==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-MAR-08 3COI . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 13; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.ATWELL,S.K.BURLEY,A.HOULE,A.RAMOS,J.M.SAUDER,NEW YORK SGX . 344 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17234.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 61.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 12.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 1 0.3 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 . 19 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 1 0 1 0 1 1 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 1 2 0 1 2 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 . 1 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 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 0 A S 0 0 154 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-168.8 41.0 32.9 63.6 2 1 A L + 0 0 179 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.709 360.0 175.4 -91.5 142.8 39.8 29.6 65.0 3 2 A S - 0 0 73 -2,-0.3 4,-0.2 1,-0.0 3,-0.2 -0.995 36.8-151.7-149.7 150.0 36.2 28.5 64.6 4 3 A L > + 0 0 110 -2,-0.3 4,-2.4 1,-0.1 5,-0.3 0.246 68.5 107.4-104.0 11.5 33.9 25.6 65.2 5 4 A I H > S+ 0 0 120 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.917 81.4 44.8 -55.2 -49.8 31.5 26.3 62.3 6 5 A R H > S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.935 114.0 46.3 -64.5 -49.5 32.7 23.4 60.2 7 6 A K H 4 S+ 0 0 152 -4,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.863 118.3 42.7 -68.4 -31.1 32.8 20.8 62.9 8 7 A K H < S+ 0 0 149 -4,-2.4 -1,-0.2 1,-0.1 -2,-0.2 0.816 121.3 40.1 -77.5 -29.7 29.3 21.7 64.1 9 8 A G H < S+ 0 0 28 -4,-2.0 15,-2.1 -5,-0.3 2,-0.3 0.637 112.3 47.0 -98.0 -15.9 27.8 22.2 60.7 10 9 A F E < -A 23 0A 36 -4,-1.9 2,-0.3 13,-0.3 11,-0.0 -0.881 54.8-161.9-132.0 153.6 29.2 19.3 58.7 11 10 A Y E -A 22 0A 50 11,-2.5 11,-2.2 -2,-0.3 2,-0.4 -0.923 18.5-127.8-131.0 162.2 29.7 15.5 58.9 12 11 A K E +A 21 0A 152 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.871 28.7 166.1-112.4 141.3 32.0 13.2 56.9 13 12 A Q E -A 20 0A 83 7,-2.6 7,-2.7 -2,-0.4 2,-0.5 -0.970 33.0-125.9-154.0 138.4 31.0 9.9 55.2 14 13 A D E +A 19 0A 119 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.735 30.7 176.2 -82.4 126.2 32.5 7.6 52.7 15 14 A V E > S-A 18 0A 12 3,-2.6 3,-1.7 -2,-0.5 15,-0.1 -0.993 72.0 -10.9-132.1 123.5 30.2 7.0 49.7 16 15 A N T 3 S- 0 0 98 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.909 126.9 -58.9 52.6 47.6 31.4 4.8 46.8 17 16 A K T 3 S+ 0 0 100 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.606 117.1 113.1 58.5 15.7 35.0 4.9 48.2 18 17 A T E < S-A 15 0A 51 -3,-1.7 -3,-2.6 -5,-0.0 2,-0.5 -0.928 72.0-118.0-117.9 139.8 35.0 8.7 48.0 19 18 A A E -A 14 0A 60 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.661 31.8-169.8 -83.5 123.1 35.1 11.0 51.0 20 19 A W E -A 13 0A 3 -7,-2.7 -7,-2.6 -2,-0.5 2,-0.5 -0.896 11.0-165.8-112.8 141.6 32.0 13.2 51.3 21 20 A E E +A 12 0A 21 -2,-0.4 -9,-0.2 -9,-0.2 -2,-0.0 -0.936 21.5 174.5-129.4 110.2 31.6 16.1 53.6 22 21 A L E -A 11 0A 2 -11,-2.2 -11,-2.5 -2,-0.5 -2,-0.0 -0.839 37.7-100.9-121.4 148.3 28.0 17.3 54.0 23 22 A P E > -A 10 0A 21 0, 0.0 3,-1.8 0, 0.0 -13,-0.3 -0.319 43.4-114.1 -60.4 148.3 26.0 19.8 56.0 24 23 A K T 3 S+ 0 0 102 -15,-2.1 -14,-0.1 1,-0.3 22,-0.1 0.768 111.3 67.5 -65.4 -25.8 24.1 17.9 58.8 25 24 A T T 3 S+ 0 0 31 -16,-0.3 21,-3.1 1,-0.1 2,-0.8 0.689 87.3 75.4 -64.4 -20.5 20.7 18.7 57.3 26 25 A Y E < S+B 45 0B 9 -3,-1.8 19,-0.2 19,-0.2 2,-0.2 -0.845 72.1 176.1 -98.7 106.7 21.5 16.4 54.3 27 26 A V E +B 44 0B 44 17,-3.0 17,-2.8 -2,-0.8 -2,-0.0 -0.566 43.8 25.9-113.3 169.5 21.2 12.8 55.5 28 27 A S E S- 0 0 81 15,-0.2 -1,-0.2 -2,-0.2 2,-0.2 0.894 71.2-157.6 46.9 56.5 21.4 9.2 54.2 29 28 A P E - 0 0 10 0, 0.0 2,-0.4 0, 0.0 14,-0.2 -0.432 11.0-168.5 -65.1 127.2 23.7 10.0 51.2 30 29 A T E -B 42 0B 78 12,-3.0 12,-2.8 -2,-0.2 -15,-0.1 -0.979 24.0-112.7-127.1 129.6 23.3 7.3 48.5 31 30 A H E +B 41 0B 71 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.287 40.3 161.9 -59.6 130.4 25.4 6.7 45.5 32 31 A V E - 0 0 81 8,-3.0 2,-0.3 1,-0.4 9,-0.2 0.716 54.8 -42.3-113.9 -43.4 23.6 7.3 42.2 33 32 A G E -B 40 0B 23 7,-1.7 7,-2.9 2,-0.0 -1,-0.4 -0.989 42.0-130.6-180.0 172.8 26.3 7.8 39.5 34 33 A S E +B 39 0B 88 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.978 15.9 170.9-143.4 145.9 29.6 9.1 38.3 35 34 A G - 0 0 51 3,-2.6 3,-0.2 -2,-0.3 -2,-0.0 -0.797 53.1 -85.7-136.5-171.7 31.2 11.0 35.4 36 35 A A S S+ 0 0 69 -2,-0.2 3,-0.1 1,-0.2 0, 0.0 0.819 124.5 40.1 -63.6 -31.9 34.5 12.6 34.6 37 36 A Y S S- 0 0 77 1,-0.2 21,-2.1 20,-0.1 2,-0.3 0.572 124.6 -19.6-102.0 -11.7 33.6 15.9 36.3 38 37 A G E - C 0 57B 3 19,-0.3 -3,-2.6 -3,-0.2 2,-0.3 -0.988 53.0-116.0-174.3 173.8 31.7 14.8 39.4 39 38 A S E -BC 34 56B 6 17,-2.1 17,-3.2 -2,-0.3 2,-0.4 -0.987 23.8-141.3-132.1 151.5 29.7 12.2 41.3 40 39 A V E +BC 33 55B 26 -7,-2.9 -8,-3.0 -2,-0.3 -7,-1.7 -0.888 16.8 176.5-118.8 133.4 26.2 12.2 42.5 41 40 A C E -BC 31 54B 0 13,-2.6 13,-3.3 -2,-0.4 2,-0.3 -0.929 25.9-131.6-118.9 150.5 24.5 11.0 45.6 42 41 A S E +BC 30 53B 9 -12,-2.8 -12,-3.0 -2,-0.3 2,-0.3 -0.734 33.1 176.3 -91.0 154.6 20.9 11.3 46.6 43 42 A A E - C 0 52B 0 9,-2.0 9,-2.8 -2,-0.3 2,-0.5 -0.959 29.0-115.5-149.8 163.9 20.2 12.6 50.1 44 43 A I E -BC 27 51B 51 -17,-2.8 -17,-3.0 -2,-0.3 2,-1.0 -0.932 17.4-137.9-106.4 127.5 17.3 13.6 52.2 45 44 A D E >>> -BC 26 50B 19 5,-2.8 4,-2.8 -2,-0.5 3,-1.5 -0.785 17.4-156.7 -76.5 106.8 16.9 17.1 53.4 46 45 A K T 345S+ 0 0 149 -21,-3.1 -1,-0.2 -2,-1.0 -20,-0.1 0.687 84.7 70.1 -66.0 -17.9 15.9 16.3 57.0 47 46 A R T 345S+ 0 0 177 -22,-0.3 -1,-0.3 1,-0.1 -21,-0.1 0.808 123.1 8.8 -62.8 -33.0 14.1 19.7 57.3 48 47 A S T <45S- 0 0 75 -3,-1.5 -2,-0.2 2,-0.2 -1,-0.1 0.546 94.8-119.2-125.4 -19.7 11.4 18.6 54.9 49 48 A G T <5 + 0 0 50 -4,-2.8 -3,-0.2 1,-0.3 2,-0.1 0.379 67.2 141.2 84.5 -1.6 11.9 14.9 54.3 50 49 A E E < -C 45 0B 136 -5,-0.5 -5,-2.8 -6,-0.1 -1,-0.3 -0.442 52.6-118.7 -79.4 145.9 12.4 15.6 50.6 51 50 A K E +C 44 0B 106 -7,-0.2 59,-0.7 -2,-0.1 2,-0.3 -0.607 33.6 178.4 -80.4 135.8 15.0 13.9 48.3 52 51 A V E -CD 43 109B 9 -9,-2.8 -9,-2.0 -2,-0.3 2,-0.4 -0.893 26.7-124.0-129.2 162.8 17.7 15.9 46.6 53 52 A A E -CD 42 108B 10 55,-2.8 55,-3.0 -2,-0.3 2,-0.5 -0.926 23.8-164.6-104.5 135.1 20.6 15.2 44.3 54 53 A I E -CD 41 107B 0 -13,-3.3 -13,-2.6 -2,-0.4 2,-0.6 -0.990 2.6-159.4-123.8 126.1 24.0 16.3 45.4 55 54 A K E -CD 40 106B 43 51,-2.6 51,-2.2 -2,-0.5 2,-0.6 -0.917 3.5-156.7-104.9 120.4 27.0 16.4 43.0 56 55 A K E -CD 39 105B 38 -17,-3.2 -17,-2.1 -2,-0.6 49,-0.2 -0.847 25.5-124.8 -90.6 120.9 30.5 16.4 44.4 57 56 A L E -C 38 0B 6 47,-2.1 2,-0.9 -2,-0.6 -19,-0.3 -0.458 23.9-124.9 -65.6 136.7 32.8 18.0 41.9 58 57 A S S S- 0 0 36 -21,-2.1 4,-0.2 1,-0.2 -1,-0.1 -0.766 71.7 -43.5 -89.7 102.9 35.6 15.5 41.1 59 58 A R S > S- 0 0 210 -2,-0.9 3,-1.4 1,-0.1 -1,-0.2 0.915 72.4-178.7 43.1 62.7 39.0 17.2 41.8 60 59 A P T 3 S+ 0 0 6 0, 0.0 3,-0.4 0, 0.0 10,-0.2 0.725 75.0 54.1 -67.3 -18.5 37.9 20.5 40.0 61 60 A F T 3 S+ 0 0 34 41,-0.3 -2,-0.1 1,-0.2 3,-0.1 0.081 74.2 100.8-104.9 25.8 41.3 22.1 40.6 62 61 A Q S < S- 0 0 115 -3,-1.4 2,-0.3 1,-0.2 -1,-0.2 0.691 97.7 -3.0 -78.8 -21.2 43.4 19.4 39.0 63 62 A S S > S- 0 0 37 -3,-0.4 4,-2.3 -4,-0.2 -1,-0.2 -0.971 72.7-105.0-163.0 163.7 43.8 21.5 35.8 64 63 A E H > S+ 0 0 95 -2,-0.3 4,-2.9 2,-0.2 5,-0.3 0.845 118.1 57.0 -64.3 -35.2 42.6 24.8 34.2 65 64 A I H > S+ 0 0 117 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.942 111.1 41.3 -63.3 -48.7 40.2 22.8 32.0 66 65 A F H > S+ 0 0 38 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.906 116.8 48.8 -64.4 -43.4 38.4 21.2 34.9 67 66 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.903 112.1 47.3 -67.1 -45.3 38.4 24.4 37.0 68 67 A K H X S+ 0 0 40 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.894 112.1 50.4 -60.9 -41.4 37.1 26.6 34.2 69 68 A R H X S+ 0 0 28 -4,-2.0 4,-3.0 -5,-0.3 5,-0.2 0.935 109.5 50.9 -63.7 -43.9 34.3 24.0 33.4 70 69 A A H X S+ 0 0 3 -4,-2.2 4,-2.0 -10,-0.2 -1,-0.2 0.881 111.4 49.6 -58.6 -43.3 33.3 23.9 37.1 71 70 A Y H X S+ 0 0 14 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.956 113.0 44.5 -58.6 -53.5 33.1 27.7 37.1 72 71 A R H X S+ 0 0 16 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.899 112.5 52.2 -64.0 -40.0 31.0 27.9 33.9 73 72 A E H X S+ 0 0 13 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.939 109.9 48.9 -57.2 -46.9 28.7 25.1 35.1 74 73 A L H X S+ 0 0 1 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.913 111.6 49.6 -62.0 -43.4 28.1 26.9 38.4 75 74 A L H X S+ 0 0 18 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.921 112.5 47.2 -61.8 -46.0 27.3 30.1 36.7 76 75 A L H X S+ 0 0 2 -4,-2.5 4,-1.9 1,-0.2 3,-0.2 0.941 111.9 49.2 -61.5 -50.8 24.8 28.4 34.3 77 76 A L H < S+ 0 0 14 -4,-2.7 11,-1.0 1,-0.2 -1,-0.2 0.849 112.0 49.8 -58.7 -38.3 23.0 26.5 37.1 78 77 A K H < S+ 0 0 48 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.839 111.6 49.2 -66.9 -35.2 22.7 29.7 39.1 79 78 A H H < S+ 0 0 49 -4,-1.7 2,-0.3 -3,-0.2 -2,-0.2 0.860 92.4 83.4 -77.8 -34.3 21.3 31.7 36.2 80 79 A M < + 0 0 5 -4,-1.9 2,-0.3 6,-0.1 8,-0.3 -0.535 44.9 175.1 -84.9 129.7 18.6 29.4 34.9 81 80 A Q + 0 0 156 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.712 35.1 114.2-131.6 84.3 15.1 29.4 36.6 82 81 A H > - 0 0 21 3,-0.4 3,-1.4 -2,-0.3 -2,-0.0 -0.988 65.6-124.7-151.1 143.8 12.8 27.1 34.6 83 82 A E T 3 S+ 0 0 93 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.639 110.6 48.1 -63.6 -22.6 11.0 23.9 35.6 84 83 A N T 3 S+ 0 0 4 82,-0.1 83,-2.1 2,-0.1 2,-0.4 0.180 101.5 74.5-106.5 16.2 12.4 22.0 32.6 85 84 A V B < S-f 167 0C 3 -3,-1.4 -3,-0.4 81,-0.3 83,-0.1 -0.998 89.2-114.7-130.7 126.9 16.0 23.1 33.1 86 85 A I + 0 0 12 81,-2.3 2,-0.3 -2,-0.4 -6,-0.1 -0.379 46.1 173.3 -66.4 136.2 18.1 21.7 35.9 87 86 A G - 0 0 14 -4,-0.1 2,-0.4 -8,-0.1 -9,-0.2 -0.835 30.9 -84.9-138.6 179.8 18.9 24.4 38.5 88 87 A L + 0 0 25 -11,-1.0 20,-0.2 -8,-0.3 3,-0.1 -0.749 24.6 175.1 -99.1 126.1 20.5 24.9 41.9 89 88 A L S S- 0 0 83 18,-3.0 2,-0.3 -2,-0.4 19,-0.2 0.745 79.9 -15.6 -87.0 -31.1 18.8 24.5 45.2 90 89 A D E -E 107 0B 45 17,-1.5 17,-3.5 254,-0.1 -1,-0.4 -0.969 51.1-159.2-166.6 151.6 22.2 25.1 47.0 91 90 A V E +E 106 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.985 26.8 159.0-133.1 144.3 25.9 25.2 46.6 92 91 A F E -E 105 0B 16 13,-1.9 13,-2.2 -2,-0.3 3,-0.0 -0.982 28.4-151.9-155.6 159.9 28.4 24.9 49.4 93 92 A T - 0 0 18 -2,-0.3 11,-0.1 2,-0.2 -71,-0.0 -0.987 21.8-137.2-128.5 145.2 31.9 24.1 50.4 94 93 A P S S+ 0 0 5 0, 0.0 -85,-0.1 0, 0.0 10,-0.1 0.806 78.4 104.2 -61.5 -30.7 33.0 22.6 53.8 95 94 A A - 0 0 11 8,-0.4 -2,-0.2 1,-0.1 6,-0.1 -0.228 63.4-153.0 -55.7 139.4 35.9 25.1 53.7 96 95 A S S S+ 0 0 74 1,-0.1 2,-0.3 -93,-0.0 -1,-0.1 0.590 76.4 13.8 -87.9 -16.8 35.6 28.2 56.0 97 96 A S S > S- 0 0 40 1,-0.1 3,-0.6 0, 0.0 4,-0.1 -0.948 80.2-102.1-151.9 169.0 37.8 30.4 53.8 98 97 A L G > S+ 0 0 62 -2,-0.3 3,-1.8 1,-0.2 -1,-0.1 0.871 116.2 66.3 -60.8 -40.8 39.4 30.6 50.3 99 98 A R G 3 S+ 0 0 151 1,-0.3 -1,-0.2 -3,-0.0 -4,-0.0 0.841 111.9 33.8 -45.2 -40.8 42.7 29.6 51.9 100 99 A N G < S+ 0 0 79 -3,-0.6 2,-0.8 -6,-0.0 -1,-0.3 0.193 86.8 127.8-107.7 12.8 41.2 26.2 52.6 101 100 A F < + 0 0 0 -3,-1.8 3,-0.1 1,-0.2 236,-0.1 -0.595 13.9 127.9 -81.3 107.6 38.9 25.9 49.6 102 101 A Y + 0 0 142 -2,-0.8 2,-0.3 1,-0.3 -41,-0.3 0.551 63.2 41.3-129.2 -13.1 39.4 22.6 47.7 103 102 A D - 0 0 27 -44,-0.1 -8,-0.4 -43,-0.1 2,-0.3 -0.987 54.6-180.0-142.7 140.8 36.0 21.0 47.3 104 103 A F - 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