==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-NOV-05 2C60 . COMPND 2 MOLECULE: HUMAN MITOGEN-ACTIVATED PROTEIN KINASE KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.E.DEBRECZENI,E.SALAH,E.PAPAGRIGORIOU,N.BURGESS, . 85 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5765.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 58 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 20.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 2.4 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 . 12 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 25.9 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 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -10 A G > 0 0 85 0, 0.0 4,-1.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -80.1 6.3 43.3 10.3 2 -9 A T T 4 + 0 0 132 2,-0.2 0, 0.0 1,-0.2 0, 0.0 0.838 360.0 50.7 -69.0 -36.4 3.3 45.5 10.9 3 -8 A E T 4 S+ 0 0 103 2,-0.2 -1,-0.2 1,-0.2 0, 0.0 0.913 107.6 52.5 -62.6 -45.1 1.7 42.3 12.4 4 -7 A N T 4 0 0 80 1,-0.2 -2,-0.2 21,-0.0 -1,-0.2 0.877 360.0 360.0 -59.0 -40.1 4.9 41.9 14.5 5 -6 A L < 0 0 182 -4,-1.8 -2,-0.2 0, 0.0 -1,-0.2 0.913 360.0 360.0 -69.7 360.0 4.4 45.5 15.8 6 ! 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 7 43 A S 0 0 127 0, 0.0 19,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 2.1 10.6 33.8 21.2 8 44 A D - 0 0 90 17,-0.1 2,-0.6 1,-0.1 17,-0.2 -0.292 360.0-120.4 -60.1 150.0 12.6 36.4 19.2 9 45 A V E -A 24 0A 1 15,-2.9 15,-2.6 70,-0.0 2,-0.6 -0.849 22.3-149.3 -92.4 119.6 16.3 35.8 18.7 10 46 A R E -A 23 0A 105 -2,-0.6 70,-2.8 68,-0.3 2,-0.5 -0.841 11.0-162.0 -91.2 121.3 18.4 38.6 20.1 11 47 A I E -Ab 22 80A 1 11,-2.9 11,-2.5 -2,-0.6 2,-0.9 -0.926 8.4-152.1-107.1 125.4 21.6 39.0 18.1 12 48 A K E -Ab 21 81A 74 68,-2.5 70,-2.5 -2,-0.5 2,-0.4 -0.860 18.7-162.4 -97.3 101.4 24.5 40.9 19.7 13 49 A F E -Ab 20 82A 1 7,-2.6 7,-2.0 -2,-0.9 2,-0.5 -0.711 5.6-163.0 -86.3 135.0 26.4 42.5 16.9 14 50 A E E +Ab 19 83A 32 68,-2.5 70,-3.0 -2,-0.4 2,-0.4 -0.977 13.0 171.2-117.3 124.6 30.0 43.7 17.4 15 51 A H E > S-A 18 0A 27 3,-2.7 3,-1.9 -2,-0.5 70,-0.1 -0.977 73.2 -18.4-134.1 121.1 31.5 46.1 14.9 16 52 A N T 3 S- 0 0 141 68,-0.5 3,-0.1 -2,-0.4 -1,-0.1 0.868 128.8 -51.0 49.4 46.5 34.9 47.8 15.6 17 53 A G T 3 S+ 0 0 48 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.339 115.0 114.2 80.3 -4.0 34.5 47.1 19.3 18 54 A E E < -A 15 0A 57 -3,-1.9 -3,-2.7 2,-0.0 2,-0.4 -0.831 49.2-158.8-102.6 135.5 31.0 48.5 19.6 19 55 A R E +A 14 0A 151 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.883 15.8 167.5-117.9 145.2 28.1 46.2 20.5 20 56 A R E -A 13 0A 121 -7,-2.0 -7,-2.6 -2,-0.4 2,-0.5 -0.985 27.1-128.8-150.6 153.7 24.4 46.4 20.0 21 57 A I E -A 12 0A 75 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.870 21.8-178.5-107.0 130.4 21.5 44.0 20.3 22 58 A I E -A 11 0A 27 -11,-2.5 -11,-2.9 -2,-0.5 2,-0.3 -0.999 18.4-139.0-127.8 131.8 18.9 43.6 17.5 23 59 A A E -A 10 0A 56 -2,-0.4 2,-0.4 -13,-0.2 -13,-0.2 -0.694 14.5-167.1 -92.7 141.1 16.0 41.2 17.8 24 60 A F E -A 9 0A 21 -15,-2.6 -15,-2.9 -2,-0.3 2,-0.1 -0.995 20.2-124.8-127.2 132.3 14.7 39.0 15.0 25 61 A S - 0 0 73 -2,-0.4 -17,-0.1 -17,-0.2 -21,-0.0 -0.461 48.8 -73.6 -71.1 145.0 11.4 37.1 14.8 26 62 A R S S+ 0 0 99 -2,-0.1 2,-0.1 1,-0.1 -1,-0.1 -0.585 114.5 48.9 -82.5 148.3 11.5 33.4 14.2 27 63 A P S S- 0 0 114 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.478 86.5-151.7 -72.8 134.9 12.1 31.8 11.8 28 64 A V - 0 0 9 -4,-0.1 2,-0.4 -2,-0.1 -2,-0.1 -0.675 7.3-149.0 -80.9 121.8 15.2 34.0 11.3 29 65 A K >> - 0 0 60 -2,-0.5 4,-1.9 1,-0.1 3,-0.6 -0.777 11.6-138.7 -94.7 131.3 16.1 34.2 7.6 30 66 A Y H 3> S+ 0 0 26 -2,-0.4 4,-2.6 1,-0.2 5,-0.2 0.902 104.9 53.3 -51.2 -46.1 19.8 34.6 6.6 31 67 A E H 3> S+ 0 0 109 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.838 107.3 52.4 -65.6 -28.2 18.9 37.2 4.0 32 68 A D H <> S+ 0 0 97 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.885 109.5 47.9 -74.4 -38.5 16.9 39.2 6.5 33 69 A V H X S+ 0 0 2 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.947 112.7 49.3 -64.6 -46.4 19.9 39.4 8.9 34 70 A E H X S+ 0 0 89 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.929 112.4 47.9 -58.6 -46.8 22.2 40.4 6.1 35 71 A H H X S+ 0 0 123 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.907 110.9 50.4 -61.9 -41.8 19.8 43.1 5.0 36 72 A K H X S+ 0 0 92 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.920 110.6 50.3 -64.1 -41.7 19.4 44.4 8.5 37 73 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 6,-0.4 0.951 111.4 47.0 -60.7 -48.1 23.2 44.6 9.0 38 74 A T H X S+ 0 0 52 -4,-2.5 4,-1.2 1,-0.2 5,-0.3 0.909 115.8 46.5 -60.5 -41.0 23.7 46.4 5.7 39 75 A T H < S+ 0 0 86 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.931 117.5 40.8 -66.9 -47.3 20.9 48.9 6.6 40 76 A V H < S+ 0 0 48 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.884 123.6 35.8 -71.0 -41.6 22.0 49.5 10.2 41 77 A F H < S- 0 0 33 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.515 101.7-126.8 -94.5 -8.0 25.8 49.7 9.7 42 78 A G S < S+ 0 0 68 -4,-1.2 -3,-0.2 -5,-0.3 -4,-0.1 0.631 83.5 58.7 74.7 14.5 25.6 51.4 6.3 43 79 A Q S S- 0 0 75 -6,-0.4 -2,-0.2 -5,-0.3 2,-0.2 -0.948 93.6 -91.8-164.4 152.1 27.8 48.8 4.6 44 80 A P - 0 0 94 0, 0.0 2,-0.4 0, 0.0 -9,-0.1 -0.524 45.1-175.9 -71.4 140.4 27.8 45.1 4.0 45 81 A L - 0 0 12 -2,-0.2 41,-0.2 -11,-0.2 2,-0.2 -1.000 25.7-115.6-138.4 140.4 29.6 43.1 6.7 46 82 A D E -C 85 0A 90 39,-2.9 39,-1.6 -2,-0.4 2,-0.6 -0.479 28.7-126.8 -75.1 144.3 30.3 39.4 7.1 47 83 A L E -C 84 0A 6 11,-0.5 11,-3.1 37,-0.2 2,-0.5 -0.819 26.4-178.0 -95.6 120.0 28.7 37.6 10.0 48 84 A H E -CD 83 57A 30 35,-2.2 35,-3.2 -2,-0.6 9,-0.3 -0.957 21.5-140.4-120.1 112.8 31.0 35.6 12.2 49 85 A Y E -CD 82 56A 13 7,-2.4 7,-2.3 -2,-0.5 2,-0.4 -0.552 32.9-167.2 -63.5 134.0 29.5 33.6 15.1 50 86 A X E + D 0 55A 26 31,-2.3 31,-0.3 -2,-0.2 5,-0.2 -0.972 25.4 173.2-132.4 141.2 31.8 34.0 18.0 51 87 A N - 0 0 62 3,-2.7 0, 0.0 -2,-0.4 0, 0.0 -0.577 59.7 -78.9-118.4-164.7 32.5 32.6 21.4 52 88 A N S S+ 0 0 142 -2,-0.2 3,-0.1 1,-0.2 -2,-0.0 0.778 127.0 20.1 -68.7 -21.7 35.4 33.4 23.7 53 89 A E S S+ 0 0 173 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.699 121.5 38.3-115.1 -31.2 37.8 31.2 21.7 54 90 A L - 0 0 116 2,-0.0 -3,-2.7 0, 0.0 2,-0.3 -0.902 50.2-166.4-128.7 150.3 36.5 30.6 18.2 55 91 A S E -D 50 0A 64 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.989 6.6-167.2-132.2 154.7 34.7 32.3 15.4 56 92 A I E -D 49 0A 98 -7,-2.3 -7,-2.4 -2,-0.3 2,-0.2 -0.992 24.5-119.6-141.1 128.2 33.0 30.9 12.4 57 93 A L E -D 48 0A 67 -2,-0.4 2,-0.7 -9,-0.3 -9,-0.3 -0.446 21.8-139.9 -65.1 132.4 31.8 32.7 9.3 58 94 A L + 0 0 6 -11,-3.1 -11,-0.5 -2,-0.2 -1,-0.1 -0.864 28.3 171.0 -97.2 112.1 28.0 32.2 8.7 59 95 A K - 0 0 120 -2,-0.7 2,-0.3 1,-0.1 -1,-0.1 0.605 55.7 -6.4 -98.7 -18.6 27.7 31.7 5.0 60 96 A N S > S- 0 0 62 1,-0.1 4,-2.2 -30,-0.0 5,-0.2 -0.934 85.4 -71.5-165.8 178.0 24.1 30.7 4.5 61 97 A Q H > S+ 0 0 43 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.860 123.5 55.6 -56.5 -41.8 20.8 29.7 6.2 62 98 A D H > S+ 0 0 116 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.925 108.9 46.9 -62.4 -43.4 22.1 26.3 7.4 63 99 A D H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.921 113.4 48.8 -62.6 -44.6 25.0 27.9 9.2 64 100 A L H X S+ 0 0 1 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.926 109.2 52.6 -61.8 -42.8 22.7 30.5 10.8 65 101 A D H X S+ 0 0 73 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.904 109.3 49.7 -60.7 -39.3 20.3 27.8 11.9 66 102 A K H X S+ 0 0 103 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.895 110.3 50.1 -68.8 -36.0 23.1 25.9 13.5 67 103 A A H X S+ 0 0 4 -4,-2.1 4,-1.8 1,-0.2 3,-0.4 0.935 109.9 50.1 -67.3 -41.5 24.3 29.0 15.3 68 104 A I H X S+ 0 0 13 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.852 105.7 58.1 -63.8 -33.3 20.8 29.7 16.6 69 105 A D H X S+ 0 0 65 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.861 101.6 54.0 -67.0 -32.5 20.7 26.1 17.8 70 106 A I H X S+ 0 0 73 -4,-1.4 4,-1.2 -3,-0.4 -2,-0.2 0.956 110.2 48.2 -59.3 -49.8 23.7 26.7 20.0 71 107 A L H >< S+ 0 0 12 -4,-1.8 3,-0.7 1,-0.2 -2,-0.2 0.936 112.7 47.7 -52.4 -49.4 21.9 29.6 21.5 72 108 A D H 3< S+ 0 0 75 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.823 110.4 50.9 -70.4 -30.0 18.8 27.5 22.0 73 109 A R H 3< S+ 0 0 199 -4,-2.1 2,-0.5 -5,-0.2 -1,-0.2 0.669 96.0 84.2 -79.2 -16.2 20.6 24.6 23.6 74 110 A S << - 0 0 34 -4,-1.2 -4,-0.0 -3,-0.7 0, 0.0 -0.760 60.2-161.6 -93.2 127.5 22.4 26.8 26.1 75 111 A S S S+ 0 0 116 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.836 92.8 43.1 -71.4 -29.3 20.7 27.8 29.3 76 112 A S S S+ 0 0 97 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 0.761 90.3 92.0 -90.2 -26.1 23.0 30.7 30.0 77 113 A X + 0 0 58 -6,-0.2 -3,-0.1 -7,-0.2 3,-0.1 -0.593 40.7 169.1 -76.6 125.1 23.2 32.2 26.5 78 114 A K + 0 0 153 -2,-0.4 -68,-0.3 1,-0.2 2,-0.3 0.465 64.9 30.2-114.9 -8.7 20.6 34.9 26.0 79 115 A S S S- 0 0 14 -70,-0.1 2,-0.7 -67,-0.1 -68,-0.2 -0.979 80.2-112.3-147.1 157.9 21.9 36.5 22.8 80 116 A L E -b 11 0A 0 -70,-2.8 -68,-2.5 -2,-0.3 2,-0.6 -0.831 31.5-137.6 -92.8 116.8 23.7 35.3 19.7 81 117 A R E +b 12 0A 76 -2,-0.7 -31,-2.3 -31,-0.3 2,-0.5 -0.663 26.8 177.3 -81.4 118.2 27.2 36.8 19.5 82 118 A I E -bC 13 49A 3 -70,-2.5 -68,-2.5 -2,-0.6 2,-0.5 -0.978 18.1-153.9-124.9 119.8 28.1 37.9 16.0 83 119 A L E -bC 14 48A 29 -35,-3.2 -35,-2.2 -2,-0.5 2,-0.5 -0.806 15.6-147.4 -87.9 127.6 31.3 39.6 15.1 84 120 A L E + C 0 47A 1 -70,-3.0 -68,-0.5 -2,-0.5 2,-0.4 -0.874 19.9 178.1-100.3 127.7 30.9 41.8 12.0 85 121 A L E C 0 46A 76 -39,-1.6 -39,-2.9 -2,-0.5 -70,-0.0 -0.988 360.0 360.0-130.2 139.2 34.0 42.2 9.7 86 122 A S 0 0 117 -2,-0.4 -41,-0.1 -41,-0.2 -2,-0.0 -0.659 360.0 360.0 -77.1 360.0 34.3 44.0 6.4