==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 28-JUN-10 2XIC . COMPND 2 MOLECULE: ANCILLARY PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PYOGENES; . AUTHOR J.A.POINTON,W.D.SMITH,G.SAALBACH,A.CROW,M.A.KEHOE,M.J.BANFIE . 847 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39502.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 549 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 237 28.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 92 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 9.9 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+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 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 0 0 0 2 2 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 . 17 11 8 6 10 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 2 6 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 1 290 A T 0 0 129 0, 0.0 2,-0.4 0, 0.0 46,-0.1 0.000 360.0 360.0 360.0 -99.5 -19.9 -34.2 21.3 2 291 A T E -A 46 0A 11 44,-0.7 44,-2.5 2,-0.0 2,-0.3 -0.969 360.0-143.4-138.4 119.7 -17.6 -31.6 23.0 3 292 A S E +A 45 0A 36 -2,-0.4 291,-0.6 42,-0.2 2,-0.3 -0.612 23.3 172.5 -79.5 134.0 -18.2 -27.9 23.5 4 293 A V E -Ab 44 294A 0 40,-2.3 40,-2.7 -2,-0.3 2,-0.5 -0.970 20.6-146.8-133.0 155.7 -15.3 -25.5 23.2 5 294 A L E -Ab 43 295A 5 289,-2.2 291,-1.8 -2,-0.3 2,-0.6 -0.986 10.2-144.5-122.3 120.9 -15.2 -21.7 23.3 6 295 A I E -Ab 42 296A 5 36,-2.2 36,-2.4 -2,-0.5 2,-0.4 -0.756 25.9-176.3 -82.8 117.8 -12.7 -19.8 21.2 7 296 A R E - b 0 297A 2 289,-1.8 291,-2.4 -2,-0.6 2,-0.5 -0.974 16.5-153.5-123.5 129.5 -11.7 -16.7 23.1 8 297 A K E + b 0 298A 2 -2,-0.4 10,-2.4 30,-0.4 2,-0.3 -0.856 20.5 178.0 -98.4 128.2 -9.3 -13.9 22.0 9 298 A Y E - b 0 299A 0 289,-3.0 291,-2.7 -2,-0.5 2,-0.5 -0.812 27.8-124.4-121.9 166.4 -7.5 -12.0 24.7 10 299 A A E > -Cb 13 300A 5 3,-0.7 3,-1.7 6,-0.4 291,-0.2 -0.961 33.8-114.8-110.0 126.8 -4.9 -9.2 24.8 11 300 A I T 3 S+ 0 0 62 289,-2.6 291,-0.2 -2,-0.5 288,-0.0 -0.414 101.3 18.0 -60.9 128.6 -1.7 -10.0 26.7 12 301 A G T 3 S+ 0 0 68 158,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.122 120.1 62.7 98.2 -20.9 -1.5 -7.7 29.7 13 302 A D B < +C 10 0A 46 -3,-1.7 -3,-0.7 3,-0.1 3,-0.4 -0.788 45.6 159.7-139.9 96.3 -5.2 -6.6 29.8 14 303 A Y + 0 0 19 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.061 45.8 108.5-101.6 21.8 -7.6 -9.5 30.5 15 304 A S S S+ 0 0 19 1,-0.1 2,-0.3 260,-0.1 -1,-0.2 0.547 92.7 9.0 -75.1 -8.8 -10.4 -7.1 31.6 16 305 A K S S- 0 0 104 -3,-0.4 -6,-0.4 -6,-0.1 2,-0.2 -0.964 86.1 -97.8-160.8 155.6 -12.2 -7.9 28.4 17 306 A L - 0 0 5 -2,-0.3 2,-0.9 22,-0.3 -8,-0.3 -0.515 46.6-108.6 -70.6 148.0 -12.0 -10.3 25.4 18 307 A L > - 0 0 7 -10,-2.4 3,-0.5 -2,-0.2 -10,-0.1 -0.727 38.8-162.5 -84.5 105.9 -10.3 -8.7 22.4 19 308 A E T 3 + 0 0 112 -2,-0.9 19,-0.2 1,-0.2 3,-0.1 -0.474 62.7 47.2 -81.9 158.1 -13.0 -8.1 19.7 20 309 A G T 3 S+ 0 0 8 17,-1.6 2,-0.4 561,-0.3 -1,-0.2 0.481 70.3 133.1 92.9 4.6 -12.2 -7.5 16.1 21 310 A A < - 0 0 0 -3,-0.5 16,-2.7 37,-0.1 2,-0.7 -0.741 53.1-135.6 -85.4 133.4 -9.7 -10.4 15.4 22 311 A T E -JK 36 57B 11 35,-2.6 34,-1.8 -2,-0.4 35,-0.9 -0.835 31.6-173.8 -90.8 115.5 -10.4 -12.4 12.3 23 312 A L E -JK 35 55B 1 12,-2.9 12,-2.5 -2,-0.7 2,-0.4 -0.785 17.3-160.5-116.2 153.4 -10.0 -16.1 13.2 24 313 A Q E -JK 34 54B 56 30,-2.5 30,-3.1 -2,-0.3 2,-0.6 -0.960 4.5-158.8-136.9 115.0 -9.9 -19.3 11.2 25 314 A L E -JK 33 53B 0 8,-2.0 8,-1.7 -2,-0.4 2,-0.3 -0.857 16.4-173.6 -96.0 123.1 -10.5 -22.8 12.8 26 315 A T E - K 0 52B 47 26,-3.5 26,-3.1 -2,-0.6 2,-0.3 -0.884 7.4-153.9-116.2 145.1 -9.2 -25.6 10.6 27 316 A G E K 0 51B 24 -2,-0.3 24,-0.2 3,-0.3 5,-0.1 -0.822 360.0 360.0-116.4 158.8 -9.5 -29.4 11.1 28 317 A D 0 0 163 22,-1.5 22,-0.1 -2,-0.3 23,-0.0 -0.597 360.0 360.0 -77.2 360.0 -7.4 -32.4 10.1 29 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 30 322 A F 0 0 109 0, 0.0 2,-0.5 0, 0.0 -3,-0.3 0.000 360.0 360.0 360.0 118.8 -15.4 -31.0 9.9 31 323 A Q - 0 0 150 -5,-0.1 -6,-0.1 1,-0.1 2,-0.1 -0.659 360.0-126.8 -84.4 122.4 -15.9 -27.9 7.7 32 324 A A - 0 0 44 -2,-0.5 2,-0.3 -5,-0.1 -6,-0.2 -0.384 35.1-175.6 -66.7 145.1 -13.3 -25.2 8.2 33 325 A R E -J 25 0B 103 -8,-1.7 -8,-2.0 -2,-0.1 2,-0.4 -0.976 23.6-139.0-147.1 152.3 -14.7 -21.8 9.0 34 326 A V E +J 24 0B 60 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.928 29.6 166.1-114.6 139.4 -13.8 -18.1 9.6 35 327 A F E -J 23 0B 12 -12,-2.5 -12,-2.9 -2,-0.4 2,-0.4 -0.922 34.6-106.2-146.3 169.7 -15.3 -15.9 12.3 36 328 A S E -J 22 0B 28 -2,-0.3 -14,-0.2 -14,-0.2 2,-0.2 -0.829 37.8-112.0-101.4 136.3 -14.9 -12.7 14.2 37 329 A S - 0 0 7 -16,-2.7 -17,-1.6 -2,-0.4 2,-0.2 -0.491 44.2-173.7 -66.6 134.2 -13.7 -12.6 17.8 38 330 A N - 0 0 46 -19,-0.2 -30,-0.4 -2,-0.2 4,-0.1 -0.593 37.3 -93.4-124.7-174.7 -16.5 -11.4 20.1 39 331 A D S S+ 0 0 91 -2,-0.2 -22,-0.3 1,-0.2 -2,-0.1 0.515 117.5 30.7 -84.4 -6.3 -17.1 -10.5 23.8 40 332 A I S S- 0 0 81 -34,-0.1 -1,-0.2 52,-0.1 2,-0.1 0.659 113.7 -96.0-119.9 -29.4 -18.2 -14.0 25.0 41 333 A G - 0 0 5 2,-0.1 2,-0.7 51,-0.1 -34,-0.2 -0.206 36.5 -80.8 120.7 147.6 -16.4 -16.5 22.9 42 334 A E E -A 6 0A 63 -36,-2.4 -36,-2.2 -4,-0.1 2,-0.5 -0.728 44.7-143.0 -83.7 113.2 -17.1 -18.5 19.7 43 335 A R E +A 5 0A 128 -2,-0.7 2,-0.4 -38,-0.2 -38,-0.2 -0.661 28.0 171.9 -82.7 120.4 -19.2 -21.6 20.8 44 336 A I E -A 4 0A 7 -40,-2.7 -40,-2.3 -2,-0.5 2,-0.6 -0.990 29.2-146.0-135.1 136.2 -18.3 -24.7 18.7 45 337 A E E -A 3 0A 103 -2,-0.4 2,-0.4 -42,-0.2 -42,-0.2 -0.907 29.7-167.8 -99.8 121.0 -19.2 -28.4 19.0 46 338 A L E -A 2 0A 0 -44,-2.5 -44,-0.7 -2,-0.6 2,-0.2 -0.902 18.1-141.5-120.8 136.2 -16.3 -30.6 17.9 47 339 A S - 0 0 75 -2,-0.4 25,-0.2 1,-0.2 0, 0.0 -0.489 53.7 -72.3 -78.9 159.4 -15.8 -34.2 17.0 48 340 A D S S+ 0 0 99 -2,-0.2 2,-0.3 23,-0.1 25,-0.2 -0.279 88.7 96.2 -53.0 134.0 -12.6 -36.0 18.1 49 341 A G E S- L 0 72B 28 23,-1.8 23,-3.3 -3,-0.1 2,-0.5 -0.911 75.2 -75.1 161.9 173.4 -9.7 -34.8 16.0 50 342 A T E - L 0 71B 39 -2,-0.3 -22,-1.5 21,-0.2 2,-0.3 -0.888 48.1-176.4-101.7 122.8 -6.7 -32.4 15.7 51 343 A Y E -KL 27 70B 9 19,-2.8 19,-2.5 -2,-0.5 2,-0.4 -0.783 15.1-149.8-117.9 161.2 -7.7 -28.7 15.0 52 344 A T E -KL 26 69B 29 -26,-3.1 -26,-3.5 -2,-0.3 2,-0.5 -0.999 4.2-153.4-134.6 129.8 -5.7 -25.6 14.3 53 345 A L E -KL 25 68B 0 15,-3.5 15,-1.9 -2,-0.4 2,-0.4 -0.929 19.2-174.4-105.9 120.7 -6.8 -22.0 15.1 54 346 A T E -K 24 0B 21 -30,-3.1 -30,-2.5 -2,-0.5 2,-0.7 -0.927 22.2-139.8-120.2 137.2 -5.2 -19.3 12.8 55 347 A E E -K 23 0B 4 10,-0.5 -32,-0.2 -2,-0.4 3,-0.2 -0.852 14.8-175.4 -94.4 113.6 -5.4 -15.5 13.0 56 348 A L E S- 0 0 57 -34,-1.8 2,-0.3 -2,-0.7 -1,-0.2 0.935 74.3 -10.4 -76.7 -48.7 -5.8 -14.1 9.5 57 349 A N E -K 22 0B 58 -35,-0.9 -35,-2.6 6,-0.1 -1,-0.3 -0.982 69.5-143.6-148.0 157.1 -5.6 -10.6 10.7 58 350 A S - 0 0 14 -2,-0.3 -37,-0.1 4,-0.2 3,-0.1 -0.621 34.0 -78.9-112.9 165.8 -5.6 -8.9 14.1 59 351 A P > - 0 0 17 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 -0.233 63.8 -80.1 -61.2 153.6 -7.0 -5.6 15.5 60 352 A A T 3 S+ 0 0 45 1,-0.3 3,-0.1 -40,-0.1 644,-0.1 -0.348 121.2 28.9 -57.1 127.2 -5.1 -2.4 14.9 61 353 A G T 3 S+ 0 0 32 1,-0.3 242,-2.4 -3,-0.1 243,-0.5 0.023 104.3 94.3 109.6 -23.8 -2.3 -2.2 17.4 62 354 A Y B < -O 302 0C 37 -3,-2.3 -1,-0.3 240,-0.3 240,-0.3 -0.749 67.2-127.7-111.3 148.4 -1.8 -5.9 17.7 63 355 A S - 0 0 18 238,-3.4 2,-0.3 -2,-0.3 238,-0.2 -0.435 40.6 -91.6 -79.8 161.9 0.5 -8.5 16.1 64 356 A I - 0 0 79 -2,-0.1 2,-0.2 -6,-0.1 -1,-0.1 -0.603 47.4-127.2 -71.4 134.3 -0.8 -11.7 14.5 65 357 A A - 0 0 14 -2,-0.3 -10,-0.5 1,-0.1 235,-0.1 -0.521 25.0 -96.5 -85.6 153.8 -0.7 -14.5 17.1 66 358 A E - 0 0 82 233,-0.2 233,-0.1 -2,-0.2 -1,-0.1 -0.374 50.5 -96.8 -66.0 141.5 0.9 -17.8 16.6 67 359 A P - 0 0 66 0, 0.0 2,-0.6 0, 0.0 -13,-0.2 -0.402 33.9-138.0 -64.0 136.1 -1.5 -20.5 15.4 68 360 A I E -L 53 0B 49 -15,-1.9 -15,-3.5 -2,-0.1 2,-0.5 -0.861 14.3-163.3 -94.9 122.6 -2.8 -22.7 18.2 69 361 A T E +L 52 0B 53 -2,-0.6 11,-2.1 -17,-0.3 2,-0.3 -0.945 18.1 172.0-104.7 122.2 -3.0 -26.5 17.4 70 362 A F E -LM 51 79B 0 -19,-2.5 -19,-2.8 -2,-0.5 2,-0.4 -0.845 23.1-136.9-130.3 167.4 -5.2 -28.5 19.8 71 363 A K E -LM 50 78B 62 7,-3.1 7,-2.4 -2,-0.3 2,-0.4 -0.986 3.7-155.2-133.2 122.7 -6.6 -32.0 20.0 72 364 A V E +LM 49 77B 3 -23,-3.3 -23,-1.8 -2,-0.4 2,-0.3 -0.845 27.8 158.0 -95.2 132.3 -10.1 -33.2 20.9 73 365 A E E > - M 0 76B 82 3,-2.4 3,-1.6 -2,-0.4 -2,-0.1 -0.857 62.4 -16.0-161.6 118.3 -10.2 -36.7 22.3 74 366 A A T 3 S- 0 0 79 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.912 125.0 -51.0 51.7 50.4 -12.8 -38.5 24.5 75 367 A G T 3 S+ 0 0 43 1,-0.2 2,-0.3 -73,-0.0 -1,-0.3 0.367 119.8 99.3 76.9 -5.8 -14.6 -35.3 25.6 76 368 A K E < -M 73 0B 110 -3,-1.6 -3,-2.4 -74,-0.1 2,-0.4 -0.751 63.4-135.5-110.6 159.5 -11.4 -33.6 26.7 77 369 A V E -M 72 0B 0 -2,-0.3 8,-2.6 -5,-0.2 2,-0.4 -0.923 16.6-170.6-114.0 140.6 -9.2 -31.0 25.0 78 370 A Y E -MN 71 84B 37 -7,-2.4 -7,-3.1 -2,-0.4 2,-0.3 -0.974 13.6-141.7-125.7 142.6 -5.4 -31.0 24.8 79 371 A T E MN 70 83B 25 4,-2.2 4,-2.3 -2,-0.4 -9,-0.2 -0.782 360.0 360.0 -96.3 149.9 -3.0 -28.3 23.5 80 372 A I 0 0 122 -11,-2.1 -1,-0.2 -2,-0.3 -10,-0.1 0.760 360.0 360.0-106.1 360.0 0.1 -29.2 21.5 81 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 82 377 A Q 0 0 122 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 106.2 0.4 -32.9 24.4 83 378 A I E -N 79 0B 104 -4,-2.3 -4,-2.2 0, 0.0 2,-0.1 -0.917 360.0 -93.3-122.6 153.1 -0.8 -31.3 27.7 84 379 A E E -N 78 0B 93 -2,-0.3 -6,-0.3 -6,-0.2 -8,-0.0 -0.415 59.4 -85.6 -65.4 140.2 -4.4 -31.1 29.1 85 380 A N - 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