==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-JUN-08 2VWD . COMPND 2 MOLECULE: HEMAGGLUTININ-NEURAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NIPAH VIRUS; . AUTHOR T.A.BOWDEN,M.CRISPIN,D.J.HARVEY,A.R.ARICESCU,J.M.GRIMES,E.Y. . 823 5 14 12 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34418.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 493 59.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 294 35.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.5 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 . 1 0.1 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 . 77 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 2 10 2 6 4 3 4 3 2 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 6 3 3 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 1 187 A N 0 0 184 0, 0.0 2,-0.3 0, 0.0 384,-0.1 0.000 360.0 360.0 360.0 120.9 -2.0 -26.1 -14.3 2 188 A I - 0 0 17 412,-0.0 2,-0.3 1,-0.0 410,-0.3 -0.798 360.0 -77.8-119.0 164.0 -3.3 -22.6 -14.0 3 189 A a - 0 0 2 408,-2.2 410,-0.1 410,-0.3 357,-0.1 -0.507 43.4-177.3 -62.4 121.1 -2.8 -19.9 -11.3 4 190 A L + 0 0 88 -2,-0.3 2,-0.3 408,-0.1 -1,-0.2 0.406 51.3 89.7-101.0 -1.3 -5.0 -20.9 -8.4 5 191 A Q S S- 0 0 128 1,-0.0 2,-0.3 354,-0.0 -2,-0.0 -0.693 81.0-108.3-106.6 149.2 -4.3 -17.9 -6.2 6 192 A K + 0 0 114 -2,-0.3 2,-0.3 2,-0.0 354,-0.2 -0.584 49.4 165.4 -70.6 130.9 -5.8 -14.5 -5.8 7 193 A T - 0 0 30 352,-2.7 354,-0.3 -2,-0.3 4,-0.1 -0.992 44.8-152.9-152.7 143.9 -3.5 -11.8 -7.2 8 194 A S + 0 0 120 -2,-0.3 2,-0.1 352,-0.1 352,-0.1 0.435 65.6 117.9 -89.3 -4.7 -3.6 -8.1 -8.3 9 195 A N S S- 0 0 72 405,-0.2 2,-2.1 1,-0.1 3,-0.3 -0.398 77.4-118.9 -61.2 139.0 -0.7 -8.8 -10.7 10 196 A Q + 0 0 160 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 -0.468 59.7 145.5 -81.0 68.5 -1.7 -8.2 -14.4 11 197 A I + 0 0 21 -2,-2.1 2,-0.5 350,-0.1 -1,-0.2 0.581 47.8 84.0 -83.6 -12.8 -1.0 -11.8 -15.4 12 198 A L - 0 0 6 349,-0.3 398,-0.1 -3,-0.3 349,-0.1 -0.831 57.7-172.9 -92.1 126.6 -3.9 -11.8 -18.0 13 199 A K - 0 0 118 -2,-0.5 396,-0.4 396,-0.4 394,-0.1 -0.778 11.3-156.8-120.0 83.3 -2.9 -10.4 -21.4 14 200 A P - 0 0 41 0, 0.0 2,-0.5 0, 0.0 394,-0.2 -0.378 6.3-151.4 -59.9 135.8 -6.0 -10.1 -23.6 15 201 A K E -A 407 0A 84 392,-2.8 392,-2.9 -2,-0.1 2,-0.7 -0.956 11.6-132.2-112.1 124.7 -5.2 -10.0 -27.3 16 202 A L E +A 406 0A 100 -2,-0.5 390,-0.2 390,-0.2 2,-0.1 -0.672 36.9 171.7 -74.1 113.0 -7.6 -8.2 -29.7 17 203 A I 0 0 8 388,-2.0 388,-0.5 -2,-0.7 60,-0.1 -0.300 360.0 360.0-103.2-168.2 -8.2 -10.7 -32.6 18 204 A S 0 0 84 -2,-0.1 59,-0.1 386,-0.1 388,-0.1 0.167 360.0 360.0-148.7 360.0 -10.7 -10.4 -35.5 19 ! 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 20 206 A T 0 0 28 0, 0.0 60,-0.3 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 -50.7 -14.7 -13.2 -38.5 21 207 A L > - 0 0 25 1,-0.1 3,-0.5 3,-0.0 0, 0.0 -0.919 360.0-138.4-123.6 149.2 -15.9 -10.8 -41.2 22 208 A P T 3 S+ 0 0 118 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.780 97.8 72.5 -74.5 -30.1 -14.5 -7.5 -42.6 23 209 A V T > S+ 0 0 37 2,-0.2 3,-1.9 1,-0.2 2,-1.8 0.810 77.7 84.5 -54.2 -32.5 -17.9 -5.8 -42.7 24 210 A V T < S+ 0 0 14 -3,-0.5 -1,-0.2 1,-0.3 3,-0.1 -0.582 97.6 35.2 -68.7 85.9 -17.6 -5.7 -38.9 25 211 A G T 3 S+ 0 0 55 -2,-1.8 -1,-0.3 1,-0.5 2,-0.2 0.047 88.0 119.2 146.0 -28.3 -15.5 -2.5 -39.3 26 212 A Q X - 0 0 99 -3,-1.9 3,-0.8 -4,-0.3 -1,-0.5 -0.503 64.0-124.3 -65.5 132.9 -17.2 -0.8 -42.2 27 213 A S T 3 S+ 0 0 115 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 -0.537 90.6 41.4 -77.3 145.9 -18.8 2.6 -41.5 28 214 A G T 3 S+ 0 0 46 1,-0.2 24,-2.7 -2,-0.2 2,-0.4 0.195 97.7 87.0 101.8 -14.5 -22.5 3.1 -42.2 29 215 A T E < -F 51 0B 12 -3,-0.8 2,-0.4 22,-0.2 22,-0.2 -0.958 62.7-147.8-121.8 139.0 -23.6 -0.4 -40.9 30 216 A b E -F 50 0B 1 20,-2.9 20,-2.3 -2,-0.4 2,-0.6 -0.882 11.1-147.0-103.8 135.0 -24.6 -1.4 -37.4 31 217 A I E +F 49 0B 2 370,-1.5 18,-0.2 -2,-0.4 2,-0.2 -0.899 31.0 157.0-108.8 115.9 -23.8 -4.9 -36.2 32 218 A T E +F 48 0B 19 16,-3.0 16,-2.8 -2,-0.6 -2,-0.0 -0.685 40.4 39.4-129.5 177.8 -26.3 -6.4 -33.7 33 219 A D E S- 0 0 47 -2,-0.2 -1,-0.2 14,-0.2 2,-0.0 0.888 74.1-165.3 46.6 57.5 -27.8 -9.7 -32.3 34 220 A P E - 0 0 12 0, 0.0 2,-0.3 0, 0.0 13,-0.2 -0.323 15.7-171.2 -74.5 152.4 -24.4 -11.6 -32.1 35 221 A L E +F 46 0B 9 11,-2.0 11,-1.9 -2,-0.0 2,-0.3 -0.988 6.3 175.8-136.2 137.4 -23.9 -15.3 -31.7 36 222 A L E +F 45 0B 0 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.967 6.6 171.0-139.0 130.2 -20.6 -17.1 -31.1 37 223 A A E -F 44 0B 1 7,-2.5 7,-2.1 -2,-0.3 2,-0.3 -0.968 8.1-169.8-135.1 148.4 -20.4 -20.9 -30.5 38 224 A M E +F 43 0B 28 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.997 14.3 151.7-145.2 137.5 -17.3 -23.2 -30.3 39 225 A D E > -F 42 0B 37 3,-2.1 3,-2.3 -2,-0.3 61,-0.1 -0.920 66.2 -5.9-164.3 136.6 -16.8 -27.0 -30.2 40 226 A E T 3 S- 0 0 121 1,-0.3 3,-0.1 -2,-0.3 339,-0.0 0.730 128.7 -47.2 53.0 35.8 -14.1 -29.4 -31.3 41 227 A G T 3 S+ 0 0 43 1,-0.3 27,-2.5 26,-0.1 -1,-0.3 0.455 120.7 99.2 86.4 3.0 -11.9 -26.8 -33.1 42 228 A Y E < -FG 39 67B 49 -3,-2.3 -3,-2.1 25,-0.3 -1,-0.3 -0.754 51.7-159.2-118.1 163.2 -14.8 -25.3 -35.0 43 229 A F E -FG 38 66B 0 23,-2.4 23,-2.1 -2,-0.3 2,-0.3 -0.960 9.0-154.5-138.1 156.7 -17.0 -22.2 -34.5 44 230 A A E -FG 37 65B 2 -7,-2.1 -7,-2.5 -2,-0.3 2,-0.3 -0.968 19.4-177.4-124.3 148.2 -20.4 -20.8 -35.6 45 231 A Y E +FG 36 64B 4 19,-3.0 19,-2.8 -2,-0.3 2,-0.3 -0.991 6.3 179.3-146.7 143.7 -21.1 -17.1 -35.7 46 232 A S E +FG 35 63B 1 -11,-1.9 -11,-2.0 -2,-0.3 2,-0.3 -0.995 5.5 162.7-145.2 148.9 -24.1 -14.9 -36.5 47 233 A H E - G 0 62B 0 15,-1.6 15,-2.3 -2,-0.3 2,-0.5 -0.977 30.7-126.0-153.2 163.4 -25.0 -11.2 -36.6 48 234 A L E -FG 32 61B 12 -16,-2.8 -16,-3.0 -2,-0.3 2,-0.5 -0.969 22.1-153.4-109.7 125.9 -27.6 -8.8 -38.0 49 235 A E E -FG 31 60B 0 11,-3.3 10,-3.7 -2,-0.5 11,-1.8 -0.869 10.5-170.8 -98.0 131.9 -26.3 -5.9 -40.2 50 236 A R E -FG 30 58B 62 -20,-2.3 -20,-2.9 -2,-0.5 2,-0.6 -0.988 25.0-125.9-124.7 124.7 -28.4 -2.7 -40.3 51 237 A I E S-F 29 0B 104 6,-1.3 2,-0.6 -2,-0.4 -22,-0.2 -0.603 82.5 -26.8 -66.6 113.5 -27.8 0.2 -42.8 52 238 A G S S+ 0 0 45 -24,-2.7 -2,-0.2 -2,-0.6 -24,-0.1 -0.715 121.7 48.9 86.8-117.7 -27.5 3.3 -40.5 53 239 A S 0 0 85 -2,-0.6 4,-0.6 1,-0.1 -23,-0.3 -0.071 360.0 360.0 -63.4 162.3 -29.4 3.1 -37.2 54 240 A b 0 0 48 2,-0.2 -1,-0.1 345,-0.1 -2,-0.1 0.507 360.0 360.0 -98.9 360.0 -29.1 0.1 -34.8 55 ! 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 56 243 A G 0 0 65 0, 0.0 -2,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-156.8 -33.0 0.0 -37.2 57 244 A V - 0 0 83 -4,-0.6 -6,-1.3 -5,-0.0 33,-0.0 -0.574 360.0-129.7-162.6 92.5 -33.4 -1.4 -40.7 58 245 A S E +G 50 0B 19 -8,-0.2 -8,-0.3 1,-0.2 32,-0.1 -0.134 31.9 167.3 -53.0 127.5 -32.1 -4.9 -41.3 59 246 A K E - 0 0 87 -10,-3.7 2,-0.3 1,-0.3 -9,-0.2 0.722 65.5 -1.1-103.8 -40.5 -29.8 -5.3 -44.4 60 247 A Q E -G 49 0B 61 -11,-1.8 -11,-3.3 29,-0.1 2,-0.5 -0.936 47.0-154.4-162.5 128.5 -28.4 -8.7 -43.9 61 248 A R E -G 48 0B 4 25,-0.4 2,-0.4 -2,-0.3 -13,-0.2 -0.913 23.4-164.2 -95.8 128.8 -28.3 -11.7 -41.5 62 249 A I E -G 47 0B 3 -15,-2.3 -15,-1.6 -2,-0.5 2,-0.4 -0.953 12.6-178.3-115.8 137.5 -25.2 -13.7 -41.7 63 250 A I E +GH 46 84B 3 21,-2.5 21,-3.4 -2,-0.4 2,-0.3 -0.978 20.8 162.7-129.7 117.0 -24.8 -17.2 -40.3 64 251 A G E -GH 45 83B 0 -19,-2.8 -19,-3.0 -2,-0.4 2,-0.3 -0.931 22.6-160.4-137.8 160.0 -21.3 -18.7 -40.8 65 252 A V E +GH 44 82B 0 17,-2.4 16,-2.7 -2,-0.3 17,-1.6 -0.849 22.8 137.1-131.6 167.3 -19.0 -21.4 -39.5 66 253 A G E -GH 43 80B 0 -23,-2.1 -23,-2.4 -2,-0.3 2,-0.3 -0.965 43.9 -59.8 179.3-162.6 -15.3 -22.0 -39.6 67 254 A E E -GH 42 79B 43 12,-2.5 12,-3.0 -2,-0.3 2,-0.6 -0.815 26.3-138.7-111.8 145.4 -12.2 -23.2 -37.8 68 255 A V E + H 0 78B 19 -27,-2.5 2,-0.3 -2,-0.3 10,-0.2 -0.938 43.0 162.3 -98.4 116.7 -10.4 -21.9 -34.6 69 256 A L E - H 0 77B 71 8,-2.2 8,-2.5 -2,-0.6 2,-0.4 -0.943 49.8 -93.9-137.4 153.0 -6.7 -22.0 -35.5 70 257 A D E - H 0 76B 61 -2,-0.3 -2,-0.0 6,-0.3 8,-0.0 -0.577 36.1-148.0 -61.1 120.4 -3.3 -20.7 -34.3 71 258 A R - 0 0 105 4,-2.6 -1,-0.1 -2,-0.4 7,-0.0 0.608 55.7 -77.2 -75.4 -12.1 -3.0 -17.6 -36.5 72 259 A G S S+ 0 0 70 3,-0.2 -2,-0.1 0, 0.0 -1,-0.1 0.073 123.0 61.9 142.8 -27.6 0.9 -17.8 -36.7 73 260 A D S S- 0 0 87 2,-0.3 -2,-0.0 0, 0.0 -3,-0.0 -0.129 118.6 -86.7-121.4 34.7 2.2 -16.5 -33.3 74 261 A E S S+ 0 0 129 1,-0.2 -4,-0.1 0, 0.0 307,-0.0 0.619 96.0 116.6 70.5 16.5 0.6 -19.0 -30.8 75 262 A V - 0 0 10 -6,-0.0 -4,-2.6 311,-0.0 -2,-0.3 -0.970 62.7-128.5-116.4 126.4 -2.6 -17.0 -30.5 76 263 A P E +H 70 0B 0 0, 0.0 2,-0.3 0, 0.0 -6,-0.3 -0.388 32.4 167.9 -74.2 149.4 -5.9 -18.6 -31.7 77 264 A S E -H 69 0B 11 -8,-2.5 -8,-2.2 -60,-0.1 2,-0.5 -0.908 35.5 -92.9-148.6 178.2 -8.3 -16.8 -34.1 78 265 A L E -H 68 0B 14 -2,-0.3 2,-0.6 -10,-0.2 -10,-0.2 -0.837 26.3-168.8-106.0 127.8 -11.3 -17.5 -36.3 79 266 A F E -H 67 0B 88 -12,-3.0 -12,-2.5 -2,-0.5 -36,-0.1 -0.946 20.7-137.3-118.7 109.1 -11.1 -18.5 -39.9 80 267 A M E +H 66 0B 48 -2,-0.6 -14,-0.3 -60,-0.3 3,-0.1 -0.403 29.1 167.9 -70.4 141.4 -14.5 -18.5 -41.7 81 268 A T E + 0 0 39 -16,-2.7 2,-0.3 1,-0.3 -15,-0.2 0.579 63.0 20.2-129.6 -23.8 -15.1 -21.4 -44.0 82 269 A N E -H 65 0B 15 -17,-1.6 -17,-2.4 53,-0.1 2,-0.4 -0.889 61.4-170.3-164.0 118.0 -18.8 -21.4 -44.9 83 270 A V E -H 64 0B 62 -2,-0.3 2,-0.4 -19,-0.2 -19,-0.3 -0.955 1.9-168.4-124.2 132.7 -21.3 -18.5 -44.9 84 271 A W E -H 63 0B 39 -21,-3.4 -21,-2.5 -2,-0.4 -2,-0.0 -0.962 4.5-162.8-120.1 137.7 -25.1 -18.5 -45.4 85 272 A T - 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