==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-APR-12 4APP . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PAK 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.D.KNIGHTON,Y.L.DENG,C.WANG,C.GUO,I.MCALPINE,J.ZHANG,S.KEPH . 292 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13855.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 205 70.2 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 16.1 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 . 22 7.5 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 27.7 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 2 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 0 104 0, 0.0 61,-0.1 0, 0.0 62,-0.1 0.000 360.0 360.0 360.0 112.3 54.8 45.9 9.2 2 300 A S > - 0 0 55 1,-0.1 4,-1.7 4,-0.0 5,-0.1 -0.047 360.0-101.3 -67.7 175.3 58.3 44.6 8.8 3 301 A H H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.906 123.1 45.6 -66.4 -43.0 59.6 41.3 10.4 4 302 A E H > S+ 0 0 109 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.851 111.7 50.7 -70.8 -34.4 61.3 43.1 13.2 5 303 A Q H > S+ 0 0 119 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.856 112.3 50.6 -68.6 -32.5 58.4 45.4 13.9 6 304 A F H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.948 112.4 43.5 -67.7 -52.0 56.3 42.2 14.0 7 305 A R H X S+ 0 0 65 -4,-2.7 4,-3.0 2,-0.2 -2,-0.2 0.907 117.0 48.1 -60.4 -43.4 58.6 40.4 16.4 8 306 A A H X S+ 0 0 52 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.930 112.6 46.7 -64.2 -47.6 58.9 43.6 18.5 9 307 A A H X S+ 0 0 16 -4,-2.7 4,-1.0 1,-0.2 3,-0.3 0.924 114.4 49.2 -59.8 -43.3 55.1 44.2 18.5 10 308 A L H >X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 3,-1.0 0.932 106.9 54.3 -60.9 -47.1 54.7 40.5 19.4 11 309 A Q H 3< S+ 0 0 96 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.781 104.5 58.5 -58.0 -28.2 57.3 40.8 22.2 12 310 A L H 3< S+ 0 0 147 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.789 114.0 32.8 -74.0 -29.5 55.2 43.7 23.6 13 311 A V H << S+ 0 0 25 -3,-1.0 -2,-0.2 -4,-1.0 -1,-0.2 0.545 103.3 83.3-106.4 -8.4 52.0 41.7 24.0 14 312 A V S < S- 0 0 10 -4,-1.7 73,-0.2 -5,-0.1 81,-0.1 -0.452 91.2 -87.2 -90.6 167.2 53.3 38.2 24.9 15 313 A D - 0 0 58 71,-2.5 73,-0.4 -2,-0.1 2,-0.1 -0.503 44.7-120.3 -73.6 141.0 54.4 37.1 28.4 16 314 A P S S+ 0 0 110 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.488 72.0 41.0 -80.0 152.9 58.0 37.8 29.2 17 315 A G S S- 0 0 63 -2,-0.1 71,-0.2 71,-0.1 -2,-0.0 -0.379 91.7 -66.7 103.7 175.0 60.3 34.9 30.1 18 316 A D > - 0 0 60 -2,-0.1 3,-2.2 1,-0.1 4,-0.2 -0.923 25.7-146.5-111.0 126.7 60.9 31.5 28.7 19 317 A P G >> S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 3,-1.2 0.666 95.5 76.9 -62.8 -15.0 58.2 28.7 29.0 20 318 A R G 34 S+ 0 0 143 1,-0.3 -3,-0.0 2,-0.2 0, 0.0 0.645 81.0 71.9 -69.0 -12.6 61.0 26.2 29.3 21 319 A S G <4 S+ 0 0 83 -3,-2.2 -1,-0.3 1,-0.2 3,-0.0 0.787 118.9 11.3 -73.1 -28.1 61.3 27.5 32.9 22 320 A Y T <4 S+ 0 0 59 -3,-1.2 21,-2.9 -4,-0.2 2,-0.4 0.331 113.2 83.5-132.7 6.0 58.1 25.8 33.9 23 321 A L E < +A 42 0A 4 -4,-1.5 19,-0.2 19,-0.2 2,-0.2 -0.944 53.1 179.9-117.2 135.0 57.2 23.5 31.1 24 322 A D E +A 41 0A 55 17,-2.8 17,-1.9 -2,-0.4 -3,-0.0 -0.692 49.6 23.3-124.8 178.1 58.6 20.0 30.6 25 323 A N E - 0 0 121 -2,-0.2 2,-0.2 15,-0.2 -1,-0.2 0.800 66.5-162.6 30.7 63.3 58.5 16.9 28.3 26 324 A F E - 0 0 56 -3,-0.2 2,-0.4 14,-0.1 14,-0.2 -0.502 9.9-176.0 -69.1 137.0 57.3 18.6 25.2 27 325 A I E -A 39 0A 95 12,-2.2 12,-2.1 -2,-0.2 2,-0.0 -0.942 24.4-125.9-142.0 116.7 55.9 16.1 22.8 28 326 A K E +A 38 0A 112 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.346 31.1 169.3 -60.5 136.4 54.7 16.9 19.2 29 327 A I E - 0 0 87 8,-2.7 2,-0.3 1,-0.2 9,-0.2 0.438 60.5 -46.9-125.8 -11.0 51.2 15.6 18.6 30 328 A G E -A 37 0A 25 7,-1.5 7,-1.4 2,-0.0 2,-0.3 -0.938 55.3-109.7 174.5-151.5 50.4 17.3 15.3 31 329 A E E -A 36 0A 131 5,-0.3 5,-0.3 -2,-0.3 2,-0.2 -0.983 15.3-146.8-165.7 168.8 50.6 20.6 13.4 32 330 A G E > -A 35 0A 50 3,-2.1 3,-0.5 -2,-0.3 5,-0.0 -0.522 50.0 -58.7-129.3-162.8 48.6 23.4 11.9 33 331 A S T 3 S+ 0 0 122 1,-0.2 3,-0.1 -2,-0.2 21,-0.0 0.640 130.4 3.9 -58.1 -17.8 48.3 26.0 9.1 34 332 A T T 3 S+ 0 0 21 19,-0.1 21,-2.0 25,-0.0 2,-0.3 0.192 129.1 3.0-159.3 26.9 51.7 27.5 10.0 35 333 A G E < S-AB 32 54A 20 -3,-0.5 -3,-2.1 19,-0.2 2,-0.3 -0.925 75.9 -73.9-179.2-156.8 53.4 25.5 12.8 36 334 A I E -AB 31 53A 49 17,-2.5 17,-2.6 -5,-0.3 2,-0.4 -0.855 23.9-137.1-129.0 163.5 53.2 22.6 15.1 37 335 A V E +AB 30 52A 42 -7,-1.4 -8,-2.7 -2,-0.3 -7,-1.5 -0.968 24.8 175.2-121.2 136.8 51.2 21.5 18.2 38 336 A C E -AB 28 51A 5 13,-2.7 13,-3.2 -2,-0.4 2,-0.4 -0.854 26.0-129.2-133.9 167.8 52.8 19.8 21.2 39 337 A I E +AB 27 50A 36 -12,-2.1 -12,-2.2 -2,-0.3 2,-0.3 -0.921 32.9 173.1-116.2 145.4 51.7 18.6 24.6 40 338 A A E - B 0 49A 2 9,-2.8 9,-2.7 -2,-0.4 2,-0.4 -0.916 26.5-118.2-145.8 171.9 53.7 19.6 27.7 41 339 A T E -AB 24 48A 43 -17,-1.9 -17,-2.8 -2,-0.3 2,-0.6 -0.956 18.9-129.0-122.1 133.3 53.7 19.5 31.5 42 340 A V E > -A 23 0A 20 5,-3.1 4,-3.8 -2,-0.4 5,-0.5 -0.700 22.2-143.1 -80.1 119.6 53.6 22.3 33.9 43 341 A R T 4 S+ 0 0 133 -21,-2.9 -1,-0.2 -2,-0.6 -20,-0.1 0.910 91.7 49.1 -46.8 -61.9 56.5 21.6 36.4 44 342 A S T 4 S+ 0 0 117 -22,-0.2 -1,-0.2 1,-0.2 -21,-0.1 0.827 129.9 18.7 -52.6 -40.4 54.9 22.9 39.7 45 343 A S T 4 S- 0 0 76 -3,-0.3 -2,-0.2 2,-0.1 -1,-0.2 0.706 90.4-127.9-106.8 -26.1 51.6 21.0 39.2 46 344 A G < + 0 0 46 -4,-3.8 2,-0.2 1,-0.3 -3,-0.2 0.559 54.4 158.2 85.1 7.4 52.3 18.3 36.6 47 345 A K - 0 0 115 -5,-0.5 -5,-3.1 -6,-0.1 2,-0.4 -0.461 39.0-129.6 -68.3 132.7 49.3 19.7 34.8 48 346 A L E +B 41 0A 78 -7,-0.2 51,-0.4 -2,-0.2 2,-0.3 -0.697 33.6 170.1 -88.6 136.1 49.3 18.8 31.1 49 347 A V E -B 40 0A 2 -9,-2.7 -9,-2.8 -2,-0.4 2,-0.4 -0.888 31.3-113.1-137.8 168.0 48.7 21.6 28.5 50 348 A A E -BC 39 97A 14 47,-2.7 47,-3.4 -2,-0.3 2,-0.5 -0.871 23.6-156.9-107.4 139.0 48.9 22.0 24.8 51 349 A V E -BC 38 96A 0 -13,-3.2 -13,-2.7 -2,-0.4 2,-0.7 -0.963 3.5-156.8-120.6 124.3 51.5 24.3 23.2 52 350 A K E -BC 37 95A 31 43,-3.0 43,-2.5 -2,-0.5 2,-0.7 -0.872 9.8-165.4 -99.7 111.6 51.1 25.8 19.7 53 351 A K E -BC 36 94A 30 -17,-2.6 -17,-2.5 -2,-0.7 2,-0.4 -0.880 9.0-165.5-100.4 114.3 54.5 26.7 18.2 54 352 A M E -BC 35 93A 17 39,-3.1 39,-2.1 -2,-0.7 2,-0.8 -0.857 20.5-129.9-107.5 133.7 54.2 29.0 15.2 55 353 A D E > - C 0 92A 41 -21,-2.0 3,-1.8 -2,-0.4 37,-0.2 -0.677 14.8-159.9 -79.5 108.4 56.8 29.8 12.6 56 354 A L G > S+ 0 0 1 35,-2.6 3,-0.6 -2,-0.8 -1,-0.2 0.699 89.0 60.1 -62.7 -20.6 56.9 33.6 12.4 57 355 A R G 3 S+ 0 0 168 34,-0.5 -1,-0.3 1,-0.2 35,-0.1 0.490 102.1 54.0 -86.3 -2.7 58.6 33.4 8.9 58 356 A K G < S+ 0 0 139 -3,-1.8 2,-0.5 -24,-0.2 -1,-0.2 0.297 76.6 118.9-111.1 6.8 55.6 31.5 7.5 59 357 A Q < - 0 0 33 -3,-0.6 3,-0.5 -4,-0.2 -25,-0.0 -0.649 45.0-165.5 -79.3 119.8 52.9 34.0 8.5 60 358 A Q S S+ 0 0 169 -2,-0.5 2,-0.6 1,-0.3 -1,-0.2 0.978 88.7 19.1 -65.4 -58.2 51.1 35.3 5.5 61 359 A R S >> S- 0 0 165 1,-0.1 3,-1.4 2,-0.0 4,-0.7 -0.829 70.5-177.1-116.6 88.9 49.4 38.2 7.3 62 360 A R H 3> S+ 0 0 70 -2,-0.6 4,-1.3 -3,-0.5 -1,-0.1 0.618 78.3 70.9 -62.6 -11.3 51.4 38.7 10.5 63 361 A E H 3> S+ 0 0 78 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.883 94.2 54.9 -71.3 -37.1 48.9 41.4 11.5 64 362 A L H <> S+ 0 0 15 -3,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.822 102.8 54.8 -64.6 -34.6 46.3 38.7 12.1 65 363 A L H X S+ 0 0 3 -4,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.923 107.7 50.5 -65.3 -42.7 48.5 36.7 14.5 66 364 A F H X S+ 0 0 47 -4,-1.3 4,-2.2 1,-0.2 -2,-0.2 0.889 108.5 52.4 -61.1 -41.0 48.9 39.9 16.6 67 365 A N H X S+ 0 0 53 -4,-1.8 4,-2.3 1,-0.2 5,-0.4 0.842 105.8 55.5 -63.5 -36.0 45.2 40.3 16.6 68 366 A E H X S+ 0 0 9 -4,-1.7 4,-1.9 94,-0.2 5,-0.2 0.934 111.5 40.9 -64.4 -48.3 44.7 36.7 17.9 69 367 A V H X S+ 0 0 1 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.902 118.5 46.2 -68.8 -41.8 47.0 37.1 20.9 70 368 A V H < S+ 0 0 54 -4,-2.2 4,-0.3 -5,-0.2 -2,-0.2 0.934 119.6 37.5 -66.8 -48.8 45.7 40.6 21.8 71 369 A I H < S+ 0 0 36 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.878 127.3 31.7 -73.0 -40.2 42.0 39.9 21.5 72 370 A M H >< S+ 0 0 11 -4,-1.9 3,-1.3 -5,-0.4 11,-0.4 0.551 86.1 99.2 -99.4 -8.7 41.8 36.4 22.9 73 371 A R T 3< S+ 0 0 102 -4,-1.4 10,-0.3 1,-0.3 -1,-0.1 0.901 102.1 21.0 -43.9 -57.1 44.6 36.3 25.5 74 372 A D T 3 S+ 0 0 129 -4,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 0.259 91.4 137.1 -99.0 12.6 42.3 36.8 28.5 75 373 A Y < - 0 0 21 -3,-1.3 2,-0.4 6,-0.1 8,-0.4 -0.355 31.8-171.1 -62.8 134.6 39.1 35.7 26.8 76 374 A Q + 0 0 153 6,-0.1 2,-0.3 -2,-0.1 5,-0.1 -0.932 22.4 135.5-135.7 111.7 37.0 33.5 29.0 77 375 A H B > -E 80 0B 45 3,-0.5 3,-2.2 -2,-0.4 52,-0.0 -0.968 54.2-124.8-153.6 137.8 33.9 31.6 27.8 78 376 A E T 3 S+ 0 0 140 -2,-0.3 4,-0.1 1,-0.3 -1,-0.0 0.717 113.4 44.2 -56.2 -25.0 32.8 28.0 28.4 79 377 A N T 3 S+ 0 0 21 78,-0.1 79,-3.1 46,-0.1 2,-0.4 0.116 101.3 81.9-107.9 20.4 32.5 27.3 24.7 80 378 A V B < S-Ef 77 158B 3 -3,-2.2 -3,-0.5 77,-0.3 79,-0.2 -0.992 85.2-114.1-128.4 125.8 35.8 29.0 23.8 81 379 A V - 0 0 15 77,-2.3 2,-0.3 -2,-0.4 -2,-0.1 -0.312 38.0-124.8 -57.1 134.5 39.3 27.3 24.1 82 380 A E - 0 0 71 -4,-0.1 16,-1.8 -6,-0.0 2,-0.5 -0.632 12.6-148.4 -89.8 142.2 41.3 29.1 26.7 83 381 A M E -D 97 0A 12 -11,-0.4 14,-0.3 -8,-0.4 3,-0.1 -0.927 12.7-177.2-106.4 126.8 44.8 30.6 26.2 84 382 A Y E - 0 0 74 12,-2.6 2,-0.3 -2,-0.5 13,-0.2 0.911 61.1 -18.4 -88.8 -51.1 47.0 30.5 29.3 85 383 A N E -D 96 0A 49 11,-1.4 11,-2.5 -70,-0.0 2,-0.3 -0.954 50.4-149.5-152.1 167.5 50.2 32.2 28.1 86 384 A S E -D 95 0A 4 -2,-0.3 -71,-2.5 9,-0.2 2,-0.3 -0.988 14.6-173.9-143.3 144.7 52.1 33.3 25.0 87 385 A Y E -D 94 0A 14 7,-2.8 7,-3.2 -2,-0.3 2,-0.7 -0.989 24.6-133.7-142.2 149.4 55.9 33.6 24.4 88 386 A L E +D 93 0A 24 -73,-0.4 2,-0.6 -2,-0.3 5,-0.2 -0.919 27.7 178.9-103.4 112.0 58.2 34.9 21.7 89 387 A V E > -D 92 0A 28 3,-3.2 3,-1.1 -2,-0.7 2,-0.5 -0.848 58.2 -64.8-118.2 94.6 61.0 32.3 21.3 90 388 A G T 3 S- 0 0 46 -2,-0.6 0, 0.0 1,-0.3 0, 0.0 -0.538 119.1 -13.6 69.0-116.4 63.4 33.3 18.6 91 389 A D T 3 S+ 0 0 47 -2,-0.5 -35,-2.6 -3,-0.1 -34,-0.5 -0.021 124.7 86.8-107.1 27.4 61.4 33.2 15.3 92 390 A E E < -CD 55 89A 67 -3,-1.1 -3,-3.2 -37,-0.2 2,-0.6 -0.982 65.2-144.4-132.7 141.9 58.5 31.4 16.9 93 391 A L E -CD 54 88A 0 -39,-2.1 -39,-3.1 -2,-0.4 2,-0.6 -0.904 19.2-159.9-101.2 122.7 55.4 32.3 18.8 94 392 A W E -CD 53 87A 2 -7,-3.2 -7,-2.8 -2,-0.6 2,-0.5 -0.929 6.3-170.8-106.4 123.0 54.6 29.8 21.5 95 393 A V E -CD 52 86A 1 -43,-2.5 -43,-3.0 -2,-0.6 2,-0.5 -0.960 10.1-153.1-117.4 115.9 51.0 29.8 22.7 96 394 A V E +CD 51 85A 2 -11,-2.5 -12,-2.6 -2,-0.5 -11,-1.4 -0.780 29.2 163.1 -88.5 123.6 50.2 27.7 25.8 97 395 A M E -CD 50 83A 31 -47,-3.4 -47,-2.7 -2,-0.5 -14,-0.2 -0.839 42.0 -74.8-135.3 172.1 46.6 26.6 25.8 98 396 A E - 0 0 27 -16,-1.8 2,-0.6 -2,-0.3 -49,-0.1 -0.342 45.1-122.2 -68.0 148.5 44.3 24.1 27.4 99 397 A F - 0 0 73 -51,-0.4 2,-0.7 -2,-0.0 -1,-0.1 -0.844 21.6-159.2 -95.0 121.5 44.5 20.5 26.2 100 398 A L > - 0 0 15 -2,-0.6 3,-1.2 1,-0.1 50,-0.2 -0.902 3.6-164.2-106.4 109.8 41.2 19.2 24.9 101 399 A E T 3 S+ 0 0 74 -2,-0.7 50,-0.2 1,-0.2 -1,-0.1 0.744 78.6 69.3 -61.9 -31.4 41.1 15.4 24.9 102 400 A G T 3 S- 0 0 7 48,-2.2 186,-0.3 1,-0.2 -1,-0.2 0.576 91.0-146.0 -69.3 -10.5 38.2 14.9 22.5 103 401 A G E < -G 150 0B 30 -3,-1.2 47,-2.0 47,-0.6 2,-0.2 -0.255 35.5 -38.1 77.1-168.4 40.0 16.2 19.4 104 402 A A E >> -G 149 0B 30 45,-0.2 3,-0.7 1,-0.1 4,-0.5 -0.617 45.5-120.9 -96.5 155.7 38.5 18.1 16.5 105 403 A L H >> S+ 0 0 1 43,-2.1 4,-2.5 40,-1.1 3,-0.7 0.756 104.9 75.1 -64.1 -24.5 35.1 17.7 15.0 106 404 A T H 3> S+ 0 0 35 39,-0.7 4,-1.7 42,-0.3 -1,-0.2 0.923 91.6 52.0 -53.7 -49.4 36.8 17.0 11.6 107 405 A D H <4 S+ 0 0 45 -3,-0.7 -1,-0.3 1,-0.2 4,-0.2 0.755 112.8 47.8 -61.0 -25.3 37.8 13.5 12.7 108 406 A I H XX S+ 0 0 3 -3,-0.7 4,-1.8 -4,-0.5 3,-1.4 0.943 109.5 47.5 -81.4 -53.1 34.2 12.8 13.6 109 407 A V H 3< S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.763 113.6 51.1 -61.4 -24.9 32.3 14.1 10.6 110 408 A T T 3< S+ 0 0 73 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.535 119.7 31.9 -91.2 -5.9 34.8 12.2 8.3 111 409 A H T <4 S+ 0 0 101 -3,-1.4 2,-0.3 1,-0.3 -2,-0.2 0.467 121.5 19.3-127.5 -5.5 34.4 8.8 10.1 112 410 A T < - 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0 0 4 0, 0.0 3,-1.1 0, 0.0 -32,-0.1 -0.264 54.8 -77.4 -76.8 169.5 31.4 20.8 2.6 216 514 A P T 3 S+ 0 0 20 0, 0.0 4,-0.1 0, 0.0 13,-0.1 -0.262 114.8 15.0 -64.2 155.8 29.9 21.6 -0.8 217 515 A Y T > S+ 0 0 58 1,-0.2 3,-2.1 -3,-0.1 8,-0.1 0.720 77.8 142.5 52.8 24.5 32.2 21.6 -3.8 218 516 A F T < + 0 0 89 -3,-1.1 -1,-0.2 1,-0.3 -36,-0.0 0.664 67.5 61.8 -68.4 -12.4 34.8 19.7 -1.8 219 517 A N T 3 S+ 0 0 121 2,-0.1 -1,-0.3 6,-0.0 -2,-0.1 0.330 96.5 77.7 -92.0 5.0 35.5 17.8 -5.0 220 518 A E S < S- 0 0 55 -3,-2.1 5,-0.0 -4,-0.1 0, 0.0 -0.817 94.6 -93.9-114.5 153.6 36.6 21.0 -6.6 221 519 A P > - 0 0 75 0, 0.0 4,-2.8 0, 0.0 3,-0.4 -0.304 43.4-108.9 -61.5 151.8 39.8 23.0 -6.3 222 520 A P H > S+ 0 0 61 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.892 117.6 46.4 -49.3 -51.8 39.7 25.7 -3.6 223 521 A L H > S+ 0 0 139 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.831 114.5 49.4 -63.4 -31.0 39.7 28.7 -5.9 224 522 A K H > S+ 0 0 109 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.910 109.9 49.5 -74.1 -43.6 37.1 27.0 -8.1 225 523 A A H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.930 108.2 55.4 -59.5 -44.3 34.8 26.3 -5.1 226 524 A M H X S+ 0 0 18 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.882 107.5 49.0 -56.2 -40.7 35.2 29.9 -4.0 227 525 A K H X S+ 0 0 124 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.892 112.5 47.7 -66.5 -40.6 33.9 31.0 -7.5 228 526 A M H X S+ 0 0 47 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.902 111.6 50.1 -67.1 -41.7 30.9 28.7 -7.3 229 527 A I H < S+ 0 0 11 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.923 113.5 46.3 -62.2 -44.5 30.1 29.8 -3.8 230 528 A R H < S+ 0 0 83 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.840 125.6 28.4 -67.4 -35.5 30.2 33.4 -4.8 231 529 A D H < S+ 0 0 80 -4,-2.0 -2,-0.2 -5,-0.1 -3,-0.2 0.716 106.4 73.0-102.8 -23.8 28.1 33.0 -8.0 232 530 A N S < S- 0 0 66 -4,-3.1 -4,-0.0 -5,-0.2 0, 0.0 -0.405 87.7 -89.0 -91.8 169.0 25.8 30.0 -7.5 233 531 A L S S- 0 0 144 1,-0.2 -1,-0.1 -2,-0.1 3,-0.1 -0.306 71.1 -65.3 -66.0 158.4 22.6 29.6 -5.4 234 532 A P - 0 0 36 0, 0.0 -1,-0.2 0, 0.0 22,-0.0 -0.021 65.9 -94.2 -46.4 149.5 23.2 28.4 -1.8 235 533 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 20,-0.1 -0.202 37.8-137.8 -64.9 157.8 24.7 24.8 -1.5 236 534 A R - 0 0 145 -3,-0.1 2,-0.3 -28,-0.0 3,-0.1 -0.852 15.9-108.3-120.5 155.7 22.5 21.8 -1.0 237 535 A L > - 0 0 13 -2,-0.3 3,-0.8 1,-0.2 4,-0.1 -0.630 12.0-153.6 -83.4 136.5 22.8 18.7 1.2 238 536 A K T 3 S+ 0 0 157 -2,-0.3 2,-0.8 1,-0.3 3,-0.3 0.943 101.3 45.1 -71.1 -48.2 23.6 15.4 -0.4 239 537 A N T > S+ 0 0 38 1,-0.2 3,-1.2 2,-0.1 4,-0.4 -0.264 77.5 144.6 -89.5 46.7 21.9 13.5 2.5 240 538 A L G X + 0 0 47 -3,-0.8 3,-1.4 -2,-0.8 -1,-0.2 0.901 66.7 47.8 -51.7 -51.9 18.9 15.9 2.3 241 539 A H G 3 S+ 0 0 174 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.541 99.2 68.9 -72.9 -5.9 16.2 13.4 3.1 242 540 A K G < S+ 0 0 166 -3,-1.2 2,-0.3 2,-0.1 -1,-0.3 0.543 90.8 76.3 -88.2 -6.5 18.0 11.9 6.0 243 541 A V S < S- 0 0 12 -3,-1.4 -32,-0.0 -4,-0.4 0, 0.0 -0.755 83.4-110.5-106.3 154.0 17.5 15.2 8.0 244 542 A S > - 0 0 26 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.284 27.1-110.6 -77.8 162.2 14.4 16.4 9.8 245 543 A P H > S+ 0 0 104 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.811 119.6 56.7 -60.0 -31.9 12.3 19.5 8.8 246 544 A S H > S+ 0 0 35 2,-0.2 4,-2.2 1,-0.2 27,-0.3 0.898 108.3 44.3 -67.8 -43.0 13.6 21.2 11.9 247 545 A L H > S+ 0 0 1 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.898 114.3 50.5 -69.6 -38.0 17.2 20.8 10.9 248 546 A K H X S+ 0 0 66 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.891 111.2 48.5 -65.5 -40.1 16.4 21.8 7.3 249 547 A G H X S+ 0 0 25 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.922 112.3 49.2 -64.8 -43.6 14.6 24.9 8.6 250 548 A F H >X S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.2 4,-0.6 0.968 111.6 48.5 -57.2 -56.0 17.5 25.7 10.8 251 549 A L H >X S+ 0 0 10 -4,-3.0 4,-2.4 1,-0.3 3,-1.2 0.836 104.0 60.4 -55.4 -38.5 20.0 25.3 7.9 252 550 A D H 3< S+ 0 0 91 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.761 102.3 53.3 -63.2 -24.8 17.8 27.5 5.6 253 551 A R H << S+ 0 0 98 -3,-1.4 10,-2.2 -4,-0.9 -1,-0.3 0.614 112.1 46.1 -84.6 -12.4 18.3 30.4 8.1 254 552 A L H << S+ 0 0 0 -3,-1.2 2,-1.5 -4,-0.6 -2,-0.2 0.870 104.8 56.2 -93.8 -48.3 22.1 29.9 7.9 255 553 A L < + 0 0 14 -4,-2.4 2,-0.6 -51,-0.1 -1,-0.2 -0.394 69.5 140.8 -88.0 60.3 22.8 29.6 4.2 256 554 A V - 0 0 29 -2,-1.5 6,-0.2 -3,-0.2 -55,-0.1 -0.912 43.7-151.7-103.3 119.6 21.2 32.9 3.1 257 555 A R S S+ 0 0 80 -2,-0.6 -70,-0.2 1,-0.1 -1,-0.2 0.902 84.4 68.0 -57.1 -45.7 23.3 34.6 0.4 258 556 A D S >> S- 0 0 80 1,-0.2 3,-2.0 -3,-0.1 4,-0.8 -0.698 75.1-154.9 -81.9 107.7 22.1 38.1 1.3 259 557 A P T 34 S+ 0 0 24 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.728 91.8 63.5 -53.0 -26.8 23.8 38.7 4.8 260 558 A A T 34 S+ 0 0 77 1,-0.2 -2,-0.0 -3,-0.0 -3,-0.0 0.802 108.9 40.7 -69.4 -28.8 21.0 41.2 5.6 261 559 A Q T <4 S+ 0 0 122 -3,-2.0 -1,-0.2 2,-0.1 2,-0.1 0.535 94.0 106.2 -95.3 -9.9 18.5 38.4 5.4 262 560 A R S < S- 0 0 7 -4,-0.8 -8,-0.2 -6,-0.2 -9,-0.1 -0.443 77.5-107.9 -73.1 143.1 20.7 35.8 7.2 263 561 A A - 0 0 3 -10,-2.2 2,-0.2 -2,-0.1 -1,-0.1 -0.274 31.3-129.5 -66.6 155.8 19.8 34.9 10.8 264 562 A T > - 0 0 63 1,-0.1 4,-2.6 -64,-0.0 5,-0.2 -0.639 24.1-106.0-103.3 165.4 22.1 36.1 13.6 265 563 A A H > S+ 0 0 2 1,-0.2 4,-1.6 -2,-0.2 -134,-0.2 0.918 121.1 52.3 -54.7 -45.3 23.6 34.0 16.4 266 564 A A H 4 S+ 0 0 58 1,-0.2 4,-0.4 2,-0.2 3,-0.3 0.913 111.1 46.1 -59.1 -44.8 21.2 35.5 18.9 267 565 A E H >4 S+ 0 0 112 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.908 109.9 54.3 -65.1 -41.8 18.2 34.6 16.7 268 566 A L H >< S+ 0 0 2 -4,-2.6 3,-1.7 1,-0.3 6,-0.3 0.765 94.1 69.3 -64.1 -27.8 19.4 31.1 16.0 269 567 A L T 3< S+ 0 0 53 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.705 100.8 48.9 -64.0 -19.4 19.7 30.4 19.7 270 568 A K T < S+ 0 0 182 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.252 83.1 122.4-104.6 12.1 15.9 30.4 19.9 271 569 A H X - 0 0 41 -3,-1.7 3,-1.5 1,-0.1 4,-0.5 -0.595 69.5-125.6 -79.1 133.4 15.4 28.1 16.9 272 570 A P G > S+ 0 0 89 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.762 104.2 69.1 -45.3 -34.4 13.4 24.9 17.7 273 571 A F G > S+ 0 0 0 -27,-0.3 3,-1.9 1,-0.3 4,-0.2 0.896 92.4 56.4 -56.9 -42.3 16.2 22.7 16.3 274 572 A L G X S+ 0 0 9 -3,-1.5 3,-1.4 -6,-0.3 -1,-0.3 0.685 89.1 75.9 -66.2 -15.6 18.5 23.5 19.1 275 573 A A G < S+ 0 0 92 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.663 87.5 62.4 -68.2 -14.4 15.9 22.2 21.6 276 574 A K G < S+ 0 0 68 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.594 75.1 131.7 -84.7 -13.4 17.0 18.7 20.5 277 575 A A < - 0 0 29 -3,-1.4 -159,-0.2 -4,-0.2 -160,-0.1 -0.082 49.1-142.6 -45.2 127.9 20.5 19.2 21.8 278 576 A G - 0 0 18 -161,-2.1 -1,-0.1 1,-0.1 -2,-0.0 -0.406 26.6 -91.6 -87.7 169.3 21.8 16.3 23.9 279 577 A P > - 0 0 88 0, 0.0 3,-2.4 0, 0.0 4,-0.4 -0.249 46.6 -91.9 -74.6 170.8 24.0 16.7 27.0 280 578 A P G >> S+ 0 0 58 0, 0.0 3,-1.9 0, 0.0 4,-1.0 0.840 123.2 68.0 -50.7 -35.9 27.8 16.6 26.7 281 579 A A G 34 S+ 0 0 70 1,-0.3 -127,-0.1 2,-0.2 -126,-0.0 0.696 90.3 63.0 -59.6 -19.8 27.7 12.8 27.4 282 580 A S G <4 S+ 0 0 27 -3,-2.4 -1,-0.3 1,-0.2 4,-0.2 0.715 99.7 53.8 -78.5 -19.7 26.0 12.3 24.0 283 581 A I T X> S+ 0 0 2 -3,-1.9 3,-1.9 -4,-0.4 4,-0.6 0.799 90.1 76.7 -82.3 -32.1 29.1 13.6 22.3 284 582 A V G >< S+ 0 0 40 -4,-1.0 3,-1.8 -131,-0.3 6,-0.2 0.888 85.5 59.9 -45.6 -51.9 31.5 11.2 24.0 285 583 A P G 34 S+ 0 0 70 0, 0.0 -1,-0.3 0, 0.0 7,-0.2 0.729 98.8 62.4 -52.6 -22.4 30.6 8.2 21.8 286 584 A L G <4 S+ 0 0 8 -3,-1.9 -2,-0.2 -4,-0.2 5,-0.1 0.756 78.0 104.5 -76.6 -27.5 31.7 10.2 18.8 287 585 A M S XX S- 0 0 3 -3,-1.8 3,-2.3 -4,-0.6 4,-0.6 -0.282 79.3-122.9 -59.1 139.4 35.4 10.5 19.8 288 586 A R G >4 S+ 0 0 136 1,-0.3 3,-1.2 -186,-0.3 -1,-0.1 0.875 112.1 58.0 -49.6 -45.8 37.8 8.3 18.0 289 587 A Q G 34 S+ 0 0 119 1,-0.3 -1,-0.3 -187,-0.1 -2,-0.1 0.670 117.2 35.0 -62.5 -14.4 39.0 6.7 21.2 290 588 A N G <4 S+ 0 0 81 -3,-2.3 2,-0.3 -6,-0.2 -1,-0.3 0.326 94.1 111.7-121.7 6.4 35.4 5.6 21.9 291 589 A R << 0 0 50 -3,-1.2 -5,-0.1 -4,-0.6 -179,-0.0 -0.614 360.0 360.0 -89.7 144.5 34.1 4.8 18.4 292 590 A T 0 0 189 -2,-0.3 -1,-0.1 -7,-0.2 -4,-0.0 -0.413 360.0 360.0-135.1 360.0 33.2 1.4 17.0