==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOPOISOMERASE 29-JUN-98 1BJT . COMPND 2 MOLECULE: TOPOISOMERASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR D.FASS,C.E.BOGDEN,J.M.BERGER . 678 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36049.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 468 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 35 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 237 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 4 0 0 0 0 1 3 1 4 1 2 0 0 0 0 0 0 1 1 0 0 0 1 0 0 0 1 RESIDUES PER ALPHA HELIX . 2 0 1 0 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 PARALLEL BRIDGES PER LADDER . 3 2 2 5 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 ANTIPARALLEL BRIDGES PER LADDER . 2 5 1 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 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 1 419 A R 0 0 284 0, 0.0 3,-0.1 0, 0.0 18,-0.1 0.000 360.0 360.0 360.0 26.3 -3.8 2.4 62.3 2 420 A K - 0 0 38 1,-0.1 2,-0.5 13,-0.1 17,-0.2 0.421 360.0-138.2 -7.6 99.7 -6.6 4.9 62.7 3 421 A S - 0 0 55 15,-1.3 2,-0.4 91,-0.0 -1,-0.1 -0.684 29.0-142.4 -70.8 120.4 -6.2 6.6 66.1 4 422 A R - 0 0 175 -2,-0.5 2,-0.7 -3,-0.1 14,-0.1 -0.758 9.9-141.5 -98.2 137.5 -9.8 6.7 67.3 5 423 A I + 0 0 32 -2,-0.4 3,-0.2 1,-0.1 8,-0.1 -0.843 27.4 166.3 -94.9 113.1 -11.5 9.5 69.3 6 424 A T + 0 0 129 -2,-0.7 -1,-0.1 1,-0.1 -2,-0.0 0.664 63.2 63.7-101.2 -19.7 -13.8 7.9 71.9 7 425 A N S S+ 0 0 81 1,-0.2 -1,-0.1 2,-0.0 -2,-0.0 0.310 89.3 70.1 -91.9 10.5 -14.6 10.8 74.2 8 426 A Y > + 0 0 44 -3,-0.2 3,-1.4 1,-0.1 -1,-0.2 -0.769 50.3 176.4-134.3 91.0 -16.5 13.1 71.7 9 427 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.688 80.5 59.4 -59.3 -33.9 -20.0 11.8 70.6 10 428 A K T 3 S+ 0 0 144 45,-0.1 2,-0.3 2,-0.0 -2,-0.0 0.518 85.5 103.9 -79.0 -5.5 -20.8 14.9 68.5 11 429 A L < - 0 0 21 -3,-1.4 2,-0.7 43,-0.1 43,-0.2 -0.615 53.3-165.4 -82.8 131.5 -17.7 14.3 66.4 12 430 A E B -A 53 0A 82 41,-2.6 41,-1.9 -2,-0.3 3,-0.1 -0.838 27.2-151.4-114.0 81.8 -18.1 12.8 62.9 13 431 A D - 0 0 27 -2,-0.7 2,-0.1 39,-0.2 39,-0.1 -0.322 18.8-107.7 -58.8 133.6 -14.5 11.9 62.4 14 432 A A > - 0 0 0 1,-0.1 3,-2.3 36,-0.1 35,-0.2 -0.461 29.6-123.9 -62.9 132.5 -13.1 11.8 58.9 15 433 A N T 3 S+ 0 0 88 33,-2.5 34,-0.2 1,-0.3 -1,-0.1 0.830 110.4 42.4 -47.6 -39.7 -12.6 8.2 58.0 16 434 A K T > S+ 0 0 61 33,-2.1 3,-1.0 32,-0.3 2,-0.3 0.207 86.5 115.4 -96.3 14.2 -9.0 8.8 57.2 17 435 A A T < S+ 0 0 0 -3,-2.3 78,-0.2 1,-0.2 77,-0.1 -0.644 78.9 24.0 -81.9 140.2 -8.2 11.1 60.1 18 436 A G T 3 S+ 0 0 15 76,-1.4 -15,-1.3 1,-0.3 -1,-0.2 0.450 108.1 96.0 85.0 -1.2 -5.7 9.5 62.5 19 437 A T S X S- 0 0 42 -3,-1.0 3,-0.9 75,-0.3 -1,-0.3 -0.183 100.4 -79.7-101.5-161.0 -4.3 7.3 59.8 20 438 A K G > S+ 0 0 194 1,-0.2 3,-0.6 2,-0.1 -2,-0.1 0.871 131.3 52.0 -71.8 -36.4 -1.2 7.9 57.5 21 439 A E G >> S+ 0 0 52 1,-0.2 3,-2.1 2,-0.1 4,-0.8 0.183 73.2 112.9 -85.6 16.9 -3.3 10.3 55.3 22 440 A G G X4 + 0 0 0 -3,-0.9 74,-1.0 1,-0.3 3,-0.8 0.829 68.0 65.3 -59.0 -30.1 -4.5 12.4 58.3 23 441 A Y G <4 S+ 0 0 60 -3,-0.6 -1,-0.3 72,-0.3 -2,-0.1 0.656 100.9 52.2 -66.7 -15.4 -2.4 15.3 56.9 24 442 A K G <4 S+ 0 0 57 -3,-2.1 -1,-0.3 -8,-0.2 -2,-0.2 0.669 93.7 93.4 -90.6 -24.6 -4.8 15.2 53.9 25 443 A C << - 0 0 0 -3,-0.8 71,-1.9 -4,-0.8 72,-1.5 -0.293 63.3-145.5 -71.7 157.5 -8.0 15.4 56.1 26 444 A T E -bc 51 97A 0 24,-1.9 26,-3.1 70,-0.2 2,-0.6 -0.987 1.6-148.8-128.6 132.1 -9.8 18.5 57.1 27 445 A L E -bc 52 98A 0 70,-2.3 72,-3.2 -2,-0.4 2,-0.7 -0.884 9.1-156.2-102.8 123.2 -11.6 19.3 60.4 28 446 A V E -bc 53 99A 0 24,-2.1 26,-2.4 -2,-0.6 2,-0.5 -0.845 5.1-162.9-103.1 107.4 -14.6 21.6 60.2 29 447 A L E -bc 54 100A 1 70,-3.1 72,-2.3 -2,-0.7 2,-0.3 -0.762 13.2-159.2 -86.6 131.0 -15.4 23.3 63.5 30 448 A T E -bc 55 101A 2 24,-2.2 27,-1.8 -2,-0.5 26,-1.4 -0.840 13.5-161.5-116.1 151.3 -18.9 24.7 63.6 31 449 A E E +bc 57 102A 21 70,-1.7 72,-1.0 -2,-0.3 4,-0.4 -0.976 62.1 5.9-130.7 116.2 -20.6 27.4 65.7 32 450 A G S > S- 0 0 11 25,-1.6 4,-1.2 -2,-0.4 27,-0.2 0.042 86.9 -84.2 94.1 153.6 -24.3 27.6 66.0 33 451 A D H > S+ 0 0 100 25,-0.6 4,-1.7 1,-0.2 3,-0.3 0.886 126.2 51.7 -61.2 -41.5 -27.1 25.3 64.7 34 452 A S H > S+ 0 0 76 1,-0.2 4,-1.6 69,-0.2 -1,-0.2 0.822 105.7 54.3 -67.8 -32.6 -27.2 26.9 61.2 35 453 A A H > S+ 0 0 0 -4,-0.4 4,-2.0 68,-0.2 -1,-0.2 0.781 106.3 53.8 -70.7 -29.1 -23.4 26.5 60.7 36 454 A L H X S+ 0 0 53 -4,-1.2 4,-2.4 -3,-0.3 -2,-0.2 0.926 107.1 50.1 -70.1 -44.5 -23.7 22.8 61.5 37 455 A S H X S+ 0 0 81 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.868 112.9 47.3 -60.7 -39.7 -26.4 22.4 58.8 38 456 A L H X S+ 0 0 15 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.905 109.0 52.0 -70.4 -42.7 -24.2 24.2 56.3 39 457 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.946 113.2 46.5 -57.3 -47.4 -21.1 22.2 57.1 40 458 A V H X S+ 0 0 58 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.883 109.1 54.9 -61.3 -41.1 -23.1 19.0 56.6 41 459 A A H < S+ 0 0 18 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.906 112.0 43.7 -60.1 -41.8 -24.5 20.4 53.4 42 460 A G H >X S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.2 4,-1.5 0.878 109.6 56.0 -70.6 -38.8 -21.0 20.9 52.1 43 461 A L H 3X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.728 93.6 69.0 -65.8 -22.8 -19.9 17.6 53.3 44 462 A A H 3< S+ 0 0 84 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.718 105.6 43.4 -67.7 -18.6 -22.6 15.9 51.3 45 463 A V H <4 S+ 0 0 68 -3,-1.5 -2,-0.2 -4,-0.3 -1,-0.2 0.889 122.2 32.5 -91.3 -48.8 -20.6 17.0 48.3 46 464 A V H < S- 0 0 25 -4,-1.5 4,-0.3 1,-0.2 3,-0.2 0.677 103.0-131.4 -86.5 -20.9 -17.0 16.1 49.3 47 465 A G < - 0 0 28 -4,-2.4 3,-0.2 -5,-0.2 -1,-0.2 -0.101 20.0 -87.1 91.9 168.4 -17.7 13.1 51.4 48 466 A R S S+ 0 0 88 1,-0.2 -33,-2.5 2,-0.1 -32,-0.3 0.292 101.8 89.0 -99.0 7.2 -16.5 11.9 54.9 49 467 A D S S+ 0 0 73 -3,-0.2 -33,-2.1 -35,-0.2 -1,-0.2 0.928 107.8 14.1 -70.1 -46.2 -13.3 10.2 53.8 50 468 A Y S S+ 0 0 45 -4,-0.3 -24,-1.9 -3,-0.2 2,-0.4 0.124 120.0 73.0-116.6 18.2 -11.1 13.4 54.0 51 469 A Y E - b 0 26A 3 -26,-0.2 2,-0.3 -38,-0.1 -36,-0.3 -0.997 53.7-170.8-139.4 131.6 -13.4 15.6 56.1 52 470 A G E - b 0 27A 0 -26,-3.1 -24,-2.1 -2,-0.4 2,-0.4 -0.795 9.7-153.0-113.1 162.1 -14.4 15.5 59.7 53 471 A C E +Ab 12 28A 1 -41,-1.9 -41,-2.6 -2,-0.3 -24,-0.2 -0.993 14.9 171.7-142.2 132.4 -17.1 17.6 61.4 54 472 A Y E - b 0 29A 29 -26,-2.4 -24,-2.2 -2,-0.4 2,-1.1 -0.972 31.3-132.6-146.0 126.7 -17.5 18.8 65.0 55 473 A P E + b 0 30A 21 0, 0.0 -24,-0.1 0, 0.0 3,-0.1 -0.645 24.8 178.7 -76.0 96.4 -20.0 21.2 66.7 56 474 A L E S+ 0 0 16 -26,-1.4 2,-0.3 -2,-1.1 -25,-0.2 0.928 74.5 10.6 -64.5 -45.1 -17.6 23.4 68.8 57 475 A R E - b 0 31A 57 -27,-1.8 -25,-1.6 -3,-0.2 -1,-0.2 -0.968 64.1-161.7-133.9 149.2 -20.6 25.5 70.0 58 476 A G - 0 0 40 1,-0.3 -25,-0.6 -2,-0.3 2,-0.3 0.919 64.1 -26.8 -96.1 -62.9 -24.3 24.9 69.6 59 477 A K - 0 0 159 -27,-0.2 2,-0.5 -26,-0.1 -1,-0.3 -0.957 54.9-135.5-155.7 146.5 -26.4 28.1 70.1 60 478 A M + 0 0 88 -2,-0.3 4,-0.1 1,-0.2 -3,-0.0 -0.938 23.8 169.5-116.2 121.2 -25.7 31.2 72.2 61 479 A L + 0 0 155 -2,-0.5 -1,-0.2 2,-0.1 0, 0.0 0.832 65.1 72.1 -91.5 -40.1 -28.3 32.7 74.4 62 480 A N S S- 0 0 117 1,-0.1 2,-0.3 0, 0.0 -2,-0.0 -0.054 91.9 -93.0 -67.3 174.3 -26.0 35.2 76.1 63 481 A V - 0 0 104 1,-0.1 2,-0.6 0, 0.0 -1,-0.1 -0.704 34.6-102.8-101.0 148.6 -24.6 38.3 74.4 64 482 A R 0 0 167 -2,-0.3 -1,-0.1 -4,-0.1 -4,-0.0 -0.508 360.0 360.0 -69.6 109.7 -21.3 38.8 72.5 65 483 A E 0 0 215 -2,-0.6 -1,-0.0 0, 0.0 0, 0.0 -0.680 360.0 360.0 -93.5 360.0 -18.5 40.6 74.4 66 ! 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 67 490 A L 0 0 64 0, 0.0 2,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 125.5 -12.2 30.1 74.8 68 491 A K >> - 0 0 150 1,-0.1 4,-1.4 2,-0.0 3,-0.9 -0.505 360.0-128.0 -67.6 140.4 -13.7 27.6 77.3 69 492 A N H 3> S+ 0 0 101 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.852 109.3 63.5 -62.1 -29.2 -10.9 25.0 78.2 70 493 A A H 3> S+ 0 0 74 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.871 103.8 49.1 -61.3 -32.2 -13.3 22.2 77.3 71 494 A E H <> S+ 0 0 15 -3,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.847 108.0 53.3 -74.1 -35.9 -13.3 23.6 73.8 72 495 A I H X S+ 0 0 34 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.897 110.5 47.0 -66.0 -40.3 -9.5 23.7 73.8 73 496 A Q H X S+ 0 0 82 -4,-2.5 4,-3.4 2,-0.2 5,-0.3 0.892 110.2 53.3 -68.2 -40.6 -9.3 20.0 74.8 74 497 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 5,-0.3 0.974 111.6 44.8 -58.2 -54.2 -11.9 19.1 72.1 75 498 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 6,-0.3 0.908 117.5 45.6 -57.7 -43.2 -9.8 20.8 69.4 76 499 A K H X>S+ 0 0 41 -4,-2.3 4,-2.2 2,-0.2 5,-1.7 0.939 113.2 47.5 -67.0 -49.1 -6.6 19.3 70.7 77 500 A K H <5S+ 0 0 111 -4,-3.4 -2,-0.2 3,-0.2 -1,-0.2 0.941 118.3 41.3 -57.6 -50.2 -7.9 15.8 71.2 78 501 A I H <5S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.895 120.0 43.0 -66.7 -42.8 -9.5 15.7 67.7 79 502 A M H <5S- 0 0 1 -4,-2.5 15,-2.0 -5,-0.3 16,-0.8 0.709 109.1-122.0 -76.6 -21.1 -6.6 17.4 66.0 80 503 A G T <5 + 0 0 20 -4,-2.2 2,-0.6 1,-0.3 -3,-0.2 0.684 50.5 165.2 85.6 18.0 -4.1 15.3 67.8 81 504 A L < + 0 0 6 -5,-1.7 -1,-0.3 -6,-0.3 -2,-0.1 -0.633 9.3 178.2 -73.8 114.3 -2.4 18.4 69.3 82 505 A Q - 0 0 147 -2,-0.6 2,-0.3 1,-0.2 -1,-0.2 0.973 45.2 -13.2 -83.1 -69.5 -0.2 17.1 72.1 83 506 A H S S- 0 0 92 35,-0.0 2,-0.5 0, 0.0 -1,-0.2 -0.851 85.8 -64.0-138.5 168.7 1.8 19.7 73.9 84 507 A R S S+ 0 0 203 -2,-0.3 2,-0.3 -3,-0.1 35,-0.2 -0.424 77.5 149.9 -55.3 111.0 3.1 23.3 73.7 85 508 A K B -e 119 0B 86 33,-1.4 2,-0.8 -2,-0.5 35,-0.6 -0.981 55.5-114.8-151.0 155.9 5.2 23.0 70.5 86 509 A K - 0 0 127 -2,-0.3 2,-0.2 33,-0.2 33,-0.1 -0.856 40.3-151.9 -92.7 107.9 6.5 24.9 67.5 87 510 A Y + 0 0 10 -2,-0.8 34,-0.1 1,-0.1 37,-0.1 -0.581 31.1 163.7 -84.7 145.7 4.9 23.1 64.5 88 511 A E S S+ 0 0 146 1,-0.5 2,-0.3 -2,-0.2 -1,-0.1 0.507 72.4 22.4-128.4 -29.2 6.5 23.1 61.1 89 512 A D - 0 0 79 36,-0.1 -1,-0.5 0, 0.0 3,-0.3 -0.912 64.1-135.7-137.0 160.2 4.5 20.3 59.5 90 513 A T S S+ 0 0 8 -2,-0.3 3,-0.1 1,-0.2 -3,-0.0 -0.265 74.7 108.6-110.1 43.3 1.1 18.7 60.1 91 514 A K S S+ 0 0 121 1,-0.2 -1,-0.2 -69,-0.1 -68,-0.1 0.686 75.3 52.1 -91.0 -20.5 2.4 15.2 59.7 92 515 A S S S+ 0 0 77 -3,-0.3 2,-0.3 -70,-0.1 -1,-0.2 0.353 97.3 89.7 -96.3 4.1 2.0 14.4 63.4 93 516 A L S S- 0 0 10 -3,-0.1 -13,-0.2 1,-0.1 -75,-0.2 -0.685 78.6-129.7-102.0 157.8 -1.6 15.5 63.5 94 517 A R S S+ 0 0 15 -15,-2.0 -76,-1.4 -2,-0.3 2,-0.3 0.765 98.1 34.8 -71.9 -30.0 -4.8 13.6 62.9 95 518 A Y - 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