==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-NOV-05 2C6I . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.M.RICHARDSON,P.DOKURNO,J.B.MURRAY,A.E.SURGENOR . 292 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14661.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 63.0 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 . 42 14.4 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 . 18 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.3 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 3 1 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 . 2 1 1 0 2 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 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 80 0, 0.0 3,-1.2 0, 0.0 33,-0.0 0.000 360.0 360.0 360.0 -48.1 -12.6 31.3 -2.3 2 2 A E T 3 + 0 0 126 1,-0.3 22,-0.0 3,-0.1 0, 0.0 0.611 360.0 67.8 -78.4 -11.6 -12.9 31.3 -6.1 3 3 A N T 3 S+ 0 0 88 20,-0.1 21,-2.3 21,-0.1 22,-0.5 0.422 99.1 66.0 -79.4 -0.9 -10.9 34.5 -5.9 4 4 A F E < -A 23 0A 17 -3,-1.2 2,-0.6 19,-0.3 19,-0.2 -0.960 69.2-147.9-127.5 140.5 -8.0 32.4 -4.8 5 5 A Q E -A 22 0A 78 17,-3.2 17,-2.5 -2,-0.4 2,-0.1 -0.945 26.7-131.2-103.4 118.4 -5.9 29.8 -6.4 6 6 A K E +A 21 0A 90 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.448 27.1 176.9 -67.6 138.2 -4.7 27.2 -3.9 7 7 A V E - 0 0 71 13,-3.2 2,-0.3 1,-0.4 14,-0.2 0.746 60.5 -28.4-106.2 -50.3 -1.0 26.5 -4.1 8 8 A E E -A 20 0A 106 12,-1.5 12,-2.9 0, 0.0 -1,-0.4 -0.961 57.3-101.1-167.1 149.4 -0.4 24.0 -1.2 9 9 A K E +A 19 0A 122 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.594 36.1 174.2 -68.2 136.9 -1.7 22.9 2.2 10 10 A I E - 0 0 71 8,-2.7 2,-0.3 1,-0.4 9,-0.2 0.210 56.8 -19.3-131.3 6.8 0.6 24.4 4.9 11 11 A G E -A 18 0A 27 7,-0.8 7,-2.4 2,-0.0 -1,-0.4 -0.907 46.2-127.0 165.4 168.3 -1.1 23.4 8.1 12 12 A E E -A 17 0A 46 -2,-0.3 5,-0.2 5,-0.2 141,-0.1 -0.884 30.2-174.1-144.5 107.9 -4.2 22.2 10.0 13 13 A G E > -A 16 0A 23 3,-2.3 3,-0.7 -2,-0.3 141,-0.5 -0.185 47.5 -90.5 -88.3-177.2 -5.4 24.2 13.0 14 14 A T T 3 S+ 0 0 20 1,-0.2 3,-0.1 139,-0.1 138,-0.1 0.608 128.5 49.4 -65.0 -11.8 -8.1 23.7 15.6 15 15 A Y T 3 S- 0 0 18 1,-0.4 21,-3.9 20,-0.1 2,-0.3 0.433 120.8 -81.6-112.9 -1.5 -10.3 25.7 13.1 16 16 A G E < -A 13 0A 8 -3,-0.7 -3,-2.3 19,-0.2 -1,-0.4 -0.868 67.5 -22.2 133.2-165.4 -9.7 24.0 9.8 17 17 A V E -A 12 0A 20 17,-0.3 17,-1.6 -2,-0.3 2,-0.5 -0.484 45.0-148.7 -90.8 148.5 -7.2 23.8 7.0 18 18 A V E -AB 11 33A 19 -7,-2.4 -8,-2.7 15,-0.2 -7,-0.8 -0.965 15.6-173.9-118.8 125.0 -4.6 26.4 5.9 19 19 A Y E -AB 9 32A 60 13,-2.6 13,-3.5 -2,-0.5 2,-0.5 -0.942 29.7-129.5-115.8 143.2 -3.5 27.0 2.3 20 20 A K E +AB 8 31A 42 -12,-2.9 -13,-3.2 -2,-0.4 -12,-1.5 -0.773 49.7 170.8 -72.3 132.6 -0.9 29.0 0.7 21 21 A A E -AB 6 30A 0 9,-2.5 9,-2.5 -2,-0.5 2,-0.4 -0.935 31.1-132.2-146.2 158.0 -3.0 30.6 -2.0 22 22 A R E -AB 5 29A 91 -17,-2.5 -17,-3.2 -2,-0.3 2,-0.7 -0.978 24.9-119.5-121.2 137.2 -2.8 33.4 -4.6 23 23 A N E > -A 4 0A 25 5,-2.9 4,-1.9 -2,-0.4 -19,-0.3 -0.643 19.9-144.6 -73.2 111.7 -5.3 36.1 -5.2 24 24 A K T 4 S+ 0 0 134 -21,-2.3 -1,-0.2 -2,-0.7 -20,-0.1 0.736 93.5 36.9 -52.0 -27.4 -6.5 35.5 -8.8 25 25 A L T 4 S+ 0 0 160 -22,-0.5 -1,-0.2 3,-0.1 -21,-0.1 0.949 124.8 26.9 -89.3 -66.2 -6.8 39.4 -9.3 26 26 A T T 4 S- 0 0 92 2,-0.1 -2,-0.1 1,-0.1 -1,-0.1 0.627 94.7-123.3 -78.5 -14.7 -4.0 41.3 -7.4 27 27 A G < + 0 0 33 -4,-1.9 -3,-0.1 1,-0.3 -1,-0.1 0.264 55.5 156.2 86.3 -9.8 -1.4 38.6 -7.5 28 28 A E - 0 0 91 -6,-0.1 -5,-2.9 1,-0.1 2,-0.6 -0.156 38.9-140.3 -55.5 135.4 -1.0 38.6 -3.7 29 29 A V E +B 22 0A 51 -7,-0.2 48,-0.8 48,-0.1 2,-0.3 -0.927 36.7 166.4 -99.8 122.0 0.3 35.4 -2.1 30 30 A V E -BC 21 76A 0 -9,-2.5 -9,-2.5 -2,-0.6 2,-0.6 -0.828 44.7-110.6-130.8 163.6 -1.7 34.9 1.2 31 31 A A E -BC 20 75A 9 44,-2.4 44,-3.6 -2,-0.3 2,-0.5 -0.943 37.8-159.4 -93.0 121.8 -2.4 32.2 3.8 32 32 A L E -BC 19 74A 0 -13,-3.5 -13,-2.6 -2,-0.6 2,-0.6 -0.923 7.8-170.7-106.7 117.7 -6.0 31.2 3.3 33 33 A K E -BC 18 73A 22 40,-3.1 40,-2.4 -2,-0.5 2,-0.5 -0.927 10.3-156.7-113.2 114.9 -7.8 29.6 6.2 34 34 A K E - C 0 72A 78 -17,-1.6 2,-0.4 -2,-0.6 -17,-0.3 -0.812 23.5-134.9 -85.6 125.3 -11.3 28.1 5.7 35 35 A I - 0 0 14 36,-2.8 2,-0.5 -2,-0.5 36,-0.4 -0.673 9.8-134.7 -90.0 128.2 -12.9 28.0 9.2 36 36 A R 0 0 57 -21,-3.9 -1,-0.0 -2,-0.4 34,-0.0 -0.706 360.0 360.0 -78.9 126.9 -14.7 24.8 10.1 37 37 A L 0 0 128 -2,-0.5 -1,-0.1 2,-0.0 33,-0.0 -0.596 360.0 360.0 174.1 360.0 -18.1 25.4 11.7 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 49 0, 0.0 5,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 125.2 -21.4 31.5 10.7 40 45 A P > - 0 0 80 0, 0.0 4,-1.9 0, 0.0 3,-0.5 -0.167 360.0-124.2 -51.3 140.1 -22.6 32.7 14.1 41 46 A S H > S+ 0 0 61 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.805 109.3 51.7 -62.4 -36.0 -23.1 36.4 14.4 42 47 A T H > S+ 0 0 86 2,-0.2 4,-3.1 1,-0.2 -1,-0.3 0.821 105.3 54.9 -69.6 -35.5 -20.7 36.8 17.4 43 48 A A H > S+ 0 0 5 -3,-0.5 4,-2.9 2,-0.2 5,-0.3 0.946 108.9 50.1 -61.3 -46.7 -17.9 34.9 15.6 44 49 A I H X S+ 0 0 40 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.924 113.6 45.0 -51.4 -48.9 -18.3 37.5 12.7 45 50 A R H X S+ 0 0 161 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.931 114.4 46.5 -70.5 -43.2 -18.1 40.3 15.2 46 51 A E H X S+ 0 0 47 -4,-3.1 4,-1.4 1,-0.2 3,-0.4 0.960 114.4 48.8 -56.6 -53.9 -15.1 39.0 17.2 47 52 A I H X S+ 0 0 0 -4,-2.9 4,-0.9 -5,-0.2 3,-0.3 0.883 106.6 55.8 -57.2 -40.3 -13.2 38.2 14.0 48 53 A S H >< S+ 0 0 54 -4,-2.2 3,-0.5 -5,-0.3 4,-0.4 0.870 102.6 56.2 -64.9 -33.2 -14.0 41.7 12.6 49 54 A L H >X S+ 0 0 119 -4,-1.6 3,-1.4 -3,-0.4 4,-0.7 0.868 100.0 61.4 -56.8 -38.3 -12.4 43.3 15.7 50 55 A L H >< S+ 0 0 19 -4,-1.4 3,-0.7 -3,-0.3 11,-0.3 0.818 90.4 67.4 -62.4 -30.0 -9.3 41.3 14.8 51 56 A K T << S+ 0 0 63 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.718 103.2 45.4 -62.0 -25.5 -9.0 43.1 11.5 52 57 A E T <4 S+ 0 0 149 -3,-1.4 2,-2.1 -4,-0.4 -1,-0.2 0.592 86.6 93.3 -89.1 -19.7 -8.1 46.4 13.4 53 58 A L << + 0 0 15 -3,-0.7 2,-0.4 -4,-0.7 8,-0.2 -0.557 61.1 167.8 -81.1 77.9 -5.6 44.8 15.8 54 59 A N + 0 0 73 -2,-2.1 5,-0.1 6,-0.1 -3,-0.0 -0.823 6.7 148.8-104.4 131.3 -2.6 45.6 13.6 55 60 A H > - 0 0 45 3,-0.4 3,-2.2 -2,-0.4 54,-0.0 -0.967 53.8-115.9-155.5 149.1 1.0 45.3 14.7 56 61 A P T 3 S+ 0 0 91 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.735 118.3 48.2 -62.0 -16.6 4.4 44.5 13.0 57 62 A N T 3 S+ 0 0 10 80,-0.1 81,-2.6 48,-0.1 2,-0.4 0.178 98.7 79.2-110.7 15.6 4.6 41.3 15.2 58 63 A I B < S-e 138 0B 13 -3,-2.2 -3,-0.4 79,-0.3 2,-0.3 -0.988 91.5-111.9-118.5 128.4 1.1 40.1 14.5 59 64 A V - 0 0 7 79,-2.9 82,-0.2 -2,-0.4 2,-0.1 -0.481 44.3-111.1 -59.3 120.3 0.4 38.3 11.2 60 65 A K - 0 0 91 -2,-0.3 16,-2.6 -4,-0.1 2,-0.9 -0.363 17.0-142.5 -63.8 123.0 -1.9 40.8 9.4 61 66 A L E -D 75 0A 8 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.807 23.7-178.6 -80.1 106.5 -5.5 39.6 8.9 62 67 A L E - 0 0 35 12,-2.4 2,-0.3 -2,-0.9 13,-0.2 0.889 56.5 -6.0 -78.8 -40.0 -6.0 41.0 5.4 63 68 A D E -D 74 0A 80 11,-1.6 11,-2.7 -3,-0.1 2,-0.5 -0.998 46.9-145.4-157.1 149.2 -9.6 40.0 4.9 64 69 A V E -D 73 0A 27 -2,-0.3 2,-0.7 9,-0.2 9,-0.2 -0.991 22.0-160.7-112.8 124.0 -12.6 38.1 6.3 65 70 A I E -D 72 0A 31 7,-3.0 7,-2.3 -2,-0.5 2,-0.8 -0.920 10.1-178.0-112.9 108.8 -14.6 36.6 3.5 66 71 A H E +D 71 0A 90 -2,-0.7 2,-0.4 5,-0.2 5,-0.2 -0.841 27.4 147.6-107.8 96.2 -18.1 35.7 4.7 67 72 A T E > +D 70 0A 65 3,-1.5 3,-2.2 -2,-0.8 -2,-0.1 -0.980 56.0 0.0-142.4 133.7 -19.6 34.1 1.7 68 73 A E T 3 S- 0 0 161 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.845 126.8 -59.9 58.2 37.2 -22.2 31.4 0.8 69 74 A N T 3 S+ 0 0 137 1,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.686 118.3 113.7 60.1 23.0 -22.6 30.8 4.6 70 75 A K E < - 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0 0 7 -4,-2.4 -3,-0.1 -7,-0.2 99,-0.1 0.122 42.7 -62.6 80.7 150.5 20.8 25.8 18.7 94 99 A I S S- 0 0 11 97,-0.4 5,-0.1 1,-0.1 100,-0.0 -0.586 71.1-100.1 -55.5 131.4 19.4 29.1 17.5 95 100 A P >> - 0 0 78 0, 0.0 4,-2.0 0, 0.0 3,-1.1 -0.364 28.1-120.0 -58.3 138.6 22.1 31.7 18.6 96 101 A L H 3> S+ 0 0 65 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.738 111.0 59.5 -48.7 -40.2 21.1 33.5 21.9 97 102 A P H 3> S+ 0 0 67 0, 0.0 4,-2.0 0, 0.0 188,-0.4 0.886 110.5 43.2 -59.1 -36.6 21.1 37.0 20.2 98 103 A L H <> S+ 0 0 7 -3,-1.1 4,-3.0 2,-0.2 -2,-0.2 0.880 111.6 52.8 -77.5 -40.5 18.4 35.7 17.9 99 104 A I H X S+ 0 0 5 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.942 112.3 47.8 -51.6 -48.3 16.5 33.9 20.7 100 105 A K H X S+ 0 0 11 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.916 111.7 48.0 -63.6 -45.8 16.6 37.2 22.5 101 106 A S H X S+ 0 0 3 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.906 114.4 47.2 -61.4 -42.9 15.4 39.2 19.5 102 107 A Y H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.908 113.0 47.4 -66.4 -41.4 12.6 36.7 18.9 103 108 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.910 111.7 52.8 -64.8 -37.7 11.5 36.7 22.5 104 109 A F H X S+ 0 0 55 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.870 111.1 45.2 -65.5 -40.5 11.6 40.6 22.5 105 110 A Q H X S+ 0 0 13 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.850 111.2 51.5 -74.3 -38.1 9.4 40.9 19.4 106 111 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.916 108.8 51.8 -65.6 -42.7 6.8 38.3 20.6 107 112 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.826 108.4 52.2 -58.6 -37.9 6.6 40.2 23.9 108 113 A Q H X S+ 0 0 65 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.940 112.0 45.8 -62.2 -44.8 5.9 43.4 21.9 109 114 A G H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.908 115.2 47.5 -64.8 -41.6 3.1 41.7 20.0 110 115 A L H X S+ 0 0 0 -4,-2.8 4,-3.2 2,-0.2 5,-0.3 0.943 110.1 51.0 -64.9 -45.0 1.8 40.3 23.2 111 116 A A H X S+ 0 0 24 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.894 110.9 51.6 -60.3 -41.4 1.9 43.7 25.0 112 117 A F H X S+ 0 0 48 -4,-2.3 4,-0.9 2,-0.2 -1,-0.2 0.969 115.2 38.2 -57.0 -57.3 0.1 45.2 22.1 113 118 A C H ><>S+ 0 0 0 -4,-2.3 5,-2.7 1,-0.2 3,-0.7 0.893 114.5 54.8 -67.1 -39.3 -2.8 42.6 22.0 114 119 A H H ><5S+ 0 0 26 -4,-3.2 3,-1.7 1,-0.2 -1,-0.2 0.849 102.8 57.1 -57.4 -37.7 -2.9 42.4 25.9 115 120 A S H 3<5S+ 0 0 71 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.733 107.5 48.4 -69.6 -24.0 -3.4 46.2 26.0 116 121 A H T <<5S- 0 0 89 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.085 120.4-114.4 -95.3 17.9 -6.5 45.8 23.7 117 122 A R T < 5S+ 0 0 199 -3,-1.7 2,-0.5 1,-0.2 -3,-0.2 0.753 73.2 136.1 57.8 30.4 -7.6 43.0 26.1 118 123 A V < - 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