==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 07-MAY-08 3D26 . COMPND 2 MOLECULE: 58 KD CAPSID PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NORWALK VIRUS; . AUTHOR R.HEGDE,W.BU . 568 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21666.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 321 56.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 146 25.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 0.2 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 . 59 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 1 1 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 2 8 0 6 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 2 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 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 1 230 A P 0 0 146 0, 0.0 2,-0.3 0, 0.0 221,-0.1 0.000 360.0 360.0 360.0-114.2 59.3 81.0 -127.1 2 231 A F - 0 0 6 219,-0.1 2,-0.3 218,-0.1 271,-0.1 -0.628 360.0-172.9 -82.6 145.9 62.3 83.1 -126.0 3 232 A T - 0 0 50 -2,-0.3 217,-0.1 215,-0.2 215,-0.1 -0.971 22.8-159.5-143.9 154.5 65.6 81.9 -127.4 4 233 A L - 0 0 12 -2,-0.3 269,-0.1 267,-0.2 207,-0.1 -0.901 52.0 -75.4-124.6 154.5 69.4 82.6 -127.1 5 234 A P - 0 0 2 0, 0.0 2,-1.5 0, 0.0 266,-0.4 -0.246 33.6-139.5 -53.4 132.0 71.9 81.5 -129.8 6 235 A N + 0 0 70 496,-0.1 266,-0.1 264,-0.1 264,-0.1 -0.423 67.6 114.6 -90.6 60.8 72.6 77.7 -129.6 7 236 A L S S- 0 0 6 -2,-1.5 264,-0.4 264,-0.1 2,-0.1 -0.966 74.5 -99.8-132.8 146.5 76.3 78.5 -130.2 8 237 A P > - 0 0 34 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.398 28.7-130.8 -66.3 137.4 79.5 78.0 -128.1 9 238 A L G > S+ 0 0 0 260,-2.2 3,-2.7 1,-0.3 12,-0.4 0.908 105.5 59.1 -55.2 -47.1 80.7 81.2 -126.5 10 239 A S G 3 S+ 0 0 35 257,-2.1 -1,-0.3 1,-0.3 258,-0.1 0.603 103.0 56.4 -61.8 -8.1 84.3 80.8 -127.6 11 240 A S G < S+ 0 0 41 -3,-1.7 330,-0.5 256,-0.2 -1,-0.3 0.451 97.1 82.0 -99.8 -2.4 82.9 80.9 -131.2 12 241 A L S < S- 0 0 0 -3,-2.7 9,-1.9 -4,-0.3 2,-0.3 -0.322 74.4-114.6 -96.5-179.6 81.1 84.2 -130.7 13 242 A S B -A 20 0A 0 7,-0.2 196,-1.9 -2,-0.1 197,-0.3 -0.824 21.1-108.7-118.8 156.6 82.3 87.9 -130.9 14 243 A N - 0 0 0 5,-3.2 25,-0.1 -2,-0.3 178,-0.1 -0.278 24.6-138.7 -69.6 165.8 82.7 90.8 -128.6 15 244 A S S S+ 0 0 0 176,-0.2 24,-0.3 192,-0.1 44,-0.2 0.335 96.3 51.7-113.0 6.6 80.2 93.6 -129.1 16 245 A R S S+ 0 0 0 1,-0.4 77,-0.4 22,-0.1 78,-0.1 0.381 124.5 9.9-118.1 -1.7 82.5 96.6 -128.7 17 246 A A S S- 0 0 2 2,-0.2 2,-2.6 75,-0.1 -1,-0.4 -0.927 86.3 -97.1-170.9 150.1 85.1 95.4 -131.2 18 247 A P S S+ 0 0 22 0, 0.0 -3,-0.1 0, 0.0 37,-0.0 -0.283 77.7 129.0 -74.7 59.2 85.4 92.6 -133.8 19 248 A L - 0 0 16 -2,-2.6 -5,-3.2 325,-0.0 -2,-0.2 -0.884 62.2-110.4-116.6 144.0 87.3 90.3 -131.4 20 249 A P B -A 13 0A 39 0, 0.0 174,-0.5 0, 0.0 2,-0.3 -0.447 38.2-106.9 -72.4 144.2 86.6 86.7 -130.4 21 250 A I + 0 0 5 -9,-1.9 172,-0.3 -12,-0.4 -9,-0.1 -0.560 38.3 176.0 -71.9 127.6 85.3 86.0 -126.9 22 251 A S - 0 0 50 170,-2.6 2,-0.3 -2,-0.3 171,-0.2 0.711 58.4 -16.7-104.7 -28.9 88.1 84.4 -124.8 23 252 A S E -B 192 0B 45 169,-1.2 169,-2.6 -14,-0.1 2,-0.4 -0.968 59.5-106.5-163.7 175.9 86.5 84.1 -121.4 24 253 A M E +B 191 0B 2 241,-0.3 2,-0.2 238,-0.3 167,-0.2 -0.883 45.3 158.3-111.7 146.6 83.7 85.3 -119.0 25 254 A G E -B 190 0B 3 165,-2.7 165,-2.4 -2,-0.4 2,-0.3 -0.795 32.2-112.5-150.0-167.0 84.4 87.7 -116.2 26 255 A I - 0 0 45 -2,-0.2 163,-0.1 163,-0.2 161,-0.0 -0.872 40.2 -89.8-133.0 165.3 83.2 90.2 -113.7 27 256 A S - 0 0 28 161,-0.4 7,-0.0 -2,-0.3 4,-0.0 -0.350 50.6 -99.8 -73.7 157.1 83.8 94.0 -113.2 28 257 A P > - 0 0 50 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.274 40.6 -92.8 -72.8 165.2 86.7 95.1 -111.0 29 258 A D T 3 S+ 0 0 168 1,-0.3 -2,-0.1 3,-0.0 0, 0.0 0.747 125.4 53.7 -48.6 -29.7 86.3 96.2 -107.3 30 259 A N T 3 S+ 0 0 124 1,-0.1 2,-0.4 2,-0.0 -1,-0.3 0.044 94.8 76.0-100.8 27.6 86.0 99.8 -108.5 31 260 A V < + 0 0 21 -3,-2.0 -4,-0.1 1,-0.1 3,-0.1 -0.925 38.6 155.2-139.1 110.6 83.2 99.3 -111.0 32 261 A Q S S+ 0 0 131 -2,-0.4 2,-0.3 1,-0.3 156,-0.2 0.859 72.2 23.2 -97.6 -55.0 79.6 98.9 -109.9 33 262 A S - 0 0 48 147,-0.1 2,-0.3 2,-0.0 -1,-0.3 -0.731 67.8-159.1-110.4 160.0 77.6 100.1 -112.9 34 263 A V B -D 179 0C 5 145,-1.7 145,-4.1 -2,-0.3 128,-0.1 -0.905 10.5-161.9-132.7 162.5 78.7 100.3 -116.6 35 264 A Q + 0 0 68 126,-0.4 141,-0.1 -2,-0.3 143,-0.1 -0.285 20.5 170.4-143.9 53.1 77.4 102.4 -119.5 36 265 A F - 0 0 1 1,-0.1 127,-0.1 3,-0.1 58,-0.1 -0.378 21.3-158.7 -65.7 145.4 78.6 100.8 -122.7 37 266 A Q S S+ 0 0 0 56,-0.2 13,-1.3 12,-0.1 14,-0.9 0.740 75.3 55.7 -96.8 -31.1 77.0 102.3 -125.8 38 267 A N S S+ 0 0 0 1,-0.2 -22,-0.1 12,-0.2 -23,-0.1 -0.657 98.7 38.2 -97.9 159.2 77.8 99.3 -128.1 39 268 A G S S+ 0 0 0 -24,-0.3 2,-0.5 -2,-0.2 168,-0.3 0.896 83.0 136.3 68.9 39.2 76.6 95.8 -127.4 40 269 A R + 0 0 10 8,-0.4 8,-3.1 -3,-0.3 2,-0.3 -0.937 14.9 140.6-126.2 111.7 73.3 96.9 -125.9 41 270 A C B -E 47 0D 1 -2,-0.5 6,-0.2 208,-0.3 2,-0.1 -0.992 42.2-125.6-148.8 137.8 70.1 95.2 -126.8 42 271 A T > - 0 0 17 4,-2.1 3,-2.2 -2,-0.3 206,-0.2 -0.443 31.7-111.9 -80.0 158.9 67.0 94.3 -124.7 43 272 A L T 3 S+ 0 0 3 204,-1.4 177,-0.3 1,-0.3 -1,-0.1 0.661 120.2 66.9 -62.8 -11.6 65.7 90.7 -124.6 44 273 A D T 3 S- 0 0 89 203,-0.5 -1,-0.3 2,-0.1 3,-0.1 0.701 122.6-105.3 -77.7 -28.4 62.9 92.3 -126.5 45 274 A G S < S+ 0 0 16 -3,-2.2 2,-0.7 1,-0.3 -2,-0.1 0.575 71.6 143.9 108.0 17.0 65.1 92.9 -129.5 46 275 A R - 0 0 170 -4,-0.1 -4,-2.1 169,-0.0 -1,-0.3 -0.805 44.3-139.8 -94.7 114.6 65.5 96.7 -129.0 47 276 A L B -E 41 0D 60 -2,-0.7 2,-0.3 -6,-0.2 -6,-0.2 -0.531 22.1-162.0 -71.5 134.6 68.9 98.0 -129.9 48 277 A V > - 0 0 26 -8,-3.1 3,-1.3 -2,-0.2 -8,-0.4 -0.896 48.9 -6.5-121.2 148.8 70.1 100.7 -127.4 49 278 A G T 3 S- 0 0 32 -2,-0.3 -11,-0.2 1,-0.2 -12,-0.1 -0.529 123.8 -32.7 73.7-133.9 72.8 103.3 -127.7 50 279 A T T 3 S+ 0 0 2 -13,-1.3 40,-2.4 -2,-0.2 -1,-0.2 0.174 93.0 143.4-107.8 15.7 74.9 103.1 -130.8 51 280 A T < - 0 0 5 -3,-1.3 2,-0.2 -14,-0.9 -13,-0.1 -0.315 35.4-154.8 -60.1 130.4 74.6 99.3 -131.0 52 281 A P - 0 0 3 0, 0.0 -13,-0.2 0, 0.0 -4,-0.1 -0.672 21.1-125.3-103.5 161.6 74.4 98.0 -134.6 53 282 A V S S+ 0 0 18 -2,-0.2 2,-0.3 245,-0.1 160,-0.3 0.941 93.0 55.2 -69.3 -48.2 72.8 94.7 -135.6 54 283 A S S > S- 0 0 0 244,-0.5 3,-1.9 1,-0.1 4,-0.4 -0.667 73.7-138.1 -95.2 142.9 75.9 93.5 -137.5 55 284 A L G > S+ 0 0 6 -2,-0.3 3,-1.1 1,-0.3 -1,-0.1 0.742 101.4 79.4 -63.8 -20.2 79.5 93.1 -136.2 56 285 A S G 3 S+ 0 0 1 1,-0.3 -1,-0.3 242,-0.1 243,-0.1 0.495 97.1 43.0 -68.3 0.3 80.3 94.6 -139.6 57 286 A H G X S+ 0 0 26 -3,-1.9 3,-0.9 249,-0.1 -1,-0.3 0.462 87.9 118.0-118.1 -12.7 79.4 98.0 -138.0 58 287 A V T < S- 0 0 1 -3,-1.1 86,-0.2 -4,-0.4 33,-0.1 -0.393 85.3 -4.8 -68.3 130.1 81.1 97.6 -134.6 59 288 A A T 3 S+ 0 0 0 31,-1.1 85,-2.2 1,-0.2 2,-0.3 0.867 103.4 128.2 59.0 41.1 83.9 100.0 -133.6 60 289 A K E < -F 143 0E 13 30,-1.3 2,-0.3 -3,-0.9 83,-0.2 -0.842 38.2-167.7-125.1 160.7 83.9 101.7 -137.0 61 290 A I E -F 142 0E 5 81,-2.0 81,-2.2 -2,-0.3 2,-0.3 -0.942 1.5-165.8-142.0 162.1 83.7 105.3 -138.2 62 291 A R E +F 141 0E 35 11,-0.5 11,-2.2 -2,-0.3 2,-0.3 -0.974 28.5 107.0-152.5 138.1 83.1 107.1 -141.5 63 292 A G E -FG 140 72E 2 77,-1.9 77,-2.7 -2,-0.3 2,-0.5 -0.990 56.1 -81.6 175.1-176.7 83.5 110.6 -142.6 64 293 A T E -FG 139 71E 65 7,-1.7 7,-2.4 -2,-0.3 2,-0.4 -0.955 29.1-150.9-118.8 124.2 85.4 113.3 -144.6 65 294 A S E -FG 138 70E 0 73,-2.1 73,-1.5 -2,-0.5 5,-0.2 -0.751 9.6-170.7 -91.5 136.6 88.6 115.0 -143.4 66 295 A N - 0 0 100 3,-2.1 71,-0.2 -2,-0.4 -1,-0.1 0.361 65.6 -88.2-103.5 2.1 89.2 118.5 -144.6 67 296 A G S S+ 0 0 35 2,-0.5 67,-0.3 68,-0.3 3,-0.1 0.062 122.8 41.0 114.6 -23.2 92.7 118.3 -143.2 68 297 A T S S+ 0 0 97 1,-0.4 64,-2.1 65,-0.1 2,-0.3 0.609 119.2 24.6-124.1 -28.5 91.9 119.5 -139.6 69 298 A V E - H 0 131E 36 62,-0.3 -3,-2.1 -5,-0.1 2,-0.6 -0.964 62.4-138.2-140.0 154.4 88.6 117.8 -138.8 70 299 A I E -GH 65 130E 2 60,-2.6 60,-1.1 -2,-0.3 2,-0.7 -0.951 17.2-148.3-115.9 112.0 86.7 114.7 -139.8 71 300 A N E -GH 64 129E 81 -7,-2.4 -7,-1.7 -2,-0.6 58,-0.2 -0.722 24.1-137.5 -82.3 116.4 83.0 115.3 -140.3 72 301 A L E +G 63 0E 11 56,-1.9 8,-0.5 -2,-0.7 2,-0.3 -0.278 27.3 170.4 -76.3 155.7 81.2 112.0 -139.4 73 302 A T - 0 0 28 -11,-2.2 -11,-0.5 6,-0.2 5,-0.1 -0.871 47.3 -72.2-148.0 175.5 78.3 110.2 -141.0 74 303 A E > - 0 0 34 4,-2.7 3,-1.8 -2,-0.3 6,-0.1 -0.297 51.8-105.7 -66.9 163.8 76.7 106.8 -140.6 75 304 A L T 3 S+ 0 0 19 14,-0.4 -1,-0.1 1,-0.3 -12,-0.1 0.825 125.2 66.1 -59.7 -26.2 78.9 103.9 -141.9 76 305 A D T 3 S- 0 0 112 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.710 114.5-118.8 -62.1 -31.5 76.3 104.1 -144.7 77 306 A G S < S+ 0 0 38 -3,-1.8 -2,-0.1 1,-0.5 -1,-0.1 0.242 76.4 126.2 100.9 -11.8 77.4 107.6 -145.8 78 307 A T S S- 0 0 68 1,-0.1 -4,-2.7 -5,-0.1 -1,-0.5 -0.526 72.0 -85.0 -75.9 148.7 73.9 108.9 -144.9 79 308 A P - 0 0 85 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.060 35.3-144.8 -57.3 154.0 74.0 111.9 -142.5 80 309 A F - 0 0 18 -8,-0.5 3,-0.0 -3,-0.1 -8,-0.0 -0.934 12.8-163.0-117.0 141.3 74.3 111.7 -138.7 81 310 A H >> - 0 0 85 -2,-0.4 3,-1.9 1,-0.1 4,-0.6 -0.974 27.4-121.8-129.4 144.9 72.5 114.1 -136.4 82 311 A P G >4 S+ 0 0 51 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.817 108.3 62.6 -47.4 -43.5 73.1 114.9 -132.7 83 312 A F G 34 S+ 0 0 149 1,-0.2 43,-0.0 3,-0.0 -3,-0.0 0.710 94.6 65.5 -60.3 -20.3 69.5 114.1 -131.7 84 313 A E G <4 S- 0 0 96 -3,-1.9 -1,-0.2 1,-0.2 3,-0.1 0.860 115.9 -63.2 -72.9 -36.5 70.1 110.5 -132.8 85 314 A G << - 0 0 5 -3,-0.9 -1,-0.2 -4,-0.6 90,-0.2 -0.997 59.6 -60.2 173.5-172.1 72.7 109.6 -130.2 86 315 A P S S- 0 0 1 0, 0.0 88,-0.1 0, 0.0 89,-0.1 0.818 114.0 -19.7 -67.0 -28.3 76.1 110.1 -128.6 87 316 A A S S- 0 0 3 39,-0.1 3,-0.1 40,-0.1 39,-0.1 -0.953 94.5 -54.9-164.2 174.7 77.8 109.3 -131.9 88 317 A P S > S- 0 0 3 0, 0.0 3,-2.2 0, 0.0 -14,-0.1 -0.170 75.1 -77.8 -59.2 156.8 77.0 107.5 -135.3 89 318 A I T 3 S+ 0 0 59 1,-0.3 -14,-0.4 -38,-0.1 -38,-0.2 -0.364 120.7 17.0 -56.5 128.2 75.8 103.9 -135.1 90 319 A G T 3 S+ 0 0 0 -40,-2.4 -30,-1.3 1,-0.3 -31,-1.1 0.250 83.4 155.1 93.6 -12.0 78.8 101.7 -134.5 91 320 A F < - 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0 0 31 3,-0.4 380,-1.6 5,-0.4 3,-1.0 -0.994 16.9-124.9-139.7 139.6 89.0 104.4 -149.0 106 335 A F B 3 S+l 485 0F 58 -2,-0.4 33,-0.1 1,-0.2 382,-0.1 -0.698 106.3 13.7 -76.9 120.9 86.6 103.3 -151.7 107 336 A G T 3 S+ 0 0 38 378,-1.5 2,-0.3 380,-0.7 -1,-0.2 0.272 115.1 86.8 97.6 -11.9 88.4 104.0 -154.9 108 337 A H < - 0 0 104 -3,-1.0 377,-0.5 377,-0.2 -3,-0.4 -0.877 68.4-125.6-124.0 156.5 91.9 104.5 -153.4 109 338 A S + 0 0 50 -2,-0.3 376,-0.1 376,-0.2 326,-0.1 -0.255 62.9 25.7 -87.8 179.2 94.8 102.2 -152.4 110 339 A S - 0 0 64 374,-0.1 -5,-0.4 -2,-0.1 2,-0.3 0.383 67.7-108.6 55.5 172.9 96.6 101.8 -149.1 111 340 A Q - 0 0 25 -7,-0.1 2,-0.4 322,-0.0 -7,-0.2 -0.906 17.1-148.7-133.7 162.1 95.7 102.4 -145.5 112 341 A T E -J 103 0E 51 -9,-1.5 -9,-2.8 -2,-0.3 2,-0.4 -0.998 19.2-123.4-137.3 137.5 96.6 105.0 -142.9 113 342 A Q E -J 102 0E 71 -2,-0.4 2,-0.7 -11,-0.2 -11,-0.2 -0.657 24.6-154.4 -80.6 129.6 96.8 104.6 -139.1 114 343 A Y E -J 101 0E 1 -13,-3.1 -13,-2.5 -2,-0.4 2,-0.5 -0.905 1.8-153.9-112.7 109.2 94.6 107.2 -137.3 115 344 A D E -J 100 0E 65 -2,-0.7 2,-0.5 18,-0.3 -15,-0.2 -0.707 15.1-167.5 -81.9 121.9 95.7 108.1 -133.8 116 345 A V E -J 99 0E 2 -17,-3.2 -17,-2.4 -2,-0.5 2,-0.6 -0.956 16.4-172.0-121.6 124.3 92.7 109.2 -131.7 117 346 A D - 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