==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER KINASE 29-AUG-03 1UMW . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PLK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.RELLOS,A.ELIA,M.B.YAFFE,S.J.SMERDON . 458 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22995.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 319 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 130 28.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 2.2 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 . 0 0.0 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 . 36 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 22.3 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+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 0 2 0 0 0 0 0 2 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 6 0 1 6 11 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 0 0 0 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 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 1 373 A H > 0 0 56 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 160.6 37.1 9.5 1.8 2 374 A L H > + 0 0 28 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.887 360.0 55.2 -62.9 -40.3 36.8 7.3 5.0 3 375 A S H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.916 110.5 45.5 -59.8 -45.9 39.9 8.9 6.6 4 376 A D H > S+ 0 0 76 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.906 111.8 51.9 -62.6 -44.0 38.4 12.3 6.1 5 377 A M H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.910 108.0 52.3 -60.7 -41.0 35.0 11.2 7.4 6 378 A L H X S+ 0 0 35 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.926 109.5 48.9 -60.3 -43.6 36.7 9.7 10.5 7 379 A Q H X S+ 0 0 129 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.916 112.4 48.5 -62.4 -43.4 38.5 13.0 11.2 8 380 A Q H X S+ 0 0 44 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.892 114.8 44.4 -63.7 -43.4 35.3 15.0 10.8 9 381 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.907 111.9 52.1 -69.6 -42.7 33.3 12.6 13.1 10 382 A H H X S+ 0 0 95 -4,-3.1 4,-2.5 -5,-0.2 -2,-0.2 0.930 109.5 52.1 -59.2 -42.2 36.1 12.5 15.7 11 383 A S H X S+ 0 0 50 -4,-2.2 4,-0.7 -5,-0.2 -2,-0.2 0.927 114.4 38.3 -62.6 -49.4 36.1 16.2 15.8 12 384 A V H >< S+ 0 0 0 -4,-1.9 3,-0.6 1,-0.2 -1,-0.2 0.916 118.0 50.0 -69.9 -39.8 32.4 16.8 16.4 13 385 A N H >< S+ 0 0 24 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.887 106.0 55.5 -66.2 -39.1 32.1 13.8 18.8 14 386 A A H 3< S+ 0 0 61 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.726 99.1 63.3 -65.4 -20.9 35.0 14.9 20.9 15 387 A S T << S- 0 0 28 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.511 102.9-134.0 -82.1 -3.5 33.3 18.2 21.4 16 388 A K X - 0 0 114 -3,-1.7 3,-1.9 -4,-0.2 -3,-0.1 0.941 25.4-169.9 49.2 63.1 30.4 16.5 23.2 17 389 A P T 3 S+ 0 0 6 0, 0.0 183,-1.4 0, 0.0 3,-0.3 0.658 78.7 48.3 -61.0 -23.7 27.7 18.4 21.3 18 390 A S T 3 S+ 0 0 32 181,-0.2 184,-0.2 1,-0.2 -2,-0.1 0.478 96.7 73.0 -94.7 -2.7 24.8 17.3 23.5 19 391 A E S < S+ 0 0 115 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 -0.194 74.6 112.4-104.6 40.6 26.6 18.1 26.7 20 392 A R S S- 0 0 78 -3,-0.3 3,-0.2 180,-0.2 178,-0.0 -0.737 74.7-121.7-108.3 158.7 26.2 21.9 26.3 21 393 A G S S+ 0 0 92 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.864 100.2 22.4 -69.2 -37.3 24.1 24.2 28.4 22 394 A L S S- 0 0 131 -3,-0.0 2,-0.4 2,-0.0 -1,-0.2 -0.990 75.1-151.1-134.1 125.2 22.1 25.5 25.4 23 395 A V + 0 0 52 -2,-0.4 176,-0.2 -3,-0.2 3,-0.1 -0.821 15.8 177.2 -98.9 133.5 21.6 23.6 22.2 24 396 A R > + 0 0 104 174,-2.3 3,-1.9 -2,-0.4 4,-0.2 -0.482 15.4 158.0-129.1 59.8 21.1 25.4 18.9 25 397 A Q G > + 0 0 27 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.815 68.4 67.6 -51.5 -36.4 21.0 22.5 16.5 26 398 A E G > S+ 0 0 99 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 0.777 88.8 65.1 -59.9 -25.6 19.0 24.7 14.0 27 399 A E G < S+ 0 0 91 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.561 96.3 57.7 -76.4 -6.2 22.1 26.9 13.5 28 400 A A G < S+ 0 0 0 -3,-2.1 163,-2.7 -4,-0.2 -1,-0.2 0.467 78.2 119.8-100.4 -4.5 24.0 24.0 12.0 29 401 A E B < +A 190 0A 70 -3,-1.2 161,-0.3 -4,-0.3 -3,-0.0 -0.392 32.7 172.5 -64.3 133.0 21.4 23.4 9.2 30 402 A D > - 0 0 34 159,-2.6 3,-2.1 -2,-0.1 4,-0.1 -0.717 11.2-179.0-145.3 87.2 22.8 23.8 5.7 31 403 A P G > S+ 0 0 88 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.701 79.9 71.3 -62.6 -20.6 20.2 22.8 3.0 32 404 A A G 3 S+ 0 0 74 1,-0.3 96,-0.0 157,-0.1 -2,-0.0 0.603 93.8 57.9 -71.0 -9.1 22.8 23.5 0.3 33 405 A C G < S+ 0 0 4 -3,-2.1 -1,-0.3 156,-0.1 142,-0.1 0.352 71.9 134.9-101.6 4.6 24.6 20.4 1.5 34 406 A I < - 0 0 23 -3,-1.4 94,-0.3 155,-0.1 155,-0.0 -0.264 63.0-105.0 -53.8 138.0 21.8 17.9 0.9 35 407 A P - 0 0 8 0, 0.0 93,-0.8 0, 0.0 -1,-0.1 -0.284 12.0-142.7 -67.9 153.7 23.1 14.8 -0.8 36 408 A I S S+ 0 0 45 91,-0.2 2,-0.3 1,-0.2 -2,-0.1 0.851 85.6 24.0 -77.9 -38.9 22.6 14.1 -4.5 37 409 A F + 0 0 8 19,-0.1 2,-0.3 18,-0.1 -1,-0.2 -0.945 59.5 157.2-131.8 148.9 22.2 10.3 -3.8 38 410 A W - 0 0 3 -2,-0.3 18,-1.8 -3,-0.1 2,-0.6 -0.944 49.8 -88.1-154.7 166.1 21.3 8.0 -0.9 39 411 A V E +G 55 0B 0 -2,-0.3 16,-0.2 16,-0.2 3,-0.1 -0.730 38.0 178.4 -82.6 120.9 20.0 4.4 -0.7 40 412 A S E + 0 0 2 14,-2.6 81,-2.2 -2,-0.6 2,-0.3 0.746 67.0 3.6 -93.6 -30.4 16.2 4.3 -0.8 41 413 A K E -G 54 0B 20 13,-1.2 13,-2.6 79,-0.2 -1,-0.3 -0.970 64.5-176.1-152.1 154.7 15.5 0.6 -0.7 42 414 A W E -G 53 0B 4 -2,-0.3 408,-2.6 11,-0.3 2,-0.4 -0.986 12.2-159.8-155.4 153.5 17.7 -2.5 -0.3 43 415 A V E -GH 52 449B 12 9,-2.7 9,-2.1 -2,-0.3 2,-1.1 -0.990 15.6-143.4-137.3 124.4 17.3 -6.3 -0.2 44 416 A D E +G 51 0B 17 404,-3.0 7,-0.2 -2,-0.4 3,-0.2 -0.733 38.2 149.2 -93.5 94.6 19.9 -8.7 1.3 45 417 A Y E >>> +G 50 0B 71 5,-1.7 4,-2.9 -2,-1.1 3,-1.7 -0.171 25.5 130.0-111.2 36.6 20.1 -11.8 -0.8 46 418 A S T 345 + 0 0 45 1,-0.3 -1,-0.1 3,-0.2 5,-0.1 0.488 54.9 79.2 -74.3 -1.7 23.8 -12.3 0.0 47 419 A D T 345S- 0 0 140 3,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.784 122.8 -5.8 -68.9 -30.5 23.0 -15.9 0.9 48 420 A K T <45S+ 0 0 135 -3,-1.7 -2,-0.2 2,-0.2 -1,-0.1 0.622 142.9 11.7-138.2 -34.1 23.1 -16.7 -2.8 49 421 A Y T <5S- 0 0 94 -4,-2.9 16,-2.7 1,-0.3 2,-0.3 0.741 94.3-104.2-122.2 -49.7 23.4 -13.6 -5.1 50 422 A G E < -GI 45 64B 0 -5,-1.6 -5,-1.7 14,-0.3 2,-0.6 -0.986 49.5 -40.1 151.4-159.6 24.4 -10.4 -3.3 51 423 A L E -GI 44 63B 0 12,-2.5 12,-2.5 -2,-0.3 2,-0.3 -0.927 47.8-165.1-110.9 117.5 23.0 -7.1 -2.1 52 424 A G E +GI 43 62B 0 -9,-2.1 -9,-2.7 -2,-0.6 2,-0.3 -0.737 14.8 170.5 -98.7 146.4 20.5 -5.3 -4.3 53 425 A Y E -GI 42 61B 2 8,-2.8 8,-2.8 -2,-0.3 2,-0.4 -0.979 27.8-135.8-152.4 160.3 19.6 -1.7 -3.8 54 426 A Q E -GI 41 60B 18 -13,-2.6 -14,-2.6 -2,-0.3 -13,-1.2 -0.963 18.8-143.9-116.2 136.8 17.7 1.4 -5.2 55 427 A L E > -G 39 0B 1 4,-2.5 3,-2.0 -2,-0.4 -16,-0.2 -0.626 33.5-103.4 -90.6 163.8 19.2 4.9 -5.2 56 428 A C T 3 S+ 0 0 12 -18,-1.8 -17,-0.1 1,-0.3 -19,-0.1 0.641 119.3 62.9 -61.8 -17.7 16.9 7.9 -4.6 57 429 A D T 3 S- 0 0 28 -19,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.317 121.1-105.6 -88.5 6.6 16.9 8.8 -8.4 58 430 A N S < S+ 0 0 73 -3,-2.0 -2,-0.1 1,-0.3 2,-0.1 0.339 79.2 132.2 82.4 -2.0 15.3 5.4 -9.1 59 431 A S - 0 0 0 -5,-0.0 -4,-2.5 16,-0.0 -1,-0.3 -0.383 44.6-147.1 -68.0 157.1 18.4 3.7 -10.5 60 432 A V E -IJ 54 72B 5 12,-2.3 12,-2.6 -6,-0.2 2,-0.3 -0.900 17.2-179.9-127.1 158.7 19.1 0.2 -9.1 61 433 A G E -IJ 53 71B 0 -8,-2.8 -8,-2.8 -2,-0.3 2,-0.3 -0.961 13.5-151.6-150.2 167.2 22.3 -1.6 -8.3 62 434 A V E -IJ 52 70B 0 8,-1.7 8,-1.6 -2,-0.3 2,-0.8 -0.996 10.7-152.8-144.6 139.6 23.7 -4.8 -7.0 63 435 A L E -IJ 51 69B 14 -12,-2.5 -12,-2.5 -2,-0.3 6,-0.2 -0.938 34.0-148.2-108.4 102.4 26.9 -5.7 -5.2 64 436 A F E > -I 50 0B 11 4,-2.2 3,-2.3 -2,-0.8 -14,-0.3 -0.323 22.0-111.2 -72.4 155.8 27.3 -9.3 -6.3 65 437 A N T 3 S+ 0 0 90 -16,-2.7 -15,-0.1 1,-0.3 -1,-0.1 0.670 117.4 61.6 -59.4 -18.5 28.9 -12.1 -4.1 66 438 A D T 3 S- 0 0 69 -17,-0.3 -1,-0.3 2,-0.2 18,-0.1 0.278 119.7-108.9 -91.1 10.8 31.8 -12.2 -6.6 67 439 A S S < S+ 0 0 67 -3,-2.3 2,-0.3 1,-0.3 -2,-0.1 0.618 80.6 122.5 72.0 15.4 32.6 -8.6 -5.8 68 440 A T - 0 0 6 -4,-0.1 -4,-2.2 17,-0.1 2,-0.4 -0.732 48.2-149.4 -98.5 159.7 31.5 -7.2 -9.2 69 441 A R E -JK 63 82B 46 13,-2.6 13,-3.2 -2,-0.3 2,-0.4 -0.980 9.9-167.3-131.7 144.7 28.8 -4.5 -9.3 70 442 A L E -JK 62 81B 0 -8,-1.6 -8,-1.7 -2,-0.4 2,-0.4 -0.996 4.0-165.9-132.6 135.2 26.1 -3.7 -11.9 71 443 A I E -JK 61 80B 2 9,-2.3 9,-1.8 -2,-0.4 2,-0.5 -0.970 7.5-159.9-123.5 137.0 24.0 -0.5 -12.1 72 444 A L E -JK 60 79B 5 -12,-2.6 -12,-2.3 -2,-0.4 7,-0.2 -0.978 24.0-133.6-115.5 117.4 20.9 0.0 -14.1 73 445 A Y > - 0 0 40 5,-2.4 3,-2.2 -2,-0.5 4,-0.1 -0.195 27.2-100.9 -66.6 162.0 20.1 3.8 -14.7 74 446 A N T 3 S+ 0 0 77 1,-0.3 -1,-0.1 2,-0.1 -15,-0.0 0.492 116.4 72.7 -66.5 -2.3 16.6 5.2 -14.2 75 447 A D T 3 S- 0 0 55 3,-0.1 -1,-0.3 256,-0.0 257,-0.1 0.489 106.0-126.3 -87.6 -0.8 16.1 5.2 -18.0 76 448 A G S < S+ 0 0 29 -3,-2.2 -2,-0.1 2,-0.2 3,-0.0 0.515 93.3 56.1 75.0 9.1 15.7 1.4 -17.7 77 449 A D S S+ 0 0 42 -4,-0.1 16,-2.4 16,-0.1 17,-0.1 0.574 75.3 93.8-138.0 -36.4 18.3 0.6 -20.3 78 450 A S E - L 0 92B 41 14,-0.2 -5,-2.4 15,-0.1 2,-0.3 -0.409 54.4-165.8 -70.4 140.2 21.7 2.2 -19.5 79 451 A L E -KL 72 91B 4 12,-3.7 12,-1.8 -7,-0.2 2,-0.4 -0.935 20.2-164.9-128.2 150.6 24.2 0.1 -17.6 80 452 A Q E -KL 71 90B 3 -9,-1.8 -9,-2.3 -2,-0.3 2,-0.5 -0.981 15.1-166.1-130.1 118.8 27.4 0.6 -15.7 81 453 A Y E -KL 70 89B 29 8,-2.9 8,-2.7 -2,-0.4 2,-0.6 -0.921 2.1-165.0-107.7 129.4 29.4 -2.5 -14.9 82 454 A I E -KL 69 88B 2 -13,-3.2 -13,-2.6 -2,-0.5 6,-0.2 -0.965 11.1-151.3-117.6 115.2 32.2 -2.4 -12.4 83 455 A E > - 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