==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-JAN-02 1KV2 . COMPND 2 MOLECULE: P38 MAP KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.PARGELLIS,L.TONG,L.CHURCHILL,P.F.CIRILLO,T.GILMORE, . 325 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16509.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 11.7 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 . 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 . 20 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 26.8 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 1 0 1 0 0 1 0 1 1 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 1 1 0 3 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 . 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 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 5 A R 0 0 196 0, 0.0 3,-0.1 0, 0.0 89,-0.0 0.000 360.0 360.0 360.0 100.2 56.9 39.9 9.0 2 6 A P - 0 0 63 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.052 360.0 -78.3 -65.2 176.8 56.8 41.5 12.5 3 7 A T - 0 0 96 2,-0.0 15,-2.0 1,-0.0 2,-0.5 -0.684 47.1-156.5 -81.6 130.8 58.3 40.1 15.6 4 8 A F E -A 17 0A 46 -2,-0.4 2,-0.4 13,-0.3 11,-0.0 -0.927 6.5-159.0-106.9 132.3 56.1 37.3 16.9 5 9 A Y E -A 16 0A 66 11,-3.3 11,-1.6 -2,-0.5 2,-0.2 -0.888 8.2-135.0-115.1 150.6 56.4 36.5 20.6 6 10 A R E +A 15 0A 180 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.652 26.7 164.7 -99.1 155.3 55.4 33.3 22.4 7 11 A Q E -A 14 0A 66 7,-0.8 7,-2.4 -2,-0.2 2,-0.9 -0.880 33.7-127.7-171.5 138.5 53.5 32.9 25.6 8 12 A E E -A 13 0A 110 5,-0.3 2,-0.6 -2,-0.3 5,-0.3 -0.772 28.0-178.3 -96.5 98.0 51.7 30.1 27.3 9 13 A L E > -A 12 0A 23 3,-1.0 3,-1.8 -2,-0.9 2,-0.5 -0.876 62.8 -33.3-102.5 123.6 48.2 31.1 28.2 10 14 A N T 3 S- 0 0 77 -2,-0.6 -2,-0.0 1,-0.3 18,-0.0 -0.609 127.1 -31.9 72.0-120.7 46.1 28.5 30.1 11 15 A K T 3 S+ 0 0 102 -2,-0.5 -1,-0.3 2,-0.1 2,-0.2 0.329 129.3 92.4-107.8 4.8 47.2 25.1 28.8 12 16 A T E < -A 9 0A 41 -3,-1.8 -3,-1.0 -4,-0.0 2,-0.3 -0.590 68.2-136.7-103.3 159.3 47.8 26.9 25.5 13 17 A I E -A 8 0A 63 -5,-0.3 2,-0.4 -2,-0.2 -5,-0.3 -0.761 16.3-160.2-106.7 154.8 50.7 28.6 23.8 14 18 A W E -A 7 0A 3 -7,-2.4 -7,-0.8 -2,-0.3 2,-0.6 -0.964 12.3-177.1-142.2 121.1 50.3 31.9 21.9 15 19 A E E +A 6 0A 47 -2,-0.4 -9,-0.3 -9,-0.2 -2,-0.0 -0.834 27.2 155.4-119.5 90.2 52.7 33.2 19.3 16 20 A V E -A 5 0A 2 -11,-1.6 -11,-3.3 -2,-0.6 -2,-0.1 -0.814 46.2 -88.2-117.8 157.5 51.4 36.6 18.3 17 21 A P E > -A 4 0A 3 0, 0.0 3,-1.5 0, 0.0 -13,-0.3 -0.085 41.1-108.0 -56.5 158.0 53.0 39.8 16.8 18 22 A E T 3 S+ 0 0 83 -15,-2.0 22,-0.2 1,-0.3 -14,-0.1 0.872 110.6 74.8 -55.8 -40.7 54.5 42.5 19.2 19 23 A R T 3 S+ 0 0 69 -16,-0.2 21,-1.9 20,-0.1 22,-0.5 0.591 85.2 72.1 -50.5 -16.1 51.6 44.9 18.4 20 24 A Y E < +B 39 0B 2 -3,-1.5 19,-0.2 19,-0.2 2,-0.2 -0.932 64.9 161.5-108.5 127.0 49.3 42.9 20.6 21 25 A Q E +B 38 0B 86 17,-2.2 17,-1.1 -2,-0.5 3,-0.2 -0.446 44.1 48.4-124.7-162.0 49.8 43.1 24.4 22 26 A N E - 0 0 113 15,-0.2 2,-0.9 1,-0.2 -1,-0.2 0.794 68.1-163.9 22.4 68.2 48.0 42.5 27.6 23 27 A L E - 0 0 20 14,-0.2 14,-0.2 -3,-0.1 -1,-0.2 -0.692 10.8-178.7 -78.6 106.3 46.9 39.1 26.5 24 28 A S E -B 36 0B 61 12,-4.0 12,-3.7 -2,-0.9 -15,-0.0 -0.935 27.3-125.3-118.3 116.0 44.1 38.2 29.0 25 29 A P E +B 35 0B 75 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.270 37.7 163.2 -53.4 133.7 42.4 34.8 28.7 26 30 A V E - 0 0 87 8,-2.5 2,-0.3 1,-0.4 9,-0.2 0.645 59.6 -8.8-122.6 -40.1 38.6 35.4 28.4 27 31 A G E -B 34 0B 27 7,-2.1 7,-3.6 2,-0.0 -1,-0.4 -0.995 52.7-178.2-160.9 152.9 37.2 32.1 27.1 28 32 A S + 0 0 94 -2,-0.3 2,-0.4 5,-0.3 5,-0.2 -0.803 31.1 84.2-140.6 180.0 38.2 28.7 25.8 29 33 A G S S+ 0 0 46 -2,-0.3 2,-1.8 3,-0.2 3,-0.5 -0.944 75.3 14.4 135.4-151.5 36.5 25.6 24.5 30 34 A A S S+ 0 0 109 -2,-0.4 3,-0.1 1,-0.2 -2,-0.0 -0.566 125.5 35.1 -74.0 83.4 34.9 24.0 21.4 31 35 A Y S S- 0 0 43 -2,-1.8 21,-1.1 19,-0.1 -1,-0.2 -0.184 124.1 -74.1 164.7 -49.4 36.3 26.4 18.8 32 36 A G - 0 0 9 -3,-0.5 -3,-0.2 19,-0.3 19,-0.1 -0.031 66.2 -81.5 168.3 -57.8 39.7 27.5 19.9 33 37 A S - 0 0 11 -5,-0.2 17,-2.2 -3,-0.1 2,-0.4 0.015 34.1-135.3 127.0 128.8 40.1 29.9 22.8 34 38 A V E -BC 27 49B 25 -7,-3.6 -8,-2.5 15,-0.2 -7,-2.1 -0.876 13.3-169.3-115.3 142.9 39.8 33.7 23.0 35 39 A C E -BC 25 48B 3 13,-2.1 13,-2.7 -2,-0.4 2,-0.3 -0.987 21.8-130.3-128.1 136.5 42.0 36.2 24.7 36 40 A A E +BC 24 47B 6 -12,-3.7 -12,-4.0 -2,-0.4 2,-0.3 -0.696 39.8 169.9 -83.0 141.0 41.3 39.8 25.2 37 41 A A E - C 0 46B 0 9,-3.0 9,-4.4 -2,-0.3 2,-0.5 -0.970 33.5-114.8-149.4 164.5 44.3 42.0 24.2 38 42 A F E -BC 21 45B 64 -17,-1.1 -17,-2.2 -2,-0.3 2,-0.9 -0.902 20.2-145.1-108.9 124.8 45.3 45.6 23.5 39 43 A D E >> -B 20 0B 2 5,-3.4 4,-2.9 -2,-0.5 3,-1.0 -0.730 12.6-174.8 -91.4 99.1 46.4 46.7 20.0 40 44 A T T 34 S+ 0 0 90 -21,-1.9 -1,-0.2 -2,-0.9 -20,-0.1 0.682 82.6 65.8 -66.2 -16.8 49.1 49.3 20.2 41 45 A K T 34 S+ 0 0 142 -22,-0.5 -1,-0.3 1,-0.1 -21,-0.1 0.884 125.2 12.1 -73.9 -29.6 48.9 49.9 16.5 42 46 A T T <4 S- 0 0 71 -3,-1.0 -2,-0.2 2,-0.2 -1,-0.1 0.425 96.6-123.0-123.3 -2.1 45.4 51.3 16.9 43 47 A G S < S+ 0 0 44 -4,-2.9 2,-0.2 1,-0.2 -3,-0.2 0.339 70.6 126.9 76.6 -8.2 45.1 51.8 20.7 44 48 A L - 0 0 51 -5,-0.5 -5,-3.4 -6,-0.1 -1,-0.2 -0.570 63.2-121.3 -90.0 147.7 42.0 49.6 20.7 45 49 A R E -C 38 0B 104 -7,-0.3 59,-1.4 -2,-0.2 2,-0.3 -0.579 39.6-172.2 -78.9 144.1 41.3 46.6 22.9 46 50 A V E -CD 37 103B 0 -9,-4.4 -9,-3.0 57,-0.3 2,-0.5 -0.859 26.4-126.3-136.3 169.9 40.7 43.5 20.8 47 51 A A E -CD 36 102B 17 55,-3.0 55,-1.7 -2,-0.3 2,-0.5 -0.973 26.5-159.1-117.4 132.0 39.6 39.9 21.1 48 52 A V E -CD 35 101B 1 -13,-2.7 -13,-2.1 -2,-0.5 2,-0.6 -0.964 2.1-157.6-119.4 129.3 41.9 37.3 19.6 49 53 A K E -CD 34 100B 30 51,-3.4 51,-3.2 -2,-0.5 2,-0.7 -0.908 2.7-164.1-107.0 124.8 40.8 33.9 18.5 50 54 A K E - D 0 99B 20 -17,-2.2 2,-0.2 -2,-0.6 49,-0.2 -0.940 24.3-133.5-104.6 113.4 43.4 31.1 18.2 51 55 A L - 0 0 6 47,-2.4 47,-0.4 -2,-0.7 -19,-0.3 -0.524 22.3-122.3 -68.8 129.9 41.7 28.3 16.2 52 56 A S S S- 0 0 53 -21,-1.1 3,-0.1 1,-0.3 -20,-0.1 0.893 83.4 -19.1 -34.7-102.0 42.4 25.0 18.0 53 57 A R S > S- 0 0 153 1,-0.2 3,-1.4 44,-0.1 4,-0.3 -0.724 75.0-160.5-116.5 78.0 44.2 22.6 15.7 54 58 A P T 3 S+ 0 0 1 0, 0.0 10,-0.4 0, 0.0 -1,-0.2 0.694 82.0 20.0 -26.0 -49.1 43.2 24.4 12.5 55 59 A F T 3 S+ 0 0 28 41,-0.4 3,-0.1 1,-0.1 258,-0.0 -0.461 76.4 121.6-132.9 65.0 43.8 21.3 10.3 56 60 A Q S < S+ 0 0 104 -3,-1.4 2,-0.3 -2,-0.1 -1,-0.1 0.574 88.1 8.4 -96.5 -13.3 43.8 18.1 12.4 57 61 A S S > S- 0 0 41 -4,-0.3 4,-2.3 -3,-0.2 5,-0.1 -0.892 84.2 -99.9-152.3 176.5 41.0 16.6 10.3 58 62 A I H > S+ 0 0 80 -2,-0.3 4,-1.3 2,-0.2 5,-0.1 0.708 124.8 51.0 -77.4 -22.2 39.1 17.4 7.1 59 63 A I H > S+ 0 0 107 2,-0.2 4,-2.7 3,-0.2 5,-0.2 0.870 110.7 48.2 -82.1 -36.0 36.3 18.8 9.2 60 64 A H H > S+ 0 0 43 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.937 115.4 44.3 -66.0 -47.1 38.7 20.9 11.2 61 65 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.820 115.7 47.0 -68.5 -32.4 40.4 22.3 8.0 62 66 A K H X S+ 0 0 38 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.951 114.0 47.1 -73.6 -48.3 37.1 22.8 6.2 63 67 A R H X S+ 0 0 126 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.916 109.8 54.7 -56.7 -46.6 35.6 24.6 9.2 64 68 A T H >X S+ 0 0 7 -4,-2.8 3,-2.2 -10,-0.4 4,-1.9 0.976 109.8 45.5 -47.8 -72.3 38.7 26.7 9.7 65 69 A Y H 3X S+ 0 0 15 -4,-1.8 4,-2.1 1,-0.3 -1,-0.2 0.771 109.9 57.3 -41.7 -35.4 38.5 27.9 6.0 66 70 A R H 3X S+ 0 0 73 -4,-2.1 4,-0.8 2,-0.2 -1,-0.3 0.852 107.6 45.2 -71.6 -32.4 34.8 28.5 6.5 67 71 A E H XX S+ 0 0 46 -3,-2.2 4,-2.2 -4,-1.8 3,-0.7 0.945 113.0 49.9 -74.7 -48.9 35.3 30.9 9.5 68 72 A L H 3X S+ 0 0 2 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.935 111.7 47.6 -54.3 -50.9 38.1 32.8 7.9 69 73 A R H 3< S+ 0 0 27 -4,-2.1 4,-0.3 -5,-0.2 -1,-0.2 0.689 114.1 47.3 -66.2 -20.9 36.1 33.4 4.6 70 74 A L H XX S+ 0 0 40 -4,-0.8 3,-2.6 -3,-0.7 4,-1.7 0.955 112.8 44.5 -82.3 -60.4 33.0 34.5 6.4 71 75 A L H 3< S+ 0 0 29 -4,-2.2 11,-1.2 1,-0.3 -2,-0.2 0.737 109.6 60.2 -57.1 -22.5 34.4 36.9 8.8 72 76 A K T 3< S+ 0 0 44 -4,-1.4 -1,-0.3 -5,-0.4 -2,-0.2 0.712 111.1 39.1 -79.8 -17.0 36.5 38.2 5.9 73 77 A H T <4 S+ 0 0 39 -3,-2.6 2,-0.7 -4,-0.3 -2,-0.2 0.587 93.0 103.2-102.4 -16.8 33.2 39.1 4.1 74 78 A M < + 0 0 9 -4,-1.7 8,-0.5 1,-0.1 2,-0.2 -0.611 35.8 154.9 -77.2 113.6 31.4 40.3 7.2 75 79 A K + 0 0 164 -2,-0.7 2,-0.3 6,-0.1 5,-0.1 -0.737 27.2 110.5-140.1 83.6 31.4 44.1 7.2 76 80 A H B > -F 79 0C 14 3,-0.6 3,-0.9 -2,-0.2 50,-0.1 -0.979 65.7-124.6-153.0 154.2 28.5 45.4 9.2 77 81 A E T 3 S+ 0 0 114 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.891 111.7 47.3 -72.1 -40.7 28.2 47.3 12.5 78 82 A N T 3 S+ 0 0 8 76,-0.1 77,-0.4 47,-0.1 2,-0.3 -0.073 108.2 68.0 -93.6 35.1 25.8 44.8 14.0 79 83 A V B < S-F 76 0C 7 -3,-0.9 -3,-0.6 75,-0.2 77,-0.2 -0.956 91.3-103.7-153.9 133.2 27.9 41.8 13.0 80 84 A I - 0 0 30 75,-2.8 2,-0.3 -2,-0.3 -2,-0.1 -0.226 45.4-171.3 -57.2 140.7 31.4 40.8 14.1 81 85 A G - 0 0 11 -6,-0.1 2,-0.7 -4,-0.1 22,-0.4 -0.968 26.0 -94.1-140.9 159.5 34.1 41.6 11.6 82 86 A L + 0 0 19 -11,-1.2 20,-0.2 -8,-0.5 3,-0.1 -0.587 33.0 166.4 -82.7 109.2 37.8 41.1 10.9 83 87 A L S S- 0 0 23 18,-1.5 2,-0.3 -2,-0.7 -1,-0.2 0.959 75.4 -18.4 -76.2 -56.4 40.3 43.6 12.2 84 88 A D - 0 0 24 17,-0.3 17,-2.2 241,-0.1 -1,-0.3 -0.881 53.3-166.2-144.6 170.2 43.4 41.4 11.6 85 89 A V E +E 100 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.826 23.9 157.3-163.8 124.0 44.2 37.7 11.1 86 90 A F E -E 99 0B 15 13,-1.4 13,-2.1 -2,-0.3 -2,-0.0 -0.877 23.1-160.2-145.5 176.7 47.7 36.3 11.3 87 91 A T - 0 0 16 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.962 28.5-122.2-155.8 159.5 50.0 33.3 11.8 88 92 A P S S+ 0 0 22 0, 0.0 2,-0.4 0, 0.0 -84,-0.1 0.442 80.4 90.4 -88.3 -0.2 53.6 32.7 12.8 89 93 A A - 0 0 10 8,-0.3 2,-0.5 3,-0.0 -2,-0.1 -0.829 56.7-155.4-108.8 139.4 54.7 30.7 9.8 90 94 A R + 0 0 158 -2,-0.4 4,-0.4 4,-0.0 2,-0.1 -0.917 69.4 24.8-108.0 132.1 56.1 31.8 6.4 91 95 A S S > S- 0 0 15 -2,-0.5 4,-0.6 2,-0.1 3,-0.3 0.142 93.1 -94.4 91.9 148.1 55.6 29.5 3.5 92 96 A L T >4 S+ 0 0 67 1,-0.2 3,-1.3 2,-0.2 -1,-0.1 0.881 119.4 66.1 -62.0 -38.9 52.7 27.0 3.3 93 97 A E T 34 S+ 0 0 175 1,-0.3 -1,-0.2 -3,-0.0 -2,-0.1 0.903 105.2 42.7 -48.7 -49.5 54.8 24.1 4.7 94 98 A E T 34 S+ 0 0 89 -4,-0.4 2,-0.6 -3,-0.3 -1,-0.3 0.597 84.9 119.3 -75.3 -13.0 55.2 25.9 8.1 95 99 A F << + 0 0 0 -3,-1.3 3,-0.1 -4,-0.6 222,-0.1 -0.381 24.4 131.0 -59.6 103.6 51.5 26.9 8.2 96 100 A N + 0 0 107 -2,-0.6 -41,-0.4 1,-0.3 2,-0.4 0.697 56.1 41.6-125.4 -36.3 49.9 25.3 11.3 97 101 A D - 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