==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 02-MAR-09 2WBN . COMPND 2 MOLECULE: TERMINASE LARGE SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS PHAGE SPP1; . AUTHOR C.SMITS,M.CHECHIK,O.V.KOVALEVSKIY,M.B.SHEVTSOV,A.W.FOSTER,J. . 178 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10181.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 12 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 43 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 1 0 0 4 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 . 0 0 4 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 . 1 1 0 0 0 1 0 0 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 . 1 0 0 0 0 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 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 1 237 A V 0 0 141 0, 0.0 145,-0.5 0, 0.0 154,-0.1 0.000 360.0 360.0 360.0 -53.2 27.7 45.6 23.8 2 238 A V - 0 0 86 143,-0.1 3,-0.4 152,-0.1 2,-0.1 -0.953 360.0-146.0-110.2 123.1 24.2 44.4 24.7 3 239 A P S S+ 0 0 11 0, 0.0 143,-0.0 0, 0.0 141,-0.0 -0.458 72.0 22.7 -82.4 161.9 22.9 41.3 22.9 4 240 A F > + 0 0 7 -2,-0.1 3,-1.9 1,-0.1 123,-0.1 0.835 57.2 161.3 55.2 41.2 19.3 40.6 21.8 5 241 A E T 3 S+ 0 0 165 -3,-0.4 -1,-0.1 1,-0.3 117,-0.0 0.798 70.6 74.7 -54.5 -25.2 18.1 44.2 21.8 6 242 A N T 3 + 0 0 20 116,-0.3 121,-2.1 118,-0.1 -1,-0.3 0.356 69.0 127.5 -68.3 4.6 15.4 42.6 19.7 7 243 A L E < -a 127 0A 33 -3,-1.9 2,-0.5 119,-0.2 121,-0.2 -0.472 39.4-169.7 -75.0 131.8 13.7 41.0 22.7 8 244 A Q E +a 128 0A 112 119,-3.1 121,-3.0 -2,-0.2 2,-0.5 -0.967 20.1 168.0-118.9 103.5 10.0 41.6 23.2 9 245 A I E +a 129 0A 45 -2,-0.5 2,-0.3 119,-0.2 121,-0.2 -0.972 9.2 132.5-129.8 119.6 9.1 40.3 26.7 10 246 A E > - 0 0 130 119,-1.5 3,-2.0 -2,-0.5 4,-0.2 -0.923 57.0 -99.5-166.8 137.4 5.9 40.8 28.6 11 247 A E T 3 S+ 0 0 138 -2,-0.3 119,-0.1 1,-0.3 -2,-0.0 -0.407 110.8 12.2 -61.4 131.5 3.5 38.7 30.5 12 248 A G T 3 S+ 0 0 39 2,-0.1 -1,-0.3 -2,-0.1 118,-0.1 0.421 84.4 129.6 78.9 2.2 0.5 37.9 28.3 13 249 A I < + 0 0 41 -3,-2.0 2,-0.5 116,-0.2 -2,-0.1 0.724 68.9 54.1 -65.7 -21.5 2.1 39.1 25.1 14 250 A I S S- 0 0 1 -4,-0.2 -2,-0.1 41,-0.0 2,-0.1 -0.968 83.7-150.9-112.5 119.1 1.2 35.8 23.4 15 251 A T > - 0 0 66 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.426 25.5-115.6 -85.6 160.4 -2.5 34.9 23.5 16 252 A D H > S+ 0 0 128 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.891 118.4 55.7 -56.1 -39.5 -4.1 31.5 23.5 17 253 A A H > S+ 0 0 55 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.877 106.4 50.0 -63.4 -40.3 -5.7 32.4 20.2 18 254 A E H >> S+ 0 0 37 2,-0.2 4,-2.0 1,-0.2 3,-0.6 0.914 108.2 51.1 -63.9 -47.0 -2.3 33.1 18.7 19 255 A V H 3< S+ 0 0 46 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.871 105.6 59.1 -59.1 -35.8 -0.8 29.8 19.9 20 256 A A H 3< S+ 0 0 86 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.858 111.5 39.2 -60.3 -35.3 -3.9 28.2 18.2 21 257 A R H << S+ 0 0 173 -4,-1.1 -2,-0.2 -3,-0.6 -1,-0.2 0.737 83.2 112.5 -87.7 -29.3 -2.9 29.7 14.8 22 258 A F < + 0 0 24 -4,-2.0 3,-0.1 1,-0.1 24,-0.0 -0.253 31.3 161.7 -52.4 128.6 0.9 29.3 14.8 23 259 A D + 0 0 142 1,-0.1 -1,-0.1 22,-0.1 2,-0.1 0.062 50.7 79.3-144.1 27.6 1.8 26.7 12.2 24 260 A N - 0 0 52 2,-0.1 21,-2.2 23,-0.0 2,-0.2 -0.592 69.5-178.7-130.7 67.9 5.5 27.1 11.4 25 261 A I E -B 44 0A 32 19,-0.2 2,-0.4 -2,-0.1 19,-0.2 -0.432 16.4-174.0 -78.9 141.2 6.8 25.3 14.5 26 262 A R E -B 43 0A 52 17,-2.7 17,-3.0 -2,-0.2 2,-0.4 -0.999 6.0-170.7-131.2 132.8 10.4 24.8 15.3 27 263 A Q E -Bc 42 82A 2 54,-0.7 56,-2.3 -2,-0.4 2,-0.3 -0.969 3.6-177.2-128.1 139.7 11.6 22.6 18.2 28 264 A G E -Bc 41 83A 0 13,-2.1 13,-2.5 -2,-0.4 2,-0.4 -0.921 6.1-162.6-131.7 157.5 15.0 22.1 19.8 29 265 A L E -Bc 40 84A 2 54,-1.7 56,-3.1 -2,-0.3 2,-0.4 -0.969 8.0-171.7-147.0 124.5 16.4 19.9 22.6 30 266 A D E -B 39 0A 16 9,-2.4 9,-2.7 -2,-0.4 138,-0.1 -0.974 16.8-150.3-109.9 132.8 19.6 20.1 24.6 31 267 A F - 0 0 1 -2,-0.4 7,-0.3 7,-0.2 -1,-0.1 0.607 32.2-127.5 -81.0 -13.8 20.1 17.0 26.8 32 268 A G - 0 0 4 5,-0.3 2,-0.3 7,-0.1 -1,-0.2 -0.016 18.5-146.9 79.4 164.1 22.0 18.6 29.7 33 269 A Y B > -G 36 0B 193 3,-0.5 3,-2.0 5,-0.0 -1,-0.1 -0.878 60.5 -16.2-171.8 131.6 25.4 17.4 30.9 34 270 A G T 3 S- 0 0 65 -2,-0.3 0, 0.0 1,-0.3 0, 0.0 -0.450 135.8 -17.6 61.3-132.1 26.8 17.5 34.5 35 271 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 0.592 112.7 110.7 -78.1 -10.0 24.7 19.9 36.5 36 272 A D B < -G 33 0B 69 -3,-2.0 -3,-0.5 1,-0.1 2,-0.1 -0.375 68.3-119.8 -70.1 139.6 23.3 21.5 33.3 37 273 A P - 0 0 1 0, 0.0 -5,-0.3 0, 0.0 24,-0.3 -0.449 16.5-108.7 -80.9 155.1 19.6 20.9 32.6 38 274 A L E - D 0 60A 0 22,-2.7 22,-2.4 -7,-0.3 2,-0.4 -0.575 40.1-162.6 -66.1 138.3 17.8 19.2 29.7 39 275 A A E -BD 30 59A 0 -9,-2.7 -9,-2.4 -2,-0.2 2,-0.5 -0.951 12.5-174.5-136.4 111.5 16.1 22.1 27.8 40 276 A F E -BD 29 58A 0 18,-3.0 18,-2.1 -2,-0.4 2,-0.4 -0.918 11.1-174.2 -99.0 131.4 13.2 21.5 25.3 41 277 A V E -BD 28 57A 0 -13,-2.5 -13,-2.1 -2,-0.5 2,-0.4 -0.973 13.6-167.2-128.1 145.2 11.9 24.5 23.4 42 278 A R E +BD 27 56A 33 14,-2.3 13,-2.9 -2,-0.4 14,-1.7 -0.997 18.7 170.1-129.3 125.7 9.1 25.0 21.0 43 279 A W E -BD 26 54A 0 -17,-3.0 -17,-2.7 -2,-0.4 2,-0.4 -0.880 28.9-131.7-128.3 159.9 8.8 28.2 18.9 44 280 A H E -BD 25 53A 23 9,-2.5 9,-2.4 -2,-0.3 2,-0.6 -0.944 21.4-147.2-110.8 142.6 6.8 29.6 16.0 45 281 A Y E - D 0 52A 11 -21,-2.2 2,-1.0 -2,-0.4 7,-0.2 -0.925 12.7-169.5-117.3 111.5 8.7 31.2 13.1 46 282 A D E >> - D 0 51A 39 5,-2.7 5,-2.2 -2,-0.6 4,-0.7 -0.847 12.2-177.4 -94.9 95.6 7.2 34.2 11.1 47 283 A K T >45S+ 0 0 150 -2,-1.0 3,-0.5 1,-0.2 -1,-0.2 0.889 75.5 54.3 -63.7 -42.5 9.7 34.2 8.2 48 284 A R T 345S+ 0 0 244 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.867 117.3 36.0 -62.8 -39.5 8.3 37.3 6.4 49 285 A K T 345S- 0 0 107 2,-0.1 -1,-0.2 -3,-0.1 -2,-0.2 0.476 107.0-125.1 -90.1 -5.3 8.4 39.5 9.6 50 286 A N T <<5 + 0 0 61 -4,-0.7 75,-2.2 -3,-0.5 76,-1.4 0.928 64.5 134.2 57.4 49.1 11.7 37.9 10.8 51 287 A R E < -De 46 126A 84 -5,-2.2 -5,-2.7 74,-0.2 2,-0.4 -0.951 42.2-159.3-127.7 150.6 10.2 37.1 14.2 52 288 A I E -De 45 127A 0 74,-1.9 76,-2.9 -2,-0.3 2,-0.4 -0.955 7.7-157.1-125.4 147.8 10.1 34.1 16.5 53 289 A Y E -De 44 128A 21 -9,-2.4 -9,-2.5 -2,-0.4 2,-0.4 -0.994 16.7-130.9-128.0 122.9 7.6 33.4 19.2 54 290 A A E +D 43 0A 0 74,-2.6 76,-0.4 -2,-0.4 -11,-0.2 -0.605 29.7 170.5 -75.9 125.2 8.2 31.2 22.2 55 291 A I E - 0 0 10 -13,-2.9 2,-0.3 -2,-0.4 -12,-0.2 0.835 57.1 -20.2-102.0 -49.0 5.3 28.7 22.7 56 292 A D E -D 42 0A 30 -14,-1.7 -14,-2.3 78,-0.1 -1,-0.4 -0.955 52.6-171.5-158.0 170.5 6.5 26.3 25.3 57 293 A E E -D 41 0A 14 76,-0.3 2,-0.3 -2,-0.3 -16,-0.2 -0.978 14.0-152.7-158.8 160.4 9.5 24.8 27.1 58 294 A L E -D 40 0A 14 -18,-2.1 -18,-3.0 -2,-0.3 2,-0.5 -0.914 14.8-178.2-141.0 120.8 10.7 22.1 29.5 59 295 A V E +D 39 0A 26 -2,-0.3 2,-0.4 -20,-0.2 -20,-0.2 -0.982 8.7 171.4-119.2 122.2 13.7 22.7 31.6 60 296 A D E -D 38 0A 19 -22,-2.4 -22,-2.7 -2,-0.5 3,-0.1 -0.958 26.0-172.9-140.0 115.1 14.8 19.8 33.9 61 297 A H S S+ 0 0 122 -2,-0.4 2,-1.0 -24,-0.3 -1,-0.1 0.690 88.9 63.7 -73.8 -22.4 18.0 19.5 36.0 62 298 A K S S- 0 0 177 -24,-0.1 -1,-0.2 2,-0.1 2,-0.1 -0.806 96.4-143.0-103.8 85.0 17.0 16.0 36.9 63 299 A V + 0 0 69 -2,-1.0 2,-0.4 -3,-0.1 -2,-0.1 -0.306 30.1 168.2 -69.9 123.3 17.2 14.7 33.4 64 300 A S > - 0 0 41 -2,-0.1 4,-1.6 1,-0.1 5,-0.1 -0.980 24.6-167.6-133.1 118.9 14.6 12.1 32.4 65 301 A L H > S+ 0 0 32 -2,-0.4 4,-2.7 2,-0.2 5,-0.2 0.851 95.9 56.8 -68.0 -36.5 14.0 11.0 28.8 66 302 A K H > S+ 0 0 125 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.955 109.5 44.9 -55.9 -49.6 10.8 9.3 30.0 67 303 A R H > S+ 0 0 123 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.840 112.8 51.8 -63.6 -35.6 9.6 12.6 31.5 68 304 A T H X S+ 0 0 3 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.949 111.8 44.5 -69.2 -48.2 10.6 14.5 28.3 69 305 A A H X S+ 0 0 0 -4,-2.7 4,-3.3 1,-0.2 5,-0.3 0.923 111.8 53.8 -62.6 -43.6 8.8 12.1 26.0 70 306 A D H X S+ 0 0 63 -4,-2.6 4,-3.3 -5,-0.2 -1,-0.2 0.916 110.2 47.6 -55.9 -43.3 5.7 12.1 28.2 71 307 A F H X S+ 0 0 43 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.919 113.7 47.0 -63.4 -44.5 5.6 15.9 28.1 72 308 A V H <>S+ 0 0 3 -4,-2.4 5,-2.7 2,-0.2 6,-0.5 0.947 117.5 42.2 -64.7 -49.2 6.0 16.0 24.3 73 309 A R H ><5S+ 0 0 82 -4,-3.3 3,-2.2 3,-0.2 -2,-0.2 0.952 110.6 56.4 -60.6 -50.4 3.3 13.3 23.8 74 310 A K H 3<5S+ 0 0 179 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.869 113.2 41.1 -50.5 -42.4 1.0 14.9 26.4 75 311 A N T 3<5S- 0 0 60 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.348 111.6-118.8 -89.0 4.7 1.0 18.2 24.6 76 312 A K T < 5S+ 0 0 163 -3,-2.2 3,-0.4 -4,-0.2 -3,-0.2 0.871 72.5 135.0 55.0 40.5 0.8 16.6 21.1 77 313 A Y > < + 0 0 26 -5,-2.7 3,-0.9 -6,-0.2 -4,-0.2 0.319 43.8 93.0 -91.6 7.0 4.1 18.1 20.2 78 314 A E T 3 S+ 0 0 80 -6,-0.5 25,-0.5 1,-0.2 -1,-0.2 0.713 74.0 63.9 -74.2 -22.3 5.2 14.7 18.7 79 315 A S T 3 S+ 0 0 77 -3,-0.4 2,-0.4 2,-0.1 -1,-0.2 0.587 92.7 70.6 -83.9 -12.9 4.0 15.7 15.2 80 316 A A S < S- 0 0 18 -3,-0.9 23,-0.1 1,-0.0 -54,-0.1 -0.850 94.8-101.3-103.1 145.5 6.5 18.5 14.8 81 317 A R - 0 0 114 -2,-0.4 -54,-0.7 -56,-0.2 2,-0.5 -0.320 26.7-150.0 -65.3 142.6 10.2 17.7 14.4 82 318 A I E -cf 27 104A 4 21,-3.1 23,-2.7 -4,-0.1 2,-0.6 -0.974 2.9-155.9-113.5 121.1 12.7 18.0 17.3 83 319 A I E -cf 28 105A 5 -56,-2.3 -54,-1.7 -2,-0.5 2,-0.4 -0.895 25.7-160.5 -94.6 122.7 16.3 18.9 16.4 84 320 A A E -cf 29 106A 0 21,-2.8 23,-2.9 -2,-0.6 -54,-0.2 -0.859 28.3 -87.3-118.8 143.4 18.4 17.6 19.2 85 321 A D > - 0 0 14 -56,-3.1 3,-1.1 -2,-0.4 7,-0.1 -0.164 37.1-152.6 -30.4 106.0 21.9 18.1 20.8 86 322 A S T 3 S+ 0 0 61 1,-0.3 -1,-0.2 23,-0.2 20,-0.1 0.487 79.9 84.9 -80.2 -1.7 24.0 15.7 18.7 87 323 A S T 3 S+ 0 0 87 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.643 90.6 52.2 -72.3 -13.1 26.5 15.1 21.5 88 324 A E X> + 0 0 50 -3,-1.1 4,-1.8 1,-0.1 3,-0.8 -0.616 64.0 164.3-121.1 68.7 24.2 12.4 22.9 89 325 A P H 3> S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.840 78.1 50.7 -58.2 -30.9 23.6 10.1 19.9 90 326 A R H 3> S+ 0 0 174 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.742 104.5 56.7 -82.4 -22.5 22.2 7.3 22.2 91 327 A S H <> S+ 0 0 23 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.882 108.8 48.3 -69.2 -40.0 19.8 9.7 24.0 92 328 A I H X S+ 0 0 16 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.943 112.1 47.9 -59.3 -49.8 18.4 10.5 20.6 93 329 A D H X>S+ 0 0 59 -4,-2.0 4,-3.4 1,-0.2 5,-0.5 0.932 111.0 53.1 -55.8 -49.1 18.2 6.7 19.8 94 330 A A H X>S+ 0 0 22 -4,-2.6 4,-2.2 1,-0.2 5,-1.5 0.910 107.8 48.4 -53.4 -50.2 16.5 6.2 23.2 95 331 A L H <5S+ 0 0 3 -4,-2.3 6,-3.0 3,-0.2 -1,-0.2 0.865 119.5 41.3 -61.2 -36.9 13.8 8.8 22.6 96 332 A K H X5S+ 0 0 80 -4,-1.9 4,-0.7 4,-0.2 -2,-0.2 0.961 127.1 26.3 -70.5 -59.1 13.1 7.3 19.2 97 333 A L H <5S+ 0 0 144 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.2 0.737 132.8 31.9 -88.9 -24.7 13.3 3.5 19.8 98 334 A E T < + 0 0 3 -6,-3.0 3,-0.5 1,-0.2 -1,-0.2 -0.742 19.7 171.9 -90.0 90.3 9.4 10.1 19.7 102 338 A N T 3 + 0 0 112 -2,-1.3 2,-0.8 1,-0.2 -1,-0.2 0.841 62.0 61.9 -74.8 -37.9 9.9 9.4 16.0 103 339 A R T 3 S+ 0 0 149 -25,-0.5 -21,-3.1 -3,-0.2 2,-0.5 -0.234 76.1 116.7 -88.8 44.2 10.5 12.9 14.6 104 340 A I E < +f 82 0A 4 -2,-0.8 2,-0.3 -3,-0.5 -21,-0.2 -0.937 37.3 171.2-107.1 134.9 13.6 13.5 16.6 105 341 A E E -f 83 0A 54 -23,-2.7 -21,-2.8 -2,-0.5 2,-0.1 -0.993 35.5-100.3-139.5 153.9 16.9 14.0 14.7 106 342 A G E -f 84 0A 26 -2,-0.3 2,-0.2 -23,-0.2 -21,-0.2 -0.394 45.4-100.3 -65.0 141.0 20.4 15.1 15.6 107 343 A A - 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