==== 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 VIRAL PROTEIN 27-MAR-06 2GHV . COMPND 2 MOLECULE: SPIKE GLYCOPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SARS CORONAVIRUS; . AUTHOR W.C.HWANG,Y.LIN,E.SANTELLI,J.SUI,L.JAROSZEWSKI,B.STEC,M.FARZ . 366 2 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18879.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 210 57.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 22.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 29 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 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 RESIDUES PER ALPHA HELIX . 6 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 . 7 0 2 0 4 0 2 1 1 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 . 2 0 0 0 0 0 0 0 0 0 1 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 1 320 E T 0 0 169 0, 0.0 29,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 164.2 20.6 4.5 25.4 2 321 E N - 0 0 118 27,-0.1 28,-2.3 2,-0.0 2,-0.2 0.883 360.0-138.3 63.1 103.5 19.6 1.6 27.7 3 322 E L B -a 30 0A 92 26,-0.3 28,-0.2 1,-0.1 -1,-0.0 -0.608 30.7 -88.3 -89.9 156.0 19.9 -1.7 25.9 4 323 E a - 0 0 6 26,-2.5 2,-1.5 -2,-0.2 3,-0.4 -0.385 31.0-128.6 -65.8 136.4 17.2 -4.3 26.2 5 324 E P + 0 0 32 0, 0.0 4,-0.4 0, 0.0 3,-0.3 -0.250 60.7 136.9 -85.0 51.8 17.7 -6.7 29.1 6 325 E F >> + 0 0 5 -2,-1.5 4,-2.8 1,-0.2 3,-0.7 0.735 63.3 67.3 -66.7 -25.9 17.4 -9.8 27.0 7 326 E G H 3> S+ 0 0 29 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.919 95.3 55.4 -58.8 -44.2 20.3 -11.4 28.8 8 327 E E H 34 S+ 0 0 127 -3,-0.3 -1,-0.2 3,-0.2 -2,-0.2 0.732 116.3 40.0 -59.8 -19.5 18.3 -11.5 31.9 9 328 E V H <4 S+ 0 0 3 -3,-0.7 3,-0.4 -4,-0.4 -2,-0.2 0.911 126.9 24.0 -94.3 -63.9 15.7 -13.5 29.9 10 329 E F H < S+ 0 0 4 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.1 0.861 129.2 40.4 -74.0 -35.2 17.5 -15.9 27.6 11 330 E N S < S+ 0 0 35 -4,-1.7 -1,-0.2 -5,-0.5 -3,-0.2 0.272 75.0 137.0-106.9 10.1 20.8 -16.2 29.6 12 331 E A - 0 0 30 -3,-0.4 -4,-0.1 -5,-0.2 3,-0.0 -0.292 53.9-137.7 -52.1 136.7 19.5 -16.4 33.1 13 332 E T S S+ 0 0 116 1,-0.1 2,-0.4 -5,-0.0 -1,-0.1 0.924 89.3 38.0 -65.7 -46.1 21.4 -19.1 35.0 14 333 E K S S- 0 0 169 -3,-0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.897 71.9-160.8-108.0 136.6 18.2 -20.4 36.7 15 334 E F - 0 0 12 -2,-0.4 53,-0.1 -3,-0.0 2,-0.1 -0.842 25.3-109.9-105.3 153.5 14.8 -20.6 35.0 16 335 E P - 0 0 16 0, 0.0 53,-1.5 0, 0.0 2,-0.2 -0.365 30.5-100.1 -74.5 155.6 11.5 -20.8 37.0 17 336 E S B > -b 69 0B 16 51,-0.2 3,-0.9 3,-0.1 104,-0.1 -0.485 37.7-114.8 -62.5 146.1 9.2 -23.8 37.3 18 337 E V G > S+ 0 0 0 51,-0.8 3,-1.2 102,-0.6 103,-0.1 0.793 116.4 56.9 -60.6 -28.7 6.2 -23.4 35.0 19 338 E Y G 3 S+ 0 0 40 101,-0.8 116,-0.6 1,-0.3 -1,-0.3 0.815 115.8 40.0 -72.8 -24.8 3.7 -23.1 38.0 20 339 E A G < S+ 0 0 17 -3,-0.9 -1,-0.3 100,-0.2 -2,-0.2 -0.164 88.4 170.1-114.7 35.2 5.9 -20.1 39.1 21 340 E W < - 0 0 12 -3,-1.2 2,-0.3 69,-0.2 47,-0.2 -0.039 22.4-137.8 -49.7 151.1 6.6 -18.6 35.7 22 341 E E E -C 67 0B 114 45,-1.7 45,-2.6 -6,-0.1 2,-0.4 -0.890 8.6-150.2-122.0 148.4 8.2 -15.2 35.7 23 342 E R E -C 66 0B 101 -2,-0.3 2,-0.4 43,-0.2 43,-0.2 -0.948 8.6-173.7-120.6 137.3 7.6 -12.1 33.6 24 343 E K E -C 65 0B 80 41,-2.3 41,-2.7 -2,-0.4 2,-0.4 -0.985 19.6-135.2-125.9 138.9 10.0 -9.4 32.5 25 344 E K E -C 64 0B 124 -2,-0.4 2,-0.5 39,-0.2 39,-0.2 -0.797 16.0-169.5 -90.7 131.7 9.0 -6.2 30.7 26 345 E I E +C 63 0B 0 37,-3.0 37,-2.7 -2,-0.4 2,-0.3 -0.966 30.4 127.0-120.6 113.2 11.1 -5.1 27.8 27 346 E S + 0 0 29 -2,-0.5 35,-0.2 35,-0.2 3,-0.1 -0.982 52.3 26.5-155.1 162.6 10.4 -1.5 26.5 28 347 E N S S+ 0 0 150 33,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.871 93.7 107.1 51.4 49.2 12.1 1.8 25.7 29 348 E a S S- 0 0 30 32,-0.4 2,-0.4 -3,-0.1 -26,-0.3 -0.950 71.1-109.3-150.4 161.4 15.4 0.2 24.9 30 349 E V B -a 3 0A 85 -28,-2.3 -26,-2.5 -2,-0.3 2,-0.5 -0.828 35.4-125.9 -97.5 135.4 17.8 -0.6 22.0 31 350 E A + 0 0 43 -2,-0.4 2,-0.3 -28,-0.2 3,-0.1 -0.712 29.5 174.5 -84.6 126.8 18.1 -4.3 21.2 32 351 E D > + 0 0 63 -2,-0.5 3,-1.2 -28,-0.3 -26,-0.1 -0.790 4.9 172.9-128.5 90.5 21.7 -5.7 21.1 33 352 E Y G > + 0 0 14 -2,-0.3 3,-1.4 1,-0.2 -1,-0.1 0.615 67.2 81.7 -73.8 -11.0 21.5 -9.5 20.5 34 353 E S G 3 S+ 0 0 99 1,-0.3 -1,-0.2 -3,-0.1 203,-0.1 0.554 84.5 58.5 -71.5 -8.3 25.3 -9.6 20.2 35 354 E V G < S+ 0 0 93 -3,-1.2 -1,-0.3 2,-0.1 2,-0.2 0.286 86.6 95.3-104.5 5.9 25.8 -9.6 23.9 36 355 E L S < S- 0 0 14 -3,-1.4 2,-0.2 1,-0.1 -29,-0.1 -0.555 90.4 -92.9 -80.8 159.9 23.8 -12.8 24.4 37 356 E Y - 0 0 168 -2,-0.2 3,-0.4 1,-0.1 200,-0.3 -0.508 40.7-116.4 -69.2 146.6 25.6 -16.0 24.6 38 357 E N S S+ 0 0 119 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 -0.052 89.8 47.8 -67.2 174.1 26.1 -18.0 21.3 39 358 E S + 0 0 82 1,-0.2 2,-0.9 196,-0.0 -1,-0.2 0.729 62.0 132.8 61.3 25.8 24.5 -21.4 20.9 40 359 E T - 0 0 13 -3,-0.4 196,-1.8 2,-0.0 2,-0.6 -0.888 36.1-179.2 -98.3 97.5 20.9 -20.7 22.1 41 360 E F B -M 235 0C 129 -2,-0.9 2,-0.5 194,-0.2 64,-0.3 -0.896 23.1-134.1-106.5 119.5 19.2 -22.4 19.2 42 361 E F - 0 0 10 192,-2.4 191,-0.4 -2,-0.6 192,-0.3 -0.612 21.2-178.0 -77.5 119.6 15.4 -22.3 19.2 43 362 E S S S+ 0 0 75 60,-2.2 2,-0.4 -2,-0.5 61,-0.2 0.626 82.4 41.5 -85.3 -20.5 13.8 -25.7 18.4 44 363 E T E +D 103 0B 25 59,-1.8 59,-2.2 -3,-0.1 -1,-0.2 -1.000 60.1 156.6-125.0 129.1 10.4 -23.9 18.7 45 364 E F E +D 102 0B 2 -2,-0.4 186,-3.0 186,-0.2 2,-0.4 -0.706 18.6 156.4-147.9 93.7 9.8 -20.5 17.3 46 365 E K E -DE 101 230B 74 55,-2.2 55,-3.2 184,-0.2 2,-0.4 -0.977 22.7-159.5-129.7 129.4 6.1 -20.0 16.6 47 366 E b E -D 100 0B 5 182,-2.8 2,-0.3 -2,-0.4 53,-0.3 -0.903 5.7-163.9-116.8 145.7 4.2 -16.8 16.4 48 367 E Y E +D 99 0B 60 51,-3.1 51,-2.3 -2,-0.4 179,-0.1 -0.907 64.6 16.5-129.4 142.3 0.4 -16.2 16.9 49 368 E G S S+ 0 0 31 177,-0.4 2,-0.2 -2,-0.3 -1,-0.1 0.601 80.7 147.9 75.4 16.1 -2.0 -13.4 16.0 50 369 E V - 0 0 2 176,-0.4 176,-2.2 49,-0.2 2,-0.3 -0.595 26.1-169.5 -87.0 140.8 0.5 -11.7 13.6 51 370 E S B > -N 225 0D 5 -2,-0.2 3,-0.5 174,-0.2 174,-0.2 -0.845 35.4-111.1-125.9 160.9 -0.8 -9.8 10.6 52 371 E A G > S+ 0 0 0 172,-2.2 3,-1.2 169,-0.4 170,-0.1 0.862 118.0 54.0 -61.4 -41.2 1.0 -8.4 7.6 53 372 E T G 3 S+ 0 0 21 168,-0.4 3,-0.3 1,-0.2 -1,-0.2 0.760 111.4 47.2 -63.3 -26.9 0.4 -4.8 8.7 54 373 E K G X S+ 0 0 115 -3,-0.5 3,-1.8 1,-0.2 -1,-0.2 -0.034 70.1 119.3-105.7 27.2 1.9 -5.6 12.2 55 374 E L G X + 0 0 2 -3,-1.2 3,-1.6 1,-0.3 -1,-0.2 0.702 62.2 75.9 -66.5 -20.0 5.1 -7.4 11.1 56 375 E N G > S+ 0 0 95 -3,-0.3 3,-2.0 1,-0.2 -1,-0.3 0.717 76.0 79.3 -59.8 -21.3 7.1 -4.7 12.8 57 376 E D G X S+ 0 0 53 -3,-1.8 3,-1.7 1,-0.3 -1,-0.2 0.738 76.9 72.3 -56.4 -25.3 6.1 -6.5 16.1 58 377 E L G < S+ 0 0 1 -3,-1.6 -1,-0.3 1,-0.3 184,-0.2 0.491 77.1 77.1 -76.3 -0.2 8.8 -9.1 15.3 59 378 E C G < S- 0 0 34 -3,-2.0 -1,-0.3 184,-0.1 -2,-0.2 0.542 92.7-145.0 -75.5 -10.5 11.4 -6.4 16.2 60 379 E F < + 0 0 2 -3,-1.7 3,-0.2 -4,-0.1 -2,-0.1 0.727 52.3 138.8 56.6 28.8 10.5 -7.3 19.9 61 380 E S S S+ 0 0 64 1,-0.2 -32,-0.4 -4,-0.1 2,-0.3 0.688 71.8 32.1 -80.8 -21.0 11.0 -3.6 21.0 62 381 E N S S+ 0 0 74 -5,-0.2 121,-1.8 -35,-0.2 2,-0.3 -0.843 91.3 131.6-139.9 103.6 7.9 -3.5 23.3 63 382 E V E -CF 26 182B 1 -37,-2.7 -37,-3.0 -2,-0.3 2,-0.4 -0.952 52.3-132.7-153.0 147.7 7.2 -6.9 24.8 64 383 E Y E -CF 25 181B 65 117,-1.5 117,-2.2 -2,-0.3 2,-0.5 -0.940 27.3-155.7-104.1 140.9 6.5 -9.0 27.9 65 384 E A E -CF 24 180B 0 -41,-2.7 -41,-2.3 -2,-0.4 2,-0.5 -0.981 5.3-164.8-122.6 119.1 8.7 -12.0 28.2 66 385 E D E -CF 23 179B 0 113,-2.8 113,-2.4 -2,-0.5 2,-0.4 -0.905 10.4-164.4-106.0 131.3 7.5 -15.0 30.2 67 386 E S E +CF 22 178B 14 -45,-2.6 -45,-1.7 -2,-0.5 2,-0.3 -0.951 22.3 125.6-121.3 140.2 10.1 -17.7 31.3 68 387 E F E - F 0 177B 0 109,-1.7 109,-2.5 -2,-0.4 2,-0.4 -0.970 45.5-105.3-170.8 172.0 9.8 -21.3 32.5 69 388 E V E +bF 17 176B 0 -53,-1.5 -51,-0.8 -2,-0.3 2,-0.3 -0.911 34.0 164.2-109.2 135.9 10.8 -24.9 32.1 70 389 E V E - F 0 175B 0 105,-2.0 105,-2.8 -2,-0.4 2,-0.1 -0.941 41.7 -96.4-131.5 165.1 8.7 -27.7 30.7 71 390 E K E >> - F 0 174B 56 -2,-0.3 3,-1.7 103,-0.2 4,-0.6 -0.422 43.6-104.7 -72.2 157.5 9.4 -31.2 29.4 72 391 E G G >4 S+ 0 0 15 101,-2.2 3,-1.4 98,-0.4 4,-0.4 0.879 119.8 54.2 -53.0 -44.2 9.7 -31.6 25.6 73 392 E D G 34 S+ 0 0 89 98,-2.8 -1,-0.3 1,-0.3 3,-0.2 0.638 107.0 53.0 -68.1 -17.4 6.3 -33.3 25.2 74 393 E D G X4 S+ 0 0 20 -3,-1.7 3,-1.8 97,-0.3 4,-0.3 0.482 82.8 87.4 -90.2 -11.2 4.6 -30.3 27.1 75 394 E V G X< S+ 0 0 12 -3,-1.4 3,-2.0 -4,-0.6 -2,-0.1 0.869 79.3 64.8 -62.3 -34.1 6.0 -27.6 24.9 76 395 E R G 3 S+ 0 0 145 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.711 90.5 66.4 -59.3 -17.8 3.0 -28.1 22.5 77 396 E Q G < S+ 0 0 17 -3,-1.8 2,-1.6 1,-0.2 -1,-0.3 0.625 78.7 84.4 -79.9 -11.0 0.7 -26.8 25.4 78 397 E I S < S+ 0 0 4 -3,-2.0 -1,-0.2 -4,-0.3 14,-0.1 -0.567 77.3 86.9 -93.0 70.1 2.3 -23.4 25.2 79 398 E A S > S- 0 0 11 -2,-1.6 3,-1.0 14,-0.1 14,-0.4 -0.955 89.7 -82.3-157.3 155.7 0.0 -22.3 22.4 80 399 E P T 3 S+ 0 0 26 0, 0.0 15,-0.1 0, 0.0 -2,-0.0 -0.381 110.2 18.5 -62.2 143.6 -3.4 -20.7 22.1 81 400 E G T 3 S+ 0 0 49 12,-0.6 2,-0.3 1,-0.2 14,-0.1 0.675 90.3 138.7 74.1 17.7 -6.3 -23.2 22.5 82 401 E Q < - 0 0 52 -3,-1.0 2,-0.3 -5,-0.2 -1,-0.2 -0.662 34.1-159.4 -95.2 151.4 -4.4 -26.1 24.1 83 402 E T + 0 0 83 -2,-0.3 2,-0.2 4,-0.1 3,-0.1 -0.787 38.9 91.4-119.1 171.6 -5.5 -28.4 26.8 84 403 E G S > S- 0 0 27 -2,-0.3 4,-2.6 1,-0.1 5,-0.3 -0.615 87.7 -59.9 124.5 175.7 -3.5 -30.6 29.2 85 404 E V H > S+ 0 0 51 -2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.797 129.8 47.7 -65.4 -34.9 -2.0 -30.1 32.6 86 405 E I H >>S+ 0 0 1 2,-0.2 5,-2.5 3,-0.2 4,-2.1 0.971 116.8 40.8 -73.9 -50.9 0.3 -27.2 31.7 87 406 E A H 45S+ 0 0 1 3,-0.2 -2,-0.2 1,-0.2 42,-0.2 0.868 121.4 43.9 -61.0 -40.2 -2.2 -25.1 29.8 88 407 E D H <5S+ 0 0 22 -4,-2.6 41,-2.8 1,-0.1 -1,-0.2 0.900 131.1 14.0 -74.0 -44.7 -5.0 -25.8 32.3 89 408 E Y H <5S+ 0 0 58 -4,-1.9 -3,-0.2 -5,-0.3 -2,-0.2 0.385 130.6 28.0-121.4 1.5 -3.2 -25.4 35.7 90 409 E N T <5S+ 0 0 1 -4,-2.1 2,-0.3 -5,-0.2 45,-0.3 0.675 119.4 5.5-127.8 -57.3 0.2 -23.7 35.1 91 410 E Y < - 0 0 1 -5,-2.5 2,-0.5 43,-0.1 -1,-0.2 -0.941 62.0-172.6-145.2 114.9 0.5 -21.3 32.2 92 411 E K - 0 0 36 41,-0.4 40,-2.5 -2,-0.3 41,-0.2 -0.946 8.4-158.6-118.5 125.6 -2.4 -20.3 29.9 93 412 E L - 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