==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-APR-08 3CR0 . COMPND 2 MOLECULE: WEE1-LIKE PROTEIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.J.SQUIRE,E.N.BAKER . 257 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12629.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 16.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 13 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 1 0 1 0 1 1 0 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 1 293 A S > 0 0 96 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 148.9 -6.0 72.4 33.4 2 294 A R H > + 0 0 99 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.883 360.0 58.7 -63.2 -39.1 -2.7 71.2 34.9 3 295 A Y H > S+ 0 0 18 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.908 110.4 41.5 -53.9 -42.8 -2.0 69.1 31.8 4 296 A T H 4 S+ 0 0 85 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.905 119.5 40.9 -75.8 -48.0 -2.2 72.1 29.5 5 297 A T H < S+ 0 0 102 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.745 120.7 43.7 -72.8 -25.4 -0.3 74.6 31.6 6 298 A E H < S+ 0 0 38 -4,-2.5 20,-2.3 -5,-0.2 21,-0.5 0.703 115.3 37.4 -93.0 -25.7 2.4 72.1 32.7 7 299 A F E < -A 25 0A 4 -4,-1.2 2,-0.5 -5,-0.3 18,-0.2 -0.899 61.9-139.7-132.6 150.0 3.2 70.3 29.5 8 300 A H E -A 24 0A 99 16,-2.7 16,-2.5 -2,-0.3 2,-0.3 -0.989 30.9-132.0-105.9 117.0 3.5 71.0 25.8 9 301 A E E +A 23 0A 86 -2,-0.5 14,-0.2 14,-0.2 3,-0.1 -0.581 28.2 176.1 -63.7 126.2 2.0 68.1 23.8 10 302 A L E - 0 0 79 12,-3.3 2,-0.3 1,-0.4 13,-0.2 0.787 56.7 -23.2-100.2 -37.4 4.3 66.9 21.1 11 303 A E E -A 22 0A 105 11,-1.4 11,-2.9 0, 0.0 2,-0.5 -0.965 59.0-103.4-174.8 147.2 2.6 64.0 19.4 12 304 A K E +A 21 0A 107 -2,-0.3 9,-0.2 9,-0.2 3,-0.1 -0.778 35.1 169.3 -85.8 127.2 0.1 61.2 20.0 13 305 A I E + 0 0 74 7,-2.5 2,-0.3 -2,-0.5 8,-0.2 0.420 61.4 27.1-117.2 -1.6 1.7 57.8 20.6 14 306 A G E -A 20 0A 22 6,-1.3 6,-2.0 2,-0.0 2,-0.3 -0.956 53.9-172.2-163.9 138.8 -1.2 55.7 21.7 15 307 A S E A 19 0A 94 -2,-0.3 4,-0.2 4,-0.2 -3,-0.0 -0.939 360.0 360.0-132.0 152.2 -5.0 55.4 21.3 16 308 A G 0 0 98 2,-1.2 -2,-0.0 -2,-0.3 0, 0.0 -0.959 360.0 360.0-167.6 360.0 -7.6 53.1 23.0 17 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 18 311 A G 0 0 51 0, 0.0 -2,-1.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -88.6 -8.1 57.2 25.6 19 312 A S E -AB 15 36A 27 17,-1.7 17,-3.2 -4,-0.2 2,-0.4 -0.967 360.0-151.0-164.7 150.9 -4.7 58.5 24.6 20 313 A V E -AB 14 35A 33 -6,-2.0 -7,-2.5 -2,-0.3 -6,-1.3 -0.951 24.7-166.7-119.8 128.9 -1.0 58.6 25.4 21 314 A F E -AB 12 34A 27 13,-2.2 13,-2.5 -2,-0.4 2,-0.6 -0.968 24.4-129.1-118.8 146.2 0.9 61.7 24.3 22 315 A K E +AB 11 33A 41 -11,-2.9 -12,-3.3 -2,-0.4 -11,-1.4 -0.803 45.8 174.0 -86.4 120.2 4.6 62.4 24.1 23 316 A C E -AB 9 32A 0 9,-2.1 9,-2.7 -2,-0.6 2,-0.5 -0.975 33.9-135.9-135.4 151.5 4.9 65.8 26.0 24 317 A V E -AB 8 31A 35 -16,-2.5 -16,-2.7 -2,-0.3 2,-0.4 -0.911 24.0-133.9-105.5 122.2 7.6 68.2 27.2 25 318 A K E >> -AB 7 30A 31 5,-2.7 4,-1.4 -2,-0.5 5,-0.5 -0.684 17.1-142.5 -72.3 127.0 7.1 69.4 30.8 26 319 A R T 45S+ 0 0 137 -20,-2.3 -1,-0.2 -2,-0.4 -19,-0.1 0.821 91.4 49.6 -68.6 -34.1 7.7 73.1 30.4 27 320 A L T 45S+ 0 0 156 -21,-0.5 -1,-0.2 1,-0.2 -20,-0.1 0.910 120.8 29.8 -70.4 -43.2 9.5 73.6 33.7 28 321 A D T 45S- 0 0 77 2,-0.1 -2,-0.2 -3,-0.0 -1,-0.2 0.519 97.2-128.3-101.9 -1.1 12.1 70.8 33.6 29 322 A G T <5 + 0 0 54 -4,-1.4 2,-0.2 1,-0.2 -3,-0.1 0.587 62.2 136.2 70.7 16.8 12.5 70.6 29.9 30 323 A C E < -B 25 0A 53 -5,-0.5 -5,-2.7 1,-0.0 2,-0.4 -0.643 54.2-124.0-114.7 155.9 11.9 67.0 29.8 31 324 A I E +B 24 0A 66 -2,-0.2 53,-0.8 -7,-0.2 2,-0.3 -0.731 32.9 172.1 -94.7 135.4 9.9 64.5 27.7 32 325 A Y E -BC 23 83A 18 -9,-2.7 -9,-2.1 -2,-0.4 2,-0.5 -0.923 35.3-120.2-137.2 157.2 7.4 62.2 29.3 33 326 A A E -BC 22 82A 18 49,-2.8 49,-3.4 -2,-0.3 2,-0.5 -0.910 34.2-167.3-101.6 128.2 4.7 59.7 28.2 34 327 A I E -BC 21 81A 1 -13,-2.5 -13,-2.2 -2,-0.5 2,-0.6 -0.958 6.9-158.5-122.7 118.2 1.4 60.9 29.5 35 328 A K E -BC 20 80A 65 45,-3.2 45,-2.1 -2,-0.5 2,-0.5 -0.851 5.3-165.1-105.8 123.6 -1.8 58.8 29.5 36 329 A R E +BC 19 79A 74 -17,-3.2 -17,-1.7 -2,-0.6 2,-0.3 -0.889 13.6 172.1-109.6 119.3 -5.3 60.4 29.6 37 330 A S E - C 0 78A 42 41,-3.0 41,-1.8 -2,-0.5 2,-0.2 -0.851 42.7 -91.0-127.0 163.2 -8.3 58.3 30.4 38 331 A K E - C 0 77A 79 -2,-0.3 39,-0.3 39,-0.2 0, 0.0 -0.525 51.2-114.9 -67.9 130.9 -12.0 58.9 31.1 39 332 A K - 0 0 104 37,-3.2 3,-0.1 -2,-0.2 -1,-0.1 -0.633 33.8-129.5 -73.4 120.0 -12.3 59.3 35.0 40 333 A P - 0 0 30 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.247 36.0 -78.5 -65.5 163.9 -14.4 56.3 36.2 41 334 A L > - 0 0 71 1,-0.1 3,-1.7 2,-0.1 6,-0.4 -0.309 60.0 -96.8 -59.7 140.7 -17.4 56.8 38.6 42 335 A A T 3 S+ 0 0 93 1,-0.3 -1,-0.1 -3,-0.1 4,-0.0 -0.397 107.2 11.8 -68.1 128.4 -16.2 57.4 42.1 43 336 A G T 3 S+ 0 0 60 1,-0.3 -1,-0.3 -2,-0.1 2,-0.1 0.530 95.8 134.8 84.4 6.0 -16.3 54.1 44.2 44 337 A S S <> S- 0 0 27 -3,-1.7 4,-2.1 1,-0.1 -1,-0.3 -0.468 70.7-114.7 -82.0 159.5 -16.8 51.9 41.2 45 338 A V H > S+ 0 0 103 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.764 120.1 56.4 -57.0 -30.4 -15.0 48.6 40.5 46 339 A D H > S+ 0 0 109 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.907 105.0 51.2 -76.0 -33.9 -13.6 50.3 37.5 47 340 A E H > S+ 0 0 42 -6,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.920 107.5 52.3 -65.0 -42.4 -12.2 53.1 39.7 48 341 A Q H X S+ 0 0 108 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.924 111.9 46.3 -55.4 -46.1 -10.6 50.5 42.0 49 342 A N H X S+ 0 0 52 -4,-1.9 4,-0.9 1,-0.2 -2,-0.2 0.895 112.3 50.8 -62.9 -40.8 -8.9 48.9 38.9 50 343 A A H X S+ 0 0 27 -4,-2.5 4,-0.9 1,-0.2 3,-0.3 0.877 110.9 48.7 -61.8 -42.7 -7.9 52.4 37.7 51 344 A L H X S+ 0 0 47 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.799 101.4 62.9 -72.3 -30.6 -6.3 53.2 41.1 52 345 A R H X S+ 0 0 93 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.823 98.8 56.4 -59.6 -33.0 -4.3 49.9 41.4 53 346 A E H X S+ 0 0 32 -4,-0.9 4,-2.7 -3,-0.3 -1,-0.2 0.912 110.8 43.8 -65.6 -44.2 -2.4 50.9 38.3 54 347 A V H X S+ 0 0 21 -4,-0.9 4,-1.6 2,-0.2 -2,-0.2 0.880 114.9 48.0 -61.7 -47.3 -1.4 54.2 40.1 55 348 A Y H X S+ 0 0 147 -4,-2.6 4,-0.6 2,-0.2 -2,-0.2 0.871 113.3 49.0 -62.3 -40.9 -0.6 52.3 43.4 56 349 A A H >X S+ 0 0 4 -4,-2.8 3,-1.3 1,-0.2 4,-1.3 0.956 110.1 50.8 -61.1 -54.9 1.4 49.8 41.5 57 350 A H H 3< S+ 0 0 1 -4,-2.7 12,-0.3 1,-0.3 -2,-0.2 0.814 107.6 55.2 -48.0 -38.7 3.4 52.5 39.6 58 351 A A H 3< S+ 0 0 59 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.520 112.7 37.3 -82.9 -16.3 4.2 54.2 42.9 59 352 A V H << S+ 0 0 71 -3,-1.3 3,-0.3 -4,-0.6 -1,-0.2 0.393 112.8 61.9 -97.6 -9.6 5.8 51.2 44.7 60 353 A L S < S+ 0 0 0 -4,-1.3 3,-0.3 1,-0.2 -2,-0.1 -0.124 73.2 105.0-109.9 42.8 7.4 50.1 41.4 61 354 A G + 0 0 16 1,-0.2 -1,-0.2 -3,-0.2 7,-0.1 0.275 62.6 67.1-106.8 8.2 9.6 53.3 40.8 62 355 A Q S S+ 0 0 174 -3,-0.3 2,-0.5 6,-0.0 -1,-0.2 0.252 77.3 110.2-104.0 11.6 13.1 52.1 41.7 63 356 A H > - 0 0 36 -3,-0.3 3,-1.4 1,-0.1 56,-0.1 -0.821 58.7-150.6-114.0 133.0 13.7 49.6 38.9 64 357 A S T 3 S+ 0 0 67 -2,-0.5 -1,-0.1 1,-0.2 4,-0.1 0.774 102.6 39.9 -48.3 -34.0 15.9 49.7 35.9 65 358 A H T 3 S+ 0 0 18 82,-0.1 83,-3.2 2,-0.1 2,-0.4 0.050 99.8 78.8-120.7 25.1 13.4 47.5 33.9 66 359 A V B < S-e 148 0B 1 -3,-1.4 2,-0.2 81,-0.3 83,-0.2 -0.993 92.2-107.0-126.1 129.6 10.1 48.9 35.0 67 360 A V - 0 0 5 81,-2.8 -2,-0.1 -2,-0.4 2,-0.1 -0.444 42.4-119.4 -47.3 122.0 9.0 52.2 33.4 68 361 A R - 0 0 105 -2,-0.2 15,-3.1 -4,-0.1 2,-0.4 -0.353 20.9-142.4 -71.1 149.7 9.4 55.0 36.0 69 362 A Y E +D 82 0A 49 -12,-0.3 13,-0.2 13,-0.2 3,-0.1 -0.866 21.3 175.4-111.6 138.7 6.4 57.0 37.2 70 363 A F E - 0 0 78 11,-2.7 2,-0.3 1,-0.4 12,-0.2 0.748 60.6 -21.2-108.9 -43.9 6.4 60.7 38.0 71 364 A S E -D 81 0A 26 10,-1.6 10,-3.1 2,-0.0 -1,-0.4 -0.994 41.3-161.3-162.2 163.3 2.9 61.7 38.7 72 365 A A E +D 80 0A 23 -2,-0.3 2,-0.3 8,-0.2 8,-0.2 -0.980 22.1 157.0-149.4 144.7 -0.8 61.0 38.4 73 366 A W E D 79 0A 38 6,-2.0 6,-3.1 -2,-0.3 -2,-0.0 -0.956 360.0 360.0-159.4 177.7 -3.8 63.4 38.9 74 367 A A 0 0 84 -2,-0.3 4,-0.3 4,-0.2 -2,-0.0 -0.974 360.0 360.0-126.7 360.0 -7.5 63.9 38.0 75 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 76 370 A D 0 0 101 0, 0.0 -37,-3.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 23.2 -13.6 64.1 34.1 77 371 A H E -C 38 0A 71 -39,-0.3 2,-0.4 2,-0.0 -39,-0.2 -0.971 360.0-150.1-122.4 145.6 -10.1 62.7 33.2 78 372 A M E -C 37 0A 29 -41,-1.8 -41,-3.0 -2,-0.4 2,-0.4 -0.940 21.7-163.7 -91.8 134.7 -7.4 60.7 35.0 79 373 A L E -CD 36 73A 4 -6,-3.1 -6,-2.0 -2,-0.4 2,-0.4 -0.937 12.1-168.1-121.9 136.6 -3.8 61.3 33.9 80 374 A I E -CD 35 72A 11 -45,-2.1 -45,-3.2 -2,-0.4 2,-0.7 -0.977 7.6-158.6-122.3 128.5 -0.6 59.3 34.4 81 375 A Q E +CD 34 71A 8 -10,-3.1 -11,-2.7 -2,-0.4 -10,-1.6 -0.910 24.4 167.5-107.4 110.9 2.8 60.8 33.6 82 376 A N E -CD 33 69A 24 -49,-3.4 -49,-2.8 -2,-0.7 -13,-0.2 -0.656 43.2 -70.2-116.9 170.1 5.5 58.2 33.1 83 377 A E E -C 32 0A 39 -15,-3.1 2,-0.5 -51,-0.2 -51,-0.2 -0.412 48.7-127.3 -55.9 130.9 9.0 57.9 31.7 84 378 A Y - 0 0 54 -53,-0.8 2,-0.7 -2,-0.1 -53,-0.1 -0.767 16.9-150.7 -86.1 124.0 9.2 58.4 27.9 85 379 A C > - 0 0 15 -2,-0.5 3,-1.0 1,-0.1 55,-0.2 -0.915 2.5-159.4-103.0 116.9 11.0 55.4 26.3 86 380 A N T 3 S+ 0 0 129 -2,-0.7 55,-0.2 1,-0.2 -1,-0.1 0.599 80.9 65.2 -68.4 -25.1 12.6 56.7 23.1 87 381 A G T 3 S- 0 0 42 53,-2.9 -1,-0.2 1,-0.2 54,-0.2 0.421 97.1-129.1 -91.2 5.7 13.0 53.3 21.4 88 382 A G < - 0 0 31 -3,-1.0 52,-2.7 52,-0.4 -1,-0.2 -0.322 43.8 -44.1 85.2-172.3 9.2 52.4 20.9 89 383 A S B > -F 139 0B 16 50,-0.2 4,-1.5 1,-0.1 50,-0.2 -0.543 44.8-119.3 -92.7 160.9 7.5 49.2 22.0 90 384 A L H > S+ 0 0 0 48,-2.3 4,-3.1 45,-1.1 46,-0.2 0.884 114.4 63.1 -63.9 -32.6 8.9 45.6 21.5 91 385 A A H > S+ 0 0 27 44,-1.3 4,-2.2 47,-0.4 -1,-0.2 0.887 103.8 45.6 -55.1 -44.7 5.8 45.0 19.4 92 386 A D H > S+ 0 0 104 2,-0.2 4,-2.2 43,-0.2 -1,-0.2 0.846 112.1 50.6 -70.7 -36.3 6.8 47.6 16.9 93 387 A A H X S+ 0 0 28 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.915 111.6 49.6 -60.1 -45.4 10.4 46.3 16.7 94 388 A I H X S+ 0 0 27 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.861 110.7 49.1 -64.6 -39.3 8.9 42.8 16.2 95 389 A S H X S+ 0 0 69 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.900 110.4 50.2 -65.2 -42.0 6.6 44.1 13.3 96 390 A E H X S+ 0 0 30 -4,-2.2 4,-1.5 1,-0.2 3,-0.4 0.960 113.2 47.5 -59.9 -46.9 9.6 45.9 11.6 97 391 A N H X>S+ 0 0 31 -4,-2.3 5,-1.6 1,-0.2 4,-1.2 0.818 106.0 58.9 -52.9 -45.9 11.6 42.6 11.9 98 392 A Y H <5S+ 0 0 105 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.870 108.3 43.9 -49.8 -44.8 8.8 40.5 10.5 99 393 A R H <5S+ 0 0 182 -4,-1.4 -1,-0.2 -3,-0.4 -2,-0.2 0.816 116.4 45.8 -81.8 -32.1 8.6 42.4 7.3 100 394 A I H <5S- 0 0 102 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.547 103.2-127.7 -87.5 -5.6 12.4 42.5 6.8 101 395 A M T <5S+ 0 0 147 -4,-1.2 2,-0.4 -3,-0.3 -3,-0.2 0.790 75.7 113.2 62.4 29.2 12.9 38.7 7.6 102 396 A S < + 0 0 58 -5,-1.6 -2,-0.2 -6,-0.1 -1,-0.2 -0.916 44.6 178.1-131.5 105.4 15.6 39.6 10.2 103 397 A Y - 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0 0 26 -3,-1.6 23,-0.1 1,-0.1 -4,-0.0 -0.337 42.0-151.4 -64.4 134.4 -5.4 38.0 45.1 160 473 A P S S+ 0 0 122 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.661 83.2 47.0 -84.5 -21.0 -8.7 35.9 44.9 161 474 A Q S S- 0 0 72 18,-0.0 2,-0.4 2,-0.0 -2,-0.0 -0.961 72.0-171.9-120.8 140.2 -10.0 37.8 41.9 162 475 A V - 0 0 22 -2,-0.4 2,-0.8 12,-0.1 -7,-0.0 -0.986 25.9-138.1-132.5 135.9 -8.0 38.5 38.8 163 476 A E - 0 0 41 -2,-0.4 2,-0.1 -10,-0.2 -2,-0.0 -0.878 39.2-131.3 -83.7 109.9 -8.4 40.6 35.6 164 477 A E - 0 0 89 -2,-0.8 3,-0.1 1,-0.1 -32,-0.1 -0.398 17.3-135.1 -64.0 138.5 -7.0 38.3 32.9 165 478 A G - 0 0 11 -34,-0.5 -33,-0.2 1,-0.2 5,-0.1 -0.067 53.5 -34.9 -77.3-176.0 -4.5 39.8 30.4 166 479 A D > - 0 0 30 1,-0.1 3,-1.5 3,-0.1 4,-0.3 -0.080 54.1-132.9 -42.4 131.7 -4.3 39.3 26.6 167 480 A S T 3 S+ 0 0 46 1,-0.3 3,-0.4 2,-0.2 -1,-0.1 0.695 100.6 67.5 -70.6 -16.8 -5.5 35.9 25.6 168 481 A R T 3 S+ 0 0 61 1,-0.2 -1,-0.3 35,-0.1 -2,-0.1 0.706 115.1 30.5 -63.4 -26.1 -2.5 35.3 23.2 169 482 A F S < S+ 0 0 9 -3,-1.5 2,-0.3 34,-0.1 -1,-0.2 0.246 93.6 124.1-121.6 3.4 -0.3 35.3 26.3 170 483 A L - 0 0 11 -3,-0.4 2,-0.2 -4,-0.3 16,-0.1 -0.579 56.7-128.5 -83.3 130.0 -2.6 33.8 28.9 171 484 A A >> - 0 0 1 -2,-0.3 4,-1.7 1,-0.1 3,-0.5 -0.441 18.3-126.3 -69.8 140.0 -1.8 30.7 30.9 172 485 A N H 3> S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.902 108.1 57.4 -53.3 -43.5 -4.5 28.0 31.0 173 486 A E H 34>S+ 0 0 17 2,-0.2 5,-3.0 1,-0.2 -1,-0.2 0.818 105.0 52.1 -61.5 -30.3 -4.6 27.8 34.8 174 487 A V H X45S+ 0 0 1 -3,-0.5 3,-1.7 3,-0.2 -1,-0.2 0.955 110.0 47.8 -69.6 -47.4 -5.5 31.6 34.9 175 488 A L H 3<5S+ 0 0 67 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.831 108.3 56.0 -54.3 -35.7 -8.3 31.0 32.4 176 489 A Q T 3<5S- 0 0 118 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.330 121.2-113.6 -79.2 7.8 -9.4 28.0 34.6 177 490 A E T < 5 + 0 0 141 -3,-1.7 2,-0.7 1,-0.2 -3,-0.2 0.830 69.4 143.7 58.3 41.6 -9.6 30.5 37.5 178 491 A N < + 0 0 72 -5,-3.0 3,-0.4 -6,-0.1 -1,-0.2 -0.875 19.2 169.3-115.1 107.2 -6.7 29.0 39.4 179 492 A Y > + 0 0 43 -2,-0.7 3,-0.7 1,-0.2 -1,-0.1 0.014 42.2 110.7-110.4 24.7 -4.6 31.6 41.1 180 493 A T T 3 S+ 0 0 100 1,-0.2 -1,-0.2 -7,-0.1 -2,-0.0 0.777 92.4 27.9 -63.7 -33.6 -2.4 29.4 43.3 181 494 A H T > S+ 0 0 53 -3,-0.4 3,-1.4 1,-0.1 4,-0.4 -0.398 70.9 153.5-129.6 55.6 0.7 30.2 41.2 182 495 A L T X> + 0 0 2 -3,-0.7 3,-1.3 -25,-0.4 4,-0.9 0.777 69.0 65.1 -60.9 -34.2 0.1 33.8 39.7 183 496 A P H >> S+ 0 0 26 0, 0.0 4,-1.2 0, 0.0 3,-0.5 0.852 96.5 57.4 -56.0 -33.6 3.8 34.6 39.4 184 497 A K H <> S+ 0 0 33 -3,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.569 93.8 66.4 -78.5 -13.3 4.2 31.8 36.9 185 498 A A H <> S+ 0 0 8 -3,-1.3 4,-1.5 -4,-0.4 -1,-0.2 0.858 101.9 48.5 -64.1 -43.4 1.6 33.3 34.6 186 499 A D H S+ 0 0 0 -4,-2.0 5,-1.8 2,-0.2 4,-0.4 0.904 107.8 51.3 -65.9 -45.0 9.1 33.5 20.9 196 509 A C H ><5S+ 0 0 16 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.914 110.4 49.0 -51.1 -50.0 7.3 36.5 19.2 197 510 A A H 3<5S+ 0 0 2 -4,-1.8 -93,-2.0 1,-0.2 -2,-0.2 0.754 101.8 64.7 -60.4 -33.0 10.7 38.3 19.2 198 511 A A T 3<5S- 0 0 0 -4,-1.5 -1,-0.2 -95,-0.2 -2,-0.2 0.541 128.7 -90.5 -70.7 -12.2 12.4 35.2 17.7 199 512 A G T < 5S+ 0 0 8 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.456 71.6 157.1 121.8 -1.5 10.4 35.5 14.6 200 513 A A < - 0 0 8 -5,-1.8 -1,-0.2 1,-0.1 21,-0.1 0.037 47.8 -97.1 -54.0 155.4 7.3 33.5 15.2 201 514 A E - 0 0 121 19,-0.4 -1,-0.1 1,-0.2 -2,-0.0 -0.491 63.2 -70.4 -58.2 147.6 3.9 33.9 13.4 202 515 A P - 0 0 103 0, 0.0 -1,-0.2 0, 0.0 -6,-0.0 -0.129 62.9-108.4 -41.6 129.5 1.3 36.0 15.3 203 516 A L - 0 0 11 -3,-0.1 -35,-0.1 1,-0.1 2,-0.1 -0.354 32.5-109.5 -67.0 147.1 0.1 34.0 18.3 204 517 A P - 0 0 38 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.386 15.7-152.5 -77.5 154.7 -3.5 32.5 18.2 205 518 A R S S- 0 0 137 1,-0.2 2,-0.2 -2,-0.1 -36,-0.1 0.706 72.8 -22.3-103.3 -20.2 -6.1 33.9 20.5 206 519 A N S > S+ 0 0 126 -38,-0.1 4,-0.8 0, 0.0 3,-0.3 -0.836 93.6 74.9-159.4-163.3 -8.2 30.8 20.8 207 520 A G H > S- 0 0 38 -2,-0.2 4,-1.9 1,-0.2 3,-0.2 -0.126 97.3 -41.7 79.3-176.0 -8.9 27.6 18.9 208 521 A D H > S+ 0 0 89 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.821 134.7 52.9 -61.9 -36.3 -6.8 24.4 18.5 209 522 A Q H > S+ 0 0 62 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.927 107.2 54.4 -68.7 -37.9 -3.4 26.2 18.1 210 523 A W H X S+ 0 0 10 -4,-0.8 4,-1.4 1,-0.2 3,-0.3 0.954 111.0 44.9 -53.8 -57.1 -4.1 28.1 21.3 211 524 A H H X S+ 0 0 100 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.844 106.7 59.2 -56.4 -40.5 -4.7 24.9 23.3 212 525 A E H <>S+ 0 0 98 -4,-2.0 5,-1.2 1,-0.2 3,-0.3 0.878 105.0 49.0 -61.5 -39.0 -1.6 23.1 21.8 213 526 A I H ><5S+ 0 0 11 -4,-1.7 3,-2.0 -3,-0.3 -1,-0.2 0.851 106.5 57.4 -63.8 -37.7 0.7 25.8 23.1 214 527 A R H 3<5S+ 0 0 10 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.686 94.2 65.7 -71.9 -18.2 -1.0 25.4 26.5 215 528 A Q T 3<5S- 0 0 105 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.428 130.0 -97.8 -69.7 -6.1 -0.0 21.7 26.4 216 529 A G T < 5S+ 0 0 6 -3,-2.0 2,-0.6 1,-0.2 -3,-0.2 0.610 78.7 138.1 98.7 12.7 3.6 23.1 26.6 217 530 A R < - 0 0 122 -5,-1.2 -1,-0.2 20,-0.1 -2,-0.1 -0.846 49.7-127.5 -98.3 122.0 4.6 23.1 22.9 218 531 A L - 0 0 44 -2,-0.6 3,-0.1 1,-0.1 16,-0.1 -0.252 25.3-114.8 -59.9 139.1 6.6 26.0 21.5 219 532 A P - 0 0 27 0, 0.0 -1,-0.1 0, 0.0 -19,-0.1 -0.335 51.7 -74.0 -61.7 156.0 5.3 27.7 18.3 220 533 A R - 0 0 191 2,-0.1 -19,-0.4 1,-0.0 0, 0.0 -0.332 47.3-157.1 -52.2 133.4 7.5 27.4 15.2 221 534 A I - 0 0 32 -21,-0.1 2,-1.5 -3,-0.1 -22,-0.1 -0.965 11.8-142.6-117.1 119.5 10.6 29.6 15.5 222 535 A P S S+ 0 0 32 0, 0.0 2,-0.3 0, 0.0 -119,-0.1 -0.143 77.2 57.1 -80.5 44.9 12.0 30.5 12.1 223 536 A Q S S- 0 0 43 -2,-1.5 2,-0.4 -118,-0.0 -2,-0.1 -0.939 89.3 -98.0-167.6 151.0 15.7 30.4 13.3 224 537 A V - 0 0 144 -2,-0.3 2,-0.3 0, 0.0 -118,-0.2 -0.636 40.3-178.0 -80.6 119.2 18.1 27.8 14.9 225 538 A L - 0 0 19 -2,-0.4 -4,-0.0 -4,-0.1 -120,-0.0 -0.841 36.7 -93.6-110.9 153.3 18.4 28.3 18.7 226 539 A S > - 0 0 36 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.297 33.4-121.5 -53.6 147.7 20.7 26.2 21.1 227 540 A Q H > S+ 0 0 164 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.819 113.6 58.5 -58.3 -37.1 18.9 23.2 22.7 228 541 A E H > S+ 0 0 117 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.939 110.4 42.9 -56.8 -49.7 19.7 24.7 26.1 229 542 A F H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.928 114.0 48.4 -64.0 -49.4 17.8 27.9 25.2 230 543 A T H X S+ 0 0 50 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.881 111.1 52.4 -56.6 -42.7 14.8 26.2 23.5 231 544 A E H X S+ 0 0 54 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.827 106.6 52.3 -64.2 -38.3 14.5 23.9 26.5 232 545 A L H X S+ 0 0 3 -4,-1.5 4,-1.1 1,-0.2 -2,-0.2 0.923 109.9 49.3 -68.7 -45.4 14.5 26.9 28.9 233 546 A L H X S+ 0 0 0 -4,-2.3 4,-0.6 2,-0.2 -2,-0.2 0.793 112.1 49.8 -54.1 -35.6 11.6 28.5 26.8 234 547 A K H >< S+ 0 0 112 -4,-1.4 3,-1.0 2,-0.2 -2,-0.2 0.909 106.8 51.7 -76.7 -44.4 9.6 25.2 26.9 235 548 A V H >< S+ 0 0 37 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.834 104.1 60.4 -57.3 -30.4 9.9 24.7 30.6 236 549 A M H 3< S+ 0 0 0 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.704 108.4 43.7 -72.4 -25.3 8.6 28.3 30.9 237 550 A I T << S+ 0 0 0 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.117 83.9 144.7-102.1 20.1 5.4 27.2 29.1 238 551 A H < - 0 0 59 -3,-1.2 6,-0.2 1,-0.1 -22,-0.2 -0.330 59.0-125.5 -58.0 135.4 5.0 23.9 31.0 239 552 A P S S+ 0 0 61 0, 0.0 -66,-0.2 0, 0.0 -1,-0.1 0.795 101.2 70.0 -52.5 -33.1 1.3 23.0 31.7 240 553 A D S >> S- 0 0 61 1,-0.2 3,-2.4 2,-0.0 4,-0.7 -0.804 75.6-155.3 -88.0 109.3 2.2 22.7 35.4 241 554 A P G >4 S+ 0 0 17 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.789 91.9 63.4 -57.1 -27.0 2.9 26.3 36.6 242 555 A E G 34 S+ 0 0 122 1,-0.2 4,-0.1 -3,-0.1 -2,-0.0 0.553 95.9 57.7 -71.2 -15.2 5.1 24.8 39.4 243 556 A R G <4 S+ 0 0 137 -3,-2.4 -1,-0.2 -5,-0.1 -6,-0.1 0.698 88.7 92.3 -90.0 -19.8 7.5 23.4 36.8 244 557 A R S << S- 0 0 7 -3,-0.8 -8,-0.2 -4,-0.7 -60,-0.1 -0.380 88.4-101.1 -68.9 147.9 8.2 26.8 35.3 245 558 A P - 0 0 17 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.387 29.6-123.5 -70.4 149.2 11.1 28.9 36.7 246 559 A S > - 0 0 49 1,-0.1 4,-2.9 -4,-0.1 5,-0.1 -0.431 35.7-102.3 -77.9 168.0 10.4 31.6 39.2 247 560 A A H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.2 -126,-0.2 0.862 125.9 51.7 -61.4 -34.9 11.8 35.0 38.1 248 561 A M H > S+ 0 0 101 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.954 110.0 46.9 -62.4 -54.9 14.8 34.5 40.5 249 562 A A H >> S+ 0 0 45 2,-0.2 4,-0.9 1,-0.2 3,-0.7 0.964 112.4 52.8 -50.8 -54.4 15.5 31.1 39.1 250 563 A L H >< S+ 0 0 0 -4,-2.9 3,-1.3 1,-0.2 6,-0.2 0.953 108.8 47.1 -41.0 -61.1 15.2 32.6 35.5 251 564 A V H 3< S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.738 117.4 44.1 -61.5 -18.6 17.7 35.4 36.1 252 565 A K H << S+ 0 0 148 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.445 84.6 126.5-104.3 0.8 20.2 33.0 37.7 253 566 A H XX - 0 0 62 -3,-1.3 3,-0.9 -4,-0.9 4,-0.6 -0.211 65.3-130.3 -61.3 141.9 19.8 30.3 35.1 254 567 A S H >> S+ 0 0 95 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.900 106.1 65.2 -63.7 -36.8 23.0 29.1 33.5 255 568 A V H 34 S+ 0 0 16 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.841 107.5 43.2 -53.1 -32.5 21.6 29.5 30.0 256 569 A L H X> S+ 0 0 0 -3,-0.9 3,-2.2 -6,-0.2 4,-1.0 0.538 85.3 95.2 -92.4 -5.9 21.5 33.2 30.8 257 570 A L H X< S+ 0 0 57 -3,-1.5 3,-1.0 -4,-0.6 -1,-0.2 0.883 80.5 57.9 -52.4 -44.4 25.0 33.6 32.4 258 571 A S T 3< S+ 0 0 109 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.560 107.8 48.7 -62.0 -11.8 26.6 34.6 29.1 259 572 A A T <4 0 0 35 -3,-2.2 -1,-0.2 -149,-0.1 -2,-0.2 0.599 360.0 360.0 -96.3 -20.4 24.0 37.6 29.0 260 573 A S << 0 0 90 -3,-1.0 -149,-0.0 -4,-1.0 -8,-0.0 -0.635 360.0 360.0 -87.1 360.0 24.8 38.6 32.7