==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 18-OCT-10 3PA2 . 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 . 625 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25349.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 362 57.9 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 . 194 31.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 56 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 8.6 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 . 11 1 8 6 1 2 7 0 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 2 2 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 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 0 122 0, 0.0 250,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 135.0 33.8 7.9 -7.6 2 225 A K - 0 0 102 248,-0.1 247,-0.0 1,-0.1 0, 0.0 -0.421 360.0-104.1 -60.2 129.4 33.1 5.5 -4.8 3 226 A P - 0 0 98 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.281 32.8-118.5 -57.8 135.6 31.0 2.5 -6.0 4 227 A F + 0 0 9 248,-0.1 2,-0.3 -3,-0.1 42,-0.1 -0.534 42.2 171.5 -72.8 142.5 27.3 2.6 -5.2 5 228 A T - 0 0 55 -2,-0.2 246,-0.1 296,-0.0 244,-0.1 -0.985 27.3-144.7-148.4 157.6 26.1 -0.3 -3.1 6 229 A L - 0 0 17 -2,-0.3 296,-0.1 294,-0.1 236,-0.1 -0.836 38.4 -98.5-111.1 158.3 23.1 -1.6 -1.1 7 230 A P - 0 0 8 0, 0.0 2,-1.0 0, 0.0 293,-0.1 -0.360 33.5-116.4 -67.8 160.5 23.4 -3.6 2.1 8 231 A I + 0 0 101 291,-0.1 2,-0.4 293,-0.0 293,-0.1 -0.750 61.0 141.8-100.2 85.4 23.1 -7.4 1.8 9 232 A L - 0 0 17 -2,-1.0 291,-0.4 291,-0.2 5,-0.1 -0.987 44.9-135.1-133.1 129.7 19.9 -8.0 3.8 10 233 A T > - 0 0 19 -2,-0.4 3,-2.2 289,-0.1 287,-0.2 -0.309 38.8-100.6 -72.8 167.8 17.1 -10.4 3.2 11 234 A L G > S+ 0 0 7 287,-1.0 3,-1.2 285,-0.7 12,-0.3 0.838 125.9 58.4 -57.2 -32.7 13.6 -9.1 3.6 12 235 A G G 3 S+ 0 0 38 284,-1.8 -1,-0.3 1,-0.2 361,-0.1 0.408 102.2 53.9 -81.2 3.7 13.6 -10.7 7.0 13 236 A E G < S+ 0 0 42 -3,-2.2 2,-0.3 283,-0.2 -1,-0.2 0.115 95.7 89.4-117.3 14.5 16.5 -8.6 8.1 14 237 A L < - 0 0 4 -3,-1.2 9,-2.3 9,-0.2 2,-0.3 -0.841 56.3-155.9-115.1 153.2 14.9 -5.3 7.2 15 238 A T B -A 22 0A 2 -2,-0.3 225,-2.3 7,-0.3 226,-0.4 -0.910 28.2 -97.8-126.4 157.6 12.8 -2.8 9.1 16 239 A N - 0 0 1 5,-3.2 5,-0.3 -2,-0.3 25,-0.1 -0.390 18.0-152.7 -72.6 142.1 10.3 -0.1 8.0 17 240 A S S S+ 0 0 0 221,-0.3 24,-0.3 1,-0.1 25,-0.1 0.455 93.1 50.4 -92.4 -2.9 11.4 3.5 7.9 18 241 A R S S+ 0 0 0 1,-0.4 88,-0.3 22,-0.1 -1,-0.1 0.547 123.0 11.6-114.1 -11.6 8.0 4.9 8.6 19 242 A F S S- 0 0 0 2,-0.2 2,-2.2 215,-0.1 -1,-0.4 -0.952 88.2 -96.7-158.6 150.2 7.0 3.0 11.7 20 243 A P S S+ 0 0 35 0, 0.0 -3,-0.1 0, 0.0 38,-0.0 -0.440 81.1 116.4 -74.2 80.6 9.0 0.7 14.0 21 244 A L - 0 0 0 -2,-2.2 -5,-3.2 -5,-0.3 -2,-0.2 -0.971 68.2-107.4-141.1 149.4 8.0 -2.6 12.4 22 245 A P B -A 15 0A 20 0, 0.0 2,-0.4 0, 0.0 -7,-0.3 -0.484 45.6 -99.0 -70.0 155.1 9.8 -5.4 10.5 23 246 A I - 0 0 7 -9,-2.3 198,-0.2 -12,-0.3 -9,-0.2 -0.632 41.3-179.6 -71.3 128.7 9.3 -5.6 6.8 24 247 A D - 0 0 65 196,-2.7 2,-0.3 -2,-0.4 197,-0.2 0.842 57.5 -14.2 -98.4 -40.3 6.7 -8.3 6.1 25 248 A V E -B 220 0B 27 195,-1.8 195,-3.0 -14,-0.0 -1,-0.4 -0.991 61.4-107.3-159.4 153.1 6.3 -8.3 2.3 26 249 A L E -BC 219 292B 2 266,-0.5 266,-2.4 -2,-0.3 2,-0.3 -0.667 47.3-170.0 -81.2 150.5 7.1 -6.3 -0.9 27 250 A Y E -BC 218 291B 33 191,-2.2 191,-3.0 -2,-0.3 2,-0.3 -0.999 20.7-166.3-150.2 141.3 4.0 -4.8 -2.3 28 251 A T E + C 0 290B 0 262,-2.0 262,-2.8 -2,-0.3 189,-0.1 -0.928 9.0 176.6-124.3 158.4 2.5 -2.9 -5.3 29 252 A N > + 0 0 44 187,-0.5 3,-1.9 -2,-0.3 260,-0.2 -0.477 5.5 177.8-154.5 75.8 -0.7 -1.0 -5.9 30 253 A P T 3 S+ 0 0 48 0, 0.0 186,-0.1 0, 0.0 259,-0.1 0.751 77.7 56.0 -56.7 -29.5 -0.6 0.5 -9.5 31 254 A N T 3 S+ 0 0 154 184,-0.0 258,-0.0 2,-0.0 184,-0.0 0.345 71.9 141.3 -92.1 8.3 -4.1 2.1 -9.3 32 255 A E < - 0 0 66 -3,-1.9 4,-0.1 1,-0.1 -3,-0.0 -0.232 34.8-165.0 -46.1 126.4 -3.3 4.2 -6.2 33 256 A S + 0 0 122 2,-0.1 -1,-0.1 0, 0.0 2,-0.1 0.668 57.4 93.1 -92.7 -18.7 -5.0 7.6 -6.6 34 257 A A S S- 0 0 34 1,-0.1 2,-0.4 155,-0.0 155,-0.1 -0.407 83.1-110.4 -75.5 150.7 -3.1 9.4 -3.8 35 258 A I - 0 0 117 153,-0.1 2,-0.8 -2,-0.1 -1,-0.1 -0.667 32.5-135.4 -71.9 129.9 0.0 11.4 -4.3 36 259 A V B +E 207 0C 8 171,-0.6 171,-2.4 -2,-0.4 152,-0.1 -0.853 49.5 140.1 -95.6 112.4 2.8 9.4 -2.6 37 260 A Q + 0 0 49 -2,-0.8 167,-0.1 169,-0.2 169,-0.1 -0.290 19.5 169.7-152.2 47.2 4.9 11.9 -0.6 38 261 A C - 0 0 1 1,-0.1 69,-0.1 3,-0.1 150,-0.1 -0.267 23.4-152.9 -62.5 157.1 5.8 10.3 2.7 39 262 A Q S S+ 0 0 0 67,-0.1 13,-1.4 65,-0.1 14,-0.6 0.594 71.1 70.5-115.3 -19.4 8.4 12.2 4.8 40 263 A N S S+ 0 0 3 1,-0.2 -22,-0.1 12,-0.2 -23,-0.1 -0.724 96.4 32.3 -95.3 154.6 10.1 9.4 6.8 41 264 A G S S+ 0 0 1 -24,-0.3 2,-0.5 -2,-0.3 197,-0.2 0.847 85.0 142.4 66.3 36.5 12.3 6.9 5.0 42 265 A R + 0 0 0 8,-0.4 8,-2.4 -3,-0.4 2,-0.3 -0.945 12.0 139.1-115.5 117.0 13.4 9.6 2.5 43 266 A C B -F 49 0D 0 -2,-0.5 6,-0.2 236,-0.4 2,-0.0 -0.941 44.8-123.8-157.8 132.9 17.0 9.6 1.4 44 267 A T > - 0 0 9 4,-2.1 3,-1.9 -2,-0.3 235,-0.2 -0.319 34.0-108.4 -72.2 162.5 18.7 10.1 -2.0 45 268 A L T 3 S+ 0 0 1 233,-2.3 206,-0.4 1,-0.3 -1,-0.1 0.760 120.4 57.6 -65.0 -23.3 21.0 7.4 -3.4 46 269 A D T 3 S- 0 0 58 232,-0.3 -1,-0.3 204,-0.2 233,-0.1 0.295 127.2 -95.7 -94.2 13.2 23.9 9.7 -2.6 47 270 A G S < S+ 0 0 9 -3,-1.9 2,-0.7 1,-0.2 -2,-0.1 0.626 72.1 144.5 96.3 16.2 23.1 9.9 1.0 48 271 A E - 0 0 107 0, 0.0 -4,-2.1 0, 0.0 -1,-0.2 -0.799 40.7-142.6 -91.7 111.0 21.0 13.1 1.5 49 272 A L B -F 43 0D 51 -2,-0.7 -6,-0.3 -6,-0.2 2,-0.3 -0.452 24.8-172.8 -67.4 141.3 18.3 12.7 4.1 50 273 A Q > + 0 0 37 -8,-2.4 3,-2.1 -2,-0.1 -8,-0.4 -0.805 42.1 8.6-130.7 174.8 15.1 14.5 3.2 51 274 A G T 3 S- 0 0 10 151,-0.3 49,-0.2 -2,-0.3 -11,-0.2 -0.323 125.2 -32.2 58.8-132.8 11.7 15.3 4.8 52 275 A T T 3 S+ 0 0 0 -13,-1.4 51,-2.6 46,-0.1 -1,-0.2 0.083 96.6 143.4-105.4 22.6 11.6 14.4 8.5 53 276 A T < + 0 0 4 -3,-2.1 2,-0.3 -14,-0.6 49,-0.1 -0.424 19.1 167.7 -73.5 129.9 14.0 11.4 8.1 54 277 A Q - 0 0 19 -2,-0.2 -13,-0.2 2,-0.1 190,-0.1 -0.820 39.8-113.4-131.1 177.3 16.5 10.6 10.8 55 278 A L S S+ 0 0 9 -2,-0.3 189,-0.1 188,-0.1 275,-0.1 0.697 78.1 96.1 -91.6 -21.2 18.7 7.6 11.4 56 279 A L >> - 0 0 15 1,-0.2 3,-1.3 273,-0.2 4,-0.6 -0.532 57.1-153.7 -80.3 129.6 17.4 6.0 14.6 57 280 A P G >4 S+ 0 0 10 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.849 102.1 55.6 -64.1 -25.4 15.0 3.2 14.4 58 281 A T G 34 S+ 0 0 37 1,-0.2 -2,-0.1 280,-0.1 -3,-0.0 0.594 100.7 60.4 -78.6 -9.8 13.9 4.3 17.9 59 282 A G G X4 S+ 0 0 2 -3,-1.3 3,-1.8 2,-0.1 2,-0.4 0.612 72.6 110.8 -93.8 -13.8 13.2 7.8 16.5 60 283 A I T << S- 0 0 3 -3,-0.6 44,-0.1 -4,-0.6 3,-0.1 -0.500 101.7 -9.5 -71.4 119.9 10.6 6.9 13.9 61 284 A C T 3 S+ 0 0 0 42,-2.2 -1,-0.3 -2,-0.4 2,-0.3 0.733 108.5 133.3 61.8 25.0 7.2 8.3 15.1 62 285 A A < - 0 0 11 -3,-1.8 2,-0.3 41,-0.3 -1,-0.3 -0.706 38.2-163.8 -97.4 155.6 8.8 9.1 18.5 63 286 A F E -G 171 0E 6 108,-1.0 108,-2.6 -2,-0.3 2,-0.4 -0.988 6.3-169.9-134.8 149.0 8.5 12.4 20.4 64 287 A R E +G 170 0E 104 21,-0.5 21,-2.7 -2,-0.3 2,-0.3 -0.991 38.5 93.2-131.3 142.9 10.4 13.8 23.3 65 288 A G E -GH 169 84E 6 104,-2.2 104,-2.7 -2,-0.4 2,-0.3 -0.900 66.1 -69.3 175.2-145.3 9.4 16.9 25.3 66 289 A K E -GH 168 83E 102 17,-1.4 17,-2.8 -2,-0.3 2,-0.2 -0.989 34.3-119.5-144.7 135.4 7.5 17.9 28.4 67 290 A V E - H 0 82E 1 100,-1.1 99,-3.0 -2,-0.3 100,-0.3 -0.502 25.6-174.0 -66.3 135.9 3.9 17.8 29.3 68 291 A T E - 0 0 53 13,-2.9 2,-0.3 1,-0.4 -1,-0.2 0.857 54.7 -36.2 -94.6 -62.9 2.6 21.3 30.0 69 292 A Q E - 0 0 118 12,-0.5 12,-2.4 96,-0.1 -1,-0.4 -0.955 60.0 -87.7-153.3 164.8 -0.9 20.8 31.3 70 293 A Q E - H 0 80E 106 -2,-0.3 2,-0.3 10,-0.2 10,-0.3 -0.641 51.8-162.2 -70.4 141.0 -4.1 18.8 31.0 71 294 A V E - H 0 79E 42 8,-2.5 8,-0.6 -2,-0.3 2,-0.3 -0.922 18.4-108.0-130.8 153.7 -6.3 20.4 28.2 72 295 A Q + 0 0 196 -2,-0.3 2,-0.3 6,-0.1 6,-0.1 -0.590 37.3 169.4 -78.1 142.2 -9.9 20.2 27.2 73 296 A D - 0 0 45 -2,-0.3 6,-0.1 2,-0.2 4,-0.0 -0.969 38.0-133.1-149.3 143.3 -10.8 18.4 24.0 74 297 A E S S+ 0 0 181 -2,-0.3 3,-0.1 2,-0.1 2,-0.0 0.719 82.3 90.4 -70.9 -18.4 -14.3 17.5 22.8 75 298 A H S S- 0 0 113 1,-0.1 -2,-0.2 -3,-0.0 4,-0.1 -0.289 91.0 -80.4 -80.4 164.5 -13.2 14.0 22.0 76 299 A R S S+ 0 0 244 -2,-0.0 2,-0.2 2,-0.0 -1,-0.1 -0.282 88.2 26.3 -68.4 142.8 -13.3 11.0 24.3 77 300 A G S S- 0 0 45 -3,-0.1 2,-0.4 79,-0.1 -4,-0.2 -0.547 95.7 -51.9 108.3-172.2 -10.6 10.5 26.9 78 301 A T E - I 0 157E 18 79,-2.2 79,-2.5 -2,-0.2 2,-0.3 -0.909 54.4-149.9-110.1 134.2 -8.2 12.7 28.9 79 302 A H E -HI 71 156E 15 -8,-0.6 -8,-2.5 -2,-0.4 2,-0.4 -0.836 13.8-175.3-119.8 144.1 -6.0 15.1 26.9 80 303 A W E -HI 70 155E 7 75,-2.6 75,-2.4 -2,-0.3 2,-0.4 -0.995 17.6-139.5-138.7 135.5 -2.6 16.6 27.5 81 304 A N E - I 0 154E 25 -12,-2.4 -13,-2.9 -2,-0.4 -12,-0.5 -0.773 22.5-175.2 -92.4 137.8 -0.5 19.1 25.8 82 305 A M E -HI 67 153E 0 71,-3.1 71,-2.7 -2,-0.4 -15,-0.3 -0.999 21.2-135.9-131.1 138.3 3.2 18.5 25.4 83 306 A T E -HI 66 152E 46 -17,-2.8 -17,-1.4 -2,-0.4 2,-0.4 -0.593 27.0-144.6 -76.9 153.7 6.0 20.6 24.0 84 307 A V E -H 65 0E 8 67,-2.0 8,-0.4 -19,-0.2 -19,-0.3 -0.976 16.0-173.3-125.8 138.6 8.3 18.7 21.8 85 308 A T - 0 0 36 -21,-2.7 -21,-0.5 -2,-0.4 5,-0.1 -0.500 45.9 -70.8-105.2-178.2 12.0 19.1 21.3 86 309 A N > - 0 0 39 4,-2.6 3,-2.0 -2,-0.2 -1,-0.2 -0.390 53.9-106.4 -60.2 157.2 14.4 17.5 18.8 87 310 A L T 3 S+ 0 0 41 15,-0.3 -1,-0.1 1,-0.3 -22,-0.1 0.815 120.8 60.4 -61.5 -27.7 14.9 13.8 19.6 88 311 A N T 3 S- 0 0 107 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.389 121.1-106.8 -81.3 3.3 18.4 14.6 20.9 89 312 A G S < S+ 0 0 33 -3,-2.0 -2,-0.1 1,-0.3 3,-0.1 0.227 79.4 125.5 94.8 -14.7 16.9 16.9 23.5 90 313 A T S S- 0 0 66 1,-0.1 -4,-2.6 -5,-0.1 -1,-0.3 -0.427 73.5 -85.9 -75.0 153.6 17.9 20.3 22.0 91 314 A P - 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