==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-AUG-07 2R3R . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.O.FISCHMANN,A.W.HRUZA,V.M.MADISON,J.S.DUCA . 290 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14277.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 63.4 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 . 39 13.4 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 . 15 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 2 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 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 49 0, 0.0 3,-2.1 0, 0.0 62,-0.0 0.000 360.0 360.0 360.0 -15.8 -13.1 31.0 -3.0 2 2 A E T 3 + 0 0 149 1,-0.3 22,-0.0 3,-0.0 0, 0.0 0.576 360.0 70.7 -67.9 -4.7 -13.0 31.0 -6.8 3 3 A N T 3 S+ 0 0 63 20,-0.1 21,-2.2 21,-0.0 22,-0.5 0.488 94.1 66.4 -88.1 -3.0 -10.7 34.0 -6.4 4 4 A F E < -A 23 0A 19 -3,-2.1 2,-0.6 19,-0.3 19,-0.2 -0.940 62.7-153.9-126.5 143.5 -7.9 31.7 -5.2 5 5 A Q E -A 22 0A 112 17,-2.8 17,-2.7 -2,-0.4 2,-0.1 -0.962 26.0-131.5-113.0 117.5 -5.7 28.9 -6.6 6 6 A K E -A 21 0A 109 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.428 22.6-176.2 -67.6 140.2 -4.5 26.5 -4.1 7 7 A V E - 0 0 56 13,-3.6 2,-0.3 1,-0.4 14,-0.2 0.788 58.7 -38.4-103.7 -49.2 -0.8 25.8 -4.4 8 8 A E E -A 20 0A 105 12,-1.3 12,-3.0 0, 0.0 -1,-0.4 -0.964 61.4 -88.8-170.5 161.2 -0.1 23.2 -1.8 9 9 A K E +A 19 0A 82 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.627 36.5 176.7 -79.0 134.5 -1.1 22.1 1.7 10 10 A I E - 0 0 63 8,-2.9 2,-0.3 1,-0.4 9,-0.2 0.351 59.3 -8.9-119.6 2.6 1.2 23.7 4.2 11 11 A G E -A 18 0A 25 7,-1.2 7,-2.7 2,-0.0 2,-0.7 -0.920 52.7-117.7 172.9 159.9 -0.4 22.5 7.4 12 12 A E E -A 17 0A 83 -2,-0.3 5,-0.2 5,-0.2 139,-0.0 -0.946 45.1-161.9-114.0 99.2 -3.2 20.7 9.3 13 13 A G - 0 0 15 3,-2.2 139,-0.4 -2,-0.7 140,-0.3 -0.232 32.6-101.1 -80.9 173.7 -4.6 23.4 11.5 14 14 A T S S+ 0 0 11 1,-0.2 138,-0.9 137,-0.1 139,-0.1 0.903 122.8 28.4 -56.3 -45.2 -6.8 23.1 14.6 15 15 A Y S S- 0 0 37 1,-0.2 2,-0.3 136,-0.2 -1,-0.2 0.548 130.4 -42.3 -98.0 -12.8 -9.9 24.0 12.6 16 16 A G S S- 0 0 4 19,-0.2 -3,-2.2 137,-0.0 -1,-0.2 -0.981 79.4 -39.3 169.1-177.5 -9.0 22.7 9.1 17 17 A V E -A 12 0A 15 -2,-0.3 17,-2.1 -5,-0.2 2,-0.5 -0.402 46.9-146.1 -71.4 146.3 -6.5 22.4 6.4 18 18 A V E -AB 11 33A 11 -7,-2.7 -8,-2.9 15,-0.2 -7,-1.2 -0.978 18.8-170.8-117.8 124.8 -4.2 25.3 5.7 19 19 A Y E -AB 9 32A 64 13,-2.5 13,-3.3 -2,-0.5 2,-0.5 -0.909 27.5-129.0-116.6 147.7 -3.1 25.9 2.1 20 20 A K E +AB 8 31A 41 -12,-3.0 -13,-3.6 -2,-0.4 -12,-1.3 -0.788 46.8 175.8 -82.6 134.2 -0.6 28.2 0.4 21 21 A A E -AB 6 30A 0 9,-3.0 9,-3.0 -2,-0.5 2,-0.5 -0.929 30.5-131.8-143.0 161.8 -2.7 29.9 -2.3 22 22 A R E -AB 5 29A 114 -17,-2.7 -17,-2.8 -2,-0.3 2,-0.9 -0.967 26.1-122.3-116.7 131.0 -2.5 32.5 -5.0 23 23 A N E > -A 4 0A 23 5,-3.3 4,-2.2 -2,-0.5 -19,-0.3 -0.629 23.5-142.8 -67.7 106.0 -5.1 35.2 -5.4 24 24 A K T 4 S+ 0 0 108 -21,-2.2 -1,-0.2 -2,-0.9 -20,-0.2 0.575 93.3 37.6 -50.9 -7.6 -6.1 34.4 -9.0 25 25 A L T 4 S+ 0 0 127 -22,-0.5 -1,-0.1 3,-0.1 -21,-0.1 0.792 122.9 27.7-106.9 -77.6 -6.3 38.2 -9.5 26 26 A T T 4 S- 0 0 105 1,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.618 95.9-125.9 -64.4 -15.0 -3.7 40.4 -7.7 27 27 A G < + 0 0 38 -4,-2.2 -1,-0.1 1,-0.3 -3,-0.1 0.322 55.0 158.1 83.7 -9.4 -1.3 37.5 -7.8 28 28 A E - 0 0 92 -6,-0.1 -5,-3.3 -5,-0.1 2,-0.5 -0.139 38.6-136.6 -47.7 137.2 -0.9 37.8 -4.0 29 29 A V E +B 22 0A 56 -7,-0.2 46,-0.6 -3,-0.1 2,-0.3 -0.880 38.0 161.7-102.0 127.7 0.5 34.6 -2.3 30 30 A V E -BC 21 74A 0 -9,-3.0 -9,-3.0 -2,-0.5 2,-0.5 -0.837 43.1-108.7-137.5 173.3 -1.5 33.9 0.9 31 31 A A E -BC 20 73A 9 42,-2.8 42,-3.2 -2,-0.3 2,-0.5 -0.950 32.7-159.3-108.6 128.6 -2.3 31.3 3.4 32 32 A L E -BC 19 72A 5 -13,-3.3 -13,-2.5 -2,-0.5 2,-0.5 -0.957 3.6-163.5-114.0 122.2 -5.9 30.1 3.2 33 33 A K E -BC 18 71A 29 38,-3.0 38,-2.4 -2,-0.5 2,-0.4 -0.910 8.7-150.6-109.0 126.2 -7.5 28.4 6.2 34 34 A K E C 0 70A 53 -17,-2.1 36,-0.2 -2,-0.5 -21,-0.1 -0.775 360.0 360.0 -89.4 130.8 -10.7 26.4 5.9 35 35 A I 0 0 38 34,-2.8 34,-0.8 -2,-0.4 -19,-0.2 -0.928 360.0 360.0-110.5 360.0 -12.7 26.5 9.2 36 ! 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 37 44 A V 0 0 63 0, 0.0 5,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 126.7 -21.5 29.7 11.0 38 45 A P >> - 0 0 83 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.246 360.0-128.1 -55.3 137.6 -22.8 31.2 14.3 39 46 A S H 3> S+ 0 0 71 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.834 106.1 61.9 -58.0 -37.5 -23.0 35.0 14.1 40 47 A T H 3> S+ 0 0 102 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.885 104.4 48.3 -58.3 -39.8 -21.0 35.4 17.3 41 48 A A H <> S+ 0 0 4 -3,-0.6 4,-3.0 2,-0.2 5,-0.3 0.942 110.8 51.3 -66.5 -43.4 -18.0 33.7 15.6 42 49 A I H X S+ 0 0 39 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.920 113.0 44.6 -59.7 -45.1 -18.4 35.9 12.5 43 50 A R H X S+ 0 0 156 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.940 114.9 48.3 -65.4 -45.7 -18.5 39.1 14.5 44 51 A E H X S+ 0 0 37 -4,-2.4 4,-0.9 -5,-0.2 -2,-0.2 0.928 115.3 44.0 -59.6 -50.2 -15.5 38.0 16.7 45 52 A I H >X S+ 0 0 0 -4,-3.0 3,-0.9 1,-0.2 4,-0.5 0.899 108.8 57.2 -63.5 -43.0 -13.4 37.0 13.8 46 53 A S H >< S+ 0 0 37 -4,-2.4 3,-1.4 -5,-0.3 4,-0.2 0.889 101.2 58.2 -57.3 -37.1 -14.3 40.1 11.8 47 54 A L H >< S+ 0 0 107 -4,-1.8 3,-1.7 1,-0.3 4,-0.4 0.808 93.6 66.8 -60.7 -33.2 -12.9 42.2 14.7 48 55 A L H X< S+ 0 0 12 -3,-0.9 3,-0.9 -4,-0.9 11,-0.3 0.697 81.7 77.9 -63.9 -18.9 -9.5 40.5 14.3 49 56 A K T << S+ 0 0 83 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.721 97.2 44.7 -62.4 -23.1 -9.1 42.2 10.9 50 57 A E T < S+ 0 0 163 -3,-1.7 2,-2.0 -4,-0.2 -1,-0.3 0.527 85.3 96.5 -97.4 -9.4 -8.2 45.4 12.8 51 58 A L < + 0 0 19 -3,-0.9 2,-0.4 -4,-0.4 8,-0.2 -0.536 60.1 165.0 -82.1 73.2 -5.9 43.8 15.3 52 59 A N + 0 0 73 -2,-2.0 5,-0.1 6,-0.1 6,-0.0 -0.815 9.1 143.2-104.7 132.0 -2.7 44.6 13.3 53 60 A H > - 0 0 45 -2,-0.4 3,-2.0 3,-0.4 54,-0.0 -0.977 56.0-110.9-159.1 151.7 0.9 44.5 14.4 54 61 A P T 3 S+ 0 0 89 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.739 117.7 50.1 -63.1 -20.7 4.2 43.5 12.8 55 62 A N T 3 S+ 0 0 9 80,-0.1 81,-2.5 48,-0.1 2,-0.4 0.165 97.7 78.9-104.8 20.5 4.5 40.5 15.0 56 63 A I B < S-e 136 0B 12 -3,-2.0 -3,-0.4 79,-0.3 2,-0.2 -0.985 90.9-111.7-124.4 131.0 1.0 39.2 14.3 57 64 A V - 0 0 7 79,-2.6 2,-0.2 -2,-0.4 81,-0.1 -0.498 44.3-109.2 -64.7 126.8 0.3 37.3 11.1 58 65 A K - 0 0 91 -2,-0.2 16,-2.6 -4,-0.1 2,-0.9 -0.406 19.1-144.9 -67.1 125.6 -2.0 39.7 9.1 59 66 A L E -D 73 0A 11 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.821 22.5-179.8 -86.0 104.5 -5.6 38.5 8.7 60 67 A L E - 0 0 31 12,-2.3 2,-0.3 -2,-0.9 13,-0.2 0.895 54.4 -15.5 -76.3 -44.4 -6.3 39.8 5.2 61 68 A D E -D 72 0A 88 11,-1.6 11,-2.9 2,-0.0 2,-0.4 -0.992 47.8-135.7-160.7 158.7 -9.9 38.8 4.8 62 69 A V E -D 71 0A 30 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.988 20.7-165.6-121.0 126.6 -12.8 36.6 6.0 63 70 A I E -D 70 0A 37 7,-3.2 7,-2.9 -2,-0.4 2,-0.6 -0.961 6.8-177.8-120.5 116.9 -14.9 34.8 3.4 64 71 A H E +D 69 0A 78 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.936 21.1 149.1-116.1 107.0 -18.2 33.2 4.4 65 72 A T E > +D 68 0A 74 3,-2.0 3,-1.9 -2,-0.6 -2,-0.0 -0.998 62.8 1.1-144.4 140.3 -20.0 31.3 1.6 66 73 A E T 3 S- 0 0 180 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.824 128.3 -61.9 55.4 32.4 -22.3 28.3 1.3 67 74 A N T 3 S+ 0 0 137 1,-0.3 2,-0.3 -30,-0.1 -1,-0.3 0.771 113.8 123.1 63.7 27.1 -22.1 28.2 5.1 68 75 A K E < - 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