==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 26-JAN-10 2KTB . COMPND 2 MOLECULE: H3_PEPTIDE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR Z.CHARLOP-POWERS,Q.ZHANG,L.ZENG . 141 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9112.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 87 61.7 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 . 0 0.0 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 0.7 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 . 4 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 44.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 1 0 0 1 0 0 0 0 0 0 0 1 1 0 0 0 0 1 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 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 1 A A 0 0 154 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -18.5 -3.4 6.8 -14.5 2 2 A R + 0 0 216 1,-0.1 3,-0.1 0, 0.0 5,-0.0 -0.985 360.0 174.1-132.5 124.0 -6.0 9.5 -15.4 3 3 A T S S- 0 0 137 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 0.353 75.7 -2.0-105.4 2.2 -5.8 11.8 -18.4 4 4 A K S S- 0 0 149 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.920 85.6 -70.7-167.5-170.1 -9.3 13.2 -17.9 5 5 A Q S S+ 0 0 166 -2,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.118 86.4 43.1 -82.4-159.7 -12.5 13.2 -15.8 6 6 A T + 0 0 114 2,-0.0 -2,-0.1 1,-0.0 0, 0.0 0.033 60.4 109.0 51.8-164.1 -15.1 10.4 -15.7 7 7 A A + 0 0 83 1,-0.2 2,-0.2 -5,-0.0 -3,-0.1 0.977 40.5 142.7 60.2 87.2 -14.1 6.8 -15.5 8 8 A R - 0 0 186 0, 0.0 2,-0.7 0, 0.0 -1,-0.2 -0.773 27.5-174.0-160.6 108.9 -14.9 5.6 -12.0 9 9 A K + 0 0 195 -2,-0.2 3,-0.0 1,-0.1 0, 0.0 -0.861 40.2 116.9-110.2 99.1 -16.3 2.2 -11.0 10 10 A S + 0 0 68 -2,-0.7 2,-1.7 1,-0.0 -1,-0.1 0.644 14.2 141.7-120.8 -70.0 -17.1 2.1 -7.3 11 11 A T S S- 0 0 150 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 -0.362 84.7 -9.3 59.7 -85.4 -20.8 1.5 -6.6 12 12 A G S S- 0 0 64 -2,-1.7 -1,-0.1 1,-0.3 2,-0.1 0.562 111.3 -36.8-106.6-105.7 -20.4 -0.8 -3.6 13 13 A G - 0 0 41 2,-0.1 -1,-0.3 1,-0.1 0, 0.0 -0.074 30.9-156.6-106.7-152.1 -17.1 -2.3 -2.4 14 14 A X + 0 0 101 2,-0.1 4,-0.1 -3,-0.1 -1,-0.1 0.312 47.0 125.2-163.4 -24.1 -13.9 -3.6 -4.1 15 15 A A S > S- 0 0 0 2,-0.1 3,-1.0 1,-0.1 38,-0.1 -0.121 70.0 -93.4 -48.5 145.1 -12.3 -6.0 -1.6 16 16 A P T 3 S+ 0 0 0 0, 0.0 101,-0.6 0, 0.0 102,-0.2 0.109 106.5 45.9 -55.3 174.6 -11.7 -9.5 -3.1 17 17 A R T 3 S+ 0 0 126 1,-0.2 2,-0.6 99,-0.1 -2,-0.1 0.139 78.0 132.5 74.8 -21.4 -14.2 -12.4 -2.7 18 18 A K < + 0 0 82 -3,-1.0 2,-0.3 -4,-0.1 -1,-0.2 -0.491 27.4 144.7 -66.5 110.9 -16.9 -10.0 -3.6 19 19 A Q 0 0 180 -2,-0.6 0, 0.0 -3,-0.1 0, 0.0 -0.995 360.0 360.0-150.9 143.9 -19.0 -11.7 -6.3 20 20 A L 0 0 241 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.377 360.0 360.0-136.2 360.0 -22.7 -11.9 -7.2 21 !* 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 22 173 B S 0 0 129 0, 0.0 67,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 104.1 15.2 12.3 -5.3 23 174 B T + 0 0 15 65,-0.1 69,-0.2 66,-0.1 66,-0.1 0.491 360.0 154.2-138.2 -57.2 15.2 9.5 -2.8 24 175 B E + 0 0 108 1,-0.1 7,-0.3 2,-0.0 3,-0.2 -0.181 14.9 133.0 51.9-142.9 18.6 9.1 -1.1 25 176 B G S S- 0 0 7 1,-0.3 2,-0.7 6,-0.1 6,-0.4 0.757 88.7 -26.6 67.1 117.0 18.4 7.5 2.3 26 177 B S S S+ 0 0 83 4,-0.1 -1,-0.3 67,-0.1 67,-0.1 -0.263 144.3 4.0 48.3 -96.7 20.9 4.6 3.0 27 178 B S S > S- 0 0 63 -2,-0.7 4,-2.1 -3,-0.2 5,-0.3 -0.974 70.5-136.9-118.3 129.0 21.1 3.7 -0.7 28 179 B P H > S+ 0 0 77 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.850 110.0 40.0 -49.3 -39.1 19.3 5.8 -3.3 29 180 B A H >>S+ 0 0 38 3,-0.2 4,-3.1 2,-0.2 5,-1.0 0.947 102.6 66.8 -76.2 -47.0 18.2 2.6 -5.0 30 181 B Y H >5S+ 0 0 57 1,-0.2 4,-0.6 3,-0.2 -1,-0.2 0.856 119.0 26.1 -42.7 -42.9 17.5 0.8 -1.8 31 182 B L H X5S+ 0 0 0 -4,-2.1 4,-2.0 -6,-0.4 -1,-0.2 0.941 129.8 40.6 -83.9 -54.3 14.7 3.2 -1.4 32 183 B K H X5S+ 0 0 78 -4,-2.7 4,-1.6 -5,-0.3 5,-0.3 0.906 115.8 52.5 -58.5 -46.1 14.0 4.2 -5.1 33 184 B E H X5S+ 0 0 25 -4,-3.1 4,-2.8 1,-0.3 3,-0.4 0.927 111.9 45.7 -54.3 -45.4 14.4 0.6 -6.1 34 185 B I H XXS+ 0 0 3 -5,-1.0 5,-1.8 -4,-0.6 4,-1.5 0.811 99.5 71.8 -68.7 -30.3 11.9 -0.3 -3.5 35 186 B L H <5S+ 0 0 30 -4,-2.0 -1,-0.2 -6,-0.3 -2,-0.2 0.920 115.5 22.7 -49.8 -53.5 9.7 2.5 -4.7 36 187 B E H X5S+ 0 0 101 -4,-1.6 4,-1.0 -3,-0.4 5,-0.3 0.786 129.5 48.9 -82.9 -31.7 9.0 0.5 -7.7 37 188 B Q H X5S+ 0 0 45 -4,-2.8 4,-2.5 -5,-0.3 -3,-0.2 0.980 121.0 26.4 -76.4 -57.4 9.8 -3.0 -6.3 38 189 B L H X5S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 5,-0.3 0.928 124.7 50.4 -72.3 -46.5 7.9 -3.1 -2.9 39 190 B L H > - 0 0 9 4,-2.3 3,-2.3 -2,-0.3 -30,-0.1 -0.560 43.2 -91.0-106.8 171.2 -5.3 -12.4 -2.1 48 199 B P T 3 S+ 0 0 114 0, 0.0 -1,-0.0 0, 0.0 5,-0.0 0.790 127.0 61.3 -50.4 -28.3 -6.2 -16.2 -2.0 49 200 B S T 3 S- 0 0 60 2,-0.2 3,-0.1 1,-0.0 -32,-0.0 0.769 123.3-106.3 -71.3 -25.7 -9.5 -15.2 -3.6 50 201 B G S < S+ 0 0 49 -3,-2.3 2,-0.3 1,-0.4 3,-0.1 0.347 83.9 103.0 116.8 -4.0 -7.6 -13.8 -6.6 51 202 B R S S- 0 0 119 1,-0.1 -4,-2.3 -5,-0.0 -1,-0.4 -0.858 79.8 -69.2-118.7 154.1 -7.9 -10.1 -6.1 52 203 B L - 0 0 43 -2,-0.3 -6,-0.3 -6,-0.3 4,-0.2 0.124 23.4-163.1 -37.7 129.3 -5.6 -7.4 -4.8 53 204 B I S > S+ 0 0 0 -11,-0.4 3,-0.5 -8,-0.3 -1,-0.2 0.713 100.8 56.2 -80.7 -25.7 -4.6 -7.4 -1.2 54 205 B S G > S+ 0 0 0 -12,-0.6 3,-1.5 -9,-0.5 -1,-0.2 0.439 77.5 105.6 -80.5 -6.8 -3.6 -3.8 -1.9 55 206 B E G > S+ 0 0 29 1,-0.3 3,-0.8 2,-0.2 4,-0.2 0.841 82.4 42.3 -45.1 -45.6 -7.2 -3.2 -3.1 56 207 B L G < S+ 0 0 8 -3,-0.5 -1,-0.3 1,-0.2 3,-0.2 0.656 118.9 46.4 -79.2 -15.3 -8.1 -1.2 -0.0 57 208 B F G < S+ 0 0 0 -3,-1.5 22,-0.8 1,-0.1 23,-0.6 0.094 76.3 111.7-112.5 19.2 -4.7 0.6 -0.1 58 209 B Q S < S+ 0 0 70 -3,-0.8 2,-0.4 1,-0.2 22,-0.2 0.931 89.4 11.7 -56.6 -47.7 -4.8 1.4 -3.7 59 210 B K - 0 0 151 -4,-0.2 -1,-0.2 -3,-0.2 18,-0.0 -0.979 59.7-157.4-143.3 128.8 -5.2 5.1 -3.0 60 211 B L - 0 0 7 -2,-0.4 -3,-0.1 1,-0.2 18,-0.0 -0.897 27.4-133.4 -99.4 122.5 -4.9 7.2 0.2 61 212 B P - 0 0 41 0, 0.0 -1,-0.2 0, 0.0 17,-0.0 0.877 46.7 -73.8 -44.9-105.1 -6.9 10.5 -0.2 62 213 B S - 0 0 62 4,-0.0 -2,-0.0 0, 0.0 0, 0.0 0.370 43.6-120.8-145.7 2.3 -4.9 13.6 0.9 63 214 B K S S+ 0 0 85 1,-0.2 -3,-0.0 3,-0.1 0, 0.0 0.545 113.9 37.3 63.3 5.8 -4.7 13.6 4.7 64 215 B V S S+ 0 0 99 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.386 109.0 56.6-149.0 -35.8 -6.5 16.9 4.4 65 216 B Q S S+ 0 0 132 1,-0.2 3,-0.1 2,-0.1 0, 0.0 0.826 121.3 26.4 -77.2 -35.5 -8.9 16.6 1.5 66 217 B Y >> + 0 0 140 1,-0.1 3,-1.9 2,-0.0 4,-1.0 -0.431 69.5 162.4-128.6 59.5 -10.8 13.6 2.9 67 218 B P H 3> + 0 0 68 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.713 68.0 74.3 -50.4 -28.5 -10.3 14.0 6.7 68 219 B D H 3> S+ 0 0 128 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.927 99.3 45.4 -52.5 -45.3 -13.2 11.6 7.2 69 220 B Y H <> S+ 0 0 12 -3,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.892 116.8 45.3 -62.6 -39.5 -10.8 8.8 6.1 70 221 B Y H < S+ 0 0 33 -4,-1.0 -2,-0.2 2,-0.2 -1,-0.2 0.658 112.2 52.5 -78.8 -16.8 -8.2 10.4 8.4 71 222 B A H < S+ 0 0 79 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.855 112.4 43.5 -82.8 -42.1 -10.7 10.7 11.2 72 223 B I H < S+ 0 0 73 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.913 111.3 62.8 -68.9 -46.6 -11.8 7.1 11.0 73 224 B I < - 0 0 4 -4,-2.1 34,-0.1 -5,-0.2 35,-0.0 -0.296 62.8-157.5 -78.1 162.6 -8.2 5.8 10.7 74 225 B K S S+ 0 0 172 29,-0.1 -1,-0.1 1,-0.1 33,-0.1 0.697 91.8 14.9-108.2 -35.6 -5.5 6.2 13.3 75 226 B E S S- 0 0 98 28,-0.2 32,-0.4 2,-0.0 31,-0.2 -0.526 79.8-175.9-141.1 69.9 -2.5 5.7 11.0 76 227 B P + 0 0 9 0, 0.0 2,-0.2 0, 0.0 28,-0.1 -0.436 20.8 136.6 -70.4 139.8 -3.6 6.1 7.4 77 228 B I - 0 0 1 26,-0.2 2,-0.2 -2,-0.1 30,-0.2 -0.660 29.8-157.7 177.3 120.1 -1.1 5.5 4.6 78 229 B D > - 0 0 0 -2,-0.2 4,-2.7 1,-0.1 3,-0.3 -0.637 41.1 -94.2-106.3 168.0 -1.5 3.5 1.4 79 230 B L H > S+ 0 0 2 -22,-0.8 4,-2.0 1,-0.3 5,-0.2 0.838 129.1 52.0 -44.7 -37.7 1.0 1.9 -0.9 80 231 B K H > S+ 0 0 44 -23,-0.6 4,-2.1 2,-0.2 -1,-0.3 0.938 109.6 46.0 -65.5 -50.4 0.9 5.2 -2.8 81 232 B T H > S+ 0 0 9 -3,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.807 109.9 56.8 -65.0 -30.8 1.6 7.3 0.2 82 233 B I H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.960 110.0 41.5 -66.3 -51.3 4.4 5.0 1.3 83 234 B A H X S+ 0 0 14 -4,-2.0 4,-1.8 1,-0.2 5,-0.3 0.887 111.8 60.0 -60.7 -35.6 6.3 5.4 -2.0 84 235 B Q H X S+ 0 0 105 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.895 109.9 40.0 -56.5 -44.3 5.4 9.0 -1.7 85 236 B R H <>S+ 0 0 86 -4,-2.0 5,-2.6 2,-0.2 6,-0.7 0.804 104.8 67.7 -77.5 -32.0 7.3 9.2 1.6 86 237 B I H ><5S+ 0 0 0 -4,-2.4 3,-0.6 1,-0.2 6,-0.5 0.942 113.6 29.5 -53.1 -52.9 10.1 7.0 0.4 87 238 B Q H 3<5S+ 0 0 90 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.755 110.5 69.0 -79.5 -26.9 11.3 9.6 -2.1 88 239 B N T 3<5S- 0 0 110 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.508 114.2-114.5 -70.5 -1.8 10.0 12.5 0.0 89 240 B G T < 5S+ 0 0 37 -3,-0.6 -3,-0.2 -4,-0.5 -2,-0.1 0.697 82.4 127.7 75.1 18.3 12.8 11.6 2.5 90 241 B S S > S- 0 0 45 -67,-0.1 3,-1.6 -68,-0.1 4,-1.1 -0.900 79.3-138.5-162.7 130.2 15.0 3.6 5.2 94 245 B I H 3> S+ 0 0 0 -2,-0.3 4,-3.7 1,-0.3 5,-0.3 0.727 100.6 74.3 -66.2 -22.8 12.5 1.2 3.8 95 246 B H H 3> S+ 0 0 106 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.855 101.6 45.8 -56.5 -29.7 12.1 -0.5 7.2 96 247 B A H <> S+ 0 0 33 -3,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.875 110.1 51.8 -76.7 -40.8 10.2 2.7 7.9 97 248 B M H X S+ 0 0 0 -4,-1.1 4,-1.2 1,-0.2 3,-0.5 0.946 110.2 50.6 -56.6 -49.8 8.3 2.5 4.7 98 249 B A H X S+ 0 0 6 -4,-3.7 4,-2.1 1,-0.3 5,-0.2 0.866 102.9 57.6 -54.0 -46.5 7.4 -1.1 5.7 99 250 B K H X S+ 0 0 123 -4,-1.5 4,-1.5 1,-0.3 -1,-0.3 0.863 109.7 46.3 -56.6 -34.1 6.3 0.1 9.1 100 251 B D H X S+ 0 0 14 -4,-1.5 4,-1.6 -3,-0.5 -1,-0.3 0.739 106.2 59.4 -75.8 -27.2 3.9 2.3 7.1 101 252 B I H X S+ 0 0 0 -4,-1.2 4,-1.5 2,-0.2 -2,-0.2 0.805 106.9 46.0 -68.8 -31.9 3.1 -0.8 5.0 102 253 B D H X S+ 0 0 55 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.849 112.3 50.4 -74.8 -36.8 2.0 -2.4 8.2 103 254 B L H X S+ 0 0 38 -4,-1.5 4,-2.6 2,-0.3 -2,-0.2 0.775 104.5 58.6 -68.4 -28.3 0.1 0.8 8.9 104 255 B L H X S+ 0 0 0 -4,-1.6 4,-0.7 -6,-0.2 -1,-0.2 0.937 109.4 42.7 -63.1 -45.8 -1.3 0.5 5.4 105 256 B A H X S+ 0 0 5 -4,-1.5 4,-1.3 1,-0.2 -2,-0.3 0.798 110.7 57.5 -70.0 -30.3 -2.6 -2.9 6.6 106 257 B K H X S+ 0 0 66 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.912 101.1 53.9 -67.7 -42.4 -3.7 -1.3 9.9 107 258 B N H X S+ 0 0 0 -4,-2.6 4,-3.1 -32,-0.4 5,-0.5 0.759 102.6 65.0 -61.7 -22.6 -5.8 1.3 8.0 108 259 B A H X S+ 0 0 0 -4,-0.7 4,-1.2 2,-0.2 -1,-0.2 0.956 103.1 41.0 -62.7 -53.1 -7.3 -1.9 6.5 109 260 B K H < S+ 0 0 98 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.734 121.2 46.5 -69.5 -22.3 -8.8 -3.2 9.7 110 261 B T H < S+ 0 0 43 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.911 119.6 31.9 -86.2 -48.3 -9.9 0.3 10.6 111 262 B Y H < S+ 0 0 96 -4,-3.1 -3,-0.2 -5,-0.1 -2,-0.1 0.963 113.9 51.3 -78.6 -55.2 -11.5 1.6 7.4 112 263 B N S < S- 0 0 28 -4,-1.2 -56,-0.0 -5,-0.5 0, 0.0 0.048 93.5 -87.6 -74.2-172.6 -13.0 -1.5 5.7 113 264 B E > - 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