==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-OCT-01 1J4K . COMPND 2 MOLECULE: PROTEIN KINASE SPK1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR I.-J.L.BYEON,S.YONGKIETTRAKUL,M.-D.TSAI . 165 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10122.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 26.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 33 20.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 2 4 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 1 573 A G 0 0 92 0, 0.0 4,-0.1 0, 0.0 125,-0.0 0.000 360.0 360.0 360.0-132.4 -16.8 10.9 -13.1 2 574 A N - 0 0 171 2,-0.4 3,-0.1 0, 0.0 21,-0.0 0.658 360.0 -82.1-100.1 -22.6 -18.9 8.0 -14.3 3 575 A G S S+ 0 0 18 1,-0.4 22,-0.8 19,-0.1 21,-0.5 0.192 101.1 92.3 140.7 -15.7 -17.5 5.4 -12.0 4 576 A R + 0 0 70 19,-0.3 -1,-0.4 20,-0.2 -2,-0.4 -0.873 32.5 167.4-112.4 143.4 -14.2 4.3 -13.6 5 577 A F S S+ 0 0 1 17,-2.4 120,-0.9 1,-0.4 121,-0.6 0.703 71.3 32.7-116.1 -45.5 -10.7 5.7 -13.1 6 578 A L E -AB 22 124A 1 16,-1.5 16,-2.8 118,-0.2 2,-0.5 -0.933 64.5-153.7-120.4 142.2 -8.4 3.1 -14.8 7 579 A T E -AB 21 123A 7 116,-0.9 116,-2.3 -2,-0.4 2,-0.8 -0.941 5.4-170.4-119.4 114.9 -9.1 1.0 -17.8 8 580 A L E -AB 20 122A 4 12,-1.7 12,-3.6 -2,-0.5 114,-0.2 -0.888 12.5-175.4-102.4 108.2 -7.3 -2.3 -18.3 9 581 A K E - B 0 121A 83 112,-2.0 112,-1.0 -2,-0.8 2,-0.3 -0.821 26.7-134.2-115.0 100.4 -8.0 -3.5 -21.8 10 582 A P E - B 0 120A 2 0, 0.0 8,-0.6 0, 0.0 110,-0.2 -0.220 37.4-145.5 -47.3 99.0 -6.7 -6.9 -22.8 11 583 A L > - 0 0 28 108,-1.3 3,-3.2 -2,-0.3 5,-0.3 -0.300 22.9-101.7 -74.6 158.3 -5.3 -5.8 -26.2 12 584 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.735 119.0 72.1 -49.5 -25.3 -5.3 -7.9 -29.4 13 585 A D T 3 S+ 0 0 111 106,-0.1 2,-0.2 3,-0.1 4,-0.1 0.827 96.2 63.0 -61.9 -27.9 -1.6 -8.5 -28.7 14 586 A S S < S- 0 0 1 -3,-3.2 104,-0.3 2,-0.4 102,-0.0 -0.638 102.1-109.9 -95.6 154.0 -2.9 -10.8 -25.9 15 587 A I S S+ 0 0 88 102,-2.1 2,-0.5 -2,-0.2 103,-0.1 0.637 105.7 75.5 -56.7 -11.5 -5.0 -13.9 -26.5 16 588 A I - 0 0 24 -5,-0.3 -2,-0.4 103,-0.1 2,-0.3 -0.915 58.9-173.0-109.7 123.9 -7.8 -11.7 -25.0 17 589 A Q + 0 0 125 -2,-0.5 2,-0.2 -5,-0.1 -6,-0.2 -0.449 50.6 109.1-109.1 56.2 -9.5 -8.9 -27.0 18 590 A E - 0 0 130 -8,-0.6 2,-0.4 -2,-0.3 -2,-0.1 -0.755 59.9-127.1-124.5 171.6 -11.6 -7.5 -24.2 19 591 A S - 0 0 72 -10,-0.3 2,-0.4 -2,-0.2 -10,-0.3 -0.986 15.4-162.5-127.7 132.0 -11.6 -4.3 -22.1 20 592 A L E -A 8 0A 17 -12,-3.6 -12,-1.7 -2,-0.4 2,-0.5 -0.885 3.7-157.6-112.3 141.3 -11.6 -4.0 -18.3 21 593 A E E -A 7 0A 86 -2,-0.4 2,-0.8 -14,-0.3 -14,-0.3 -0.934 8.9-147.4-124.0 110.9 -12.6 -0.9 -16.3 22 594 A I E -A 6 0A 9 -16,-2.8 -17,-2.4 -2,-0.5 -16,-1.5 -0.637 20.9-134.2 -77.8 109.4 -11.4 -0.5 -12.7 23 595 A Q > - 0 0 68 -2,-0.8 3,-3.6 -19,-0.3 -19,-0.3 -0.498 6.2-139.8 -66.5 115.8 -14.1 1.4 -10.9 24 596 A Q T 3 S+ 0 0 47 -2,-0.5 -1,-0.2 -21,-0.5 -20,-0.2 0.771 103.4 64.0 -46.4 -27.2 -12.3 4.2 -8.9 25 597 A G T 3 S+ 0 0 67 -22,-0.8 2,-0.6 1,-0.1 -1,-0.3 0.725 90.0 75.7 -71.7 -22.2 -14.8 3.3 -6.2 26 598 A V S < S- 0 0 47 -3,-3.6 3,-0.2 12,-0.0 -1,-0.1 -0.831 73.2-153.1 -97.9 118.8 -13.4 -0.2 -5.9 27 599 A N S S+ 0 0 77 -2,-0.6 27,-0.1 1,-0.3 2,-0.1 -0.971 76.4 18.9-139.2 121.7 -10.1 -0.5 -4.0 28 600 A P S S- 0 0 7 0, 0.0 2,-0.7 0, 0.0 -1,-0.3 0.583 81.7-147.8 -90.2 160.4 -8.3 -2.7 -4.5 29 601 A F E -F 53 0B 11 24,-3.2 24,-3.4 -3,-0.2 2,-0.4 -0.781 16.5-151.3 -91.2 115.8 -9.4 -4.0 -8.0 30 602 A F E -F 52 0B 21 -2,-0.7 9,-4.0 22,-0.3 2,-0.4 -0.714 11.5-169.5 -92.3 138.1 -8.8 -7.8 -8.2 31 603 A I E +Fg 51 39B 2 20,-3.4 20,-2.2 -2,-0.4 2,-0.3 -0.955 28.6 97.5-125.6 143.5 -8.0 -9.5 -11.4 32 604 A G E S- g 0 40B 0 7,-1.0 9,-2.7 -2,-0.4 16,-0.2 -0.986 79.8 -67.0 167.6-174.1 -7.9 -13.3 -12.1 33 605 A R S S+ 0 0 80 14,-2.0 2,-0.5 -2,-0.3 15,-0.2 0.486 103.1 88.7 -81.4 -4.1 -9.5 -16.4 -13.4 34 606 A S S > S- 0 0 35 14,-1.2 3,-2.7 13,-0.4 7,-0.1 -0.843 76.8-138.9-101.0 129.3 -12.0 -16.3 -10.5 35 607 A E T 3 S+ 0 0 145 -2,-0.5 -1,-0.1 1,-0.3 -3,-0.0 0.764 100.0 76.7 -53.4 -25.3 -15.2 -14.3 -10.8 36 608 A D T 3 S+ 0 0 97 122,-0.0 2,-0.3 2,-0.0 -1,-0.3 0.798 78.2 89.5 -56.6 -28.4 -14.5 -13.2 -7.3 37 609 A C S < S- 0 0 3 -3,-2.7 -5,-0.2 11,-0.2 -6,-0.1 -0.556 87.8-127.8 -75.1 131.3 -12.0 -10.8 -8.8 38 610 A N S S+ 0 0 70 -2,-0.3 2,-0.4 -10,-0.2 -7,-0.2 0.815 102.0 55.0 -45.6 -32.0 -13.3 -7.4 -9.8 39 611 A C E S-g 31 0B 6 -9,-4.0 -7,-1.0 -5,-0.1 2,-0.6 -0.862 81.0-147.0-107.4 138.2 -11.7 -8.2 -13.2 40 612 A K E +g 32 0B 106 -2,-0.4 2,-0.4 -9,-0.2 -7,-0.2 -0.901 30.2 152.0-113.3 111.9 -12.6 -11.4 -15.1 41 613 A I - 0 0 4 -9,-2.7 2,-1.1 -2,-0.6 -7,-0.1 -0.928 29.9-152.2-137.8 109.7 -9.9 -13.1 -17.1 42 614 A E + 0 0 126 -2,-0.4 2,-0.4 -9,-0.1 -9,-0.1 -0.715 31.3 155.4 -87.8 104.1 -9.9 -16.8 -17.7 43 615 A D > - 0 0 2 -2,-1.1 3,-0.7 1,-0.1 -10,-0.1 -0.963 42.0-144.3-131.0 112.1 -6.3 -17.9 -18.3 44 616 A N T 3 S+ 0 0 113 -2,-0.4 -1,-0.1 1,-0.3 -11,-0.0 0.815 108.2 45.3 -42.2 -36.0 -5.4 -21.5 -17.5 45 617 A R T 3 S+ 0 0 87 -3,-0.1 -1,-0.3 2,-0.1 38,-0.2 0.847 99.7 86.4 -77.6 -36.5 -2.1 -20.1 -16.3 46 618 A L S < S- 0 0 0 -3,-0.7 2,-0.2 1,-0.1 -14,-0.1 -0.159 73.6-132.5 -62.0 159.6 -3.7 -17.3 -14.3 47 619 A S > - 0 0 18 -16,-0.1 -14,-2.0 1,-0.1 3,-1.7 -0.658 29.1 -96.1-111.1 168.6 -4.8 -17.9 -10.7 48 620 A R T 3 S+ 0 0 138 1,-0.3 -14,-1.2 -16,-0.2 -11,-0.2 0.924 129.1 18.9 -47.0 -50.5 -8.0 -17.0 -8.9 49 621 A V T 3 S+ 0 0 22 1,-0.2 -1,-0.3 -17,-0.2 31,-0.3 -0.500 80.0 157.9-119.7 58.5 -6.4 -13.9 -7.6 50 622 A H < - 0 0 0 -3,-1.7 31,-1.9 1,-0.2 30,-1.7 0.896 70.0 -20.2 -48.6 -48.9 -3.5 -13.6 -10.1 51 623 A C E -FH 31 79B 1 -20,-2.2 -20,-3.4 28,-0.3 2,-0.3 -0.985 57.6-162.4-162.7 154.3 -3.2 -9.9 -9.5 52 624 A F E -FH 30 78B 0 26,-3.5 26,-3.2 -2,-0.3 2,-0.4 -0.995 17.4-131.4-143.2 147.2 -5.0 -6.8 -8.2 53 625 A I E -FH 29 77B 3 -24,-3.4 -24,-3.2 -2,-0.3 2,-0.4 -0.831 21.4-166.8-101.7 134.6 -4.5 -3.1 -8.4 54 626 A F E - H 0 76B 38 22,-3.9 22,-4.2 -2,-0.4 2,-0.4 -0.978 10.3-144.5-125.1 133.0 -4.6 -0.9 -5.3 55 627 A K E + H 0 75B 20 -2,-0.4 2,-0.3 20,-0.3 20,-0.3 -0.778 22.5 179.2 -97.8 136.6 -4.9 2.9 -5.1 56 628 A K E - H 0 74B 116 18,-3.3 18,-4.3 -2,-0.4 2,-0.7 -0.932 37.1 -94.7-135.5 158.6 -3.1 4.8 -2.4 57 629 A R E - H 0 73B 145 -2,-0.3 2,-0.3 16,-0.3 16,-0.3 -0.629 41.1-139.9 -76.9 112.7 -2.7 8.4 -1.3 58 630 A H E + H 0 72B 36 14,-1.5 14,-0.8 -2,-0.7 2,-0.3 -0.582 33.1 160.0 -76.4 128.8 0.5 9.8 -3.0 59 631 A A - 0 0 64 -2,-0.3 12,-0.1 12,-0.2 -2,-0.0 -0.887 26.6-144.2-155.3 119.2 2.6 12.0 -0.7 60 632 A V - 0 0 64 -2,-0.3 3,-0.1 1,-0.1 0, 0.0 -0.143 30.6-107.0 -74.0 174.2 6.3 12.9 -0.9 61 633 A G S S- 0 0 82 1,-0.2 2,-0.3 0, 0.0 -1,-0.1 0.922 90.6 -17.1 -69.7 -45.3 8.6 13.4 2.0 62 634 A K - 0 0 165 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 -0.963 51.4-133.7-154.9 168.1 8.8 17.2 1.7 63 635 A S + 0 0 79 -2,-0.3 2,-0.7 -3,-0.1 4,-0.0 -0.720 25.9 176.7-132.5 83.4 8.2 20.1 -0.6 64 636 A M S S- 0 0 154 -2,-0.3 2,-3.2 1,-0.1 -2,-0.1 -0.791 73.2 -39.9 -92.2 115.3 11.0 22.6 -0.7 65 637 A Y S S+ 0 0 249 -2,-0.7 2,-0.2 2,-0.0 -1,-0.1 -0.334 127.5 78.1 69.4 -65.7 10.5 25.4 -3.2 66 638 A E S S- 0 0 147 -2,-3.2 0, 0.0 1,-0.1 0, 0.0 -0.480 82.2-130.1 -75.9 144.2 9.0 23.0 -5.7 67 639 A S - 0 0 91 -2,-0.2 -4,-0.1 2,-0.1 -1,-0.1 -0.815 30.7-172.8 -99.2 99.8 5.4 21.9 -5.3 68 640 A P - 0 0 30 0, 0.0 3,-0.1 0, 0.0 -5,-0.1 0.178 55.6 -55.6 -73.2-162.7 5.2 18.0 -5.6 69 641 A A - 0 0 15 1,-0.2 2,-2.3 2,-0.0 -11,-0.1 0.756 66.7-161.1 -49.0 -26.2 2.2 15.8 -5.6 70 642 A Q - 0 0 144 1,-0.2 -1,-0.2 -8,-0.1 -7,-0.0 -0.449 62.5 -35.4 77.0 -70.8 1.2 17.5 -2.3 71 643 A G S S+ 0 0 20 -2,-2.3 -12,-0.2 -3,-0.1 -1,-0.2 0.030 91.7 127.3 177.0 61.6 -1.2 14.8 -1.3 72 644 A L E -H 58 0B 51 -14,-0.8 -14,-1.5 -3,-0.0 2,-0.4 -0.212 55.1 -86.9-108.5-160.9 -3.3 13.2 -3.9 73 645 A D E -Hi 57 130B 55 56,-1.9 58,-0.5 -16,-0.3 2,-0.3 -0.909 32.3-171.6-119.7 146.9 -4.0 9.5 -4.9 74 646 A D E -H 56 0B 2 -18,-4.3 -18,-3.3 -2,-0.4 2,-0.5 -0.883 23.1-119.1-129.2 160.0 -2.1 7.1 -7.1 75 647 A I E -H 55 0B 5 25,-0.3 25,-2.3 -2,-0.3 2,-0.4 -0.899 23.7-164.1-108.7 124.7 -2.9 3.6 -8.4 76 648 A W E -HJ 54 99B 42 -22,-4.2 -22,-3.9 -2,-0.5 2,-0.6 -0.856 14.3-137.2-106.2 138.7 -0.6 0.6 -7.6 77 649 A Y E -HJ 53 98B 4 21,-3.9 21,-1.4 -2,-0.4 2,-0.5 -0.841 20.8-164.7 -97.7 117.7 -0.6 -2.7 -9.4 78 650 A C E -HJ 52 97B 0 -26,-3.2 -26,-3.5 -2,-0.6 2,-0.5 -0.876 3.4-158.0-106.2 132.5 -0.3 -5.7 -7.0 79 651 A H E +HJ 51 96B 0 17,-2.1 16,-4.1 -2,-0.5 17,-1.2 -0.935 23.6 161.2-113.0 125.1 0.6 -9.2 -8.3 80 652 A T + 0 0 29 -30,-1.7 -29,-0.3 -2,-0.5 2,-0.2 0.225 41.9 114.6-121.5 9.3 -0.3 -12.2 -6.2 81 653 A G > - 0 0 0 -31,-1.9 3,-1.0 1,-0.1 13,-0.3 -0.571 63.1-140.6 -84.9 147.0 -0.1 -14.8 -9.0 82 654 A T T 3 S+ 0 0 61 1,-0.2 83,-0.2 -2,-0.2 -1,-0.1 0.656 100.3 66.7 -77.8 -16.4 2.6 -17.6 -8.9 83 655 A N T 3 S- 0 0 1 -38,-0.2 27,-0.3 81,-0.2 -1,-0.2 0.420 103.9-133.1 -83.9 2.1 3.1 -17.2 -12.7 84 656 A V < - 0 0 26 -3,-1.0 9,-0.2 -34,-0.1 2,-0.2 0.740 14.5-126.1 49.3 130.6 4.5 -13.7 -12.1 85 657 A S E -C 92 0A 0 7,-1.8 7,-2.1 -4,-0.2 2,-0.5 -0.566 11.8-130.4-100.4 165.9 3.3 -10.8 -14.3 86 658 A Y E -CD 91 107A 67 21,-4.5 21,-5.0 5,-0.2 2,-0.9 -0.966 10.0-159.5-124.2 120.1 5.4 -8.4 -16.3 87 659 A L E > -CD 90 106A 0 3,-2.4 3,-2.9 -2,-0.5 2,-2.2 -0.819 63.7 -65.2-100.7 100.4 4.8 -4.6 -16.2 88 660 A N T 3 S- 0 0 74 17,-1.6 18,-0.0 -2,-0.9 -2,-0.0 -0.364 121.2 -18.7 61.5 -81.7 6.3 -3.0 -19.3 89 661 A N T 3 S+ 0 0 164 -2,-2.2 2,-0.4 2,-0.1 -1,-0.3 0.262 118.5 94.2-137.4 6.8 9.9 -3.9 -18.6 90 662 A N E < S-C 87 0A 32 -3,-2.9 -3,-2.4 53,-0.1 2,-0.2 -0.856 73.3-118.3-108.5 141.2 9.8 -4.7 -14.8 91 663 A R E -C 86 0A 172 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.502 20.2-158.2 -75.9 141.3 9.4 -8.2 -13.3 92 664 A M E -C 85 0A 0 -7,-2.1 -7,-1.8 -2,-0.2 2,-0.2 -0.830 13.5-176.7-125.1 93.1 6.3 -8.7 -11.1 93 665 A I > - 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