==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-APR-08 2VSK . COMPND 2 MOLECULE: HEMAGGLUTININ-NEURAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HENDRA VIRUS; . AUTHOR T.A.BOWDEN,A.R.ARICESCU,R.J.GILBERT,J.M.GRIMES,E.Y.JONES, . 1061 12 18 12 6 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44308.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 652 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 334 31.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.1 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 . 4 0.4 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 . 134 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 1 1 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 RESIDUES PER ALPHA HELIX . 10 4 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 PARALLEL BRIDGES PER LADDER . 15 7 7 8 3 11 4 1 3 1 2 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 8 6 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 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 1 188 A I 0 0 81 0, 0.0 398,-0.3 0, 0.0 399,-0.2 0.000 360.0 360.0 360.0 117.7 32.9 -15.9 -3.0 2 189 A a + 0 0 1 396,-1.7 398,-0.1 398,-0.3 345,-0.1 -0.175 360.0 163.3 -49.2 124.0 33.9 -12.4 -4.2 3 190 A L + 0 0 80 2,-0.1 2,-0.4 343,-0.1 -1,-0.2 0.246 49.3 91.6-123.5 4.3 30.9 -10.0 -4.3 4 191 A Q S S- 0 0 137 1,-0.0 2,-0.1 2,-0.0 -2,-0.0 -0.814 82.4-112.2-105.7 138.9 32.9 -6.7 -4.4 5 192 A K + 0 0 123 -2,-0.4 2,-0.2 2,-0.0 342,-0.2 -0.442 54.2 156.9 -51.6 140.2 34.0 -4.8 -7.5 6 193 A T - 0 0 29 340,-2.7 342,-0.2 339,-0.2 4,-0.1 -0.848 48.1-150.7-173.2 140.7 37.8 -5.1 -7.7 7 194 A T + 0 0 140 -2,-0.2 340,-0.1 340,-0.1 -1,-0.1 0.463 60.2 125.5 -93.3 -5.8 40.7 -5.0 -10.1 8 195 A S S S- 0 0 51 1,-0.1 2,-0.8 393,-0.1 3,-0.3 -0.188 75.7-115.2 -37.0 149.4 42.7 -7.4 -8.1 9 196 A T + 0 0 108 1,-0.2 -1,-0.1 338,-0.1 -2,-0.1 -0.443 65.9 141.2 -94.4 56.1 43.8 -10.3 -10.4 10 197 A I + 0 0 6 -2,-0.8 2,-0.4 -4,-0.1 -1,-0.2 0.842 45.2 84.4 -71.0 -35.0 41.8 -12.8 -8.4 11 198 A L - 0 0 6 337,-0.4 386,-0.1 -3,-0.3 337,-0.1 -0.594 55.8-177.7 -78.0 124.1 40.5 -14.8 -11.6 12 199 A K - 0 0 101 384,-0.4 384,-0.3 -2,-0.4 -1,-0.1 -0.670 9.8-159.8-131.6 71.9 43.1 -17.4 -12.7 13 200 A P - 0 0 38 0, 0.0 2,-0.5 0, 0.0 382,-0.2 -0.240 2.4-159.1 -57.3 138.9 42.0 -19.2 -15.8 14 201 A R E -A 394 0A 120 380,-1.2 380,-1.8 2,-0.0 2,-0.5 -0.992 19.2-126.8-125.8 120.8 43.7 -22.6 -16.5 15 202 A L E -A 393 0A 92 -2,-0.5 378,-0.2 378,-0.2 380,-0.0 -0.553 27.4-174.6 -67.9 112.9 43.7 -24.0 -20.1 16 203 A I 0 0 15 376,-2.4 55,-0.5 -2,-0.5 377,-0.2 0.018 360.0 360.0-114.1 31.3 42.3 -27.6 -19.8 17 204 A S 0 0 95 375,-0.4 376,-0.1 53,-0.1 374,-0.1 0.899 360.0 360.0 63.3 360.0 42.6 -29.1 -23.3 18 ! 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 19 213 A E 0 0 183 0, 0.0 2,-0.9 0, 0.0 369,-0.0 0.000 360.0 360.0 360.0 -93.5 47.6 -28.7 -40.7 20 214 A G + 0 0 22 367,-0.1 24,-0.9 2,-0.1 2,-0.3 -0.537 360.0 120.1-114.3 58.5 45.3 -26.3 -42.5 21 215 A V E -E 43 0B 19 -2,-0.9 367,-1.8 365,-0.3 2,-0.4 -0.823 49.1-146.6-121.7 159.5 42.1 -27.3 -40.9 22 216 A b E -Ef 42 388B 0 20,-1.9 20,-2.7 -2,-0.3 2,-0.6 -0.999 3.5-154.1-129.8 124.0 39.5 -25.4 -38.9 23 217 A I E +E 41 0B 10 365,-3.5 2,-0.3 -2,-0.4 18,-0.2 -0.899 38.7 144.5 -88.0 125.0 37.5 -27.0 -36.0 24 218 A T E +E 40 0B 18 16,-2.5 16,-3.1 -2,-0.6 -2,-0.0 -0.905 29.4 67.0-148.3-176.8 34.3 -25.0 -35.7 25 219 A D E S- 0 0 51 -2,-0.3 -1,-0.1 14,-0.2 2,-0.1 0.924 71.6-168.8 68.4 46.3 30.6 -25.3 -34.9 26 220 A P E - 0 0 6 0, 0.0 2,-0.4 0, 0.0 13,-0.2 -0.367 17.6-171.4 -79.3 148.3 31.3 -26.2 -31.3 27 221 A L E +E 38 0B 9 11,-2.3 11,-1.3 -2,-0.1 2,-0.4 -0.996 6.6 174.1-125.7 134.6 28.9 -27.4 -28.7 28 222 A L E +E 37 0B 9 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.943 2.2 172.2-138.3 133.6 29.5 -27.9 -25.0 29 223 A A E -E 36 0B 0 7,-1.3 7,-2.0 -2,-0.4 2,-0.3 -0.908 12.3-161.2-125.9 154.5 26.9 -28.9 -22.5 30 224 A V E -E 35 0B 29 -2,-0.3 2,-0.6 5,-0.2 5,-0.3 -0.845 8.8-179.9-143.9 104.9 27.5 -29.8 -18.8 31 225 A D E > -E 34 0B 16 3,-2.4 3,-3.0 -2,-0.3 2,-0.5 -0.902 62.0 -55.6-116.3 113.2 25.0 -31.7 -16.7 32 226 A N T 3 S- 0 0 128 -2,-0.6 3,-0.1 1,-0.3 -1,-0.1 0.338 127.6 -19.8 58.4 -7.3 25.5 -32.7 -13.0 33 227 A G T 3 S+ 0 0 23 1,-0.5 28,-2.5 -2,-0.5 -1,-0.3 0.242 123.5 80.2 155.0 -14.9 28.8 -34.4 -13.8 34 228 A F E < -EG 31 60B 36 -3,-3.0 -3,-2.4 26,-0.2 -1,-0.5 -0.798 56.2-152.1-124.0 161.1 28.7 -35.2 -17.4 35 229 A F E -EG 30 59B 9 24,-3.4 24,-2.2 -2,-0.3 2,-0.3 -0.956 3.1-153.8-136.3 153.0 29.3 -33.2 -20.6 36 230 A A E +EG 29 58B 2 -7,-2.0 -7,-1.3 -2,-0.3 2,-0.3 -0.771 21.4 174.8-114.9 160.7 28.2 -33.2 -24.1 37 231 A Y E +EG 28 57B 36 20,-2.3 20,-4.1 -2,-0.3 2,-0.3 -0.926 12.7 169.5-168.7 150.0 30.2 -31.9 -27.1 38 232 A S E +EG 27 56B 2 -11,-1.3 -11,-2.3 -2,-0.3 2,-0.3 -0.970 2.8 166.5-147.2 162.8 30.5 -31.5 -30.8 39 233 A H E - G 0 55B 16 16,-1.0 16,-2.0 -2,-0.3 2,-0.4 -0.932 29.0-119.8-153.4 178.5 32.4 -29.8 -33.5 40 234 A L E -EG 24 54B 13 -16,-3.1 -16,-2.5 -2,-0.3 2,-0.6 -0.999 16.9-143.5-125.3 136.4 32.9 -29.8 -37.2 41 235 A E E -E 23 0B 37 12,-0.9 11,-3.3 -2,-0.4 12,-0.4 -0.818 23.0-171.7 -95.7 124.5 36.2 -30.5 -38.8 42 236 A K E -EG 22 51B 30 -20,-2.7 -20,-1.9 -2,-0.6 2,-1.1 -0.930 28.2-124.8-117.1 142.4 36.7 -28.4 -42.0 43 237 A I E S-EG 21 50B 83 7,-4.8 7,-1.0 -2,-0.4 2,-0.3 -0.768 82.9 -33.8 -81.4 98.9 39.5 -28.5 -44.6 44 238 A G S S+ 0 0 21 -2,-1.1 -2,-0.2 -24,-0.9 -22,-0.1 -0.730 115.7 51.6 96.1-138.7 40.7 -24.9 -44.6 45 239 A S > - 0 0 13 -2,-0.3 4,-0.7 1,-0.2 -23,-0.2 0.089 70.0-131.0 -42.2 136.1 38.5 -21.9 -44.0 46 240 A b T 4 S+ 0 0 11 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.678 106.5 37.0 -61.1 -18.1 36.3 -21.9 -40.9 47 241 A T T 4 S+ 0 0 39 447,-0.2 -1,-0.2 -23,-0.0 448,-0.1 0.842 133.6 11.6-101.6 -48.3 33.4 -20.9 -43.0 48 242 A R T 4 S+ 0 0 155 446,-0.1 3,-0.2 2,-0.1 -2,-0.1 0.799 85.0 123.1-107.7 -34.9 33.7 -22.6 -46.4 49 243 A G S < S- 0 0 9 -4,-0.7 -5,-0.2 1,-0.1 3,-0.0 0.201 77.6 -81.3 -37.8 149.8 36.4 -25.3 -46.2 50 244 A I E -G 43 0B 126 -7,-1.0 -7,-4.8 -8,-0.2 2,-0.6 -0.343 50.5-114.1 -61.1 132.1 35.4 -28.9 -47.1 51 245 A A E -G 42 0B 24 -9,-0.3 -9,-0.3 1,-0.2 -1,-0.1 -0.536 34.7-174.9 -77.0 111.6 33.7 -30.5 -44.1 52 246 A K E - 0 0 78 -11,-3.3 2,-0.3 -2,-0.6 -10,-0.2 0.996 56.6 -22.4 -70.7 -71.1 36.0 -33.2 -42.9 53 247 A Q E - 0 0 90 -12,-0.4 -12,-0.9 29,-0.1 2,-0.2 -0.934 50.9-139.3-157.5 122.0 34.1 -35.0 -40.1 54 248 A R E -G 40 0B 4 -2,-0.3 2,-0.4 25,-0.2 -14,-0.2 -0.503 24.3-165.4 -76.5 137.7 31.4 -34.2 -37.6 55 249 A I E -G 39 0B 22 -16,-2.0 -16,-1.0 -2,-0.2 2,-0.3 -0.941 16.5-179.3-125.1 155.9 31.7 -35.4 -34.1 56 250 A I E +GH 38 77B 4 21,-1.2 21,-3.5 -2,-0.4 2,-0.3 -0.932 21.3 161.8-147.1 120.0 29.4 -35.7 -31.3 57 251 A G E -GH 37 76B 0 -20,-4.1 -20,-2.3 -2,-0.3 2,-0.3 -0.923 20.4-163.9-142.0 166.7 30.6 -37.0 -28.0 58 252 A V E +GH 36 75B 0 17,-2.3 16,-4.0 -2,-0.3 17,-2.0 -0.931 21.8 134.1-144.8 161.1 29.9 -37.2 -24.3 59 253 A G E -GH 35 73B 0 -24,-2.2 -24,-3.4 14,-0.3 2,-0.3 -0.980 45.4 -56.1 175.4-165.3 31.8 -38.0 -21.2 60 254 A E E -GH 34 72B 53 12,-1.9 12,-1.1 -2,-0.3 2,-0.9 -0.772 25.5-137.7-111.4 146.8 32.6 -37.0 -17.6 61 255 A V E - H 0 71B 27 -28,-2.5 2,-0.4 -2,-0.3 10,-0.2 -0.850 38.8-179.4-103.9 104.6 33.9 -33.9 -15.9 62 256 A L E - H 0 70B 57 8,-2.2 8,-1.2 -2,-0.9 2,-0.3 -0.912 25.0-153.4-120.5 129.8 36.3 -35.2 -13.4 63 257 A D E - H 0 69B 52 -2,-0.4 306,-0.0 6,-0.3 2,-0.0 -0.716 16.1-174.0 -80.5 143.9 38.6 -33.7 -10.8 64 258 A R - 0 0 99 4,-1.1 -1,-0.2 -2,-0.3 6,-0.0 0.312 55.3 -52.0-103.2-111.0 41.7 -35.6 -9.9 65 259 A G S S+ 0 0 58 1,-0.2 -2,-0.0 2,-0.1 0, 0.0 0.726 129.9 59.0-107.8 -28.0 44.0 -34.5 -7.1 66 260 A D S S- 0 0 135 2,-0.2 -1,-0.2 1,-0.0 -3,-0.0 0.395 105.3-124.1 -85.3 0.7 44.8 -30.9 -8.0 67 261 A K S S+ 0 0 131 1,-0.3 -2,-0.1 0, 0.0 -4,-0.1 0.794 71.7 129.5 60.0 25.2 41.0 -30.3 -7.7 68 262 A V - 0 0 19 -6,-0.0 -4,-1.1 326,-0.0 -1,-0.3 -0.939 59.1-128.4 -96.2 134.8 41.0 -28.9 -11.2 69 263 A P E -H 63 0B 0 0, 0.0 -6,-0.3 0, 0.0 2,-0.3 -0.314 28.9-163.3 -67.2 166.7 38.3 -30.6 -13.2 70 264 A S E -H 62 0B 24 -8,-1.2 -8,-2.2 -2,-0.1 2,-0.4 -0.994 23.4 -96.9-157.7 162.5 39.1 -32.2 -16.6 71 265 A M E +H 61 0B 88 -55,-0.5 -10,-0.2 -2,-0.3 2,-0.1 -0.628 32.9 172.3 -85.6 127.5 37.7 -33.6 -19.9 72 266 A F E -H 60 0B 84 -12,-1.1 -12,-1.9 -2,-0.4 -37,-0.1 -0.593 18.1-158.2-134.8 71.4 37.1 -37.4 -20.0 73 267 A M E +H 59 0B 53 -14,-0.3 -14,-0.3 1,-0.1 3,-0.1 -0.186 14.8 176.3 -45.3 131.3 35.2 -38.1 -23.3 74 268 A T E + 0 0 55 -16,-4.0 2,-0.4 1,-0.4 -15,-0.2 0.754 60.9 20.7-106.8 -43.7 33.5 -41.5 -23.0 75 269 A N E -H 58 0B 17 -17,-2.0 -17,-2.3 50,-0.1 -1,-0.4 -0.958 64.4-170.8-139.2 138.3 31.5 -42.1 -26.1 76 270 A V E -H 57 0B 67 -2,-0.4 2,-0.4 -19,-0.2 -19,-0.3 -0.999 3.1-161.1-143.4 141.3 31.9 -40.5 -29.4 77 271 A W E -H 56 0B 39 -21,-3.5 -21,-1.2 -2,-0.4 -2,-0.0 -0.972 5.6-165.9-133.3 131.6 29.8 -40.5 -32.5 78 272 A T - 0 0 75 -2,-0.4 -23,-0.1 -23,-0.2 -2,-0.0 -0.928 17.9-139.1-113.8 119.3 30.4 -39.8 -36.2 79 273 A P - 0 0 8 0, 0.0 -25,-0.2 0, 0.0 6,-0.0 -0.452 26.6-116.9 -67.1 155.7 27.6 -39.3 -38.7 80 274 A P S S+ 0 0 136 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.615 104.3 28.3 -71.5 -24.1 28.3 -40.9 -42.1 81 275 A N > - 0 0 73 1,-0.0 3,-0.6 -28,-0.0 4,-0.2 -0.961 67.6-163.6-132.4 125.0 28.3 -37.6 -44.0 82 276 A P T 3 S+ 0 0 18 0, 0.0 3,-0.2 0, 0.0 -29,-0.1 0.470 79.5 75.9 -89.3 3.5 29.4 -34.6 -42.0 83 277 A S T 3 S+ 0 0 68 1,-0.2 24,-0.1 -32,-0.1 -30,-0.0 0.766 93.4 46.8 -79.4 -26.3 27.9 -32.2 -44.6 84 278 A T S < S+ 0 0 41 -3,-0.6 20,-2.9 19,-0.1 2,-0.4 0.394 86.7 87.6-112.3 -1.3 24.2 -32.6 -43.7 85 279 A I E +I 103 0C 4 18,-0.2 2,-0.3 -4,-0.2 18,-0.2 -0.820 55.2 170.2 -96.1 141.1 24.0 -32.3 -39.9 86 280 A H E +I 102 0C 17 16,-2.3 16,-2.4 -2,-0.4 -2,-0.0 -0.995 43.3 8.3-151.3 156.1 23.6 -28.8 -38.4 87 281 A H E - 0 0 37 -2,-0.3 67,-0.3 14,-0.2 -1,-0.1 0.801 70.0-171.3 45.8 49.4 22.9 -26.8 -35.3 88 282 A c E - 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