==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-DEC-04 1Y8Y . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.S.WILLIAMSON,M.J.PARRATT,C.J.TORRANCE,J.F.BOWER,J.D.MOORE, . 292 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14566.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 13.7 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 0 0 2 0 1 0 0 0 1 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 1 0 1 2 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 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 1 A M > 0 0 33 0, 0.0 3,-2.7 0, 0.0 64,-0.0 0.000 360.0 360.0 360.0 -31.8 39.6 30.9 39.1 2 2 A E T 3 + 0 0 154 1,-0.3 22,-0.0 3,-0.0 0, 0.0 0.572 360.0 69.2 -61.9 -12.2 39.5 31.2 42.9 3 3 A N T 3 S+ 0 0 64 20,-0.1 21,-2.1 21,-0.1 22,-0.5 0.504 100.0 60.5 -80.2 -4.9 37.2 34.2 42.5 4 4 A F E < -A 23 0A 22 -3,-2.7 2,-0.4 19,-0.2 19,-0.2 -0.938 63.4-157.5-127.9 144.3 34.5 31.8 41.2 5 5 A Q E -A 22 0A 83 17,-1.6 17,-2.1 -2,-0.3 2,-0.4 -0.989 30.0-118.0-120.5 135.4 32.7 28.8 42.6 6 6 A K E +A 21 0A 122 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.536 28.8 178.9 -80.4 123.1 31.1 26.4 40.2 7 7 A V E - 0 0 49 13,-2.5 2,-0.3 1,-0.4 14,-0.2 0.896 63.0 -34.2 -87.1 -52.0 27.3 26.1 40.5 8 8 A E E -A 20 0A 108 12,-1.8 12,-3.3 0, 0.0 -1,-0.4 -0.965 57.7 -93.0-164.2 159.9 26.8 23.6 37.7 9 9 A K E +A 19 0A 117 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.602 34.8 172.3 -68.0 130.3 27.8 22.1 34.4 10 10 A I E - 0 0 65 8,-2.9 2,-0.2 1,-0.4 9,-0.2 0.060 59.6 -18.1-131.9 20.5 25.7 23.7 31.6 11 11 A G E -A 18 0A 28 7,-0.5 7,-3.3 2,-0.1 2,-0.7 -0.607 42.1-122.8 154.3 148.5 27.6 22.3 28.7 12 12 A E E -A 17 0A 80 5,-0.2 5,-0.2 -2,-0.2 141,-0.1 -0.926 51.1-170.5-102.9 93.0 30.5 20.6 27.0 13 13 A G - 0 0 23 3,-1.6 141,-0.3 -2,-0.7 142,-0.3 -0.119 40.4 -80.4 -74.6-177.9 31.0 23.4 24.4 14 14 A T S S+ 0 0 12 1,-0.2 140,-0.6 139,-0.1 141,-0.1 0.842 126.3 25.2 -52.3 -39.5 33.3 23.3 21.4 15 15 A Y S S- 0 0 24 1,-0.2 21,-1.3 138,-0.2 2,-0.3 0.702 126.9 -36.7-106.7 -24.2 36.5 24.1 23.4 16 16 A G S S- 0 0 8 19,-0.2 -3,-1.6 20,-0.1 2,-0.2 -0.931 81.8 -41.5-175.6-168.7 35.8 23.0 26.9 17 17 A V E -A 12 0A 27 -2,-0.3 17,-2.5 -5,-0.2 2,-0.5 -0.567 46.0-146.0 -79.7 141.9 33.4 22.7 29.7 18 18 A V E -AB 11 33A 14 -7,-3.3 -8,-2.9 -2,-0.2 -7,-0.5 -0.965 19.3-170.6-108.7 124.7 30.9 25.5 30.3 19 19 A Y E -AB 9 32A 67 13,-3.2 13,-4.1 -2,-0.5 2,-0.5 -0.902 27.6-132.4-117.1 142.4 29.9 26.1 33.9 20 20 A K E +AB 8 31A 41 -12,-3.3 -13,-2.5 -2,-0.4 -12,-1.8 -0.833 48.2 171.7 -78.3 130.3 27.3 28.3 35.6 21 21 A A E -AB 6 30A 0 9,-2.9 9,-2.8 -2,-0.5 2,-0.4 -0.936 30.5-126.6-144.1 164.2 29.5 29.9 38.3 22 22 A R E -AB 5 29A 110 -17,-2.1 -17,-1.6 -2,-0.3 2,-1.2 -0.949 20.3-125.7-121.2 133.8 29.3 32.7 40.9 23 23 A N E > -A 4 0A 23 5,-3.0 4,-2.5 -2,-0.4 -19,-0.2 -0.652 21.1-152.3 -77.7 98.0 31.7 35.6 41.4 24 24 A K T 4 S+ 0 0 132 -21,-2.1 -1,-0.2 -2,-1.2 -20,-0.1 0.607 90.0 37.5 -52.3 -15.8 32.6 35.1 45.1 25 25 A L T 4 S+ 0 0 141 -22,-0.5 -1,-0.1 3,-0.1 -2,-0.0 0.840 127.0 27.2 -91.1 -78.2 33.3 38.8 45.5 26 26 A T T 4 S- 0 0 96 1,-0.1 -2,-0.2 2,-0.0 -3,-0.1 0.338 94.7-132.0 -73.2 1.1 30.7 40.7 43.4 27 27 A G < + 0 0 51 -4,-2.5 -1,-0.1 1,-0.2 -3,-0.1 0.180 52.9 148.3 70.3 -16.9 28.1 38.0 43.7 28 28 A E - 0 0 82 -5,-0.2 -5,-3.0 -6,-0.1 2,-0.5 -0.030 46.0-131.4 -56.2 146.1 27.3 38.0 39.9 29 29 A V E +B 22 0A 55 -7,-0.2 48,-0.6 48,-0.1 2,-0.3 -0.880 37.3 171.6-101.3 132.6 26.2 34.8 38.3 30 30 A V E -BC 21 76A 1 -9,-2.8 -9,-2.9 -2,-0.5 2,-0.5 -0.900 39.0-112.7-138.9 158.9 28.2 34.1 35.1 31 31 A A E -BC 20 75A 11 44,-2.3 44,-3.0 -2,-0.3 2,-0.5 -0.920 35.6-157.7 -92.7 127.3 28.8 31.4 32.4 32 32 A L E -BC 19 74A 8 -13,-4.1 -13,-3.2 -2,-0.5 2,-0.5 -0.932 7.1-167.6-117.1 117.8 32.4 30.2 32.7 33 33 A K E -BC 18 73A 28 40,-2.8 40,-2.3 -2,-0.5 2,-0.5 -0.906 9.7-152.6-108.1 122.7 34.1 28.6 29.8 34 34 A K E - C 0 72A 75 -17,-2.5 2,-0.5 -2,-0.5 38,-0.2 -0.820 18.7-140.6 -90.5 132.3 37.4 26.7 30.1 35 35 A I E - C 0 71A 7 36,-3.3 2,-0.8 -2,-0.5 36,-0.8 -0.852 23.2-107.1-103.2 126.4 39.3 26.8 26.8 36 36 A R 0 0 59 -21,-1.3 -20,-0.1 -2,-0.5 -1,-0.1 -0.231 360.0 360.0 -46.6 89.3 41.2 23.7 25.7 37 37 A L 0 0 95 -2,-0.8 -1,-0.2 34,-0.1 33,-0.1 0.417 360.0 360.0 -13.3 360.0 44.8 24.8 26.3 38 ! 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 39 44 A V 0 0 46 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 156.9 47.7 29.4 24.7 40 45 A P >> - 0 0 84 0, 0.0 4,-1.3 0, 0.0 3,-0.7 -0.340 360.0-120.0 -74.4 153.5 49.3 31.3 21.8 41 46 A S H 3> S+ 0 0 64 1,-0.3 4,-1.8 2,-0.2 5,-0.2 0.771 107.4 60.0 -66.9 -36.9 49.5 35.0 21.8 42 47 A T H 3> S+ 0 0 93 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.816 104.6 52.4 -57.8 -38.1 47.5 35.7 18.7 43 48 A A H <> S+ 0 0 4 -3,-0.7 4,-3.9 2,-0.2 5,-0.2 0.924 107.7 50.5 -64.9 -44.4 44.5 34.0 20.3 44 49 A I H X S+ 0 0 40 -4,-1.3 4,-2.5 1,-0.2 -2,-0.2 0.879 114.3 44.9 -59.9 -41.2 44.8 36.3 23.5 45 50 A R H X S+ 0 0 160 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.854 114.4 49.2 -70.2 -39.6 44.9 39.3 21.3 46 51 A E H X S+ 0 0 55 -4,-2.1 4,-0.7 2,-0.2 3,-0.5 0.964 113.9 44.8 -64.9 -54.5 42.0 38.0 19.2 47 52 A I H >X S+ 0 0 0 -4,-3.9 3,-1.7 1,-0.2 4,-0.6 0.933 108.2 58.7 -53.4 -49.3 39.9 37.2 22.3 48 53 A S H >< S+ 0 0 40 -4,-2.5 3,-1.2 1,-0.3 4,-0.4 0.841 98.7 58.3 -52.3 -36.8 40.7 40.6 23.8 49 54 A L H >< S+ 0 0 108 -4,-1.4 3,-0.8 -3,-0.5 4,-0.3 0.745 96.9 63.8 -64.7 -22.8 39.3 42.5 20.8 50 55 A L H X< S+ 0 0 17 -3,-1.7 3,-0.8 -4,-0.7 11,-0.3 0.708 84.5 73.3 -72.9 -24.8 36.0 40.8 21.5 51 56 A K T << S+ 0 0 73 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.755 100.5 46.3 -58.2 -25.6 35.6 42.5 24.9 52 57 A E T < S+ 0 0 155 -3,-0.8 2,-1.8 -4,-0.4 -1,-0.2 0.606 86.6 92.8 -89.8 -18.1 34.9 45.7 23.0 53 58 A L < + 0 0 16 -3,-0.8 2,-0.4 -4,-0.3 8,-0.2 -0.563 60.5 166.7 -85.1 82.4 32.3 44.1 20.6 54 59 A N + 0 0 69 -2,-1.8 5,-0.1 6,-0.1 -3,-0.0 -0.829 7.4 147.1-111.0 129.0 29.3 44.9 22.7 55 60 A H > - 0 0 43 3,-0.5 3,-2.0 -2,-0.4 54,-0.0 -0.981 54.8-113.7-157.1 148.6 25.6 44.7 21.5 56 61 A P T 3 S+ 0 0 87 0, 0.0 4,-0.1 0, 0.0 80,-0.1 0.676 118.2 48.1 -62.5 -12.1 22.3 43.8 23.2 57 62 A N T 3 S+ 0 0 9 80,-0.1 81,-2.4 2,-0.1 2,-0.5 0.221 97.2 79.1-113.8 16.7 22.1 40.7 21.0 58 63 A I B < S-e 138 0B 9 -3,-2.0 -3,-0.5 79,-0.3 2,-0.3 -0.988 91.2-113.3-119.0 125.0 25.6 39.4 21.6 59 64 A V - 0 0 8 79,-2.1 82,-0.2 -2,-0.5 81,-0.2 -0.464 45.5-112.6 -55.8 119.2 26.2 37.6 24.9 60 65 A K - 0 0 91 -2,-0.3 16,-2.1 1,-0.1 2,-0.7 -0.354 16.6-138.7 -66.3 125.6 28.6 40.0 26.7 61 66 A L E +D 75 0A 10 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.822 24.8 179.8 -78.3 114.5 32.2 38.9 27.2 62 67 A L E - 0 0 43 12,-2.7 2,-0.3 -2,-0.7 13,-0.2 0.874 55.8 -11.4 -87.2 -44.4 32.9 40.1 30.8 63 68 A D E -D 74 0A 92 11,-1.5 11,-2.8 2,-0.0 2,-0.4 -0.987 46.3-139.4-156.6 161.5 36.4 38.9 31.3 64 69 A V E -D 73 0A 29 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.998 22.1-166.9-123.0 122.2 39.4 36.8 30.0 65 70 A I E -D 72 0A 35 7,-3.2 7,-2.9 -2,-0.4 2,-0.5 -0.953 6.0-177.6-119.2 125.7 41.4 35.0 32.6 66 71 A H E +D 71 0A 79 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.896 19.3 146.0-129.9 95.0 44.8 33.4 31.7 67 72 A T E > +D 70 0A 65 3,-1.0 3,-2.8 -2,-0.5 -2,-0.0 -0.984 64.0 6.0-140.0 156.5 46.6 31.5 34.5 68 73 A E T 3 S- 0 0 158 -2,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.872 127.1 -67.1 35.8 48.6 48.9 28.4 34.7 69 74 A N T 3 S+ 0 0 123 1,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.660 111.7 121.5 47.6 22.3 48.7 28.6 30.9 70 75 A K E < - 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0 0 8 -4,-2.8 -3,-0.1 -7,-0.2 99,-0.1 0.139 42.7 -55.4 73.6 156.4 5.7 25.3 17.4 94 99 A I S S- 0 0 11 97,-0.5 5,-0.1 1,-0.1 -8,-0.0 -0.506 70.0-102.2 -60.1 129.5 7.1 28.7 18.3 95 100 A P >> - 0 0 80 0, 0.0 4,-2.4 0, 0.0 3,-0.6 -0.218 27.5-120.3 -55.3 140.8 4.5 31.3 17.3 96 101 A L H 3> S+ 0 0 75 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.847 111.6 57.4 -53.6 -38.4 5.4 33.0 14.1 97 102 A P H 3> S+ 0 0 65 0, 0.0 4,-2.0 0, 0.0 188,-0.4 0.877 110.0 45.9 -60.6 -38.9 5.5 36.5 15.8 98 103 A L H <> S+ 0 0 7 -3,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.838 111.6 50.6 -72.6 -35.7 8.1 35.2 18.2 99 104 A I H X S+ 0 0 6 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.944 111.9 49.1 -61.7 -47.9 10.1 33.5 15.3 100 105 A K H X S+ 0 0 11 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.900 112.2 47.6 -58.0 -45.8 10.1 36.8 13.4 101 106 A S H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.914 112.9 48.3 -65.4 -41.6 11.3 38.7 16.5 102 107 A Y H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.966 113.7 46.9 -60.9 -52.9 14.0 36.3 17.2 103 108 A L H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.904 112.3 52.0 -48.5 -42.8 15.2 36.4 13.5 104 109 A F H X S+ 0 0 54 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.900 112.1 44.0 -70.0 -38.0 15.0 40.2 13.7 105 110 A Q H X S+ 0 0 7 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.846 112.7 51.0 -72.8 -38.1 17.2 40.4 16.8 106 111 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.912 108.8 53.3 -68.2 -42.9 19.7 37.8 15.6 107 112 A L H X S+ 0 0 0 -4,-2.8 4,-3.1 -5,-0.2 -1,-0.2 0.843 107.4 50.2 -54.1 -40.8 20.0 39.8 12.4 108 113 A Q H X S+ 0 0 63 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.926 110.4 50.9 -66.1 -45.3 20.7 43.0 14.3 109 114 A G H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.925 113.8 43.6 -53.7 -51.5 23.4 41.1 16.3 110 115 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.934 110.0 55.7 -57.8 -52.9 25.0 39.8 13.0 111 116 A A H X S+ 0 0 23 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.908 110.4 47.9 -51.8 -39.0 24.7 43.3 11.3 112 117 A F H X S+ 0 0 48 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.912 116.4 39.5 -63.6 -52.5 26.7 44.7 14.3 113 118 A C H ><>S+ 0 0 0 -4,-2.0 5,-2.6 1,-0.2 3,-0.6 0.900 115.7 52.1 -70.5 -37.8 29.5 42.2 14.4 114 119 A H H ><5S+ 0 0 25 -4,-3.1 3,-1.9 1,-0.3 -2,-0.2 0.837 100.8 60.8 -69.1 -30.9 29.7 42.0 10.6 115 120 A S H 3<5S+ 0 0 76 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.839 108.7 46.0 -60.6 -30.2 30.0 45.8 10.4 116 121 A H T <<5S- 0 0 78 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.154 120.7-112.9 -95.3 13.5 33.2 45.3 12.5 117 122 A R T < 5S+ 0 0 195 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.694 73.8 134.5 60.5 22.8 34.3 42.4 10.2 118 123 A V < - 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