==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 08-MAY-12 4F2S . COMPND 2 MOLECULE: DNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS KAUSTOPHILUS; . AUTHOR W.WANG,L.S.BEESE . 1161 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53791.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 821 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 55 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 108 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 475 40.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 42 3.6 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 4 3 6 2 7 4 4 0 0 2 5 1 0 2 2 0 0 0 0 0 0 0 2 0 2 0 2 RESIDUES PER ALPHA HELIX . 0 1 5 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 . 2 5 4 2 3 3 2 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 . 5 1 3 0 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 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 1 299 A M 0 0 81 0, 0.0 2,-0.2 0, 0.0 150,-0.1 0.000 360.0 360.0 360.0 115.8 110.1 -62.1 9.4 2 300 A A + 0 0 77 2,-0.0 2,-0.3 42,-0.0 43,-0.1 -0.464 360.0 155.0 -78.0 139.0 111.0 -65.7 10.1 3 301 A F - 0 0 57 -2,-0.2 2,-0.6 41,-0.1 43,-0.2 -0.976 40.1-111.6-154.1 164.9 112.3 -66.8 13.5 4 302 A T E -a 46 0A 76 41,-2.8 43,-2.6 -2,-0.3 2,-1.2 -0.879 13.3-150.9-101.4 121.8 112.5 -69.8 15.7 5 303 A L E -a 47 0A 55 -2,-0.6 2,-0.2 41,-0.2 43,-0.1 -0.798 35.7-155.6 -87.7 98.6 110.4 -70.0 18.9 6 304 A A - 0 0 8 41,-2.0 43,-0.5 -2,-1.2 3,-0.1 -0.514 32.2-167.3 -93.2 145.8 112.9 -72.2 20.7 7 305 A D S S+ 0 0 121 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.545 80.0 24.3-100.7 -15.4 112.4 -74.6 23.6 8 306 A R S S- 0 0 164 44,-0.0 2,-0.3 48,-0.0 -1,-0.2 -0.989 85.6-100.7-147.0 155.9 116.1 -75.0 24.3 9 307 A V - 0 0 7 -2,-0.3 2,-0.3 -3,-0.1 49,-0.1 -0.602 39.7-166.7 -75.1 133.6 119.3 -73.2 23.9 10 308 A T > - 0 0 35 -2,-0.3 3,-1.7 1,-0.1 4,-0.4 -0.862 33.3-109.1-118.2 160.8 121.4 -74.4 21.0 11 309 A E G > S+ 0 0 147 -2,-0.3 3,-1.8 1,-0.3 -1,-0.1 0.838 114.8 61.6 -56.4 -37.4 125.0 -73.8 20.1 12 310 A E G > S+ 0 0 90 1,-0.3 3,-0.6 2,-0.1 31,-0.3 0.743 96.0 61.4 -67.4 -17.0 124.1 -71.6 17.1 13 311 A M G < S+ 0 0 4 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.673 96.8 63.8 -75.6 -13.0 122.3 -69.1 19.4 14 312 A L G < S+ 0 0 15 -3,-1.8 -1,-0.2 -4,-0.4 -2,-0.1 -0.184 71.0 148.3-108.9 41.0 125.7 -68.6 21.1 15 313 A A < - 0 0 10 -3,-0.6 -3,-0.0 2,-0.1 3,-0.0 -0.225 60.7-108.2 -74.3 167.0 127.7 -67.0 18.3 16 314 A D S S+ 0 0 93 1,-0.1 53,-2.3 52,-0.1 2,-0.3 0.407 105.4 41.4 -86.4 5.5 130.4 -64.4 19.1 17 315 A K E S+b 69 0A 64 51,-0.2 25,-0.5 2,-0.0 2,-0.3 -0.937 74.0 144.1-146.0 131.6 128.4 -61.5 17.7 18 316 A A E -b 70 0A 0 51,-1.9 53,-2.6 -2,-0.3 2,-0.5 -0.992 48.3-119.2-157.6 151.5 124.6 -61.1 18.2 19 317 A A E -bC 71 40A 0 21,-3.1 21,-2.4 -2,-0.3 2,-0.4 -0.857 41.6-164.4 -87.0 135.6 121.8 -58.6 18.8 20 318 A L E - C 0 39A 1 51,-2.4 2,-0.5 -2,-0.5 53,-0.4 -0.982 16.7-169.9-130.1 131.6 120.3 -59.4 22.2 21 319 A V E + C 0 38A 11 17,-2.8 17,-2.2 -2,-0.4 2,-0.5 -0.993 6.1 178.7-121.1 123.4 117.0 -58.4 23.7 22 320 A V E - C 0 37A 9 -2,-0.5 2,-0.4 15,-0.2 15,-0.2 -0.902 30.9-143.5-121.2 94.1 116.4 -59.1 27.4 23 321 A E E + C 0 36A 14 13,-2.5 12,-2.3 -2,-0.5 13,-0.7 -0.495 29.2 171.3 -82.9 122.3 113.0 -57.6 27.8 24 322 A V + 0 0 8 -2,-0.4 10,-0.1 10,-0.2 5,-0.1 -0.985 4.2 179.9-123.2 116.3 111.9 -55.8 31.0 25 323 A V + 0 0 24 -2,-0.5 -1,-0.1 8,-0.4 9,-0.1 0.770 53.7 94.5 -93.5 -29.6 108.5 -54.1 30.5 26 324 A E S S- 0 0 86 7,-0.3 6,-0.1 1,-0.2 -2,-0.0 -0.431 77.9-133.4 -59.8 136.2 108.1 -52.5 34.0 27 325 A E S S+ 0 0 150 1,-0.2 2,-0.8 -2,-0.1 -1,-0.2 0.899 99.6 57.2 -62.1 -40.2 109.5 -49.0 33.7 28 326 A N S S- 0 0 34 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.845 73.9-169.8 -93.7 107.8 111.4 -49.5 36.9 29 327 A Y > + 0 0 3 -2,-0.8 3,-1.6 3,-0.1 2,-0.4 0.437 41.8 122.3 -83.8 1.8 113.6 -52.5 36.2 30 328 A H T 3 S- 0 0 14 1,-0.3 51,-0.1 275,-0.1 -2,-0.1 -0.503 97.5 -13.7 -71.9 123.7 114.9 -53.1 39.7 31 329 A D T 3 S+ 0 0 82 -2,-0.4 -1,-0.3 49,-0.2 50,-0.1 0.845 106.1 151.2 56.0 35.8 114.0 -56.7 40.8 32 330 A A < - 0 0 2 -3,-1.6 -1,-0.2 1,-0.1 2,-0.1 -0.619 49.8 -97.9 -99.1 155.1 111.6 -56.6 37.8 33 331 A P - 0 0 59 0, 0.0 2,-0.6 0, 0.0 -8,-0.4 -0.401 22.3-136.2 -72.7 148.8 110.6 -59.7 35.7 34 332 A I - 0 0 13 -10,-0.1 -10,-0.2 1,-0.1 3,-0.1 -0.933 20.5-172.9-100.1 121.9 112.3 -60.6 32.4 35 333 A V - 0 0 36 -12,-2.3 2,-0.3 -2,-0.6 -11,-0.1 0.655 57.2 -15.8 -97.5 -17.4 109.4 -61.5 30.1 36 334 A G E -C 23 0A 0 -13,-0.7 -13,-2.5 13,-0.1 2,-0.4 -0.959 52.0-137.7-178.3 161.2 111.3 -62.8 27.1 37 335 A I E -CD 22 48A 0 11,-2.0 11,-2.8 -2,-0.3 2,-0.4 -0.987 13.4-172.3-132.6 139.6 114.6 -63.0 25.3 38 336 A A E -CD 21 47A 0 -17,-2.2 -17,-2.8 -2,-0.4 2,-0.4 -0.993 1.3-170.7-130.8 146.5 115.5 -62.7 21.6 39 337 A V E -CD 20 46A 0 7,-2.3 7,-2.7 -2,-0.4 2,-0.4 -1.000 1.8-175.3-132.9 129.2 118.8 -63.3 19.9 40 338 A V E +CD 19 45A 5 -21,-2.4 -21,-3.1 -2,-0.4 2,-0.2 -0.996 22.9 140.8-122.7 128.5 119.6 -62.4 16.2 41 339 A N E > - D 0 44A 6 3,-2.5 3,-0.9 -2,-0.4 -23,-0.1 -0.783 66.9 -68.3-146.5-167.9 123.0 -63.5 14.8 42 340 A E T 3 S+ 0 0 134 -25,-0.5 3,-0.1 1,-0.2 -24,-0.1 0.705 127.5 52.0 -62.0 -21.3 124.5 -64.8 11.5 43 341 A H T 3 S- 0 0 96 -31,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.647 119.8 -75.6 -96.1 -17.3 122.7 -68.1 12.0 44 342 A G E < - D 0 41A 26 -3,-0.9 -3,-2.5 -32,-0.1 2,-0.4 -0.990 50.7 -62.7 157.3-162.0 119.2 -66.9 12.5 45 343 A R E - D 0 40A 86 -2,-0.3 -41,-2.8 -5,-0.2 2,-0.4 -0.990 45.5-173.9-127.7 135.5 116.7 -65.3 14.8 46 344 A F E -aD 4 39A 3 -7,-2.7 -7,-2.3 -2,-0.4 2,-0.4 -0.969 18.8-158.5-136.3 139.0 115.6 -66.9 18.1 47 345 A F E -aD 5 38A 2 -43,-2.6 -41,-2.0 -2,-0.4 2,-0.4 -0.983 19.6-172.4-113.4 134.2 113.1 -66.3 20.9 48 346 A L E - D 0 37A 0 -11,-2.8 -11,-2.0 -2,-0.4 -41,-0.1 -0.947 25.1-122.9-126.2 143.1 113.7 -67.9 24.2 49 347 A R >> - 0 0 52 -43,-0.5 4,-2.4 -2,-0.4 3,-0.7 -0.689 23.3-132.3 -79.8 136.9 111.7 -68.2 27.4 50 348 A P H 3> S+ 0 0 12 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.899 105.1 59.0 -56.1 -45.5 113.5 -66.6 30.4 51 349 A E H 34 S+ 0 0 135 1,-0.2 4,-0.2 2,-0.2 -15,-0.0 0.825 115.1 38.4 -55.0 -34.6 112.8 -69.6 32.6 52 350 A T H X4 S+ 0 0 42 -3,-0.7 3,-1.3 2,-0.1 4,-0.5 0.978 120.6 38.8 -76.9 -66.9 114.6 -71.8 30.1 53 351 A A H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.3 7,-0.3 0.837 114.4 52.5 -58.1 -42.5 117.5 -69.6 28.9 54 352 A L T 3< S+ 0 0 30 -4,-2.7 -1,-0.3 -5,-0.3 -3,-0.1 0.603 111.9 47.7 -77.3 -10.0 118.4 -68.1 32.3 55 353 A A T < S+ 0 0 74 -3,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.411 90.7 98.6 -99.9 -5.2 118.5 -71.6 33.8 56 354 A D <> - 0 0 33 -3,-1.0 4,-2.5 -4,-0.5 3,-0.3 -0.753 65.4-152.2 -90.1 114.0 120.7 -72.9 31.0 57 355 A P H > S+ 0 0 89 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.837 93.7 52.7 -56.8 -34.6 124.4 -72.9 32.0 58 356 A Q H > S+ 0 0 117 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.895 110.5 46.2 -67.7 -40.1 125.6 -72.5 28.4 59 357 A F H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.918 112.6 51.2 -69.0 -39.4 123.4 -69.4 27.8 60 358 A V H X S+ 0 0 43 -4,-2.5 4,-1.8 -7,-0.3 -2,-0.2 0.918 109.7 49.9 -63.5 -40.5 124.5 -67.9 31.1 61 359 A A H < S+ 0 0 64 -4,-2.2 4,-0.4 -5,-0.2 -1,-0.2 0.892 110.2 51.2 -59.8 -43.0 128.1 -68.5 30.2 62 360 A W H >< S+ 0 0 9 -4,-2.1 3,-1.5 1,-0.2 6,-0.2 0.944 107.7 52.1 -61.4 -47.3 127.6 -66.8 26.9 63 361 A L H 3< S+ 0 0 0 -4,-2.6 27,-2.7 1,-0.3 -1,-0.2 0.880 113.9 43.9 -56.2 -41.7 125.9 -63.8 28.5 64 362 A G T 3< S+ 0 0 26 -4,-1.8 2,-0.7 25,-0.3 -1,-0.3 0.412 88.4 103.7 -87.2 2.2 128.9 -63.3 30.9 65 363 A D X - 0 0 55 -3,-1.5 3,-1.8 -4,-0.4 25,-0.1 -0.759 56.3-159.7 -92.9 113.3 131.6 -63.9 28.3 66 364 A E T 3 S+ 0 0 135 -2,-0.7 -1,-0.1 1,-0.3 -4,-0.0 0.699 89.1 59.9 -67.7 -18.0 133.1 -60.5 27.3 67 365 A T T 3 S+ 0 0 84 2,-0.1 2,-0.8 1,-0.1 -1,-0.3 0.502 87.3 81.4 -87.2 -6.5 134.5 -61.8 24.0 68 366 A K S < S- 0 0 59 -3,-1.8 2,-0.3 -6,-0.2 -51,-0.2 -0.901 83.9-144.3 -96.9 107.7 131.0 -62.7 22.9 69 367 A K E -b 17 0A 85 -53,-2.3 -51,-1.9 -2,-0.8 2,-0.4 -0.606 16.7-167.1 -89.2 133.2 129.8 -59.4 21.6 70 368 A K E -be 18 92A 0 21,-2.3 23,-2.1 -2,-0.3 24,-1.2 -0.942 12.3-154.4-114.8 139.1 126.2 -58.2 22.0 71 369 A S E +be 19 94A 0 -53,-2.6 -51,-2.4 -2,-0.4 2,-0.2 -0.938 33.1 160.9-106.5 129.7 124.4 -55.3 20.4 72 370 A M E - e 0 95A 4 22,-2.9 24,-3.1 -2,-0.5 2,-0.4 -0.778 42.4-121.2-136.9 175.1 121.5 -54.1 22.5 73 371 A F S S- 0 0 35 -53,-0.4 5,-0.1 -2,-0.2 39,-0.1 -0.991 98.9 -2.9-121.4 121.1 119.1 -51.2 23.2 74 372 A D S > S+ 0 0 29 -2,-0.4 4,-1.5 3,-0.1 3,-0.3 0.989 72.5 179.1 60.5 62.7 119.3 -49.9 26.9 75 373 A S H > S+ 0 0 11 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.773 74.8 64.9 -66.1 -23.9 121.8 -52.5 28.1 76 374 A K H > S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.929 99.4 51.8 -66.2 -41.7 121.8 -51.0 31.5 77 375 A R H > S+ 0 0 54 -3,-0.3 4,-2.5 1,-0.2 5,-0.2 0.956 115.3 42.2 -54.2 -51.4 118.1 -52.0 32.0 78 376 A A H X S+ 0 0 3 -4,-1.5 4,-2.4 1,-0.2 -2,-0.2 0.922 113.2 52.2 -64.2 -46.3 119.0 -55.6 31.0 79 377 A A H X S+ 0 0 16 -4,-3.1 4,-2.2 2,-0.2 -1,-0.2 0.902 113.7 43.2 -58.1 -43.3 122.2 -55.7 33.0 80 378 A V H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -49,-0.2 0.931 112.4 51.0 -72.3 -44.6 120.5 -54.5 36.2 81 379 A A H < S+ 0 0 0 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.887 113.6 47.6 -56.8 -37.2 117.5 -56.8 35.8 82 380 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.4 -5,-0.2 3,-1.8 0.890 106.0 57.4 -71.2 -38.4 120.0 -59.6 35.3 83 381 A K H ><5S+ 0 0 50 -4,-2.2 3,-2.0 1,-0.3 -2,-0.2 0.890 99.7 58.9 -58.7 -38.6 122.0 -58.6 38.3 84 382 A W T 3<5S+ 0 0 61 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.628 108.2 46.5 -67.6 -11.1 118.9 -59.0 40.4 85 383 A K T < 5S- 0 0 109 -3,-1.8 -1,-0.3 2,-0.2 -2,-0.2 0.274 121.5-109.2-105.7 2.8 118.8 -62.6 39.2 86 384 A G T < 5S+ 0 0 71 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.746 76.8 131.8 73.8 26.4 122.5 -63.1 40.0 87 385 A I < - 0 0 18 -5,-2.4 2,-0.5 -8,-0.1 -1,-0.2 -0.936 48.7-141.9-116.0 129.8 123.5 -63.2 36.3 88 386 A E - 0 0 132 -2,-0.4 2,-0.5 -28,-0.1 -23,-0.1 -0.796 8.4-159.4 -95.7 129.0 126.4 -61.2 34.8 89 387 A L + 0 0 25 -2,-0.5 2,-0.3 -10,-0.1 -25,-0.3 -0.939 23.3 160.8-105.1 121.2 126.1 -59.6 31.3 90 388 A C + 0 0 27 -27,-2.7 -25,-0.2 -2,-0.5 3,-0.1 -0.851 42.8 52.6-129.7 169.4 129.4 -58.7 29.6 91 389 A G + 0 0 14 -2,-0.3 -21,-2.3 1,-0.3 2,-0.7 0.660 55.3 159.8 80.1 17.9 130.6 -57.9 26.1 92 390 A V E +e 70 0A 39 -23,-0.2 -1,-0.3 1,-0.2 -21,-0.2 -0.651 5.1 167.7 -73.5 114.0 128.0 -55.2 25.2 93 391 A S E + 0 0 41 -23,-2.1 2,-0.3 -2,-0.7 -22,-0.2 0.538 61.8 32.5-105.7 -14.8 129.8 -53.5 22.3 94 392 A F E -e 71 0A 1 -24,-1.2 -22,-2.9 87,-0.1 2,-0.5 -0.952 55.6-171.8-148.8 124.8 126.9 -51.4 21.0 95 393 A D E > -e 72 0A 2 -2,-0.3 4,-2.5 -24,-0.2 -22,-0.2 -0.946 8.1-163.4-119.1 107.8 124.0 -49.7 22.7 96 394 A L H > S+ 0 0 0 -24,-3.1 4,-2.3 -2,-0.5 5,-0.2 0.772 88.5 57.4 -62.4 -28.8 121.5 -48.3 20.3 97 395 A L H > S+ 0 0 19 -25,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.951 110.6 42.9 -66.3 -47.9 119.8 -46.1 23.0 98 396 A L H > S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.907 113.4 52.6 -65.8 -38.8 123.1 -44.4 23.7 99 397 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.931 111.3 45.9 -60.8 -46.7 123.9 -44.1 20.0 100 398 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.898 111.2 53.7 -64.1 -41.6 120.6 -42.4 19.2 101 399 A Y H < S+ 0 0 7 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.921 109.3 47.1 -59.6 -45.4 121.0 -40.1 22.2 102 400 A L H < S+ 0 0 1 -4,-2.5 370,-0.4 1,-0.2 -1,-0.2 0.911 109.2 54.4 -65.0 -38.3 124.4 -38.9 21.1 103 401 A L H < S- 0 0 3 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.884 136.8 -14.2 -65.2 -36.7 123.2 -38.3 17.6 104 402 A D >< - 0 0 28 -4,-2.0 3,-1.6 -5,-0.1 5,-0.4 -0.560 53.4-171.9-168.1 96.8 120.3 -36.1 18.7 105 403 A P G > S+ 0 0 5 0, 0.0 3,-1.1 0, 0.0 -3,-0.1 0.741 84.6 70.0 -61.7 -19.8 119.1 -35.9 22.3 106 404 A A G 3 S+ 0 0 58 1,-0.3 -5,-0.1 208,-0.1 208,-0.1 0.622 83.2 71.0 -75.0 -15.1 116.1 -33.7 21.3 107 405 A Q G < S- 0 0 111 -3,-1.6 -1,-0.3 -7,-0.2 3,-0.1 0.758 92.9-143.3 -73.2 -21.1 114.5 -36.7 19.5 108 406 A G < - 0 0 46 -3,-1.1 2,-0.2 -4,-0.3 -2,-0.1 0.863 21.2-165.9 59.9 37.3 113.8 -38.2 22.9 109 407 A V + 0 0 11 -5,-0.4 -1,-0.2 1,-0.2 3,-0.1 -0.373 25.8 154.7 -55.3 121.6 114.4 -41.7 21.7 110 408 A D + 0 0 124 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.280 58.1 36.9-135.9 9.5 113.1 -44.2 24.3 111 409 A D S > S- 0 0 16 1,-0.1 4,-1.6 -14,-0.1 3,-0.5 -0.973 84.3-105.1-152.8 164.3 112.4 -47.3 22.3 112 410 A V H > S+ 0 0 3 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.850 116.6 57.6 -58.1 -37.8 113.9 -49.2 19.4 113 411 A A H > S+ 0 0 16 12,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.891 105.4 51.6 -64.4 -36.2 111.2 -48.1 16.9 114 412 A A H > S+ 0 0 27 -3,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.876 112.2 45.6 -67.2 -39.8 112.1 -44.4 17.7 115 413 A A H >< S+ 0 0 0 -4,-1.6 3,-1.1 1,-0.2 4,-0.4 0.919 111.1 52.8 -63.2 -44.5 115.8 -45.1 17.0 116 414 A A H ><>S+ 0 0 0 -4,-3.0 5,-2.4 1,-0.3 3,-1.9 0.865 98.7 65.1 -61.8 -34.6 114.9 -47.0 13.9 117 415 A K H ><5S+ 0 0 154 -4,-2.0 3,-1.7 1,-0.3 -1,-0.3 0.826 89.7 67.2 -57.4 -31.5 112.9 -44.0 12.7 118 416 A M T <<5S+ 0 0 43 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.750 111.0 33.3 -62.7 -23.2 116.2 -42.1 12.5 119 417 A K T < 5S- 0 0 54 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.034 116.9-108.9-119.4 23.6 117.3 -44.3 9.6 120 418 A Q T < 5 + 0 0 155 -3,-1.7 2,-0.6 1,-0.2 -3,-0.2 0.796 66.7 152.4 51.4 32.1 113.8 -44.9 8.1 121 419 A Y < + 0 0 50 -5,-2.4 -1,-0.2 -6,-0.1 -2,-0.1 -0.832 12.0 166.3 -88.9 120.4 113.8 -48.5 9.3 122 420 A E + 0 0 179 -2,-0.6 2,-0.6 1,-0.1 -1,-0.1 0.355 40.2 105.5-125.6 10.8 110.2 -49.5 9.9 123 421 A A S S+ 0 0 43 28,-0.1 2,-0.3 -7,-0.1 -1,-0.1 -0.064 77.7 65.8 -80.3 37.6 110.1 -53.4 10.2 124 422 A V S S- 0 0 13 -2,-0.6 24,-0.1 -3,-0.1 28,-0.0 -0.973 75.9-130.3-157.9 139.5 109.5 -53.0 14.0 125 423 A R - 0 0 132 -2,-0.3 -12,-0.3 23,-0.1 -13,-0.1 -0.589 30.7 -99.3 -93.1 153.9 106.7 -51.6 16.2 126 424 A P >> - 0 0 62 0, 0.0 4,-1.0 0, 0.0 3,-0.7 -0.413 31.0-122.6 -62.1 145.2 106.8 -49.1 19.0 127 425 A D H >> S+ 0 0 38 1,-0.2 4,-2.8 2,-0.2 3,-1.0 0.900 111.8 58.2 -57.0 -42.4 106.7 -50.6 22.5 128 426 A E H 3> S+ 0 0 119 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.814 102.0 55.9 -62.5 -26.9 103.6 -48.6 23.4 129 427 A A H <4 S+ 0 0 47 -3,-0.7 -1,-0.3 2,-0.2 -2,-0.2 0.804 115.0 37.8 -71.4 -30.2 101.8 -50.2 20.5 130 428 A V H << S+ 0 0 17 -4,-1.0 -2,-0.2 -3,-1.0 -1,-0.2 0.858 128.3 29.6 -90.3 -40.7 102.5 -53.7 21.7 131 429 A Y H < S- 0 0 15 -4,-2.8 7,-2.3 1,-0.2 -3,-0.2 0.793 100.6-134.7 -94.6 -29.8 102.2 -53.3 25.4 132 430 A G < - 0 0 25 -4,-1.4 2,-0.3 -5,-0.5 -1,-0.2 -0.319 23.9 -78.2 94.4 174.2 99.6 -50.5 25.6 133 431 A K S > S- 0 0 142 -2,-0.1 3,-2.4 4,-0.1 4,-0.2 -0.829 74.2 -28.6-118.7 154.0 99.6 -47.4 27.8 134 432 A G G > S+ 0 0 67 -2,-0.3 3,-2.1 1,-0.3 0, 0.0 -0.118 130.2 1.9 51.3-132.7 98.8 -46.7 31.4 135 433 A A G 3 S+ 0 0 116 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.557 131.2 62.5 -63.1 -8.3 96.2 -48.9 33.0 136 434 A K G < S+ 0 0 162 -3,-2.4 -1,-0.3 2,-0.0 -2,-0.2 0.533 72.8 124.8 -93.9 -7.2 96.1 -50.9 29.7 137 435 A R < + 0 0 105 -3,-2.1 2,-0.3 -4,-0.2 -5,-0.2 -0.326 30.9 145.6 -64.5 127.5 99.7 -52.0 29.8 138 436 A A - 0 0 59 -7,-2.3 -2,-0.0 -2,-0.1 -3,-0.0 -0.984 53.6-105.6-157.9 148.8 100.1 -55.8 29.5 139 437 A V - 0 0 66 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.679 46.2-134.6 -73.5 123.9 102.4 -58.4 28.1 140 438 A P - 0 0 33 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 -0.041 37.0 -63.8 -73.1-179.4 100.7 -59.8 25.0 141 439 A D >> - 0 0 120 1,-0.1 4,-2.5 4,-0.1 3,-0.9 -0.277 58.2-100.1 -67.6 155.2 100.3 -63.5 24.1 142 440 A E H 3> S+ 0 0 63 1,-0.3 4,-3.4 2,-0.2 5,-0.3 0.818 118.9 51.0 -50.4 -47.1 103.6 -65.4 23.4 143 441 A P H 3> S+ 0 0 72 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.901 115.4 44.5 -61.8 -35.1 103.4 -65.3 19.5 144 442 A V H <> S+ 0 0 75 -3,-0.9 4,-1.6 2,-0.2 -2,-0.2 0.901 116.9 44.9 -71.9 -43.6 102.8 -61.6 19.6 145 443 A L H X S+ 0 0 8 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.930 111.8 52.9 -62.6 -47.3 105.5 -60.9 22.2 146 444 A A H X S+ 0 0 0 -4,-3.4 4,-2.5 1,-0.2 5,-0.3 0.917 108.6 48.9 -59.5 -46.8 108.0 -63.2 20.5 147 445 A E H X S+ 0 0 84 -4,-1.9 4,-2.3 -5,-0.3 -1,-0.2 0.888 111.3 51.4 -60.8 -37.3 107.6 -61.4 17.1 148 446 A H H X S+ 0 0 6 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.940 111.6 44.6 -67.5 -48.4 108.1 -58.1 18.8 149 447 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.901 114.8 48.9 -62.8 -42.8 111.3 -59.0 20.7 150 448 A V H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.2 5,-0.2 0.902 110.0 51.9 -63.4 -40.4 112.8 -60.6 17.6 151 449 A R H X S+ 0 0 50 -4,-2.3 4,-1.6 -5,-0.3 -1,-0.2 0.866 109.6 50.0 -64.3 -35.0 111.9 -57.6 15.4 152 450 A K H X S+ 0 0 10 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.913 111.9 47.6 -67.9 -42.0 113.6 -55.4 18.0 153 451 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.908 111.3 50.4 -63.0 -42.7 116.7 -57.6 17.9 154 452 A A H X S+ 0 0 5 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.830 110.0 51.6 -63.8 -34.0 116.7 -57.6 14.1 155 453 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 5,-0.2 0.945 109.7 47.4 -69.4 -47.1 116.4 -53.8 14.1 156 454 A I H X S+ 0 0 1 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.916 111.5 54.0 -56.5 -43.5 119.4 -53.4 16.4 157 455 A W H < S+ 0 0 73 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.900 115.8 36.8 -57.0 -45.4 121.3 -55.9 14.2 158 456 A E H < S+ 0 0 94 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.760 117.4 51.3 -81.3 -25.5 120.6 -53.9 11.0 159 457 A L H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.643 85.8 83.5 -90.8 -18.0 121.0 -50.4 12.6 160 458 A E H X S+ 0 0 19 -4,-1.5 4,-2.9 -5,-0.2 5,-0.2 0.948 94.8 42.6 -51.7 -55.0 124.3 -50.8 14.3 161 459 A R H > S+ 0 0 78 -4,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.927 113.3 50.9 -64.7 -46.7 126.5 -50.0 11.3 162 460 A P H > S+ 0 0 44 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.902 114.8 44.4 -54.0 -42.3 124.4 -47.1 10.1 163 461 A F H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.916 113.2 49.7 -71.8 -46.4 124.5 -45.5 13.5 164 462 A L H X S+ 0 0 50 -4,-2.9 4,-2.4 -5,-0.3 5,-0.2 0.897 109.5 53.4 -56.9 -39.4 128.2 -46.2 14.0 165 463 A D H X S+ 0 0 69 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.898 111.1 44.5 -65.6 -40.6 128.9 -44.6 10.6 166 464 A E H X S+ 0 0 24 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.872 112.6 51.8 -69.5 -40.5 127.0 -41.4 11.4 167 465 A L H <>S+ 0 0 0 -4,-2.5 5,-3.4 2,-0.2 6,-0.6 0.931 111.0 47.7 -58.8 -41.9 128.6 -41.2 14.8 168 466 A R H ><5S+ 0 0 61 -4,-2.4 3,-1.7 4,-0.2 -2,-0.2 0.936 109.0 54.5 -66.6 -44.1 132.0 -41.6 13.2 169 467 A R H 3<5S+ 0 0 48 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.904 111.2 45.6 -48.9 -46.5 131.0 -38.9 10.7 170 468 A N T 3<5S- 0 0 6 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.322 115.9-112.1 -79.4 1.8 130.2 -36.6 13.7 171 469 A E T < 5S+ 0 0 79 -3,-1.7 -3,-0.2 -4,-0.2 4,-0.1 0.868 90.7 112.6 61.9 37.2 133.4 -37.3 15.6 172 470 A Q >< + 0 0 0 -5,-3.4 4,-1.8 -6,-0.2 -4,-0.2 0.335 35.0 95.6-119.1 5.5 131.2 -39.1 18.2 173 471 A D H > S+ 0 0 48 -6,-0.6 4,-2.8 1,-0.2 5,-0.2 0.898 90.6 45.4 -66.8 -38.0 132.2 -42.8 17.9 174 472 A R H >>S+ 0 0 160 2,-0.2 4,-2.9 1,-0.2 5,-0.9 0.865 106.4 60.4 -69.8 -35.0 134.7 -42.6 20.7 175 473 A L H >>S+ 0 0 8 3,-0.2 5,-2.9 2,-0.2 4,-0.6 0.922 113.8 38.1 -56.3 -41.7 132.2 -40.6 22.8 176 474 A L H <>S+ 0 0 0 -4,-1.8 5,-2.6 3,-0.2 -2,-0.2 0.972 125.7 34.0 -71.3 -56.0 129.9 -43.7 22.5 177 475 A V H <5S+ 0 0 69 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.818 128.4 32.4 -77.7 -29.0 132.5 -46.5 22.8 178 476 A E H <5S+ 0 0 105 -4,-2.9 -1,-0.2 -5,-0.2 -3,-0.2 0.637 133.1 18.8-104.1 -16.4 135.0 -45.0 25.2 179 477 A L T X S+ 0 0 43 0, 0.0 4,-1.5 0, 0.0 3,-0.3 0.899 112.2 54.6 -63.0 -35.4 131.6 -47.9 29.7 183 481 A L H X S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.869 99.4 62.3 -62.1 -36.1 129.8 -45.4 31.9 184 482 A S H X S+ 0 0 3 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.893 103.5 48.4 -56.1 -43.3 126.6 -47.4 31.5 185 483 A S H X S+ 0 0 73 -4,-1.2 4,-1.7 -3,-0.3 -1,-0.2 0.865 111.0 50.3 -64.4 -40.0 128.2 -50.4 33.2 186 484 A I H X S+ 0 0 12 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.920 111.0 48.1 -65.6 -45.4 129.4 -48.3 36.0 187 485 A L H X S+ 0 0 0 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.897 107.0 57.4 -60.1 -41.6 126.0 -46.8 36.6 188 486 A A H X S+ 0 0 2 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.927 108.4 47.2 -54.3 -43.6 124.5 -50.3 36.5 189 487 A E H X S+ 0 0 100 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.921 112.4 48.7 -63.8 -47.9 126.8 -51.2 39.4 190 488 A M H X S+ 0 0 6 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.917 112.7 46.9 -56.7 -50.2 125.9 -48.0 41.3 191 489 A E H < S+ 0 0 1 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.929 114.6 47.0 -61.5 -44.8 122.1 -48.5 40.9 192 490 A F H < S+ 0 0 72 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.865 111.0 51.0 -69.1 -36.6 122.3 -52.2 41.8 193 491 A A H < S- 0 0 23 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.922 94.1-174.7 -63.0 -43.5 124.4 -51.6 44.9 194 492 A G < - 0 0 3 -4,-2.1 2,-0.4 -5,-0.2 111,-0.2 0.013 27.1 -83.4 69.9 177.5 122.0 -48.9 46.1 195 493 A V E -F 304 0B 7 109,-2.1 109,-2.3 -4,-0.1 2,-0.2 -0.980 37.9-123.0-122.2 136.0 122.4 -46.6 49.1 196 494 A K E -FG 303 343B 77 147,-0.7 147,-2.3 -2,-0.4 2,-0.4 -0.553 25.9-156.5 -81.7 142.3 121.5 -47.6 52.7 197 495 A V E - G 0 342B 2 105,-2.7 2,-1.3 -2,-0.2 145,-0.2 -0.940 20.2-134.5-127.8 137.9 119.0 -45.6 54.6 198 496 A D > + 0 0 56 143,-2.5 4,-1.6 -2,-0.4 5,-0.1 -0.748 29.5 178.2 -89.4 88.3 118.5 -45.1 58.3 199 497 A T H > S+ 0 0 13 -2,-1.3 4,-2.9 1,-0.2 5,-0.2 0.848 74.2 60.4 -66.9 -35.5 114.7 -45.4 58.2 200 498 A K H > S+ 0 0 168 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.953 106.2 49.3 -54.2 -46.3 114.2 -45.1 62.0 201 499 A R H > S+ 0 0 97 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.904 112.0 46.7 -62.7 -45.0 115.8 -41.7 61.7 202 500 A L H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.914 110.8 52.3 -63.1 -41.4 113.6 -40.6 58.8 203 501 A E H X S+ 0 0 112 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.899 110.9 48.1 -64.0 -38.4 110.4 -41.9 60.6 204 502 A Q H X S+ 0 0 108 -4,-2.4 4,-2.4 -5,-0.2 5,-0.3 0.951 110.7 50.4 -64.2 -48.4 111.3 -39.9 63.7 205 503 A M H X S+ 0 0 33 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.912 110.5 51.5 -53.9 -42.9 112.0 -36.8 61.6 206 504 A G H X S+ 0 0 9 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.906 107.7 51.3 -62.5 -42.9 108.6 -37.3 59.9 207 505 A K H X S+ 0 0 127 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.962 114.7 42.6 -59.3 -49.9 106.9 -37.6 63.3 208 506 A E H X S+ 0 0 99 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.868 112.8 53.5 -62.9 -40.3 108.5 -34.3 64.5 209 507 A L H X S+ 0 0 15 -4,-2.7 4,-2.6 -5,-0.3 -1,-0.2 0.862 103.0 56.9 -65.6 -38.4 107.8 -32.6 61.1 210 508 A A H X S+ 0 0 49 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.917 107.3 49.8 -58.1 -41.5 104.1 -33.5 61.3 211 509 A E H X S+ 0 0 117 -4,-1.4 4,-1.6 1,-0.2 -2,-0.2 0.931 112.7 46.1 -62.1 -47.0 103.9 -31.7 64.6 212 510 A Q H X S+ 0 0 59 -4,-2.0 4,-2.8 2,-0.2 5,-0.3 0.881 108.2 55.3 -68.1 -38.3 105.7 -28.6 63.3 213 511 A L H X S+ 0 0 23 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.924 107.8 50.8 -60.1 -41.6 103.6 -28.5 60.1 214 512 A G H X S+ 0 0 30 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.879 111.6 48.5 -61.7 -37.5 100.5 -28.4 62.2 215 513 A T H X S+ 0 0 100 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.919 114.8 42.3 -68.5 -46.4 101.9 -25.5 64.3 216 514 A V H X S+ 0 0 15 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.909 113.0 55.1 -68.7 -41.2 102.9 -23.4 61.3 217 515 A E H X S+ 0 0 58 -4,-2.8 4,-2.1 -5,-0.3 5,-0.2 0.950 108.7 46.2 -55.9 -53.3 99.6 -24.2 59.5 218 516 A Q H X S+ 0 0 108 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.870 111.1 52.7 -62.8 -35.3 97.5 -23.0 62.4 219 517 A R H X S+ 0 0 96 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.855 107.4 52.6 -68.9 -35.6 99.6 -19.8 62.8 220 518 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.897 107.4 50.8 -65.0 -41.7 99.1 -19.1 59.1 221 519 A Y H X>S+ 0 0 23 -4,-2.1 5,-1.6 2,-0.2 4,-1.3 0.852 110.2 51.7 -63.4 -34.4 95.3 -19.4 59.4 222 520 A E H <5S+ 0 0 134 -4,-1.7 3,-0.3 2,-0.2 -2,-0.2 0.954 111.5 45.0 -65.5 -49.2 95.5 -17.0 62.4 223 521 A L H <5S+ 0 0 29 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.861 118.0 44.7 -62.9 -35.8 97.5 -14.5 60.4 224 522 A A H <5S- 0 0 1 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.668 101.1-135.3 -80.8 -19.9 95.1 -14.9 57.4 225 523 A G T <5S+ 0 0 58 -4,-1.3 2,-0.3 -3,-0.3 -3,-0.2 0.748 78.7 66.5 67.8 26.1 92.0 -14.8 59.6 226 524 A Q S - 0 0 76 -2,-0.3 3,-1.5 1,-0.2 7,-0.3 -0.704 35.8-168.7 -80.4 108.8 94.6 -24.9 51.5 230 528 A I T 3 S+ 0 0 2 -2,-0.9 -1,-0.2 1,-0.3 50,-0.1 0.724 85.0 61.1 -72.1 -20.9 98.1 -23.4 51.8 231 529 A N T 3 S+ 0 0 92 1,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.256 86.7 86.2 -90.4 13.1 99.3 -25.9 49.3 232 530 A S <> - 0 0 26 -3,-1.5 4,-3.0 1,-0.1 5,-0.3 -0.899 60.8-164.7-113.2 100.7 97.0 -24.6 46.6 233 531 A P H > S+ 0 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0 45 1,-0.1 4,-2.6 4,-0.1 5,-0.2 -0.133 62.3-106.2 -62.0 160.8 106.3 -18.0 43.6 260 558 A A H > S+ 0 0 44 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.890 122.1 53.7 -54.7 -39.0 109.0 -17.9 46.3 261 559 A D H > S+ 0 0 71 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.907 109.6 46.9 -66.0 -39.9 110.4 -14.8 44.6 262 560 A V H > S+ 0 0 7 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.940 112.4 49.1 -66.7 -45.7 107.0 -13.0 44.6 263 561 A L H >< S+ 0 0 0 -4,-2.6 3,-0.7 1,-0.2 4,-0.5 0.891 107.7 54.8 -63.6 -39.1 106.4 -13.9 48.3 264 562 A E H >< S+ 0 0 103 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.921 107.5 50.9 -57.7 -40.3 109.8 -12.6 49.3 265 563 A K H 3< S+ 0 0 33 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.691 104.9 56.8 -74.4 -16.5 109.0 -9.3 47.7 266 564 A L T XX S+ 0 0 0 -4,-1.0 3,-2.6 -3,-0.7 4,-1.3 0.472 76.0 100.8 -89.3 -4.0 105.8 -9.0 49.6 267 565 A A T <4 S+ 0 0 31 -3,-1.3 -1,-0.2 -4,-0.5 -2,-0.1 0.826 74.9 59.5 -54.1 -34.2 107.5 -9.3 52.9 268 566 A P T 34 S+ 0 0 113 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.615 108.2 46.9 -70.1 -5.9 107.3 -5.6 53.5 269 567 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K G >< S+ 0 0 75 -4,-1.3 3,-1.8 1,-0.3 4,-0.3 0.698 76.1 78.2 -66.6 -17.6 119.5 -33.2 58.1 338 636 A I G X S+ 0 0 4 -3,-2.4 3,-2.0 1,-0.3 -1,-0.3 0.865 84.1 65.8 -53.7 -33.4 117.8 -35.6 55.7 339 637 A R G X S+ 0 0 22 -3,-1.8 3,-1.5 -4,-0.3 236,-1.3 0.673 82.0 73.1 -69.0 -16.6 121.4 -36.5 54.7 340 638 A Q G < S+ 0 0 29 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.685 91.4 61.7 -65.2 -15.4 122.0 -38.0 58.2 341 639 A A G < S+ 0 0 0 -3,-2.0 -143,-2.5 -4,-0.3 2,-0.8 0.464 82.3 86.6 -93.1 -2.1 119.8 -40.8 57.0 342 640 A F E < +G 197 0B 1 -3,-1.5 232,-2.3 -145,-0.2 233,-0.3 -0.886 64.7 166.5-100.9 108.6 122.1 -41.8 54.1 343 641 A V E -G 196 0B 26 -147,-2.3 -147,-0.7 -2,-0.8 230,-0.2 -0.770 39.7 -81.3-127.4 162.3 124.5 -44.2 55.7 344 642 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 -0.247 32.3-131.7 -65.5 153.9 127.2 -46.7 54.7 345 643 A S S S+ 0 0 21 5,-0.1 2,-0.3 -151,-0.1 -148,-0.1 0.521 85.5 47.0 -86.0 -8.2 126.0 -50.2 53.7 346 644 A E S > S- 0 0 115 192,-0.1 3,-1.2 -150,-0.1 2,-0.1 -0.927 93.8 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356 654 A Y E - L 0 566E 3 176,-2.9 2,-0.8 -2,-0.4 3,-0.4 -0.595 30.9-126.6 -68.1 137.4 134.5 -30.0 41.7 357 655 A S S S- 0 0 20 208,-2.8 208,-0.4 -2,-0.3 5,-0.1 -0.777 78.4 -27.4 -88.3 109.1 134.9 -26.4 42.7 358 656 A Q S > S+ 0 0 35 -2,-0.8 4,-2.0 1,-0.1 3,-0.4 0.865 76.3 167.8 62.3 44.7 133.2 -24.1 40.2 359 657 A I H > S+ 0 0 5 -3,-0.4 4,-2.5 1,-0.2 5,-0.2 0.865 70.5 54.6 -66.1 -35.0 133.6 -26.4 37.3 360 658 A E H > S+ 0 0 16 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.872 109.6 46.7 -62.6 -39.0 131.2 -24.4 35.0 361 659 A L H > S+ 0 0 2 -3,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.862 113.1 49.3 -74.0 -34.8 133.2 -21.1 35.5 362 660 A R H X S+ 0 0 3 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.896 111.6 48.8 -66.8 -43.1 136.5 -22.9 34.9 363 661 A V H X S+ 0 0 2 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.922 110.3 51.9 -60.5 -43.6 135.1 -24.5 31.7 364 662 A L H X S+ 0 0 5 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.935 108.5 51.3 -58.9 -42.7 133.8 -21.0 30.7 365 663 A A H X>S+ 0 0 0 -4,-2.4 4,-1.3 1,-0.2 5,-0.8 0.945 112.8 46.2 -57.8 -48.4 137.4 -19.7 31.3 366 664 A H H <5S+ 0 0 25 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.939 117.1 41.2 -58.3 -52.7 138.7 -22.5 29.1 367 665 A I H <5S+ 0 0 44 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.899 118.5 44.2 -71.6 -36.3 136.2 -22.1 26.2 368 666 A A H <5S- 0 0 10 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.671 93.0-144.7 -81.1 -16.9 136.2 -18.3 26.1 369 667 A E T <5 + 0 0 108 -4,-1.3 2,-0.6 -5,-0.3 -3,-0.2 0.898 33.2 172.1 51.4 44.3 140.0 -18.1 26.5 370 668 A D >< - 0 0 2 -5,-0.8 4,-2.8 -6,-0.2 5,-0.2 -0.778 27.6-151.2 -85.8 117.9 139.5 -14.9 28.5 371 669 A D H > S+ 0 0 118 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.905 92.9 49.6 -58.0 -43.7 142.9 -13.9 30.0 372 670 A N H > S+ 0 0 52 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.917 115.0 42.2 -65.5 -45.5 141.4 -12.3 33.1 373 671 A L H > S+ 0 0 2 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.937 114.9 51.5 -67.4 -45.3 139.2 -15.2 34.0 374 672 A M H X S+ 0 0 8 -4,-2.8 4,-3.4 1,-0.2 -2,-0.2 0.915 110.0 49.5 -55.9 -44.5 141.9 -17.8 33.2 375 673 A E H X S+ 0 0 79 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.884 105.3 56.9 -66.3 -38.1 144.4 -15.9 35.4 376 674 A A H <>S+ 0 0 1 -4,-1.8 5,-2.8 -5,-0.2 -1,-0.2 0.945 115.7 37.3 -59.0 -46.2 142.0 -15.8 38.3 377 675 A F H ><5S+ 0 0 1 -4,-2.0 3,-1.7 3,-0.2 -2,-0.2 0.911 110.9 58.7 -71.4 -41.0 141.8 -19.6 38.2 378 676 A R H 3<5S+ 0 0 96 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.841 116.6 36.4 -57.0 -30.9 145.4 -20.1 37.3 379 677 A R T 3<5S- 0 0 157 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.353 111.1-124.5 -99.6 3.0 146.2 -18.3 40.6 380 678 A D T < 5 + 0 0 81 -3,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.855 49.1 165.6 49.2 46.8 143.2 -19.8 42.4 381 679 A L < - 0 0 92 -5,-2.8 2,-0.5 -6,-0.2 -1,-0.2 -0.645 51.4 -93.4 -84.5 145.5 141.8 -16.4 43.4 382 680 A D > - 0 0 67 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 -0.475 36.1-157.7 -63.1 112.3 138.2 -16.3 44.7 383 681 A I H > S+ 0 0 0 -2,-0.5 4,-2.7 2,-0.2 5,-0.2 0.824 88.3 53.2 -69.6 -31.3 136.2 -15.6 41.5 384 682 A H H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.938 111.3 46.0 -68.7 -42.3 133.2 -14.2 43.3 385 683 A T H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.901 112.5 52.7 -62.8 -39.6 135.3 -11.7 45.2 386 684 A K H X S+ 0 0 42 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.950 110.2 45.8 -60.1 -51.6 137.1 -10.9 42.0 387 685 A T H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.890 110.3 55.7 -62.0 -35.9 133.8 -10.2 40.2 388 686 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.4 0.946 104.1 52.6 -59.7 -48.6 132.6 -8.1 43.1 389 687 A M H X>S+ 0 0 55 -4,-2.3 5,-1.5 1,-0.2 4,-0.6 0.875 115.8 42.4 -53.5 -37.7 135.7 -5.9 43.0 390 688 A D H <5S+ 0 0 35 -4,-1.6 -2,-0.2 3,-0.2 -1,-0.2 0.897 116.5 42.9 -78.3 -44.4 134.9 -5.3 39.3 391 689 A I H <5S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.729 127.3 33.1 -79.2 -21.9 131.1 -4.8 39.4 392 690 A F H <5S- 0 0 49 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.491 103.6-132.0-104.9 -11.9 131.2 -2.6 42.5 393 691 A Q T <5 + 0 0 145 -4,-0.6 2,-0.3 -5,-0.4 -3,-0.2 0.968 59.7 125.5 59.8 58.5 134.6 -1.1 41.6 394 692 A V < - 0 0 34 -5,-1.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.923 63.3 -95.3-138.9 165.0 136.3 -1.6 45.0 395 693 A S > - 0 0 55 -2,-0.3 3,-0.8 1,-0.1 4,-0.4 -0.358 46.9-100.2 -74.9 163.5 139.4 -3.1 46.5 396 694 A E G > S+ 0 0 129 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.803 120.9 59.2 -58.4 -32.5 139.2 -6.6 47.9 397 695 A D G 3 S+ 0 0 154 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.897 100.1 55.5 -62.3 -41.5 138.9 -5.3 51.5 398 696 A E G < S+ 0 0 116 -3,-0.8 2,-0.9 2,-0.0 -1,-0.2 0.475 78.4 110.8 -77.7 -1.6 135.7 -3.3 50.7 399 697 A V < - 0 0 24 -3,-0.9 -10,-0.1 -4,-0.4 -14,-0.0 -0.653 55.8-158.0 -78.8 109.7 133.8 -6.4 49.4 400 698 A T > - 0 0 66 -2,-0.9 4,-2.2 1,-0.1 5,-0.2 -0.452 31.7-104.8 -78.6 156.9 131.1 -7.3 52.0 401 699 A P H > S+ 0 0 96 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.846 123.0 51.9 -48.8 -40.0 129.6 -10.8 52.1 402 700 A N H > S+ 0 0 74 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.921 105.5 53.2 -68.9 -42.5 126.5 -9.5 50.4 403 701 A M H > S+ 0 0 27 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.895 108.5 52.5 -55.8 -40.4 128.5 -7.9 47.6 404 702 A R H X S+ 0 0 75 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.901 108.0 49.6 -62.9 -40.0 130.1 -11.3 47.1 405 703 A R H X S+ 0 0 132 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.857 111.4 48.9 -70.5 -31.6 126.7 -13.0 46.9 406 704 A Q H X S+ 0 0 27 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.922 111.0 50.0 -67.8 -44.7 125.5 -10.5 44.3 407 705 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.847 107.7 55.3 -62.6 -33.0 128.7 -11.0 42.3 408 706 A K H X S+ 0 0 73 -4,-2.0 4,-2.4 2,-0.2 5,-0.4 0.901 104.9 52.0 -64.8 -40.9 128.0 -14.8 42.6 409 707 A A H X S+ 0 0 29 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.869 111.6 47.7 -62.9 -36.6 124.6 -14.2 41.0 410 708 A V H X S+ 0 0 0 -4,-1.8 4,-2.9 3,-0.2 5,-0.3 0.944 109.1 53.6 -67.4 -48.3 126.3 -12.3 38.2 411 709 A N H X S+ 0 0 1 -4,-2.9 4,-0.8 1,-0.2 -2,-0.2 0.906 119.8 31.1 -56.1 -48.8 128.9 -15.0 37.7 412 710 A Y H X S+ 0 0 55 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.870 115.8 60.6 -78.3 -35.1 126.5 -17.9 37.3 413 711 A G H ><>S+ 0 0 7 -4,-2.1 5,-2.9 -5,-0.4 3,-0.6 0.902 101.6 52.3 -56.5 -44.5 123.8 -15.7 35.7 414 712 A I H ><5S+ 0 0 8 -4,-2.9 3,-1.1 1,-0.2 -1,-0.2 0.902 107.3 54.0 -57.9 -37.9 126.1 -14.7 32.8 415 713 A V H 3<5S+ 0 0 7 -4,-0.8 -1,-0.2 -5,-0.3 -2,-0.2 0.764 111.7 44.7 -68.3 -25.5 126.6 -18.5 32.3 416 714 A Y T <<5S- 0 0 119 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.285 119.1-108.6-103.9 8.4 122.8 -19.0 32.1 417 715 A G T < 5 - 0 0 17 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.772 51.2-176.7 75.0 28.1 122.2 -16.0 29.8 418 716 A I < - 0 0 42 -5,-2.9 2,-0.2 -6,-0.1 -1,-0.1 -0.195 14.6-141.5 -62.1 148.5 120.5 -13.8 32.5 419 717 A S > - 0 0 58 1,-0.1 4,-2.4 19,-0.0 5,-0.2 -0.591 30.6-103.3 -96.5 169.0 119.1 -10.3 31.5 420 718 A D H > S+ 0 0 49 1,-0.2 4,-2.7 -2,-0.2 5,-0.2 0.865 123.9 55.6 -58.8 -33.8 119.3 -7.2 33.7 421 719 A Y H > S+ 0 0 116 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.955 109.8 43.0 -63.3 -51.2 115.6 -7.8 34.5 422 720 A G H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.877 115.4 49.2 -64.5 -37.2 116.2 -11.3 35.7 423 721 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.930 112.6 48.0 -67.5 -43.6 119.3 -10.3 37.7 424 722 A A H X>S+ 0 0 4 -4,-2.7 5,-1.6 -5,-0.2 4,-1.1 0.899 114.0 47.3 -62.6 -41.2 117.4 -7.4 39.2 425 723 A Q H <5S+ 0 0 69 -4,-2.6 -1,-0.2 3,-0.2 -2,-0.2 0.898 112.6 48.5 -69.0 -38.6 114.5 -9.6 40.1 426 724 A N H <5S+ 0 0 97 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.906 122.1 33.1 -71.2 -37.2 116.8 -12.3 41.6 427 725 A L H <5S- 0 0 39 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.532 102.6-130.2 -93.3 -8.0 118.8 -9.9 43.8 428 726 A N T <5 + 0 0 113 -4,-1.1 2,-0.3 -5,-0.2 -3,-0.2 0.949 63.8 130.0 53.7 52.7 115.8 -7.6 44.4 429 727 A I < - 0 0 31 -5,-1.6 -1,-0.2 -6,-0.2 -2,-0.1 -0.760 68.1 -65.5-126.0 174.1 117.9 -4.6 43.4 430 728 A S > - 0 0 51 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.310 37.1-138.7 -61.1 139.7 117.5 -1.7 41.0 431 729 A R H > S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.782 104.2 59.5 -74.1 -25.0 117.4 -2.7 37.3 432 730 A K H > S+ 0 0 156 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.919 109.2 43.1 -67.2 -40.5 119.5 0.2 36.4 433 731 A E H > S+ 0 0 106 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.923 109.9 55.8 -69.9 -45.7 122.3 -1.2 38.7 434 732 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.3 -1,-0.2 0.879 106.5 51.6 -53.6 -43.0 121.8 -4.8 37.5 435 733 A A H X S+ 0 0 35 -4,-2.0 4,-2.3 1,-0.2 -1,-0.3 0.885 109.0 50.8 -60.5 -41.8 122.4 -3.5 34.0 436 734 A E H X S+ 0 0 63 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.886 105.8 55.7 -61.8 -41.6 125.6 -1.9 35.2 437 735 A F H X S+ 0 0 10 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.922 111.2 44.3 -55.6 -47.6 126.8 -5.1 36.9 438 736 A I H X S+ 0 0 25 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.928 113.3 49.4 -66.9 -43.9 126.4 -6.9 33.6 439 737 A E H X S+ 0 0 101 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.907 113.7 47.4 -62.8 -41.2 128.1 -4.2 31.5 440 738 A R H X S+ 0 0 84 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.904 108.7 54.3 -67.0 -41.1 131.0 -4.1 34.0 441 739 A Y H X S+ 0 0 1 -4,-2.5 4,-1.7 -5,-0.2 -2,-0.2 0.941 112.3 43.6 -54.1 -49.3 131.3 -7.9 34.0 442 740 A F H < S+ 0 0 32 -4,-2.3 7,-0.3 1,-0.2 -1,-0.2 0.820 111.0 54.3 -70.8 -31.1 131.6 -7.8 30.2 443 741 A E H < S+ 0 0 133 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.836 115.2 41.4 -66.5 -33.0 134.0 -4.9 30.3 444 742 A S H < S+ 0 0 29 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.700 125.0 34.4 -86.8 -23.9 136.2 -6.9 32.7 445 743 A F >X + 0 0 0 -4,-1.7 3,-1.6 -5,-0.2 4,-1.1 -0.498 67.6 162.2-132.0 61.5 135.9 -10.3 30.9 446 744 A P H 3> S+ 0 0 54 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.764 71.9 64.1 -58.4 -29.4 135.8 -9.2 27.3 447 745 A G H 3> S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.827 100.2 52.4 -64.7 -32.2 136.7 -12.8 26.2 448 746 A V H <> S+ 0 0 1 -3,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.922 108.4 49.5 -69.2 -41.9 133.4 -14.0 27.7 449 747 A K H X S+ 0 0 104 -4,-1.1 4,-2.0 -7,-0.3 -2,-0.2 0.918 111.8 49.1 -61.6 -44.1 131.4 -11.4 25.7 450 748 A R H X S+ 0 0 130 -4,-2.4 4,-3.4 1,-0.2 -2,-0.2 0.909 109.9 53.0 -62.1 -41.9 133.3 -12.5 22.5 451 749 A Y H X S+ 0 0 17 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.937 107.6 49.7 -55.7 -50.2 132.5 -16.1 23.4 452 750 A M H X S+ 0 0 41 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.916 115.6 43.5 -57.8 -41.9 128.8 -15.4 23.7 453 751 A E H X S+ 0 0 107 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.957 116.6 47.0 -66.5 -48.6 128.8 -13.6 20.4 454 752 A N H X S+ 0 0 105 -4,-3.4 4,-2.8 1,-0.2 -2,-0.2 0.900 110.6 49.4 -64.0 -44.8 130.9 -16.2 18.6 455 753 A I H X S+ 0 0 15 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.839 110.1 51.3 -69.1 -31.0 129.0 -19.3 19.9 456 754 A V H X S+ 0 0 15 -4,-1.3 4,-1.9 -5,-0.3 -1,-0.2 0.916 111.5 48.9 -68.7 -41.3 125.7 -17.8 18.8 457 755 A Q H X S+ 0 0 82 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.906 110.9 50.0 -62.5 -44.5 127.2 -17.1 15.4 458 756 A E H X S+ 0 0 53 -4,-2.8 4,-2.9 1,-0.2 5,-0.5 0.904 109.9 50.4 -61.1 -42.8 128.5 -20.7 15.2 459 757 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.885 109.7 50.1 -63.9 -40.6 125.1 -22.2 16.1 460 758 A K H < S+ 0 0 55 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.882 116.6 42.7 -63.2 -39.5 123.4 -20.1 13.5 461 759 A Q H < S+ 0 0 100 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.869 128.1 25.7 -77.3 -39.6 125.9 -21.3 10.9 462 760 A K H < S- 0 0 71 -4,-2.9 -3,-0.2 2,-0.2 -2,-0.2 0.710 95.6-127.5 -96.5 -27.5 126.1 -25.0 11.8 463 761 A G S < S+ 0 0 24 -4,-2.2 12,-2.1 -5,-0.5 2,-0.3 0.465 81.5 51.6 90.4 2.7 122.7 -25.5 13.4 464 762 A Y E -N 474 0F 6 -6,-0.4 2,-0.3 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-67.0 145.8 146.3 -40.2 -14.8 711 425 D D H >> S+ 0 0 35 1,-0.2 4,-2.7 2,-0.2 3,-0.5 0.863 113.2 56.7 -55.7 -39.6 143.6 -41.6 -17.1 712 426 D E H 3> S+ 0 0 118 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.832 102.0 56.1 -63.9 -32.4 145.0 -39.7 -20.0 713 427 D A H <4 S+ 0 0 49 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.823 116.1 37.1 -65.6 -32.1 148.4 -41.3 -19.6 714 428 D V H << S+ 0 0 20 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.886 128.7 28.6 -87.9 -44.1 146.8 -44.7 -19.9 715 429 D Y H < S- 0 0 8 -4,-2.7 7,-2.7 1,-0.2 -3,-0.2 0.675 96.1-143.2 -96.8 -22.5 144.1 -44.3 -22.5 716 430 D G < - 0 0 27 -4,-1.6 2,-0.3 -5,-0.4 -1,-0.2 -0.318 22.5 -81.6 82.3-171.0 145.6 -41.4 -24.6 717 431 D K > - 0 0 138 -2,-0.1 3,-1.9 4,-0.1 4,-0.0 -0.948 69.9 -16.8-139.3 155.3 143.7 -38.6 -26.2 718 432 D G G > S- 0 0 67 -2,-0.3 3,-1.8 1,-0.3 0, 0.0 -0.281 126.6 -8.6 60.8-137.0 141.6 -37.6 -29.2 719 433 D A G 3 S+ 0 0 116 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.579 135.2 63.8 -65.8 -12.5 141.8 -39.9 -32.2 720 434 D K G < S+ 0 0 174 -3,-1.9 -1,-0.3 2,-0.0 -2,-0.2 0.453 76.4 122.5 -89.8 -1.4 144.7 -41.7 -30.4 721 435 D R < + 0 0 96 -3,-1.8 2,-0.3 -5,-0.2 -5,-0.2 -0.408 32.4 147.3 -73.1 133.2 142.3 -42.8 -27.5 722 436 D A - 0 0 59 -7,-2.7 -2,-0.0 -2,-0.2 -3,-0.0 -0.990 51.7-106.8-162.3 148.1 142.2 -46.6 -26.8 723 437 D V - 0 0 69 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.685 49.0-132.8 -73.7 127.0 141.7 -49.2 -24.1 724 438 D P - 0 0 34 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.154 34.9 -60.8 -81.2-178.4 145.2 -50.8 -23.6 725 439 D D >> - 0 0 118 1,-0.1 4,-2.4 3,-0.1 3,-0.9 -0.162 59.7-103.6 -57.9 148.4 146.3 -54.4 -23.4 726 440 D E H 3> S+ 0 0 70 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.845 117.6 51.4 -50.7 -47.1 144.6 -56.3 -20.5 727 441 D P H 3> S+ 0 0 74 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.884 113.4 46.3 -61.5 -33.7 147.6 -56.4 -18.1 728 442 D V H <> S+ 0 0 44 -3,-0.9 4,-1.9 2,-0.2 -2,-0.2 0.920 115.0 46.4 -70.8 -46.1 148.0 -52.6 -18.5 729 443 D L H X S+ 0 0 9 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.943 112.1 51.7 -57.8 -47.7 144.3 -52.0 -18.0 730 444 D A H X S+ 0 0 0 -4,-3.3 4,-2.4 -5,-0.2 5,-0.2 0.905 108.7 48.5 -61.9 -44.7 144.1 -54.3 -15.0 731 445 D E H X S+ 0 0 52 -4,-2.0 4,-2.9 -5,-0.3 -1,-0.2 0.928 111.9 51.3 -62.5 -41.3 147.0 -52.7 -13.2 732 446 D H H X S+ 0 0 7 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.937 111.1 45.7 -60.8 -47.5 145.5 -49.2 -13.8 733 447 D L H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.908 113.8 49.3 -65.6 -40.8 142.1 -50.2 -12.5 734 448 D V H X S+ 0 0 0 -4,-2.4 4,-3.0 -5,-0.2 -2,-0.2 0.914 110.7 50.2 -61.5 -45.3 143.6 -51.9 -9.4 735 449 D R H X S+ 0 0 11 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.874 110.5 50.6 -62.0 -37.1 145.8 -48.8 -8.7 736 450 D K H X S+ 0 0 9 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.945 112.6 45.7 -63.8 -46.3 142.7 -46.6 -8.9 737 451 D A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.916 112.1 51.9 -63.4 -44.3 140.8 -48.8 -6.5 738 452 D A H X S+ 0 0 6 -4,-3.0 4,-1.9 2,-0.2 -1,-0.2 0.880 109.2 50.6 -56.9 -41.3 143.8 -49.0 -4.2 739 453 D A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.946 110.4 48.1 -64.1 -46.9 144.0 -45.2 -4.2 740 454 D I H X S+ 0 0 0 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.911 110.5 53.6 -57.1 -41.9 140.2 -44.8 -3.4 741 455 D W H < S+ 0 0 86 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.898 115.2 38.7 -61.1 -42.7 140.7 -47.4 -0.6 742 456 D E H < S+ 0 0 117 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.793 116.1 51.1 -77.9 -30.9 143.5 -45.4 1.0 743 457 D L H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.632 84.7 83.8 -90.0 -17.9 142.1 -41.9 0.4 744 458 D E H X S+ 0 0 22 -4,-1.5 4,-2.9 -5,-0.2 5,-0.2 0.936 92.2 47.3 -50.2 -54.3 138.6 -42.3 1.9 745 459 D R H > S+ 0 0 93 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.946 113.9 44.8 -61.1 -50.0 139.7 -41.6 5.5 746 460 D P H > S+ 0 0 40 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.886 115.3 49.3 -65.1 -35.5 141.8 -38.5 4.8 747 461 D F H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.945 112.7 46.4 -64.3 -46.4 139.2 -37.0 2.5 748 462 D L H X S+ 0 0 28 -4,-2.9 4,-2.6 -5,-0.3 -1,-0.2 0.881 110.9 53.9 -62.6 -38.9 136.4 -37.7 5.1 749 463 D D H X S+ 0 0 38 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.918 111.1 44.7 -62.1 -41.5 138.6 -36.2 7.8 750 464 D E H X S+ 0 0 42 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.917 111.0 53.3 -69.9 -41.8 139.1 -33.0 5.9 751 465 D L H <>S+ 0 0 0 -4,-2.6 5,-3.3 1,-0.2 6,-0.6 0.931 108.7 51.0 -57.6 -44.9 135.5 -32.7 4.9 752 466 D R H ><5S+ 0 0 50 -4,-2.6 3,-1.6 4,-0.3 -1,-0.2 0.931 108.4 51.1 -55.4 -48.2 134.6 -33.0 8.6 753 467 D R H 3<5S+ 0 0 167 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.864 111.7 48.5 -56.3 -36.6 137.0 -30.2 9.4 754 468 D N T 3<5S- 0 0 19 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.371 115.5-114.1 -84.4 -1.9 135.4 -28.1 6.7 755 469 D E T < 5S+ 0 0 18 -3,-1.6 -3,-0.2 -4,-0.3 4,-0.2 0.831 88.4 114.7 65.6 33.0 131.9 -28.8 8.0 756 470 D Q >< + 0 0 0 -5,-3.3 4,-2.0 -6,-0.2 -4,-0.3 0.277 33.0 102.1-116.0 8.0 131.2 -30.6 4.7 757 471 D D H > S+ 0 0 4 -6,-0.6 4,-2.2 1,-0.2 5,-0.2 0.902 91.4 38.0 -59.5 -42.8 130.7 -34.2 6.0 758 472 D R H >>S+ 0 0 42 2,-0.2 4,-2.5 1,-0.2 5,-0.9 0.825 108.4 63.7 -79.0 -29.6 127.0 -34.0 5.6 759 473 D L H 4>S+ 0 0 7 3,-0.2 5,-3.1 1,-0.2 4,-0.4 0.918 112.6 36.7 -58.3 -39.8 127.2 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143,-3.0 4,-1.7 -2,-0.4 5,-0.1 -0.766 28.0 179.4 -84.8 94.1 108.5 -35.7 -30.6 783 497 D T H > S+ 0 0 15 -2,-1.2 4,-3.5 2,-0.2 5,-0.3 0.828 74.8 59.7 -74.4 -28.9 110.9 -35.8 -33.5 784 498 D K H > S+ 0 0 157 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.944 107.2 48.0 -63.7 -40.2 108.2 -35.4 -36.2 785 499 D R H > S+ 0 0 108 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.902 115.8 43.8 -64.7 -40.2 107.3 -32.1 -34.6 786 500 D L H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.893 113.0 51.2 -66.6 -41.5 111.0 -31.1 -34.6 787 501 D E H X S+ 0 0 103 -4,-3.5 4,-2.1 1,-0.2 -2,-0.2 0.860 113.4 46.3 -68.4 -33.9 111.6 -32.5 -38.1 788 502 D Q H X S+ 0 0 90 -4,-2.4 4,-2.2 -5,-0.3 5,-0.2 0.936 111.2 50.5 -70.8 -45.2 108.6 -30.4 -39.2 789 503 D M H X S+ 0 0 30 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.835 112.0 51.5 -60.8 -31.8 109.8 -27.4 -37.3 790 504 D G H X S+ 0 0 7 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.908 108.4 45.9 -71.7 -46.9 113.2 -27.9 -39.0 791 505 D K H < S+ 0 0 137 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.893 116.8 47.8 -68.1 -35.5 112.1 -28.1 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108.3 51.2 -63.1 -46.2 119.0 -14.4 -45.4 802 516 D Q H X S+ 0 0 98 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.895 107.9 52.2 -61.9 -40.3 117.9 -13.0 -48.8 803 517 D R H X S+ 0 0 85 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.877 107.5 52.7 -63.3 -38.5 116.5 -9.8 -47.3 804 518 D I H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 6,-0.2 0.926 108.6 49.3 -63.5 -41.9 119.9 -9.3 -45.5 805 519 D Y H X>S+ 0 0 21 -4,-2.1 4,-1.8 1,-0.2 5,-1.3 0.920 109.9 53.0 -64.9 -40.6 121.8 -9.6 -48.8 806 520 D E H <5S+ 0 0 140 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.927 112.1 43.5 -57.0 -49.8 119.4 -7.2 -50.4 807 521 D L H <5S+ 0 0 29 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.851 116.9 46.6 -65.5 -34.8 120.0 -4.6 -47.6 808 522 D A H <5S- 0 0 0 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.730 102.7-133.2 -80.0 -22.0 123.7 -5.1 -47.6 809 523 D G T <5S+ 0 0 58 -4,-1.8 2,-0.3 -5,-0.2 -3,-0.2 0.625 79.6 63.4 77.6 17.9 123.8 -5.0 -51.4 810 524 D Q S - 0 0 75 -2,-0.3 3,-1.5 1,-0.2 7,-0.3 -0.734 35.5-170.4 -86.3 105.1 128.4 -15.1 -44.7 814 528 D I T 3 S+ 0 0 1 -2,-1.0 -1,-0.2 1,-0.3 6,-0.1 0.816 83.0 60.6 -66.9 -30.3 126.1 -13.7 -41.9 815 529 D N T 3 S+ 0 0 93 -3,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.248 87.5 86.1 -84.4 13.9 127.4 -16.3 -39.4 816 530 D S <> - 0 0 25 -3,-1.5 4,-2.9 1,-0.1 5,-0.3 -0.916 62.0-163.8-112.3 104.1 130.9 -15.0 -39.7 817 531 D P H > S+ 0 0 73 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.823 92.0 57.0 -55.5 -29.8 131.5 -12.1 -37.4 818 532 D K H > S+ 0 0 158 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.954 111.5 38.4 -62.1 -54.5 134.6 -11.3 -39.5 819 533 D Q H > S+ 0 0 84 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.902 116.5 53.3 -63.9 -39.0 132.7 -11.0 -42.8 820 534 D L H X S+ 0 0 0 -4,-2.9 4,-2.9 -7,-0.3 5,-0.2 0.884 104.3 55.5 -63.7 -40.4 129.8 -9.3 -41.1 821 535 D G H X>S+ 0 0 1 -4,-2.1 4,-2.9 -5,-0.3 5,-0.6 0.899 106.0 51.1 -60.8 -40.2 132.1 -6.7 -39.6 822 536 D V H X>S+ 0 0 52 -4,-1.6 5,-2.6 3,-0.2 4,-1.9 0.952 111.7 48.0 -62.7 -42.5 133.4 -5.8 -43.0 823 537 D I H <>S+ 0 0 3 -4,-1.9 5,-2.9 3,-0.2 6,-0.2 0.951 119.9 36.8 -62.7 -47.8 129.8 -5.3 -44.2 824 538 D L H <5S+ 0 0 0 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844 558 D A H > S+ 0 0 44 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.882 120.3 52.7 -57.1 -38.8 123.9 -8.4 -29.9 845 559 D D H > S+ 0 0 55 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.919 111.0 46.7 -64.0 -43.5 124.3 -5.5 -27.5 846 560 D V H > S+ 0 0 5 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.948 113.2 48.2 -59.1 -49.7 126.4 -3.6 -30.1 847 561 D L H >X S+ 0 0 0 -4,-2.8 3,-0.7 1,-0.2 4,-0.7 0.909 107.4 55.7 -63.3 -39.0 124.0 -4.4 -32.9 848 562 D E H >< S+ 0 0 99 -4,-2.5 3,-0.9 1,-0.3 -1,-0.2 0.908 108.2 49.3 -59.5 -37.3 121.0 -3.3 -30.8 849 563 D K H 3< S+ 0 0 37 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.707 107.6 54.6 -73.9 -21.4 122.8 0.1 -30.3 850 564 D L H XX S+ 0 0 0 -4,-1.2 3,-2.4 -3,-0.7 4,-1.0 0.494 77.2 101.9 -89.3 -0.9 123.4 0.4 -34.1 851 565 D A T << S+ 0 0 28 -3,-0.9 -1,-0.2 -4,-0.7 3,-0.2 0.783 72.9 60.5 -56.2 -31.3 119.7 -0.1 -34.9 852 566 D P T 34 S+ 0 0 109 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.603 104.7 51.0 -72.8 -7.7 119.1 3.7 -35.4 853 567 D Y T <4 S+ 0 0 139 -3,-2.4 2,-0.3 1,-0.3 -2,-0.2 0.743 120.6 7.2 -98.5 -28.9 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H H <5S+ 0 0 18 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.917 117.7 41.0 -63.0 -52.8 118.2 -14.0 4.1 951 665 D I H <5S+ 0 0 51 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.921 121.2 40.9 -67.4 -45.1 122.1 -13.7 4.1 952 666 D A H <5S- 0 0 15 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.677 92.9-145.0 -73.6 -22.6 122.2 -10.0 4.1 953 667 D E T <5 + 0 0 84 -4,-1.2 2,-0.6 -5,-0.3 -3,-0.2 0.899 30.2 175.5 49.6 47.6 119.4 -9.6 6.7 954 668 D D >< - 0 0 3 -5,-0.7 4,-2.7 -6,-0.3 5,-0.2 -0.733 26.3-147.0 -80.6 120.4 118.3 -6.4 4.9 955 669 D D H > S+ 0 0 119 -2,-0.6 4,-2.4 1,-0.2 5,-0.2 0.902 94.9 46.3 -58.9 -44.5 115.1 -5.4 6.7 956 670 D N H > S+ 0 0 80 72,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 114.1 46.8 -67.2 -40.6 113.5 -3.9 3.6 957 671 D L H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.913 113.7 49.0 -65.2 -44.1 114.3 -6.8 1.3 958 672 D M H X S+ 0 0 11 -4,-2.7 4,-2.3 -9,-0.2 -2,-0.2 0.920 111.1 50.0 -62.3 -40.1 113.1 -9.3 4.0 959 673 D E H X S+ 0 0 80 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.935 108.2 54.6 -62.9 -42.6 109.9 -7.3 4.4 960 674 D A H <>S+ 0 0 2 -4,-2.4 5,-2.5 1,-0.2 3,-0.2 0.926 112.0 41.6 -58.9 -47.5 109.3 -7.3 0.7 961 675 D F H ><5S+ 0 0 1 -4,-2.2 3,-1.5 1,-0.2 -1,-0.2 0.833 108.8 58.9 -72.8 -31.2 109.6 -11.0 0.4 962 676 D R H 3<5S+ 0 0 81 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.814 107.4 48.4 -62.7 -29.3 107.5 -11.6 3.6 963 677 D R T 3<5S- 0 0 163 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.386 116.5-123.4 -82.9 0.3 104.8 -9.6 1.7 964 678 D D T < 5 + 0 0 74 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.853 49.7 173.4 52.1 42.7 105.4 -11.9 -1.3 965 679 D L < - 0 0 55 -5,-2.5 2,-0.9 -6,-0.2 -1,-0.2 -0.401 44.8-110.7 -71.3 149.6 106.2 -8.9 -3.5 966 680 D D > - 0 0 55 1,-0.1 4,-2.2 -2,-0.1 3,-0.4 -0.820 34.0-152.3 -73.0 109.0 107.5 -9.2 -7.0 967 681 D I H > S+ 0 0 1 -2,-0.9 4,-2.4 1,-0.2 5,-0.2 0.747 88.5 57.4 -68.7 -22.2 110.9 -7.8 -6.2 968 682 D H H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.899 108.5 46.4 -75.5 -34.8 111.5 -6.4 -9.6 969 683 D T H > S+ 0 0 21 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.915 112.7 51.2 -68.8 -38.1 108.3 -4.3 -9.4 970 684 D K H X S+ 0 0 37 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.943 111.3 45.9 -64.5 -46.9 109.3 -3.2 -5.9 971 685 D T H X S+ 0 0 0 -4,-2.4 4,-3.4 2,-0.2 5,-0.3 0.923 110.7 54.6 -62.4 -40.4 112.8 -2.1 -7.0 972 686 D A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.4 0.937 106.4 51.5 -56.4 -47.2 111.3 -0.3 -10.0 973 687 D M H X>S+ 0 0 51 -4,-2.5 5,-1.2 1,-0.2 4,-0.7 0.912 115.1 42.6 -56.8 -44.1 109.0 1.6 -7.7 974 688 D D H <5S+ 0 0 40 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.939 117.9 42.1 -69.4 -48.8 112.0 2.7 -5.6 975 689 D I H <5S+ 0 0 1 -4,-3.4 -2,-0.2 1,-0.2 -3,-0.2 0.824 126.1 34.4 -74.2 -28.7 114.5 3.5 -8.4 976 690 D F H <5S- 0 0 39 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.543 102.0-133.9 -93.6 -9.4 112.0 5.3 -10.6 977 691 D Q T <5 + 0 0 128 -4,-0.7 2,-0.3 -5,-0.4 -3,-0.2 0.949 60.4 127.6 49.9 57.5 110.1 6.7 -7.6 978 692 D V < - 0 0 34 -5,-1.2 -1,-0.2 -6,-0.2 -2,-0.1 -0.853 61.9 -94.3-133.9 167.1 106.7 5.7 -9.0 979 693 D S > - 0 0 52 -2,-0.3 3,-1.1 -3,-0.1 4,-0.4 -0.341 41.5-103.3 -79.2 163.9 103.6 3.8 -7.9 980 694 D E G > S+ 0 0 126 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.843 122.0 55.2 -55.6 -34.7 103.0 0.1 -8.6 981 695 D D G 3 S+ 0 0 154 1,-0.2 -1,-0.3 3,-0.0 0, 0.0 0.759 101.8 58.6 -73.5 -22.5 100.6 1.0 -11.4 982 696 D E G < S+ 0 0 112 -3,-1.1 2,-0.9 2,-0.1 -1,-0.2 0.490 77.6 109.6 -83.7 -5.7 103.1 3.2 -13.1 983 697 D V < - 0 0 25 -3,-1.0 -10,-0.1 -4,-0.4 -14,-0.0 -0.635 55.1-159.7 -82.8 108.5 105.7 0.4 -13.6 984 698 D T > - 0 0 61 -2,-0.9 4,-2.6 1,-0.1 5,-0.2 -0.369 33.0-106.5 -75.8 160.0 105.9 -0.5 -17.2 985 699 D P H > S+ 0 0 96 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.826 123.8 52.6 -57.6 -29.8 107.3 -3.8 -18.5 986 700 D N H > S+ 0 0 77 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.903 107.5 49.9 -71.9 -43.9 110.4 -1.9 -19.6 987 701 D M H > S+ 0 0 29 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.908 110.9 50.4 -57.7 -42.1 110.8 -0.3 -16.1 988 702 D R H X S+ 0 0 78 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.915 108.8 51.3 -65.8 -40.3 110.5 -3.8 -14.5 989 703 D R H X S+ 0 0 138 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.892 110.9 48.8 -63.0 -36.4 113.1 -5.2 -16.9 990 704 D Q H X S+ 0 0 19 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.941 111.9 48.2 -68.4 -44.3 115.5 -2.4 -16.0 991 705 D A H X S+ 0 0 0 -4,-2.6 4,-3.5 1,-0.2 -2,-0.2 0.850 107.6 56.6 -63.7 -35.4 114.9 -3.0 -12.3 992 706 D K H X S+ 0 0 95 -4,-2.5 4,-2.2 2,-0.2 5,-0.3 0.933 106.8 48.9 -59.7 -45.3 115.4 -6.7 -12.8 993 707 D A H X S+ 0 0 33 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.879 113.0 47.7 -62.1 -39.3 118.8 -5.9 -14.2 994 708 D V H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.954 109.1 55.1 -62.8 -50.2 119.6 -3.7 -11.2 995 709 D N H < S+ 0 0 2 -4,-3.5 4,-0.4 1,-0.2 -2,-0.2 0.857 120.3 28.3 -54.7 -43.5 118.4 -6.4 -8.8 996 710 D Y H X S+ 0 0 72 -4,-2.2 4,-1.1 -5,-0.1 -1,-0.2 0.881 118.5 57.5 -84.8 -37.3 120.8 -9.1 -10.2 997 711 D G H <>S+ 0 0 12 -4,-2.4 5,-2.6 -5,-0.3 4,-0.3 0.862 97.1 58.6 -61.1 -42.9 123.5 -6.8 -11.3 998 712 D I T ><5S+ 0 0 4 -4,-2.2 3,-1.4 1,-0.3 -1,-0.2 0.924 108.8 39.5 -65.0 -45.7 124.4 -5.0 -8.1 999 713 D V T 345S+ 0 0 2 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.2 0.740 112.5 58.9 -78.6 -20.4 125.3 -7.8 -5.8 1000 714 D Y T 3<5S- 0 0 71 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.415 127.1-101.8 -84.2 -0.5 127.1 -9.5 -8.7 1001 715 D G T < 5 + 0 0 21 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.670 60.8 163.9 98.2 21.5 129.2 -6.4 -8.9 1002 716 D I < - 0 0 42 -5,-2.6 2,-0.2 -6,-0.1 -1,-0.2 -0.359 21.1-152.4 -69.4 150.8 127.9 -4.4 -11.8 1003 717 D S > - 0 0 60 1,-0.0 4,-2.1 -2,-0.0 5,-0.2 -0.619 36.2 -91.8-111.5 178.1 128.9 -0.7 -12.1 1004 718 D D H > S+ 0 0 49 -2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.828 124.9 56.8 -59.2 -29.7 127.1 2.2 -13.7 1005 719 D Y H > S+ 0 0 121 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.952 108.4 43.8 -67.2 -52.3 129.0 1.5 -16.9 1006 720 D G H > S+ 0 0 15 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.882 115.2 49.3 -58.8 -40.5 127.8 -2.1 -17.3 1007 721 D L H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.956 113.5 45.6 -64.9 -48.0 124.2 -1.1 -16.3 1008 722 D A H X>S+ 0 0 2 -4,-2.3 5,-1.8 -5,-0.2 4,-1.0 0.900 116.9 45.9 -62.6 -40.9 124.1 1.7 -18.8 1009 723 D Q H <5S+ 0 0 64 -4,-2.7 3,-0.2 -5,-0.2 -2,-0.2 0.940 115.2 44.3 -68.0 -46.7 125.7 -0.5 -21.5 1010 724 D N H <5S+ 0 0 95 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.902 123.5 36.4 -70.1 -36.4 123.4 -3.5 -20.9 1011 725 D L H <5S- 0 0 38 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.551 103.7-126.9 -89.7 -9.1 120.3 -1.4 -20.7 1012 726 D N T <5 + 0 0 102 -4,-1.0 2,-0.3 -3,-0.2 -3,-0.2 0.957 66.6 124.2 55.5 54.3 121.2 1.2 -23.3 1013 727 D I < - 0 0 31 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.832 68.7 -66.4-132.4 171.9 120.6 4.1 -21.0 1014 728 D S > - 0 0 60 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.296 32.3-138.6 -53.6 137.6 122.4 7.1 -19.6 1015 729 D R H > S+ 0 0 128 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.850 108.5 56.9 -65.9 -34.5 125.4 6.4 -17.2 1016 730 D K H > S+ 0 0 183 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.939 109.3 44.8 -58.8 -44.1 124.1 9.2 -15.1 1017 731 D E H > S+ 0 0 70 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.892 111.4 52.6 -66.0 -43.4 120.7 7.4 -14.9 1018 732 D A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.897 108.0 51.3 -56.9 -43.2 122.4 4.1 -14.2 1019 733 D A H X S+ 0 0 43 -4,-2.4 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-12.3 1126 840 D E G <> S+ 0 0 14 -3,-2.3 4,-2.5 1,-0.1 -1,-0.3 0.468 79.9 92.7-102.1 -4.6 98.7 -38.1 -10.0 1127 841 D M H <> S+ 0 0 5 -3,-1.5 4,-2.7 -4,-0.4 5,-0.2 0.906 81.5 52.8 -62.3 -43.6 98.6 -34.5 -11.0 1128 842 D E H > S+ 0 0 167 -4,-0.4 4,-1.1 1,-0.2 -1,-0.2 0.944 112.7 45.5 -60.0 -45.1 96.2 -33.3 -8.2 1129 843 D R H >> S+ 0 0 122 -4,-0.2 4,-2.6 1,-0.2 3,-0.6 0.916 112.6 51.2 -60.8 -40.9 98.5 -34.9 -5.6 1130 844 D L H 3X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.874 99.7 63.8 -65.7 -35.8 101.6 -33.4 -7.2 1131 845 D C H 3< S+ 0 0 26 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.805 115.5 32.3 -56.2 -34.1 100.1 -29.9 -7.3 1132 846 D R H S+ 0 0 9 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.922 114.0 52.6 -63.8 -36.7 105.6 -27.0 -4.0 1136 850 D E H X S+ 0 0 97 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.948 110.8 46.5 -61.9 -46.7 105.3 -28.0 -0.3 1137 851 D V H < S+ 0 0 11 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.912 115.9 45.7 -63.7 -40.2 108.5 -30.1 -0.5 1138 852 D M H >< S+ 0 0 0 -4,-2.2 3,-0.9 -5,-0.2 4,-0.3 0.925 113.3 48.6 -67.9 -40.1 110.4 -27.3 -2.4 1139 853 D E H 3< S+ 0 0 45 -4,-3.1 9,-0.4 1,-0.2 3,-0.3 0.799 115.7 44.9 -70.5 -29.1 109.2 -24.5 -0.1 1140 854 D Q T 3< S+ 0 0 107 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.346 78.7 103.4 -97.7 5.5 110.1 -26.5 3.0 1141 855 D A S < S+ 0 0 4 -3,-0.9 2,-0.3 -4,-0.4 -1,-0.2 0.873 97.5 3.6 -59.2 -42.2 113.6 -27.7 1.9 1142 856 D V S S- 0 0 19 -4,-0.3 2,-0.6 -3,-0.3 6,-0.2 -0.869 74.3-123.6-133.4 165.7 115.3 -25.2 4.1 1143 857 D T + 0 0 111 -2,-0.3 2,-0.2 4,-0.1 -3,-0.1 -0.969 36.5 173.0-113.9 112.7 114.1 -22.6 6.6 1144 858 D L - 0 0 20 -2,-0.6 4,-0.1 2,-0.5 -197,-0.1 -0.584 49.5 -99.1-107.6-177.6 115.2 -19.0 5.8 1145 859 D R S S+ 0 0 39 -2,-0.2 -198,-0.1 -199,-0.1 -183,-0.0 0.578 112.9 42.4 -83.9 -7.9 114.3 -15.6 7.2 1146 860 D V S S- 0 0 6 -200,-0.1 -2,-0.5 -185,-0.0 -184,-0.1 -0.941 98.5 -99.1-126.9 158.2 111.9 -15.2 4.3 1147 861 D P - 0 0 70 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.333 29.6-129.5 -67.6 149.9 109.5 -17.7 2.8 1148 862 D L - 0 0 14 -9,-0.4 2,-0.4 -6,-0.2 -206,-0.1 -0.818 23.0-154.4 -90.9 147.9 110.4 -19.6 -0.3 1149 863 D K - 0 0 66 -208,-0.4 -208,-2.7 -2,-0.4 2,-0.4 -0.989 7.5-165.7-127.6 134.6 107.7 -19.4 -3.0 1150 864 D V E -Y 940 0K 5 -2,-0.4 2,-0.3 -210,-0.2 -210,-0.2 -0.972 3.6-161.6-124.7 133.6 107.2 -22.0 -5.8 1151 865 D D E -Y 939 0K 59 -212,-2.6 -212,-2.7 -2,-0.4 2,-0.3 -0.819 17.4-175.9-106.5 150.7 105.1 -21.6 -8.9 1152 866 D Y E +Y 938 0K 96 -2,-0.3 2,-0.3 -214,-0.2 -214,-0.2 -0.998 13.7 172.1-153.0 152.7 104.0 -24.7 -10.8 1153 867 D H E -Y 937 0K 76 -216,-2.4 -216,-2.9 -2,-0.3 2,-0.3 -0.983 9.8-160.4-153.7 157.4 102.2 -25.8 -14.0 1154 868 D Y E +Y 936 0K 111 -2,-0.3 8,-0.3 -218,-0.2 2,-0.3 -0.969 20.0 138.3-142.5 158.8 101.5 -28.9 -15.9 1155 869 D G E -Y 935 0K 10 -220,-2.3 -220,-2.9 -2,-0.3 6,-0.1 -0.984 61.2 -69.4-175.5-171.8 100.4 -29.9 -19.4 1156 870 D S S S+ 0 0 78 -2,-0.3 2,-0.3 -222,-0.2 -223,-0.1 0.653 113.0 15.6 -72.5 -22.6 100.8 -32.3 -22.4 1157 871 D T S > S- 0 0 11 -230,-0.2 4,-1.0 -222,-0.1 3,-0.5 -0.911 87.5-100.1-141.9 168.4 104.3 -31.0 -23.3 1158 872 D W T 4 S+ 0 0 10 -232,-2.3 3,-0.5 -235,-0.7 -234,-0.2 0.854 123.0 58.7 -60.7 -34.3 107.0 -29.0 -21.6 1159 873 D Y T 4 S+ 0 0 27 -236,-1.3 -1,-0.2 -233,-0.3 -235,-0.2 0.891 105.9 48.3 -60.0 -36.9 105.7 -26.0 -23.6 1160 874 D D T 4 S+ 0 0 63 -3,-0.5 2,-2.7 -237,-0.2 -1,-0.2 0.636 83.4 90.9 -83.7 -15.7 102.3 -26.3 -22.0 1161 875 D A < 0 0 10 -4,-1.0 -1,-0.2 -3,-0.5 -8,-0.2 -0.445 360.0 360.0 -78.9 65.1 103.6 -26.7 -18.5 1162 876 D K 0 0 128 -2,-2.7 -1,-0.3 -8,-0.3 -2,-0.1 0.218 360.0 360.0-146.8 360.0 103.2 -22.9 -18.2