==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 02-OCT-06 2IKK . COMPND 2 MOLECULE: HYPOTHETICAL TRANSCRIPTIONAL REGULATOR YURK; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR K.TAN,C.HATZOS,J.ABDULLAH,A.JOACHIMIAK,MIDWEST CENTER FOR . 291 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15049.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 77.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 37.1 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 . 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 . 24 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.1 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 4 0 2 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 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 PARALLEL BRIDGES PER LADDER . 0 0 2 0 2 0 0 2 2 4 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 2 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 83 A G 0 0 99 0, 0.0 3,-0.1 0, 0.0 141,-0.0 0.000 360.0 360.0 360.0-118.1 -5.2 4.7 9.7 2 84 A T - 0 0 65 1,-0.1 2,-0.4 141,-0.1 140,-0.2 0.165 360.0 -12.0-140.7 -98.5 -4.1 1.6 7.7 3 85 A E E S-a 142 0A 45 138,-0.6 140,-2.5 47,-0.1 2,-0.8 -0.964 77.4-126.2-110.1 147.1 -0.9 -0.3 8.5 4 86 A N E -a 143 0A 67 -2,-0.4 2,-0.7 138,-0.2 140,-0.2 -0.782 24.1-175.0-111.3 99.7 1.3 1.6 10.9 5 87 A L E -a 144 0A 55 138,-1.9 140,-1.9 -2,-0.8 2,-0.5 -0.826 22.1-145.5 -88.6 118.1 5.0 2.4 10.2 6 88 A Y E -a 145 0A 166 -2,-0.7 2,-0.3 138,-0.2 140,-0.2 -0.724 9.5-149.0 -86.6 124.3 6.4 4.1 13.3 7 89 A F 0 0 17 138,-3.5 140,-0.5 -2,-0.5 0, 0.0 -0.713 360.0 360.0 -90.2 155.2 9.0 6.7 12.6 8 90 A Q 0 0 127 -2,-0.3 286,-0.1 138,-0.1 -2,-0.1 -0.459 360.0 360.0 70.6 360.0 11.9 7.4 15.0 9 ! 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 10 101 A H 0 0 98 0, 0.0 62,-0.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 107.5 11.0 -10.2 3.9 11 102 A H E -H 42 0B 82 31,-2.4 31,-2.2 60,-0.1 2,-0.6 -0.897 360.0-128.1-113.8 135.9 11.8 -11.8 0.5 12 103 A V E +H 41 0B 22 -2,-0.4 29,-0.3 29,-0.2 59,-0.1 -0.773 24.5 179.5 -90.7 120.0 15.1 -11.1 -1.3 13 104 A L E - 0 0 39 27,-3.1 2,-0.3 -2,-0.6 -1,-0.2 0.931 60.0 -32.5 -81.2 -52.5 14.4 -10.1 -4.8 14 105 A S E -H 40 0B 38 26,-1.2 26,-3.0 2,-0.0 -1,-0.4 -0.975 40.5-158.1-163.8 160.9 18.0 -9.6 -6.0 15 106 A H E +H 39 0B 78 -2,-0.3 2,-0.3 24,-0.2 24,-0.2 -0.938 21.9 169.6-148.4 130.6 21.4 -8.5 -5.1 16 107 A D E -H 38 0B 93 22,-1.0 22,-3.3 -2,-0.3 2,-0.6 -0.964 34.5-123.4-138.0 149.2 23.8 -7.4 -7.7 17 108 A I E +H 37 0B 85 -2,-0.3 20,-0.2 20,-0.2 -2,-0.0 -0.865 46.4 162.7 -93.2 121.1 27.2 -5.8 -7.5 18 109 A I E -H 36 0B 46 18,-2.7 18,-3.2 -2,-0.6 2,-0.2 -0.942 44.0 -90.1-135.4 162.1 27.1 -2.5 -9.4 19 110 A P E -H 35 0B 85 0, 0.0 2,-0.2 0, 0.0 15,-0.2 -0.503 52.8-104.8 -68.2 138.1 29.0 0.8 -9.7 20 111 A A - 0 0 1 14,-2.7 13,-1.3 -2,-0.2 14,-0.1 -0.441 32.2-133.6 -62.5 127.0 27.8 3.5 -7.3 21 112 A S > - 0 0 52 -2,-0.2 4,-3.5 11,-0.1 5,-0.3 -0.254 31.6 -96.5 -66.7 170.1 25.7 6.2 -9.0 22 113 A K H > S+ 0 0 170 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.942 125.0 44.0 -57.3 -52.2 26.4 9.9 -8.2 23 114 A P H > S+ 0 0 84 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.874 115.6 47.9 -62.5 -37.0 23.6 10.1 -5.5 24 115 A I H > S+ 0 0 20 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.936 113.3 47.4 -69.5 -46.2 24.6 6.8 -4.0 25 116 A A H X>S+ 0 0 8 -4,-3.5 5,-1.8 2,-0.2 4,-0.9 0.892 111.9 51.9 -61.6 -33.5 28.3 7.7 -3.9 26 117 A E H ><5S+ 0 0 149 -4,-2.5 3,-0.6 -5,-0.3 -2,-0.2 0.944 111.6 45.7 -65.3 -46.2 27.4 11.1 -2.4 27 118 A K H 3<5S+ 0 0 44 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.866 118.4 41.6 -62.4 -42.0 25.4 9.5 0.4 28 119 A L H 3<5S- 0 0 2 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.485 103.7-130.5 -87.0 -6.6 28.0 6.9 1.2 29 120 A Q T <<5 + 0 0 159 -4,-0.9 2,-0.3 -3,-0.6 -3,-0.2 0.923 62.8 129.7 52.7 54.5 30.9 9.4 0.9 30 121 A I < - 0 0 35 -5,-1.8 -1,-0.2 -6,-0.1 3,-0.1 -0.813 64.5 -72.6-125.3 169.4 32.9 7.0 -1.4 31 122 A Q > - 0 0 150 -2,-0.3 3,-1.8 1,-0.1 -11,-0.2 -0.186 61.2 -86.8 -59.3 150.1 34.6 7.4 -4.8 32 123 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 -0.304 113.9 12.3 -55.8 149.0 32.5 7.7 -8.0 33 124 A E T 3 S+ 0 0 123 -13,-1.3 -12,-0.1 1,-0.2 -2,-0.1 0.618 86.6 163.8 58.6 19.4 31.6 4.3 -9.4 34 125 A S < - 0 0 6 -3,-1.8 -14,-2.7 -15,-0.2 2,-0.2 -0.402 48.3 -95.8 -62.4 145.8 32.7 2.4 -6.3 35 126 A P E +H 19 0B 52 0, 0.0 24,-2.2 0, 0.0 25,-0.5 -0.413 50.8 176.5 -65.4 127.6 31.4 -1.2 -6.1 36 127 A V E -HI 18 58B 0 -18,-3.2 -18,-2.7 -2,-0.2 2,-0.6 -0.941 32.5-123.8-129.7 151.5 28.2 -1.4 -4.1 37 128 A V E -HI 17 57B 0 20,-2.5 20,-1.7 -2,-0.3 2,-0.8 -0.880 23.4-153.6 -90.5 123.5 25.9 -4.3 -3.4 38 129 A E E -HI 16 56B 42 -22,-3.3 -22,-1.0 -2,-0.6 2,-0.6 -0.879 14.1-169.3 -98.3 103.0 22.3 -3.4 -4.5 39 130 A L E -HI 15 55B 0 16,-3.2 16,-2.6 -2,-0.8 2,-0.5 -0.878 3.6-167.8-100.6 123.5 20.0 -5.4 -2.3 40 131 A K E +HI 14 54B 28 -26,-3.0 -27,-3.1 -2,-0.6 -26,-1.2 -0.916 14.6 165.6-110.8 126.3 16.3 -5.4 -3.3 41 132 A R E -HI 12 53B 27 12,-2.2 12,-3.1 -2,-0.5 2,-0.4 -0.987 25.2-145.6-135.9 155.4 13.8 -6.8 -0.9 42 133 A I E -HI 11 52B 3 -31,-2.2 -31,-2.4 -2,-0.3 2,-0.5 -0.966 7.2-156.7-119.0 133.9 10.0 -6.8 -0.5 43 134 A L E - I 0 51B 64 8,-3.4 7,-3.2 -2,-0.4 8,-2.2 -0.958 16.2-152.2-105.4 130.7 8.3 -6.8 2.9 44 135 A Y E - I 0 49B 91 -2,-0.5 3,-0.1 5,-0.3 -2,-0.0 -0.752 16.2-156.8-105.6 142.1 4.7 -8.2 2.8 45 136 A N S S- 0 0 71 3,-4.1 -1,-0.2 -2,-0.3 5,-0.0 0.926 84.8 -43.5 -75.9 -78.4 1.8 -7.3 5.1 46 137 A D S S- 0 0 106 2,-0.1 -2,-0.1 3,-0.0 4,-0.1 0.553 119.6 -32.7-104.4 -89.4 -0.1 -10.5 4.5 47 138 A D S S+ 0 0 147 -3,-0.1 -3,-0.0 2,-0.1 0, 0.0 0.260 122.4 103.2-102.9 1.4 0.0 -11.3 0.8 48 139 A Q S S- 0 0 54 1,-0.0 -3,-4.1 2,-0.0 2,-0.3 -0.760 80.1-122.9 -88.8 124.5 -0.0 -7.5 0.3 49 140 A P E +I 44 0B 8 0, 0.0 -5,-0.3 0, 0.0 89,-0.2 -0.537 36.5 171.4 -65.5 124.5 3.4 -5.9 -0.7 50 141 A L E + 0 0 21 -7,-3.2 2,-0.4 1,-0.3 -6,-0.2 0.780 59.8 16.5-107.4 -37.1 4.0 -3.3 2.0 51 142 A T E -I 43 0B 9 -8,-2.2 -8,-3.4 86,-0.1 2,-0.6 -0.981 52.2-161.3-142.8 129.5 7.6 -2.1 1.4 52 143 A F E -IJ 42 136B 2 84,-2.3 84,-2.4 -2,-0.4 2,-0.4 -0.949 24.9-165.9-103.8 118.2 9.8 -2.4 -1.5 53 144 A E E -IJ 41 135B 9 -12,-3.1 -12,-2.2 -2,-0.6 2,-0.5 -0.874 18.4-176.3-111.0 135.5 13.4 -1.7 -0.2 54 145 A V E +IJ 40 134B 20 80,-2.8 80,-2.1 -2,-0.4 2,-0.3 -0.950 16.7 177.1-127.8 117.4 16.5 -1.0 -2.3 55 146 A T E -IJ 39 133B 0 -16,-2.6 -16,-3.2 -2,-0.5 2,-0.5 -0.936 16.1-151.5-121.7 145.0 19.6 -0.7 -0.0 56 147 A H E -IJ 38 132B 16 76,-2.6 76,-1.9 -2,-0.3 -18,-0.2 -0.962 7.6-169.3-121.4 132.1 23.3 -0.2 -1.1 57 148 A Y E -I 37 0B 4 -20,-1.7 -20,-2.5 -2,-0.5 2,-0.5 -0.980 26.5-123.0-117.8 129.3 26.3 -1.4 0.9 58 149 A P E >> -I 36 0B 1 0, 0.0 4,-1.7 0, 0.0 3,-1.1 -0.601 13.7-153.6 -76.0 124.8 29.7 -0.2 -0.1 59 150 A L T 34 S+ 0 0 21 -24,-2.2 -23,-0.1 -2,-0.5 6,-0.1 0.755 91.1 65.3 -71.3 -22.6 31.9 -3.3 -0.8 60 151 A D T 34 S+ 0 0 119 -25,-0.5 -1,-0.3 1,-0.2 -24,-0.1 0.771 111.4 34.5 -69.9 -27.0 35.0 -1.4 0.1 61 152 A L T <4 S+ 0 0 65 -3,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.768 130.9 33.4 -91.5 -33.0 33.8 -1.2 3.8 62 153 A F S >< S- 0 0 3 -4,-1.7 3,-2.0 68,-0.1 4,-0.2 -0.590 83.0-162.6-122.7 64.7 32.1 -4.6 3.8 63 154 A P T 3 S+ 0 0 89 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.217 75.5 5.5 -59.7 136.8 34.1 -6.8 1.6 64 155 A G T > S+ 0 0 31 1,-0.1 3,-1.8 -5,-0.1 4,-0.3 0.614 82.5 139.6 70.7 15.7 32.2 -10.0 0.5 65 156 A I G X + 0 0 0 -3,-2.0 3,-1.8 1,-0.3 4,-0.3 0.852 62.5 66.7 -67.7 -27.7 28.9 -8.8 2.2 66 157 A D G > S+ 0 0 35 1,-0.3 3,-1.2 -4,-0.2 -1,-0.3 0.770 87.9 68.0 -56.6 -27.2 26.9 -10.1 -0.8 67 158 A T G < S+ 0 0 102 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.679 97.0 53.4 -73.1 -15.4 27.8 -13.6 0.1 68 159 A F G < S+ 0 0 63 -3,-1.8 2,-0.4 -4,-0.3 -1,-0.2 0.480 82.1 113.9 -90.9 -5.8 25.7 -13.4 3.3 69 160 A I < + 0 0 18 -3,-1.2 2,-0.3 -4,-0.3 -54,-0.1 -0.548 34.8 129.5 -79.9 125.5 22.5 -12.3 1.6 70 161 A A > - 0 0 50 -2,-0.4 3,-1.9 3,-0.0 -2,-0.0 -0.976 64.7 -69.3-159.2 160.2 19.6 -14.8 1.7 71 162 A D T 3 S+ 0 0 98 -2,-0.3 -60,-0.1 1,-0.2 3,-0.1 -0.318 119.7 18.9 -51.2 135.5 15.9 -14.8 2.5 72 163 A G T 3 S+ 0 0 73 -62,-0.7 2,-0.3 1,-0.3 -1,-0.2 0.293 90.0 137.7 88.7 -6.0 15.4 -14.3 6.3 73 164 A V < - 0 0 43 -3,-1.9 2,-0.8 -63,-0.1 -1,-0.3 -0.522 51.4-137.7 -81.9 135.9 18.8 -12.9 6.9 74 165 A S > - 0 0 49 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 -0.831 9.1-161.1 -87.4 113.5 19.1 -9.9 9.2 75 166 A X H > S+ 0 0 4 -2,-0.8 4,-2.8 2,-0.2 5,-0.2 0.855 93.1 57.9 -66.5 -28.1 21.5 -7.5 7.5 76 167 A H H > S+ 0 0 82 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.953 105.5 50.5 -66.6 -38.9 22.0 -5.8 10.9 77 168 A D H > S+ 0 0 102 2,-0.2 4,-3.2 1,-0.2 5,-0.4 0.889 110.1 49.8 -58.6 -40.9 23.1 -9.2 12.3 78 169 A I H X>S+ 0 0 26 -4,-1.8 4,-2.6 2,-0.2 5,-0.9 0.950 111.1 48.8 -65.9 -48.3 25.6 -9.6 9.4 79 170 A L H X5S+ 0 0 0 -4,-2.8 6,-2.1 3,-0.2 4,-1.3 0.934 116.2 44.1 -58.7 -46.4 27.0 -6.2 9.9 80 171 A K H X5S+ 0 0 109 -4,-2.5 4,-1.2 4,-0.3 -2,-0.2 0.959 123.5 31.6 -62.4 -56.0 27.4 -6.9 13.7 81 172 A Q H <5S+ 0 0 119 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.898 128.4 35.4 -75.0 -37.9 28.8 -10.4 13.6 82 173 A Q H <5S+ 0 0 99 -4,-2.6 -3,-0.2 -5,-0.4 -2,-0.2 0.866 135.4 19.3 -85.8 -35.5 30.8 -10.3 10.3 83 174 A Y H < - 0 0 135 11,-0.2 4,-2.5 12,-0.1 5,-0.3 -0.439 48.8 -72.3-108.4-173.5 7.4 3.3 -12.5 101 192 A Q H > S+ 0 0 163 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.898 130.0 48.2 -49.3 -48.1 7.4 -0.1 -14.1 102 193 A E H > S+ 0 0 74 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.901 114.7 44.1 -64.2 -41.6 9.6 -1.8 -11.5 103 194 A E H > S+ 0 0 33 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.883 108.8 57.2 -67.8 -41.6 7.6 -0.5 -8.5 104 195 A S H X>S+ 0 0 17 -4,-2.5 5,-1.5 2,-0.2 4,-0.7 0.934 110.2 46.4 -59.0 -43.9 4.3 -1.2 -10.1 105 196 A K H ><5S+ 0 0 156 -4,-2.0 3,-0.7 -5,-0.3 -2,-0.2 0.974 118.5 37.5 -60.6 -54.2 5.4 -4.9 -10.4 106 197 A Y H 3<5S+ 0 0 69 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.797 123.4 41.1 -75.4 -31.2 6.8 -5.4 -6.9 107 198 A L H 3<5S- 0 0 0 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.347 103.8-128.8 -95.7 2.3 4.2 -3.3 -5.0 108 199 A D T <<5 + 0 0 119 -4,-0.7 2,-0.2 -3,-0.7 -3,-0.2 0.946 67.3 115.1 52.7 60.3 1.4 -4.6 -7.2 109 200 A C < - 0 0 19 -5,-1.5 2,-0.2 -6,-0.1 -1,-0.2 -0.772 69.1 -77.3-143.2-175.8 -0.0 -1.2 -8.1 110 201 A D > - 0 0 118 -2,-0.2 3,-1.9 1,-0.1 -11,-0.2 -0.598 48.5 -97.1 -86.7 149.7 -0.4 0.9 -11.2 111 202 A I T 3 S+ 0 0 117 1,-0.2 -11,-0.2 -2,-0.2 -1,-0.1 -0.414 113.9 28.4 -55.9 133.1 2.3 2.8 -13.0 112 203 A G T 3 S+ 0 0 39 -13,-3.0 -1,-0.2 1,-0.3 -12,-0.1 0.282 84.7 143.4 96.9 -13.8 2.0 6.4 -11.8 113 204 A D < - 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