==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-FEB-09 3GEY . COMPND 2 MOLECULE: POLY [ADP-RIBOSE] POLYMERASE 15; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.KARLBERG,M.I.SIPONEN,C.H.ARROWSMITH,H.BERGLUND,C.BOUNTRA, . 770 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35793.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 523 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 181 23.5 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 78 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 138 17.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 4 0 0 4 0 0 0 0 0 0 4 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 7 5 0 4 5 3 0 8 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 . 1 0 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 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 1 460 A L 0 0 129 0, 0.0 49,-0.0 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 145.5 -42.9 23.0 -21.7 2 461 A P > - 0 0 22 0, 0.0 3,-0.9 0, 0.0 0, 0.0 -0.220 360.0-137.4 -54.2 141.1 -43.6 26.6 -22.8 3 462 A E T 3 S+ 0 0 188 1,-0.2 0, 0.0 0, 0.0 0, 0.0 0.798 100.0 62.4 -72.7 -29.8 -47.3 27.5 -22.5 4 463 A H T 3 S+ 0 0 73 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.496 83.0 101.8 -78.3 -4.6 -47.3 29.4 -25.8 5 464 A W S < S- 0 0 21 -3,-0.9 2,-0.2 1,-0.1 3,-0.1 -0.423 77.5-116.8 -68.9 155.8 -46.5 26.1 -27.6 6 465 A T - 0 0 64 1,-0.1 2,-0.1 -2,-0.1 -1,-0.1 -0.566 40.7 -78.8 -92.9 163.1 -49.4 24.3 -29.3 7 466 A D - 0 0 135 -2,-0.2 -1,-0.1 1,-0.1 0, 0.0 -0.370 37.2-166.2 -63.8 133.3 -50.7 20.9 -28.3 8 467 A M > - 0 0 27 3,-0.2 3,-1.5 -2,-0.1 5,-0.2 0.216 36.0-120.0-107.4 14.0 -48.4 18.2 -29.8 9 468 A N T 3 S- 0 0 129 1,-0.3 3,-0.1 3,-0.1 -2,-0.1 0.861 76.9 -50.8 50.1 43.2 -50.8 15.2 -29.2 10 469 A H T 3 S+ 0 0 185 1,-0.3 -1,-0.3 2,-0.0 2,-0.2 0.707 108.6 134.4 66.3 22.8 -48.2 13.5 -26.9 11 470 A Q < - 0 0 128 -3,-1.5 -1,-0.3 1,-0.1 -3,-0.2 -0.598 53.7-143.9 -93.3 163.2 -45.5 13.9 -29.6 12 471 A L S S+ 0 0 69 1,-0.2 38,-2.2 -2,-0.2 39,-0.6 0.510 79.2 32.9-107.2 -9.7 -42.1 15.2 -28.7 13 472 A F E +A 49 0A 46 36,-0.2 2,-0.3 -5,-0.2 -1,-0.2 -0.990 59.8 147.9-149.6 138.7 -41.4 17.2 -31.8 14 473 A C E -A 48 0A 31 34,-1.3 34,-2.3 -2,-0.3 2,-0.6 -0.939 37.4-126.9-165.3 149.3 -43.3 19.3 -34.3 15 474 A M E -A 47 0A 49 -2,-0.3 2,-0.7 32,-0.2 32,-0.2 -0.896 23.9-161.1 -99.7 121.7 -43.0 22.4 -36.5 16 475 A V E -A 46 0A 23 30,-2.6 30,-2.9 -2,-0.6 2,-0.1 -0.867 11.6-141.7-110.1 101.1 -45.8 24.9 -35.9 17 476 A Q E -A 45 0A 117 -2,-0.7 28,-0.3 28,-0.3 2,-0.1 -0.393 23.3-127.4 -63.1 130.8 -46.2 27.4 -38.8 18 477 A L - 0 0 11 26,-3.5 26,-0.3 -2,-0.1 -1,-0.1 -0.383 11.1-120.3 -83.0 157.7 -46.9 30.9 -37.5 19 478 A E > - 0 0 118 -2,-0.1 3,-1.4 24,-0.1 6,-0.5 -0.874 28.1-126.0 -99.8 120.6 -49.8 33.1 -38.5 20 479 A P T 3 S+ 0 0 77 0, 0.0 3,-0.1 0, 0.0 4,-0.0 -0.354 93.8 36.3 -66.0 144.0 -48.8 36.5 -40.0 21 480 A G T 3 S+ 0 0 63 1,-0.4 2,-0.2 2,-0.1 -2,-0.0 0.142 93.2 113.0 97.0 -17.9 -50.3 39.6 -38.4 22 481 A Q S <> S- 0 0 113 -3,-1.4 4,-2.6 1,-0.1 -1,-0.4 -0.611 80.4-114.0 -89.6 150.8 -50.1 37.9 -35.0 23 482 A S H > S+ 0 0 99 1,-0.2 4,-2.7 -2,-0.2 5,-0.2 0.846 114.1 51.7 -51.8 -41.8 -47.7 39.3 -32.3 24 483 A E H > S+ 0 0 54 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.932 113.0 43.3 -63.8 -48.1 -45.5 36.2 -32.3 25 484 A Y H > S+ 0 0 17 -6,-0.5 4,-2.0 -3,-0.2 -2,-0.2 0.911 117.0 47.5 -62.2 -43.7 -45.0 36.2 -36.1 26 485 A N H X S+ 0 0 50 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.860 105.5 56.9 -70.5 -38.5 -44.5 40.0 -36.2 27 486 A T H X S+ 0 0 57 -4,-2.7 4,-1.4 -5,-0.3 -1,-0.2 0.915 112.7 42.1 -58.6 -44.1 -42.0 40.1 -33.3 28 487 A I H X S+ 0 0 7 -4,-1.5 4,-1.2 -5,-0.2 -1,-0.2 0.868 113.2 53.2 -70.8 -38.0 -39.8 37.6 -35.1 29 488 A K H X S+ 0 0 81 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.883 107.5 52.9 -62.6 -38.4 -40.3 39.4 -38.4 30 489 A D H X S+ 0 0 91 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.857 106.8 50.4 -66.8 -37.4 -39.3 42.7 -36.8 31 490 A K H < S+ 0 0 58 -4,-1.4 77,-0.5 -5,-0.2 -1,-0.2 0.765 115.7 44.7 -72.2 -25.1 -36.0 41.2 -35.5 32 491 A F H >X S+ 0 0 0 -4,-1.2 3,-1.6 2,-0.1 4,-1.5 0.927 113.4 45.5 -82.0 -53.0 -35.2 39.9 -39.0 33 492 A T H 3X S+ 0 0 37 -4,-2.9 4,-0.8 1,-0.3 -2,-0.2 0.735 90.6 86.4 -65.4 -22.9 -36.2 42.9 -41.1 34 493 A R H 3< S+ 0 0 174 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.1 0.774 119.8 3.9 -47.6 -28.6 -34.3 45.1 -38.6 35 494 A T H <4 S+ 0 0 51 -3,-1.6 -1,-0.3 -4,-0.1 -2,-0.2 0.358 137.8 53.3-135.4 -5.3 -31.3 44.3 -40.8 36 495 A C H >< + 0 0 2 -4,-1.5 3,-1.4 1,-0.1 -2,-0.2 -0.255 57.3 136.3-127.0 45.4 -32.9 42.2 -43.6 37 496 A S T 3< + 0 0 101 -4,-0.8 -4,-0.1 1,-0.2 -1,-0.1 0.644 69.4 63.2 -67.5 -13.7 -35.7 44.6 -44.8 38 497 A S T 3 S+ 0 0 97 -3,-0.1 -1,-0.2 -5,-0.1 2,-0.2 0.579 90.3 80.0 -89.2 -12.1 -34.8 43.7 -48.4 39 498 A Y S < S- 0 0 67 -3,-1.4 2,-0.6 151,-0.1 151,-0.2 -0.633 76.6-128.6 -95.7 155.5 -35.7 40.0 -48.1 40 499 A A E - B 0 189A 49 149,-1.7 149,-2.2 -2,-0.2 2,-0.5 -0.908 16.2-136.0-110.4 115.0 -39.2 38.6 -48.3 41 500 A I E - B 0 188A 28 -2,-0.6 147,-0.3 147,-0.2 3,-0.1 -0.531 18.7-176.3 -70.3 116.9 -40.3 36.2 -45.5 42 501 A E E - 0 0 79 145,-2.3 2,-0.3 -2,-0.5 146,-0.2 0.849 66.2 -26.7 -81.8 -38.0 -42.1 33.2 -46.9 43 502 A K E - B 0 187A 54 144,-1.9 144,-2.5 -24,-0.0 2,-0.4 -0.961 48.4-138.8-170.2 159.5 -43.0 31.7 -43.5 44 503 A I E - B 0 186A 0 -26,-0.3 -26,-3.5 -2,-0.3 2,-0.5 -0.994 20.0-165.8-127.9 125.6 -42.0 31.5 -39.9 45 504 A E E -AB 17 185A 27 140,-2.1 140,-2.3 -2,-0.4 2,-0.6 -0.945 16.6-137.3-118.3 127.9 -42.2 28.2 -37.9 46 505 A R E -AB 16 184A 8 -30,-2.9 -30,-2.6 -2,-0.5 2,-0.7 -0.704 22.0-139.1 -79.5 120.7 -42.0 27.7 -34.2 47 506 A I E -A 15 0A 0 136,-3.1 2,-0.8 -2,-0.6 -32,-0.2 -0.736 16.7-169.3 -84.9 115.8 -39.8 24.7 -33.4 48 507 A Q E +A 14 0A 0 -34,-2.3 -34,-1.3 -2,-0.7 2,-0.7 -0.777 17.9 160.6-108.9 87.5 -41.3 22.6 -30.6 49 508 A N E > -A 13 0A 5 -2,-0.8 4,-2.7 -36,-0.2 5,-0.3 -0.850 18.9-171.9-110.8 94.5 -38.6 20.1 -29.6 50 509 A A H > S+ 0 0 6 -38,-2.2 4,-1.9 -2,-0.7 -1,-0.2 0.850 86.1 47.3 -51.6 -39.9 -39.4 18.8 -26.1 51 510 A F H > S+ 0 0 30 -39,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.934 113.6 43.5 -73.3 -49.4 -36.1 17.0 -25.9 52 511 A L H > S+ 0 0 35 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.892 114.7 52.8 -59.9 -41.9 -33.8 19.8 -27.0 53 512 A W H X S+ 0 0 37 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.918 107.1 51.5 -61.9 -45.1 -35.7 22.2 -24.9 54 513 A Q H X S+ 0 0 66 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.935 113.0 43.7 -57.3 -51.5 -35.3 20.0 -21.8 55 514 A S H X S+ 0 0 7 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.871 114.9 50.5 -63.5 -38.9 -31.5 19.7 -22.2 56 515 A Y H X S+ 0 0 2 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.897 110.6 47.3 -66.3 -44.0 -31.2 23.4 -23.0 57 516 A Q H X S+ 0 0 40 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.891 110.3 52.7 -68.7 -39.6 -33.2 24.5 -19.9 58 517 A V H X S+ 0 0 13 -4,-2.2 4,-1.6 -5,-0.2 -1,-0.2 0.923 111.7 47.7 -54.0 -45.7 -31.2 22.2 -17.7 59 518 A K H X S+ 0 0 49 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.860 110.1 52.7 -63.9 -37.6 -28.1 23.8 -19.2 60 519 A K H X S+ 0 0 48 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.914 108.3 47.8 -67.9 -45.9 -29.6 27.3 -18.6 61 520 A R H X S+ 0 0 156 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.847 110.4 53.4 -64.9 -34.1 -30.4 26.8 -14.9 62 521 A Q H X S+ 0 0 7 -4,-1.6 4,-1.6 -5,-0.2 -1,-0.2 0.872 111.3 46.4 -66.3 -36.9 -26.9 25.4 -14.4 63 522 A M H X S+ 0 0 0 -4,-1.5 4,-1.2 2,-0.2 -2,-0.2 0.859 110.6 50.6 -75.7 -38.6 -25.4 28.5 -16.0 64 523 A D H < S+ 0 0 70 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.883 115.4 45.5 -62.0 -38.6 -27.6 31.0 -14.0 65 524 A I H < S+ 0 0 115 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.833 111.7 50.7 -73.2 -34.8 -26.4 29.1 -10.9 66 525 A K H < 0 0 72 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.658 360.0 360.0 -82.7 -17.1 -22.8 29.0 -11.9 67 526 A N < 0 0 76 -4,-1.2 3,-0.0 -5,-0.1 68,-0.0 -0.841 360.0 360.0-110.9 360.0 -22.6 32.7 -12.6 68 ! 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 69 530 A N 0 0 201 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 74.1 -28.1 37.3 -18.1 70 531 A N + 0 0 13 64,-0.1 65,-2.5 -3,-0.0 64,-0.7 0.576 360.0 83.3-113.1 -16.2 -26.8 34.2 -19.9 71 532 A E E +C 133 0A 60 62,-0.2 2,-0.4 63,-0.2 62,-0.2 -0.743 49.6 179.5-100.5 135.0 -29.2 33.9 -22.8 72 533 A R E -C 132 0A 93 60,-2.7 60,-3.0 -2,-0.4 2,-0.8 -0.982 28.3-129.5-128.6 145.5 -29.1 35.8 -26.1 73 534 A L E +C 131 0A 57 -2,-0.4 58,-0.2 58,-0.2 2,-0.2 -0.843 45.5 163.5 -92.6 110.3 -31.4 35.7 -29.1 74 535 A L E -C 130 0A 6 56,-3.2 56,-3.0 -2,-0.8 2,-0.3 -0.590 31.3-110.9-121.5-178.3 -29.1 35.1 -32.1 75 536 A F E -CD 129 105A 13 30,-2.5 30,-2.4 54,-0.2 2,-0.3 -0.890 19.0-174.4-120.0 147.9 -29.3 34.0 -35.7 76 537 A H E -C 128 0A 18 52,-2.0 52,-3.3 -2,-0.3 2,-0.4 -0.854 6.3-164.6-142.9 109.4 -28.1 31.0 -37.7 77 538 A G E +C 127 0A 0 -2,-0.3 2,-0.3 50,-0.3 50,-0.3 -0.763 19.8 167.0 -90.3 131.1 -28.4 30.6 -41.5 78 539 A T E -C 126 0A 9 48,-1.9 48,-0.6 -2,-0.4 38,-0.1 -0.905 37.4 -92.3-136.5 166.1 -27.9 27.1 -42.9 79 540 A D > - 0 0 47 -2,-0.3 3,-0.6 38,-0.2 4,-0.4 -0.198 43.2-105.4 -69.1 170.2 -28.4 25.2 -46.1 80 541 A A G > S+ 0 0 27 38,-0.4 3,-0.9 1,-0.2 -1,-0.1 0.838 116.2 60.1 -67.1 -33.6 -31.7 23.4 -46.8 81 542 A D G 3 S+ 0 0 134 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.727 102.4 51.4 -70.8 -23.3 -30.1 19.9 -46.2 82 543 A S G <> S+ 0 0 42 -3,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.577 89.3 84.6 -88.9 -11.5 -29.1 20.7 -42.6 83 544 A V H <> S+ 0 0 16 -3,-0.9 4,-2.6 -4,-0.4 5,-0.2 0.907 86.4 49.9 -60.7 -48.0 -32.6 21.9 -41.7 84 545 A P H > S+ 0 0 61 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.924 114.0 46.0 -58.6 -45.1 -34.1 18.5 -40.9 85 546 A Y H >>S+ 0 0 34 -4,-0.4 4,-4.0 1,-0.2 5,-0.7 0.935 112.6 49.6 -62.0 -47.5 -31.2 17.6 -38.6 86 547 A V H X5S+ 0 0 8 -4,-2.5 4,-1.4 3,-0.2 -1,-0.2 0.893 107.6 54.3 -61.4 -42.4 -31.2 21.0 -36.8 87 548 A N H <5S+ 0 0 16 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.909 122.0 30.2 -53.7 -45.6 -35.0 20.8 -36.2 88 549 A Q H <5S+ 0 0 65 -4,-1.7 -2,-0.2 -5,-0.2 -36,-0.2 0.924 138.5 15.7 -80.7 -50.1 -34.5 17.4 -34.5 89 550 A H H <5S- 0 0 66 -4,-4.0 -3,-0.2 1,-0.3 2,-0.2 0.542 91.3-140.6-113.2 -11.6 -31.0 17.5 -33.0 90 551 A G << - 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