==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-AUG-10 3OMV . COMPND 2 MOLECULE: RAF PROTO-ONCOGENE SERINE/THREONINE-PROTEIN KINAS . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.HATZIVASSILIOU,K.SONG,I.YEN,B.J.BRANDHUBER,D.J.ANDERSON,R. . 528 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26623.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 332 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 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 . 37 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 1 2 2 0 2 1 1 1 1 0 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 . 4 1 1 4 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 1 340 A Y 0 0 149 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -91.5 5.0 41.7 30.4 2 341 A Y - 0 0 157 1,-0.1 2,-0.7 2,-0.1 324,-0.0 -0.624 360.0-140.2 -70.0 116.4 2.0 39.4 29.8 3 342 A W + 0 0 19 -2,-0.6 69,-2.9 68,-0.1 2,-0.7 0.092 57.8 133.5 -74.0 28.0 3.7 36.0 29.5 4 343 A E B -a 72 0A 71 -2,-0.7 2,-0.6 67,-0.2 69,-0.2 -0.726 52.2-142.2 -82.2 115.6 1.4 35.1 26.6 5 344 A I - 0 0 7 67,-3.3 69,-0.1 -2,-0.7 3,-0.1 -0.711 27.5-110.8 -77.8 119.6 3.4 33.6 23.8 6 345 A E > - 0 0 132 -2,-0.6 3,-1.6 1,-0.1 4,-0.3 -0.291 50.5 -88.4 -51.1 129.0 1.9 34.8 20.5 7 346 A A T 3 S+ 0 0 33 1,-0.2 -1,-0.1 2,-0.1 69,-0.1 -0.016 107.8 18.4 -49.1 143.6 0.3 31.8 18.9 8 347 A S T 3 S+ 0 0 107 67,-0.2 -1,-0.2 68,-0.1 -2,-0.1 0.353 91.5 102.4 75.6 -1.6 2.4 29.4 16.6 9 348 A E S < S+ 0 0 79 -3,-1.6 21,-0.2 -4,-0.1 -2,-0.1 0.784 72.5 76.4 -73.7 -29.7 5.7 30.7 18.0 10 349 A V - 0 0 22 -4,-0.3 2,-0.3 -5,-0.1 19,-0.2 -0.244 66.5-163.7 -72.6 167.2 5.8 27.4 20.0 11 350 A M - 0 0 122 17,-0.4 17,-1.0 -2,-0.0 2,-0.4 -0.955 4.2-151.5-148.8 154.9 6.6 24.0 18.5 12 351 A L E -B 27 0A 86 -2,-0.3 15,-0.3 15,-0.2 3,-0.1 -0.923 11.1-178.4-145.0 117.2 5.9 20.5 19.9 13 352 A S E - 0 0 77 13,-3.0 14,-0.1 -2,-0.4 15,-0.0 0.221 52.8 -27.4 -86.4-150.3 7.8 17.3 19.4 14 353 A T E S- 0 0 106 1,-0.1 12,-1.3 11,-0.1 -1,-0.3 -0.101 75.3 -90.4 -63.9 163.5 7.0 13.8 20.8 15 354 A R E -B 25 0A 123 10,-0.2 10,-0.2 1,-0.1 -1,-0.1 -0.215 24.8-166.5 -71.7 163.7 5.1 13.3 24.1 16 355 A I - 0 0 95 8,-2.3 2,-0.3 1,-0.2 9,-0.2 0.519 56.8 -81.8-124.3 -22.5 6.7 12.9 27.5 17 356 A G - 0 0 33 7,-0.8 -1,-0.2 2,-0.0 2,-0.2 -0.914 48.8 -95.9 159.3-128.4 3.8 11.6 29.5 18 357 A S + 0 0 79 -2,-0.3 5,-0.2 5,-0.2 2,-0.0 -0.801 48.9 111.8-160.0-158.1 0.8 13.2 31.2 19 358 A G + 0 0 38 3,-0.6 3,-0.4 -2,-0.2 -2,-0.0 0.033 53.3 63.6 98.5 157.5 -0.5 14.6 34.5 20 359 A S S S- 0 0 17 1,-0.2 3,-0.1 127,-0.1 128,-0.1 0.600 126.8 -48.9 68.6 15.8 -1.4 17.9 36.2 21 360 A F S S+ 0 0 125 1,-0.3 -1,-0.2 17,-0.0 2,-0.2 0.715 121.2 17.2 99.7 30.8 -4.3 18.5 33.7 22 361 A G S S- 0 0 18 -3,-0.4 -3,-0.6 17,-0.1 2,-0.3 -0.717 87.7 -60.6-175.4-130.7 -2.8 17.9 30.3 23 362 A T E - C 0 37A 3 14,-1.2 14,-2.2 -5,-0.2 2,-0.4 -0.974 36.9-129.0-155.3 136.4 0.1 16.4 28.4 24 363 A V E + C 0 36A 35 -2,-0.3 -8,-2.3 -7,-0.2 -7,-0.8 -0.721 28.0 175.9 -97.9 135.8 3.8 17.0 28.4 25 364 A Y E -BC 15 35A 26 10,-2.3 10,-2.9 -2,-0.4 2,-0.6 -0.976 34.2-126.2-135.6 148.6 6.0 17.7 25.4 26 365 A K E + C 0 34A 59 -12,-1.3 -13,-3.0 -2,-0.3 8,-0.2 -0.858 51.3 163.7 -83.4 124.0 9.5 18.6 24.4 27 366 A G E -BC 12 33A 4 6,-2.9 6,-1.1 -2,-0.6 2,-0.4 -0.504 34.9-109.2-127.2-165.0 9.1 21.7 22.3 28 367 A K E + C 0 32A 81 -17,-1.0 -17,-0.4 4,-0.2 4,-0.2 -0.993 40.0 141.0-139.3 132.1 10.9 24.7 20.8 29 368 A W S S- 0 0 12 2,-3.1 -19,-0.1 -2,-0.4 -2,-0.1 -0.625 94.7 -27.4-168.4 102.2 10.7 28.4 21.6 30 369 A H S S- 0 0 31 -21,-0.2 2,-0.2 -2,-0.2 355,-0.2 0.704 139.5 -26.7 52.7 22.6 13.9 30.4 21.5 31 370 A G S S- 0 0 9 2,-0.0 -2,-3.1 354,-0.0 2,-0.1 -0.778 112.4 -19.4 131.3-179.1 15.3 26.9 22.4 32 371 A D E +C 28 0A 62 -2,-0.2 52,-1.0 -4,-0.2 2,-0.3 -0.340 64.2 173.0 -63.8 136.7 14.2 23.7 24.1 33 372 A V E -CD 27 83A 2 -6,-1.1 -6,-2.9 50,-0.2 2,-0.4 -0.998 34.4-122.2-149.8 140.5 11.2 24.0 26.3 34 373 A A E -CD 26 82A 16 48,-3.0 48,-2.9 -2,-0.3 2,-0.5 -0.730 34.9-163.3 -83.2 129.0 8.9 21.8 28.3 35 374 A V E -CD 25 81A 5 -10,-2.9 -10,-2.3 -2,-0.4 2,-0.6 -0.963 17.0-163.6-124.6 126.6 5.3 22.3 27.2 36 375 A K E -CD 24 80A 28 44,-3.1 44,-1.9 -2,-0.5 -12,-0.2 -0.931 21.5-177.7-106.8 111.6 2.0 21.3 28.9 37 376 A I E -CD 23 79A 13 -14,-2.2 -14,-1.2 -2,-0.6 42,-0.2 -0.615 31.9-132.1-106.4 164.6 -0.9 21.5 26.5 38 377 A L - 0 0 20 40,-1.2 2,-0.2 -2,-0.2 3,-0.1 0.850 20.3-165.7 -82.5 -38.6 -4.6 20.8 27.0 39 378 A K + 0 0 103 1,-0.2 2,-0.2 39,-0.2 -1,-0.1 0.075 50.8 119.4 71.2 -24.7 -5.2 18.5 24.0 40 379 A V - 0 0 60 -2,-0.2 38,-0.2 1,-0.1 -1,-0.2 -0.496 61.2-145.6 -75.9 139.2 -8.9 19.1 24.5 41 380 A V S S+ 0 0 139 1,-0.2 36,-0.2 -2,-0.2 -1,-0.1 0.890 88.3 33.0 -72.9 -43.9 -10.9 20.6 21.6 42 381 A D S S- 0 0 119 35,-0.0 -1,-0.2 0, 0.0 2,-0.2 -0.964 88.7-129.9-119.7 116.4 -13.4 22.7 23.7 43 382 A P - 0 0 51 0, 0.0 -2,-0.0 0, 0.0 -5,-0.0 -0.429 18.6-124.7 -76.3 135.8 -12.1 24.0 27.0 44 383 A T > - 0 0 51 -2,-0.2 4,-3.8 1,-0.1 5,-0.2 -0.506 10.0-131.6 -78.0 138.4 -14.1 23.5 30.3 45 384 A P H > S+ 0 0 109 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 0.730 113.7 48.9 -57.7 -26.1 -15.2 26.5 32.5 46 385 A E H > S+ 0 0 161 2,-0.2 4,-0.9 3,-0.1 5,-0.0 0.792 114.4 44.5 -81.6 -32.3 -13.8 24.5 35.5 47 386 A Q H > S+ 0 0 68 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.871 105.0 63.5 -73.4 -40.5 -10.6 23.8 33.6 48 387 A F H X S+ 0 0 82 -4,-3.8 4,-1.8 1,-0.3 -2,-0.2 0.865 109.0 40.4 -48.5 -43.2 -10.5 27.5 32.5 49 388 A Q H X S+ 0 0 107 -4,-0.8 4,-1.5 2,-0.2 -1,-0.3 0.752 112.4 56.1 -79.8 -26.3 -10.2 28.5 36.1 50 389 A A H X S+ 0 0 25 -4,-0.9 4,-1.1 2,-0.2 -2,-0.2 0.848 110.4 45.7 -71.5 -35.7 -7.8 25.6 36.8 51 390 A F H X S+ 0 0 27 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.950 113.4 47.2 -67.9 -52.6 -5.5 26.9 34.0 52 391 A R H X S+ 0 0 164 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.790 111.8 50.7 -66.4 -32.1 -5.5 30.5 35.0 53 392 A N H X S+ 0 0 85 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.825 108.2 53.2 -73.3 -34.7 -4.9 29.7 38.7 54 393 A E H X S+ 0 0 9 -4,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.925 111.8 45.1 -61.3 -46.6 -1.9 27.6 37.7 55 394 A V H X S+ 0 0 11 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.827 108.1 57.0 -70.0 -34.7 -0.4 30.5 35.7 56 395 A A H < S+ 0 0 48 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.834 109.7 47.1 -63.6 -33.8 -1.1 33.0 38.5 57 396 A V H >< S+ 0 0 16 -4,-1.3 3,-1.6 1,-0.2 -2,-0.2 0.930 110.9 49.3 -71.6 -49.0 0.9 30.7 40.8 58 397 A L H >< S+ 0 0 11 -4,-2.1 3,-1.6 1,-0.3 11,-0.2 0.798 98.3 70.4 -61.1 -31.0 3.8 30.3 38.4 59 398 A R T 3< S+ 0 0 58 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.551 99.0 49.6 -63.1 -9.7 3.9 34.1 37.9 60 399 A K T < S+ 0 0 42 -3,-1.6 2,-0.6 1,-0.1 -1,-0.3 0.324 90.7 86.0-113.8 6.8 5.3 34.5 41.4 61 400 A T < + 0 0 1 -3,-1.6 2,-1.1 -4,-0.1 8,-0.4 -0.693 35.6 157.9-120.4 79.4 8.1 32.0 41.3 62 401 A R + 0 0 1 -2,-0.6 2,-0.3 274,-0.2 5,-0.1 -0.803 36.4 132.2 -93.3 88.9 11.4 33.3 40.0 63 402 A H > - 0 0 3 -2,-1.1 3,-1.0 3,-0.3 5,-0.1 -0.995 65.4-129.3-144.0 148.4 13.7 30.7 41.6 64 403 A V T 3 S+ 0 0 29 -2,-0.3 4,-0.1 1,-0.2 52,-0.1 0.564 112.5 46.1 -70.5 -10.8 16.6 28.4 40.6 65 404 A N T 3 S+ 0 0 5 79,-0.1 80,-2.8 50,-0.1 2,-0.5 0.333 98.2 78.0-117.2 3.3 14.8 25.5 42.2 66 405 A I B < S-f 145 0B 0 -3,-1.0 -3,-0.3 78,-0.3 2,-0.2 -0.964 101.2 -96.9-109.8 131.9 11.3 26.1 40.8 67 406 A L - 0 0 17 78,-2.0 2,-0.7 -2,-0.5 -6,-0.1 -0.273 48.9-111.9 -50.0 108.8 10.8 25.0 37.2 68 407 A L - 0 0 3 -2,-0.2 15,-2.0 -4,-0.1 2,-0.2 -0.280 28.7-143.5 -55.2 97.1 11.4 28.4 35.4 69 408 A F E + E 0 82A 0 -2,-0.7 13,-0.3 -8,-0.4 3,-0.1 -0.482 23.7 177.1 -60.9 127.3 7.9 29.2 34.1 70 409 A M E - 0 0 1 11,-2.5 2,-0.3 1,-0.4 12,-0.2 0.765 48.1 -49.8-108.9 -35.9 8.5 30.9 30.7 71 410 A G E - E 0 81A 0 10,-1.9 10,-3.4 -66,-0.0 -1,-0.4 -0.983 42.8-122.3 177.3 179.0 5.1 31.6 29.2 72 411 A Y E -aE 4 80A 45 -69,-2.9 -67,-3.3 -2,-0.3 2,-0.3 -0.844 8.6-150.0-136.7 174.8 1.6 30.4 28.3 73 412 A M E + E 0 79A 6 6,-2.2 6,-2.6 -2,-0.3 -67,-0.1 -0.867 18.4 170.0-154.3 116.0 -0.8 30.2 25.3 74 413 A T + 0 0 54 -2,-0.3 3,-0.2 4,-0.2 2,-0.1 0.815 66.3 83.2 -89.1 -39.1 -4.6 30.3 25.2 75 414 A K S S+ 0 0 122 1,-0.2 -67,-0.2 4,-0.0 4,-0.1 -0.452 100.0 14.2 -66.4 137.1 -4.8 30.5 21.4 76 415 A D S S- 0 0 128 -2,-0.1 -1,-0.2 -69,-0.1 -68,-0.1 0.994 139.6 -23.5 58.1 74.5 -4.6 27.1 19.7 77 416 A N S S- 0 0 69 -3,-0.2 2,-0.5 -36,-0.2 -36,-0.1 0.300 90.7 -77.6 70.8 154.1 -5.2 24.9 22.8 78 417 A L + 0 0 9 -38,-0.2 -40,-1.2 -6,-0.0 2,-0.3 -0.773 65.2 173.5 -83.5 126.7 -4.5 25.9 26.4 79 418 A A E -DE 37 73A 3 -6,-2.6 -6,-2.2 -2,-0.5 2,-0.4 -0.943 29.4-160.8-140.7 153.6 -0.8 25.7 27.0 80 419 A I E -DE 36 72A 12 -44,-1.9 -44,-3.1 -2,-0.3 2,-0.4 -0.995 14.1-157.4-135.9 130.1 2.0 26.4 29.5 81 420 A V E +DE 35 71A 0 -10,-3.4 -11,-2.5 -2,-0.4 -10,-1.9 -0.890 18.2 161.8-112.3 136.5 5.7 26.6 28.6 82 421 A T E -DE 34 69A 18 -48,-2.9 -48,-3.0 -2,-0.4 -13,-0.2 -0.953 46.2 -65.1-146.6 164.7 8.6 26.2 31.0 83 422 A Q E -D 33 0A 1 -15,-2.0 2,-0.3 -2,-0.3 -50,-0.2 -0.114 49.4-122.1 -54.4 139.7 12.4 25.4 30.8 84 423 A W - 0 0 47 -52,-1.0 2,-0.5 -51,-0.1 -1,-0.1 -0.641 20.7-159.1 -82.2 142.3 13.5 22.1 29.4 85 424 A C - 0 0 16 -2,-0.3 2,-0.1 2,-0.2 52,-0.1 -0.917 10.8-144.1-126.1 102.8 15.7 19.9 31.6 86 425 A E S S+ 0 0 113 -2,-0.5 53,-1.2 52,-0.1 2,-0.1 -0.468 78.0 48.9 -60.7 135.1 17.7 17.2 29.9 87 426 A G S S- 0 0 38 51,-0.2 -2,-0.2 -2,-0.1 2,-0.1 -0.188 92.1 -88.9 99.3 158.4 17.6 14.3 32.3 88 427 A S - 0 0 37 51,-0.2 49,-1.6 1,-0.2 2,-0.1 -0.283 38.2 -78.5-104.6 177.4 14.5 12.9 34.0 89 428 A S B >> -G 136 0B 6 47,-0.2 4,-1.7 1,-0.1 3,-0.9 -0.410 46.7-113.0 -66.4 151.4 12.2 13.3 36.9 90 429 A L H 3> S+ 0 0 2 45,-2.7 4,-2.7 42,-0.4 5,-0.3 0.894 113.0 66.3 -56.7 -45.6 13.4 11.7 40.2 91 430 A Y H 3>>S+ 0 0 76 41,-2.0 4,-2.3 1,-0.2 5,-0.6 0.844 107.8 42.4 -43.5 -42.0 10.7 9.0 40.2 92 431 A K H <>>S+ 0 0 70 -3,-0.9 5,-3.1 40,-0.2 4,-2.3 0.990 112.3 50.2 -69.2 -63.2 12.3 7.6 37.1 93 432 A H H <5S+ 0 0 22 -4,-1.7 6,-3.5 1,-0.2 -2,-0.2 0.785 122.8 35.1 -42.5 -35.3 16.0 7.9 38.2 94 433 A L H <5S+ 0 0 14 -4,-2.7 -1,-0.2 4,-0.2 -2,-0.2 0.908 133.2 15.9 -94.1 -49.5 15.1 6.2 41.4 95 434 A H H <5S+ 0 0 39 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.598 132.7 35.3-107.6 -15.5 12.4 3.5 40.8 96 435 A V T <> - 0 0 131 -2,-0.3 4,-1.7 1,-0.1 3,-1.1 -0.400 15.9-119.0 -74.4 152.4 26.1 8.4 46.4 103 442 A M H 3> S+ 0 0 15 1,-0.3 4,-1.7 2,-0.2 5,-0.3 0.847 106.9 74.1 -61.1 -38.3 25.3 9.9 49.8 104 443 A F H 34 S+ 0 0 138 1,-0.2 -1,-0.3 2,-0.2 159,-0.1 0.845 120.6 14.0 -38.1 -45.7 27.7 12.8 49.3 105 444 A Q H <> S+ 0 0 51 -3,-1.1 4,-1.4 2,-0.2 -1,-0.2 0.431 107.4 84.7-117.3 -5.8 25.2 14.3 46.9 106 445 A L H X S+ 0 0 8 -4,-1.7 4,-1.1 1,-0.2 -3,-0.2 0.878 101.6 41.9 -62.2 -37.0 22.1 12.2 47.7 107 446 A I H X S+ 0 0 1 -4,-1.7 4,-2.9 2,-0.2 -1,-0.2 0.752 106.3 63.4 -76.9 -28.1 21.6 14.7 50.5 108 447 A D H > S+ 0 0 49 -5,-0.3 4,-1.0 2,-0.2 -2,-0.2 0.748 103.0 49.3 -68.9 -24.6 22.6 17.5 48.1 109 448 A I H X S+ 0 0 8 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.883 112.9 47.3 -72.3 -43.4 19.4 16.4 46.1 110 449 A A H X S+ 0 0 0 -4,-1.1 4,-0.8 1,-0.2 -2,-0.2 0.843 108.0 55.2 -66.3 -37.1 17.5 16.6 49.4 111 450 A R H X S+ 0 0 65 -4,-2.9 4,-3.1 1,-0.2 3,-0.3 0.900 110.3 45.8 -63.6 -42.6 18.9 20.0 50.3 112 451 A Q H X S+ 0 0 18 -4,-1.0 4,-3.1 2,-0.2 5,-0.2 0.900 108.2 54.1 -69.1 -43.5 17.8 21.5 47.0 113 452 A T H X S+ 0 0 2 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.645 116.4 41.2 -69.7 -14.1 14.3 20.1 47.1 114 453 A A H X S+ 0 0 0 -4,-0.8 4,-2.8 -3,-0.3 5,-0.3 0.806 108.9 59.0 -88.9 -45.7 14.0 21.7 50.6 115 454 A Q H X S+ 0 0 19 -4,-3.1 4,-0.9 1,-0.2 -2,-0.2 0.895 115.2 38.0 -45.1 -48.1 15.8 24.9 49.3 116 455 A G H >X S+ 0 0 0 -4,-3.1 4,-1.2 2,-0.2 3,-1.0 0.977 113.1 54.1 -66.8 -59.4 13.0 25.1 46.8 117 456 A M H 3X S+ 0 0 0 -4,-1.0 4,-1.6 1,-0.3 -2,-0.2 0.735 104.8 56.4 -51.7 -29.5 10.2 24.0 49.1 118 457 A D H 3X S+ 0 0 14 -4,-2.8 4,-2.4 2,-0.2 -1,-0.3 0.908 102.0 56.5 -66.1 -44.2 11.1 26.7 51.6 119 458 A Y H S+ 0 0 0 -4,-1.2 5,-1.8 2,-0.2 -1,-0.2 0.958 111.4 51.4 -67.1 -53.1 7.1 28.6 48.2 121 460 A H H ><5S+ 0 0 15 -4,-1.6 3,-0.9 1,-0.2 -2,-0.2 0.899 114.8 44.9 -47.3 -46.5 6.0 28.2 51.8 122 461 A A H 3<5S+ 0 0 54 -4,-2.4 2,-0.3 1,-0.3 -1,-0.2 0.894 110.8 53.2 -68.4 -41.8 7.6 31.6 52.4 123 462 A K T 3<5S- 0 0 39 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 -0.147 124.3 -98.6 -90.4 40.8 6.1 33.2 49.3 124 463 A N T < 5S+ 0 0 118 -3,-0.9 2,-0.4 -2,-0.3 -3,-0.2 0.169 78.5 139.7 76.8 -15.8 2.5 32.1 50.2 125 464 A I < - 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0 0 75 -4,-0.6 6,-0.1 -3,-0.3 -55,-0.1 -0.177 53.1-139.8 -52.5 134.0 31.0 43.6 9.6 507 591 B K S S+ 0 0 101 4,-0.1 -76,-0.3 -78,-0.1 -1,-0.1 0.933 79.8 82.3 -63.6 -51.0 31.6 47.4 9.9 508 592 B V S S- 0 0 71 1,-0.1 4,-0.3 3,-0.1 3,-0.3 -0.352 78.8-136.4 -62.4 133.3 28.6 48.5 7.9 509 593 B K S > S+ 0 0 70 1,-0.2 3,-2.1 2,-0.2 -1,-0.1 0.975 92.9 35.6 -57.5 -76.2 25.4 48.5 10.1 510 594 B E T 3 S+ 0 0 136 1,-0.3 -1,-0.2 3,-0.0 -2,-0.1 0.530 103.3 76.9 -64.5 -6.6 22.5 46.9 8.1 511 595 B E T 3 S+ 0 0 110 -3,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.609 76.7 95.4 -79.7 -13.3 24.9 44.5 6.5 512 596 B R S < S- 0 0 9 -3,-2.1 2,-0.3 -4,-0.3 -8,-0.2 -0.451 79.5-115.2 -77.4 151.0 25.0 42.4 9.7 513 597 B P - 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.700 27.5-122.0 -91.1 141.1 22.8 39.3 10.2 514 598 B L >> - 0 0 67 -2,-0.3 3,-1.2 1,-0.1 4,-0.7 -0.280 23.0-109.4 -78.1 162.8 20.1 39.2 12.9 515 599 B F H >> S+ 0 0 0 1,-0.3 4,-1.1 2,-0.2 3,-0.6 0.828 109.8 74.4 -64.4 -36.2 19.8 36.7 15.7 516 600 B P H 34 S+ 0 0 83 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.398 116.1 26.2 -57.5 7.6 16.7 35.0 14.3 517 601 B Q H <> S+ 0 0 105 -3,-1.2 4,-1.0 3,-0.1 -2,-0.2 0.350 108.1 75.6-142.7 -8.7 19.2 33.6 11.8 518 602 B I H > S+ 0 0 115 -4,-0.4 3,-0.7 -5,-0.2 4,-0.5 0.808 109.6 48.3 -85.5 -36.7 23.1 23.4 12.0 525 609 B L H 3> S+ 0 0 6 -4,-0.5 4,-1.3 1,-0.2 -2,-0.2 0.657 98.9 69.1 -76.9 -16.3 26.9 23.7 12.0 526 610 B Q H 3< S+ 0 0 53 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.1 0.758 95.6 56.6 -69.4 -25.0 26.9 22.1 15.5 527 611 B H H <4 S+ 0 0 154 -3,-0.7 -1,-0.2 -4,-0.2 -2,-0.2 0.816 105.3 51.9 -70.2 -32.8 25.8 18.9 13.7 528 612 B S H >< S+ 0 0 81 -4,-0.5 3,-1.3 -3,-0.2 -2,-0.2 0.913 98.0 55.5 -78.8 -47.9 28.8 18.9 11.3 529 613 B L T 3< S+ 0 0 52 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.718 77.2 91.0 -69.5 -24.2 32.0 19.2 13.4 530 614 B P T 3 0 0 64 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.782 360.0 360.0 -37.0 -33.6 31.3 16.1 15.8 531 615 B K < 0 0 238 -3,-1.3 -3,-0.1 -4,-0.2 -2,-0.1 0.273 360.0 360.0-119.1 360.0 33.3 14.3 13.0