==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-MAY-04 1WI0 . COMPND 2 MOLECULE: MITOGEN ACTIVATED PROTEIN KINASE KINASE 5; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.YONEYAMA,F.HAYASHI,N.TOCHIO,S.KOSHIBA,M.INOUE,T.KIGAWA, . 113 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7829.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 73 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 13.3 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 . 1 0.9 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-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 . 1 0.9 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 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 23.0 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 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 0 2 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 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 1 A G 0 0 86 0, 0.0 2,-0.8 0, 0.0 42,-0.1 0.000 360.0 360.0 360.0-136.2 -10.8 6.1 6.6 2 2 A S - 0 0 71 41,-0.0 2,-0.5 38,-0.0 3,-0.1 -0.859 360.0-148.2-102.1 104.3 -9.5 8.9 8.8 3 3 A S S S+ 0 0 132 -2,-0.8 0, 0.0 1,-0.2 0, 0.0 -0.598 78.9 30.2 -74.4 119.9 -12.2 10.1 11.2 4 4 A G + 0 0 67 -2,-0.5 -1,-0.2 0, 0.0 0, 0.0 0.892 61.1 166.1 95.8 66.8 -11.7 13.7 12.0 5 5 A S - 0 0 87 -3,-0.1 5,-0.1 5,-0.0 -2,-0.1 0.937 16.4-171.0 -74.8 -50.3 -10.1 15.3 8.9 6 6 A S + 0 0 112 2,-0.0 3,-0.0 3,-0.0 0, 0.0 0.982 66.5 35.3 52.7 75.5 -10.8 18.9 10.0 7 7 A G S > S- 0 0 45 2,-0.1 2,-2.2 1,-0.0 3,-0.8 0.543 79.8-129.5 114.1 98.4 -9.8 20.7 6.8 8 8 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.501 84.2 88.5 -75.0 78.1 -10.4 19.2 3.3 9 9 A F T 3 S- 0 0 195 -2,-2.2 -2,-0.1 -4,-0.1 -3,-0.0 0.524 70.0-148.8-136.1 -50.7 -6.9 19.7 2.1 10 10 A C < - 0 0 59 -3,-0.8 2,-0.3 -5,-0.1 -3,-0.0 0.895 15.5-138.4 68.8 100.9 -4.8 16.7 2.9 11 11 A A + 0 0 89 24,-0.0 2,-0.2 2,-0.0 -1,-0.1 -0.642 33.0 154.8 -91.1 148.3 -1.2 17.7 3.5 12 12 A M - 0 0 78 -2,-0.3 4,-0.1 1,-0.1 23,-0.0 -0.781 30.6-166.3-175.1 127.6 1.7 15.7 2.1 13 13 A E S S+ 0 0 207 -2,-0.2 2,-0.2 2,-0.1 -1,-0.1 0.922 79.8 63.4 -81.9 -50.5 5.3 16.4 1.1 14 14 A N S S- 0 0 93 1,-0.1 22,-0.2 3,-0.0 3,-0.1 -0.548 102.7 -91.8 -78.4 141.2 6.0 13.1 -0.7 15 15 A Q - 0 0 147 -2,-0.2 -1,-0.1 1,-0.1 21,-0.1 0.075 56.2 -81.6 -44.7 162.0 4.0 12.4 -3.8 16 16 A V - 0 0 52 1,-0.1 2,-0.3 -4,-0.1 18,-0.3 -0.068 46.4-116.2 -62.8 169.9 0.8 10.4 -3.4 17 17 A L E -A 33 0A 0 16,-3.4 16,-2.4 -3,-0.1 2,-0.5 -0.865 17.3-156.8-114.0 147.6 0.8 6.7 -3.1 18 18 A V E -A 32 0A 47 -2,-0.3 84,-2.5 14,-0.2 2,-0.5 -0.950 6.8-162.7-128.4 110.2 -0.7 4.2 -5.6 19 19 A I E -Ab 31 102A 0 12,-1.6 12,-3.1 -2,-0.5 2,-0.7 -0.801 5.6-154.5 -95.0 129.7 -1.6 0.7 -4.3 20 20 A R E -Ab 30 103A 78 82,-1.8 84,-2.6 -2,-0.5 2,-0.6 -0.880 6.8-156.0-108.1 102.4 -2.1 -2.0 -6.9 21 21 A I E -Ab 29 104A 0 8,-2.5 8,-1.6 -2,-0.7 2,-0.8 -0.678 20.2-127.2 -80.4 118.5 -4.4 -4.7 -5.6 22 22 A K E -A 28 0A 74 82,-2.8 6,-0.2 -2,-0.6 -1,-0.1 -0.547 27.5-152.5 -69.2 106.4 -3.7 -7.9 -7.5 23 23 A I > - 0 0 20 4,-1.5 3,-0.8 -2,-0.8 2,-0.6 -0.618 20.0-110.4 -84.1 141.1 -7.2 -8.9 -8.7 24 24 A P T 3 S- 0 0 83 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 -0.610 91.8 -24.5 -75.0 114.4 -7.9 -12.7 -9.2 25 25 A N T 3 S+ 0 0 172 -2,-0.6 3,-0.1 1,-0.1 -3,-0.0 0.938 128.2 83.2 46.2 59.0 -8.3 -13.2 -13.0 26 26 A S S < S- 0 0 95 -3,-0.8 -1,-0.1 1,-0.3 -3,-0.1 0.106 95.7-111.5-177.8 36.4 -9.3 -9.6 -13.5 27 27 A G - 0 0 52 -4,-0.2 -4,-1.5 -5,-0.1 -1,-0.3 -0.332 53.8 -67.9 61.4-137.4 -6.1 -7.6 -13.7 28 28 A A E -A 22 0A 37 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.2 -0.989 34.7-132.2-152.8 149.8 -5.5 -5.2 -10.8 29 29 A V E -A 21 0A 69 -8,-1.6 -8,-2.5 -2,-0.3 2,-0.6 -0.827 15.9-137.3-106.9 144.8 -7.1 -2.1 -9.4 30 30 A D E -A 20 0A 99 -2,-0.4 2,-1.0 -10,-0.2 -10,-0.2 -0.902 9.2-152.0-105.2 119.7 -5.2 1.0 -8.3 31 31 A W E -A 19 0A 45 -12,-3.1 -12,-1.6 -2,-0.6 2,-0.9 -0.803 18.6-134.8 -93.4 103.0 -6.3 2.6 -5.1 32 32 A T E -A 18 0A 81 -2,-1.0 2,-0.5 -14,-0.2 -14,-0.2 -0.423 30.4-175.3 -60.7 100.3 -5.5 6.3 -5.4 33 33 A V E +A 17 0A 5 -16,-2.4 -16,-3.4 -2,-0.9 3,-0.2 -0.898 21.2 171.4-105.9 126.6 -3.9 6.9 -2.0 34 34 A H S S+ 0 0 94 -2,-0.5 2,-0.9 -18,-0.3 -1,-0.1 0.740 77.5 60.9 -99.6 -33.3 -2.9 10.5 -1.1 35 35 A S + 0 0 23 1,-0.2 -1,-0.2 3,-0.1 -19,-0.1 -0.331 62.5 156.0 -91.1 51.1 -2.0 9.8 2.5 36 36 A G S S+ 0 0 1 -2,-0.9 3,-0.4 -3,-0.2 -1,-0.2 0.878 81.8 31.7 -40.9 -51.4 0.7 7.3 1.5 37 37 A P S S+ 0 0 81 0, 0.0 2,-1.9 0, 0.0 -1,-0.2 0.913 115.8 58.3 -75.0 -46.0 2.4 8.0 4.9 38 38 A Q S S+ 0 0 124 -4,-0.1 2,-0.4 2,-0.0 -3,-0.1 -0.301 85.1 123.1 -81.3 52.8 -0.8 8.7 6.8 39 39 A L - 0 0 6 -2,-1.9 2,-0.3 -3,-0.4 43,-0.1 -0.931 44.6-158.9-118.8 141.3 -2.1 5.3 5.9 40 40 A L > - 0 0 84 -2,-0.4 4,-1.4 1,-0.1 -2,-0.0 -0.745 28.5-116.3-114.9 163.4 -3.2 2.6 8.3 41 41 A F H > S+ 0 0 18 -2,-0.3 4,-1.8 1,-0.2 3,-0.5 0.942 115.4 50.9 -61.7 -51.0 -3.5 -1.2 7.9 42 42 A R H > S+ 0 0 173 1,-0.2 4,-3.7 2,-0.2 5,-0.3 0.918 101.7 62.2 -52.5 -49.1 -7.2 -1.2 8.5 43 43 A D H > S+ 0 0 21 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.891 104.0 49.4 -42.9 -49.6 -7.6 1.5 5.8 44 44 A V H X S+ 0 0 0 -4,-1.4 4,-3.8 -3,-0.5 3,-0.5 0.940 113.6 44.3 -56.2 -50.9 -6.2 -0.9 3.3 45 45 A L H X S+ 0 0 29 -4,-1.8 4,-1.9 1,-0.3 -1,-0.2 0.820 110.5 56.7 -63.0 -31.6 -8.6 -3.6 4.5 46 46 A D H < S+ 0 0 94 -4,-3.7 -1,-0.3 -5,-0.2 -2,-0.2 0.807 115.8 36.9 -68.7 -30.5 -11.3 -0.9 4.4 47 47 A V H >X S+ 0 0 28 -4,-1.9 3,-3.7 -3,-0.5 4,-1.0 0.942 113.6 52.4 -84.3 -58.8 -10.5 -0.3 0.8 48 48 A I H >X S+ 0 0 0 -4,-3.8 4,-3.8 1,-0.3 3,-1.3 0.861 98.5 69.1 -44.2 -42.1 -9.8 -3.9 -0.3 49 49 A G H 3< S+ 0 0 37 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.781 101.9 45.8 -48.4 -29.8 -13.1 -4.7 1.2 50 50 A Q H <4 S+ 0 0 166 -3,-3.7 -1,-0.3 -4,-0.2 -2,-0.2 0.722 115.4 46.3 -85.4 -25.0 -14.5 -2.7 -1.7 51 51 A V H << S+ 0 0 38 -3,-1.3 -2,-0.2 -4,-1.0 3,-0.2 0.923 128.5 23.0 -81.0 -50.2 -12.2 -4.4 -4.2 52 52 A L >< + 0 0 13 -4,-3.8 3,-0.7 1,-0.1 -1,-0.2 -0.709 68.4 153.6-120.6 77.4 -12.9 -7.9 -3.0 53 53 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.706 82.6 46.1 -75.0 -21.3 -16.2 -7.8 -1.3 54 54 A E T 3 S+ 0 0 192 1,-0.2 2,-0.3 -3,-0.2 -2,-0.1 0.300 114.1 54.8-101.0 5.5 -16.7 -11.5 -2.1 55 55 A A S < S- 0 0 29 -3,-0.7 -1,-0.2 -6,-0.1 -3,-0.1 -0.878 81.3-139.6-144.5 106.5 -13.2 -12.3 -1.0 56 56 A T + 0 0 59 -2,-0.3 -2,-0.1 53,-0.3 56,-0.0 0.077 22.8 172.9 -54.4 173.4 -11.9 -11.4 2.5 57 57 A T + 0 0 10 51,-0.1 2,-2.8 -12,-0.0 -1,-0.1 0.290 13.3 165.3-146.0 -74.2 -8.4 -10.1 3.0 58 58 A T S S+ 0 0 83 -13,-0.1 2,-0.3 -16,-0.1 -13,-0.2 -0.295 77.9 29.7 75.4 -55.7 -7.5 -8.8 6.4 59 59 A A - 0 0 4 -2,-2.8 48,-1.5 48,-0.5 2,-0.3 -0.806 69.7-163.6-128.9 169.6 -3.8 -8.9 5.4 60 60 A F E -CD 72 106A 0 12,-1.1 12,-3.1 -2,-0.3 2,-0.3 -0.958 12.1-129.9-150.4 164.9 -1.8 -8.5 2.3 61 61 A E E -CD 71 105A 54 44,-1.3 44,-1.7 -2,-0.3 2,-0.3 -0.842 14.4-168.0-119.7 156.8 1.6 -9.1 0.8 62 62 A Y E -CD 70 104A 11 8,-0.7 8,-2.8 -2,-0.3 6,-0.2 -0.964 27.9-113.3-149.1 127.4 4.0 -6.9 -1.1 63 63 A E - 0 0 68 40,-0.7 40,-0.1 -2,-0.3 2,-0.0 -0.331 36.3-163.0 -59.5 134.0 7.2 -7.8 -3.1 64 64 A D > - 0 0 41 -2,-0.0 3,-0.8 24,-0.0 -1,-0.1 0.040 44.6 -67.7 -97.9-152.4 10.3 -6.4 -1.4 65 65 A E T 3 S+ 0 0 155 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 0.870 140.0 39.8 -70.1 -38.6 13.8 -5.9 -2.8 66 66 A D T 3 S- 0 0 139 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 0.109 112.0-123.1 -96.0 19.3 14.4 -9.6 -3.1 67 67 A G < + 0 0 38 -3,-0.8 -4,-0.1 1,-0.2 -2,-0.1 0.874 65.2 143.0 37.0 56.8 10.8 -10.0 -4.3 68 68 A D - 0 0 129 -6,-0.2 -1,-0.2 0, 0.0 -5,-0.1 0.333 62.6-120.1-102.2 2.6 10.1 -12.4 -1.5 69 69 A R - 0 0 107 -8,-0.1 -6,-0.3 -5,-0.1 2,-0.1 0.920 29.6-142.2 55.2 100.6 6.6 -11.1 -1.0 70 70 A I E -C 62 0A 54 -8,-2.8 -8,-0.7 7,-0.0 2,-0.4 -0.236 7.4-127.2 -83.2 176.2 6.2 -9.7 2.5 71 71 A T E -C 61 0A 36 -10,-0.2 2,-0.6 -2,-0.1 -10,-0.2 -0.996 10.0-158.8-132.7 133.2 3.2 -10.0 4.7 72 72 A V E +C 60 0A 0 -12,-3.1 -12,-1.1 -2,-0.4 3,-0.1 -0.921 32.5 144.3-114.8 106.2 1.3 -7.2 6.5 73 73 A R S S+ 0 0 181 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.293 70.2 36.7-119.2 3.1 -0.8 -8.5 9.4 74 74 A S S >> S- 0 0 40 -3,-0.1 4,-1.7 1,-0.1 3,-1.5 -0.979 86.5-109.2-157.1 144.3 -0.2 -5.5 11.6 75 75 A D H 3> S+ 0 0 55 -2,-0.3 4,-2.4 1,-0.3 5,-0.3 0.790 118.6 67.1 -41.3 -31.7 0.2 -1.7 11.2 76 76 A E H 3> S+ 0 0 157 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.947 101.2 43.2 -55.7 -53.7 3.8 -2.5 12.1 77 77 A E H <> S+ 0 0 56 -3,-1.5 4,-3.1 2,-0.2 -1,-0.2 0.874 110.6 59.6 -60.1 -39.3 4.3 -4.4 8.9 78 78 A M H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.3 5,-0.4 0.973 101.6 48.7 -52.2 -67.1 2.5 -1.7 7.0 79 79 A K H X S+ 0 0 128 -4,-2.4 4,-1.3 1,-0.3 -1,-0.3 0.793 114.0 52.7 -44.3 -30.8 4.8 1.2 8.0 80 80 A A H X S+ 0 0 45 -4,-1.1 4,-1.5 -5,-0.3 -1,-0.3 0.966 106.1 48.8 -70.5 -55.3 7.5 -1.3 6.9 81 81 A M H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.3 3,-0.3 0.866 116.0 45.0 -51.6 -40.8 6.0 -2.0 3.5 82 82 A L H X S+ 0 0 5 -4,-2.7 4,-2.0 1,-0.2 -1,-0.3 0.797 106.0 61.1 -73.4 -30.0 5.7 1.7 3.0 83 83 A S H X S+ 0 0 84 -4,-1.3 4,-0.6 -5,-0.4 -1,-0.2 0.754 111.1 40.9 -67.0 -24.8 9.2 2.2 4.3 84 84 A Y H X S+ 0 0 42 -4,-1.5 4,-2.9 -3,-0.3 5,-0.4 0.899 108.5 56.5 -87.6 -49.8 10.3 0.0 1.4 85 85 A Y H X S+ 0 0 19 -4,-2.4 4,-4.0 1,-0.3 5,-0.2 0.887 115.1 40.4 -48.5 -46.1 8.1 1.4 -1.4 86 86 A Y H X S+ 0 0 58 -4,-2.0 4,-1.9 2,-0.2 -1,-0.3 0.832 114.0 53.2 -72.7 -34.2 9.5 4.8 -0.7 87 87 A S H < S+ 0 0 65 -4,-0.6 -2,-0.2 -5,-0.2 -1,-0.2 0.774 122.3 31.4 -70.7 -27.3 13.0 3.5 -0.2 88 88 A T H >X S+ 0 0 37 -4,-2.9 4,-1.7 2,-0.1 3,-0.5 0.817 115.1 57.7 -96.2 -41.7 12.7 1.8 -3.5 89 89 A V H >X S+ 0 0 13 -4,-4.0 4,-1.2 -5,-0.4 3,-1.0 0.950 105.4 51.0 -53.3 -55.0 10.5 4.2 -5.3 90 90 A M H 3X S+ 0 0 102 -4,-1.9 4,-1.8 1,-0.3 -1,-0.3 0.771 109.9 52.7 -54.0 -27.4 13.0 7.0 -4.7 91 91 A E H <> S+ 0 0 97 -3,-0.5 4,-1.4 2,-0.2 -1,-0.3 0.795 102.6 56.5 -78.3 -30.9 15.6 4.7 -6.2 92 92 A Q H