==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-FEB-04 1UWJ . COMPND 2 MOLECULE: B-RAF PROTO-ONCOGENE SERINE/THREONINE-PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.BARFORD,S.M.ROE,P.T.C.WAN,CANCER GENOME PROJECT . 527 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25481.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 344 65.3 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 44 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 152 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.3 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 0 2 2 0 0 0 4 0 2 2 0 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 . 0 0 4 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 1 447 A D 0 0 108 0, 0.0 2,-0.4 0, 0.0 325,-0.0 0.000 360.0 360.0 360.0-167.0 5.1 43.9 29.7 2 448 A D - 0 0 89 324,-0.1 0, 0.0 2,-0.1 0, 0.0 -1.000 360.0-162.9-139.0 135.2 3.4 41.0 27.8 3 449 A W + 0 0 14 -2,-0.4 69,-2.1 2,-0.1 2,-0.4 -0.082 41.4 134.0-109.5 34.2 4.8 37.5 27.1 4 450 A E B -a 72 0A 63 67,-0.2 69,-0.2 69,-0.1 -2,-0.1 -0.703 47.6-143.9 -83.9 133.9 2.5 36.4 24.3 5 451 A I - 0 0 1 67,-2.2 70,-0.2 -2,-0.4 4,-0.2 -0.879 18.3-122.5-103.3 111.0 4.5 34.8 21.6 6 452 A P - 0 0 62 0, 0.0 3,-0.4 0, 0.0 4,-0.3 -0.140 39.2-100.7 -46.2 137.9 3.1 35.5 18.1 7 453 A D S S+ 0 0 68 1,-0.2 67,-0.0 2,-0.1 66,-0.0 -0.142 104.0 47.9 -63.4 163.1 2.4 32.2 16.3 8 454 A G S S+ 0 0 75 2,-0.2 -1,-0.2 -3,-0.1 3,-0.1 0.710 95.7 83.6 79.7 20.0 4.7 30.9 13.7 9 455 A Q + 0 0 79 -3,-0.4 2,-1.1 1,-0.2 -2,-0.1 0.732 66.5 70.7-116.6 -54.3 7.7 31.4 16.0 10 456 A I S S- 0 0 15 -4,-0.3 2,-1.8 -5,-0.1 19,-0.2 -0.587 78.5-141.4 -73.1 99.0 8.1 28.5 18.4 11 457 A T - 0 0 99 17,-1.7 2,-0.2 -2,-1.1 -1,-0.1 -0.440 18.2-136.0 -65.9 85.6 9.3 25.7 16.1 12 458 A V - 0 0 66 -2,-1.8 15,-0.2 15,-0.2 14,-0.1 -0.211 29.8-171.5 -49.3 107.3 7.3 22.8 17.7 13 459 A G - 0 0 37 12,-0.3 14,-0.2 1,-0.2 15,-0.1 0.298 33.3 -42.0 -81.3-148.7 9.8 20.0 17.8 14 460 A Q - 0 0 142 12,-0.3 12,-0.6 1,-0.1 2,-0.2 0.003 68.8 -81.5 -74.6-177.6 9.2 16.4 18.7 15 461 A R E +B 25 0A 140 10,-0.2 10,-0.2 1,-0.1 -1,-0.1 -0.606 35.2 172.7 -92.0 148.3 7.1 14.8 21.4 16 462 A I E - 0 0 86 8,-2.5 2,-0.3 1,-0.5 9,-0.2 0.673 64.9 -33.4-118.6 -39.1 8.0 14.4 25.1 17 463 A G E -B 24 0A 25 7,-1.2 7,-2.4 2,-0.0 -1,-0.5 -0.959 50.7-165.4-176.3 165.9 4.9 13.2 26.8 18 464 A S E +B 23 0A 67 -2,-0.3 5,-0.2 5,-0.3 2,-0.2 -0.931 16.8 142.8-168.1 140.0 1.1 13.4 26.8 19 465 A G E > -B 22 0A 40 3,-2.6 3,-1.6 -2,-0.3 132,-0.1 -0.819 60.6 -33.0-156.5-163.6 -1.9 12.6 28.9 20 466 A S T 3 S+ 0 0 91 1,-0.3 131,-0.2 -2,-0.2 3,-0.0 0.784 130.9 15.1 -31.6 -57.9 -5.3 13.5 30.1 21 467 A F T 3 S+ 0 0 100 129,-3.6 -1,-0.3 1,-0.1 2,-0.3 -0.234 123.0 7.4-122.9 47.6 -4.9 17.3 30.1 22 468 A G E < -B 19 0A 5 -3,-1.6 -3,-2.6 128,-0.1 2,-0.3 -0.878 47.3-134.3 160.7 166.5 -1.8 18.2 28.0 23 469 A T E -BC 18 37A 27 14,-1.9 14,-3.3 -2,-0.3 2,-0.5 -0.975 18.7-146.3-147.6 129.7 1.1 17.3 25.7 24 470 A V E -BC 17 36A 29 -7,-2.4 -8,-2.5 -2,-0.3 -7,-1.2 -0.881 14.3-171.4-103.4 128.4 4.7 18.5 26.1 25 471 A Y E -BC 15 35A 47 10,-3.2 10,-1.4 -2,-0.5 2,-0.7 -0.935 24.2-133.7-121.9 110.9 6.7 19.1 22.9 26 472 A K E + C 0 34A 55 -12,-0.6 -12,-0.3 -2,-0.5 8,-0.2 -0.455 50.4 164.6 -60.3 108.8 10.4 19.8 23.1 27 473 A G E - C 0 33A 2 6,-2.6 6,-0.8 -2,-0.7 2,-0.3 -0.030 34.8-103.1-109.6-148.7 10.5 22.8 20.8 28 474 A K E + C 0 32A 54 4,-0.2 -17,-1.7 -15,-0.1 4,-0.2 -0.977 39.7 142.7-149.3 131.0 12.5 25.7 19.6 29 475 A W S S- 0 0 11 2,-1.8 -19,-0.1 -2,-0.3 -2,-0.0 -0.559 91.9 -34.5-169.0 93.9 12.4 29.5 20.4 30 476 A H S S- 0 0 26 -2,-0.1 2,-0.2 354,-0.1 355,-0.2 0.586 137.2 -9.3 63.2 6.2 15.6 31.4 20.7 31 477 A G S S- 0 0 5 354,-0.0 -2,-1.8 2,-0.0 -4,-0.1 -0.830 110.9 -37.0 153.6 169.8 16.9 28.1 22.1 32 478 A D E +C 28 0A 49 -2,-0.2 52,-1.1 -4,-0.2 2,-0.3 -0.306 67.8 167.9 -54.1 135.4 15.7 24.7 23.4 33 479 A V E -CD 27 83A 0 -6,-0.8 -6,-2.6 50,-0.2 2,-0.5 -0.990 35.4-124.0-150.0 152.9 12.4 25.2 25.1 34 480 A A E -CD 26 82A 15 48,-3.9 48,-3.1 -2,-0.3 2,-0.5 -0.867 24.3-161.8-100.9 132.9 9.6 23.0 26.4 35 481 A V E -CD 25 81A 0 -10,-1.4 -10,-3.2 -2,-0.5 2,-0.7 -0.969 4.9-156.3-119.7 121.2 6.2 23.8 25.0 36 482 A K E -CD 24 80A 22 44,-2.8 44,-1.8 -2,-0.5 2,-0.5 -0.864 10.2-160.8 -99.3 111.7 3.1 22.5 26.9 37 483 A M E +CD 23 79A 15 -14,-3.3 -14,-1.9 -2,-0.7 42,-0.2 -0.806 11.3 179.1 -93.7 131.8 0.2 22.2 24.5 38 484 A L + 0 0 36 40,-1.8 -1,-0.2 -2,-0.5 41,-0.1 0.878 53.7 36.9 -95.8 -74.8 -3.2 22.1 26.2 39 485 A N + 0 0 8 39,-0.2 2,-0.1 1,-0.1 -16,-0.0 0.054 47.6 170.1 -75.0-177.0 -6.1 21.9 23.7 40 486 A V S S+ 0 0 108 2,-0.6 -1,-0.1 37,-0.0 37,-0.1 -0.234 73.0 34.0-151.2-114.9 -6.7 20.2 20.3 41 487 A T S S- 0 0 144 -2,-0.1 -2,-0.1 1,-0.1 36,-0.0 0.705 134.2 -40.9 -20.2 -48.2 -10.0 19.9 18.5 42 488 A A S S- 0 0 52 0, 0.0 -2,-0.6 0, 0.0 2,-0.4 -0.916 72.9 -80.4-179.0 159.9 -10.8 23.3 19.9 43 489 A P - 0 0 77 0, 0.0 3,-0.0 0, 0.0 -2,-0.0 -0.642 43.8-142.5 -81.3 132.0 -10.4 25.3 23.2 44 490 A T > - 0 0 51 -2,-0.4 4,-3.4 1,-0.1 5,-0.2 -0.522 14.7-124.5 -89.8 155.4 -13.0 24.5 25.9 45 491 A P H > S+ 0 0 101 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.950 114.6 41.3 -64.3 -50.0 -14.5 27.0 28.4 46 492 A Q H > S+ 0 0 144 2,-0.2 4,-1.1 1,-0.2 3,-0.0 0.925 117.9 51.5 -63.0 -41.5 -13.5 25.1 31.5 47 493 A Q H >> S+ 0 0 67 1,-0.2 4,-1.5 2,-0.2 3,-1.1 0.948 104.3 54.1 -57.5 -57.2 -10.2 24.5 29.8 48 494 A L H 3X S+ 0 0 75 -4,-3.4 4,-1.9 1,-0.3 -1,-0.2 0.860 103.6 56.4 -47.7 -44.0 -9.5 28.1 29.0 49 495 A Q H 3< S+ 0 0 116 -4,-1.6 -1,-0.3 1,-0.2 4,-0.2 0.856 105.1 54.7 -59.3 -34.3 -10.0 29.1 32.6 50 496 A A H XX S+ 0 0 16 -3,-1.1 3,-2.2 -4,-1.1 4,-1.8 0.963 105.3 50.2 -61.9 -55.9 -7.2 26.6 33.5 51 497 A F H 3X S+ 0 0 13 -4,-1.5 4,-1.0 1,-0.3 5,-0.3 0.865 101.2 62.5 -49.4 -46.2 -4.6 28.0 31.2 52 498 A K H 3X S+ 0 0 135 -4,-1.9 4,-0.7 1,-0.2 -1,-0.3 0.612 111.6 41.6 -60.8 -9.1 -5.2 31.6 32.5 53 499 A N H <> S+ 0 0 53 -3,-2.2 4,-2.8 -4,-0.2 5,-0.4 0.854 103.8 56.1-103.8 -54.4 -4.0 30.2 35.8 54 500 A E H < S+ 0 0 23 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.1 0.655 121.6 39.6 -54.2 -11.8 -1.0 27.9 35.1 55 501 A V H >X S+ 0 0 11 -4,-1.0 4,-3.0 -5,-0.3 3,-0.6 0.843 111.1 50.1-101.9 -57.0 0.3 31.1 33.5 56 502 A G H 3< S+ 0 0 29 -4,-0.7 -2,-0.2 -5,-0.3 -3,-0.1 0.782 118.6 44.4 -54.9 -27.4 -0.8 33.9 35.8 57 503 A V T 3< S+ 0 0 56 -4,-2.8 -1,-0.3 2,-0.1 4,-0.2 0.710 113.1 50.4 -88.3 -25.5 0.7 31.8 38.5 58 504 A L T X4 S+ 0 0 30 -3,-0.6 3,-1.9 -5,-0.4 -2,-0.2 0.927 106.7 51.9 -77.3 -49.0 3.9 31.0 36.6 59 505 A R T 3< S+ 0 0 76 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.1 0.542 101.1 65.4 -64.1 -10.6 4.7 34.5 35.5 60 506 A K T 3 S+ 0 0 66 -5,-0.3 2,-0.3 -4,-0.1 -1,-0.3 0.611 93.3 73.4 -87.6 -15.4 4.5 35.5 39.2 61 507 A T < + 0 0 8 -3,-1.9 8,-0.2 -4,-0.2 2,-0.1 -0.725 49.2 165.4 -99.2 150.2 7.5 33.3 40.0 62 508 A R + 0 0 3 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.483 28.9 120.7-166.7 81.0 11.0 34.2 39.2 63 509 A H > - 0 0 8 3,-0.3 3,-2.0 -2,-0.1 233,-0.0 -0.995 65.8-114.4-151.6 149.0 13.6 32.2 41.0 64 510 A V T 3 S+ 0 0 34 -2,-0.3 4,-0.1 1,-0.3 52,-0.1 0.497 112.5 51.6 -62.2 -9.2 16.5 29.8 40.2 65 511 A N T 3 S+ 0 0 2 79,-0.1 80,-2.2 50,-0.1 2,-0.4 0.308 97.9 77.4-111.4 7.6 14.9 26.8 41.7 66 512 A I B < S-f 145 0B 11 -3,-2.0 -3,-0.3 78,-0.3 80,-0.2 -0.970 96.2 -95.1-121.5 133.1 11.6 27.1 39.9 67 513 A L - 0 0 25 78,-2.7 -6,-0.1 -2,-0.4 -2,-0.1 -0.152 48.8-115.3 -44.8 116.4 11.1 26.1 36.2 68 514 A L - 0 0 20 -4,-0.1 15,-1.0 1,-0.1 2,-0.6 -0.275 19.0-140.8 -61.3 138.0 11.5 29.3 34.1 69 515 A F E + E 0 82A 0 -8,-0.2 13,-0.3 13,-0.2 3,-0.1 -0.896 19.9 179.2-102.2 115.9 8.5 30.6 32.3 70 516 A M E - 0 0 1 11,-2.1 2,-0.3 -2,-0.6 12,-0.2 0.879 55.4 -69.0 -83.7 -42.0 9.5 31.9 28.8 71 517 A G E - E 0 81A 0 10,-2.0 10,-3.3 -66,-0.0 -1,-0.3 -0.953 42.7-105.6 168.6 178.9 6.1 32.9 27.6 72 518 A Y E -aE 4 80A 31 -69,-2.1 -67,-2.2 -2,-0.3 8,-0.3 -0.609 17.6-144.9-121.6-176.8 2.6 31.7 26.5 73 519 A S E + E 0 79A 1 6,-1.5 6,-1.2 -69,-0.2 -69,-0.1 -0.738 19.3 178.1-159.8 107.5 0.7 31.3 23.2 74 520 A T + 0 0 67 -2,-0.2 3,-0.4 4,-0.2 -1,-0.1 0.845 68.2 91.2 -72.5 -35.3 -3.0 31.8 22.4 75 521 A K S S+ 0 0 85 -70,-0.2 -2,-0.1 1,-0.2 -70,-0.0 0.158 96.4 2.6 -47.5 176.9 -2.3 31.1 18.7 76 522 A P S S- 0 0 72 0, 0.0 -1,-0.2 0, 0.0 -68,-0.1 0.467 139.1 -22.4 -4.8 82.1 -2.5 27.4 17.4 77 523 A Q S S- 0 0 77 -3,-0.4 2,-0.1 -37,-0.1 -37,-0.0 0.384 95.8 -73.9 74.7 143.8 -3.6 25.8 20.7 78 524 A L - 0 0 10 -6,-0.0 -40,-1.8 -38,-0.0 2,-0.4 -0.482 63.7-173.5 -65.6 137.0 -3.0 27.4 24.1 79 525 A A E -DE 37 73A 1 -6,-1.2 -6,-1.5 -42,-0.2 2,-0.6 -0.986 25.9-160.2-147.4 137.7 0.7 27.0 24.8 80 526 A I E -DE 36 72A 0 -44,-1.8 -44,-2.8 -2,-0.4 2,-0.5 -0.963 14.6-159.0-115.1 118.4 3.0 27.6 27.7 81 527 A V E +DE 35 71A 0 -10,-3.3 -11,-2.1 -2,-0.6 -10,-2.0 -0.873 16.8 170.3-101.4 123.2 6.7 27.8 26.8 82 528 A T E -DE 34 69A 15 -48,-3.1 -48,-3.9 -2,-0.5 -13,-0.2 -0.948 45.6 -81.1-129.6 150.4 9.2 27.1 29.5 83 529 A Q E -D 33 0A 10 -15,-1.0 -50,-0.2 -2,-0.3 2,-0.2 -0.116 49.5-116.8 -46.2 144.5 12.9 26.7 29.3 84 530 A W - 0 0 42 -52,-1.1 2,-0.4 -57,-0.1 -1,-0.1 -0.616 27.4-152.9 -84.7 149.2 13.8 23.2 28.3 85 531 A C - 0 0 12 -2,-0.2 2,-0.3 2,-0.1 52,-0.1 -0.996 3.0-146.1-125.0 129.3 15.8 21.3 31.0 86 532 A E + 0 0 97 -2,-0.4 53,-2.4 2,-0.0 54,-0.3 -0.689 65.0 41.3 -92.7 151.1 18.1 18.5 30.1 87 533 A G E S-G 138 0B 31 -2,-0.3 2,-0.3 51,-0.2 51,-0.1 -0.817 87.5 -70.4 115.8-156.5 18.4 15.6 32.6 88 534 A S E -G 137 0B 29 49,-0.6 49,-1.6 -2,-0.3 52,-0.1 -0.952 40.3 -88.9-143.8 163.1 15.7 13.8 34.5 89 535 A S E >> -G 136 0B 19 -2,-0.3 4,-2.2 47,-0.2 3,-0.9 -0.327 38.2-115.3 -68.8 148.7 13.2 14.2 37.4 90 536 A L H 3> S+ 0 0 0 45,-4.2 4,-2.9 1,-0.3 5,-0.3 0.908 116.7 56.0 -48.1 -51.4 14.2 13.3 41.0 91 537 A Y H 3> S+ 0 0 65 41,-2.6 4,-2.0 44,-0.2 5,-0.3 0.851 107.5 50.3 -51.1 -39.0 11.7 10.4 41.0 92 538 A H H <>>S+ 0 0 66 -3,-0.9 4,-2.3 40,-0.3 5,-1.6 0.974 111.8 47.2 -65.3 -52.4 13.4 9.0 38.0 93 539 A H H <5S+ 0 0 12 -4,-2.2 6,-1.8 3,-0.2 -2,-0.2 0.931 119.0 37.4 -53.9 -55.1 16.8 9.3 39.5 94 540 A L H <5S+ 0 0 10 -4,-2.9 -1,-0.2 4,-0.2 -2,-0.2 0.948 131.0 22.4 -67.8 -49.7 15.9 7.7 42.9 95 541 A H H <5S+ 0 0 36 -4,-2.0 -3,-0.2 -5,-0.3 -2,-0.2 0.490 125.3 38.7-102.9 -1.2 13.5 5.0 41.8 96 542 A I T <5S+ 0 0 97 -4,-2.3 -3,-0.2 -5,-0.3 -4,-0.1 0.815 131.1 14.4-110.7 -57.7 14.1 4.2 38.2 97 543 A I S - 0 0 155 -2,-0.2 4,-1.5 1,-0.1 -1,-0.1 -0.321 35.2-112.8 -59.6 156.7 26.8 10.9 47.7 103 549 A M H > S+ 0 0 15 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.951 113.2 56.7 -61.4 -52.2 25.2 12.0 51.0 104 550 A I H > S+ 0 0 108 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.892 105.8 53.7 -45.3 -47.0 26.2 15.7 50.9 105 551 A K H > S+ 0 0 52 1,-0.2 4,-2.8 2,-0.2 3,-0.4 0.926 105.9 52.2 -55.6 -49.8 24.5 15.9 47.5 106 552 A L H X S+ 0 0 2 -4,-1.5 4,-1.9 -3,-0.3 -1,-0.2 0.916 107.0 52.3 -53.9 -48.2 21.2 14.6 48.9 107 553 A I H X S+ 0 0 7 -4,-2.2 4,-2.1 1,-0.2 -1,-0.3 0.853 113.5 45.5 -60.0 -32.2 21.3 17.1 51.7 108 554 A D H X S+ 0 0 48 -4,-1.7 4,-2.9 -3,-0.4 5,-0.3 0.854 103.9 58.9 -81.1 -34.3 21.7 19.8 49.1 109 555 A I H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.905 113.4 43.2 -57.4 -36.9 19.0 18.5 46.7 110 556 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.945 107.5 59.3 -70.1 -49.6 16.8 19.0 49.7 111 557 A R H X S+ 0 0 53 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.904 112.4 39.9 -43.8 -52.5 18.3 22.3 50.5 112 558 A Q H X S+ 0 0 19 -4,-2.9 4,-3.1 2,-0.2 5,-0.3 0.914 109.2 56.9 -67.6 -45.4 17.3 23.6 47.1 113 559 A T H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.833 110.4 50.9 -54.6 -28.0 13.9 22.0 47.1 114 560 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.925 108.2 47.6 -75.0 -47.3 13.5 24.0 50.2 115 561 A Q H X S+ 0 0 5 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.933 113.0 50.3 -60.2 -46.0 14.6 27.3 48.8 116 562 A G H >X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 3,-0.7 0.973 114.5 42.5 -54.9 -58.8 12.3 26.8 45.8 117 563 A M H 3X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.3 -1,-0.2 0.870 110.5 57.1 -57.1 -38.5 9.4 26.0 48.0 118 564 A D H 3X S+ 0 0 19 -4,-2.9 4,-1.1 1,-0.2 -1,-0.3 0.848 110.2 46.1 -63.1 -31.2 10.2 28.8 50.4 119 565 A Y H S+ 0 0 10 -4,-2.3 5,-1.9 1,-0.2 -2,-0.2 0.867 109.5 45.9 -58.8 -38.0 6.8 29.8 46.1 121 567 A H H ><5S+ 0 0 11 -4,-1.9 3,-2.0 3,-0.2 -1,-0.2 0.848 104.9 60.4 -75.5 -33.4 5.0 30.4 49.3 122 568 A A H 3<5S+ 0 0 53 -4,-1.1 -2,-0.2 1,-0.3 -1,-0.2 0.940 105.1 48.8 -56.8 -46.9 6.4 33.9 49.7 123 569 A K T 3<5S- 0 0 37 -4,-1.9 -1,-0.3 2,-0.1 -2,-0.2 0.388 124.8-112.3 -73.9 7.4 4.7 34.8 46.5 124 570 A S T < 5 + 0 0 85 -3,-2.0 2,-0.5 1,-0.2 -3,-0.2 0.960 69.9 143.8 58.6 56.0 1.7 33.2 48.1 125 571 A I < - 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0 0 73 -4,-0.4 5,-0.1 -5,-0.2 6,-0.1 -0.239 52.4-142.4 -47.0 124.3 32.2 43.8 8.4 506 698 B K S S+ 0 0 108 -27,-0.1 2,-0.4 4,-0.1 -76,-0.2 0.734 82.3 80.2 -65.6 -25.0 33.0 47.5 8.7 507 699 B K S > S- 0 0 119 1,-0.1 3,-1.0 -78,-0.1 4,-0.2 -0.723 77.6-143.2 -85.3 132.1 29.8 48.5 6.9 508 700 B R G > S+ 0 0 89 -2,-0.4 3,-2.2 1,-0.2 -1,-0.1 0.976 94.5 46.8 -57.8 -65.4 26.8 48.5 9.1 509 701 B D G 3 S+ 0 0 138 1,-0.3 -1,-0.2 -66,-0.0 -2,-0.0 0.331 102.1 69.1 -62.9 5.7 24.1 47.2 6.8 510 702 B E G < S+ 0 0 78 -3,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.435 81.6 89.1-104.4 -4.2 26.4 44.4 5.6 511 703 B R S < S- 0 0 11 -3,-2.2 2,-0.2 -4,-0.2 -8,-0.2 -0.658 80.4-115.3 -93.0 150.4 26.4 42.6 8.9 512 704 B P - 0 0 11 0, 0.0 -2,-0.1 0, 0.0 -66,-0.1 -0.547 20.7-117.2 -87.4 152.0 23.7 39.9 9.6 513 705 B L > - 0 0 86 -2,-0.2 4,-1.1 1,-0.1 3,-0.1 -0.201 36.7-104.0 -71.1 176.8 20.9 40.0 12.2 514 706 B F H > S+ 0 0 1 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.781 112.1 68.9 -79.3 -28.2 21.0 37.3 14.9 515 707 B P H > S+ 0 0 78 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.928 109.6 40.9 -55.7 -38.0 18.3 35.0 13.7 516 708 B Q H > S+ 0 0 131 2,-0.2 4,-1.7 -3,-0.1 -2,-0.2 0.847 113.4 53.7 -75.7 -36.8 20.6 34.2 10.9 517 709 B I H X S+ 0 0 2 -4,-1.1 4,-2.1 2,-0.2 3,-0.3 0.971 108.2 48.7 -61.4 -55.0 23.7 34.1 13.1 518 710 B L H X S+ 0 0 12 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.932 110.1 51.3 -50.7 -53.7 22.3 31.6 15.5 519 711 B A H X S+ 0 0 57 -4,-1.5 4,-2.7 -5,-0.3 -1,-0.2 0.859 108.7 52.9 -53.5 -40.1 21.1 29.3 12.7 520 712 B S H X S+ 0 0 39 -4,-1.7 4,-2.3 -3,-0.3 -2,-0.2 0.992 111.9 42.4 -60.2 -64.4 24.6 29.3 11.1 521 713 B I H < S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.943 115.0 51.2 -46.8 -58.6 26.4 28.3 14.3 522 714 B E H >X S+ 0 0 63 -4,-2.7 4,-1.4 -5,-0.2 3,-1.0 0.909 111.7 46.9 -47.5 -53.0 23.9 25.7 15.2 523 715 B L H >X S+ 0 0 87 -4,-2.7 2,-3.5 1,-0.3 3,-0.9 0.985 110.7 50.5 -52.6 -66.6 24.0 24.1 11.7 524 716 B L H 3< S+ 0 0 16 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.1 -0.088 108.6 60.0 -68.7 45.0 27.8 24.0 11.6 525 717 B A H X4 S+ 0 0 23 -2,-3.5 3,-0.5 -3,-1.0 -1,-0.2 0.508 86.1 63.4-134.0 -51.4 27.7 22.4 15.0 526 718 B R H << S+ 0 0 178 -4,-1.4 2,-0.3 -3,-0.9 -2,-0.1 0.662 98.9 66.5 -55.8 -13.0 25.7 19.2 14.6 527 719 B S T 3< S+ 0 0 77 -4,-0.6 -1,-0.3 1,-0.1 -4,-0.0 -0.377 93.9 59.7-105.9 52.4 28.6 18.2 12.3 528 720 B L < + 0 0 58 -3,-0.5 -2,-0.1 -2,-0.3 -1,-0.1 0.556 64.4 81.4-139.8 -64.7 31.4 18.1 14.9 529 721 B P 0 0 108 0, 0.0 -2,-0.1 0, 0.0 -3,-0.1 0.615 360.0 360.0 -27.3 -29.8 31.5 15.7 18.0 530 722 B K 0 0 250 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 0.030 360.0 360.0 -66.6 360.0 32.8 12.8 15.9