==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 05-JUL-12 4FYN . COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE SYK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.KUGLSTATTER,A.G.VILLASENOR . 267 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13713.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 17.2 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 18 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 1 0 1 1 0 0 0 1 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 0 1 3 0 0 0 1 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 1 363 A V 0 0 83 0, 0.0 71,-3.6 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 -29.2 21.4 -1.0 11.4 2 364 A Y B -a 72 0A 148 69,-0.2 2,-0.3 71,-0.0 71,-0.2 -0.867 360.0-157.0-104.1 131.3 21.5 -3.3 8.3 3 365 A L - 0 0 31 69,-2.5 2,-0.8 -2,-0.5 71,-0.3 -0.718 20.8-112.5-113.9 156.8 19.3 -6.3 8.2 4 366 A D >> - 0 0 68 -2,-0.3 3,-1.5 1,-0.2 4,-0.6 -0.751 18.8-153.4 -89.3 106.6 19.3 -9.6 6.4 5 367 A R G >4 S+ 0 0 70 -2,-0.8 3,-1.1 1,-0.3 -1,-0.2 0.829 96.4 55.0 -46.6 -41.2 16.3 -9.8 4.1 6 368 A K G 34 S+ 0 0 187 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.773 102.9 55.5 -67.8 -28.2 16.3 -13.6 4.3 7 369 A L G <4 S+ 0 0 63 -3,-1.5 22,-1.9 21,-0.0 2,-0.5 0.544 95.9 87.8 -75.9 -8.8 16.0 -13.4 8.1 8 370 A L E << -B 28 0A 11 -3,-1.1 2,-0.5 -4,-0.6 20,-0.2 -0.817 59.7-166.2 -98.4 129.1 12.9 -11.3 7.7 9 371 A T E -B 27 0A 86 18,-2.0 18,-1.3 -2,-0.5 2,-0.4 -0.958 6.1-162.3-114.5 127.1 9.4 -12.8 7.4 10 372 A L E -B 26 0A 48 -2,-0.5 2,-0.3 16,-0.2 16,-0.2 -0.910 10.6-138.2-112.8 134.5 6.5 -10.6 6.2 11 373 A E E - 0 0 35 14,-2.9 14,-0.2 -2,-0.4 -2,-0.0 -0.658 18.4-127.6 -87.7 144.1 2.8 -11.4 6.7 12 374 A D E S+ 0 0 141 -2,-0.3 -1,-0.1 12,-0.1 2,-0.0 0.824 86.5 97.5 -56.0 -36.2 0.3 -10.8 3.8 13 375 A K E S- 0 0 134 1,-0.1 12,-0.8 12,-0.1 2,-0.5 -0.311 70.5-144.3 -54.2 134.3 -1.8 -8.8 6.4 14 376 A E E -B 24 0A 101 10,-0.2 10,-0.2 1,-0.1 3,-0.1 -0.931 8.7-163.8-106.0 122.9 -1.2 -5.1 6.2 15 377 A L E - 0 0 101 8,-2.5 2,-0.2 -2,-0.5 9,-0.2 0.888 70.0 -17.4 -73.3 -41.1 -1.3 -3.3 9.6 16 378 A G E B 23 0A 33 7,-1.4 7,-1.6 1,-0.0 -1,-0.2 -0.864 360.0 360.0-152.9-175.9 -1.7 0.2 8.2 17 379 A S 0 0 101 -2,-0.2 3,-0.2 5,-0.2 5,-0.1 -0.334 360.0 360.0-138.6 360.0 -1.3 2.3 5.0 18 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 19 381 A N 0 0 164 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-124.1 1.3 8.1 1.9 20 382 A F - 0 0 33 -3,-0.2 23,-1.1 1,-0.1 2,-0.3 0.700 360.0 -94.4 -73.8 -27.2 4.6 6.3 1.7 21 383 A G E - C 0 42A 15 21,-0.2 2,-0.2 22,-0.1 21,-0.2 -0.964 66.5 -16.9 143.7-128.3 3.3 2.8 1.2 22 384 A T E - C 0 41A 32 19,-1.8 19,-3.4 -2,-0.3 2,-0.5 -0.739 31.4-146.1-125.7 160.7 2.6 0.1 3.7 23 385 A V E +BC 16 40A 36 -7,-1.6 -8,-2.5 -2,-0.2 -7,-1.4 -0.987 30.6 179.8-123.5 118.2 3.1 -1.1 7.3 24 386 A K E -BC 14 39A 49 15,-2.0 15,-3.1 -2,-0.5 2,-0.3 -0.818 24.0-121.9-120.3 158.5 3.3 -4.9 7.7 25 387 A K E + C 0 38A 46 -12,-0.8 -14,-2.9 -2,-0.3 2,-0.3 -0.723 44.8 131.0 -95.8 148.7 3.8 -7.4 10.5 26 388 A G E -BC 10 37A 0 11,-1.9 11,-3.3 -2,-0.3 2,-0.4 -0.954 44.7-101.6-172.0-171.6 6.6 -9.9 10.6 27 389 A Y E -BC 9 36A 90 -18,-1.3 -18,-2.0 -2,-0.3 2,-0.5 -0.993 16.0-147.3-134.9 139.2 9.4 -11.5 12.6 28 390 A Y E -BC 8 35A 20 7,-2.9 7,-2.7 -2,-0.4 2,-0.7 -0.943 21.6-130.1-108.0 123.5 13.1 -11.1 12.6 29 391 A Q E - C 0 34A 86 -22,-1.9 5,-0.2 -2,-0.5 4,-0.1 -0.632 39.6-177.6 -73.0 109.4 15.2 -14.1 13.4 30 392 A M - 0 0 49 3,-1.9 -1,-0.1 -2,-0.7 4,-0.0 -0.028 44.5 -58.7 -96.8-162.0 17.6 -12.9 16.0 31 393 A K S S- 0 0 193 1,-0.1 3,-0.1 -2,-0.0 -2,-0.1 0.882 118.8 -31.7 -46.9 -52.3 20.6 -14.3 18.0 32 394 A K S S+ 0 0 192 1,-0.1 2,-0.1 0, 0.0 -1,-0.1 0.476 128.9 62.2-141.1 -38.7 18.5 -17.1 19.6 33 395 A V S S- 0 0 98 -4,-0.1 -3,-1.9 1,-0.0 2,-0.5 -0.459 77.7-119.7 -92.8 165.6 15.0 -15.7 19.9 34 396 A V E -C 29 0A 78 -5,-0.2 2,-0.6 -2,-0.1 -5,-0.2 -0.939 24.9-144.8-112.4 129.4 12.6 -14.5 17.3 35 397 A K E -C 28 0A 51 -7,-2.7 -7,-2.9 -2,-0.5 2,-0.2 -0.825 6.2-137.3-104.5 121.1 11.4 -10.9 17.3 36 398 A T E -C 27 0A 44 -2,-0.6 48,-1.5 -9,-0.2 2,-0.3 -0.504 37.1-179.9 -65.7 134.4 7.9 -9.7 16.4 37 399 A V E -CD 26 83A 0 -11,-3.3 -11,-1.9 46,-0.2 2,-0.4 -0.934 32.9-137.0-140.2 157.3 8.2 -6.5 14.3 38 400 A A E -CD 25 82A 14 44,-2.8 44,-2.4 -2,-0.3 2,-0.5 -0.960 26.9-153.9-111.6 138.7 6.3 -3.9 12.5 39 401 A V E -CD 24 81A 0 -15,-3.1 -15,-2.0 -2,-0.4 2,-0.6 -0.908 9.9-152.0-125.4 110.6 7.8 -2.9 9.1 40 402 A K E -CD 23 80A 29 40,-2.6 40,-2.8 -2,-0.5 2,-0.4 -0.656 25.3-170.0 -73.6 117.6 7.4 0.4 7.4 41 403 A I E -CD 22 79A 16 -19,-3.4 -19,-1.8 -2,-0.6 38,-0.2 -0.950 9.5-143.9-120.2 129.7 7.7 -0.3 3.6 42 404 A L E C 21 0A 8 36,-2.2 -21,-0.2 -2,-0.4 -22,-0.1 -0.327 360.0 360.0 -84.4 168.7 8.0 2.2 0.7 43 405 A K 0 0 171 -23,-1.1 -22,-0.1 -2,-0.1 -1,-0.1 0.859 360.0 360.0 -76.2 360.0 6.6 2.1 -2.9 44 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 45 411 A P > 0 0 133 0, 0.0 4,-1.0 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -61.2 14.2 9.3 -4.6 46 412 A A H > + 0 0 59 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.752 360.0 62.7 -76.4 -24.9 13.2 11.8 -1.8 47 413 A L H > S+ 0 0 49 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.817 105.1 49.3 -64.5 -29.6 10.7 9.4 -0.4 48 414 A K H > S+ 0 0 55 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.806 105.4 55.9 -78.1 -33.4 13.7 7.2 0.3 49 415 A D H X S+ 0 0 104 -4,-1.0 4,-2.1 1,-0.2 -2,-0.2 0.825 102.1 56.0 -72.1 -33.5 15.8 9.9 2.0 50 416 A E H X S+ 0 0 118 -4,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.884 105.9 52.6 -63.9 -39.0 13.1 10.7 4.5 51 417 A L H X S+ 0 0 2 -4,-0.8 4,-3.0 2,-0.2 -2,-0.2 0.922 109.0 48.3 -63.0 -47.1 13.2 7.0 5.6 52 418 A L H X S+ 0 0 62 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.933 113.0 47.6 -58.2 -50.2 17.0 7.0 6.2 53 419 A A H X S+ 0 0 59 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.919 112.0 51.1 -54.4 -48.5 16.7 10.3 8.2 54 420 A E H >X S+ 0 0 11 -4,-2.6 4,-1.9 1,-0.2 3,-0.6 0.940 110.5 48.2 -54.7 -53.5 13.9 8.8 10.2 55 421 A A H 3X S+ 0 0 4 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.889 107.2 57.1 -53.6 -43.8 15.9 5.6 10.9 56 422 A N H 3X S+ 0 0 79 -4,-2.6 4,-0.7 1,-0.2 -1,-0.2 0.821 106.2 49.7 -61.4 -32.7 18.9 7.8 11.9 57 423 A V H X< S+ 0 0 11 -4,-1.5 3,-1.0 -3,-0.6 4,-0.5 0.938 111.8 45.8 -68.9 -49.2 16.8 9.5 14.6 58 424 A M H >< S+ 0 0 8 -4,-1.9 3,-1.5 1,-0.3 11,-0.2 0.868 104.0 66.4 -63.6 -34.3 15.4 6.3 16.2 59 425 A Q H 3< S+ 0 0 98 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.818 103.2 45.5 -50.1 -37.8 19.0 5.0 16.0 60 426 A Q T << S+ 0 0 97 -3,-1.0 2,-0.5 -4,-0.7 -1,-0.3 0.545 95.6 92.7 -88.5 -8.3 20.0 7.6 18.6 61 427 A L < + 0 0 12 -3,-1.5 2,-0.4 -4,-0.5 8,-0.2 -0.791 41.8 170.9-103.4 127.9 17.0 7.1 21.0 62 428 A D + 0 0 119 -2,-0.5 5,-0.1 6,-0.1 6,-0.1 -0.901 29.3 117.9-139.6 96.8 17.2 4.7 23.9 63 429 A N > - 0 0 25 -2,-0.4 3,-1.2 3,-0.4 52,-0.0 -0.966 63.9-123.0-162.0 143.4 14.2 4.9 26.3 64 430 A P T 3 S+ 0 0 51 0, 0.0 4,-0.1 0, 0.0 51,-0.1 0.731 111.1 52.9 -61.0 -24.8 11.4 2.5 27.5 65 431 A Y T 3 S+ 0 0 54 78,-0.1 79,-2.5 2,-0.1 2,-0.4 0.129 97.8 74.6-106.2 17.7 8.7 5.0 26.3 66 432 A I B < S-f 144 0B 2 -3,-1.2 -3,-0.4 77,-0.3 79,-0.2 -1.000 89.6-106.7-132.2 130.9 9.9 5.3 22.8 67 433 A V - 0 0 9 77,-2.3 2,-0.4 -2,-0.4 -6,-0.1 -0.284 36.5-132.2 -52.7 134.3 9.6 2.7 20.1 68 434 A R - 0 0 79 -4,-0.1 15,-2.3 -6,-0.1 2,-0.3 -0.807 8.8-139.2 -96.1 133.6 12.8 1.0 19.2 69 435 A M E - E 0 82A 31 -2,-0.4 13,-0.3 13,-0.2 3,-0.1 -0.698 9.4-166.5 -85.2 139.5 14.2 0.4 15.7 70 436 A I E - 0 0 35 11,-3.1 2,-0.3 1,-0.4 12,-0.2 0.828 55.9 -90.6 -88.8 -44.5 15.8 -2.9 14.8 71 437 A G E - E 0 81A 0 10,-1.8 10,-2.6 -68,-0.0 -1,-0.4 -0.982 40.9 -71.0 162.0-161.9 17.3 -1.6 11.5 72 438 A I E -aE 2 80A 6 -71,-3.6 -69,-2.5 -2,-0.3 2,-0.3 -0.755 28.5-160.1-125.7 166.6 16.7 -1.1 7.8 73 439 A C E - E 0 79A 2 6,-1.6 6,-2.3 -2,-0.2 2,-0.6 -0.984 10.6-153.3-153.8 130.7 16.6 -3.3 4.6 74 440 A E E + E 0 78A 134 -2,-0.3 4,-0.2 -71,-0.3 -69,-0.2 -0.954 51.4 105.2-105.4 117.5 16.9 -2.8 0.9 75 441 A A S S- 0 0 41 2,-1.6 3,-0.0 -2,-0.6 -2,-0.0 -0.482 90.9 -10.1-151.3-130.7 15.0 -5.4 -1.1 76 442 A E S S- 0 0 144 -2,-0.2 2,-0.3 1,-0.1 -2,-0.0 0.873 139.9 -13.2 -44.7 -39.2 11.8 -5.2 -3.2 77 443 A S S S- 0 0 27 -4,-0.1 -2,-1.6 0, 0.0 2,-0.4 -0.894 92.2 -72.9-148.8 176.0 11.5 -1.8 -1.4 78 444 A W E - E 0 74A 40 -2,-0.3 -36,-2.2 -4,-0.2 2,-0.4 -0.662 51.9-164.5 -79.4 134.3 13.1 0.2 1.5 79 445 A M E -DE 41 73A 2 -6,-2.3 -6,-1.6 -2,-0.4 2,-0.6 -0.971 19.2-158.5-132.7 130.0 12.0 -1.2 4.8 80 446 A L E -DE 40 72A 0 -40,-2.8 -40,-2.6 -2,-0.4 2,-0.5 -0.945 18.8-159.0-111.1 111.3 12.2 0.2 8.4 81 447 A V E +DE 39 71A 0 -10,-2.6 -11,-3.1 -2,-0.6 -10,-1.8 -0.794 17.2 169.4-100.8 125.0 12.0 -2.6 10.9 82 448 A M E -DE 38 69A 30 -44,-2.4 -44,-2.8 -2,-0.5 -13,-0.2 -0.948 42.9 -84.1-135.0 152.2 10.9 -1.9 14.5 83 449 A E E -D 37 0A 54 -15,-2.3 2,-0.4 -2,-0.3 -46,-0.2 -0.202 57.8-108.2 -43.4 139.0 9.9 -3.6 17.7 84 450 A M - 0 0 28 -48,-1.5 2,-0.7 -47,-0.1 -1,-0.1 -0.667 21.2-157.9 -83.5 130.8 6.2 -4.5 17.5 85 451 A A > - 0 0 11 -2,-0.4 3,-1.4 1,-0.1 51,-0.3 -0.907 16.5-160.7-100.6 101.4 3.7 -2.5 19.7 86 452 A E T 3 S+ 0 0 99 -2,-0.7 51,-0.2 1,-0.3 -1,-0.1 0.763 78.8 48.2 -61.4 -40.3 0.9 -5.1 19.7 87 453 A L T 3 S- 0 0 71 49,-2.2 -1,-0.3 1,-0.2 50,-0.2 0.472 95.7-152.3 -86.4 -3.9 -2.2 -3.0 20.6 88 454 A G E < +G 136 0B 16 -3,-1.4 48,-2.2 48,-0.6 -1,-0.2 -0.088 46.4 12.7 71.1-165.1 -1.5 -0.2 18.1 89 455 A P E > -G 135 0B 36 0, 0.0 4,-1.9 0, 0.0 3,-0.3 -0.156 60.9-134.6 -55.8 131.1 -2.4 3.6 18.2 90 456 A L H > S+ 0 0 2 44,-3.2 4,-2.1 41,-0.7 5,-0.2 0.838 101.9 55.2 -52.2 -43.5 -3.7 5.1 21.5 91 457 A N H > S+ 0 0 25 40,-0.7 4,-2.0 43,-0.3 -1,-0.2 0.924 110.8 43.5 -61.2 -42.6 -6.6 7.0 20.0 92 458 A K H > S+ 0 0 110 -3,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.830 110.3 55.8 -74.9 -33.5 -8.1 3.9 18.3 93 459 A Y H X S+ 0 0 33 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.949 112.0 42.9 -59.9 -48.8 -7.6 1.7 21.4 94 460 A L H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 3,-0.2 0.814 108.9 58.5 -69.2 -34.5 -9.6 4.2 23.5 95 461 A Q H < S+ 0 0 67 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.879 116.3 35.3 -57.2 -41.1 -12.2 4.6 20.7 96 462 A Q H < S+ 0 0 143 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.459 120.6 50.3 -94.9 -3.8 -12.9 0.9 20.9 97 463 A N >< + 0 0 44 -4,-0.7 3,-1.3 -3,-0.2 -1,-0.2 -0.582 55.6 159.8-135.2 72.8 -12.3 0.6 24.7 98 464 A R T 3 + 0 0 167 -3,-0.3 -1,-0.1 1,-0.3 -4,-0.1 0.472 66.4 75.5 -75.0 -2.2 -14.4 3.2 26.5 99 465 A H T 3 + 0 0 100 -3,-0.1 -1,-0.3 2,-0.1 -5,-0.1 0.619 64.1 127.3 -78.9 -18.4 -14.3 1.3 29.8 100 466 A V < - 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