==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-JAN-10 3LKM . COMPND 2 MOLECULE: MYOSIN HEAVY CHAIN KINASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR Q.YE,Z.JIA . 247 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13041.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 22.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 18 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 19.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 1 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 1 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 3 2 0 1 1 0 1 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 1 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 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 1 556 A T 0 0 149 0, 0.0 2,-0.0 0, 0.0 24,-0.0 0.000 360.0 360.0 360.0 -25.5 5.2 -21.0 31.0 2 557 A G - 0 0 18 24,-0.1 2,-0.3 21,-0.1 23,-0.3 -0.226 360.0-108.3 85.1-179.2 7.9 -18.4 30.3 3 558 A E E -A 24 0A 25 21,-2.8 21,-2.7 -2,-0.0 2,-0.2 -0.976 21.3-106.7-151.4 157.3 10.2 -17.9 27.3 4 559 A M E -A 23 0A 37 -2,-0.3 136,-0.8 19,-0.2 2,-0.3 -0.545 33.0-177.5 -88.1 152.7 13.8 -18.4 26.3 5 560 A G E -A 22 0A 0 17,-2.5 17,-2.2 -2,-0.2 2,-0.5 -0.995 30.6-124.9-145.2 151.6 16.3 -15.6 25.7 6 561 A I E -AB 21 137A 3 131,-1.8 131,-2.4 -2,-0.3 2,-0.5 -0.867 36.1-152.0 -87.7 130.9 19.9 -15.1 24.6 7 562 A L E -AB 20 136A 0 13,-2.7 13,-3.4 -2,-0.5 2,-0.5 -0.908 9.2-162.9-115.0 129.7 21.5 -13.1 27.4 8 563 A W E -AB 19 135A 2 127,-2.8 127,-1.8 -2,-0.5 2,-0.4 -0.957 5.5-174.8-118.0 127.1 24.4 -10.8 26.8 9 564 A E E -A 18 0A 10 9,-2.5 9,-3.1 -2,-0.5 2,-0.5 -0.963 14.0-147.3-118.8 130.9 26.7 -9.5 29.5 10 565 A F E -A 17 0A 7 -2,-0.4 7,-0.2 123,-0.4 123,-0.1 -0.845 6.1-163.6 -99.7 134.3 29.4 -6.9 28.8 11 566 A D E >>> -A 16 0A 54 5,-2.6 4,-1.3 -2,-0.5 5,-1.3 -0.896 1.9-165.9-116.3 101.9 32.7 -6.9 30.8 12 567 A P T 345S+ 0 0 32 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.797 82.3 63.8 -54.4 -32.4 34.6 -3.7 30.4 13 568 A I T 345S+ 0 0 153 1,-0.2 -2,-0.0 2,-0.1 0, 0.0 0.815 117.8 26.3 -72.6 -26.4 37.9 -5.0 31.8 14 569 A I T <45S- 0 0 84 -3,-1.1 -1,-0.2 2,-0.2 3,-0.1 0.471 103.5-131.3-103.5 -5.6 38.3 -7.5 29.0 15 570 A N T <5 + 0 0 85 -4,-1.3 2,-0.3 1,-0.2 -2,-0.1 0.902 66.0 118.4 54.9 44.7 36.3 -5.4 26.6 16 571 A K E < -A 11 0A 76 -5,-1.3 -5,-2.6 50,-0.0 2,-0.3 -0.973 61.8-124.6-137.6 154.0 34.2 -8.4 25.5 17 572 A W E -Ac 10 66A 3 48,-3.1 50,-2.8 -2,-0.3 2,-0.4 -0.752 19.0-146.3 -92.3 146.2 30.6 -9.6 25.6 18 573 A I E -A 9 0A 7 -9,-3.1 -9,-2.5 -2,-0.3 2,-0.5 -0.950 11.9-147.4-114.3 130.6 29.7 -12.9 27.2 19 574 A R E +A 8 0A 18 48,-0.4 31,-0.6 -2,-0.4 -11,-0.2 -0.894 29.5 150.8-109.4 124.8 26.8 -14.8 25.6 20 575 A L E -AD 7 49A 0 -13,-3.4 -13,-2.7 -2,-0.5 2,-0.3 -0.674 33.5-123.8-133.0-178.4 24.5 -16.9 27.7 21 576 A S E +AD 6 48A 11 27,-2.3 27,-3.2 -15,-0.3 2,-0.3 -0.925 24.3 176.6-127.3 160.5 20.9 -18.1 27.7 22 577 A M E -AD 5 47A 1 -17,-2.2 -17,-2.5 -2,-0.3 2,-0.4 -0.981 25.1-132.8-151.2 164.2 18.1 -17.8 30.2 23 578 A K E +A 4 0A 60 23,-2.5 22,-3.2 -2,-0.3 23,-0.5 -0.964 34.7 171.5-114.2 139.1 14.4 -18.6 30.6 24 579 A L E -AD 3 44A 0 -21,-2.7 -21,-2.8 -2,-0.4 2,-0.4 -0.966 29.6-144.5-144.1 160.8 12.2 -15.9 32.0 25 580 A K E - D 0 43A 105 18,-2.3 18,-2.1 -2,-0.3 2,-0.3 -0.965 23.2-168.8-130.3 114.8 8.6 -15.0 32.6 26 581 A V E - D 0 42A 19 -2,-0.4 16,-0.2 16,-0.2 -24,-0.1 -0.813 25.1-111.6-108.7 142.5 7.5 -11.4 32.0 27 582 A E - 0 0 97 14,-2.7 4,-0.1 -2,-0.3 -1,-0.0 -0.338 25.7-125.8 -65.4 151.1 4.3 -9.7 33.0 28 583 A R S S+ 0 0 229 2,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.812 90.6 44.4 -71.8 -29.7 2.1 -8.6 30.0 29 584 A K S S- 0 0 152 12,-0.1 12,-0.4 1,-0.0 -2,-0.1 -0.890 87.6-110.1-121.6 147.7 1.9 -5.0 31.1 30 585 A P - 0 0 42 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.360 10.3-155.4 -77.1 153.8 4.5 -2.5 32.4 31 586 A F S S+ 0 0 95 8,-2.6 2,-0.3 1,-0.2 9,-0.2 0.587 76.9 3.0 -99.6 -14.4 4.6 -1.2 35.9 32 587 A A E -E 39 0A 47 7,-1.2 7,-2.9 2,-0.0 2,-0.3 -0.968 62.8-158.7-160.2 166.6 6.4 2.0 35.2 33 588 A E E -E 38 0A 126 -2,-0.3 5,-0.2 5,-0.3 2,-0.2 -0.993 4.3-162.5-152.0 159.4 7.9 4.1 32.3 34 589 A G - 0 0 44 3,-3.0 5,-0.0 -2,-0.3 -2,-0.0 -0.505 53.9 -72.6-120.5-165.6 10.4 6.8 31.4 35 590 A A S S+ 0 0 95 -2,-0.2 3,-0.0 1,-0.2 56,-0.0 0.913 128.3 14.2 -56.8 -45.3 10.7 9.0 28.4 36 591 A L S S+ 0 0 66 54,-0.1 55,-3.1 1,-0.1 2,-0.3 0.719 122.6 44.1-106.7 -27.7 12.0 6.2 26.1 37 592 A R E - F 0 90A 25 53,-0.3 -3,-3.0 51,-0.0 2,-0.4 -0.811 56.8-141.4-128.0 159.6 11.2 2.9 27.8 38 593 A E E -EF 33 89A 49 51,-2.7 51,-2.0 -2,-0.3 2,-0.4 -0.941 22.3-138.0-117.2 146.3 8.7 0.9 29.7 39 594 A A E -EF 32 88A 10 -7,-2.9 -8,-2.6 -2,-0.4 -7,-1.2 -0.868 16.2-168.2-113.0 136.6 9.5 -1.4 32.6 40 595 A Y E - F 0 87A 30 47,-2.9 47,-2.5 -2,-0.4 2,-0.3 -0.961 24.8-118.8-126.0 136.1 8.1 -4.9 33.3 41 596 A H E + F 0 86A 58 -12,-0.4 -14,-2.7 -2,-0.4 2,-0.3 -0.554 42.0 176.8 -70.2 136.0 8.2 -7.2 36.3 42 597 A T E -DF 26 85A 7 43,-2.4 43,-2.6 -2,-0.3 2,-0.4 -0.937 22.0-147.9-139.2 155.3 9.9 -10.4 35.4 43 598 A V E -DF 25 84A 45 -18,-2.1 -18,-2.3 -2,-0.3 2,-0.3 -0.989 22.1-122.1-127.1 139.5 11.0 -13.6 37.1 44 599 A S E -D 24 0A 2 39,-2.8 38,-2.7 -2,-0.4 -20,-0.3 -0.621 18.0-173.8 -76.7 135.6 13.9 -15.8 36.2 45 600 A L E - 0 0 61 -22,-3.2 -21,-0.2 1,-0.4 36,-0.2 0.115 68.4 -58.2-108.6 15.6 13.3 -19.5 35.3 46 601 A G E - 0 0 19 -23,-0.5 -23,-2.5 33,-0.4 -1,-0.4 -0.129 44.2-112.8 122.8 146.6 17.1 -20.1 35.2 47 602 A V E +D 22 0A 30 -25,-0.2 -25,-0.3 29,-0.2 2,-0.2 -0.882 39.2 161.7-107.8 141.5 20.3 -19.1 33.5 48 603 A G E -D 21 0A 22 -27,-3.2 -27,-2.3 -2,-0.4 2,-0.1 -0.760 38.6 -77.8-141.5-172.8 22.3 -21.4 31.2 49 604 A T E -D 20 0A 56 -29,-0.2 3,-0.4 -2,-0.2 -29,-0.2 -0.419 32.8-123.1 -87.3 170.0 25.0 -21.4 28.5 50 605 A D S > S+ 0 0 43 -31,-0.6 3,-2.0 1,-0.2 -30,-0.1 0.243 75.7 116.2 -95.2 14.3 24.4 -20.5 24.9 51 606 A E T 3 S+ 0 0 141 1,-0.3 -1,-0.2 -30,-0.1 -31,-0.0 0.795 72.7 51.6 -56.4 -35.7 25.6 -23.9 23.6 52 607 A N T 3 S+ 0 0 118 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.549 103.9 61.3 -78.5 -8.1 22.3 -24.8 22.1 53 608 A Y S < S- 0 0 75 -3,-2.0 -1,-0.2 -4,-0.0 -2,-0.0 -0.667 78.6-165.1-124.3 75.1 21.9 -21.6 20.1 54 609 A P + 0 0 108 0, 0.0 -3,-0.0 0, 0.0 -2,-0.0 -0.039 52.5 52.2 -67.9 163.8 24.8 -21.3 17.6 55 610 A L 0 0 142 1,-0.3 4,-0.0 4,-0.0 0, 0.0 0.957 360.0 360.0 77.9 86.2 26.1 -18.3 15.7 56 611 A G 0 0 19 3,-0.1 -1,-0.3 -37,-0.0 10,-0.1 -0.942 360.0 360.0 171.0 360.0 26.6 -15.5 18.1 57 ! 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 58 615 A K 0 0 242 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-139.8 27.6 -9.6 9.7 59 616 A L - 0 0 53 1,-0.1 4,-0.1 3,-0.1 -3,-0.1 0.734 360.0-112.2 73.4 121.5 26.8 -10.4 13.3 60 617 A F S S+ 0 0 64 1,-0.1 -1,-0.1 2,-0.1 3,-0.0 -0.988 104.3 36.2-131.6 127.2 26.6 -7.8 16.1 61 618 A P S S- 0 0 1 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.519 108.5-118.4 -65.5 152.5 28.5 -7.7 18.3 62 619 A P > - 0 0 36 0, 0.0 3,-2.5 0, 0.0 4,-0.2 -0.294 24.6-108.0 -62.0 152.3 31.3 -8.8 15.9 63 620 A I G > S+ 0 0 107 1,-0.3 3,-1.7 2,-0.2 -4,-0.1 0.793 117.6 61.8 -55.9 -32.5 32.8 -12.2 16.7 64 621 A E G 3 S+ 0 0 138 1,-0.3 -1,-0.3 -48,-0.0 0, 0.0 0.654 100.7 55.8 -70.1 -13.6 36.1 -10.6 17.9 65 622 A M G < S+ 0 0 38 -3,-2.5 -48,-3.1 -49,-0.1 2,-0.5 0.298 93.5 86.6 -97.6 6.2 34.1 -8.8 20.6 66 623 A I B < S-c 17 0A 16 -3,-1.7 -48,-0.2 -50,-0.2 -50,-0.0 -0.928 74.7-132.3-114.2 127.4 32.7 -12.0 22.1 67 624 A S - 0 0 22 -50,-2.8 -48,-0.4 -2,-0.5 -2,-0.1 -0.585 6.5-149.3 -70.9 130.6 34.4 -14.1 24.7 68 625 A P S S+ 0 0 120 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.637 84.7 64.0 -73.4 -9.5 34.4 -17.8 23.7 69 626 A I + 0 0 119 1,-0.1 -2,-0.1 3,-0.0 3,-0.1 -0.944 50.8 169.0-119.8 134.3 34.3 -18.5 27.5 70 627 A S + 0 0 24 -2,-0.4 -1,-0.1 -52,-0.1 -52,-0.1 0.185 40.5 116.9-129.7 13.8 31.5 -17.6 29.7 71 628 A K S S+ 0 0 188 1,-0.1 2,-0.6 -22,-0.0 -1,-0.1 0.842 73.5 55.3 -55.9 -40.4 32.3 -19.5 32.9 72 629 A N S S+ 0 0 147 -3,-0.1 2,-0.3 4,-0.0 -1,-0.1 -0.875 75.9 130.5-101.1 118.9 32.7 -16.3 35.0 73 630 A N - 0 0 21 -2,-0.6 4,-0.2 1,-0.1 -3,-0.0 -0.988 57.9-128.8-161.4 161.5 29.7 -14.0 34.9 74 631 A E S >> S+ 0 0 73 -2,-0.3 4,-2.8 1,-0.2 3,-1.1 0.789 97.9 71.3 -82.7 -31.2 27.3 -11.9 37.0 75 632 A A H 3> S+ 0 0 0 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.854 86.7 62.6 -56.7 -40.7 24.1 -13.3 35.5 76 633 A M H 34 S+ 0 0 87 1,-0.2 -1,-0.3 2,-0.2 -29,-0.2 0.765 118.3 27.0 -67.0 -22.1 24.4 -16.8 37.0 77 634 A T H X4 S+ 0 0 92 -3,-1.1 3,-1.1 -4,-0.2 -2,-0.2 0.827 124.9 45.6 -96.8 -47.2 24.1 -15.4 40.5 78 635 A Q H 3< S+ 0 0 59 -4,-2.8 -3,-0.2 1,-0.3 -2,-0.2 0.713 124.9 32.5 -73.5 -19.2 22.1 -12.1 40.0 79 636 A L T 3< S+ 0 0 0 -4,-2.6 -33,-0.4 -5,-0.3 -1,-0.3 0.001 86.6 149.4-123.4 27.2 19.6 -13.7 37.7 80 637 A K X - 0 0 123 -3,-1.1 3,-2.5 1,-0.2 -36,-0.3 -0.182 63.0 -62.7 -63.3 154.7 19.4 -17.2 39.2 81 638 A N T 3 S+ 0 0 114 1,-0.3 -36,-0.2 -36,-0.2 -1,-0.2 -0.048 126.0 20.6 -36.3 125.0 16.2 -19.3 39.1 82 639 A G T 3 S+ 0 0 48 -38,-2.7 -1,-0.3 1,-0.3 2,-0.1 0.173 87.2 140.9 97.7 -16.2 13.5 -17.6 41.0 83 640 A T < - 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