==== 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 4FYO . COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE SYK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.KUGLSTATTER,M.SLADE . 267 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13415.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 67.8 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 . 43 16.1 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 . 16 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 32.6 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 . 1 3 1 1 2 0 0 1 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 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 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 88 0, 0.0 70,-2.7 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 -29.3 21.9 -1.8 11.6 2 364 A Y B -a 71 0A 164 68,-0.2 70,-0.2 70,-0.0 2,-0.2 -0.764 360.0-152.6 -90.0 117.6 21.7 -3.4 8.2 3 365 A L - 0 0 31 68,-3.3 2,-0.6 -2,-0.6 70,-0.2 -0.493 15.1-113.1 -95.7 158.3 19.3 -6.4 8.2 4 366 A D > - 0 0 66 -2,-0.2 3,-1.8 1,-0.1 4,-0.3 -0.797 15.7-150.1 -94.0 117.7 19.2 -9.5 6.1 5 367 A R G > S+ 0 0 68 -2,-0.6 3,-1.3 1,-0.3 -1,-0.1 0.805 96.0 58.8 -56.5 -35.0 16.1 -9.7 3.9 6 368 A K G 3 S+ 0 0 176 1,-0.3 -1,-0.3 3,-0.1 -2,-0.0 0.634 101.7 55.5 -73.7 -12.2 16.0 -13.6 4.0 7 369 A L G < S+ 0 0 66 -3,-1.8 22,-2.0 22,-0.0 2,-0.5 0.443 97.6 81.5 -92.6 -3.2 15.7 -13.4 7.8 8 370 A L E < -B 28 0A 7 -3,-1.3 2,-0.5 -4,-0.3 20,-0.2 -0.903 58.5-170.9-107.8 128.0 12.6 -11.2 7.5 9 371 A T E -B 27 0A 88 18,-2.3 18,-1.9 -2,-0.5 2,-0.3 -0.981 11.5-159.3-117.9 121.8 9.2 -12.6 6.8 10 372 A L E -B 26 0A 41 -2,-0.5 16,-0.2 16,-0.2 2,-0.1 -0.763 14.1-123.2-103.6 145.2 6.4 -10.2 5.9 11 373 A E - 0 0 44 14,-2.6 -1,-0.0 -2,-0.3 16,-0.0 -0.453 16.7-129.6 -76.5 156.2 2.6 -10.6 6.2 12 374 A D S S+ 0 0 145 -2,-0.1 -1,-0.1 2,-0.1 2,-0.1 0.893 87.3 72.4 -72.2 -42.9 0.4 -10.1 3.1 13 375 A K S S- 0 0 127 1,-0.1 12,-0.5 2,-0.0 2,-0.4 -0.316 80.4-125.6 -74.1 156.0 -2.0 -7.7 4.9 14 376 A E - 0 0 120 10,-0.1 10,-0.2 1,-0.1 3,-0.1 -0.823 6.5-155.8-103.2 142.6 -1.2 -4.1 5.9 15 377 A L - 0 0 104 8,-2.6 2,-0.3 -2,-0.4 9,-0.2 0.918 61.7 -71.9 -77.0 -48.9 -1.5 -2.7 9.4 16 378 A G B -C 23 0A 35 7,-1.3 7,-2.8 0, 0.0 2,-0.4 -0.944 40.5-100.3 167.5 174.3 -1.9 0.9 8.4 17 379 A S - 0 0 79 -2,-0.3 5,-0.2 5,-0.2 4,-0.1 -0.972 21.5-168.4-127.3 136.6 -0.2 4.0 7.0 18 380 A G - 0 0 40 2,-0.5 3,-0.1 -2,-0.4 -1,-0.1 0.150 63.8 -49.1 -91.0-146.3 1.2 7.2 8.6 19 381 A N S S+ 0 0 101 1,-0.2 2,-0.3 -2,-0.0 -2,-0.0 0.893 127.3 3.3 -58.9 -44.8 2.3 10.4 6.9 20 382 A F S S+ 0 0 23 29,-0.0 -2,-0.5 26,-0.0 -1,-0.2 -0.967 112.9 18.1-139.2 158.2 4.4 8.4 4.5 21 383 A G S S- 0 0 15 -2,-0.3 2,-0.4 -4,-0.1 -3,-0.3 -0.007 74.7 -94.2 74.7 177.8 5.1 4.7 3.8 22 384 A T E - D 0 41A 37 19,-2.7 19,-3.6 -5,-0.2 2,-0.5 -0.996 26.4-137.9-136.9 138.8 3.0 1.7 4.8 23 385 A V E +CD 16 40A 31 -7,-2.8 -8,-2.6 -2,-0.4 -7,-1.3 -0.844 21.2 178.9-105.9 129.8 3.5 -0.6 7.9 24 386 A K E - D 0 39A 49 15,-2.6 15,-3.3 -2,-0.5 2,-0.2 -0.911 31.5-109.4-122.7 152.7 3.2 -4.4 7.8 25 387 A K E + D 0 38A 47 -12,-0.5 -14,-2.6 -2,-0.3 2,-0.3 -0.588 47.6 164.9 -76.4 142.2 3.6 -7.1 10.5 26 388 A G E -BD 10 37A 0 11,-2.7 11,-2.8 -2,-0.2 2,-0.4 -0.893 33.7-126.1-149.3 178.8 6.7 -9.2 10.2 27 389 A Y E -BD 9 36A 88 -18,-1.9 -18,-2.3 -2,-0.3 2,-0.5 -0.995 19.5-165.2-136.6 125.6 9.0 -11.7 11.8 28 390 A Y E -BD 8 35A 18 7,-3.1 7,-3.1 -2,-0.4 2,-0.8 -0.958 19.8-131.9-118.5 127.8 12.8 -11.3 12.1 29 391 A Q E - D 0 34A 77 -22,-2.0 5,-0.2 -2,-0.5 4,-0.1 -0.640 32.9-173.5 -75.6 108.6 15.2 -14.1 13.1 30 392 A M - 0 0 52 3,-2.1 -1,-0.0 -2,-0.8 4,-0.0 0.032 50.0 -63.9 -84.3-162.5 17.5 -12.6 15.8 31 393 A K S S- 0 0 195 1,-0.1 3,-0.1 3,-0.0 -2,-0.1 0.811 121.0 -26.2 -56.2 -34.3 20.6 -14.2 17.3 32 394 A K S S+ 0 0 186 1,-0.3 2,-0.1 0, 0.0 -1,-0.1 0.403 127.6 62.2-146.4 -51.6 18.4 -17.0 18.8 33 395 A V S S- 0 0 102 -4,-0.1 -3,-2.1 1,-0.0 2,-0.4 -0.389 77.2-121.2 -79.5 160.6 14.8 -15.9 19.3 34 396 A V E -D 29 0A 82 -5,-0.2 2,-0.5 -2,-0.1 -5,-0.2 -0.901 28.0-147.7 -99.9 136.6 12.5 -14.8 16.6 35 397 A K E -D 28 0A 73 -7,-3.1 -7,-3.1 -2,-0.4 2,-0.3 -0.912 8.5-132.8-113.0 129.2 11.1 -11.2 17.0 36 398 A T E -D 27 0A 50 -2,-0.5 47,-1.5 -9,-0.2 2,-0.3 -0.626 38.2-175.5 -74.2 131.6 7.7 -10.0 15.9 37 399 A V E -DE 26 82A 0 -11,-2.8 -11,-2.7 -2,-0.3 2,-0.5 -0.885 32.4-135.4-132.8 157.3 8.2 -6.7 14.1 38 400 A A E -DE 25 81A 12 43,-2.4 43,-2.8 -2,-0.3 2,-0.5 -0.976 30.5-158.3-108.5 129.1 6.4 -3.8 12.5 39 401 A V E -DE 24 80A 0 -15,-3.3 -15,-2.6 -2,-0.5 2,-0.6 -0.943 11.4-148.7-120.4 120.9 7.9 -2.9 9.2 40 402 A K E -DE 23 79A 10 39,-2.9 39,-2.4 -2,-0.5 2,-0.3 -0.777 24.3-174.1 -85.1 121.1 7.6 0.5 7.4 41 403 A I E DE 22 78A 31 -19,-3.6 -19,-2.7 -2,-0.6 37,-0.2 -0.884 360.0 360.0-118.5 146.3 7.8 -0.1 3.6 42 404 A L 0 0 61 35,-1.0 5,-0.0 -2,-0.3 -22,-0.0 -0.798 360.0 360.0 -97.5 360.0 7.9 2.4 0.8 43 ! 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 44 411 A P > 0 0 145 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -28.5 14.2 10.0 -4.3 45 412 A A H > + 0 0 61 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.859 360.0 54.4 -71.7 -38.2 12.7 12.2 -1.5 46 413 A L H > S+ 0 0 76 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.818 105.8 53.8 -66.7 -34.0 10.7 9.4 0.1 47 414 A K H > S+ 0 0 86 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.920 109.5 46.8 -64.9 -46.9 13.9 7.3 0.4 48 415 A D H X S+ 0 0 90 -4,-1.3 4,-2.1 1,-0.2 -2,-0.2 0.838 109.1 55.6 -65.3 -35.6 15.8 10.1 2.3 49 416 A E H X S+ 0 0 86 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.893 108.7 46.4 -64.7 -42.6 12.8 10.7 4.6 50 417 A L H X S+ 0 0 3 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.884 113.2 49.5 -66.3 -39.8 12.7 7.0 5.7 51 418 A L H X S+ 0 0 45 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.840 109.8 51.0 -68.7 -34.7 16.5 7.1 6.3 52 419 A A H X S+ 0 0 52 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.888 110.2 50.0 -67.0 -40.8 16.2 10.3 8.3 53 420 A E H X S+ 0 0 4 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.916 112.3 47.4 -60.7 -45.8 13.5 8.7 10.4 54 421 A A H X S+ 0 0 4 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.886 107.9 56.2 -62.2 -41.2 15.8 5.7 10.9 55 422 A N H X S+ 0 0 87 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.865 108.8 46.9 -60.1 -39.3 18.7 8.0 11.8 56 423 A V H >< S+ 0 0 9 -4,-1.8 3,-1.2 1,-0.2 4,-0.4 0.949 111.9 49.2 -65.7 -50.5 16.7 9.6 14.6 57 424 A M H >< S+ 0 0 8 -4,-2.1 3,-1.0 1,-0.3 11,-0.4 0.810 102.6 62.4 -62.1 -33.2 15.5 6.2 16.0 58 425 A Q H 3< S+ 0 0 116 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.792 104.3 49.0 -59.9 -30.4 19.0 4.8 16.0 59 426 A Q T << S+ 0 0 101 -3,-1.2 2,-0.4 -4,-0.6 -1,-0.2 0.514 95.3 89.6 -91.0 -7.6 20.1 7.5 18.5 60 427 A L < + 0 0 17 -3,-1.0 2,-0.3 -4,-0.4 8,-0.2 -0.771 44.1 173.9-101.8 138.2 17.2 7.0 20.9 61 428 A D + 0 0 109 -2,-0.4 5,-0.1 6,-0.1 6,-0.0 -0.781 28.4 122.3-145.4 90.9 17.2 4.6 23.9 62 429 A N > - 0 0 22 -2,-0.3 3,-1.5 3,-0.3 52,-0.1 -0.990 61.2-126.3-153.3 142.1 14.2 4.8 26.2 63 430 A P T 3 S+ 0 0 58 0, 0.0 4,-0.1 0, 0.0 51,-0.1 0.748 111.2 52.4 -60.7 -23.4 11.6 2.3 27.5 64 431 A Y T 3 S+ 0 0 55 78,-0.1 79,-2.7 46,-0.1 2,-0.4 0.097 97.9 77.2-105.2 21.9 8.8 4.7 26.3 65 432 A I B < S-g 143 0B 4 -3,-1.5 -3,-0.3 77,-0.3 79,-0.2 -0.996 89.5-105.4-130.4 135.7 10.0 5.1 22.8 66 433 A V - 0 0 7 77,-2.7 2,-0.3 -2,-0.4 -6,-0.1 -0.381 38.7-133.4 -58.8 128.8 9.6 2.5 19.9 67 434 A R - 0 0 83 -2,-0.1 15,-2.5 -4,-0.1 2,-0.4 -0.699 7.3-134.6 -91.0 137.1 12.9 0.8 19.2 68 435 A M E - F 0 81A 32 -11,-0.4 13,-0.3 -2,-0.3 3,-0.1 -0.764 11.9-168.5 -85.5 132.3 14.3 0.3 15.7 69 436 A I E - 0 0 40 11,-2.8 2,-0.3 -2,-0.4 12,-0.2 0.862 57.5 -83.5 -82.3 -44.7 15.7 -3.1 14.9 70 437 A G E - F 0 80A 0 10,-1.7 10,-2.8 -67,-0.0 -1,-0.3 -0.984 40.1 -82.6 166.7-168.1 17.3 -1.9 11.7 71 438 A I E -aF 2 79A 11 -70,-2.7 -68,-3.3 -2,-0.3 2,-0.3 -0.850 26.4-168.9-126.0 161.0 16.9 -1.1 8.0 72 439 A C E - F 0 78A 7 6,-1.8 6,-2.2 -2,-0.3 2,-0.8 -0.963 16.5-146.9-153.5 132.3 17.0 -3.2 4.8 73 440 A E E + F 0 77A 134 -2,-0.3 4,-0.2 -70,-0.2 -68,-0.1 -0.867 53.4 115.7-101.5 101.7 17.1 -2.3 1.1 74 441 A A S S- 0 0 39 2,-2.2 3,-0.1 -2,-0.8 -1,-0.0 0.066 85.4 -8.8-127.7-121.5 15.1 -4.9 -0.8 75 442 A E S S- 0 0 149 1,-0.1 2,-0.3 -2,-0.1 -2,-0.1 0.883 143.1 -19.1 -50.4 -42.3 11.9 -4.7 -2.9 76 443 A S S S- 0 0 26 -4,-0.1 -2,-2.2 -29,-0.0 2,-0.2 -0.885 97.4 -67.5-145.3 178.0 11.9 -1.2 -1.4 77 444 A W E - F 0 73A 32 -2,-0.3 -35,-1.0 -4,-0.2 2,-0.4 -0.513 55.6-160.5 -66.3 139.5 13.7 0.4 1.6 78 445 A M E -EF 41 72A 2 -6,-2.2 -6,-1.8 -2,-0.2 2,-0.6 -0.986 18.3-155.4-131.3 137.4 12.3 -1.0 4.9 79 446 A L E -EF 40 71A 0 -39,-2.4 -39,-2.9 -2,-0.4 2,-0.5 -0.955 17.6-157.7-110.8 113.1 12.4 0.3 8.5 80 447 A V E +EF 39 70A 1 -10,-2.8 -11,-2.8 -2,-0.6 -10,-1.7 -0.817 17.8 173.0 -99.4 121.7 12.1 -2.6 10.9 81 448 A M E -EF 38 68A 20 -43,-2.8 -43,-2.4 -2,-0.5 -13,-0.2 -0.858 40.2 -89.9-125.1 156.5 10.8 -1.7 14.4 82 449 A E E -E 37 0A 30 -15,-2.5 2,-0.3 -2,-0.3 -45,-0.2 -0.429 54.5-107.5 -61.0 139.4 9.8 -3.7 17.5 83 450 A M - 0 0 30 -47,-1.5 2,-0.7 -2,-0.1 -1,-0.1 -0.554 22.1-161.3 -77.8 131.4 6.1 -4.5 17.4 84 451 A A > - 0 0 11 -2,-0.3 3,-1.0 1,-0.1 51,-0.2 -0.933 15.7-161.0-105.8 102.6 3.6 -2.7 19.6 85 452 A E T 3 S+ 0 0 105 -2,-0.7 51,-0.2 51,-0.3 -1,-0.1 0.731 79.2 52.0 -63.4 -31.2 0.7 -5.2 19.4 86 453 A L T 3 S- 0 0 66 49,-2.1 -1,-0.2 1,-0.2 50,-0.2 0.650 95.1-154.3 -86.7 -14.8 -2.3 -3.0 20.5 87 454 A G E < +H 135 0B 14 -3,-1.0 48,-2.2 48,-0.8 -1,-0.2 -0.203 44.3 10.4 80.5-166.7 -1.6 -0.2 18.1 88 455 A P E > -H 134 0B 48 0, 0.0 4,-2.1 0, 0.0 46,-0.2 -0.164 62.0-134.0 -54.8 137.2 -2.4 3.5 18.1 89 456 A L H > S+ 0 0 1 44,-2.7 4,-2.3 41,-1.0 5,-0.2 0.851 102.6 53.0 -61.0 -41.7 -3.7 4.9 21.4 90 457 A N H > S+ 0 0 20 40,-0.7 4,-1.9 43,-0.2 -1,-0.2 0.941 111.9 44.9 -62.4 -46.7 -6.6 6.9 19.8 91 458 A K H > S+ 0 0 100 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.867 112.4 52.7 -64.5 -38.9 -7.9 3.9 17.9 92 459 A Y H X S+ 0 0 32 -4,-2.1 4,-1.0 1,-0.2 3,-0.5 0.926 110.8 45.8 -62.3 -46.5 -7.6 1.7 21.0 93 460 A L H < S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.829 107.2 58.2 -69.5 -32.2 -9.6 4.0 23.2 94 461 A Q H < S+ 0 0 47 -4,-1.9 3,-0.2 1,-0.2 -1,-0.2 0.799 114.1 39.2 -61.3 -31.2 -12.3 4.4 20.6 95 462 A Q H < S+ 0 0 145 -4,-1.1 2,-0.3 -3,-0.5 -2,-0.2 0.570 119.3 48.4 -95.6 -13.0 -12.7 0.7 20.7 96 463 A N >< + 0 0 34 -4,-1.0 3,-1.1 -5,-0.1 -1,-0.2 -0.665 54.9 159.2-133.1 76.3 -12.4 0.4 24.5 97 464 A R T 3 + 0 0 156 -2,-0.3 -1,-0.1 1,-0.2 -4,-0.1 0.608 69.4 72.7 -73.3 -13.5 -14.5 3.0 26.3 98 465 A H T 3 + 0 0 113 -3,-0.1 -1,-0.2 2,-0.1 -5,-0.1 0.621 65.8 124.9 -75.8 -15.2 -14.4 1.0 29.5 99 466 A V < - 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