==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-AUG-11 3TDH . COMPND 2 MOLECULE: CARBON CATABOLITE-DEREPRESSING PROTEIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR F.V.MAYER,R.HEATH,E.UNDERWOOD,M.J.SANDERS,D.CARMENA,R.MCCART . 559 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26652.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 393 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 97 17.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 34 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 3 1 0 1 2 1 4 2 0 1 1 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 0 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 PARALLEL BRIDGES PER LADDER . 8 4 2 1 2 1 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 1 465 A S 0 0 113 0, 0.0 520,-0.1 0, 0.0 516,-0.0 0.000 360.0 360.0 360.0 165.7 50.5 79.1 5.2 2 466 A T + 0 0 67 516,-0.1 2,-0.5 2,-0.1 519,-0.1 -0.085 360.0 126.8-114.8 31.8 47.7 79.0 7.8 3 467 A V + 0 0 21 514,-0.2 2,-0.3 512,-0.0 514,-0.2 -0.819 36.3 160.0 -89.2 124.5 46.8 75.3 7.4 4 468 A S E -A 516 0A 64 512,-2.4 512,-3.0 -2,-0.5 2,-0.6 -0.892 46.7-110.8-139.4 164.1 46.9 73.7 10.8 5 469 A I E -A 515 0A 64 -2,-0.3 510,-0.2 510,-0.2 508,-0.1 -0.926 42.6-119.3 -95.5 123.4 45.7 70.7 12.9 6 470 A L >> - 0 0 21 508,-3.0 3,-1.8 -2,-0.6 4,-0.5 -0.522 21.1-150.1 -63.0 110.4 43.2 71.9 15.4 7 471 A P G >4 S+ 0 0 77 0, 0.0 3,-1.1 0, 0.0 6,-0.3 0.828 92.5 58.5 -57.3 -36.1 44.9 71.0 18.8 8 472 A T G 34 S+ 0 0 34 1,-0.2 9,-0.1 467,-0.2 468,-0.1 0.598 96.9 63.9 -72.3 -9.8 41.5 70.5 20.6 9 473 A S G <4 S+ 0 0 1 -3,-1.8 -1,-0.2 505,-0.2 504,-0.2 0.695 80.0 98.6 -82.8 -22.8 40.6 67.8 18.1 10 474 A L S XX S- 0 0 53 -3,-1.1 4,-2.3 -4,-0.5 3,-0.9 -0.498 82.0-126.1 -70.8 135.1 43.5 65.6 19.2 11 475 A P H 3> S+ 0 0 12 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.813 105.5 55.8 -53.4 -41.0 42.4 62.9 21.6 12 476 A Q H 3> S+ 0 0 119 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.851 113.7 39.8 -62.9 -38.4 44.9 63.7 24.3 13 477 A I H <> S+ 0 0 66 -3,-0.9 4,-2.2 -6,-0.3 -1,-0.2 0.863 115.3 51.4 -78.7 -39.1 43.8 67.4 24.5 14 478 A H H X S+ 0 0 10 -4,-2.3 4,-1.5 -7,-0.2 -2,-0.2 0.929 111.9 46.9 -62.7 -47.9 40.1 66.6 24.2 15 479 A R H X S+ 0 0 49 -4,-2.7 4,-2.4 -5,-0.2 3,-0.5 0.947 112.5 49.7 -55.7 -53.5 40.2 64.0 27.0 16 480 A A H X S+ 0 0 49 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.855 109.9 51.1 -57.1 -40.2 42.2 66.4 29.3 17 481 A N H X S+ 0 0 77 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.785 110.8 48.4 -69.5 -29.0 39.7 69.2 28.7 18 482 A M H X>S+ 0 0 11 -4,-1.5 4,-1.6 -3,-0.5 5,-0.9 0.867 112.9 48.2 -76.5 -39.3 36.7 66.9 29.5 19 483 A L H <5S+ 0 0 92 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.900 108.6 53.9 -62.8 -45.0 38.5 65.8 32.7 20 484 A A H <5S+ 0 0 88 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.813 106.5 52.1 -63.0 -34.4 39.3 69.3 33.8 21 485 A Q H <5S- 0 0 153 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 0.907 116.2-118.4 -67.2 -44.0 35.7 70.3 33.5 22 486 A G T <5 + 0 0 53 -4,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.306 54.1 155.6 127.1 -6.5 34.7 67.4 35.7 23 487 A S > < - 0 0 32 -5,-0.9 3,-1.1 1,-0.1 4,-0.3 -0.235 41.7-137.5 -56.5 133.3 32.5 65.1 33.6 24 488 A P T >> S+ 0 0 90 0, 0.0 4,-1.8 0, 0.0 3,-1.7 0.828 97.3 70.9 -61.7 -36.7 32.5 61.5 34.9 25 489 A A H 3> S+ 0 0 10 1,-0.3 4,-2.5 2,-0.2 -6,-0.1 0.745 86.1 69.7 -52.9 -27.0 32.6 60.0 31.3 26 490 A A H <4 S+ 0 0 3 -3,-1.1 -1,-0.3 -8,-0.2 -7,-0.1 0.849 107.4 34.9 -61.0 -37.8 36.2 61.3 31.1 27 491 A S H <4 S+ 0 0 89 -3,-1.7 -2,-0.2 -4,-0.3 -1,-0.2 0.908 123.8 42.2 -80.2 -46.0 37.3 58.7 33.7 28 492 A K H < S+ 0 0 175 -4,-1.8 2,-0.5 2,-0.0 -2,-0.2 0.877 99.2 72.3 -76.8 -43.1 35.0 55.9 32.6 29 493 A I < - 0 0 25 -4,-2.5 -1,-0.0 -5,-0.2 474,-0.0 -0.655 65.7-166.8 -81.4 123.8 35.2 56.0 28.8 30 494 A S - 0 0 69 -2,-0.5 3,-0.1 1,-0.1 -3,-0.0 -0.752 28.1 -93.3-106.8 155.1 38.5 54.7 27.4 31 495 A P - 0 0 24 0, 0.0 2,-0.2 0, 0.0 477,-0.2 -0.313 47.4 -96.3 -65.4 149.9 39.8 55.1 23.8 32 496 A L - 0 0 15 474,-2.3 2,-0.5 473,-0.0 477,-0.4 -0.499 36.5-166.5 -67.3 128.7 39.1 52.4 21.2 33 497 A V - 0 0 109 -2,-0.2 2,-0.9 475,-0.1 -1,-0.0 -0.916 1.0-167.3-121.2 101.7 42.1 50.0 20.9 34 498 A T - 0 0 27 -2,-0.5 2,-0.9 267,-0.1 -2,-0.0 -0.794 10.7-152.3 -92.5 102.4 41.8 47.8 17.8 35 499 A K - 0 0 175 -2,-0.9 2,-1.1 1,-0.1 267,-0.1 -0.662 7.5-159.7 -75.9 104.9 44.4 45.0 18.2 36 500 A K - 0 0 94 -2,-0.9 2,-0.1 265,-0.1 -1,-0.1 -0.761 11.1-150.3 -90.8 95.9 45.3 44.0 14.6 37 501 A S - 0 0 78 -2,-1.1 2,-1.2 1,-0.1 -2,-0.0 -0.378 23.1-109.1 -65.6 139.5 46.8 40.5 14.8 38 502 A K - 0 0 97 -2,-0.1 2,-0.2 1,-0.0 -1,-0.1 -0.606 38.5-144.3 -72.6 97.8 49.4 39.6 12.2 39 503 A T - 0 0 72 -2,-1.2 2,-0.6 1,-0.1 -1,-0.0 -0.462 3.8-138.7 -66.0 129.0 47.4 37.0 10.2 40 504 A R - 0 0 154 -2,-0.2 179,-0.4 179,-0.0 2,-0.3 -0.838 20.3-157.5 -89.3 121.1 49.5 34.1 8.9 41 505 A W + 0 0 20 -2,-0.6 2,-0.3 142,-0.2 146,-0.2 -0.770 13.0 178.9 -99.4 145.8 48.5 33.2 5.3 42 506 A H E -E 217 0B 13 175,-2.3 175,-3.4 -2,-0.3 2,-0.4 -0.977 33.3-110.4-138.1 152.0 49.1 29.9 3.6 43 507 A F E S-E 216 0B 4 138,-0.5 173,-0.3 -2,-0.3 65,-0.1 -0.720 81.1 -34.2 -77.1 132.5 48.3 28.4 0.3 44 508 A G S S- 0 0 1 171,-2.1 2,-0.4 -2,-0.4 65,-0.2 -0.062 95.4 -51.5 56.4-149.5 45.6 25.7 0.6 45 509 A I E -L 108 0C 42 63,-1.6 63,-3.2 171,-0.1 2,-0.2 -0.963 43.3-131.0-129.3 144.2 45.3 23.4 3.7 46 510 A R E -L 107 0C 137 -2,-0.4 2,-0.4 61,-0.2 61,-0.2 -0.634 18.9-166.0 -90.7 148.9 47.8 21.2 5.5 47 511 A S E -L 106 0C 23 59,-2.9 59,-2.6 -2,-0.2 7,-0.1 -0.999 19.3-159.6-135.7 140.4 47.2 17.6 6.5 48 512 A R S S+ 0 0 156 -2,-0.4 -1,-0.1 57,-0.2 59,-0.1 0.588 70.1 89.7 -92.2 -12.7 49.1 15.4 9.0 49 513 A S S S- 0 0 37 1,-0.1 -2,-0.1 57,-0.1 57,-0.1 0.105 85.0 -87.9 -69.4-170.8 47.7 12.1 7.5 50 514 A Y >> - 0 0 144 55,-0.0 4,-2.5 1,-0.0 3,-0.7 -0.726 39.4 -96.9-110.8 158.4 49.4 10.2 4.6 51 515 A P H 3> S+ 0 0 20 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.775 118.7 39.8 -41.6 -58.4 48.9 10.5 0.8 52 516 A L H 3> S+ 0 0 59 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.851 117.4 51.0 -64.6 -36.6 46.3 7.8 -0.0 53 517 A D H <> S+ 0 0 90 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.919 112.4 45.9 -64.4 -46.1 44.4 8.7 3.2 54 518 A V H X S+ 0 0 3 -4,-2.5 4,-2.1 2,-0.2 3,-0.2 0.955 111.9 49.9 -62.4 -52.8 44.3 12.4 2.3 55 519 A M H X S+ 0 0 1 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.849 109.9 53.7 -54.8 -37.1 43.3 11.8 -1.3 56 520 A G H X S+ 0 0 11 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.894 106.9 49.8 -64.5 -43.9 40.5 9.5 -0.1 57 521 A E H X S+ 0 0 45 -4,-1.9 4,-2.1 -3,-0.2 -2,-0.2 0.879 111.5 49.9 -61.3 -40.0 39.1 12.2 2.3 58 522 A I H X S+ 0 0 2 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.954 110.5 47.5 -65.9 -52.5 39.1 14.7 -0.6 59 523 A Y H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.877 111.8 51.5 -56.6 -42.2 37.3 12.5 -3.1 60 524 A I H X S+ 0 0 81 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.932 112.4 45.6 -58.9 -48.3 34.7 11.6 -0.4 61 525 A A H X S+ 0 0 0 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.912 113.0 51.1 -60.8 -44.7 34.1 15.3 0.3 62 526 A L H <>S+ 0 0 0 -4,-3.1 5,-2.6 1,-0.2 4,-0.4 0.867 109.9 50.1 -57.1 -42.3 33.9 16.0 -3.5 63 527 A K H ><5S+ 0 0 88 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.907 110.1 48.0 -67.8 -44.9 31.4 13.2 -4.0 64 528 A N H 3<5S+ 0 0 114 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.689 109.5 54.4 -70.1 -20.9 29.0 14.4 -1.2 65 529 A L T 3<5S- 0 0 44 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.504 120.3-108.8 -91.5 -7.1 29.2 18.0 -2.5 66 530 A G T < 5 + 0 0 52 -3,-0.9 19,-0.5 -4,-0.4 -3,-0.2 0.723 66.4 145.8 90.6 25.0 28.1 16.8 -5.9 67 531 A A < - 0 0 1 -5,-2.6 2,-0.3 -6,-0.1 -1,-0.2 -0.533 33.4-150.0 -88.7 158.0 31.3 17.3 -7.9 68 532 A E E -M 83 0C 51 15,-2.6 15,-3.1 -2,-0.2 2,-0.3 -0.875 14.1-168.9-122.6 160.6 32.5 15.1 -10.8 69 533 A W E -MN 82 146C 1 77,-2.4 77,-2.4 -2,-0.3 13,-0.2 -0.962 23.2-103.4-148.9 161.0 36.1 14.4 -11.9 70 534 A A E - N 0 145C 14 11,-2.2 11,-0.3 -2,-0.3 75,-0.2 -0.542 45.1 -99.3 -83.6 151.6 38.3 12.9 -14.6 71 535 A K - 0 0 149 73,-0.6 2,-0.1 -2,-0.2 73,-0.1 -0.618 43.9-134.7 -70.9 118.2 39.9 9.4 -14.3 72 536 A P - 0 0 19 0, 0.0 2,-0.2 0, 0.0 5,-0.1 -0.442 12.7-139.3 -77.4 150.3 43.6 10.0 -13.2 73 537 A S > - 0 0 60 3,-0.1 3,-1.1 -2,-0.1 0, 0.0 -0.445 31.5 -95.6 -99.1 177.3 46.5 8.2 -14.8 74 538 A E T 3 S+ 0 0 41 1,-0.3 3,-0.5 2,-0.2 -1,-0.0 0.703 122.2 54.7 -68.6 -22.5 49.7 6.7 -13.2 75 539 A E T 3 S+ 0 0 89 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.556 118.5 33.6 -87.2 -10.1 51.8 9.9 -13.8 76 540 A D X + 0 0 41 -3,-1.1 3,-1.2 1,-0.1 -1,-0.2 -0.247 68.5 137.6-141.4 49.6 49.2 12.1 -12.1 77 541 A L T 3 S+ 0 0 5 -3,-0.5 -3,-0.1 94,-0.3 -1,-0.1 0.802 75.9 52.6 -63.2 -31.9 47.7 10.1 -9.2 78 542 A W T 3 S+ 0 0 10 93,-0.1 20,-2.1 95,-0.1 2,-0.4 0.121 94.3 88.5 -98.4 20.1 47.9 13.0 -6.8 79 543 A T E < - O 0 97C 18 -3,-1.2 2,-0.5 18,-0.2 18,-0.2 -0.970 58.1-160.0-120.9 131.8 46.0 15.4 -9.1 80 544 A I E - O 0 96C 0 16,-3.0 16,-2.4 -2,-0.4 2,-0.8 -0.960 3.1-167.2-113.4 120.1 42.3 15.9 -9.2 81 545 A K E + O 0 95C 85 -2,-0.5 -11,-2.2 -11,-0.3 14,-0.2 -0.858 30.0 172.9-104.2 94.0 40.8 17.4 -12.4 82 546 A L E -MO 69 94C 1 12,-1.8 12,-1.8 -2,-0.8 2,-0.3 -0.555 28.3-152.8-108.2 166.3 37.2 18.2 -11.2 83 547 A R E -MO 68 93C 47 -15,-3.1 -15,-2.6 10,-0.2 2,-0.4 -0.995 10.5-161.3-138.1 139.3 34.1 19.9 -12.3 84 548 A W E - O 0 92C 16 8,-2.5 8,-3.0 -2,-0.3 -17,-0.1 -0.988 14.2-148.6-132.3 132.0 31.4 21.5 -10.1 85 549 A K 0 0 120 -19,-0.5 -1,-0.1 -2,-0.4 -18,-0.1 0.858 360.0 360.0 -67.1 -42.4 27.8 22.4 -11.1 86 550 A Y 0 0 81 5,-0.1 -1,-0.2 6,-0.1 5,-0.1 -0.136 360.0 360.0 59.9 360.0 27.2 25.4 -8.8 87 ! 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 88 562 A I 0 0 132 0, 0.0 311,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 123.0 26.2 31.3 -19.4 89 563 A P - 0 0 33 0, 0.0 28,-0.2 0, 0.0 309,-0.0 -0.364 360.0-173.9 -61.2 132.4 28.7 28.6 -18.5 90 564 A D + 0 0 75 26,-0.4 2,-0.6 -2,-0.1 27,-0.2 0.759 56.2 74.9-102.5 -31.4 27.4 26.4 -15.6 91 565 A L E - 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