==== 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 02-MAY-08 3D11 . COMPND 2 MOLECULE: HEMAGGLUTININ-NEURAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NIPAH VIRUS; . AUTHOR K.XU,K.R.RAJASHANKAR,Y.P.CHAN,P.HIMANEN,C.C.BRODER,D.B.NIKOL . 427 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17611.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 262 61.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 151 35.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 . 48 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 . 3 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 0 0 PARALLEL BRIDGES PER LADDER . 2 2 1 6 1 2 2 1 2 2 1 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 3 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 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 1 177 A G 0 0 105 0, 0.0 392,-0.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0-149.3 34.8 16.8 68.7 2 178 A V E +A 392 0A 21 77,-0.3 2,-0.3 390,-0.2 390,-0.2 -0.922 360.0 168.9-112.6 137.4 33.3 14.4 71.3 3 179 A S E -A 391 0A 61 388,-1.9 388,-3.1 -2,-0.4 3,-0.1 -0.941 36.4 -75.6-145.8 165.5 29.7 13.3 71.1 4 180 A N - 0 0 46 -2,-0.3 2,-1.4 386,-0.2 386,-0.2 -0.109 52.5 -96.5 -61.9 159.9 27.3 10.8 72.6 5 181 A L S S+ 0 0 4 384,-0.5 267,-2.7 265,-0.3 2,-0.3 -0.636 78.3 127.0 -79.5 93.3 27.2 7.1 71.7 6 182 A V + 0 0 80 -2,-1.4 2,-0.4 266,-0.2 -3,-0.0 -0.960 47.4 13.2-149.6 155.3 24.5 7.3 69.2 7 183 A G S S- 0 0 55 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.593 112.8 -23.9 81.3-129.1 23.9 6.2 65.5 8 184 A L - 0 0 152 -2,-0.4 -1,-0.1 3,-0.0 3,-0.1 -0.713 67.8-172.4-130.6 84.0 26.4 3.8 63.9 9 185 A P - 0 0 28 0, 0.0 386,-0.2 0, 0.0 3,-0.1 -0.143 39.2 -75.5 -68.0 162.1 29.9 3.8 65.5 10 186 A N - 0 0 65 384,-3.1 386,-0.2 1,-0.1 384,-0.0 -0.196 63.8 -87.5 -53.0 150.7 32.9 2.0 64.2 11 187 A N - 0 0 130 412,-0.1 2,-0.3 -3,-0.1 385,-0.2 -0.164 42.4-156.2 -58.6 155.1 33.0 -1.7 64.7 12 188 A I - 0 0 15 411,-0.1 411,-0.3 -3,-0.1 2,-0.2 -0.879 33.1 -82.3-126.5 163.0 34.4 -3.2 67.9 13 189 A a - 0 0 6 409,-2.7 411,-0.1 -2,-0.3 357,-0.1 -0.470 40.2-178.2 -66.7 136.2 35.8 -6.6 68.7 14 190 A L + 0 0 62 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.377 48.3 91.6-117.4 -1.6 33.0 -9.1 69.4 15 191 A Q S S- 0 0 135 1,-0.0 2,-0.4 355,-0.0 409,-0.0 -0.762 80.2-108.4-105.8 144.6 35.0 -12.2 70.3 16 192 A K + 0 0 107 -2,-0.3 2,-0.3 2,-0.0 355,-0.2 -0.541 54.6 161.4 -64.6 120.2 36.2 -13.6 73.6 17 193 A T - 0 0 22 353,-2.5 355,-0.3 -2,-0.4 4,-0.1 -0.977 47.5-152.4-143.7 155.8 40.0 -13.2 73.6 18 194 A S + 0 0 107 -2,-0.3 -1,-0.1 353,-0.1 353,-0.1 0.391 63.0 120.6-104.8 -2.6 42.9 -13.1 75.9 19 195 A N S S- 0 0 78 406,-0.2 2,-1.7 1,-0.1 3,-0.3 -0.352 75.3-118.3 -55.4 139.0 44.9 -10.9 73.6 20 196 A Q + 0 0 109 1,-0.2 -1,-0.1 351,-0.1 353,-0.1 -0.628 62.9 139.9 -84.4 83.6 45.8 -7.6 75.2 21 197 A I + 0 0 12 -2,-1.7 2,-0.5 351,-0.2 -1,-0.2 0.484 47.5 85.9-105.3 -10.6 43.8 -5.3 72.8 22 198 A L - 0 0 5 350,-0.3 399,-0.1 -3,-0.3 350,-0.1 -0.844 56.6-177.6 -89.3 126.1 42.6 -3.0 75.6 23 199 A K - 0 0 109 -2,-0.5 397,-0.3 397,-0.4 2,-0.1 -0.728 10.1-158.8-129.4 84.0 45.2 -0.3 76.3 24 200 A P - 0 0 39 0, 0.0 2,-0.4 0, 0.0 395,-0.2 -0.347 3.7-152.3 -66.6 137.5 44.1 2.0 79.1 25 201 A K E -B 418 0A 78 393,-3.2 393,-3.0 -2,-0.1 2,-0.5 -0.928 15.4-126.4-111.6 136.2 45.7 5.5 79.3 26 202 A L E +B 417 0A 82 -2,-0.4 391,-0.2 391,-0.2 3,-0.1 -0.686 37.4 161.5 -83.5 120.8 46.1 7.3 82.7 27 203 A I > + 0 0 0 389,-2.9 3,-1.3 -2,-0.5 62,-0.3 0.091 30.6 118.3-129.5 23.9 44.5 10.8 82.4 28 204 A S G > + 0 0 12 388,-0.6 3,-2.4 1,-0.3 5,-0.4 0.832 61.3 76.4 -61.0 -33.3 44.0 11.9 86.0 29 205 A Y G 3 S+ 0 0 143 1,-0.3 -1,-0.3 387,-0.1 5,-0.1 0.472 80.9 68.3 -66.2 -2.5 46.3 14.9 85.7 30 206 A T G < S+ 0 0 29 -3,-1.3 61,-0.5 3,-0.0 -1,-0.3 0.684 100.4 55.0 -87.4 -16.8 43.8 17.0 83.8 31 207 A L S < S- 0 0 7 -3,-2.4 2,-2.0 -4,-0.2 3,-0.4 -0.753 99.5-103.4-109.9 161.3 41.6 17.2 86.9 32 208 A P S S+ 0 0 73 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.365 92.2 97.6 -83.6 63.9 42.5 18.5 90.4 33 209 A V + 0 0 2 -2,-2.0 -4,-0.1 -5,-0.4 8,-0.1 0.141 42.0 97.4-136.1 14.1 42.8 15.0 92.0 34 210 A V S S- 0 0 98 -3,-0.4 -5,-0.1 -6,-0.1 -1,-0.0 0.722 79.3-167.1 -80.2 -23.0 46.6 14.2 91.9 35 211 A G - 0 0 41 1,-0.1 2,-0.4 5,-0.0 -2,-0.1 0.377 19.9 -81.3 77.3 168.6 46.5 15.4 95.4 36 212 A Q > - 0 0 127 1,-0.1 3,-2.6 3,-0.0 -1,-0.1 -0.947 41.4-112.1-119.8 134.4 48.6 16.5 98.4 37 213 A S T 3 S+ 0 0 85 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.709 113.4 44.4 -35.4 -44.4 50.3 14.0 100.8 38 214 A G T 3 S+ 0 0 50 23,-0.0 24,-1.7 2,-0.0 2,-0.4 0.151 101.3 86.2 -95.0 22.1 48.2 14.9 103.9 39 215 A T E < -F 61 0B 13 -3,-2.6 2,-0.4 22,-0.2 22,-0.2 -0.952 59.1-152.5-128.8 139.8 44.8 15.0 102.1 40 216 A b E -F 60 0B 0 20,-3.0 20,-2.5 -2,-0.4 2,-0.5 -0.855 9.5-149.1-106.0 142.9 42.3 12.3 101.2 41 217 A I E +F 59 0B 2 371,-1.8 2,-0.3 -2,-0.4 18,-0.2 -0.963 32.2 161.7-114.8 118.4 40.0 12.6 98.2 42 218 A T E +F 58 0B 14 16,-3.1 16,-2.8 -2,-0.5 23,-0.0 -0.823 38.2 34.9-134.7 167.8 36.6 10.9 98.8 43 219 A D E S- 0 0 50 -2,-0.3 -1,-0.2 14,-0.2 2,-0.1 0.901 72.8-170.1 57.9 51.2 33.0 10.7 97.6 44 220 A P E - 0 0 2 0, 0.0 2,-0.4 0, 0.0 13,-0.2 -0.308 15.3-168.3 -77.6 154.6 33.6 11.3 93.9 45 221 A L E +F 56 0B 7 11,-2.1 11,-2.0 -2,-0.1 2,-0.3 -0.990 5.6 178.8-135.9 139.5 31.1 11.9 91.1 46 222 A L E +F 55 0B 0 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.981 6.4 169.9-139.7 136.2 31.7 11.8 87.4 47 223 A A E -F 54 0B 1 7,-2.0 7,-2.3 -2,-0.3 2,-0.3 -0.992 9.3-167.9-146.3 144.6 29.0 12.4 84.8 48 224 A M E +F 53 0B 29 -2,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.996 14.2 155.6-141.9 141.8 29.3 12.9 81.0 49 225 A D E > -F 52 0B 14 3,-2.5 3,-1.3 -2,-0.3 62,-0.1 -0.823 67.1 -11.7-168.7 120.8 26.9 14.1 78.3 50 226 A E T 3 S- 0 0 89 1,-0.3 3,-0.1 -2,-0.2 -48,-0.1 0.737 128.4 -42.9 62.9 32.1 27.3 15.7 74.8 51 227 A G T 3 S+ 0 0 12 1,-0.4 28,-2.3 -50,-0.1 2,-0.3 0.485 122.0 95.6 92.7 3.0 31.0 16.6 75.1 52 228 A Y E < -FG 49 78B 29 -3,-1.3 -3,-2.5 26,-0.3 -1,-0.4 -0.821 51.1-164.7-122.0 164.3 30.7 17.9 78.7 53 229 A F E -FG 48 77B 0 24,-2.2 24,-1.7 -2,-0.3 2,-0.4 -0.979 11.9-147.3-142.6 153.4 31.3 16.4 82.1 54 230 A A E -FG 47 76B 3 -7,-2.3 -7,-2.0 -2,-0.3 2,-0.4 -0.973 21.3-173.8-117.4 141.7 30.4 17.2 85.7 55 231 A Y E +FG 46 75B 0 20,-3.3 20,-3.0 -2,-0.4 2,-0.3 -0.995 6.1 173.8-136.7 140.8 32.9 16.3 88.5 56 232 A S E +FG 45 74B 1 -11,-2.0 -11,-2.1 -2,-0.4 2,-0.3 -1.000 4.3 157.5-146.3 147.6 32.7 16.4 92.2 57 233 A H E - G 0 73B 0 16,-1.5 16,-2.9 -2,-0.3 2,-0.4 -0.983 30.1-128.6-157.8 164.4 34.7 15.3 95.3 58 234 A L E -FG 42 72B 8 -16,-2.8 -16,-3.1 -2,-0.3 2,-0.5 -0.956 19.1-150.1-112.9 133.3 35.3 16.0 98.9 59 235 A E E -FG 41 71B 16 12,-2.4 11,-2.5 -2,-0.4 12,-1.0 -0.914 13.9-168.3-103.3 133.2 38.8 16.6 100.3 60 236 A R E -FG 40 69B 46 -20,-2.5 -20,-3.0 -2,-0.5 2,-0.7 -0.928 21.4-127.2-117.1 144.5 39.5 15.6 103.9 61 237 A I E S-FG 39 68B 93 7,-2.4 7,-1.1 -2,-0.4 2,-0.4 -0.810 78.3 -24.7 -89.7 117.9 42.5 16.4 106.0 62 238 A G S S+ 0 0 37 -24,-1.7 5,-0.2 -2,-0.7 -2,-0.1 -0.700 118.3 48.3 87.7-130.0 44.0 13.2 107.4 63 239 A S S > S- 0 0 60 -2,-0.4 4,-0.7 3,-0.1 -23,-0.2 -0.068 70.6-135.4 -50.8 148.0 41.7 10.1 107.9 64 240 A b T 4 S+ 0 0 39 2,-0.1 -1,-0.1 1,-0.1 347,-0.0 0.687 100.6 26.5 -79.1 -19.9 39.6 9.1 104.9 65 241 A S T 4 S+ 0 0 72 -23,-0.0 -1,-0.1 -5,-0.0 -2,-0.1 0.739 133.8 27.5-113.2 -35.8 36.5 8.5 107.0 66 242 A R T 4 S+ 0 0 208 2,-0.1 -2,-0.1 -6,-0.0 -3,-0.1 0.183 91.1 122.8-117.2 15.0 36.8 10.7 110.0 67 243 A G S < S- 0 0 11 -4,-0.7 2,-0.3 -5,-0.2 -5,-0.2 -0.333 72.2 -88.0 -78.4 161.2 38.9 13.5 108.7 68 244 A V E -G 61 0B 97 -7,-1.1 -7,-2.4 1,-0.1 2,-0.6 -0.517 41.9-118.9 -69.1 123.8 38.1 17.2 108.6 69 245 A S E +G 60 0B 19 -2,-0.3 -9,-0.2 -9,-0.2 3,-0.1 -0.515 35.4 176.8 -66.6 109.9 36.2 18.2 105.5 70 246 A K E - 0 0 90 -11,-2.5 2,-0.3 -2,-0.6 -1,-0.2 0.949 58.5 -19.7 -79.8 -55.8 38.4 20.8 103.8 71 247 A Q E -G 59 0B 58 -12,-1.0 -12,-2.4 29,-0.1 2,-0.6 -0.971 44.9-137.7-159.8 143.3 36.4 21.5 100.7 72 248 A R E -G 58 0B 4 -2,-0.3 2,-0.5 25,-0.3 -14,-0.2 -0.892 25.9-156.7 -94.1 123.0 33.7 20.2 98.4 73 249 A I E +G 57 0B 16 -16,-2.9 -16,-1.5 -2,-0.6 2,-0.4 -0.873 14.8 177.6-101.3 130.8 34.5 20.7 94.7 74 250 A I E +GH 56 95B 3 21,-2.2 21,-3.4 -2,-0.5 2,-0.3 -0.944 19.0 160.1-129.9 110.8 31.8 20.9 92.1 75 251 A G E -GH 55 94B 0 -20,-3.0 -20,-3.3 -2,-0.4 2,-0.3 -0.900 23.2-164.7-129.7 159.4 33.0 21.5 88.6 76 252 A V E +GH 54 93B 0 17,-2.6 16,-2.6 -2,-0.3 17,-1.8 -0.866 23.5 138.5-133.7 168.9 31.9 21.1 85.1 77 253 A G E -GH 53 91B 0 -24,-1.7 -24,-2.2 14,-0.3 2,-0.3 -0.959 43.8 -68.3 175.8-167.2 33.9 21.2 81.9 78 254 A E E -GH 52 90B 60 12,-2.2 12,-2.2 -2,-0.3 2,-0.6 -0.873 26.6-128.9-120.8 148.1 34.4 19.6 78.5 79 255 A V E + H 0 89B 3 -28,-2.3 2,-0.4 -2,-0.3 -77,-0.3 -0.842 42.6 176.1 -89.4 119.0 35.7 16.3 77.2 80 256 A L E - 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