==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-OCT-09 3K7N . COMPND 2 MOLECULE: K-LIKE; . SOURCE 2 ORGANISM_SCIENTIFIC: NAJA ATRA; . AUTHOR H.H.GUAN,Y.W.HUANG,W.G.WU,C.J.CHEN . 396 1 15 15 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20660.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 56.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 8.8 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 2 0.5 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 . 23 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 17.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.3 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 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 2 0 0 0 1 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 . 4 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 2 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 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 1 198 A D 0 0 181 0, 0.0 2,-0.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 164.5 -19.1 -47.2 42.3 2 199 A R + 0 0 127 1,-0.3 190,-0.0 2,-0.1 2,-0.0 -0.999 360.0 121.9-139.4 131.3 -20.5 -44.1 40.6 3 200 A Y S > S+ 0 0 34 -2,-0.3 3,-1.5 3,-0.1 -1,-0.3 0.793 85.2 77.6 46.6-122.0 -20.1 -42.0 38.3 4 201 A L T 3 S+ 0 0 19 1,-0.7 4,-0.1 -3,-0.2 -2,-0.1 -0.555 90.8 39.7-135.7 -23.1 -23.0 -43.1 37.3 5 202 A Q T 3 S+ 0 0 121 -2,-0.1 -1,-0.7 2,-0.1 2,-0.4 -0.334 95.6 96.2 75.4 -58.2 -25.3 -41.7 39.2 6 203 A D S < S- 0 0 98 -3,-1.5 -3,-0.1 1,-0.0 2,-0.1 -0.847 82.5-108.1 -90.7 136.9 -23.7 -38.3 39.3 7 204 A K - 0 0 65 -2,-0.4 2,-0.3 44,-0.1 44,-0.2 -0.381 40.5-153.4 -49.5 127.9 -24.7 -35.5 36.9 8 205 A K E -a 51 0A 0 42,-2.9 44,-1.8 41,-0.1 2,-0.4 -0.723 6.5-155.4-112.7 164.0 -21.9 -35.0 34.4 9 206 A Y E -a 52 0A 23 190,-3.0 2,-0.6 -2,-0.3 44,-0.2 -0.991 7.9-153.2-144.7 137.5 -21.0 -31.9 32.4 10 207 A I E -a 53 0A 2 42,-3.1 44,-3.3 -2,-0.4 2,-1.1 -0.950 13.8-145.3-116.0 119.5 -19.2 -31.2 29.2 11 208 A E E -a 54 0A 10 -2,-0.6 84,-2.3 187,-0.2 85,-1.2 -0.759 34.7-161.9 -78.7 100.0 -17.5 -27.9 28.8 12 209 A F E -ab 55 96A 1 42,-2.8 44,-2.1 -2,-1.1 45,-1.0 -0.727 17.2-164.0-105.3 133.6 -18.3 -27.6 25.1 13 210 A Y E -ab 57 97A 12 83,-2.2 85,-2.2 -2,-0.4 2,-0.4 -0.954 8.2-161.3-119.1 132.0 -16.6 -25.3 22.6 14 211 A V E -ab 58 98A 4 43,-2.6 45,-2.6 -2,-0.4 2,-0.4 -0.943 5.6-166.5-118.5 133.6 -18.2 -24.6 19.1 15 212 A I E -ab 59 99A 0 83,-2.2 85,-2.9 -2,-0.4 2,-0.6 -0.971 7.4-158.2-112.2 130.0 -16.6 -23.2 15.9 16 213 A V E -ab 60 100A 0 43,-2.8 45,-3.3 -2,-0.4 85,-0.2 -0.973 24.7-137.8-103.7 115.2 -18.7 -22.0 13.0 17 214 A D > - 0 0 0 83,-2.5 4,-2.0 -2,-0.6 5,-0.1 -0.117 21.5-103.3 -74.7 168.4 -16.5 -22.1 9.9 18 215 A N H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.837 118.1 57.3 -65.7 -34.7 -16.3 -19.4 7.2 19 216 A R H > S+ 0 0 103 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.908 108.8 46.7 -59.4 -42.0 -18.5 -21.4 4.7 20 217 A M H > S+ 0 0 0 80,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.929 109.1 53.1 -66.8 -44.3 -21.2 -21.5 7.2 21 218 A Y H <>S+ 0 0 37 -4,-2.0 5,-2.2 2,-0.2 6,-0.4 0.898 113.0 45.8 -54.6 -45.2 -20.9 -17.8 8.0 22 219 A R H ><5S+ 0 0 160 -4,-2.2 3,-1.8 3,-0.2 -2,-0.2 0.913 109.4 53.5 -61.9 -47.7 -21.3 -17.1 4.2 23 220 A Y H 3<5S+ 0 0 120 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.798 106.2 55.6 -57.9 -30.9 -24.2 -19.5 3.9 24 221 A Y T ><5S- 0 0 33 -4,-1.9 3,-2.3 -5,-0.1 -1,-0.3 0.042 119.5-111.8 -87.7 22.1 -25.8 -17.4 6.8 25 222 A N T < 5 - 0 0 142 -3,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.866 63.9 -67.1 55.1 36.7 -25.5 -14.3 4.8 26 223 A N T 3 + 0 0 73 -3,-2.3 4,-2.4 -6,-0.4 3,-0.3 -0.701 21.7 176.9 -95.8 89.7 -25.6 -12.7 9.9 28 225 A K H > S+ 0 0 85 -2,-1.1 4,-2.8 1,-0.2 5,-0.2 0.928 80.3 54.8 -59.1 -49.5 -23.9 -13.3 13.3 29 226 A P H > S+ 0 0 95 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.872 111.0 45.0 -51.8 -36.3 -27.0 -12.8 15.3 30 227 A A H > S+ 0 0 30 -3,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.875 112.7 52.3 -78.7 -34.4 -28.8 -15.5 13.2 31 228 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.957 111.4 46.1 -62.9 -47.2 -25.9 -17.8 13.5 32 229 A K H X S+ 0 0 82 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.903 111.1 49.6 -64.0 -48.7 -25.7 -17.5 17.3 33 230 A I H X S+ 0 0 102 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.884 109.8 53.6 -60.1 -36.1 -29.4 -17.9 18.0 34 231 A K H X S+ 0 0 24 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.933 111.6 44.6 -62.2 -46.6 -29.3 -21.1 15.7 35 232 A V H X S+ 0 0 3 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.930 111.8 52.9 -69.9 -39.6 -26.4 -22.6 17.8 36 233 A Y H X S+ 0 0 43 -4,-2.7 4,-1.7 -5,-0.2 -1,-0.2 0.930 110.8 46.5 -54.1 -45.2 -28.1 -21.7 21.1 37 234 A E H X S+ 0 0 102 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.880 113.0 50.0 -72.3 -30.1 -31.3 -23.4 20.0 38 235 A M H X S+ 0 0 5 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.920 107.9 52.2 -74.1 -41.8 -29.4 -26.5 18.9 39 236 A I H X S+ 0 0 11 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.857 108.6 50.8 -62.1 -35.4 -27.4 -26.8 22.0 40 237 A N H X S+ 0 0 37 -4,-1.7 4,-1.6 -5,-0.2 -1,-0.2 0.866 110.6 49.4 -69.5 -35.7 -30.6 -26.7 24.1 41 238 A A H X S+ 0 0 28 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.872 109.0 52.4 -69.8 -41.7 -32.1 -29.4 21.9 42 239 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.917 108.7 50.8 -55.8 -45.5 -28.9 -31.5 22.4 43 240 A N H X S+ 0 0 6 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.855 106.0 55.6 -61.1 -38.8 -29.3 -31.1 26.2 44 241 A T H < S+ 0 0 73 -4,-1.6 3,-0.2 2,-0.2 -1,-0.2 0.894 110.9 44.5 -59.2 -42.5 -32.9 -32.3 26.0 45 242 A K H < S+ 0 0 14 -4,-1.7 4,-0.2 1,-0.2 134,-0.2 0.860 115.4 48.1 -72.3 -33.2 -31.8 -35.5 24.3 46 243 A F H ><>S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 5,-0.9 0.663 85.2 92.6 -80.2 -14.0 -28.9 -36.0 26.7 47 244 A R G ><5S+ 0 0 74 -4,-1.2 3,-2.5 1,-0.3 -1,-0.2 0.866 81.1 54.6 -48.7 -49.5 -31.0 -35.4 29.9 48 245 A P G 3 5S+ 0 0 102 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.815 105.9 56.1 -58.8 -24.0 -31.8 -39.2 30.4 49 246 A L G < 5S- 0 0 11 -3,-1.6 -2,-0.2 -4,-0.2 -41,-0.1 0.326 110.6-125.2 -84.9 5.8 -28.1 -39.8 30.3 50 247 A K T < 5 + 0 0 107 -3,-2.5 -42,-2.9 1,-0.2 2,-0.4 0.903 69.5 126.2 56.7 41.3 -27.4 -37.3 33.1 51 248 A I E < -a 8 0A 6 -5,-0.9 2,-0.5 -44,-0.2 -42,-0.2 -0.997 43.1-161.6-136.8 128.6 -25.0 -35.3 31.0 52 249 A H E -a 9 0A 9 -44,-1.8 -42,-3.1 -2,-0.4 2,-0.7 -0.974 11.7-142.2-116.9 134.7 -25.3 -31.6 30.4 53 250 A I E -a 10 0A 2 -2,-0.5 2,-0.8 -44,-0.2 -42,-0.2 -0.854 17.6-163.8 -98.1 110.4 -23.5 -29.7 27.6 54 251 A A E -a 11 0A 1 -44,-3.3 -42,-2.8 -2,-0.7 2,-0.9 -0.867 14.1-138.3-103.7 116.5 -22.4 -26.4 28.7 55 252 A L E +a 12 0A 1 -2,-0.8 154,-3.0 -44,-0.2 155,-1.0 -0.570 37.0 156.6 -74.3 108.4 -21.5 -24.0 26.0 56 253 A I E + 0 0 31 -44,-2.1 2,-0.3 -2,-0.9 -43,-0.2 0.386 61.2 30.9-113.6 1.2 -18.4 -22.2 27.1 57 254 A G E +a 13 0A 6 -45,-1.0 -43,-2.6 2,-0.0 2,-0.3 -0.940 51.0 176.7-157.8 141.3 -16.9 -21.0 23.8 58 255 A L E -a 14 0A 33 -2,-0.3 2,-0.5 -45,-0.2 -43,-0.2 -0.937 6.8-177.4-142.2 112.3 -18.2 -19.9 20.3 59 256 A E E -a 15 0A 30 -45,-2.6 -43,-2.8 -2,-0.3 2,-0.5 -0.948 9.3-162.0-108.5 137.4 -16.0 -18.7 17.5 60 257 A I E -a 16 0A 27 -2,-0.5 2,-2.3 -45,-0.2 3,-0.2 -0.979 15.9-143.3-110.4 118.0 -17.4 -17.6 14.2 61 258 A W + 0 0 3 -45,-3.3 -40,-0.2 -2,-0.5 -2,-0.0 -0.480 35.5 161.8 -81.8 75.0 -14.7 -17.5 11.5 62 259 A S S S+ 0 0 40 -2,-2.3 -1,-0.2 1,-0.1 3,-0.1 0.670 71.8 32.2 -70.0 -16.3 -16.1 -14.4 9.8 63 260 A N S S- 0 0 115 1,-0.4 2,-0.3 -3,-0.2 -1,-0.1 0.848 128.1 -27.8-106.8 -50.3 -12.8 -13.6 7.9 64 261 A K - 0 0 152 -45,-0.0 -1,-0.4 0, 0.0 2,-0.1 -0.970 69.0 -88.6-157.8 161.7 -11.1 -16.9 7.0 65 262 A D - 0 0 37 -2,-0.3 3,-0.1 1,-0.1 -48,-0.1 -0.415 27.7-137.7 -72.8 152.6 -10.9 -20.4 8.4 66 263 A K S S+ 0 0 117 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.687 88.7 13.3 -91.6 -19.2 -8.2 -21.1 10.9 67 264 A F S S- 0 0 30 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.914 103.4 -77.7-137.8 170.9 -7.2 -24.5 9.4 68 265 A E - 0 0 128 -2,-0.3 2,-0.4 -3,-0.1 11,-0.1 -0.469 38.3-156.3 -74.3 115.4 -8.2 -26.0 5.9 69 266 A V - 0 0 10 -2,-0.4 4,-0.1 10,-0.1 -4,-0.1 -0.796 18.2-176.8 -95.8 136.1 -11.6 -27.4 5.8 70 267 A K - 0 0 91 -2,-0.4 6,-0.2 2,-0.2 33,-0.1 -0.896 37.1-116.2-136.3 153.4 -11.9 -30.0 3.1 71 268 A P S S+ 0 0 55 0, 0.0 35,-3.0 0, 0.0 2,-1.0 0.590 92.3 90.9 -75.1 -14.2 -14.8 -32.1 1.8 72 269 A A S > S- 0 0 29 33,-0.2 4,-2.0 1,-0.2 3,-0.4 -0.779 70.9-154.5 -77.9 106.9 -13.3 -35.4 2.9 73 270 A A H > S+ 0 0 9 -2,-1.0 4,-2.6 1,-0.2 5,-0.2 0.832 89.0 53.5 -55.3 -40.6 -14.8 -35.6 6.3 74 271 A S H > S+ 0 0 62 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.858 108.2 50.5 -68.7 -32.8 -12.1 -37.8 7.7 75 272 A V H > S+ 0 0 70 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.913 112.8 45.5 -70.8 -38.0 -9.4 -35.4 6.6 76 273 A T H X S+ 0 0 0 -4,-2.0 4,-2.8 -6,-0.2 5,-0.2 0.943 110.5 54.5 -67.3 -41.3 -11.2 -32.4 8.2 77 274 A L H X S+ 0 0 7 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.894 110.5 44.9 -61.3 -43.2 -11.9 -34.3 11.4 78 275 A K H X S+ 0 0 115 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.922 114.2 49.3 -69.2 -41.2 -8.2 -35.1 11.8 79 276 A S H X S+ 0 0 37 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.853 111.1 49.7 -57.9 -38.7 -7.2 -31.6 11.0 80 277 A F H X S+ 0 0 0 -4,-2.8 4,-3.5 2,-0.2 5,-0.2 0.946 108.4 53.7 -67.3 -47.8 -9.8 -30.1 13.5 81 278 A G H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.841 111.2 46.0 -51.2 -40.0 -8.5 -32.5 16.2 82 279 A E H X S+ 0 0 89 -4,-1.6 4,-3.3 2,-0.2 5,-0.3 0.853 111.8 49.7 -76.7 -40.2 -5.0 -31.3 15.7 83 280 A W H X>S+ 0 0 23 -4,-2.0 4,-2.5 2,-0.2 5,-1.6 0.925 110.8 51.4 -64.1 -44.1 -6.0 -27.7 15.6 84 281 A R H <>S+ 0 0 5 -4,-3.5 5,-3.0 1,-0.2 -2,-0.2 0.965 117.9 38.1 -59.8 -47.5 -7.9 -28.2 18.8 85 282 A E H <5S+ 0 0 73 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.935 125.1 35.6 -67.5 -45.1 -4.9 -29.8 20.4 86 283 A T H <5S+ 0 0 98 -4,-3.3 -3,-0.2 -5,-0.1 -2,-0.2 0.844 133.7 15.6 -84.6 -32.2 -2.1 -27.6 19.0 87 284 A V T <5S+ 0 0 68 -4,-2.5 4,-0.3 -5,-0.3 -3,-0.2 0.823 126.4 34.2-108.8 -46.6 -3.9 -24.2 18.9 88 285 A L T >> S- 0 0 92 -35,-3.0 3,-1.0 -2,-0.1 -33,-0.1 -0.081 95.7 -9.2 -46.3 139.0 -18.1 -36.0 0.0 107 304 A G T 3 S- 0 0 70 1,-0.2 -2,-0.0 -3,-0.1 0, 0.0 -0.135 121.3 -45.1 68.5-150.7 -21.0 -38.4 -0.6 108 305 A N T 3 S+ 0 0 120 -4,-0.0 -1,-0.2 2,-0.0 -2,-0.1 0.288 91.4 139.0-107.5 15.4 -23.9 -38.1 1.7 109 306 A T < + 0 0 54 -3,-1.0 -4,-0.4 1,-0.1 3,-0.1 -0.333 26.9 179.9 -48.9 131.8 -21.8 -37.8 4.9 110 307 A V - 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