==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-OCT-97 1AWJ . COMPND 2 MOLECULE: ITK; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR A.H.ANDREOTTI,S.C.BUNNELL,S.FENG,L.J.BERG,S.L.SCHREIBER . 77 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5838.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 27 35.1 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 . 4 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 1.3 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 . 9 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 3.9 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+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 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 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A K 0 0 252 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -52.3 81.7 5.9 -3.1 2 4 A K + 0 0 96 3,-0.0 0, 0.0 2,-0.0 0, 0.0 -0.566 360.0 177.5-163.2 92.8 78.3 5.8 -1.3 3 5 A P - 0 0 110 0, 0.0 51,-0.0 0, 0.0 0, 0.0 0.196 45.6 -70.8 -77.7-158.7 78.0 4.3 2.2 4 6 A L - 0 0 67 65,-0.0 3,-0.1 67,-0.0 51,-0.0 -0.890 45.0-142.0-107.1 132.3 74.8 4.2 4.2 5 7 A P - 0 0 51 0, 0.0 66,-0.0 0, 0.0 67,-0.0 -0.172 34.4 -79.8 -78.9 176.9 73.2 7.4 5.6 6 8 A P - 0 0 114 0, 0.0 66,-0.0 0, 0.0 65,-0.0 -0.238 50.3-152.7 -73.2 164.3 71.5 7.8 9.0 7 9 A T - 0 0 52 -3,-0.1 2,-0.1 22,-0.1 65,-0.1 -0.915 17.3 -94.2-139.9 168.9 67.9 6.7 9.4 8 10 A P - 0 0 42 0, 0.0 2,-0.8 0, 0.0 3,-0.3 -0.438 28.5-134.0 -79.1 151.3 64.7 7.3 11.3 9 11 A E + 0 0 170 1,-0.2 -2,-0.0 -2,-0.1 0, 0.0 -0.702 67.0 111.2-109.7 81.9 63.8 5.2 14.4 10 12 A D + 0 0 130 -2,-0.8 -1,-0.2 2,-0.0 17,-0.0 0.384 33.6 131.2-129.0 -2.8 60.2 4.2 14.0 11 13 A N + 0 0 89 -3,-0.3 3,-0.1 1,-0.2 64,-0.1 -0.244 20.5 133.8 -52.7 137.0 60.5 0.5 13.3 12 14 A R - 0 0 197 1,-0.6 2,-0.2 2,-0.0 -1,-0.2 0.262 60.9 -13.3-150.0 -72.0 58.0 -1.3 15.6 13 15 A R - 0 0 146 1,-0.2 -1,-0.6 62,-0.0 63,-0.0 -0.528 66.6 -99.8-127.9-163.3 55.8 -4.1 14.2 14 16 A S - 0 0 50 63,-0.2 -1,-0.2 -2,-0.2 63,-0.2 0.093 21.5-154.4-100.9-143.7 54.8 -5.4 10.7 15 17 A F - 0 0 90 1,-0.3 -1,-0.1 61,-0.2 61,-0.1 0.075 55.6 -39.9-159.0 -78.4 51.6 -4.7 8.7 16 18 A Q + 0 0 100 1,-0.0 -1,-0.3 0, 0.0 8,-0.1 0.250 42.9 176.5-130.8-101.7 50.3 -7.2 6.1 17 19 A E + 0 0 96 60,-0.2 7,-0.1 6,-0.1 60,-0.0 0.507 44.3 118.7 100.7 7.2 52.5 -9.1 3.6 18 20 A P + 0 0 118 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.646 51.3 104.6 -77.8 -13.0 49.8 -11.3 1.9 19 21 A E S S- 0 0 93 1,-0.1 4,-0.0 2,-0.1 0, 0.0 -0.003 77.3-120.6 -57.7 173.7 50.7 -9.6 -1.4 20 22 A E S S- 0 0 167 3,-0.0 -1,-0.1 0, 0.0 26,-0.0 0.857 84.8 -20.8 -84.4 -92.3 52.8 -11.6 -3.9 21 23 A T S S+ 0 0 54 2,-0.0 -2,-0.1 24,-0.0 24,-0.0 0.797 119.3 87.6 -90.1 -30.6 56.1 -9.9 -4.8 22 24 A L + 0 0 11 1,-0.1 24,-0.2 21,-0.1 21,-0.1 -0.315 51.3 159.9 -65.8 151.8 55.0 -6.4 -3.6 23 25 A V - 0 0 34 22,-1.3 -6,-0.1 1,-0.1 -1,-0.1 -0.046 36.8-115.8-139.2-116.1 55.5 -5.6 0.1 24 26 A I - 0 0 3 19,-0.2 20,-0.6 20,-0.1 18,-0.3 0.111 15.6-170.0-160.3 -74.8 55.8 -2.3 2.0 25 27 A A - 0 0 5 50,-1.6 2,-1.5 1,-0.2 17,-0.3 0.998 24.4-149.6 63.8 61.1 59.0 -1.2 3.7 26 28 A L + 0 0 37 49,-0.7 2,-0.3 15,-0.2 -1,-0.2 -0.450 47.1 126.8 -66.9 92.5 57.4 1.7 5.6 27 29 A Y - 0 0 14 -2,-1.5 2,-1.6 -3,-0.2 15,-0.2 -0.987 60.9-132.8-150.7 138.4 60.4 4.1 5.8 28 30 A D + 0 0 95 -2,-0.3 2,-0.3 13,-0.1 12,-0.2 -0.552 37.1 179.9 -90.6 75.2 61.0 7.7 4.7 29 31 A Y B -A 39 0A 14 -2,-1.6 10,-1.6 10,-0.6 2,-0.5 -0.577 23.5-132.8 -78.6 135.5 64.3 7.2 2.9 30 32 A Q + 0 0 156 -2,-0.3 2,-0.3 8,-0.2 -1,-0.0 -0.753 45.5 137.5 -90.2 126.3 65.8 10.4 1.5 31 33 A T + 0 0 30 -2,-0.5 7,-0.6 1,-0.1 -2,-0.0 -0.918 28.2 175.7-167.3 138.2 67.0 10.0 -2.1 32 34 A N + 0 0 162 -2,-0.3 -1,-0.1 5,-0.1 5,-0.1 0.599 43.6 122.8-119.3 -23.2 66.9 12.1 -5.4 33 35 A D > - 0 0 83 1,-0.2 3,-0.6 3,-0.1 5,-0.1 -0.164 62.1-138.0 -43.9 128.8 69.0 10.0 -7.7 34 36 A P T 3 S+ 0 0 125 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.529 101.4 62.7 -70.9 -4.2 66.7 9.2 -10.7 35 37 A Q T 3 S+ 0 0 128 1,-0.3 2,-0.5 32,-0.0 -2,-0.1 0.819 111.2 33.7 -89.6 -33.3 68.1 5.6 -10.6 36 38 A E S < S- 0 0 18 -3,-0.6 30,-0.4 30,-0.1 -1,-0.3 -0.780 84.4-143.5-123.4 90.0 66.7 4.9 -7.1 37 39 A L - 0 0 74 28,-1.1 30,-0.4 -2,-0.5 -5,-0.1 -0.237 31.7-111.5 -49.7 131.4 63.4 6.7 -6.5 38 40 A A - 0 0 40 -7,-0.6 2,-0.4 28,-0.1 -8,-0.2 0.178 34.6-110.0 -52.9-172.8 63.5 7.7 -2.8 39 41 A L B -A 29 0A 14 -10,-1.6 -10,-0.6 1,-0.2 -1,-0.1 -0.983 28.4-178.1-131.4 133.9 61.1 5.9 -0.4 40 42 A R - 0 0 179 -2,-0.4 -1,-0.2 -12,-0.2 -15,-0.0 0.916 52.5 -95.1 -89.2 -75.7 58.0 7.3 1.3 41 43 A C S S+ 0 0 43 -15,-0.2 2,-0.3 -13,-0.1 -15,-0.2 0.272 82.1 97.8 157.0 47.7 56.5 4.5 3.5 42 44 A D S S- 0 0 80 -18,-0.3 2,-1.9 -17,-0.3 -15,-0.1 -0.886 89.1 -64.6-142.8 174.9 53.8 2.7 1.6 43 45 A E S S+ 0 0 93 -2,-0.3 -19,-0.2 1,-0.2 -18,-0.1 -0.407 84.8 120.7 -65.0 88.2 53.3 -0.5 -0.5 44 46 A E + 0 0 46 -2,-1.9 2,-0.3 -20,-0.6 16,-0.3 0.107 41.7 96.8-138.9 22.9 55.6 0.6 -3.3 45 47 A Y + 0 0 1 1,-0.1 -22,-1.3 15,-0.1 13,-0.1 -0.847 35.0 164.1-113.8 151.3 58.3 -2.2 -3.3 46 48 A Y S S+ 0 0 81 -2,-0.3 -1,-0.1 -24,-0.2 14,-0.1 0.556 70.8 11.8-129.3 -71.9 58.2 -5.2 -5.7 47 49 A L - 0 0 87 2,-0.1 11,-0.2 13,-0.0 -2,-0.1 0.974 66.7-179.0 -79.2 -70.0 61.4 -7.3 -6.1 48 50 A L - 0 0 48 9,-1.2 2,-0.8 1,-0.2 10,-0.2 0.979 21.8-143.5 67.0 80.1 63.8 -6.0 -3.3 49 51 A D > - 0 0 62 8,-1.2 3,-0.9 1,-0.2 -1,-0.2 -0.647 11.1-163.7 -79.2 112.8 66.9 -8.1 -3.9 50 52 A S T 3 + 0 0 93 -2,-0.8 -1,-0.2 1,-0.2 5,-0.1 0.552 65.7 106.1 -73.3 -2.3 68.4 -8.9 -0.4 51 53 A S T 3 S+ 0 0 96 2,-0.1 2,-0.5 6,-0.1 -1,-0.2 0.910 75.0 57.9 -43.0 -46.3 71.6 -9.8 -2.2 52 54 A E S < S- 0 0 105 -3,-0.9 2,-0.4 3,-0.2 5,-0.1 -0.743 79.5-147.2 -90.1 129.3 73.0 -6.5 -0.9 53 55 A I S S+ 0 0 126 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.1 -0.036 97.6 12.8 -83.8 36.4 73.0 -6.2 2.9 54 56 A H S S+ 0 0 85 -2,-0.4 16,-1.4 14,-0.1 2,-0.4 0.240 125.9 50.8-177.0 -29.4 72.4 -2.4 2.6 55 57 A W B +B 69 0B 38 14,-0.3 -3,-0.2 15,-0.1 13,-0.1 -0.783 64.9 170.5-130.1 93.0 71.5 -1.5 -1.0 56 58 A W - 0 0 33 12,-1.8 2,-0.3 -2,-0.4 -6,-0.1 -0.227 26.3-125.7 -88.4-174.6 68.6 -3.6 -2.5 57 59 A R + 0 0 153 -8,-0.1 -9,-1.2 10,-0.1 -8,-1.2 -0.970 27.6 175.3-132.2 146.9 66.8 -3.1 -5.8 58 60 A V - 0 0 6 8,-1.7 2,-0.4 -2,-0.3 -13,-0.1 -1.000 23.9-153.9-152.7 152.4 63.0 -2.8 -6.3 59 61 A Q - 0 0 114 -2,-0.3 6,-0.2 6,-0.2 4,-0.1 -0.738 19.7-160.2-129.4 85.7 60.5 -2.1 -9.1 60 62 A D - 0 0 20 4,-1.6 3,-0.5 -2,-0.4 -15,-0.1 0.144 34.3-103.4 -50.4-177.2 57.3 -0.6 -7.7 61 63 A K S S+ 0 0 157 1,-0.2 2,-0.5 2,-0.1 -1,-0.1 0.816 116.3 57.1 -85.1 -30.3 54.2 -0.8 -10.0 62 64 A N S S- 0 0 122 2,-0.1 -1,-0.2 1,-0.1 3,-0.1 -0.186 127.0 -91.5 -94.4 46.8 54.3 2.8 -11.2 63 65 A G S S+ 0 0 52 -3,-0.5 2,-2.4 -2,-0.5 -2,-0.1 0.737 79.0 149.9 55.2 20.4 57.8 2.7 -12.5 64 66 A H - 0 0 71 1,-0.1 2,-2.0 -28,-0.1 -4,-1.6 -0.502 22.5-179.6 -82.0 74.6 59.0 3.8 -9.1 65 67 A E + 0 0 80 -2,-2.4 -28,-1.1 -6,-0.2 -6,-0.2 -0.497 14.0 159.5 -79.3 78.4 62.2 1.9 -9.5 66 68 A G - 0 0 3 -2,-2.0 -8,-1.7 -30,-0.4 -28,-0.1 -0.342 41.2-136.0 -90.7 178.6 63.9 2.8 -6.2 67 69 A Y - 0 0 37 -30,-0.4 -11,-0.3 -10,-0.2 -10,-0.1 -0.384 23.5-155.1-133.2 55.8 66.7 0.9 -4.5 68 70 A A - 0 0 0 -13,-0.1 -12,-1.8 -30,-0.1 -14,-0.1 -0.004 11.8-143.6 -35.0 126.8 65.5 0.7 -0.9 69 71 A P B -B 55 0B 0 0, 0.0 -14,-0.3 0, 0.0 -15,-0.1 -0.093 18.2-111.9 -83.5-173.8 68.6 0.2 1.4 70 72 A S S > S+ 0 0 33 -16,-1.4 3,-1.1 2,-0.1 -16,-0.1 0.853 111.7 49.6 -91.8 -40.0 68.7 -1.9 4.6 71 73 A S T 3 S+ 0 0 45 -17,-0.3 -1,-0.1 1,-0.3 -16,-0.1 0.946 114.6 43.9 -65.8 -46.4 69.1 0.9 7.1 72 74 A Y T 3 S+ 0 0 19 -18,-0.2 2,-0.3 -65,-0.1 -1,-0.3 0.276 118.1 56.4 -82.7 16.4 66.2 3.0 5.7 73 75 A L < + 0 0 3 -3,-1.1 3,-0.1 1,-0.1 -46,-0.1 -0.999 46.5 117.9-147.7 143.3 64.2 -0.2 5.4 74 76 A V + 0 0 85 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.238 46.5 106.3 166.9 37.1 63.1 -3.0 7.9 75 77 A E + 0 0 21 -64,-0.1 -50,-1.6 -48,-0.0 -49,-0.7 -0.823 42.6 109.2-135.8 98.3 59.2 -3.0 8.1 76 78 A K 0 0 134 -2,-0.4 -61,-0.2 -52,-0.2 -53,-0.0 -0.751 360.0 360.0-147.7-164.9 57.4 -5.9 6.3 77 79 A S 0 0 60 -2,-0.2 -63,-0.2 -63,-0.2 -60,-0.2 0.738 360.0 360.0 71.1 360.0 55.5 -9.1 7.1