==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 30-AUG-10 3ONU . COMPND 2 MOLECULE: CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NORWALK VIRUS; . AUTHOR G.S.HANSMAN,C.BIERTUMPFEL,L.CHEN,I.GEORGIEV,J.S.MCLELLAN,K.K . 622 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25337.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 362 58.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 196 31.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 7 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 1.1 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 . 58 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 10 3 6 7 1 2 6 1 1 0 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 1 1 0 0 1 0 2 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 1 224 A S 0 0 112 0, 0.0 3,-0.1 0, 0.0 250,-0.1 0.000 360.0 360.0 360.0 114.6 34.1 7.2 -7.7 2 225 A K - 0 0 100 248,-0.1 2,-0.0 1,-0.1 247,-0.0 -0.319 360.0-110.5 -54.7 125.3 33.1 5.0 -4.7 3 226 A P - 0 0 96 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.315 29.5-116.6 -62.0 138.5 31.0 2.1 -6.0 4 227 A F + 0 0 8 248,-0.2 2,-0.3 -3,-0.1 42,-0.1 -0.491 41.2 173.1 -75.1 141.7 27.4 2.1 -5.0 5 228 A T - 0 0 54 -2,-0.2 246,-0.1 296,-0.0 244,-0.1 -0.981 26.2-145.4-145.8 157.0 26.1 -0.8 -2.9 6 229 A L - 0 0 16 -2,-0.3 296,-0.1 294,-0.1 236,-0.1 -0.852 38.4-100.6-111.0 154.6 23.1 -2.0 -0.9 7 230 A P - 0 0 8 0, 0.0 2,-0.9 0, 0.0 293,-0.1 -0.355 33.1-114.2 -67.7 162.8 23.4 -3.9 2.3 8 231 A I + 0 0 95 291,-0.1 2,-0.4 293,-0.0 293,-0.1 -0.814 62.1 139.1 -99.0 95.9 23.0 -7.7 2.2 9 232 A L - 0 0 17 -2,-0.9 291,-0.4 291,-0.2 2,-0.1 -0.995 44.3-138.2-145.5 127.2 19.8 -8.2 4.1 10 233 A T > - 0 0 29 -2,-0.4 3,-2.5 289,-0.1 289,-0.2 -0.329 40.0 -99.0 -75.3 167.0 16.9 -10.5 3.6 11 234 A L G > S+ 0 0 30 287,-0.8 3,-1.4 1,-0.3 12,-0.4 0.863 125.9 59.5 -55.2 -33.0 13.4 -9.2 4.2 12 235 A G G 3 S+ 0 0 54 284,-0.5 -1,-0.3 1,-0.3 360,-0.2 0.444 103.8 51.9 -78.9 1.9 13.5 -10.9 7.6 13 236 A E G < S+ 0 0 45 -3,-2.5 2,-0.3 358,-0.1 -1,-0.3 0.110 97.3 88.8-117.6 16.2 16.5 -8.7 8.5 14 237 A L < - 0 0 4 -3,-1.4 9,-2.4 9,-0.2 2,-0.3 -0.830 56.1-156.0-118.0 151.1 14.9 -5.4 7.5 15 238 A T B -A 22 0A 2 -2,-0.3 225,-2.3 7,-0.3 226,-0.4 -0.907 28.1 -99.3-125.0 155.6 12.8 -2.8 9.4 16 239 A N - 0 0 1 5,-3.2 5,-0.3 -2,-0.3 25,-0.1 -0.456 17.3-151.9 -70.8 143.8 10.3 -0.2 8.3 17 240 A S S S+ 0 0 0 221,-0.4 24,-0.4 1,-0.2 25,-0.1 0.486 93.3 49.9 -94.8 -3.0 11.5 3.4 8.0 18 241 A R S S+ 0 0 0 1,-0.4 88,-0.3 22,-0.1 -1,-0.2 0.518 122.9 12.4-112.5 -11.8 8.0 4.9 8.7 19 242 A F S S- 0 0 0 2,-0.2 2,-2.1 215,-0.1 -1,-0.4 -0.936 88.5 -97.2-158.5 149.9 7.0 2.9 11.8 20 243 A P S S+ 0 0 35 0, 0.0 -3,-0.1 0, 0.0 38,-0.0 -0.449 80.7 116.1 -77.5 83.1 9.1 0.7 14.2 21 244 A L - 0 0 0 -2,-2.1 -5,-3.2 -5,-0.3 -2,-0.2 -0.973 68.4-104.9-142.8 149.9 8.1 -2.6 12.7 22 245 A P B -A 15 0A 20 0, 0.0 2,-0.4 0, 0.0 -7,-0.3 -0.456 45.9-100.9 -69.4 152.9 9.9 -5.5 10.9 23 246 A I - 0 0 7 -9,-2.4 198,-0.2 -12,-0.4 -9,-0.2 -0.649 40.5-179.0 -71.1 128.8 9.4 -5.7 7.1 24 247 A D - 0 0 68 196,-2.6 2,-0.3 -2,-0.4 197,-0.2 0.837 56.4 -15.4 -96.7 -42.7 6.7 -8.4 6.4 25 248 A V E -B 220 0B 37 195,-1.8 195,-3.0 -14,-0.1 -1,-0.3 -0.990 61.0-105.8-156.6 157.3 6.4 -8.4 2.7 26 249 A L E -BC 219 292B 3 266,-0.5 266,-2.4 -2,-0.3 2,-0.3 -0.682 47.3-171.9 -81.9 150.0 7.1 -6.6 -0.6 27 250 A Y E -BC 218 291B 30 191,-2.1 191,-2.9 -2,-0.3 2,-0.3 -0.998 20.5-165.2-150.7 143.7 4.0 -5.0 -2.0 28 251 A T E + C 0 290B 0 262,-1.9 262,-2.7 -2,-0.3 189,-0.1 -0.934 8.8 177.3-126.9 157.3 2.6 -3.2 -5.0 29 252 A N > + 0 0 44 187,-0.5 3,-1.9 -2,-0.3 260,-0.2 -0.500 6.2 177.3-153.2 74.5 -0.6 -1.2 -5.6 30 253 A P T 3 S+ 0 0 45 0, 0.0 259,-0.1 0, 0.0 186,-0.1 0.745 77.4 55.4 -57.2 -27.7 -0.6 0.2 -9.2 31 254 A N T 3 S+ 0 0 150 184,-0.0 258,-0.0 2,-0.0 184,-0.0 0.360 71.7 142.2 -96.2 7.9 -4.0 1.8 -9.1 32 255 A E < - 0 0 63 -3,-1.9 4,-0.1 1,-0.2 -3,-0.0 -0.195 34.5-164.8 -42.2 125.6 -3.3 3.9 -6.0 33 256 A S + 0 0 123 2,-0.1 -1,-0.2 0, 0.0 2,-0.1 0.677 57.9 92.3 -93.4 -20.8 -5.0 7.2 -6.5 34 257 A A S S- 0 0 33 1,-0.1 2,-0.4 155,-0.0 155,-0.1 -0.426 84.3-109.1 -74.3 150.6 -3.1 9.1 -3.7 35 258 A I - 0 0 118 -2,-0.1 2,-0.8 153,-0.1 -1,-0.1 -0.638 31.9-134.8 -72.0 125.5 0.1 11.1 -4.3 36 259 A V B +E 207 0C 8 171,-0.5 171,-2.3 -2,-0.4 152,-0.1 -0.805 50.1 140.0 -89.8 108.5 2.9 9.1 -2.6 37 260 A Q + 0 0 51 -2,-0.8 167,-0.1 169,-0.2 -1,-0.1 -0.199 19.7 168.8-148.0 48.2 4.9 11.7 -0.6 38 261 A C - 0 0 1 1,-0.1 69,-0.1 3,-0.1 150,-0.1 -0.227 24.2-152.6 -61.8 157.0 5.9 10.2 2.7 39 262 A Q S S+ 0 0 0 67,-0.1 13,-1.6 65,-0.1 14,-0.6 0.605 71.3 69.1-114.5 -21.4 8.5 12.1 4.7 40 263 A N S S+ 0 0 2 1,-0.2 -22,-0.1 11,-0.2 -23,-0.1 -0.734 95.7 33.3 -93.6 154.9 10.1 9.3 6.8 41 264 A G S S+ 0 0 1 -24,-0.4 2,-0.5 -2,-0.3 197,-0.2 0.855 85.1 141.6 67.6 36.4 12.4 6.8 5.1 42 265 A R + 0 0 0 8,-0.4 8,-2.4 -3,-0.4 2,-0.3 -0.949 11.7 138.6-116.8 121.1 13.5 9.4 2.5 43 266 A C B -F 49 0D 0 -2,-0.5 6,-0.2 236,-0.4 2,-0.1 -0.960 44.8-123.6-160.4 133.8 17.1 9.3 1.4 44 267 A T > - 0 0 11 4,-2.1 3,-1.9 -2,-0.3 235,-0.2 -0.358 34.7-107.4 -74.3 163.0 18.8 9.8 -2.0 45 268 A L T 3 S+ 0 0 1 233,-2.4 206,-0.4 1,-0.3 -1,-0.1 0.745 120.6 57.8 -65.6 -21.1 21.1 7.1 -3.3 46 269 A D T 3 S- 0 0 59 232,-0.3 -1,-0.3 204,-0.2 233,-0.1 0.289 127.1 -96.0 -94.7 12.1 24.0 9.4 -2.6 47 270 A G S < S+ 0 0 8 -3,-1.9 2,-0.7 1,-0.2 -2,-0.1 0.628 71.9 144.7 96.4 14.4 23.1 9.6 1.1 48 271 A E - 0 0 106 1,-0.0 -4,-2.1 198,-0.0 -1,-0.2 -0.778 40.9-141.7 -89.4 112.4 21.1 12.8 1.5 49 272 A L B -F 43 0D 50 -2,-0.7 -6,-0.3 -6,-0.2 2,-0.2 -0.493 24.7-172.8 -71.4 141.4 18.3 12.5 4.1 50 273 A Q > + 0 0 35 -8,-2.4 3,-2.1 -2,-0.2 -8,-0.4 -0.794 42.2 9.0-130.1 172.1 15.1 14.2 3.2 51 274 A G T 3 S- 0 0 9 151,-0.4 49,-0.2 1,-0.3 -11,-0.2 -0.363 124.9 -32.6 61.5-134.3 11.8 15.1 4.8 52 275 A T T 3 S+ 0 0 0 -13,-1.6 51,-2.6 46,-0.1 -1,-0.3 0.075 96.9 143.2-102.4 20.3 11.6 14.3 8.5 53 276 A T < + 0 0 4 -3,-2.1 2,-0.3 -14,-0.6 -13,-0.1 -0.422 19.6 168.0 -75.0 132.6 14.0 11.3 8.1 54 277 A Q - 0 0 21 -2,-0.2 -13,-0.2 2,-0.1 190,-0.1 -0.811 39.5-114.4-134.3 171.6 16.6 10.6 10.8 55 278 A L S S+ 0 0 10 -2,-0.3 189,-0.1 188,-0.1 274,-0.1 0.744 78.4 95.5 -87.5 -22.6 18.8 7.6 11.4 56 279 A L >> - 0 0 15 272,-0.2 3,-1.3 1,-0.2 4,-0.5 -0.512 58.3-152.5 -79.7 129.3 17.6 6.1 14.7 57 280 A P G >4 S+ 0 0 9 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.848 102.5 56.1 -61.4 -28.0 15.1 3.2 14.5 58 281 A T G 34 S+ 0 0 37 1,-0.2 -2,-0.1 279,-0.1 -3,-0.0 0.600 99.7 61.3 -76.3 -10.7 13.9 4.5 18.0 59 282 A G G X4 S+ 0 0 2 -3,-1.3 3,-1.8 2,-0.1 2,-0.5 0.581 73.1 109.9 -91.2 -14.8 13.3 7.9 16.5 60 283 A I T << S- 0 0 3 -3,-0.7 44,-0.1 -4,-0.5 3,-0.1 -0.534 101.1 -9.6 -74.9 118.2 10.6 6.9 14.0 61 284 A C T 3 S+ 0 0 0 42,-2.3 -1,-0.3 -2,-0.5 2,-0.2 0.689 108.9 132.3 63.6 26.1 7.2 8.3 15.2 62 285 A A < - 0 0 9 -3,-1.8 2,-0.3 41,-0.3 -1,-0.3 -0.671 38.7-163.5-101.7 156.5 8.8 9.2 18.5 63 286 A F E -G 171 0E 6 108,-1.1 108,-2.6 -2,-0.2 2,-0.4 -0.990 6.4-168.3-134.0 151.1 8.6 12.5 20.4 64 287 A R E +G 170 0E 108 21,-0.5 21,-2.5 -2,-0.3 2,-0.3 -0.987 39.6 92.2-131.1 140.6 10.5 14.1 23.2 65 288 A G E -GH 169 84E 7 104,-2.3 104,-2.8 -2,-0.4 2,-0.3 -0.912 65.4 -69.7 174.9-145.8 9.4 17.1 25.2 66 289 A K E -GH 168 83E 99 17,-1.5 17,-2.5 -2,-0.3 2,-0.1 -0.983 33.8-119.8-144.4 132.3 7.5 18.2 28.3 67 290 A V E - H 0 82E 1 100,-1.2 99,-2.8 -2,-0.3 15,-0.3 -0.462 23.9-174.1 -62.4 139.9 3.8 18.2 29.2 68 291 A T E - 0 0 50 13,-2.7 2,-0.3 1,-0.4 -1,-0.2 0.820 55.1 -40.6 -97.5 -68.3 2.5 21.6 29.9 69 292 A Q E - 0 0 117 12,-0.3 12,-2.5 96,-0.1 -1,-0.4 -0.973 59.5 -85.6-151.0 166.7 -1.1 21.0 31.2 70 293 A Q E - H 0 80E 108 -2,-0.3 2,-0.3 10,-0.2 10,-0.3 -0.492 51.6-159.9 -65.9 143.2 -4.2 19.0 30.7 71 294 A V E - H 0 79E 43 8,-2.5 8,-0.7 -2,-0.1 2,-0.2 -0.934 18.2-106.4-129.5 157.7 -6.4 20.6 28.1 72 295 A Q + 0 0 194 -2,-0.3 2,-0.3 6,-0.1 6,-0.1 -0.567 39.8 165.0 -78.7 142.7 -10.0 20.5 27.0 73 296 A D - 0 0 44 -2,-0.2 6,-0.1 2,-0.2 4,-0.1 -0.941 40.0-132.6-153.9 143.2 -10.9 18.6 23.9 74 297 A E S S+ 0 0 197 -2,-0.3 3,-0.1 2,-0.1 -1,-0.0 0.758 81.2 94.8 -70.0 -23.2 -14.4 17.5 22.7 75 298 A H S S- 0 0 125 1,-0.1 -2,-0.2 -3,-0.0 4,-0.1 -0.201 90.1 -84.7 -72.1 159.9 -13.1 14.1 22.0 76 299 A R S S+ 0 0 244 2,-0.0 2,-0.2 80,-0.0 -1,-0.1 -0.351 88.5 34.0 -65.7 140.1 -13.2 11.1 24.3 77 300 A G S S- 0 0 44 -3,-0.1 2,-0.5 79,-0.1 81,-0.2 -0.591 95.4 -60.8 114.7-175.9 -10.4 10.8 26.9 78 301 A T E - I 0 157E 18 79,-2.3 79,-2.6 -2,-0.2 2,-0.3 -0.935 55.0-148.8-108.6 133.2 -8.3 13.0 28.9 79 302 A H E -HI 71 156E 12 -8,-0.7 -8,-2.5 -2,-0.5 2,-0.4 -0.827 14.0-173.0-115.2 149.3 -6.1 15.3 26.8 80 303 A W E -HI 70 155E 7 75,-2.7 75,-2.4 -2,-0.3 2,-0.4 -0.994 16.4-139.6-140.6 137.3 -2.6 16.8 27.4 81 304 A N E - I 0 154E 31 -12,-2.5 -13,-2.7 -2,-0.4 2,-0.4 -0.793 22.4-175.5 -93.4 142.2 -0.5 19.3 25.6 82 305 A M E -HI 67 153E 0 71,-3.0 71,-2.6 -2,-0.4 -15,-0.3 -0.999 21.7-135.2-135.0 136.3 3.2 18.7 25.3 83 306 A T E -HI 66 152E 51 -17,-2.5 -17,-1.5 -2,-0.4 2,-0.4 -0.534 27.5-144.6 -72.2 152.2 6.0 20.9 23.9 84 307 A V E -H 65 0E 8 67,-2.0 8,-0.4 -19,-0.2 -19,-0.3 -0.975 15.8-172.8-124.5 140.0 8.4 19.0 21.7 85 308 A T - 0 0 36 -21,-2.5 -21,-0.5 -2,-0.4 2,-0.1 -0.499 46.3 -71.5-104.2 179.9 12.1 19.3 21.2 86 309 A N > - 0 0 39 4,-2.8 3,-2.2 -2,-0.2 -1,-0.2 -0.437 54.6-104.9 -61.6 157.4 14.4 17.6 18.7 87 310 A L T 3 S+ 0 0 42 15,-0.3 -1,-0.1 1,-0.3 -22,-0.1 0.800 122.6 59.3 -59.9 -26.0 14.8 14.0 19.6 88 311 A N T 3 S- 0 0 106 2,-0.1 -1,-0.3 -24,-0.1 -2,-0.0 0.427 121.0-108.4 -84.0 3.9 18.4 14.8 20.9 89 312 A G S < S+ 0 0 31 -3,-2.2 -2,-0.1 1,-0.3 3,-0.1 0.259 78.5 127.9 92.5 -11.2 16.8 17.2 23.4 90 313 A T S S- 0 0 65 1,-0.1 -4,-2.8 -5,-0.1 -1,-0.3 -0.407 73.4 -86.7 -72.0 152.9 17.9 20.4 21.8 91 314 A P - 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