==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 03-OCT-11 3U2G . COMPND 2 MOLECULE: S-LAYER PROTEIN MA0829; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOSARCINA ACETIVORANS; . AUTHOR S.CHAN,T.PHAN,C.J.AHN,A.SHIN,L.ROHLIN,R.P.GUNSALUS,M.A.ARBIN . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13316.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 129 47.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 3.3 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 . 33 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 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 . 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 0 PARALLEL BRIDGES PER LADDER . 5 4 2 2 6 1 1 2 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 2 2 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 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 1 295 A T 0 0 125 0, 0.0 2,-0.3 0, 0.0 273,-0.2 0.000 360.0 360.0 360.0 152.2 28.3 57.4 28.6 2 296 A Y E -A 273 0A 123 271,-1.4 271,-2.3 2,-0.0 2,-0.4 -0.861 360.0-124.8-134.3 170.8 30.0 56.5 25.3 3 297 A E E -A 272 0A 84 -2,-0.3 2,-0.4 269,-0.2 269,-0.2 -0.908 11.1-167.6-123.7 136.0 29.6 57.5 21.6 4 298 A I E -A 271 0A 47 267,-1.9 267,-2.1 -2,-0.4 2,-0.2 -0.983 20.6-155.6-122.5 119.4 29.1 55.5 18.5 5 299 A R E -A 270 0A 163 -2,-0.4 18,-0.6 265,-0.2 265,-0.2 -0.523 3.9-146.9 -96.8 158.2 29.6 57.4 15.2 6 300 A G B -E 22 0B 5 263,-2.5 16,-0.2 1,-0.2 -1,-0.1 -0.520 45.4 -58.3-106.0-178.8 28.3 56.9 11.7 7 301 A Q - 0 0 121 14,-2.8 2,-0.2 -2,-0.2 -1,-0.2 -0.234 60.6-104.2 -60.0 151.3 29.9 57.6 8.3 8 302 A V - 0 0 75 260,-0.1 2,-0.4 -3,-0.1 260,-0.2 -0.540 28.4-151.6 -81.7 140.1 31.1 61.1 7.6 9 303 A A E -B 267 0A 2 258,-3.2 258,-2.1 -2,-0.2 2,-0.3 -0.898 12.8-168.6-107.3 140.0 29.0 63.3 5.2 10 304 A S E +B 266 0A 73 -2,-0.4 3,-0.3 256,-0.2 256,-0.2 -0.963 42.3 8.0-128.0 151.3 30.7 66.0 3.2 11 305 A G S S- 0 0 29 254,-2.3 253,-0.1 -2,-0.3 -2,-0.0 -0.238 91.2 -66.9 83.2-168.1 29.3 68.9 1.1 12 306 A F S S+ 0 0 80 31,-0.0 31,-0.4 -2,-0.0 -1,-0.2 0.308 91.4 109.2-111.3 5.0 25.8 70.3 0.7 13 307 A G S S- 0 0 44 -3,-0.3 2,-0.1 1,-0.2 30,-0.0 -0.126 80.1 -76.7 -72.4 173.2 24.2 67.3 -1.1 14 308 A D - 0 0 97 28,-0.1 2,-0.3 27,-0.0 27,-0.2 -0.391 50.6-160.5 -70.7 151.0 21.6 65.0 0.2 15 309 A Q E -F 40 0C 49 25,-2.8 25,-2.2 -2,-0.1 2,-0.3 -0.950 10.2-166.6-136.9 156.2 22.8 62.3 2.7 16 310 A S E -F 39 0C 75 -2,-0.3 2,-0.4 23,-0.2 23,-0.2 -0.987 1.7-169.5-148.8 133.6 21.6 58.9 4.0 17 311 A W E +F 38 0C 6 21,-2.7 21,-1.9 -2,-0.3 2,-0.2 -0.961 13.0 162.0-119.9 141.7 22.5 56.6 6.8 18 312 A D >> - 0 0 61 -2,-0.4 4,-0.9 19,-0.2 3,-0.9 -0.713 59.7 -72.1-135.1-168.9 21.4 53.0 7.5 19 313 A A T 34 S+ 0 0 16 17,-0.5 3,-0.3 1,-0.2 6,-0.1 0.836 128.8 55.4 -58.1 -33.5 22.7 50.1 9.6 20 314 A S T 34 S+ 0 0 106 1,-0.2 -1,-0.2 3,-0.0 3,-0.1 0.762 118.9 31.8 -74.6 -23.2 25.6 49.5 7.2 21 315 A S T <4 S+ 0 0 18 -3,-0.9 -14,-2.8 1,-0.2 2,-0.2 0.298 120.6 51.6-115.2 3.4 26.9 53.1 7.5 22 316 A F B >< -E 6 0B 1 -4,-0.9 3,-2.2 -3,-0.3 -1,-0.2 -0.722 59.2-168.4-145.6 95.7 25.8 53.8 11.1 23 317 A A T 3 S+ 0 0 76 -18,-0.6 -17,-0.1 1,-0.3 4,-0.1 0.520 83.8 72.2 -60.8 -10.7 26.9 51.3 13.8 24 318 A G T 3 S+ 0 0 6 -20,-0.1 -1,-0.3 2,-0.1 -5,-0.1 0.791 80.8 89.6 -72.6 -30.9 24.6 53.0 16.3 25 319 A F S < S- 0 0 7 -3,-2.2 -3,-0.1 -7,-0.2 -7,-0.0 -0.384 92.6 -95.6 -69.3 147.2 21.5 51.6 14.5 26 320 A Y + 0 0 23 58,-0.1 9,-0.5 -2,-0.1 10,-0.3 -0.303 48.3 177.0 -61.2 138.3 20.2 48.2 15.5 27 321 A Y - 0 0 105 7,-0.1 2,-0.6 -4,-0.1 7,-0.2 -0.986 23.1-155.6-151.0 135.6 21.4 45.2 13.4 28 322 A D B >> -J 33 0D 36 5,-2.7 5,-1.8 -2,-0.3 4,-1.2 -0.954 6.3-168.2-113.5 112.9 20.9 41.4 13.6 29 323 A I T 45S+ 0 0 126 -2,-0.6 -1,-0.1 3,-0.2 5,-0.0 0.859 81.2 56.9 -73.6 -35.7 23.8 39.5 11.9 30 324 A D T 45S+ 0 0 126 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.876 123.1 25.7 -65.1 -39.4 22.2 36.0 11.8 31 325 A D T 45S- 0 0 38 2,-0.1 -1,-0.2 -3,-0.1 -2,-0.2 0.532 103.3-130.4 -99.1 -8.6 19.1 37.2 9.9 32 326 A N T <5 + 0 0 118 -4,-1.2 2,-0.4 1,-0.2 -3,-0.2 0.954 57.5 145.2 58.3 54.9 21.0 40.2 8.3 33 327 A V B < +J 28 0D 30 -5,-1.8 -5,-2.7 27,-0.0 2,-0.3 -0.954 23.6 161.4-132.1 137.4 18.3 42.6 9.3 34 328 A S - 0 0 45 -2,-0.4 -7,-0.1 -7,-0.2 44,-0.0 -0.915 18.2-161.9-142.2 172.0 18.0 46.2 10.4 35 329 A T + 0 0 14 -9,-0.5 23,-1.4 -2,-0.3 2,-0.3 0.561 52.8 92.1-130.3 -14.0 15.2 48.8 10.5 36 330 A E E + G 0 57C 1 -10,-0.3 -17,-0.5 21,-0.2 2,-0.3 -0.660 35.2 171.3-105.5 142.9 16.5 52.3 10.8 37 331 A T E - G 0 56C 48 19,-2.1 19,-2.7 -2,-0.3 2,-0.4 -0.976 11.7-164.5-135.3 154.0 17.4 55.1 8.4 38 332 A L E -FG 17 55C 0 -21,-1.9 -21,-2.7 -2,-0.3 2,-0.3 -0.991 16.7-173.7-132.3 125.7 18.4 58.8 9.0 39 333 A T E -FG 16 54C 34 15,-2.4 15,-1.8 -2,-0.4 2,-0.4 -0.918 17.9-160.4-124.0 151.4 18.3 61.2 6.0 40 334 A V E +FG 15 53C 0 -25,-2.2 -25,-2.8 -2,-0.3 2,-0.3 -1.000 25.6 172.5-124.0 125.9 19.3 64.8 5.4 41 335 A S + 0 0 34 11,-1.8 -28,-0.1 -2,-0.4 -27,-0.0 -0.961 46.4 12.8-137.4 151.3 17.8 66.5 2.3 42 336 A D - 0 0 115 -2,-0.3 -1,-0.1 1,-0.2 -29,-0.1 0.807 69.8-171.4 59.1 41.4 17.5 69.9 0.5 43 337 A L - 0 0 23 -31,-0.4 2,-0.6 5,-0.1 5,-0.2 -0.330 18.0-157.6 -58.8 138.9 20.2 71.8 2.5 44 338 A D B > S-K 47 0E 136 3,-2.3 3,-1.7 -2,-0.0 2,-0.2 -0.931 72.9 -51.8-114.8 101.4 20.4 75.5 2.0 45 339 A G T 3 S- 0 0 36 -2,-0.6 218,-0.0 1,-0.2 220,-0.0 -0.530 121.4 -25.3 61.2-129.9 24.0 76.1 3.1 46 340 A N T 3 S+ 0 0 31 -2,-0.2 195,-3.1 -3,-0.1 2,-0.6 0.150 116.9 102.9 -97.7 21.5 24.1 74.4 6.5 47 341 A V E < -KL 44 240E 45 -3,-1.7 -3,-2.3 193,-0.2 193,-0.2 -0.910 58.7-151.7-111.5 118.9 20.4 74.8 7.2 48 342 A I E - L 0 239E 0 191,-3.4 191,-2.0 -2,-0.6 -5,-0.1 -0.760 22.7-131.3 -84.1 128.5 18.1 71.8 6.9 49 343 A P > - 0 0 42 0, 0.0 3,-2.6 0, 0.0 4,-0.4 -0.217 40.3 -67.7 -75.1 166.8 14.5 72.8 5.9 50 344 A E T 3 S+ 0 0 123 1,-0.3 186,-0.2 186,-0.2 188,-0.1 -0.321 127.1 13.6 -48.5 130.1 11.3 71.6 7.6 51 345 A G T 3 S+ 0 0 35 184,-2.4 -1,-0.3 186,-0.2 185,-0.1 0.463 97.3 107.8 78.8 2.9 11.0 67.9 6.8 52 346 A G < + 0 0 3 -3,-2.6 -11,-1.8 183,-0.2 2,-0.6 0.606 68.4 63.8 -88.3 -14.6 14.6 67.6 5.5 53 347 A L E S+G 40 0C 0 -4,-0.4 182,-1.0 -13,-0.2 2,-0.4 -0.951 71.3 175.0-114.0 113.8 15.7 65.6 8.5 54 348 A V E -GH 39 234C 14 -15,-1.8 -15,-2.4 -2,-0.6 2,-0.5 -0.976 21.0-168.8-133.3 122.0 13.9 62.3 8.7 55 349 A Y E -GH 38 233C 0 178,-3.5 178,-3.5 -2,-0.4 2,-0.4 -0.944 19.6-177.5-104.4 125.2 14.4 59.3 11.0 56 350 A T E -GH 37 232C 27 -19,-2.7 -19,-2.1 -2,-0.5 2,-0.4 -0.976 14.1-178.3-126.7 138.8 12.5 56.2 9.9 57 351 A T E -GH 36 231C 0 174,-2.4 174,-2.8 -2,-0.4 2,-0.4 -0.989 5.9-172.5-137.6 131.0 12.1 52.7 11.4 58 352 A T E - H 0 230C 51 -23,-1.4 172,-0.2 -2,-0.4 22,-0.2 -0.979 32.7-103.9-126.2 131.1 10.1 49.9 9.7 59 353 A I + 0 0 17 170,-2.6 2,-0.2 -2,-0.4 20,-0.2 -0.213 41.8 178.7 -60.4 137.7 9.3 46.6 11.4 60 354 A A E -M 78 0F 19 18,-2.3 18,-3.2 -27,-0.1 2,-0.3 -0.771 19.6-122.1-127.7 177.3 11.4 43.6 10.2 61 355 A D E -M 77 0F 69 16,-0.3 2,-0.3 -2,-0.2 14,-0.0 -0.936 19.3-172.7-129.1 145.9 11.5 39.9 11.3 62 356 A V E -M 76 0F 0 14,-2.6 14,-2.8 -2,-0.3 2,-0.2 -0.942 32.5 -97.9-133.3 157.2 14.1 37.6 12.7 63 357 A D E -M 75 0F 48 -2,-0.3 12,-0.3 12,-0.3 4,-0.1 -0.502 42.1-109.0 -69.8 136.3 14.2 33.8 13.4 64 358 A F E - 0 0 14 10,-1.9 -1,-0.1 -2,-0.2 138,-0.1 -0.327 25.0-121.9 -52.1 147.4 13.6 32.7 16.9 65 359 A E E S+ 0 0 90 1,-0.3 2,-1.3 136,-0.2 40,-0.1 0.924 115.6 56.1 -62.0 -44.8 16.8 31.4 18.6 66 360 A Y E S- 0 0 27 38,-0.3 2,-0.6 135,-0.2 -1,-0.3 -0.755 91.2-166.6 -82.9 91.6 14.9 28.2 19.1 67 361 A Y E + 0 0 120 -2,-1.3 7,-0.2 -4,-0.1 8,-0.1 -0.745 32.8 130.9 -91.3 115.6 14.1 27.8 15.3 68 362 A N E > > -M 73 0F 46 5,-2.5 5,-2.5 -2,-0.6 3,-1.0 -0.548 28.0-174.5-163.2 81.0 11.5 25.2 14.5 69 363 A P G > 5S+ 0 0 56 0, 0.0 3,-1.5 0, 0.0 5,-0.2 0.862 84.4 58.0 -55.0 -36.1 8.7 26.3 12.2 70 364 A D G 3 5S+ 0 0 117 1,-0.3 90,-0.3 2,-0.2 4,-0.1 0.807 106.5 47.7 -65.7 -32.4 6.7 23.1 12.5 71 365 A A G < 5S- 0 0 0 -3,-1.0 -1,-0.3 88,-0.1 92,-0.1 0.336 132.7 -93.3 -87.9 6.7 6.5 23.4 16.3 72 366 A G T < 5S+ 0 0 16 -3,-1.5 2,-0.5 -4,-0.3 -2,-0.2 0.704 91.3 122.2 93.2 24.1 5.4 27.0 15.8 73 367 A W E < +M 68 0F 0 -5,-2.5 -5,-2.5 1,-0.1 -3,-0.2 -0.750 26.1 121.9-120.1 80.7 8.8 28.7 16.0 74 368 A D E - 0 0 78 -2,-0.5 -10,-1.9 1,-0.3 2,-0.3 0.701 69.2 -26.4-103.6 -91.2 9.4 30.6 12.8 75 369 A Q E -M 63 0F 86 -12,-0.3 -1,-0.3 -6,-0.1 -12,-0.3 -0.880 45.0-157.3-130.6 157.5 10.0 34.4 13.1 76 370 A Y E -M 62 0F 10 -14,-2.8 -14,-2.6 -2,-0.3 2,-0.2 -0.937 30.7-100.1-129.7 158.3 9.2 37.3 15.4 77 371 A P E -M 61 0F 17 0, 0.0 2,-0.3 0, 0.0 -16,-0.3 -0.489 34.8-174.5 -82.1 146.0 9.1 41.1 14.7 78 372 A V E -M 60 0F 0 -18,-3.2 -18,-2.3 -2,-0.2 2,-0.3 -0.952 4.2-173.0-134.0 152.5 11.9 43.5 15.6 79 373 A X E -N 86 0G 0 7,-2.3 7,-2.2 -2,-0.3 2,-0.3 -0.929 20.3-136.3-151.1 125.6 12.2 47.2 15.5 80 374 A G E -N 85 0G 0 -2,-0.3 2,-0.4 -22,-0.2 5,-0.2 -0.595 22.7-174.3 -71.2 135.2 15.0 49.6 16.1 81 375 A F E > S-N 84 0G 11 3,-2.7 3,-0.9 -2,-0.3 -2,-0.0 -0.830 71.3 -29.2-139.1 103.6 13.9 52.6 18.1 82 376 A F T 3 S- 0 0 11 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.965 127.2 -46.8 48.2 57.5 16.5 55.4 18.5 83 377 A A T 3 S+ 0 0 9 1,-0.2 2,-0.4 -57,-0.1 -1,-0.2 0.465 119.8 106.7 71.5 4.2 19.3 52.8 18.3 84 378 A E E < S-N 81 0G 82 -3,-0.9 -3,-2.7 -58,-0.1 2,-0.4 -0.903 71.4-115.0-112.8 147.5 17.6 50.3 20.8 85 379 A E E +N 80 0G 57 -2,-0.4 2,-0.3 -5,-0.2 15,-0.3 -0.619 38.5 171.1 -77.7 129.7 16.0 47.0 20.0 86 380 A Y E -N 79 0G 36 -7,-2.2 -7,-2.3 -2,-0.4 13,-0.2 -0.938 28.7-130.3-129.8 159.0 12.2 46.7 20.7 87 381 A I E -O 98 0H 1 11,-3.4 11,-1.8 -2,-0.3 2,-0.3 -0.947 20.6-132.7-107.5 117.3 9.6 44.1 19.9 88 382 A P E -O 97 0H 3 0, 0.0 9,-0.3 0, 0.0 6,-0.1 -0.573 11.6-146.8 -65.2 128.9 6.4 45.4 18.3 89 383 A I S S+ 0 0 11 7,-2.0 89,-0.3 -2,-0.3 8,-0.1 0.736 95.0 39.2 -76.1 -22.0 3.6 43.7 20.3 90 384 A N S > S- 0 0 32 6,-0.5 3,-2.9 3,-0.5 -1,-0.3 -0.984 87.6-141.6-120.9 115.2 1.5 43.5 17.1 91 385 A P T 3 S+ 0 0 66 0, 0.0 -13,-0.1 0, 0.0 -2,-0.1 0.566 98.6 52.1 -60.6 -9.4 3.8 42.7 14.2 92 386 A D T 3 S+ 0 0 116 1,-0.1 2,-0.5 -15,-0.1 138,-0.1 0.390 99.0 72.7-100.1 -1.6 1.9 45.1 11.9 93 387 A K X - 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