 -4,-1.6 4,-2.8 -5,-0.2 5,-0.2 0.938 108.9 46.8 -61.2 -47.7 78.7 50.2 -3.1 216 539 A R H X S+ 0 0 36 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.893 112.1 50.0 -64.5 -39.6 78.8 46.8 -1.4 217 540 A I H X S+ 0 0 4 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.951 113.8 45.1 -64.3 -47.5 81.5 47.9 1.1 218 541 A E H < S+ 0 0 27 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.930 116.3 45.5 -61.4 -45.9 79.6 51.0 2.0 219 542 A R H < S+ 0 0 43 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.764 108.4 57.2 -71.0 -24.0 76.3 49.2 2.3 220 543 A N H < S- 0 0 46 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.931 91.4-179.4 -68.8 -45.6 77.9 46.4 4.3 221 544 A G < - 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L 0 590F 3 176,-2.2 3,-1.2 -2,-0.4 210,-0.2 -0.800 36.5-128.1 -88.0 102.4 100.4 45.5 1.8 381 707 A S T 3 S- 0 0 8 208,-1.6 208,-0.3 -2,-1.0 5,-0.2 -0.338 74.2 -30.3 -56.7 125.8 103.6 45.9 3.7 382 708 A Q T 3> S+ 0 0 64 1,-0.1 4,-2.0 3,-0.1 3,-0.4 0.771 78.7 172.1 26.1 57.2 105.3 49.2 2.7 383 709 A I H <> S+ 0 0 1 -3,-1.2 4,-2.1 1,-0.2 -1,-0.1 0.861 71.3 54.2 -58.6 -38.3 103.9 49.0 -0.7 384 710 A E H > S+ 0 0 16 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.858 108.1 48.4 -67.5 -34.8 105.1 52.5 -1.6 385 711 A L H > S+ 0 0 5 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.873 111.4 50.8 -71.7 -35.9 108.7 51.7 -0.7 386 712 A R H X S+ 0 0 21 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.890 110.5 50.5 -66.7 -37.1 108.5 48.5 -2.7 387 713 A I H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 -2,-0.2 0.876 108.6 49.9 -68.5 -38.6 107.2 50.6 -5.6 388 714 A M H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 6,-0.3 0.900 108.0 55.1 -66.4 -37.7 110.0 53.1 -5.4 389 715 A A H <>S+ 0 0 0 -4,-2.1 5,-1.3 1,-0.2 4,-0.4 0.938 113.0 42.7 -58.4 -45.5 112.4 50.2 -5.4 390 716 A H H ><5S+ 0 0 55 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.942 113.3 49.8 -65.5 -51.4 110.8 49.0 -8.6 391 717 A L H 3<5S+ 0 0 24 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.763 114.4 46.2 -61.0 -26.1 110.6 52.4 -10.2 392 718 A S T 3<5S- 0 0 4 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.458 98.4-139.0 -96.6 -1.3 114.2 53.1 -9.4 393 719 A R T < 5 + 0 0 183 -3,-1.4 2,-0.8 -4,-0.4 -3,-0.2 0.772 40.1 168.1 49.3 31.4 115.4 49.7 -10.6 394 720 A D >< - 0 0 10 -5,-1.3 4,-2.6 -6,-0.3 5,-0.3 -0.659 29.5-161.2 -83.2 107.9 117.7 49.6 -7.6 395 721 A K H > S+ 0 0 167 -2,-0.8 4,-2.0 1,-0.2 -1,-0.2 0.769 88.6 59.7 -56.0 -28.2 119.1 46.1 -7.2 396 722 A G H > S+ 0 0 30 2,-0.2 4,-2.3 3,-0.2 -1,-0.2 0.983 111.2 34.5 -66.2 -60.0 120.0 47.0 -3.6 397 723 A L H > S+ 0 0 5 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.930 118.3 54.7 -60.5 -46.4 116.5 47.8 -2.3 398 724 A L H X S+ 0 0 51 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.889 110.0 46.5 -55.5 -42.0 115.0 45.1 -4.6 399 725 A T H X S+ 0 0 50 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.896 107.2 57.7 -69.7 -38.7 117.4 42.5 -3.0 400 726 A A H <>S+ 0 0 4 -4,-2.3 5,-2.8 1,-0.2 -2,-0.2 0.930 112.9 39.7 -56.4 -46.6 116.6 43.7 0.5 401 727 A F H ><5S+ 0 0 13 -4,-2.3 3,-1.9 3,-0.2 -1,-0.2 0.906 110.8 60.4 -68.9 -41.0 112.9 43.0 -0.1 402 728 A A H 3<5S+ 0 0 83 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.859 109.6 40.9 -55.8 -38.6 113.7 39.8 -2.0 403 729 A E T 3<5S- 0 0 120 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.262 116.9-111.8 -96.4 16.0 115.5 38.3 1.1 404 730 A G T < 5 + 0 0 68 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.797 61.9 155.6 64.4 32.2 112.9 39.6 3.5 405 731 A K < - 0 0 72 -5,-2.8 2,-0.8 -6,-0.2 -1,-0.2 -0.533 56.4 -98.3 -90.8 158.9 115.0 42.1 5.3 406 732 A D >> - 0 0 55 -2,-0.2 4,-3.1 1,-0.2 3,-0.6 -0.646 34.0-151.4 -70.7 106.1 113.9 45.2 7.1 407 733 A I H 3> S+ 0 0 2 -2,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.766 93.8 55.2 -57.0 -24.8 114.4 47.8 4.4 408 734 A H H 3> S+ 0 0 4 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.896 114.2 39.0 -74.6 -37.3 115.0 50.5 7.0 409 735 A R H <> S+ 0 0 67 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.849 116.3 51.8 -77.7 -34.4 117.7 48.4 8.7 410 736 A A H X S+ 0 0 5 -4,-3.1 4,-0.9 2,-0.2 -2,-0.2 0.923 112.9 46.4 -65.0 -43.1 119.1 47.3 5.3 411 737 A T H >X S+ 0 0 0 -4,-2.1 4,-2.9 -5,-0.3 3,-0.6 0.904 112.0 49.6 -64.4 -45.0 119.2 50.9 4.2 412 738 A A H 3X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 5,-0.4 0.891 105.0 58.5 -63.2 -39.7 120.8 52.1 7.4 413 739 A A H 3<>S+ 0 0 16 -4,-2.3 5,-1.7 1,-0.2 -1,-0.2 0.773 114.3 38.7 -60.7 -26.9 123.5 49.3 7.0 414 740 A E H <<5S+ 0 0 84 -4,-0.9 -2,-0.2 -3,-0.6 -1,-0.2 0.869 117.4 46.3 -90.2 -44.4 124.4 50.8 3.7 415 741 A V H <5S+ 0 0 4 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.843 127.6 29.3 -67.4 -35.2 124.1 54.5 4.5 416 742 A F T <5S- 0 0 56 -4,-2.9 -1,-0.2 -5,-0.2 -3,-0.2 0.493 106.8-127.4-104.0 -6.1 126.1 54.1 7.7 417 743 A G T 5 + 0 0 60 -5,-0.4 -3,-0.2 1,-0.2 -4,-0.1 0.984 60.3 117.3 58.7 70.7 128.2 51.2 6.6 418 744 A L < - 0 0 42 -5,-1.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.973 70.0 -72.0-155.9 162.8 127.7 48.5 9.3 419 745 A P >> - 0 0 73 0, 0.0 4,-1.0 0, 0.0 3,-0.8 -0.302 41.8-122.7 -60.4 143.6 126.4 44.9 9.6 420 746 A L T 34 S+ 0 0 39 1,-0.2 3,-0.4 2,-0.2 -8,-0.1 0.836 110.2 57.0 -55.5 -37.2 122.6 44.6 9.4 421 747 A E T 34 S+ 0 0 156 1,-0.2 -1,-0.2 -8,-0.0 -12,-0.0 0.833 107.8 47.8 -66.2 -31.8 122.5 42.9 12.8 422 748 A T T <4 S+ 0 0 74 -3,-0.8 -1,-0.2 2,-0.0 -2,-0.2 0.651 76.0 124.8 -86.1 -14.5 124.2 45.8 14.5 423 749 A V < - 0 0 8 -4,-1.0 2,-0.1 -3,-0.4 -10,-0.1 -0.216 56.9-135.4 -50.9 127.1 122.2 48.7 13.1 424 750 A T > - 0 0 65 1,-0.1 4,-2.0 -12,-0.1 3,-0.2 -0.300 18.9-106.3 -82.0 167.5 120.9 50.6 16.0 425 751 A S H > S+ 0 0 96 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.846 121.3 53.5 -62.0 -35.0 117.4 52.0 16.6 426 752 A E H > S+ 0 0 124 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.839 109.2 47.1 -70.1 -34.7 118.6 55.5 15.9 427 753 A Q H > S+ 0 0 37 2,-0.2 4,-2.0 -3,-0.2 -2,-0.2 0.825 112.1 50.5 -75.8 -32.8 120.2 54.5 12.6 428 754 A R H X S+ 0 0 60 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.914 110.6 49.9 -68.9 -42.1 117.0 52.6 11.6 429 755 A R H X S+ 0 0 138 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.838 110.9 49.7 -64.7 -33.9 115.0 55.7 12.5 430 756 A S H X S+ 0 0 7 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.891 113.1 45.1 -72.7 -40.0 117.3 57.9 10.4 431 757 A A H X S+ 0 0 0 -4,-2.0 4,-3.2 2,-0.2 -2,-0.2 0.899 110.8 54.7 -69.4 -40.8 117.1 55.6 7.4 432 758 A K H X S+ 0 0 53 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.903 107.9 48.7 -59.2 -43.6 113.3 55.4 7.8 433 759 A A H X S+ 0 0 29 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.900 112.8 49.2 -63.7 -40.2 112.9 59.1 7.7 434 760 A I H X S+ 0 0 1 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.961 112.1 48.0 -62.4 -52.9 115.1 59.2 4.6 435 761 A N H X S+ 0 0 2 -4,-3.2 4,-1.2 1,-0.2 3,-0.4 0.954 117.5 38.5 -53.3 -59.7 113.1 56.5 2.8 436 762 A F H X S+ 0 0 69 -4,-2.5 4,-1.1 1,-0.2 -1,-0.2 0.658 112.6 60.3 -69.9 -13.3 109.7 57.9 3.5 437 763 A G H <>S+ 0 0 13 -4,-1.1 5,-3.4 -5,-0.3 -1,-0.2 0.844 100.4 54.6 -79.6 -34.2 111.1 61.4 2.9 438 764 A L H ><5S+ 0 0 4 -4,-2.1 3,-0.6 -3,-0.4 -2,-0.2 0.859 103.7 56.3 -64.9 -35.9 112.1 60.4 -0.6 439 765 A I H 3<5S+ 0 0 0 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.911 114.0 37.3 -63.1 -44.7 108.5 59.3 -1.4 440 766 A Y T 3<5S- 0 0 120 -4,-1.1 -1,-0.3 78,-0.1 -2,-0.2 0.356 116.2-120.2 -88.7 5.9 107.1 62.7 -0.5 441 767 A G T < 5 - 0 0 15 -3,-0.6 -3,-0.2 1,-0.1 -2,-0.1 0.829 47.6-179.8 59.8 38.6 110.2 64.2 -2.1 442 768 A M < - 0 0 87 -5,-3.4 2,-0.2 -8,-0.1 -1,-0.1 -0.229 24.0-110.4 -72.8 158.9 111.4 66.0 1.0 443 769 A S > - 0 0 56 1,-0.1 4,-3.0 4,-0.0 5,-0.3 -0.494 24.2-112.9 -87.4 154.5 114.6 68.2 1.4 444 770 A A H > S+ 0 0 6 1,-0.3 4,-1.5 2,-0.2 -1,-0.1 0.835 123.2 51.5 -52.9 -32.7 117.7 67.4 3.4 445 771 A F H > S+ 0 0 95 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.900 107.7 49.8 -72.0 -42.3 116.6 70.2 5.6 446 772 A G H > S+ 0 0 10 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.921 108.1 54.2 -61.2 -42.6 113.2 68.8 6.0 447 773 A L H X S+ 0 0 10 -4,-3.0 4,-1.5 1,-0.2 3,-0.5 0.896 109.7 49.0 -56.1 -41.2 114.9 65.5 6.9 448 774 A A H X>S+ 0 0 5 -4,-1.5 4,-2.1 -5,-0.3 5,-1.1 0.913 106.5 53.3 -66.3 -44.9 116.8 67.4 9.5 449 775 A R H <5S+ 0 0 139 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.635 116.5 41.0 -66.9 -13.1 113.7 69.1 11.0 450 776 A Q H <5S+ 0 0 104 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.628 120.7 42.1-104.7 -21.2 112.1 65.7 11.4 451 777 A L H <5S- 0 0 25 -4,-1.5 -2,-0.2 -5,-0.2 -3,-0.2 0.524 101.4-129.0-102.0 -9.3 115.3 64.0 12.6 452 778 A N T <5 + 0 0 118 -4,-2.1 -3,-0.2 1,-0.2 -4,-0.1 0.885 66.2 123.0 60.5 42.2 116.4 66.8 15.0 453 779 A I < - 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