==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE/LYASE INHIBITOR 11-FEB-09 3G82 . COMPND 2 MOLECULE: ADENYLATE CYCLASE TYPE 5; . SOURCE 2 ORGANISM_SCIENTIFIC: CANIS LUPUS FAMILIARIS; . AUTHOR M.HUEBNER,T.-C.MOU,S.R.SPRANG,R.SEIFERT . 708 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32539.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 502 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 13.6 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 0.1 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-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 . 43 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 229 32.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.3 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 3 3 1 1 0 1 2 2 2 1 0 1 0 1 1 0 0 1 0 2 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 0 2 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 PARALLEL BRIDGES PER LADDER . 3 1 3 0 1 3 0 2 1 0 0 0 0 1 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 1 2 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 1 377 A M 0 0 203 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -50.0 29.0 -26.8 -37.6 2 378 A M + 0 0 42 603,-0.1 604,-0.1 2,-0.1 2,-0.1 0.995 360.0 19.9 -68.3 -69.8 29.7 -23.1 -38.5 3 379 A F S S- 0 0 11 1,-0.2 2,-0.2 602,-0.1 223,-0.1 -0.260 98.9 -95.4 -78.1 178.7 32.0 -22.1 -35.6 4 380 A H - 0 0 69 221,-0.2 2,-0.7 -2,-0.1 -1,-0.2 -0.515 55.3 -81.5 -82.8 167.2 33.9 -24.6 -33.5 5 381 A K - 0 0 151 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.1 -0.649 44.2-139.1 -72.2 113.7 32.2 -25.7 -30.3 6 382 A I - 0 0 32 -2,-0.7 2,-0.3 1,-0.1 115,-0.1 -0.652 7.9-158.7 -69.5 121.4 33.0 -23.0 -27.7 7 383 A Y E +A 120 0A 112 113,-0.7 113,-0.7 -2,-0.5 2,-0.3 -0.316 59.1 108.0 -95.6 49.2 33.8 -24.8 -24.4 8 384 A I E +A 119 0A 15 -2,-0.3 2,-0.3 111,-0.2 111,-0.2 -0.830 42.5 177.6-123.7 160.3 33.0 -21.6 -22.5 9 385 A Q E -A 118 0A 120 109,-1.1 109,-2.0 -2,-0.3 2,-0.2 -0.977 30.1-104.7-160.6 150.4 30.1 -20.5 -20.3 10 386 A K E -A 117 0A 84 -2,-0.3 2,-0.3 107,-0.2 107,-0.2 -0.523 29.6-174.1 -78.0 146.8 29.0 -17.5 -18.2 11 387 A H E -A 116 0A 41 105,-2.5 105,-2.7 -2,-0.2 3,-0.2 -0.964 5.3-161.8-140.1 126.5 29.3 -17.5 -14.4 12 388 A D E + 0 0 82 -2,-0.3 103,-0.2 103,-0.2 102,-0.1 -0.410 65.6 32.5 -93.4 175.5 27.9 -14.7 -12.1 13 389 A N E S+ 0 0 84 1,-0.2 63,-0.4 -2,-0.1 2,-0.3 0.857 85.2 138.5 44.0 55.1 28.7 -13.8 -8.5 14 390 A V E -A 114 0A 2 100,-2.7 100,-2.5 -3,-0.2 2,-0.4 -0.843 46.1-135.0-126.5 163.6 32.4 -15.0 -8.6 15 391 A S E -AB 113 70A 0 55,-1.9 55,-1.8 98,-0.3 2,-0.5 -0.979 11.2-155.7-127.2 126.9 35.7 -13.6 -7.2 16 392 A I E -AB 112 69A 0 96,-3.5 96,-2.2 -2,-0.4 2,-0.4 -0.889 8.6-161.9-108.4 123.8 39.0 -13.5 -9.2 17 393 A L E +AB 111 68A 0 51,-2.3 51,-0.7 -2,-0.5 2,-0.3 -0.900 9.0 179.7-111.6 130.0 42.3 -13.5 -7.3 18 394 A F E +AB 110 67A 17 92,-2.8 92,-2.8 -2,-0.4 2,-0.3 -0.942 2.7 172.7-126.0 145.8 45.7 -12.3 -8.8 19 395 A A E -AB 109 66A 0 47,-1.7 47,-2.7 -2,-0.3 2,-0.3 -0.933 5.2-174.3-158.4 132.6 49.1 -12.2 -7.2 20 396 A D E -AB 108 65A 28 88,-1.2 88,-1.1 -2,-0.3 2,-0.4 -0.861 34.5 -96.7-126.7 155.9 52.6 -11.5 -8.6 21 397 A I E > -A 107 0A 10 43,-0.9 3,-0.7 -2,-0.3 2,-0.6 -0.611 33.4-135.0 -74.5 124.1 56.2 -11.6 -7.2 22 398 A E E 3 S+A 106 0A 82 84,-3.7 84,-0.7 -2,-0.4 -1,-0.0 -0.723 88.3 0.7 -75.4 120.3 57.4 -8.2 -6.0 23 399 A G T 3> S+ 0 0 37 -2,-0.6 4,-1.0 82,-0.1 -1,-0.2 0.919 78.7 149.0 66.8 48.1 61.0 -7.7 -7.3 24 400 A F H <> S+ 0 0 47 -3,-0.7 4,-3.0 2,-0.2 5,-0.1 0.868 73.9 50.3 -73.8 -41.4 61.3 -11.0 -9.2 25 401 A T H 4 S+ 0 0 53 2,-0.2 -1,-0.1 1,-0.2 -3,-0.0 0.847 109.3 51.9 -68.2 -35.4 63.7 -9.5 -11.8 26 402 A S H >4 S+ 0 0 68 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.857 114.5 43.9 -63.8 -38.1 65.8 -8.1 -9.0 27 403 A L H >X S+ 0 0 13 -4,-1.0 3,-2.1 1,-0.2 4,-1.0 0.875 100.2 68.4 -74.3 -39.3 65.9 -11.6 -7.5 28 404 A A T 3< S+ 0 0 43 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.430 90.6 68.6 -62.0 3.0 66.5 -13.2 -10.9 29 405 A S T <4 S+ 0 0 91 -3,-0.7 -1,-0.3 -5,-0.1 -2,-0.2 0.723 103.7 37.2 -91.5 -27.8 70.0 -11.6 -10.7 30 406 A Q T <4 S+ 0 0 117 -3,-2.1 -2,-0.2 -4,-0.2 -3,-0.1 0.947 105.3 57.8 -92.1 -62.9 71.4 -13.6 -7.8 31 407 A C S < S- 0 0 23 -4,-1.0 5,-0.0 1,-0.1 70,-0.0 -0.269 87.3 -98.3 -77.6 157.3 70.2 -17.2 -8.1 32 408 A T >> - 0 0 90 1,-0.1 4,-1.5 -2,-0.0 3,-0.6 -0.303 37.2-106.3 -68.6 156.7 70.7 -19.6 -11.0 33 409 A A H 3> S+ 0 0 50 1,-0.3 4,-1.4 2,-0.2 3,-0.2 0.872 122.7 47.0 -51.7 -42.7 67.9 -20.2 -13.5 34 410 A Q H 3> S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.767 104.4 61.4 -72.3 -27.9 67.2 -23.6 -12.0 35 411 A E H <> S+ 0 0 82 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.844 104.2 49.6 -67.4 -35.6 67.2 -22.3 -8.4 36 412 A L H X S+ 0 0 21 -4,-1.5 4,-3.6 2,-0.2 5,-0.2 0.934 107.8 51.6 -65.8 -49.5 64.3 -20.0 -9.3 37 413 A V H X S+ 0 0 4 -4,-1.4 4,-2.2 1,-0.2 5,-0.2 0.808 108.9 54.2 -61.6 -31.5 62.2 -22.7 -10.8 38 414 A M H X S+ 0 0 126 -4,-1.6 4,-3.0 2,-0.2 -1,-0.2 0.977 113.5 39.7 -59.4 -57.8 62.9 -24.7 -7.6 39 415 A T H X S+ 0 0 30 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.919 115.9 51.6 -59.9 -48.8 61.5 -21.8 -5.4 40 416 A L H X S+ 0 0 9 -4,-3.6 4,-3.0 2,-0.2 5,-0.2 0.943 115.1 41.3 -51.5 -56.8 58.7 -21.0 -7.8 41 417 A N H X S+ 0 0 52 -4,-2.2 4,-2.4 1,-0.2 5,-0.3 0.879 113.8 53.3 -61.9 -41.5 57.5 -24.7 -7.9 42 418 A E H X S+ 0 0 107 -4,-3.0 4,-1.0 -5,-0.2 -1,-0.2 0.895 113.9 44.7 -57.9 -41.9 58.1 -25.0 -4.1 43 419 A L H X S+ 0 0 7 -4,-2.9 4,-2.3 -5,-0.2 -2,-0.2 0.957 116.8 41.3 -66.9 -54.8 55.9 -21.9 -3.7 44 420 A F H X S+ 0 0 0 -4,-3.0 4,-3.8 2,-0.3 271,-0.3 0.825 108.3 57.6 -73.3 -34.2 53.1 -22.8 -6.1 45 421 A A H X S+ 0 0 28 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.913 113.2 44.2 -56.5 -41.0 52.8 -26.5 -5.1 46 422 A R H X S+ 0 0 117 -4,-1.0 4,-1.9 -5,-0.3 3,-0.3 0.910 112.7 51.8 -64.7 -45.0 52.3 -25.0 -1.7 47 423 A F H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.890 107.7 51.3 -58.3 -43.4 49.9 -22.4 -3.2 48 424 A D H X S+ 0 0 1 -4,-3.8 4,-1.0 1,-0.2 -1,-0.2 0.762 107.9 53.9 -67.7 -27.1 47.9 -25.2 -5.0 49 425 A K H X S+ 0 0 131 -4,-1.1 4,-0.9 -3,-0.3 -2,-0.2 0.888 108.5 48.1 -70.0 -42.9 47.6 -27.0 -1.6 50 426 A L H >X S+ 0 0 19 -4,-1.9 4,-1.7 1,-0.2 3,-0.6 0.890 102.1 66.7 -64.7 -40.2 46.1 -23.9 0.1 51 427 A A H ><>S+ 0 0 0 -4,-2.0 5,-2.6 1,-0.2 3,-0.6 0.909 98.7 48.6 -45.0 -59.3 43.7 -23.5 -2.8 52 428 A A H ><5S+ 0 0 64 -4,-1.0 3,-0.9 1,-0.2 -1,-0.2 0.798 108.8 54.9 -56.9 -34.3 41.7 -26.6 -2.1 53 429 A E H <<5S+ 0 0 137 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.863 110.6 44.3 -67.1 -39.2 41.4 -25.8 1.7 54 430 A N T <<5S- 0 0 21 -4,-1.7 -1,-0.2 -3,-0.6 -2,-0.2 0.208 120.0-106.2 -91.9 14.9 39.9 -22.4 1.0 55 431 A H T < 5S+ 0 0 97 -3,-0.9 2,-0.4 1,-0.2 16,-0.4 0.917 73.1 147.6 57.1 47.4 37.5 -23.7 -1.7 56 432 A C < - 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0 0 25 -17,-0.3 -1,-0.4 -3,-0.1 2,-0.2 -0.957 46.8 -9.4-143.2 159.6 33.7 -22.9 -9.4 73 449 A P S S+ 0 0 109 0, 0.0 2,-0.2 0, 0.0 -3,-0.0 -0.892 137.6 16.1 -73.4 -34.5 32.8 -25.4 -10.8 74 450 A E S S- 0 0 164 -2,-0.2 -3,-0.1 1,-0.1 0, 0.0 -0.646 98.9 -98.5 -91.4 156.9 29.6 -25.1 -8.9 75 451 A A - 0 0 77 -2,-0.2 2,-0.3 -5,-0.0 -1,-0.1 -0.087 29.4-164.5 -77.0 168.5 28.7 -21.7 -7.2 76 452 A R > - 0 0 83 -63,-0.4 3,-0.8 -6,-0.1 4,-0.1 -0.955 21.6-152.4-151.4 137.8 29.0 -20.5 -3.6 77 453 A A T 3 S+ 0 0 95 -2,-0.3 3,-0.3 1,-0.2 -1,-0.1 0.687 103.3 58.9 -77.2 -20.2 27.5 -17.5 -1.8 78 454 A D T >> S+ 0 0 65 1,-0.2 4,-1.3 2,-0.1 3,-0.7 0.229 74.9 118.8 -88.6 13.2 30.5 -17.5 0.5 79 455 A H H <> + 0 0 2 -3,-0.8 4,-1.2 1,-0.2 -1,-0.2 0.791 66.0 50.9 -56.6 -41.0 32.8 -17.0 -2.6 80 456 A A H 3> S+ 0 0 0 -3,-0.3 4,-1.5 79,-0.2 -1,-0.2 0.811 104.2 57.1 -72.6 -32.2 34.4 -13.6 -1.7 81 457 A H H <> S+ 0 0 26 -3,-0.7 4,-3.3 78,-0.3 5,-0.2 0.904 102.1 59.4 -60.2 -43.9 35.5 -14.6 1.8 82 458 A C H X S+ 0 0 5 -4,-1.3 4,-3.2 2,-0.2 5,-0.2 0.947 103.3 47.5 -50.2 -62.0 37.4 -17.6 0.3 83 459 A C H X S+ 0 0 0 -4,-1.2 4,-3.3 1,-0.2 -1,-0.2 0.893 114.7 48.1 -49.1 -46.8 39.7 -15.4 -1.9 84 460 A V H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -1,-0.2 0.945 114.3 45.1 -60.2 -49.4 40.4 -13.2 1.0 85 461 A E H X S+ 0 0 68 -4,-3.3 4,-1.8 2,-0.2 -2,-0.2 0.817 113.2 52.6 -63.5 -31.2 41.1 -16.2 3.2 86 462 A M H X S+ 0 0 0 -4,-3.2 4,-3.0 -5,-0.2 -2,-0.2 0.941 108.2 49.3 -66.3 -50.8 43.2 -17.6 0.4 87 463 A G H X S+ 0 0 0 -4,-3.3 4,-2.7 2,-0.2 -2,-0.2 0.900 107.2 57.4 -52.9 -45.5 45.2 -14.4 0.1 88 464 A M H X S+ 0 0 67 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.934 112.4 38.1 -51.0 -56.6 45.8 -14.5 3.9 89 465 A D H X S+ 0 0 65 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.864 114.2 57.2 -64.2 -38.6 47.3 -18.0 3.8 90 466 A M H X S+ 0 0 0 -4,-3.0 4,-1.2 2,-0.2 -2,-0.2 0.859 105.6 52.2 -57.1 -40.2 49.1 -17.0 0.5 91 467 A I H >X S+ 0 0 31 -4,-2.7 4,-1.0 2,-0.2 3,-0.5 0.965 114.7 38.1 -61.3 -56.9 50.7 -14.1 2.3 92 468 A E H 3X S+ 0 0 117 -4,-1.8 4,-1.4 1,-0.2 3,-0.3 0.861 110.8 61.1 -67.1 -36.1 52.1 -16.1 5.2 93 469 A A H 3X S+ 0 0 11 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.806 101.9 53.1 -60.4 -31.9 53.1 -19.0 3.0 94 470 A I H X S+ 0 0 12 -4,-1.1 4,-1.4 1,-0.2 3,-0.8 0.634 97.0 72.8 -84.3 -16.5 59.2 -19.9 1.6 98 474 A R H 3X S+ 0 0 117 -4,-1.0 4,-2.3 1,-0.2 5,-0.3 0.765 85.7 68.0 -63.0 -25.4 61.3 -16.7 2.0 99 475 A E H 34 S+ 0 0 140 -4,-0.3 -1,-0.2 -3,-0.3 -2,-0.2 0.849 101.1 45.8 -58.7 -37.0 63.3 -18.9 4.4 100 476 A M H <4 S+ 0 0 137 -3,-0.8 -2,-0.2 -4,-0.2 -1,-0.2 0.853 114.0 44.9 -81.8 -38.9 64.5 -20.9 1.4 101 477 A T H < S- 0 0 24 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.893 85.5-154.5 -66.1 -41.3 65.4 -18.0 -0.9 102 478 A G < + 0 0 69 -4,-2.3 2,-0.3 1,-0.3 -3,-0.1 0.508 63.8 101.0 71.3 5.2 67.1 -16.2 1.9 103 479 A V S S- 0 0 18 -5,-0.3 2,-2.3 0, 0.0 -1,-0.3 -0.793 92.8 -84.9-120.7 162.1 66.3 -13.1 -0.2 104 480 A N + 0 0 99 -2,-0.3 2,-0.3 -3,-0.1 -77,-0.1 -0.371 58.7 166.3 -70.7 72.5 63.5 -10.4 0.0 105 481 A V + 0 0 9 -2,-2.3 2,-0.3 -11,-0.1 -82,-0.1 -0.700 7.0 174.3 -89.6 140.4 60.7 -12.2 -1.8 106 482 A N E -A 22 0A 53 -84,-0.7 -84,-3.7 -2,-0.3 2,-0.2 -1.000 23.2-137.6-148.3 145.5 57.1 -10.8 -1.6 107 483 A M E -A 21 0A 0 -2,-0.3 41,-3.0 -86,-0.2 2,-0.4 -0.665 8.2-154.7 -97.6 156.2 53.6 -11.3 -3.0 108 484 A R E -A 20 0A 34 -88,-1.1 -88,-1.2 -2,-0.2 2,-0.2 -0.907 16.2-156.1-134.2 103.9 51.2 -8.7 -4.1 109 485 A V E -Ad 19 150A 0 40,-1.4 42,-1.7 37,-0.4 37,-0.4 -0.521 13.7-179.7 -87.2 145.4 47.5 -9.7 -4.0 110 486 A G E -Ad 18 151A 0 -92,-2.8 -92,-2.8 -2,-0.2 2,-0.4 -0.936 5.3-176.1-143.4 120.7 44.6 -8.2 -6.0 111 487 A I E +Ad 17 152A 0 40,-3.8 42,-1.1 -2,-0.3 2,-0.4 -0.968 6.8 172.7-122.6 129.8 41.0 -9.4 -5.7 112 488 A H E -A 16 0A 2 -96,-2.2 -96,-3.5 -2,-0.4 2,-0.5 -0.998 17.0-150.6-129.7 140.9 37.9 -8.4 -7.7 113 489 A S E +A 15 0A 2 -2,-0.4 -98,-0.3 -98,-0.3 2,-0.2 -0.935 47.0 91.3-112.1 127.5 34.5 -10.0 -7.5 114 490 A G E S-A 14 0A 13 -100,-2.5 -100,-2.7 -2,-0.5 2,-0.4 -0.614 72.2 -34.7-168.7-132.2 32.1 -9.9 -10.5 115 491 A R E - 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