==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-JUL-09 3I5Z . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.D.JACOBS,X.XIE . 331 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16773.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 62.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 13.0 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 . 19 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 29.3 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+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 1 1 0 2 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 1 3 0 0 1 1 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 6 A G 0 0 137 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 77.2 -3.4 -17.8 66.9 2 7 A A - 0 0 102 1,-0.1 3,-0.1 14,-0.0 13,-0.0 -0.420 360.0-137.0 -71.2 140.2 -2.1 -18.1 63.3 3 8 A G - 0 0 59 1,-0.2 -1,-0.1 -2,-0.1 2,-0.0 0.197 52.6 -26.9 -77.5-159.1 1.6 -18.9 62.7 4 9 A P - 0 0 82 0, 0.0 -1,-0.2 0, 0.0 9,-0.2 -0.283 68.0-119.3 -55.7 132.2 4.1 -17.4 60.2 5 10 A E E -A 12 0A 58 7,-1.2 7,-2.7 -3,-0.1 2,-0.3 -0.295 29.3-155.0 -66.3 158.4 2.5 -16.1 57.0 6 11 A M E -A 11 0A 126 5,-0.2 2,-0.4 15,-0.1 5,-0.2 -0.997 16.7-179.9-143.9 136.3 3.6 -17.7 53.7 7 12 A V E > S-A 10 0A 11 3,-1.8 3,-0.6 -2,-0.3 15,-0.1 -0.976 74.2 -22.7-137.9 123.5 3.7 -16.5 50.1 8 13 A R T 3 S- 0 0 187 -2,-0.4 2,-0.9 1,-0.3 -1,-0.1 0.870 125.7 -48.3 43.8 51.1 5.0 -18.6 47.1 9 14 A G T 3 S+ 0 0 56 1,-0.1 -1,-0.3 0, 0.0 2,-0.1 -0.514 115.4 92.7 100.9 -65.0 7.0 -20.9 49.4 10 15 A Q E < S-A 7 0A 62 -2,-0.9 -3,-1.8 -3,-0.6 2,-0.2 -0.357 74.8-109.6 -78.3 147.4 9.1 -18.6 51.6 11 16 A V E -A 6 0A 68 -5,-0.2 2,-0.6 -2,-0.1 -5,-0.2 -0.436 17.9-161.0 -78.3 139.7 8.0 -17.5 55.1 12 17 A F E -A 5 0A 0 -7,-2.7 2,-1.7 -2,-0.2 -7,-1.2 -0.892 6.1-168.2-118.7 96.8 7.0 -13.9 56.0 13 18 A D + 0 0 91 -2,-0.6 82,-0.1 -9,-0.2 80,-0.0 -0.563 34.8 138.9 -90.1 77.4 7.2 -13.5 59.7 14 19 A V > - 0 0 4 -2,-1.7 4,-1.6 1,-0.3 3,-0.2 0.001 50.8-141.4-114.6 23.6 5.4 -10.2 60.1 15 20 A G T 4 - 0 0 38 1,-0.2 -1,-0.3 2,-0.2 3,-0.2 0.158 45.9 -40.4 61.6-162.3 3.5 -11.2 63.2 16 21 A P T 4 S+ 0 0 115 0, 0.0 -1,-0.2 0, 0.0 22,-0.1 0.717 127.0 67.2 -77.2 -21.5 -0.0 -10.3 64.2 17 22 A R T 4 S+ 0 0 79 -3,-0.2 21,-2.6 1,-0.2 2,-0.6 0.907 100.9 46.0 -64.8 -44.5 0.1 -6.7 62.9 18 23 A Y E < S+B 37 0B 2 -4,-1.6 -4,-0.2 -3,-0.2 19,-0.2 -0.902 72.4 145.7-112.4 117.3 0.4 -7.6 59.2 19 24 A T E +B 36 0B 40 17,-1.9 17,-3.5 -2,-0.6 -2,-0.0 -0.642 38.7 62.2-133.1-173.5 -1.9 -10.2 57.7 20 25 A N E S- 0 0 103 15,-0.2 2,-0.2 -2,-0.2 -1,-0.2 0.947 72.9-162.8 54.3 57.1 -3.7 -11.1 54.4 21 26 A L E + 0 0 25 14,-0.1 2,-0.3 -3,-0.1 14,-0.2 -0.487 14.4 179.5 -82.8 141.2 -0.5 -11.4 52.4 22 27 A S E -B 34 0B 63 12,-1.8 12,-2.6 -2,-0.2 -15,-0.1 -0.998 30.8-108.1-145.0 133.9 -0.4 -11.3 48.6 23 28 A Y E +B 33 0B 57 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.318 42.8 154.1 -59.5 133.7 2.4 -11.5 46.0 24 29 A I E - 0 0 87 8,-2.2 2,-0.3 1,-0.4 9,-0.2 0.505 61.1 -34.1-131.3 -18.8 3.3 -8.3 44.2 25 30 A G E -B 32 0B 18 7,-1.8 7,-3.3 2,-0.0 -1,-0.4 -0.980 47.5-136.2 173.5 176.8 7.0 -8.7 43.2 26 31 A E E -B 31 0B 146 5,-0.3 5,-0.3 -2,-0.3 2,-0.2 -0.909 5.5-161.3-148.2 168.6 10.5 -9.9 43.8 27 32 A G E > -B 30 0B 50 3,-2.6 3,-1.0 -2,-0.3 -2,-0.0 -0.840 49.4 -76.2-143.9-175.7 14.2 -9.2 43.7 28 33 A A T 3 S+ 0 0 79 1,-0.3 3,-0.1 -2,-0.2 29,-0.0 0.684 129.0 11.9 -61.6 -19.7 17.6 -11.0 43.6 29 34 A Y T 3 S+ 0 0 38 19,-0.1 21,-3.3 28,-0.1 2,-0.3 -0.027 127.0 27.0-151.7 33.8 17.4 -11.8 47.4 30 35 A G E < -BC 27 49B 16 -3,-1.0 -3,-2.6 19,-0.2 2,-0.3 -0.989 59.4-121.5-175.2-176.4 13.8 -11.0 48.4 31 36 A M E -BC 26 48B 12 17,-1.6 17,-3.2 -2,-0.3 2,-0.5 -0.995 14.4-140.7-146.8 145.3 10.1 -10.6 47.8 32 37 A V E +BC 25 47B 39 -7,-3.3 -8,-2.2 -2,-0.3 -7,-1.8 -0.936 23.5 177.5-111.7 127.8 7.6 -7.8 48.1 33 38 A C E -BC 23 46B 0 13,-2.7 13,-3.7 -2,-0.5 2,-0.3 -0.909 28.3-125.6-121.5 154.3 4.0 -8.5 49.3 34 39 A S E -BC 22 45B 8 -12,-2.6 -12,-1.8 -2,-0.3 2,-0.3 -0.683 38.0-178.4 -86.8 154.7 1.0 -6.3 50.0 35 40 A A E - C 0 44B 0 9,-2.6 9,-3.3 -2,-0.3 2,-0.6 -0.993 31.7-109.5-152.2 155.6 -0.4 -6.8 53.5 36 41 A Y E -BC 19 43B 78 -17,-3.5 -17,-1.9 -2,-0.3 2,-0.8 -0.798 26.2-150.3 -88.8 122.1 -3.2 -5.6 55.8 37 42 A D E >> -BC 18 42B 2 5,-3.1 4,-1.5 -2,-0.6 5,-0.9 -0.836 4.9-163.9 -89.9 110.8 -1.9 -3.4 58.6 38 43 A N T 45S+ 0 0 79 -21,-2.6 -1,-0.1 -2,-0.8 -20,-0.1 0.466 85.7 51.0 -77.9 0.8 -4.3 -3.9 61.5 39 44 A V T 45S+ 0 0 81 -22,-0.2 -1,-0.2 3,-0.1 -21,-0.0 0.838 120.8 28.7 -98.1 -52.0 -3.1 -0.7 63.3 40 45 A N T 45S- 0 0 106 2,-0.2 -2,-0.2 0, 0.0 3,-0.1 0.589 101.5-132.8 -83.5 -10.2 -3.4 1.8 60.5 41 46 A K T <5 + 0 0 152 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.908 69.1 101.1 56.3 48.6 -6.3 -0.2 58.9 42 47 A V E + 0 0 1 0, 0.0 3,-1.9 0, 0.0 7,-0.4 0.467 34.2 102.0-103.1 -2.6 20.9 -10.7 52.0 52 57 A F T 3 S+ 0 0 29 40,-0.4 268,-0.1 1,-0.3 41,-0.1 0.629 71.0 64.8 -70.6 -16.7 23.2 -12.1 54.7 53 58 A E T 3 S+ 0 0 138 -3,-0.3 2,-0.4 1,-0.1 -1,-0.3 0.632 105.7 51.7 -76.2 -12.4 24.9 -14.9 52.7 54 59 A H <> - 0 0 96 -3,-1.9 4,-1.7 1,-0.1 5,-0.1 -0.990 65.3-149.9-136.1 133.9 26.5 -12.2 50.4 55 60 A Q H > S+ 0 0 57 -2,-0.4 4,-2.1 2,-0.2 5,-0.1 0.883 100.6 54.7 -61.8 -44.7 28.5 -9.0 51.1 56 61 A T H > S+ 0 0 62 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.939 110.1 46.2 -57.5 -48.3 27.2 -7.2 48.0 57 62 A Y H > S+ 0 0 60 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.832 109.6 53.8 -63.9 -36.4 23.6 -7.7 49.0 58 63 A C H X S+ 0 0 0 -4,-1.7 4,-2.3 -7,-0.4 -1,-0.2 0.872 109.7 50.2 -66.5 -36.8 24.3 -6.6 52.6 59 64 A Q H X S+ 0 0 12 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.975 111.6 46.0 -59.9 -58.8 25.8 -3.4 51.1 60 65 A R H X S+ 0 0 54 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.857 113.2 51.2 -52.6 -42.6 22.7 -2.8 48.9 61 66 A T H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.955 112.5 44.0 -61.7 -53.4 20.4 -3.5 51.9 62 67 A L H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.880 113.4 51.6 -61.8 -41.0 22.2 -1.1 54.2 63 68 A R H X S+ 0 0 11 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.958 111.0 46.6 -59.0 -54.1 22.5 1.7 51.5 64 69 A E H X S+ 0 0 4 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.935 113.8 48.0 -54.7 -52.8 18.8 1.6 50.7 65 70 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.942 114.3 45.6 -55.4 -54.4 17.7 1.6 54.3 66 71 A K H X S+ 0 0 30 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.920 116.1 46.0 -54.2 -48.8 20.0 4.5 55.2 67 72 A I H X S+ 0 0 0 -4,-2.9 4,-3.3 -5,-0.2 -2,-0.2 0.938 115.1 45.1 -63.5 -48.7 19.1 6.6 52.2 68 73 A L H < S+ 0 0 4 -4,-3.0 11,-0.3 -5,-0.2 -1,-0.2 0.855 110.0 54.6 -66.5 -36.1 15.3 6.1 52.5 69 74 A L H < S+ 0 0 27 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.933 116.6 39.0 -60.6 -43.9 15.3 6.8 56.2 70 75 A R H < S+ 0 0 121 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.955 102.2 82.1 -69.7 -54.7 17.0 10.1 55.5 71 76 A F < - 0 0 14 -4,-3.3 2,-0.3 -5,-0.2 62,-0.0 -0.152 52.0-177.1 -57.2 143.1 15.2 11.1 52.3 72 77 A R + 0 0 220 6,-0.1 2,-0.3 3,-0.0 5,-0.1 -0.780 24.9 133.6-143.6 103.0 11.8 12.7 52.5 73 78 A H > - 0 0 19 3,-0.4 3,-2.0 -2,-0.3 56,-0.0 -0.990 57.7-126.2-155.2 137.7 10.1 13.5 49.3 74 79 A E T 3 S+ 0 0 115 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.751 111.6 45.7 -51.6 -32.4 6.6 13.1 47.7 75 80 A N T 3 S+ 0 0 0 82,-0.1 83,-2.9 53,-0.1 2,-0.4 0.145 101.7 76.9-104.5 20.5 8.1 11.2 44.6 76 81 A I B < S-f 158 0C 7 -3,-2.0 -3,-0.4 81,-0.3 83,-0.2 -0.998 86.1-111.7-129.8 133.1 10.4 8.8 46.5 77 82 A I - 0 0 5 81,-2.3 2,-0.2 -2,-0.4 -2,-0.1 -0.324 36.7-156.2 -60.0 137.8 9.2 5.7 48.4 78 83 A G - 0 0 23 -4,-0.1 2,-0.4 -6,-0.1 21,-0.3 -0.467 13.9-117.3-105.5-177.7 9.6 6.0 52.2 79 84 A I + 0 0 23 -11,-0.3 19,-0.2 -2,-0.2 3,-0.1 -0.996 25.1 175.0-125.2 129.1 9.9 3.5 55.1 80 85 A N - 0 0 84 17,-2.8 2,-0.3 -2,-0.4 18,-0.2 0.720 68.4 -4.4-101.6 -31.5 7.3 3.3 57.8 81 86 A D E -E 97 0B 24 16,-1.2 16,-2.6 2,-0.0 -1,-0.4 -0.975 54.7-148.3-159.4 155.5 8.5 0.4 59.8 82 87 A I E -E 96 0B 1 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.990 13.7-165.1-134.2 129.6 11.2 -2.3 59.9 83 88 A I E +E 95 0B 38 12,-3.0 12,-3.1 -2,-0.4 2,-0.3 -0.935 23.1 135.4-114.5 137.0 10.8 -5.8 61.3 84 89 A R - 0 0 15 -2,-0.4 10,-0.1 10,-0.2 7,-0.1 -0.953 56.6 -59.3-163.2 173.4 13.5 -8.3 62.2 85 90 A A - 0 0 22 8,-0.5 6,-0.1 -2,-0.3 0, 0.0 -0.171 44.5-119.3 -62.0 147.8 14.5 -10.7 64.9 86 91 A P S S+ 0 0 103 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.707 98.5 42.5 -61.3 -22.9 15.1 -9.4 68.5 87 92 A T S >> S- 0 0 55 1,-0.1 4,-0.8 0, 0.0 3,-0.8 -0.957 81.3-125.7-126.7 150.7 18.7 -10.7 68.3 88 93 A I T 34 S+ 0 0 41 -2,-0.3 3,-0.4 1,-0.2 -3,-0.1 0.816 107.4 63.2 -60.7 -35.0 21.4 -10.6 65.6 89 94 A E T 34 S+ 0 0 134 1,-0.2 -1,-0.2 3,-0.0 -4,-0.0 0.856 110.3 38.8 -58.7 -38.7 21.9 -14.4 65.8 90 95 A Q T <4 S+ 0 0 124 -3,-0.8 2,-1.2 2,-0.0 3,-0.3 0.541 87.2 109.5 -88.8 -10.7 18.3 -15.0 64.6 91 96 A M < + 0 0 0 -4,-0.8 3,-0.1 -3,-0.4 233,-0.1 -0.565 25.5 137.3 -71.7 98.9 18.3 -12.1 62.1 92 97 A K + 0 0 135 -2,-1.2 -40,-0.4 1,-0.2 2,-0.3 0.506 68.2 35.9-110.2 -15.8 18.2 -13.9 58.8 93 98 A D - 0 0 42 -3,-0.3 -8,-0.5 -43,-0.1 2,-0.4 -0.977 62.6-154.4-140.9 147.8 15.6 -11.7 57.2 94 99 A V E -D 49 0B 0 -45,-2.3 -45,-2.4 -2,-0.3 2,-0.5 -0.990 8.6-155.8-124.3 135.4 14.7 -8.0 57.3 95 100 A Y E -DE 48 83B 8 -12,-3.1 -12,-3.0 -2,-0.4 2,-0.6 -0.951 3.9-164.8-114.9 113.9 11.1 -6.7 56.5 96 101 A I E -DE 47 82B 1 -49,-2.5 -49,-2.7 -2,-0.5 2,-0.5 -0.872 10.0-152.7 -97.1 116.3 10.8 -3.1 55.3 97 102 A V E +DE 46 81B 1 -16,-2.6 -17,-2.8 -2,-0.6 -16,-1.2 -0.775 26.1 165.1 -93.3 127.0 7.2 -1.8 55.5 98 103 A Q E -D 45 0B 19 -53,-3.1 -53,-2.8 -2,-0.5 2,-0.1 -0.853 43.9 -70.6-136.9 168.4 6.3 0.9 53.0 99 104 A D E -D 44 0B 75 -21,-0.3 2,-0.5 -2,-0.3 -55,-0.1 -0.431 53.9-121.6 -58.3 129.4 3.4 2.7 51.4 100 105 A L - 0 0 56 -57,-0.5 2,-0.3 -2,-0.1 -1,-0.1 -0.648 27.9-163.5 -77.5 121.9 1.5 0.4 49.1 101 106 A M - 0 0 23 -2,-0.5 50,-0.2 1,-0.1 3,-0.1 -0.705 22.9-125.2-100.6 161.8 1.3 1.6 45.5 102 107 A E S S- 0 0 133 48,-1.2 2,-0.3 -2,-0.3 49,-0.2 0.876 74.3 -38.4 -73.9 -42.2 -1.1 0.3 42.9 103 108 A T E -G 150 0C 39 47,-2.1 47,-3.1 -3,-0.0 2,-0.3 -0.882 58.2-101.7-164.6-171.9 1.3 -0.8 40.1 104 109 A D E > -G 149 0C 37 45,-0.3 4,-1.9 -2,-0.3 45,-0.2 -0.860 33.0-108.1-127.6 165.6 4.6 0.1 38.3 105 110 A L H > S+ 0 0 0 43,-2.4 4,-2.5 40,-1.1 41,-0.2 0.831 115.5 62.2 -62.2 -32.9 5.4 1.7 35.0 106 111 A Y H 4 S+ 0 0 123 39,-1.1 4,-0.4 42,-0.3 -1,-0.2 0.950 109.8 37.9 -55.5 -53.3 6.6 -1.7 33.7 107 112 A K H > S+ 0 0 101 1,-0.2 4,-0.8 2,-0.2 3,-0.4 0.819 114.8 54.8 -71.7 -33.4 3.2 -3.4 34.1 108 113 A L H >X S+ 0 0 23 -4,-1.9 4,-2.2 1,-0.2 3,-1.0 0.922 106.9 48.8 -67.0 -44.5 1.3 -0.3 33.0 109 114 A L H 3< S+ 0 0 9 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.568 105.1 63.7 -71.2 -10.0 3.1 -0.0 29.7 110 115 A K H 34 S+ 0 0 122 -4,-0.4 -1,-0.3 -3,-0.4 -2,-0.2 0.780 121.1 16.6 -78.3 -31.5 2.4 -3.7 29.3 111 116 A T H << S+ 0 0 89 -3,-1.0 2,-0.4 -4,-0.8 -2,-0.2 0.496 118.3 59.2-123.1 -10.0 -1.4 -3.1 29.1 112 117 A Q < - 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