==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-FEB-10 2X4Z . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PAK 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.R.KNIGHTON,Y.DENG,B.MURRAY,C.GUO,J.PIRAINO,J.WESTWICK,C.ZH . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14046.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 16.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 . 20 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 1 0 0 0 0 2 2 0 0 0 0 1 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 . 2 2 1 0 0 2 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 . 1 0 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 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 74 0, 0.0 61,-0.6 0, 0.0 62,-0.1 0.000 360.0 360.0 360.0 128.0 30.6 40.8 48.7 2 300 A S > - 0 0 45 59,-0.1 4,-2.9 60,-0.1 5,-0.2 -0.307 360.0-101.2 -85.4 170.5 34.1 39.4 48.3 3 301 A H H > S+ 0 0 59 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.868 124.0 45.0 -55.9 -41.1 36.0 36.8 50.3 4 302 A E H > S+ 0 0 129 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.907 113.9 47.4 -72.6 -43.2 37.9 39.6 52.1 5 303 A Q H > S+ 0 0 95 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.888 110.1 54.9 -64.3 -38.9 34.9 41.8 52.8 6 304 A F H X S+ 0 0 3 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.922 111.9 42.6 -60.6 -46.6 33.0 38.7 54.1 7 305 A R H X S+ 0 0 63 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.892 114.4 50.3 -68.1 -42.2 35.7 37.9 56.6 8 306 A A H X S+ 0 0 45 -4,-2.4 4,-0.6 2,-0.2 -2,-0.2 0.919 113.4 45.9 -62.5 -45.0 36.2 41.6 57.7 9 307 A A H >X S+ 0 0 23 -4,-2.7 3,-1.1 1,-0.2 4,-0.5 0.912 111.7 51.8 -64.1 -45.1 32.4 42.0 58.2 10 308 A L H >X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.3 3,-1.3 0.843 97.5 66.3 -61.8 -36.6 32.1 38.7 60.1 11 309 A Q H 3< S+ 0 0 111 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.768 101.0 51.7 -57.9 -24.5 34.9 39.7 62.5 12 310 A L H << S+ 0 0 156 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.644 119.8 30.8 -87.6 -16.1 32.7 42.4 63.8 13 311 A V H << S+ 0 0 32 -3,-1.3 -2,-0.2 -4,-0.5 -3,-0.1 0.726 95.9 89.5-114.1 -29.4 29.6 40.3 64.5 14 312 A V S < S- 0 0 21 -4,-2.9 73,-0.2 1,-0.1 71,-0.0 -0.242 82.6 -99.4 -70.3 160.0 30.8 36.8 65.4 15 313 A D - 0 0 55 71,-2.5 73,-0.4 1,-0.1 2,-0.1 -0.429 45.8-102.9 -73.9 152.5 31.5 35.7 68.9 16 314 A P S S+ 0 0 118 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.447 75.6 14.3 -79.4 151.9 35.2 35.6 69.9 17 315 A G S S- 0 0 56 -2,-0.1 71,-0.4 71,-0.1 -2,-0.0 -0.368 92.3 -54.7 91.3-168.4 37.3 32.5 70.2 18 316 A D > - 0 0 48 -2,-0.1 3,-1.9 69,-0.1 4,-0.2 -0.970 32.0-141.5-119.3 128.3 36.9 28.9 69.1 19 317 A P G >> S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 3,-1.6 0.633 94.9 79.1 -63.6 -13.6 33.9 26.8 70.0 20 318 A R G 34 S+ 0 0 134 1,-0.3 -3,-0.0 2,-0.2 6,-0.0 0.618 78.6 71.7 -70.0 -11.2 36.1 23.8 70.5 21 319 A S G <4 S+ 0 0 87 -3,-1.9 -1,-0.3 1,-0.2 3,-0.1 0.660 118.4 15.4 -77.6 -16.0 37.0 25.3 73.9 22 320 A Y T <4 S+ 0 0 68 -3,-1.6 21,-2.4 -4,-0.2 2,-0.4 0.437 115.4 74.0-134.9 -3.6 33.6 24.4 75.1 23 321 A L E < -A 42 0A 4 -4,-1.7 2,-0.2 19,-0.2 19,-0.2 -0.956 59.8-168.6-118.1 132.8 32.1 21.9 72.6 24 322 A D E +A 41 0A 48 17,-2.8 17,-2.9 -2,-0.4 -3,-0.0 -0.732 51.9 25.6-118.7 166.7 33.3 18.2 72.4 25 323 A N E - 0 0 118 -2,-0.2 2,-0.4 15,-0.2 -1,-0.2 0.934 65.5-160.3 50.4 65.0 32.9 15.2 70.2 26 324 A F E + 0 0 57 -3,-0.2 2,-0.4 14,-0.1 14,-0.2 -0.604 13.0 179.4 -74.6 126.8 32.2 16.8 66.8 27 325 A I E -A 39 0A 97 12,-2.2 12,-2.6 -2,-0.4 2,-0.2 -0.988 25.6-130.4-133.8 123.1 30.6 14.3 64.4 28 326 A K E +A 38 0A 106 -2,-0.4 10,-0.3 10,-0.3 3,-0.1 -0.517 31.3 166.7 -71.3 134.0 29.6 15.1 60.8 29 327 A I E - 0 0 91 8,-2.8 2,-0.3 1,-0.3 9,-0.2 0.405 57.3 -32.8-126.9 -5.4 26.0 14.0 60.1 30 328 A G E -A 37 0A 25 7,-1.3 7,-2.3 2,-0.0 2,-0.3 -0.991 51.8-109.1 176.3-167.6 25.3 15.8 56.9 31 329 A E E -A 36 0A 136 -2,-0.3 5,-0.3 5,-0.3 2,-0.2 -0.920 11.7-162.8-147.5 170.4 25.6 18.7 54.5 32 330 A G - 0 0 48 3,-3.0 3,-0.4 -2,-0.3 5,-0.0 -0.774 49.5 -80.7-142.3-175.4 23.7 21.6 52.9 33 331 A S S S+ 0 0 127 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.794 128.0 33.8 -65.7 -28.7 24.3 23.8 49.9 34 332 A T S S- 0 0 35 1,-0.1 21,-0.5 25,-0.1 2,-0.3 0.448 127.5 -42.9-107.5 -2.3 26.8 26.0 51.7 35 333 A G E - B 0 54A 20 -3,-0.4 -3,-3.0 19,-0.2 2,-0.2 -0.970 68.5 -56.4 172.7-156.6 28.6 23.6 54.0 36 334 A I E -AB 31 53A 46 17,-1.8 17,-2.5 -2,-0.3 2,-0.4 -0.737 31.6-134.8-117.5 166.8 28.4 20.7 56.4 37 335 A V E -AB 30 52A 39 -7,-2.3 -8,-2.8 -2,-0.2 -7,-1.3 -0.983 20.4-179.7-125.7 129.2 26.6 19.9 59.7 38 336 A C E -AB 28 51A 6 13,-2.1 13,-3.5 -2,-0.4 2,-0.3 -0.870 21.5-134.5-122.0 156.0 28.2 18.3 62.7 39 337 A I E +AB 27 50A 34 -12,-2.6 -12,-2.2 -2,-0.3 2,-0.3 -0.813 29.5 176.3-105.3 152.0 26.7 17.5 66.1 40 338 A A E - B 0 49A 0 9,-2.0 9,-2.5 -2,-0.3 2,-0.4 -0.979 25.7-119.5-152.3 159.1 28.6 18.4 69.2 41 339 A T E -AB 24 48A 32 -17,-2.9 -17,-2.8 -2,-0.3 2,-0.7 -0.880 21.2-125.4-109.0 134.1 28.2 18.2 72.9 42 340 A V E > -A 23 0A 23 5,-2.9 4,-3.4 -2,-0.4 3,-0.5 -0.675 24.3-144.1 -74.7 115.6 28.2 21.2 75.3 43 341 A R T 4 S+ 0 0 136 -21,-2.4 -1,-0.2 -2,-0.7 -20,-0.1 0.827 92.8 47.4 -50.2 -41.2 30.9 20.1 77.7 44 342 A S T 4 S+ 0 0 116 -22,-0.4 -1,-0.2 1,-0.1 -21,-0.1 0.817 128.0 20.0 -75.8 -31.5 29.2 21.7 80.8 45 343 A S T 4 S- 0 0 79 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.1 0.628 90.3-126.1-113.8 -19.0 25.7 20.4 80.3 46 344 A G < + 0 0 49 -4,-3.4 2,-0.2 1,-0.3 -3,-0.1 0.572 58.8 150.1 81.3 7.5 26.0 17.4 77.9 47 345 A K - 0 0 104 -5,-0.4 -5,-2.9 -6,-0.1 2,-0.4 -0.503 44.9-123.2 -76.3 141.8 23.4 19.1 75.7 48 346 A L E +B 41 0A 78 -7,-0.2 51,-0.5 -2,-0.2 2,-0.3 -0.698 31.3 176.5 -90.0 135.8 23.6 18.4 71.9 49 347 A V E -BC 40 98A 3 -9,-2.5 -9,-2.0 -2,-0.4 2,-0.4 -0.898 26.4-123.8-131.3 161.0 23.9 21.2 69.4 50 348 A A E -BC 39 97A 13 47,-2.9 47,-3.7 -2,-0.3 2,-0.6 -0.889 19.9-155.7-106.2 137.2 24.3 21.3 65.6 51 349 A V E -BC 38 96A 0 -13,-3.5 -13,-2.1 -2,-0.4 2,-0.6 -0.943 0.8-157.3-119.4 115.6 27.3 23.1 64.1 52 350 A K E -BC 37 95A 30 43,-2.7 43,-2.6 -2,-0.6 2,-0.6 -0.782 10.5-163.2 -89.5 121.5 27.1 24.5 60.5 53 351 A K E -BC 36 94A 34 -17,-2.5 -17,-1.8 -2,-0.6 2,-0.4 -0.933 10.1-179.5-110.7 120.3 30.5 24.9 59.0 54 352 A M E -BC 35 93A 4 39,-2.7 39,-3.0 -2,-0.6 2,-0.2 -0.968 26.8-127.8-126.3 128.0 30.8 27.1 55.9 55 353 A D E - C 0 92A 39 -21,-0.5 37,-0.2 -2,-0.4 -2,-0.0 -0.495 13.2-149.0 -69.5 132.5 33.9 28.0 53.8 56 354 A L S S+ 0 0 0 35,-2.4 3,-0.3 -2,-0.2 -1,-0.2 0.824 93.4 44.0 -71.9 -31.5 34.2 31.7 53.4 57 355 A R S S+ 0 0 183 34,-0.5 2,-2.7 1,-0.2 -1,-0.1 0.962 102.0 60.6 -78.7 -57.8 35.9 31.4 50.0 58 356 A K S S+ 0 0 173 -24,-0.0 2,-0.3 -55,-0.0 -1,-0.2 -0.322 89.4 106.6 -73.0 61.9 33.8 28.8 48.2 59 357 A Q - 0 0 16 -2,-2.7 2,-0.4 -3,-0.3 3,-0.2 -0.929 57.7-139.9-139.6 163.9 30.6 30.7 48.3 60 358 A Q S S+ 0 0 162 -2,-0.3 5,-0.1 1,-0.2 4,-0.1 -0.934 84.5 3.7-121.8 145.3 28.1 32.7 46.2 61 359 A R >> - 0 0 104 -2,-0.4 3,-1.7 1,-0.1 4,-0.8 0.928 68.7-178.2 43.3 60.8 26.4 35.9 47.4 62 360 A R H 3> S+ 0 0 42 -61,-0.6 4,-2.1 1,-0.3 3,-0.4 0.769 73.2 72.1 -58.0 -27.7 28.2 36.0 50.7 63 361 A E H 3> S+ 0 0 62 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.820 95.6 51.5 -59.8 -30.6 26.2 39.1 51.6 64 362 A L H <> S+ 0 0 6 -3,-1.7 4,-1.4 2,-0.2 -1,-0.3 0.808 108.4 50.6 -75.7 -29.5 23.2 36.9 52.0 65 363 A L H X S+ 0 0 10 -4,-0.8 4,-1.1 -3,-0.4 -2,-0.2 0.817 111.2 49.8 -74.6 -31.6 25.1 34.6 54.3 66 364 A F H X S+ 0 0 38 -4,-2.1 4,-2.4 2,-0.2 3,-0.2 0.886 109.5 49.7 -73.4 -40.7 26.2 37.6 56.3 67 365 A N H X S+ 0 0 55 -4,-2.0 4,-3.0 1,-0.2 5,-0.5 0.826 103.9 61.9 -66.5 -31.6 22.6 38.9 56.6 68 366 A E H X S+ 0 0 18 -4,-1.4 4,-1.2 2,-0.2 -1,-0.2 0.873 110.6 37.8 -62.5 -39.6 21.5 35.5 57.7 69 367 A V H X S+ 0 0 5 -4,-1.1 4,-1.2 -3,-0.2 -2,-0.2 0.924 120.7 45.4 -78.4 -44.7 23.7 35.7 60.8 70 368 A V H < S+ 0 0 41 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.934 120.1 38.4 -63.5 -49.7 23.1 39.4 61.5 71 369 A I H < S+ 0 0 33 -4,-3.0 -3,-0.2 1,-0.2 -1,-0.2 0.893 122.1 41.7 -70.9 -40.1 19.4 39.4 61.0 72 370 A M H >< S+ 0 0 15 -4,-1.2 3,-1.3 -5,-0.5 11,-0.3 0.521 87.1 103.6 -89.7 -5.3 18.7 36.0 62.6 73 371 A R T 3< S+ 0 0 98 -4,-1.2 3,-0.1 1,-0.3 11,-0.1 -0.507 91.5 16.5 -73.3 147.6 21.0 36.2 65.6 74 372 A D T 3 S+ 0 0 143 9,-0.4 2,-0.3 1,-0.3 -1,-0.3 0.526 96.3 137.0 68.1 3.2 19.1 37.0 68.9 75 373 A Y < - 0 0 29 -3,-1.3 8,-0.4 8,-0.1 2,-0.4 -0.661 30.6-178.3 -84.0 136.3 15.9 35.9 67.0 76 374 A Q + 0 0 151 -2,-0.3 2,-0.3 -3,-0.1 5,-0.1 -0.924 17.0 139.5-143.6 116.5 13.6 33.7 69.0 77 375 A H B > -E 80 0B 35 3,-0.5 3,-2.4 -2,-0.4 52,-0.1 -0.967 51.4-126.3-153.8 136.2 10.4 32.1 68.0 78 376 A E T 3 S+ 0 0 144 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.753 113.3 47.7 -54.8 -26.1 9.0 28.7 68.8 79 377 A N T 3 S+ 0 0 18 78,-0.1 79,-3.1 46,-0.1 2,-0.4 0.164 101.6 77.5-102.7 17.1 8.5 28.1 65.0 80 378 A V B < S-Ef 77 158B 2 -3,-2.4 -3,-0.5 77,-0.3 79,-0.2 -0.994 87.1-109.6-130.0 130.2 11.9 29.3 64.0 81 379 A V - 0 0 15 77,-2.6 2,-0.4 -2,-0.4 -2,-0.1 -0.247 40.5-119.1 -55.9 140.2 15.2 27.3 64.3 82 380 A E - 0 0 44 -4,-0.1 16,-2.5 -6,-0.1 2,-0.5 -0.674 18.6-159.4 -92.7 137.6 17.5 28.8 66.9 83 381 A M E +D 97 0A 27 -8,-0.4 -9,-0.4 -2,-0.4 14,-0.2 -0.946 9.8 179.0-110.9 124.8 21.0 30.1 66.4 84 382 A Y E - 0 0 74 12,-2.4 2,-0.3 -2,-0.5 13,-0.2 0.914 59.2 -24.7 -90.9 -54.1 23.1 30.2 69.6 85 383 A N E -D 96 0A 52 11,-1.6 11,-2.1 -12,-0.1 -1,-0.3 -0.934 48.0-141.5-152.4 173.6 26.4 31.6 68.4 86 384 A S E -D 95 0A 6 -2,-0.3 -71,-2.5 9,-0.2 2,-0.3 -0.979 18.6-178.2-141.5 150.0 28.8 32.1 65.4 87 385 A Y E -D 94 0A 13 7,-2.5 7,-2.9 -2,-0.3 2,-0.6 -0.967 27.9-125.6-146.9 160.5 32.6 31.9 65.2 88 386 A L E +D 93 0A 29 -71,-0.4 2,-0.5 -73,-0.4 5,-0.2 -0.954 31.3 174.7-110.7 113.7 35.4 32.3 62.7 89 387 A V E > -D 92 0A 14 3,-2.2 3,-1.3 -2,-0.6 2,-0.1 -0.974 62.1 -48.1-122.9 114.6 37.6 29.2 62.6 90 388 A G T 3 S- 0 0 54 -2,-0.5 0, 0.0 1,-0.3 0, 0.0 -0.401 122.0 -24.4 60.6-133.2 40.3 29.3 60.0 91 389 A D T 3 S+ 0 0 78 -2,-0.1 -35,-2.4 -3,-0.1 -34,-0.5 -0.228 122.8 93.8-102.6 42.6 38.7 30.3 56.7 92 390 A E E < -CD 55 89A 66 -3,-1.3 -3,-2.2 -37,-0.2 2,-0.6 -0.968 67.8-135.5-136.7 151.2 35.3 29.1 57.9 93 391 A L E -CD 54 88A 1 -39,-3.0 -39,-2.7 -2,-0.3 2,-0.5 -0.924 23.9-163.1-103.0 122.0 32.2 30.5 59.5 94 392 A W E -CD 53 87A 3 -7,-2.9 -7,-2.5 -2,-0.6 2,-0.6 -0.943 3.5-168.1-110.1 123.7 30.9 28.1 62.2 95 393 A V E -CD 52 86A 5 -43,-2.6 -43,-2.7 -2,-0.5 2,-0.6 -0.948 9.9-151.4-115.5 115.2 27.3 28.6 63.4 96 394 A V E +CD 51 85A 3 -11,-2.1 -12,-2.4 -2,-0.6 -11,-1.6 -0.770 33.0 162.4 -86.4 121.9 26.3 26.8 66.6 97 395 A M E -CD 50 83A 29 -47,-3.7 -47,-2.9 -2,-0.6 -14,-0.2 -0.770 42.0 -69.1-134.5 177.9 22.6 26.1 66.4 98 396 A E E -C 49 0A 26 -16,-2.5 2,-0.6 -2,-0.2 -49,-0.1 -0.403 44.9-132.2 -67.6 139.5 19.8 24.0 67.8 99 397 A F - 0 0 62 -51,-0.5 2,-0.6 -2,-0.1 -51,-0.1 -0.872 18.9-164.4 -98.0 121.8 19.8 20.4 66.8 100 398 A L > - 0 0 15 -2,-0.6 3,-0.8 1,-0.1 50,-0.2 -0.938 6.3-164.9-110.0 116.5 16.5 19.1 65.5 101 399 A E T 3 S+ 0 0 130 -2,-0.6 50,-0.2 1,-0.2 -1,-0.1 0.716 76.5 72.5 -70.8 -26.0 16.1 15.3 65.5 102 400 A G T 3 S- 0 0 14 48,-1.9 186,-0.3 1,-0.2 -1,-0.2 0.556 89.5-144.5 -70.3 -8.6 13.1 15.0 63.2 103 401 A G E < -G 150 0B 31 -3,-0.8 47,-2.2 47,-0.6 -1,-0.2 -0.177 37.8 -36.1 74.6-173.3 14.9 16.0 60.0 104 402 A A E >> -G 149 0B 31 45,-0.2 3,-0.7 1,-0.1 4,-0.5 -0.430 49.3-119.4 -84.8 160.8 13.5 18.1 57.2 105 403 A L H 3> S+ 0 0 2 43,-1.9 4,-2.1 40,-1.2 3,-0.5 0.735 104.8 75.4 -71.0 -21.9 9.9 18.0 55.9 106 404 A T H 3> S+ 0 0 32 39,-0.7 4,-1.4 42,-0.3 -1,-0.2 0.857 89.0 56.6 -59.0 -37.4 11.2 16.8 52.4 107 405 A D H <4 S+ 0 0 42 -3,-0.7 -1,-0.2 1,-0.2 4,-0.2 0.868 110.2 46.5 -63.1 -35.0 11.8 13.3 53.7 108 406 A I H >X S+ 0 0 1 -4,-0.5 4,-1.6 -3,-0.5 3,-1.0 0.905 110.6 49.4 -74.2 -43.9 8.2 13.1 54.8 109 407 A V H 3< S+ 0 0 7 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.715 113.8 47.1 -70.0 -20.8 6.6 14.5 51.6 110 408 A T T 3< S+ 0 0 76 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.389 121.2 33.9-101.0 3.0 8.6 12.1 49.4 111 409 A H T <4 S+ 0 0 110 -3,-1.0 2,-0.3 -4,-0.2 -2,-0.2 0.471 119.7 23.1-132.9 -8.5 8.0 8.9 51.3 112 410 A T S < S- 0 0 46 -4,-1.6 2,-0.5 -5,-0.1 -1,-0.2 -0.882 70.7-110.0-148.3 178.9 4.5 9.2 52.8 113 411 A R - 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0 0 29 -2,-1.8 6,-0.1 -3,-0.2 -55,-0.1 -0.964 47.1-151.7-114.3 125.7 -2.6 34.4 43.6 257 555 A R S S+ 0 0 82 -2,-0.5 -70,-0.3 1,-0.1 -1,-0.1 0.912 85.1 69.6 -62.6 -46.5 -0.4 36.0 41.0 258 556 A D S >> S- 0 0 90 1,-0.2 3,-2.1 -72,-0.1 4,-0.7 -0.653 74.5-156.7 -76.2 104.0 -1.3 39.6 42.0 259 557 A P G >4 S+ 0 0 42 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.771 90.0 65.8 -53.7 -25.7 0.5 39.9 45.3 260 558 A A G 34 S+ 0 0 75 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.782 107.2 39.7 -67.5 -27.2 -2.0 42.6 46.3 261 559 A Q G <4 S+ 0 0 122 -3,-2.1 -1,-0.2 2,-0.1 2,-0.2 0.433 95.4 103.0-100.4 -2.7 -4.9 40.1 46.2 262 560 A R S << S- 0 0 7 -4,-0.7 -8,-0.2 -3,-0.5 -9,-0.1 -0.576 81.0-105.1 -80.2 143.8 -2.8 37.4 47.9 263 561 A A - 0 0 3 -10,-2.3 2,-0.1 -2,-0.2 -1,-0.1 -0.371 29.2-129.1 -70.8 147.7 -3.5 36.7 51.6 264 562 A T > - 0 0 52 1,-0.1 4,-2.0 -2,-0.1 5,-0.1 -0.413 24.6-109.5 -87.4 169.6 -1.1 37.9 54.2 265 563 A A H > S+ 0 0 3 2,-0.2 4,-1.5 1,-0.2 -134,-0.2 0.941 117.1 54.7 -65.9 -47.5 0.2 35.6 56.9 266 564 A A H 4 S+ 0 0 64 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.887 111.2 45.8 -53.5 -42.6 -1.7 37.3 59.7 267 565 A E H >4 S+ 0 0 105 1,-0.2 3,-1.9 2,-0.2 4,-0.2 0.926 107.6 56.6 -67.7 -45.3 -5.0 36.9 57.8 268 566 A L H >< S+ 0 0 4 -4,-2.0 3,-1.5 1,-0.3 6,-0.3 0.734 92.5 69.7 -59.2 -25.7 -4.3 33.2 56.9 269 567 A L T 3< S+ 0 0 57 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.777 99.7 50.7 -64.3 -22.8 -3.9 32.4 60.6 270 568 A K T < S+ 0 0 182 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.476 84.5 122.1 -91.0 -4.7 -7.6 33.0 60.8 271 569 A H X - 0 0 40 -3,-1.5 3,-1.5 -4,-0.2 4,-0.4 -0.410 69.0-126.3 -68.1 132.0 -8.4 30.7 57.9 272 570 A P G > S+ 0 0 90 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.762 103.1 66.4 -41.7 -41.7 -10.8 27.8 58.6 273 571 A F G > S+ 0 0 0 -27,-0.4 3,-2.1 1,-0.3 4,-0.1 0.873 92.5 60.1 -54.3 -41.8 -8.4 25.1 57.3 274 572 A L G X S+ 0 0 9 -3,-1.5 3,-1.5 1,-0.3 -1,-0.3 0.632 86.7 75.5 -64.2 -13.1 -5.9 25.7 60.1 275 573 A A G < S+ 0 0 90 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.697 89.2 60.7 -70.6 -16.9 -8.6 24.7 62.6 276 574 A K G < S+ 0 0 82 -3,-2.1 -1,-0.3 -4,-0.3 -155,-0.2 0.454 76.3 129.7 -87.3 -2.9 -7.9 21.2 61.4 277 575 A A < - 0 0 27 -3,-1.5 -159,-0.2 -157,-0.3 -160,-0.1 -0.326 48.9-147.0 -58.1 123.0 -4.3 21.4 62.6 278 576 A G - 0 0 15 -161,-2.6 -1,-0.1 1,-0.1 -2,-0.0 -0.224 25.4 -88.6 -81.8 178.2 -3.3 18.5 64.8 279 577 A P >> - 0 0 76 0, 0.0 3,-1.5 0, 0.0 4,-0.5 -0.318 42.3 -95.0 -83.9 171.3 -0.9 18.7 67.7 280 578 A P H >> S+ 0 0 63 0, 0.0 3,-1.7 0, 0.0 4,-0.9 0.876 124.5 61.1 -51.1 -40.6 2.9 18.2 67.5 281 579 A A H 34 S+ 0 0 67 1,-0.3 3,-0.3 2,-0.2 -127,-0.1 0.791 92.0 65.4 -58.2 -31.3 2.4 14.5 68.5 282 580 A S H <4 S+ 0 0 18 -3,-1.5 -1,-0.3 1,-0.2 4,-0.2 0.716 100.9 51.9 -65.9 -19.8 0.3 14.0 65.3 283 581 A I H XX S+ 0 0 3 -3,-1.7 3,-1.9 -4,-0.5 4,-0.7 0.793 89.3 79.2 -85.8 -32.0 3.5 14.6 63.3 284 582 A V G >< S+ 0 0 38 -4,-0.9 3,-1.5 -3,-0.3 6,-0.2 0.873 84.8 58.7 -44.4 -54.0 5.7 12.1 65.0 285 583 A P G 34 S+ 0 0 82 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.758 100.1 61.9 -51.4 -24.1 4.4 9.0 63.2 286 584 A L G <4 S+ 0 0 13 -3,-1.9 -2,-0.2 -4,-0.2 5,-0.1 0.829 80.6 102.4 -71.7 -34.8 5.5 10.7 60.0 287 585 A M S X< S- 0 0 8 -3,-1.5 3,-1.5 -4,-0.7 4,-0.4 -0.112 80.8-118.1 -53.7 147.6 9.2 10.8 60.9 288 586 A R G > S+ 0 0 137 -186,-0.3 3,-2.1 1,-0.3 -1,-0.1 0.926 112.8 52.4 -52.6 -56.8 11.5 8.3 59.3 289 587 A Q G 3 S+ 0 0 174 1,-0.3 -1,-0.3 -187,-0.1 -2,-0.1 0.532 116.0 45.5 -62.1 -2.3 12.7 6.6 62.5 290 588 A N G < 0 0 86 -3,-1.5 -1,-0.3 -6,-0.2 -2,-0.2 0.381 360.0 360.0-119.6 -1.3 9.0 6.2 63.3 291 589 A R < 0 0 107 -3,-2.1 -5,-0.1 -4,-0.4 -4,-0.0 -0.386 360.0 360.0 -84.0 360.0 7.7 4.9 59.9