==== 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 30-JAN-10 3LMH . COMPND 2 MOLECULE: MYOSIN HEAVY CHAIN KINASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR Q.YE,Z.JIA . 488 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23228.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 305 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 112 23.0 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 36 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 18.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 2 2 0 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 . 2 5 5 3 1 2 2 0 2 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 . 2 0 2 0 0 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 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 1 552 A I 0 0 141 0, 0.0 2,-0.2 0, 0.0 49,-0.2 0.000 360.0 360.0 360.0 -24.8 43.0 -14.4 -0.4 2 553 A S - 0 0 34 47,-1.5 47,-0.1 2,-0.1 48,-0.0 -0.616 360.0-135.1-102.6 156.2 43.9 -12.4 2.8 3 554 A S S S+ 0 0 125 -2,-0.2 3,-0.1 2,-0.1 -1,-0.1 0.749 71.7 101.7 -74.8 -30.3 46.3 -13.1 5.7 4 555 A E S S- 0 0 109 1,-0.1 2,-0.2 45,-0.1 -2,-0.1 -0.044 84.8 -75.0 -66.1 163.9 43.9 -12.0 8.5 5 556 A T S S+ 0 0 123 22,-0.0 2,-0.3 24,-0.0 -1,-0.1 -0.351 75.8 106.5 -68.2 125.2 41.9 -14.3 10.8 6 557 A G - 0 0 23 -2,-0.2 2,-0.3 -3,-0.1 23,-0.2 -0.949 63.5 -84.3-174.2-178.4 38.8 -16.0 9.4 7 558 A E E -A 28 0A 31 21,-3.0 21,-2.7 -2,-0.3 2,-0.2 -0.796 37.9-120.1-107.2 149.8 37.5 -19.4 8.2 8 559 A M E -A 27 0A 31 -2,-0.3 133,-0.9 19,-0.2 2,-0.3 -0.507 29.7-175.7 -85.8 151.1 38.0 -20.9 4.8 9 560 A G E -A 26 0A 0 17,-2.5 17,-2.1 130,-0.2 2,-0.6 -0.995 30.5-126.8-142.8 152.6 35.2 -21.9 2.4 10 561 A I E -AB 25 138A 2 128,-2.0 128,-2.9 -2,-0.3 2,-0.4 -0.910 36.4-155.3 -90.7 122.9 34.6 -23.6 -0.9 11 562 A L E -AB 24 137A 0 13,-1.9 13,-3.2 -2,-0.6 2,-0.5 -0.858 9.2-165.5-110.8 130.1 32.5 -21.1 -2.8 12 563 A W E -AB 23 136A 1 124,-3.0 124,-1.7 -2,-0.4 2,-0.4 -0.967 4.8-174.7-121.8 127.0 30.2 -22.2 -5.6 13 564 A E E -A 22 0A 8 9,-2.4 9,-3.5 -2,-0.5 2,-0.4 -0.971 16.1-144.3-119.3 131.5 28.6 -19.8 -8.2 14 565 A F E -A 21 0A 4 -2,-0.4 7,-0.2 120,-0.4 120,-0.1 -0.815 7.9-162.2 -94.4 134.2 26.1 -21.1 -10.7 15 566 A D E >>> -A 20 0A 18 5,-2.8 5,-1.6 -2,-0.4 4,-1.2 -0.894 2.5-168.6-116.3 101.0 26.3 -19.4 -14.1 16 567 A P T 345S+ 0 0 28 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.816 82.0 63.2 -58.3 -33.5 23.0 -20.1 -16.0 17 568 A I T 345S+ 0 0 39 1,-0.3 348,-0.1 2,-0.1 419,-0.1 0.815 118.1 26.3 -70.6 -27.4 24.3 -18.9 -19.3 18 569 A I T <45S- 0 0 19 -3,-1.0 -1,-0.3 2,-0.2 3,-0.1 0.466 104.6-130.5-103.6 -2.9 27.0 -21.6 -19.5 19 570 A N T <5 + 0 0 86 -4,-1.2 2,-0.3 1,-0.2 -2,-0.1 0.924 66.3 120.1 56.3 44.9 24.9 -23.9 -17.4 20 571 A K E < -A 15 0A 49 -5,-1.6 -5,-2.8 48,-0.0 2,-0.3 -0.991 63.4-123.6-139.4 149.1 27.9 -24.6 -15.1 21 572 A W E -Ac 14 68A 5 46,-3.2 48,-3.2 -2,-0.3 2,-0.5 -0.709 22.2-145.5 -83.0 142.5 29.0 -24.2 -11.6 22 573 A I E -A 13 0A 1 -9,-3.5 -9,-2.4 -2,-0.3 2,-0.5 -0.957 12.2-149.4-113.2 121.0 32.1 -22.2 -10.9 23 574 A R E +A 12 0A 17 -2,-0.5 31,-0.6 46,-0.4 2,-0.2 -0.830 29.9 149.3-101.2 125.6 34.2 -23.5 -8.0 24 575 A L E -AD 11 53A 5 -13,-3.2 -13,-1.9 -2,-0.5 2,-0.3 -0.691 35.7-122.9-134.6-179.8 36.3 -21.0 -6.0 25 576 A S E +AD 10 52A 9 27,-2.5 27,-2.8 -15,-0.3 2,-0.3 -0.916 26.3 174.8-123.3 161.4 37.5 -20.5 -2.4 26 577 A M E -AD 9 51A 0 -17,-2.1 -17,-2.5 -2,-0.3 2,-0.4 -0.971 25.0-132.2-149.8 168.1 37.0 -17.7 -0.0 27 578 A K E +A 8 0A 33 23,-2.1 22,-3.5 -2,-0.3 2,-0.3 -0.979 31.2 176.2-118.1 140.1 37.8 -16.6 3.5 28 579 A L E -AD 7 48A 0 -21,-2.7 -21,-3.0 -2,-0.4 2,-0.5 -0.958 27.6-145.1-139.2 160.5 35.1 -15.2 5.7 29 580 A K E - D 0 47A 119 18,-2.4 18,-2.2 -2,-0.3 2,-0.4 -0.966 24.0-167.0-126.2 112.2 34.4 -14.0 9.2 30 581 A V E - D 0 46A 17 -2,-0.5 16,-0.2 16,-0.2 15,-0.1 -0.810 24.1-113.0-105.1 138.9 30.9 -14.7 10.4 31 582 A E - 0 0 105 14,-2.7 4,-0.1 -2,-0.4 -1,-0.0 -0.372 23.8-127.5 -63.5 145.8 29.3 -13.2 13.6 32 583 A R S S+ 0 0 203 2,-0.1 -1,-0.1 -2,-0.0 -2,-0.0 0.843 90.9 52.8 -67.1 -33.5 28.7 -15.8 16.3 33 584 A K S S- 0 0 130 12,-0.0 12,-0.4 1,-0.0 -2,-0.1 -0.858 86.5-117.4-110.6 140.6 25.0 -14.8 16.7 34 585 A P - 0 0 38 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.340 9.0-153.3 -68.0 149.8 22.3 -14.6 13.9 35 586 A F S S+ 0 0 91 8,-2.3 2,-0.3 1,-0.2 9,-0.2 0.537 77.2 6.1 -98.2 -10.5 20.7 -11.2 13.2 36 587 A A E -E 43 0A 49 7,-1.1 7,-2.6 2,-0.0 2,-0.3 -0.981 61.0-152.3-160.9 159.7 17.4 -12.8 11.9 37 588 A E E -E 42 0A 127 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.997 6.4-174.4-138.5 147.5 15.6 -16.1 11.4 38 589 A G - 0 0 47 3,-2.6 5,-0.0 -2,-0.3 -2,-0.0 -0.283 56.5 -65.6-110.0-154.8 13.0 -17.5 9.0 39 590 A A S S+ 0 0 89 -2,-0.1 3,-0.0 1,-0.1 54,-0.0 0.962 126.2 5.6 -61.6 -56.1 11.2 -20.8 9.1 40 591 A L S S+ 0 0 71 53,-0.1 53,-2.6 52,-0.1 55,-0.3 0.644 122.7 52.8-107.0 -18.4 14.2 -23.2 8.5 41 592 A R E - F 0 92A 25 51,-0.3 -3,-2.6 52,-0.1 2,-0.4 -0.808 58.3-142.2-128.0 159.5 17.3 -20.9 8.5 42 593 A E E -EF 37 91A 48 49,-2.7 49,-2.4 -2,-0.3 2,-0.4 -0.953 20.3-138.1-118.8 141.7 19.2 -18.3 10.4 43 594 A A E -EF 36 90A 12 -7,-2.6 -8,-2.3 -2,-0.4 -7,-1.1 -0.834 17.4-167.1-104.9 138.5 21.0 -15.4 8.9 44 595 A Y E - F 0 89A 31 45,-2.8 45,-2.7 -2,-0.4 2,-0.2 -0.979 24.2-119.9-128.4 130.2 24.4 -14.2 10.0 45 596 A H E - F 0 88A 57 -2,-0.4 -14,-2.7 -12,-0.4 2,-0.3 -0.490 41.4-179.5 -62.5 135.3 26.3 -11.0 9.3 46 597 A T E -DF 30 87A 1 41,-2.4 41,-2.9 -16,-0.2 2,-0.4 -0.960 22.1-147.0-139.8 151.1 29.6 -11.9 7.6 47 598 A V E -DF 29 86A 51 -18,-2.2 -18,-2.4 -2,-0.3 2,-0.3 -0.968 23.2-124.5-118.3 138.1 32.6 -10.1 6.3 48 599 A S E -D 28 0A 0 37,-2.6 36,-2.9 -2,-0.4 -20,-0.2 -0.643 16.5-170.3 -79.4 136.8 34.6 -11.3 3.3 49 600 A L E - 0 0 8 -22,-3.5 -47,-1.5 1,-0.4 34,-0.2 -0.049 64.0 -72.2-111.8 28.3 38.3 -11.8 3.6 50 601 A G E - 0 0 1 31,-0.5 -23,-2.1 -23,-0.2 -1,-0.4 -0.034 41.9-101.7 105.3 159.3 38.7 -12.3 -0.1 51 602 A V E +D 26 0A 17 -25,-0.2 -25,-0.3 27,-0.2 2,-0.2 -0.951 40.9 160.5-120.1 134.2 38.0 -14.7 -2.9 52 603 A G E -D 25 0A 19 -27,-2.8 -27,-2.5 -2,-0.4 2,-0.1 -0.658 40.0 -68.4-136.1-166.0 40.5 -17.1 -4.5 53 604 A T E -D 24 0A 55 -29,-0.3 3,-0.3 -2,-0.2 -29,-0.2 -0.417 30.2-128.2 -88.0 166.0 40.8 -20.2 -6.5 54 605 A D S > S+ 0 0 37 -31,-0.6 3,-2.4 1,-0.2 -30,-0.1 0.230 73.4 117.6 -91.1 11.2 39.9 -23.7 -5.5 55 606 A E T 3 S+ 0 0 142 1,-0.3 -1,-0.2 2,-0.1 -31,-0.0 0.807 71.7 52.0 -56.4 -35.0 43.3 -25.1 -6.6 56 607 A N T 3 S+ 0 0 123 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.515 104.9 60.0 -77.3 -6.4 44.4 -26.2 -3.0 57 608 A Y S < S- 0 0 74 -3,-2.4 -1,-0.2 0, 0.0 -2,-0.1 -0.568 79.2-159.6-124.3 68.9 41.2 -28.2 -2.5 58 609 A P 0 0 114 0, 0.0 -3,-0.1 0, 0.0 -2,-0.0 -0.097 360.0 360.0 -55.5 143.8 41.0 -30.9 -5.2 59 610 A L 0 0 97 2,-0.0 6,-0.0 6,-0.0 0, 0.0 -0.225 360.0 360.0 -63.9 360.0 37.6 -32.4 -6.0 60 ! 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 61 616 A L 0 0 134 0, 0.0 4,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 127.8 30.3 -36.0 -6.6 62 617 A F + 0 0 66 1,-0.2 3,-0.0 2,-0.1 42,-0.0 -0.991 360.0 30.7-135.7 129.3 27.7 -33.3 -6.5 63 618 A P S S- 0 0 2 0, 0.0 -1,-0.2 0, 0.0 5,-0.0 0.620 110.8-117.6 -63.3 155.7 27.3 -31.3 -8.6 64 619 A P > - 0 0 37 0, 0.0 3,-2.4 0, 0.0 4,-0.2 -0.258 22.5-106.0 -66.0 155.4 28.7 -33.9 -11.1 65 620 A I G > S+ 0 0 106 1,-0.3 3,-1.5 2,-0.2 -3,-0.1 0.787 118.5 60.7 -52.3 -35.4 32.0 -33.1 -12.9 66 621 A E G 3 S+ 0 0 136 1,-0.3 -1,-0.3 -46,-0.0 0, 0.0 0.602 102.1 54.1 -70.2 -12.0 30.2 -32.4 -16.2 67 622 A M G < S+ 0 0 36 -3,-2.4 -46,-3.2 -47,-0.1 2,-0.5 0.318 94.0 87.6-100.5 4.8 28.3 -29.5 -14.5 68 623 A I B < S-c 21 0A 17 -3,-1.5 -46,-0.2 -48,-0.2 -54,-0.0 -0.903 77.9-125.6-113.6 130.0 31.4 -27.8 -13.3 69 624 A S - 0 0 8 -48,-3.2 -46,-0.4 -2,-0.5 -2,-0.1 -0.554 7.5-147.3 -68.7 134.3 33.4 -25.3 -15.3 70 625 A P S S+ 0 0 105 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.654 87.2 57.0 -72.0 -16.2 37.1 -26.2 -15.7 71 626 A I + 0 0 51 366,-0.2 -2,-0.1 1,-0.1 368,-0.1 -0.949 52.7 170.6-122.9 137.2 37.9 -22.4 -15.7 72 627 A S + 0 0 24 -2,-0.4 -1,-0.1 -50,-0.1 -50,-0.1 0.154 40.9 117.1-133.6 16.6 36.9 -20.0 -12.9 73 628 A K S S+ 0 0 144 364,-0.1 2,-0.4 1,-0.1 -1,-0.1 0.779 76.3 50.0 -59.8 -32.9 38.8 -16.8 -13.8 74 629 A N + 0 0 23 360,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.945 68.9 128.0-114.6 137.5 35.5 -14.9 -14.3 75 630 A N - 0 0 23 -2,-0.4 4,-0.3 1,-0.1 3,-0.2 -0.947 60.9-115.1-172.1 159.2 32.7 -14.8 -11.7 76 631 A E S >> S+ 0 0 41 -2,-0.3 4,-2.8 1,-0.2 3,-1.3 0.809 105.5 73.4 -71.4 -33.0 30.5 -12.3 -9.9 77 632 A A H 3> S+ 0 0 0 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.842 85.3 62.6 -51.6 -44.0 32.0 -13.4 -6.5 78 633 A M H 34 S+ 0 0 95 1,-0.2 -1,-0.3 2,-0.2 -27,-0.2 0.772 118.2 26.6 -60.5 -29.1 35.3 -11.7 -7.1 79 634 A T H X4 S+ 0 0 78 -3,-1.3 3,-1.1 -4,-0.3 -2,-0.2 0.849 125.3 45.8 -94.5 -46.0 33.7 -8.2 -7.2 80 635 A Q H 3< S+ 0 0 58 -4,-2.8 -3,-0.2 1,-0.3 -2,-0.2 0.719 124.5 33.3 -73.8 -19.6 30.6 -8.8 -5.1 81 636 A L T 3< S+ 0 0 0 -4,-2.8 -31,-0.5 -5,-0.3 -1,-0.3 -0.001 84.7 145.7-123.1 27.2 32.4 -10.6 -2.3 82 637 A K X - 0 0 123 -3,-1.1 3,-2.4 1,-0.2 -34,-0.3 -0.163 66.4 -64.3 -63.6 161.4 35.8 -8.8 -2.4 83 638 A N T 3 S+ 0 0 68 1,-0.3 -34,-0.2 -34,-0.2 -1,-0.2 -0.161 125.9 25.4 -50.3 135.9 37.7 -8.3 0.8 84 639 A G T 3 S+ 0 0 42 -36,-2.9 -1,-0.3 1,-0.3 -35,-0.1 0.064 85.4 139.2 97.0 -22.9 35.8 -6.1 3.2 85 640 A T < - 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