==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 24-AUG-09 3IRP . COMPND 2 MOLECULE: URO-ADHERENCE FACTOR A; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS SAPROPHYTICUS SUBSP. . AUTHOR Y.TANAKA,Y.SHOUJI,E.MATSUOKA,M.KURODA,I.TANAKA,M.YAO . 418 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19444.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 287 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 160 38.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 55 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 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 0 0 RESIDUES PER ALPHA HELIX . 2 1 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 PARALLEL BRIDGES PER LADDER . 3 3 4 2 4 4 1 2 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 2 2 1 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 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 1 392 X A 0 0 109 0, 0.0 2,-0.4 0, 0.0 345,-0.1 0.000 360.0 360.0 360.0 146.0 -12.1 -13.5 14.6 2 393 X Q - 0 0 73 343,-0.2 2,-0.1 1,-0.0 50,-0.1 -0.547 360.0-141.5 -67.1 120.6 -13.1 -14.7 18.1 3 394 X S + 0 0 100 -2,-0.4 2,-0.3 48,-0.1 50,-0.1 -0.421 34.9 143.7 -75.6 159.2 -15.9 -12.5 19.6 4 395 X G - 0 0 41 -2,-0.1 2,-0.3 96,-0.0 49,-0.2 -0.968 37.5-107.1-178.2 175.1 -15.9 -11.6 23.2 5 396 X R - 0 0 126 -2,-0.3 49,-2.2 45,-0.1 2,-0.5 -0.796 37.2 -93.4-117.1 162.0 -16.7 -8.9 25.8 6 397 X N B +a 54 0A 64 -2,-0.3 3,-0.2 47,-0.2 49,-0.2 -0.625 39.7 179.9 -66.4 117.8 -14.8 -6.4 27.9 7 398 X V >> + 0 0 0 47,-3.2 3,-2.2 -2,-0.5 4,-0.7 -0.065 37.2 127.3-117.0 32.5 -14.4 -8.2 31.3 8 399 X N G >4 S+ 0 0 26 46,-0.3 3,-0.8 1,-0.3 -1,-0.2 0.856 75.5 59.7 -48.9 -35.8 -12.5 -5.6 33.2 9 400 X H G 34 S+ 0 0 129 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.603 107.8 44.1 -72.2 -10.1 -15.3 -6.1 35.8 10 401 X L G <4 S+ 0 0 37 -3,-2.2 36,-2.5 36,-0.1 2,-0.5 0.354 103.4 71.2-113.3 -0.5 -14.4 -9.8 36.2 11 402 X V E << -H 45 0B 2 -3,-0.8 2,-0.5 -4,-0.7 34,-0.2 -0.984 67.2-158.2-118.8 124.9 -10.6 -9.4 36.3 12 403 X F E -H 44 0B 103 32,-1.7 32,-1.6 -2,-0.5 2,-0.4 -0.932 10.4-165.6-108.4 127.8 -9.1 -7.8 39.4 13 404 X A E -H 43 0B 4 -2,-0.5 2,-0.5 126,-0.4 30,-0.2 -0.934 15.5-166.5-118.9 131.8 -5.6 -6.3 39.2 14 405 X N E -H 42 0B 100 28,-2.9 28,-2.8 -2,-0.4 2,-0.4 -0.972 23.7-167.6-107.7 126.8 -3.1 -5.2 41.8 15 406 X T E +H 41 0B 18 -2,-0.5 2,-0.3 26,-0.2 26,-0.2 -0.902 16.2 168.1-122.7 139.7 -0.4 -3.0 40.3 16 407 X S E -H 40 0B 49 24,-2.2 24,-3.0 -2,-0.4 2,-0.3 -0.952 22.9-132.0-138.5 164.1 3.0 -1.7 41.4 17 408 X Y E -H 39 0B 21 -2,-0.3 2,-0.4 22,-0.2 22,-0.2 -0.874 11.9-167.7-112.7 152.7 6.0 -0.0 39.8 18 409 X E E -H 38 0B 44 20,-2.4 20,-3.0 -2,-0.3 2,-0.5 -0.980 18.6-136.8-137.3 124.3 9.7 -0.7 39.9 19 410 X I E -H 37 0B 15 -2,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.680 24.6-160.1 -79.0 127.1 12.3 1.6 38.6 20 411 X L E +H 36 0B 43 16,-2.7 16,-1.1 -2,-0.5 10,-0.4 -0.782 41.6 28.8-104.4 153.4 15.1 -0.2 36.7 21 412 X G S > S- 0 0 27 -2,-0.3 3,-2.0 14,-0.2 4,-0.3 -0.388 104.0 -32.4 101.3-172.5 18.6 0.9 35.9 22 413 X G T 3 S+ 0 0 27 1,-0.3 3,-0.3 8,-0.2 -1,-0.2 0.619 126.9 57.8 -63.9 -17.5 21.3 3.2 37.3 23 414 X G T > >S+ 0 0 0 -3,-0.3 5,-2.3 5,-0.2 3,-1.9 0.438 74.4 98.5 -92.4 -0.2 18.9 5.7 38.8 24 415 X K G X 5S+ 0 0 110 -3,-2.0 3,-2.0 1,-0.3 -1,-0.2 0.905 80.5 54.7 -54.6 -43.8 17.1 3.2 41.0 25 416 X K G 3 5S+ 0 0 171 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.623 113.5 43.3 -65.9 -13.5 19.2 4.2 44.1 26 417 X Y G < 5S- 0 0 139 -3,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.194 114.9-116.2-111.0 10.7 18.1 7.8 43.4 27 418 X N T < 5S+ 0 0 108 -3,-2.0 122,-0.6 1,-0.2 2,-0.4 0.879 77.5 121.3 53.2 41.2 14.4 6.8 42.7 28 419 X Q E < -b 149 0A 29 -5,-2.3 2,-0.8 120,-0.1 -2,-0.2 -0.988 68.7-125.0-134.2 144.7 14.8 8.1 39.1 29 420 X V E -b 150 0A 0 120,-2.8 122,-2.5 -2,-0.4 2,-1.3 -0.819 25.4-150.4 -85.5 109.1 14.4 6.6 35.7 30 421 X F E > > -b 151 0A 38 -2,-0.8 5,-2.6 -10,-0.4 3,-1.5 -0.702 14.2-171.8 -86.5 93.3 17.8 7.3 34.1 31 422 X M T 3 5S+ 0 0 8 120,-2.0 121,-0.2 -2,-1.3 -1,-0.2 0.623 77.7 44.1 -66.6 -22.0 16.6 7.5 30.5 32 423 X T T 3 5S+ 0 0 62 119,-0.6 -1,-0.3 -3,-0.1 120,-0.1 0.244 116.8 45.3-111.5 12.3 20.0 7.7 28.8 33 424 X M T < 5S- 0 0 126 -3,-1.5 -2,-0.1 2,-0.0 -12,-0.1 0.467 129.2 -57.1-106.3 -98.6 21.7 5.0 30.8 34 425 X D T 5S+ 0 0 81 -4,-0.3 -3,-0.2 -14,-0.1 2,-0.1 0.051 85.4 142.3-136.7 19.8 19.6 1.8 31.3 35 426 X G < + 0 0 2 -5,-2.6 2,-0.3 116,-0.1 -14,-0.2 -0.379 11.0 144.2 -76.8 143.7 16.5 3.2 32.9 36 427 X K E -H 20 0B 53 -16,-1.1 -16,-2.7 -2,-0.1 2,-0.6 -0.948 46.6-108.0-160.7 167.9 12.9 2.1 32.4 37 428 X L E -HI 19 119B 1 82,-2.4 82,-1.7 -2,-0.3 2,-0.5 -0.920 28.0-153.0-105.8 115.8 9.7 1.8 34.4 38 429 X K E -HI 18 118B 59 -20,-3.0 -20,-2.4 -2,-0.6 2,-0.5 -0.769 4.4-155.9 -88.7 129.0 8.7 -1.8 35.2 39 430 X I E -HI 17 117B 0 78,-2.9 78,-2.1 -2,-0.5 2,-0.5 -0.931 7.8-162.3-106.4 123.7 5.0 -2.3 35.7 40 431 X K E -HI 16 116B 75 -24,-3.0 -24,-2.2 -2,-0.5 2,-0.5 -0.934 7.4-170.7-114.8 123.0 4.1 -5.4 37.8 41 432 X I E -HI 15 115B 1 74,-3.1 74,-2.5 -2,-0.5 2,-0.5 -0.965 14.6-169.1-123.2 124.6 0.6 -6.8 37.7 42 433 X D E -HI 14 114B 88 -28,-2.8 -28,-2.9 -2,-0.5 2,-0.3 -0.955 25.6-178.1-103.1 129.6 -1.0 -9.5 39.9 43 434 X Y E -HI 13 113B 8 70,-2.8 70,-2.3 -2,-0.5 2,-0.3 -0.917 22.7-161.8-134.1 152.9 -4.4 -10.5 38.4 44 435 X T E -HI 12 112B 47 -32,-1.6 -32,-1.7 -2,-0.3 2,-0.4 -0.958 11.4-154.4-128.8 149.5 -7.4 -12.8 39.1 45 436 X V E -H 11 0B 7 66,-2.6 66,-0.5 -2,-0.3 -34,-0.2 -0.988 18.2-124.0-129.6 123.2 -10.0 -13.9 36.6 46 437 X D > - 0 0 81 -36,-2.5 3,-1.9 -2,-0.4 -36,-0.1 -0.331 24.0-119.3 -63.6 149.8 -13.5 -15.0 37.4 47 438 X D T 3 S+ 0 0 98 1,-0.3 -1,-0.1 63,-0.0 -37,-0.0 0.723 109.3 69.5 -62.0 -22.9 -14.6 -18.4 36.2 48 439 X S T 3 S+ 0 0 58 -38,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.558 74.9 105.4 -75.3 -8.8 -17.4 -16.8 34.1 49 440 X V < - 0 0 0 -3,-1.9 2,-0.3 -39,-0.1 3,-0.0 -0.546 56.3-167.2 -71.2 136.7 -14.8 -15.3 31.8 50 441 X V > - 0 0 66 -2,-0.2 3,-2.3 -45,-0.1 51,-0.2 -0.778 33.0 -65.9-124.2 167.0 -14.7 -17.2 28.4 51 442 X E T 3 S+ 0 0 24 1,-0.3 51,-0.2 -2,-0.3 52,-0.1 -0.261 121.5 25.6 -50.3 128.8 -12.4 -17.5 25.4 52 443 X G T 3 S+ 0 0 2 49,-2.7 -1,-0.3 1,-0.5 50,-0.1 0.055 90.2 118.6 100.3 -26.2 -12.5 -14.2 23.5 53 444 X D < - 0 0 4 -3,-2.3 48,-2.7 -49,-0.2 -1,-0.5 -0.342 47.0-167.5 -62.8 159.5 -13.3 -12.0 26.5 54 445 X Y E -aC 6 100A 58 -49,-2.2 -47,-3.2 46,-0.3 2,-0.3 -0.986 22.3-147.3-149.9 155.3 -10.6 -9.4 27.3 55 446 X F E - C 0 99A 1 44,-2.1 44,-3.1 -2,-0.3 2,-0.3 -0.806 22.5-139.0-116.4 166.1 -9.3 -6.9 29.7 56 447 X T E - C 0 98A 28 -2,-0.3 84,-2.8 42,-0.2 2,-0.4 -0.878 8.4-151.4-123.8 156.5 -7.6 -3.7 29.0 57 448 X V E -DC 139 97A 0 40,-2.5 40,-2.7 -2,-0.3 2,-0.7 -0.982 12.3-159.3-124.5 117.3 -4.6 -1.7 30.3 58 449 X D E -DC 138 96A 63 80,-2.5 80,-2.4 -2,-0.4 38,-0.2 -0.878 1.7-163.0 -96.2 112.8 -4.9 2.1 29.8 59 450 X F > - 0 0 1 36,-2.5 4,-0.8 -2,-0.7 3,-0.4 0.503 30.0-155.8 -79.8 -2.6 -1.4 3.5 30.0 60 451 X G T 4 - 0 0 26 35,-0.3 -1,-0.2 34,-0.3 77,-0.1 -0.278 39.2 -32.8 73.6-148.0 -2.8 7.0 30.5 61 452 X K T 4 S+ 0 0 125 75,-0.4 -1,-0.2 73,-0.2 74,-0.1 0.804 125.6 34.3 -85.0 -32.7 -1.2 10.3 29.8 62 453 X Y T 4 S+ 0 0 42 -3,-0.4 60,-2.4 74,-0.3 2,-0.3 0.631 105.7 42.5-111.0 -20.9 2.6 9.9 30.4 63 454 X I E < -J 121 0B 0 -4,-0.8 -4,-0.0 58,-0.3 56,-0.0 -0.882 48.8-162.9-131.2 162.1 3.9 6.5 29.5 64 455 X H E -J 120 0B 3 56,-2.4 56,-2.0 -2,-0.3 2,-0.0 -0.953 36.4 -95.9-134.0 156.9 3.6 3.8 26.8 65 456 X P E S+J 119 0B 1 0, 0.0 54,-0.3 0, 0.0 9,-0.1 -0.384 89.9 26.2 -69.2 155.1 4.6 0.1 26.9 66 457 X G S S- 0 0 20 52,-2.9 -2,-0.2 6,-0.1 54,-0.2 -0.233 75.9-118.1 83.1-177.0 8.0 -0.7 25.5 67 458 X T S S- 0 0 45 2,-0.2 53,-0.1 52,-0.1 -31,-0.0 0.331 74.0 -9.2-126.8-103.8 11.0 1.5 25.2 68 459 X S S S+ 0 0 9 97,-0.1 98,-2.5 2,-0.0 2,-0.4 0.819 104.4 84.1 -80.9 -34.7 13.0 2.7 22.2 69 460 X R B S-k 166 0C 61 96,-0.2 98,-0.2 2,-0.0 -2,-0.2 -0.603 73.0-126.6 -81.0 127.8 11.4 0.7 19.3 70 461 X K S S+ 0 0 81 96,-2.8 98,-0.4 -2,-0.4 2,-0.2 -0.851 84.6 51.8-111.1 152.9 8.2 2.0 17.7 71 462 X P S S- 0 0 94 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 0.600 91.6-132.5 -62.7 151.6 5.5 0.9 17.0 72 463 X Y - 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