==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATION 18-JUL-94 1HKS . COMPND 2 MOLECULE: HEAT-SHOCK TRANSCRIPTION FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR G.W.VUISTER,S.-J.KIM,A.OROSZ,J.L.MARQUARDT,C.WU,A.BAX . 106 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7534.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 58 54.7 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 . 6 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), 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-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 . 11 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 18.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 1 0 0 1 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 . 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 43 A G > 0 0 72 0, 0.0 3,-0.9 0, 0.0 100,-0.0 0.000 360.0 360.0 360.0 178.6 18.9 0.6 -1.9 2 44 A S T 3 - 0 0 142 1,-0.3 0, 0.0 2,-0.1 0, 0.0 0.779 360.0 -1.1 56.0 21.1 21.9 1.5 0.3 3 45 A G T 3 S+ 0 0 50 1,-0.3 -1,-0.3 2,-0.0 0, 0.0 -0.074 93.7 122.2 160.5 -46.7 19.3 1.7 3.1 4 46 A V < - 0 0 24 -3,-0.9 -1,-0.3 2,-0.1 -2,-0.1 -0.215 62.6-133.1 -44.6 108.2 15.9 0.9 1.7 5 47 A P > - 0 0 73 0, 0.0 4,-1.5 0, 0.0 5,-0.2 -0.104 24.7-101.0 -61.3 166.5 14.9 -2.1 3.9 6 48 A A T 4 S+ 0 0 71 1,-0.2 4,-0.4 2,-0.1 -2,-0.1 0.452 116.2 70.1 -71.0 6.1 13.4 -5.2 2.1 7 49 A F T >> S+ 0 0 40 2,-0.1 4,-1.4 3,-0.1 3,-0.5 0.941 104.8 28.4 -86.7 -69.2 10.0 -3.9 3.3 8 50 A L H 3> S+ 0 0 6 1,-0.2 4,-1.1 2,-0.2 3,-0.3 0.930 115.8 63.5 -59.4 -42.6 9.4 -0.7 1.3 9 51 A A H >X S+ 0 0 38 -4,-1.5 4,-1.4 1,-0.3 3,-0.9 0.905 100.7 53.2 -49.5 -40.6 11.5 -2.1 -1.6 10 52 A K H <> S+ 0 0 65 -3,-0.5 4,-3.1 -4,-0.4 5,-0.4 0.931 100.5 58.9 -63.2 -42.0 8.9 -4.9 -1.9 11 53 A L H 3X S+ 0 0 4 -4,-1.4 4,-0.9 -3,-0.3 -1,-0.3 0.758 102.6 58.5 -59.7 -18.2 6.0 -2.3 -2.1 12 54 A W H < S+ 0 0 179 -4,-1.4 3,-0.7 2,-0.2 -2,-0.2 0.939 119.1 59.4 -75.3 -46.0 7.9 -4.3 -7.2 14 56 A L H 3< S+ 0 0 14 -4,-3.1 -3,-0.2 1,-0.3 -2,-0.1 0.957 104.4 49.2 -46.4 -61.4 4.7 -5.7 -5.6 15 57 A V H 3< S+ 0 0 6 -4,-0.9 -1,-0.3 -5,-0.4 11,-0.2 0.851 120.1 45.2 -49.9 -31.1 2.6 -2.7 -6.7 16 58 A D S << S+ 0 0 80 -4,-0.7 4,-0.3 -3,-0.7 -3,-0.1 0.485 79.4 88.5 -84.3-128.4 4.1 -3.4 -10.2 17 59 A D S S- 0 0 91 2,-0.1 -3,-0.0 1,-0.1 0, 0.0 0.208 76.9-112.1 53.2 171.1 4.4 -6.9 -11.6 18 60 A A S > S+ 0 0 79 2,-0.1 3,-2.7 3,-0.1 -1,-0.1 0.797 108.1 64.6-105.4 -46.6 1.4 -8.3 -13.7 19 61 A D T 3 S+ 0 0 126 1,-0.3 4,-0.2 2,-0.1 -2,-0.1 0.824 105.9 51.2 -48.9 -27.7 0.1 -11.1 -11.5 20 62 A T T 3> S+ 0 0 5 -4,-0.3 4,-0.9 1,-0.2 2,-0.8 -0.026 73.5 121.0 -99.7 31.7 -0.8 -8.3 -9.1 21 63 A N T <4 S+ 0 0 126 -3,-2.7 -1,-0.2 1,-0.2 4,-0.1 -0.148 85.6 23.8 -87.1 44.1 -2.6 -6.2 -11.8 22 64 A R T 4 S+ 0 0 131 -2,-0.8 15,-0.5 2,-0.3 14,-0.2 0.243 114.3 58.0-170.3 -37.6 -5.8 -6.2 -9.8 23 65 A L T 4 S+ 0 0 2 1,-0.3 2,-0.3 -4,-0.2 -2,-0.1 0.826 123.8 4.7 -79.3 -29.6 -5.1 -6.8 -6.1 24 66 A I S < S+ 0 0 4 -4,-0.9 -2,-0.3 11,-0.2 -1,-0.3 -0.965 73.4 146.6-155.7 136.0 -2.9 -3.7 -5.9 25 67 A C E -A 34 0A 45 9,-1.4 9,-1.6 -2,-0.3 2,-0.2 -0.924 49.9 -71.5-155.8 179.8 -1.9 -0.9 -8.4 26 68 A W E -A 33 0A 46 -2,-0.3 2,-0.5 7,-0.2 7,-0.3 -0.517 50.7-110.6 -80.8 150.4 -1.0 2.8 -8.6 27 69 A T S > S- 0 0 7 5,-0.9 4,-0.9 -2,-0.2 5,-0.3 -0.675 70.5 -52.6 -83.1 126.3 -3.8 5.4 -8.1 28 70 A K T 4 S- 0 0 197 -2,-0.5 -2,-0.1 2,-0.1 0, 0.0 -0.197 128.9 -6.3 46.1-105.5 -4.7 7.2 -11.3 29 71 A D T 4 S- 0 0 145 -2,-0.2 -1,-0.1 1,-0.0 -3,-0.1 0.885 119.1 -61.7 -81.4 -90.7 -1.2 8.4 -12.3 30 72 A G T 4 S+ 0 0 20 -4,-0.1 64,-0.6 3,-0.0 -2,-0.1 -0.174 86.6 122.2-158.6 54.3 1.4 7.6 -9.6 31 73 A Q S < S- 0 0 112 -4,-0.9 58,-0.5 62,-0.1 61,-0.3 0.798 87.9 -52.3 -89.9 -30.7 0.6 9.4 -6.4 32 74 A S - 0 0 3 -5,-0.3 -5,-0.9 56,-0.1 2,-0.3 -0.693 66.7 -86.0-171.1-133.8 0.4 6.2 -4.2 33 75 A F E -AB 26 87A 4 54,-1.3 54,-2.2 -7,-0.3 2,-0.3 -0.980 22.2-155.2-156.1 168.0 -1.5 2.9 -4.4 34 76 A V E -AB 25 86A 13 -9,-1.6 -9,-1.4 -2,-0.3 2,-0.3 -0.984 11.5-149.4-147.1 157.2 -4.8 1.1 -3.5 35 77 A I + 0 0 0 50,-1.2 50,-0.3 -2,-0.3 -11,-0.2 -0.681 16.4 175.8-129.3 78.7 -6.0 -2.5 -2.7 36 78 A Q S S+ 0 0 74 -2,-0.3 2,-1.0 -14,-0.2 49,-0.2 0.962 77.7 50.6 -47.9 -60.8 -9.7 -2.8 -3.9 37 79 A N + 0 0 90 -15,-0.5 4,-0.3 1,-0.2 -1,-0.2 -0.682 63.6 175.2 -83.3 105.5 -9.8 -6.5 -3.0 38 80 A Q + 0 0 90 -2,-1.0 -1,-0.2 2,-0.1 -2,-0.1 0.486 69.7 66.3 -87.6 -1.3 -8.5 -6.8 0.5 39 81 A A S >> S+ 0 0 71 2,-0.1 3,-2.8 1,-0.1 4,-0.8 0.896 108.4 24.9 -82.5 -88.8 -9.3 -10.5 0.5 40 82 A Q T 34 S+ 0 0 89 1,-0.3 4,-0.1 2,-0.2 -2,-0.1 0.748 109.9 79.0 -50.3 -18.6 -7.1 -12.4 -1.9 41 83 A F T 34 S+ 0 0 1 -4,-0.3 -1,-0.3 1,-0.1 -2,-0.1 0.518 100.9 39.2 -70.2 1.4 -4.7 -9.5 -1.4 42 84 A A T X> S+ 0 0 11 -3,-2.8 4,-1.3 3,-0.1 3,-1.0 0.752 116.6 40.2-113.7 -61.1 -3.8 -11.3 1.8 43 85 A K T 3< S+ 0 0 151 -4,-0.8 -2,-0.1 1,-0.2 -3,-0.1 0.009 123.4 43.0 -82.2 34.8 -3.7 -15.1 1.3 44 86 A E T 34 S+ 0 0 68 -2,-0.4 -1,-0.2 -5,-0.2 -3,-0.1 0.299 122.9 25.2-157.7 7.5 -2.0 -14.6 -2.1 45 87 A L T <4 S+ 0 0 9 -3,-1.0 5,-0.3 8,-0.0 6,-0.2 0.463 112.5 57.0-146.3 -31.6 0.7 -11.9 -1.7 46 88 A L S >X>S+ 0 0 2 -4,-1.3 5,-1.9 3,-0.2 3,-1.1 0.856 102.7 54.9 -78.4 -34.0 1.8 -11.8 2.0 47 89 A P T 345S+ 0 0 52 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.946 108.2 47.8 -65.9 -47.1 2.9 -15.5 2.2 48 90 A L T 345S+ 0 0 144 2,-0.1 -2,-0.1 1,-0.1 4,-0.0 0.139 131.4 21.5 -79.9 26.2 5.3 -15.3 -0.8 49 91 A N T <45S+ 0 0 56 -3,-1.1 -3,-0.2 3,-0.2 -1,-0.1 0.208 138.4 15.4-150.3 -77.4 6.7 -12.1 0.8 50 92 A Y T <5S- 0 0 36 -4,-1.1 2,-2.9 -5,-0.3 -4,-0.1 0.480 85.7-140.3 -89.8 -0.5 6.2 -11.4 4.6 51 93 A K S - 0 0 118 1,-0.1 4,-0.8 2,-0.1 -2,-0.0 -0.217 41.5-161.2 -48.8 128.2 -2.8 -11.6 9.0 55 97 A M H >> S+ 0 0 40 2,-0.2 3,-2.0 1,-0.2 4,-1.7 0.973 86.4 49.6 -79.9 -67.2 -4.3 -8.6 7.1 56 98 A A H 3> S+ 0 0 77 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.750 106.9 64.3 -45.6 -18.0 -5.0 -6.1 9.8 57 99 A S H 3> S+ 0 0 33 2,-0.2 4,-1.2 3,-0.2 -1,-0.3 0.916 101.4 45.7 -74.8 -40.8 -1.4 -6.8 10.7 58 100 A F H X S+ 0 0 29 -4,-1.2 3,-1.7 1,-0.2 4,-1.4 0.844 97.7 63.7 -78.5 -31.5 2.1 -1.8 10.3 62 104 A L H 3X S+ 0 0 0 -4,-1.3 4,-1.9 -3,-0.5 5,-0.5 0.886 94.6 61.2 -60.1 -34.4 1.4 1.0 7.8 63 105 A N H 3< S+ 0 0 118 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.727 103.4 52.4 -65.7 -16.1 0.4 3.2 10.8 64 106 A M H <4 S+ 0 0 59 -3,-1.7 42,-1.3 -4,-0.2 -1,-0.2 0.818 108.4 47.0 -88.6 -32.4 4.0 2.7 12.0 65 107 A Y H < S- 0 0 40 -4,-1.4 39,-0.4 -3,-0.2 -2,-0.2 0.783 125.3 -98.3 -79.6 -24.2 5.7 3.8 8.7 66 108 A G < + 0 0 40 -4,-1.9 2,-0.3 -5,-0.2 -3,-0.2 0.778 62.2 157.1 106.3 76.2 3.4 6.9 8.5 67 109 A F - 0 0 25 -5,-0.5 2,-0.1 22,-0.1 22,-0.1 -0.822 25.7-162.5-124.3 165.3 0.4 6.4 6.2 68 110 A H - 0 0 129 20,-1.0 2,-0.3 -2,-0.3 20,-0.3 -0.579 7.4-163.4-150.5 82.4 -3.0 8.1 6.0 69 111 A K - 0 0 59 18,-0.2 2,-1.7 -2,-0.1 18,-0.2 -0.504 15.5-143.3 -69.5 127.6 -5.8 6.3 4.1 70 112 A I S S+ 0 0 91 16,-0.9 2,-0.3 -2,-0.3 -1,-0.1 -0.445 70.6 78.3 -89.0 65.2 -8.6 8.7 3.2 71 113 A T S S+ 0 0 22 -2,-1.7 6,-0.1 1,-0.3 -2,-0.1 -0.991 70.6 34.3-161.7 164.4 -11.3 6.1 3.7 72 114 A S + 0 0 94 -2,-0.3 -1,-0.3 4,-0.2 2,-0.1 0.910 69.4 134.4 48.0 94.2 -13.4 4.3 6.4 73 115 A I S S- 0 0 108 2,-0.4 -1,-0.1 3,-0.1 3,-0.1 -0.466 84.5 -48.8-172.7 92.2 -13.7 7.0 9.1 74 116 A D S S+ 0 0 150 1,-0.1 2,-0.3 -2,-0.1 -2,-0.0 0.872 116.1 95.8 42.3 41.1 -17.1 7.7 10.9 75 117 A N S S- 0 0 127 0, 0.0 -2,-0.4 0, 0.0 -1,-0.1 -0.995 89.9 -73.3-154.2 155.6 -18.6 7.8 7.4 76 118 A G + 0 0 62 -2,-0.3 -4,-0.2 1,-0.1 -3,-0.1 -0.134 52.1 156.9 -48.4 144.3 -20.5 5.5 5.0 77 119 A G + 0 0 43 -5,-0.1 3,-0.2 -6,-0.1 -1,-0.1 0.201 15.1 145.3-157.8 16.5 -18.1 2.9 3.5 78 120 A L S S- 0 0 123 1,-0.2 0, 0.0 0, 0.0 0, 0.0 0.119 73.6 -40.8 -50.5 179.2 -20.3 -0.0 2.4 79 121 A R S S+ 0 0 207 2,-0.1 -1,-0.2 1,-0.0 2,-0.1 -0.176 82.2 145.8 -46.3 127.8 -19.2 -1.9 -0.8 80 122 A F > - 0 0 105 -3,-0.2 2,-2.9 3,-0.0 3,-1.6 -0.546 41.8-153.1-171.2 98.1 -18.1 0.9 -3.3 81 123 A D T 3 S+ 0 0 78 1,-0.2 -2,-0.1 -2,-0.1 -45,-0.0 -0.321 88.1 69.4 -75.0 65.6 -15.3 0.5 -5.9 82 124 A R T 3 S+ 0 0 156 -2,-2.9 -1,-0.2 -46,-0.1 -46,-0.0 0.292 101.9 38.0-153.5 -12.2 -14.6 4.3 -5.9 83 125 A D S X S+ 0 0 57 -3,-1.6 3,-0.5 -6,-0.1 -2,-0.1 0.030 81.2 167.5-132.0 20.8 -13.1 4.7 -2.4 84 126 A E T 3 - 0 0 43 1,-0.2 -48,-0.2 -4,-0.1 2,-0.2 -0.026 65.2 -65.7 -39.6 137.4 -11.2 1.5 -2.4 85 127 A I T 3 - 0 0 5 -50,-0.3 -50,-1.2 -49,-0.2 2,-0.7 0.087 69.4-169.7 -30.6 83.2 -8.7 1.4 0.5 86 128 A E E < -B 34 0A 72 -3,-0.5 -16,-0.9 -52,-0.2 2,-0.6 -0.751 8.8-156.7 -90.0 118.8 -6.5 4.2 -1.0 87 129 A F E -B 33 0A 1 -54,-2.2 -54,-1.3 -2,-0.7 2,-0.5 -0.823 6.7-162.0 -96.3 123.6 -3.2 4.7 0.8 88 130 A S + 0 0 45 -2,-0.6 -20,-1.0 -20,-0.3 -56,-0.1 -0.884 18.4 162.3-106.6 131.5 -1.7 8.2 0.5 89 131 A H > - 0 0 12 -58,-0.5 3,-1.4 -2,-0.5 2,-0.6 -0.750 28.7-158.5-150.5 99.0 2.0 8.8 1.2 90 132 A P T 3 S+ 0 0 88 0, 0.0 3,-0.1 0, 0.0 -58,-0.1 0.222 95.3 58.1 -64.2 23.1 3.8 11.9 -0.1 91 133 A F T 3 S+ 0 0 72 -2,-0.6 12,-0.2 1,-0.1 11,-0.1 -0.006 94.1 61.1-141.0 31.0 7.0 9.9 0.4 92 134 A F < + 0 0 2 -3,-1.4 -1,-0.1 -61,-0.3 4,-0.1 -0.127 69.5 127.6-150.4 43.4 6.4 6.8 -1.9 93 135 A K - 0 0 64 3,-0.2 -62,-0.1 2,-0.1 7,-0.1 -0.135 65.9-105.4 -89.9-168.1 6.0 8.2 -5.4 94 136 A R S S+ 0 0 137 -64,-0.6 -1,-0.1 3,-0.0 -63,-0.1 0.944 98.8 41.2 -85.4 -70.8 7.8 7.1 -8.6 95 137 A N S S+ 0 0 136 2,-0.1 4,-0.2 1,-0.1 3,-0.2 0.288 84.9 74.9 -58.3-159.8 10.3 9.9 -9.3 96 138 A S > - 0 0 56 1,-0.2 2,-2.2 2,-0.1 3,-1.4 0.972 66.3-155.9 50.8 72.3 12.3 11.5 -6.5 97 139 A P T 3 S+ 0 0 137 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.119 81.6 68.3 -71.9 44.3 14.7 8.5 -5.9 98 140 A F T 3 S+ 0 0 122 -2,-2.2 -2,-0.1 -3,-0.2 -3,-0.1 0.294 72.3 82.2-143.4 5.7 15.2 9.7 -2.3 99 141 A L S <> S+ 0 0 11 -3,-1.4 4,-1.0 -4,-0.2 3,-0.4 0.915 84.8 59.3 -81.4 -44.0 11.8 9.1 -0.6 100 142 A L T >4 S+ 0 0 41 -4,-0.3 2,-2.8 1,-0.3 3,-0.7 0.943 98.7 60.5 -49.5 -50.6 12.3 5.4 0.1 101 143 A D T 34 S+ 0 0 104 1,-0.2 -1,-0.3 -97,-0.1 3,-0.1 -0.258 105.6 49.6 -75.5 58.4 15.4 6.3 2.2 102 144 A Q T 34 S+ 0 0 87 -2,-2.8 2,-0.4 -3,-0.4 -1,-0.2 0.325 82.7 87.1-160.1 -36.9 13.2 8.3 4.6 103 145 A I << + 0 0 13 -4,-1.0 -1,-0.3 -3,-0.7 2,-0.3 -0.633 55.5 143.2 -79.1 126.1 10.2 6.3 5.7 104 146 A K - 0 0 134 -2,-0.4 2,-1.9 -39,-0.4 -3,-0.0 -0.900 63.4 -61.7-150.3 179.1 11.0 4.2 8.8 105 147 A R 0 0 195 -2,-0.3 -40,-0.2 1,-0.2 -41,-0.1 -0.459 360.0 360.0 -70.2 87.1 9.5 2.9 12.0 106 148 A K 0 0 209 -2,-1.9 -1,-0.2 -42,-1.3 -41,-0.1 0.909 360.0 360.0 45.3 360.0 8.9 6.3 13.7