==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 15-JUL-11 3SXS . COMPND 2 MOLECULE: CYTOPLASMIC TYROSINE-PROTEIN KINASE BMX; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.SACK,J.MUCKELBAUER . 264 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13125.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 16.7 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 14 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 28.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 0 1 0 2 2 0 0 0 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 0 3 1 0 2 1 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 . 2 0 1 0 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 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 1 408 A G > 0 0 102 0, 0.0 3,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-120.6 29.1 1.4 3.6 2 409 A H T 3 + 0 0 189 1,-0.2 0, 0.0 68,-0.0 0, 0.0 0.757 360.0 65.5 -68.6 -25.1 28.9 5.2 2.9 3 410 A M T 3 S+ 0 0 24 67,-0.1 68,-2.4 2,-0.0 2,-0.4 0.810 87.6 79.6 -65.8 -34.0 26.5 5.4 6.0 4 411 A E B < -a 71 0A 46 -3,-0.6 2,-0.2 66,-0.2 68,-0.2 -0.652 67.5-162.5 -82.9 127.6 29.3 4.3 8.4 5 412 A L - 0 0 18 66,-3.1 2,-0.7 -2,-0.4 68,-0.2 -0.638 30.7 -97.1-102.5 163.3 31.8 7.1 9.4 6 413 A K > - 0 0 114 -2,-0.2 3,-1.5 1,-0.2 24,-0.2 -0.747 28.5-152.9 -82.1 118.0 35.2 6.7 11.0 7 414 A R G > S+ 0 0 41 -2,-0.7 3,-1.5 1,-0.3 -1,-0.2 0.796 94.5 59.6 -61.2 -35.0 34.8 7.2 14.7 8 415 A E G 3 S+ 0 0 140 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.698 97.5 64.0 -66.8 -18.6 38.4 8.5 15.2 9 416 A E G < S+ 0 0 64 -3,-1.5 21,-2.5 21,-0.1 2,-0.5 0.348 91.3 77.9 -87.8 7.0 37.4 11.3 12.7 10 417 A I E < -B 29 0A 11 -3,-1.5 2,-0.5 19,-0.2 19,-0.2 -0.972 58.5-174.9-117.5 122.2 34.8 12.6 15.2 11 418 A T E -B 28 0A 85 17,-2.4 17,-2.2 -2,-0.5 2,-0.4 -0.976 19.2-139.6-113.6 126.3 35.9 14.7 18.2 12 419 A L E +B 27 0A 55 -2,-0.5 15,-0.3 15,-0.2 2,-0.1 -0.699 23.9 174.4 -89.2 138.3 33.2 15.6 20.7 13 420 A L E - 0 0 81 13,-3.1 -1,-0.0 -2,-0.4 14,-0.0 -0.159 47.6 -16.3-114.2-153.7 33.1 19.0 22.2 14 421 A K E - 0 0 134 11,-0.2 12,-3.3 -2,-0.1 -1,-0.3 0.039 68.8 -99.3 -55.7 158.7 30.4 20.5 24.5 15 422 A E E -B 25 0A 106 10,-0.3 10,-0.3 1,-0.1 -1,-0.1 -0.555 29.9-171.7 -73.9 136.3 26.9 19.3 25.2 16 423 A L E - 0 0 65 8,-3.1 2,-0.3 1,-0.5 9,-0.2 0.726 52.5 -83.7 -99.0 -33.1 24.3 21.3 23.2 17 424 A G E -B 24 0A 29 7,-1.4 7,-3.2 2,-0.0 -1,-0.5 -0.973 46.5 -79.5 157.9-161.6 21.2 19.9 24.8 18 425 A S E +B 23 0A 92 -2,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.929 42.2 145.7-134.3 159.1 19.0 16.9 24.6 19 426 A G E > +B 22 0A 35 3,-1.4 3,-1.9 -2,-0.3 115,-0.1 -0.762 53.1 4.8-158.9-155.4 16.1 15.7 22.4 20 427 A Q T 3 S- 0 0 47 1,-0.3 129,-0.0 -2,-0.2 -2,-0.0 0.007 124.1 -20.8 35.3-129.6 14.9 12.4 21.1 21 428 A F T 3 S+ 0 0 68 18,-0.1 -1,-0.3 2,-0.1 20,-0.2 -0.897 126.3 28.3 87.1 -3.5 16.3 9.5 22.0 22 429 A G E < S-B 19 0A 17 -3,-1.9 -3,-1.4 18,-0.1 18,-0.1 -0.602 74.3 -92.7 155.0 149.1 19.6 11.2 23.1 23 430 A V E -B 18 0A 53 16,-0.3 16,-2.5 -5,-0.2 2,-0.4 -0.365 43.7-140.2 -67.4 147.1 21.9 13.9 24.4 24 431 A V E -BC 17 38A 28 -7,-3.2 -8,-3.1 14,-0.2 -7,-1.4 -0.971 16.6-167.8-118.4 131.2 23.4 16.0 21.6 25 432 A K E -BC 15 37A 63 12,-2.5 12,-3.1 -2,-0.4 -10,-0.3 -0.909 24.8-119.3-117.8 145.5 27.0 17.2 21.6 26 433 A L E + C 0 36A 26 -12,-3.3 -13,-3.1 -2,-0.4 2,-0.3 -0.567 47.4 170.8 -71.4 145.4 28.7 19.8 19.4 27 434 A G E -BC 12 35A 0 8,-2.8 8,-2.6 -15,-0.3 2,-0.4 -0.933 34.5-123.7-149.0 174.8 31.6 18.1 17.5 28 435 A K E -BC 11 34A 74 -17,-2.2 -17,-2.4 -2,-0.3 2,-0.4 -0.985 22.3-155.8-123.4 135.3 34.2 18.4 14.8 29 436 A W E >> S-BC 10 33A 33 4,-2.4 4,-2.8 -2,-0.4 3,-2.1 -0.957 74.1 -9.9-117.8 130.9 34.4 15.9 11.9 30 437 A K T 34 S- 0 0 105 -21,-2.5 -1,-0.2 -2,-0.4 -20,-0.1 0.761 117.6 -74.7 55.1 32.8 37.5 15.2 9.8 31 438 A G T 34 S+ 0 0 66 -22,-0.4 -1,-0.3 2,-0.1 3,-0.1 0.690 131.4 60.1 55.0 28.5 39.1 18.2 11.6 32 439 A Q T <4 S+ 0 0 130 -3,-2.1 2,-0.4 1,-0.2 -2,-0.2 0.541 80.1 75.1-146.2 -42.4 37.1 20.6 9.5 33 440 A Y E < -C 29 0A 115 -4,-2.8 -4,-2.4 50,-0.0 2,-0.4 -0.771 65.8-132.9 -96.1 135.4 33.3 20.3 9.7 34 441 A D E +C 28 0A 87 -2,-0.4 50,-1.3 -6,-0.2 2,-0.3 -0.680 38.1 175.2 -79.4 126.9 31.1 21.5 12.6 35 442 A V E -CD 27 83A 0 -8,-2.6 -8,-2.8 -2,-0.4 2,-0.4 -0.885 32.9-138.2-130.6 163.6 28.7 18.7 13.5 36 443 A A E -CD 26 82A 10 46,-2.3 46,-2.4 -2,-0.3 2,-0.5 -0.981 25.5-158.9-118.5 127.1 26.0 17.9 16.1 37 444 A V E -CD 25 81A 0 -12,-3.1 -12,-2.5 -2,-0.4 2,-0.4 -0.961 5.7-152.6-117.9 119.4 26.2 14.3 17.3 38 445 A K E -CD 24 80A 20 42,-2.5 42,-2.1 -2,-0.5 2,-0.5 -0.763 16.0-138.3 -88.4 134.0 23.3 12.5 18.9 39 446 A M E - D 0 79A 18 -16,-2.5 2,-0.8 -2,-0.4 -16,-0.3 -0.820 10.8-160.6 -93.7 120.3 24.3 9.7 21.4 40 447 A I E - D 0 78A 3 38,-2.9 38,-2.4 -2,-0.5 -18,-0.1 -0.903 17.1-145.9-102.1 105.1 22.3 6.5 21.2 41 448 A K >> - 0 0 115 -2,-0.8 3,-1.1 36,-0.2 4,-0.6 -0.321 27.9 -93.1 -69.3 154.1 22.8 4.6 24.5 42 449 A E B 34 S+f 45 0B 138 1,-0.2 -1,-0.1 2,-0.1 4,-0.1 -0.603 115.2 11.0 -69.3 118.1 22.8 0.8 24.6 43 450 A G T 34 S+ 0 0 76 2,-0.5 -1,-0.2 -2,-0.4 3,-0.1 0.142 96.5 107.7 97.2 -17.5 19.2 -0.3 25.3 44 451 A S T <4 S- 0 0 68 -3,-1.1 2,-0.3 1,-0.1 -2,-0.1 0.851 97.1 -5.4 -57.4 -42.0 17.7 3.2 24.8 45 452 A M B < S-f 42 0B 30 -4,-0.6 -2,-0.5 -24,-0.1 -1,-0.1 -0.909 96.7 -74.7-145.9 164.7 16.1 2.0 21.4 46 453 A S > - 0 0 54 -2,-0.3 4,-1.6 1,-0.1 -2,-0.0 -0.269 29.1-131.0 -66.9 151.6 16.4 -1.2 19.4 47 454 A E H > S+ 0 0 106 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.906 110.8 41.6 -64.5 -48.0 19.4 -2.2 17.3 48 455 A D H > S+ 0 0 130 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.684 110.7 57.1 -75.0 -24.5 17.3 -3.0 14.2 49 456 A E H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.889 103.6 56.3 -69.9 -40.2 15.1 0.1 14.7 50 457 A F H X S+ 0 0 10 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.881 104.6 50.2 -56.7 -47.3 18.3 2.1 14.6 51 458 A F H X S+ 0 0 105 -4,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.867 111.1 48.3 -60.8 -44.1 19.3 0.8 11.1 52 459 A Q H X S+ 0 0 113 -4,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.910 114.5 46.8 -63.0 -43.5 15.9 1.5 9.6 53 460 A E H X S+ 0 0 21 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.900 112.4 48.4 -62.3 -49.4 16.0 5.1 11.1 54 461 A A H X S+ 0 0 1 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.915 113.6 47.5 -61.9 -42.7 19.5 5.8 9.9 55 462 A Q H X S+ 0 0 90 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.890 111.5 50.8 -65.0 -43.6 18.7 4.6 6.4 56 463 A T H X S+ 0 0 23 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.915 111.4 47.8 -61.8 -44.3 15.5 6.7 6.3 57 464 A M H < S+ 0 0 10 -4,-2.4 11,-0.4 1,-0.2 -1,-0.2 0.837 112.3 49.5 -65.4 -35.8 17.3 9.8 7.3 58 465 A M H < S+ 0 0 76 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.882 111.4 49.4 -69.8 -40.4 20.0 9.2 4.7 59 466 A K H < S+ 0 0 120 -4,-2.2 2,-1.5 1,-0.2 -2,-0.2 0.877 101.5 65.9 -64.5 -44.5 17.4 8.7 2.0 60 467 A L < + 0 0 3 -4,-2.1 2,-0.5 -5,-0.1 -1,-0.2 -0.513 66.0 162.6 -86.9 68.0 15.5 11.8 2.8 61 468 A S + 0 0 57 -2,-1.5 6,-0.1 -3,-0.2 5,-0.1 -0.784 9.3 145.1 -88.8 127.9 18.1 14.6 1.9 62 469 A H > - 0 0 42 -2,-0.5 3,-2.1 3,-0.3 54,-0.0 -0.951 58.3-115.9-158.4 144.3 16.5 18.1 1.5 63 470 A P T 3 S+ 0 0 89 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.717 116.8 49.9 -56.2 -22.2 17.8 21.6 2.3 64 471 A K T 3 S+ 0 0 26 80,-0.1 81,-2.7 2,-0.1 2,-0.4 0.195 99.1 77.1-104.6 14.8 14.9 22.0 4.9 65 472 A L B < S-g 145 0C 2 -3,-2.1 -3,-0.3 79,-0.3 81,-0.2 -0.966 99.8 -92.6-120.3 140.8 15.6 18.7 6.7 66 473 A V - 0 0 9 79,-2.1 2,-0.5 -2,-0.4 81,-0.1 -0.301 50.1-116.2 -52.2 125.4 18.5 18.3 9.2 67 474 A K - 0 0 89 -4,-0.1 16,-2.0 -6,-0.1 2,-0.4 -0.626 24.8-150.2 -76.4 124.1 21.4 17.0 7.1 68 475 A F E + E 0 82A 9 -2,-0.5 14,-0.2 -11,-0.4 3,-0.1 -0.792 18.0 177.1 -92.6 129.7 22.5 13.5 8.1 69 476 A Y E - 0 0 70 12,-3.0 2,-0.3 -2,-0.4 13,-0.2 0.796 52.5 -76.2 -98.4 -41.0 26.2 12.7 7.5 70 477 A G E - E 0 81A 0 11,-1.5 11,-2.7 -65,-0.0 -1,-0.4 -0.976 41.0 -92.9 165.4-173.7 26.5 9.2 8.9 71 478 A V E -aE 4 80A 0 -68,-2.4 -66,-3.1 -2,-0.3 2,-0.5 -0.905 7.8-145.6-128.4 159.6 26.7 7.0 12.0 72 479 A C E + E 0 79A 2 7,-1.7 7,-2.2 -2,-0.3 -66,-0.1 -0.935 40.3 151.8-122.6 92.3 29.5 5.6 14.2 73 480 A S + 0 0 38 -2,-0.5 -1,-0.1 5,-0.2 5,-0.1 0.460 39.9 93.0-106.1 -5.1 27.8 2.3 15.2 74 481 A K S S+ 0 0 170 1,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.793 99.5 17.3 -61.2 -30.9 30.7 -0.2 15.8 75 482 A E S S- 0 0 114 2,-0.2 4,-0.2 -3,-0.1 -3,-0.1 -0.930 96.9 -62.9-140.4 162.1 30.7 0.7 19.5 76 483 A Y S S+ 0 0 77 -2,-0.3 2,-0.1 2,-0.1 -35,-0.1 -0.715 105.5 47.0 -94.9 145.6 28.4 2.4 22.1 77 484 A P S S- 0 0 37 0, 0.0 2,-0.2 0, 0.0 -36,-0.2 0.519 89.9-139.1 -68.4 143.0 27.2 5.1 22.5 78 485 A I E -D 40 0A 2 -38,-2.4 -38,-2.9 -2,-0.1 2,-0.4 -0.577 15.5-137.7 -72.0 136.8 26.2 5.0 18.8 79 486 A Y E -DE 39 72A 28 -7,-2.2 -7,-1.7 -2,-0.2 2,-0.6 -0.855 13.8-163.7 -97.7 135.9 26.8 8.4 17.2 80 487 A I E -DE 38 71A 3 -42,-2.1 -42,-2.5 -2,-0.4 2,-0.5 -0.975 19.6-156.1-113.1 114.0 24.3 10.0 14.8 81 488 A V E +DE 37 70A 0 -11,-2.7 -12,-3.0 -2,-0.6 -11,-1.5 -0.822 23.1 156.8 -99.8 126.2 26.3 12.7 13.0 82 489 A T E -DE 36 68A 20 -46,-2.4 -46,-2.3 -2,-0.5 -14,-0.2 -0.825 48.4 -74.5-135.4 172.0 24.4 15.6 11.5 83 490 A E E -D 35 0A 33 -16,-2.0 2,-0.5 -2,-0.3 -48,-0.2 -0.324 50.3-114.1 -63.9 145.5 25.1 19.2 10.4 84 491 A Y - 0 0 74 -50,-1.3 2,-0.8 -49,-0.1 -50,-0.1 -0.781 24.3-155.9 -84.9 123.8 25.4 21.7 13.4 85 492 A I > - 0 0 9 -2,-0.5 3,-2.1 1,-0.1 52,-0.3 -0.884 10.0-153.3-107.0 95.6 22.5 24.2 13.1 86 493 A S T 3 S+ 0 0 50 -2,-0.8 52,-0.2 1,-0.3 -1,-0.1 0.630 84.0 52.7 -53.8 -28.6 23.9 27.1 15.0 87 494 A N T 3 S- 0 0 60 50,-2.0 -1,-0.3 1,-0.2 51,-0.2 0.374 95.2-154.3 -92.4 8.2 20.7 28.9 16.4 88 495 A G < + 0 0 28 -3,-2.1 49,-2.8 49,-0.3 -1,-0.2 -0.118 49.7 15.4 61.9-149.3 19.5 25.6 17.9 89 496 A C B > -H 136 0C 29 47,-0.2 4,-2.3 1,-0.1 47,-0.3 -0.291 61.8-138.9 -64.3 134.1 15.8 24.7 18.6 90 497 A L H > S+ 0 0 0 45,-2.8 4,-2.8 42,-0.6 5,-0.2 0.873 101.9 54.7 -59.7 -43.1 13.1 26.9 16.9 91 498 A L H > S+ 0 0 22 41,-1.0 4,-2.2 44,-0.4 -1,-0.2 0.956 111.4 43.2 -58.8 -49.2 10.9 27.0 20.1 92 499 A N H > S+ 0 0 101 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.897 113.2 54.3 -62.8 -39.2 13.8 28.4 22.2 93 500 A Y H X S+ 0 0 29 -4,-2.3 4,-2.8 1,-0.2 5,-0.4 0.913 108.7 47.1 -60.7 -46.8 14.7 30.8 19.4 94 501 A L H X S+ 0 0 2 -4,-2.8 4,-1.7 1,-0.2 5,-0.2 0.903 113.9 48.9 -61.4 -41.3 11.1 32.2 19.2 95 502 A R H < S+ 0 0 145 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.819 121.4 33.4 -67.7 -32.8 11.0 32.6 23.0 96 503 A S H < S+ 0 0 93 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.710 138.3 15.0 -93.9 -29.3 14.5 34.3 23.2 97 504 A H H >< S+ 0 0 103 -4,-2.8 3,-1.1 -5,-0.2 -3,-0.2 0.355 89.3 105.8-130.3 1.1 14.5 36.3 19.9 98 505 A G G >< S+ 0 0 1 -4,-1.7 3,-1.9 -5,-0.4 -3,-0.1 0.802 73.2 64.4 -56.9 -36.8 10.9 36.3 18.6 99 506 A K G 3 S+ 0 0 201 1,-0.3 -1,-0.2 -5,-0.2 -2,-0.1 0.811 99.4 55.1 -59.5 -29.0 10.2 40.0 19.5 100 507 A G G < S+ 0 0 67 -3,-1.1 2,-0.3 2,-0.1 -1,-0.3 0.467 90.7 99.1 -82.1 -3.5 12.9 41.1 17.0 101 508 A L < - 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0 0 80 1,-0.1 3,-0.8 -4,-0.0 -1,-0.1 -0.661 39.0-116.1 -75.0 134.1 2.1 27.0 24.4 205 612 A P T 3 S+ 0 0 0 0, 0.0 4,-0.1 0, 0.0 -35,-0.1 -0.434 97.7 5.5 -69.2 147.3 -1.1 26.1 22.3 206 613 A Y T > S+ 0 0 25 1,-0.1 3,-1.5 -2,-0.1 8,-0.1 0.916 85.7 174.3 47.7 47.1 -4.3 25.8 24.4 207 614 A D T < + 0 0 108 -3,-0.8 -1,-0.1 1,-0.3 -3,-0.0 0.746 69.1 54.0 -61.7 -25.5 -2.1 27.0 27.3 208 615 A L T 3 S+ 0 0 141 -4,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.636 102.0 79.0 -78.6 -16.9 -5.0 27.3 29.9 209 616 A Y S < S- 0 0 79 -3,-1.5 2,-0.1 -4,-0.1 0, 0.0 -0.733 71.5-130.1-108.9 146.2 -6.1 23.7 29.2 210 617 A T > - 0 0 79 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.313 38.6-104.3 -75.2 166.5 -5.0 20.2 30.2 211 618 A N H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.889 123.6 53.9 -59.1 -38.4 -4.5 17.4 27.6 212 619 A S H > S+ 0 0 98 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.900 109.8 47.9 -62.9 -43.3 -7.9 15.9 28.6 213 620 A E H > S+ 0 0 86 2,-0.2 4,-3.2 1,-0.2 -2,-0.2 0.891 109.6 52.3 -64.6 -44.4 -9.6 19.2 28.1 214 621 A V H X S+ 0 0 3 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.932 106.7 52.1 -59.2 -48.1 -8.0 19.8 24.7 215 622 A V H X S+ 0 0 38 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.939 116.2 41.8 -53.5 -46.9 -9.2 16.3 23.4 216 623 A L H X S+ 0 0 103 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.964 116.6 46.4 -65.8 -52.1 -12.8 17.2 24.4 217 624 A K H <>S+ 0 0 49 -4,-3.2 5,-2.2 1,-0.2 4,-0.4 0.929 113.6 47.9 -58.0 -48.1 -12.7 20.8 23.2 218 625 A V H ><5S+ 0 0 3 -4,-3.2 3,-1.6 1,-0.2 -1,-0.2 0.905 109.4 53.8 -61.0 -40.5 -11.1 19.9 19.8 219 626 A S H 3<5S+ 0 0 37 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.866 107.6 52.8 -60.3 -33.3 -13.8 17.1 19.4 220 627 A Q T 3<5S- 0 0 121 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.462 128.7 -97.9 -80.5 -6.5 -16.4 19.7 20.0 221 628 A G T < 5S+ 0 0 44 -3,-1.6 -3,-0.2 -4,-0.4 2,-0.2 0.378 72.2 147.5 105.9 -1.4 -15.0 22.0 17.3 222 629 A H < - 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