==== 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 24-AUG-09 3IS0 . 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 . 392 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18809.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 272 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 157 40.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 51 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.8 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 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 RESIDUES PER ALPHA HELIX . 3 1 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 0 PARALLEL BRIDGES PER LADDER . 3 4 3 2 6 1 1 3 1 1 1 0 0 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 0 155 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -55.0 29.9 24.9 -8.3 2 393 X Q - 0 0 105 1,-0.1 3,-0.1 4,-0.0 51,-0.1 -0.766 360.0-147.4-109.2 147.7 32.3 25.5 -5.4 3 394 X S S S- 0 0 78 -2,-0.3 2,-0.3 49,-0.3 50,-0.2 0.546 83.6 -27.1 -81.8 -10.5 32.6 28.2 -2.7 4 395 X G S S- 0 0 24 48,-0.1 49,-0.2 50,-0.0 2,-0.2 -0.954 86.8 -48.0-177.0-168.0 36.4 27.9 -2.8 5 396 X R - 0 0 125 -2,-0.3 49,-2.6 45,-0.1 2,-0.7 -0.511 49.3-106.0 -84.8 153.9 39.3 25.7 -3.5 6 397 X N B -a 54 0A 67 47,-0.2 3,-0.3 -2,-0.2 49,-0.2 -0.716 40.4-179.1 -71.6 111.5 40.1 22.1 -2.4 7 398 X V > + 0 0 0 47,-3.1 3,-2.0 -2,-0.7 4,-0.4 -0.043 37.3 126.7-110.4 31.9 42.8 22.9 0.2 8 399 X N G > S+ 0 0 20 46,-0.3 3,-1.3 1,-0.3 -1,-0.2 0.884 74.7 57.0 -50.3 -40.5 43.6 19.4 1.2 9 400 X H G 3 S+ 0 0 118 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.615 106.7 48.8 -71.5 -9.6 47.2 20.2 0.5 10 401 X L G < S+ 0 0 21 -3,-2.0 36,-2.6 36,-0.1 2,-0.6 0.285 93.8 82.0-112.1 2.8 47.1 23.2 3.0 11 402 X V E < -H 45 0B 1 -3,-1.3 2,-0.7 -4,-0.4 34,-0.2 -0.955 66.5-158.1-114.7 112.2 45.5 21.3 5.9 12 403 X F E +H 44 0B 96 32,-2.2 32,-2.0 -2,-0.6 2,-0.3 -0.829 22.6 175.3 -98.9 112.9 48.2 19.4 7.8 13 404 X A E -H 43 0B 14 -2,-0.7 2,-0.4 30,-0.2 30,-0.2 -0.873 28.9-159.0-125.1 149.3 46.5 16.6 9.8 14 405 X N E -H 42 0B 120 28,-2.5 28,-2.4 -2,-0.3 2,-0.3 -0.996 21.8-162.2-123.3 135.5 47.4 13.6 12.0 15 406 X T E +H 41 0B 22 -2,-0.4 2,-0.3 26,-0.2 26,-0.2 -0.886 13.3 170.4-121.8 142.8 44.8 10.9 12.3 16 407 X S E -H 40 0B 43 24,-2.0 24,-2.9 -2,-0.3 2,-0.3 -0.979 21.6-134.2-145.4 161.0 44.3 8.0 14.9 17 408 X Y E -H 39 0B 22 -2,-0.3 2,-0.4 22,-0.2 22,-0.2 -0.854 12.6-168.6-112.9 149.3 41.6 5.5 15.7 18 409 X E E -H 38 0B 63 20,-2.4 20,-3.1 -2,-0.3 2,-0.4 -0.977 17.5-137.5-136.6 124.5 40.2 4.5 19.1 19 410 X I E -H 37 0B 31 -2,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.688 25.7-169.9 -78.0 128.9 38.0 1.5 19.7 20 411 X L E +H 36 0B 32 16,-2.6 16,-1.3 -2,-0.4 10,-0.4 -0.795 36.8 33.7-113.2 160.3 35.1 2.2 22.0 21 412 X G S > S- 0 0 21 -2,-0.3 3,-1.9 14,-0.2 4,-0.3 -0.412 104.3 -27.6 97.3-167.4 32.6 -0.1 23.8 22 413 X G T 3 S+ 0 0 28 11,-3.1 3,-0.3 8,-0.3 -1,-0.2 0.603 129.1 53.6 -67.5 -16.5 32.5 -3.6 25.2 23 414 X G T > >S+ 0 0 0 -3,-0.3 3,-2.2 10,-0.2 5,-1.8 0.441 75.4 101.9 -95.2 -0.7 35.2 -5.0 23.0 24 415 X K G X 5S+ 0 0 116 -3,-1.9 3,-1.3 1,-0.3 -1,-0.2 0.868 81.2 50.7 -58.5 -37.0 37.8 -2.4 23.8 25 416 X K G 3 5S+ 0 0 144 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.577 113.0 48.1 -75.5 -8.2 39.7 -4.7 26.2 26 417 X Y G < 5S- 0 0 133 -3,-2.2 -1,-0.3 2,-0.3 -2,-0.2 0.249 115.3-115.0-109.6 8.2 39.7 -7.4 23.5 27 418 X N T < 5S+ 0 0 108 -3,-1.3 122,-0.5 -4,-0.3 2,-0.3 0.875 79.4 113.1 60.4 38.7 41.0 -5.0 20.8 28 419 X Q S > -b 151 0A 35 -2,-0.9 3,-2.1 -10,-0.4 5,-2.1 -0.761 6.9-164.8 -87.3 97.3 31.9 -5.3 19.6 31 422 X M T 3 5S+ 0 0 6 120,-2.3 3,-0.3 -2,-1.1 121,-0.2 0.679 85.2 41.7 -64.5 -20.5 29.0 -4.2 17.4 32 423 X T T 3 5S+ 0 0 61 119,-0.5 -1,-0.3 1,-0.2 261,-0.2 0.240 108.0 61.8-107.5 13.1 26.3 -5.4 19.7 33 424 X M T < 5S- 0 0 100 -3,-2.1 -11,-3.1 0, 0.0 -10,-0.2 -0.362 128.5 -79.6-132.3 50.7 28.0 -4.1 22.9 34 425 X D T 5S+ 0 0 123 -3,-0.3 -3,-0.2 -13,-0.2 2,-0.1 0.687 79.5 162.6 61.9 21.6 28.1 -0.3 22.2 35 426 X G < + 0 0 1 -5,-2.1 2,-0.3 -14,-0.2 -14,-0.2 -0.429 2.6 150.1 -72.4 142.4 31.2 -0.8 20.0 36 427 X K E -H 20 0B 29 -16,-1.3 -16,-2.6 -2,-0.1 2,-0.6 -0.949 43.6-113.3-159.3 168.0 32.2 1.9 17.6 37 428 X L E -HI 19 119B 1 82,-2.4 82,-1.6 -2,-0.3 2,-0.5 -0.945 25.9-154.1-111.0 116.2 35.3 3.3 16.0 38 429 X K E -HI 18 118B 57 -20,-3.1 -20,-2.4 -2,-0.6 2,-0.5 -0.773 3.9-156.1 -89.8 133.6 36.3 6.8 17.0 39 430 X I E -HI 17 117B 1 78,-2.9 78,-2.2 -2,-0.5 2,-0.5 -0.944 8.2-164.3-110.7 125.0 38.4 8.8 14.5 40 431 X K E -HI 16 116B 69 -24,-2.9 -24,-2.0 -2,-0.5 2,-0.5 -0.952 5.5-172.9-117.8 124.1 40.5 11.6 16.0 41 432 X I E -HI 15 115B 2 74,-3.0 74,-2.6 -2,-0.5 2,-0.4 -0.975 8.3-171.3-126.8 121.1 42.0 14.3 13.8 42 433 X D E +HI 14 114B 84 -28,-2.4 -28,-2.5 -2,-0.5 2,-0.3 -0.930 23.5 171.9-105.7 135.0 44.4 17.0 14.9 43 434 X Y E -HI 13 113B 5 70,-2.6 70,-2.3 -2,-0.4 2,-0.3 -0.959 30.5-156.7-144.9 157.6 45.1 19.6 12.3 44 435 X T E -HI 12 112B 45 -32,-2.0 -32,-2.2 -2,-0.3 2,-0.4 -0.954 21.1-142.3-128.2 151.0 46.7 22.9 11.4 45 436 X V E -H 11 0B 7 66,-2.8 66,-0.3 -2,-0.3 -34,-0.2 -0.951 19.3-116.0-118.5 132.3 45.5 25.2 8.6 46 437 X D > - 0 0 60 -36,-2.6 3,-1.9 -2,-0.4 -36,-0.1 -0.320 23.8-122.7 -62.6 144.7 47.8 27.2 6.3 47 438 X D T 3 S+ 0 0 84 1,-0.3 -1,-0.1 -2,-0.0 -37,-0.0 0.715 107.5 68.0 -62.1 -17.7 47.4 31.0 6.5 48 439 X S T 3 S+ 0 0 61 -38,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.572 74.9 105.3 -81.7 -9.8 46.6 31.2 2.8 49 440 X V < - 0 0 1 -3,-1.9 2,-0.2 -39,-0.2 3,-0.0 -0.517 55.4-167.1 -68.6 136.6 43.3 29.3 3.2 50 441 X V > - 0 0 65 -2,-0.2 3,-2.0 1,-0.1 51,-0.2 -0.774 33.3 -65.6-121.2 169.4 40.3 31.6 2.9 51 442 X E T 3 S+ 0 0 54 -2,-0.2 51,-0.2 1,-0.2 52,-0.1 -0.285 120.9 25.3 -53.1 133.4 36.5 31.5 3.6 52 443 X G T 3 S+ 0 0 10 49,-2.9 -49,-0.3 1,-0.4 -1,-0.2 0.095 90.1 120.5 92.6 -20.5 34.8 29.0 1.3 53 444 X D < - 0 0 4 -3,-2.0 48,-2.7 -49,-0.2 -1,-0.4 -0.340 47.2-163.0 -61.6 161.7 37.9 26.8 0.8 54 445 X Y E -aC 6 100A 29 -49,-2.6 -47,-3.1 46,-0.3 2,-0.3 -0.984 20.7-155.6-150.1 152.0 37.4 23.2 1.9 55 446 X F E - C 0 99A 1 44,-2.2 44,-3.1 -2,-0.3 2,-0.3 -0.846 22.0-139.0-119.7 169.2 39.1 20.0 2.9 56 447 X T E - C 0 98A 25 -2,-0.3 84,-2.6 42,-0.2 2,-0.4 -0.879 13.8-155.4-129.0 156.5 37.7 16.5 2.7 57 448 X V E -DC 139 97A 0 40,-2.3 40,-3.1 -2,-0.3 2,-0.6 -0.977 15.6-160.6-127.2 116.2 37.7 13.2 4.7 58 449 X D E -DC 138 96A 60 80,-2.7 80,-2.3 -2,-0.4 38,-0.2 -0.883 5.4-156.6 -97.7 118.8 37.0 10.2 2.4 59 450 X F > - 0 0 1 36,-2.7 4,-0.8 -2,-0.6 3,-0.4 0.490 30.3-147.3 -83.3 2.0 35.8 7.4 4.7 60 451 X G T 4 - 0 0 25 35,-0.3 -1,-0.2 34,-0.2 77,-0.1 -0.308 39.3 -43.2 79.3-153.2 36.9 4.7 2.1 61 452 X K T 4 S+ 0 0 152 75,-0.3 -1,-0.2 1,-0.1 61,-0.1 0.745 125.4 41.4 -86.4 -29.7 35.2 1.3 1.4 62 453 X Y T 4 S+ 0 0 60 -3,-0.4 60,-2.4 74,-0.3 2,-0.3 0.683 104.4 37.2-107.4 -22.3 34.5 -0.0 4.9 63 454 X I E < -J 121 0B 0 -4,-0.8 56,-0.0 58,-0.3 -1,-0.0 -0.886 49.8-160.0-134.3 162.3 33.1 2.6 7.3 64 455 X H E -J 120 0B 2 56,-2.4 56,-1.8 -2,-0.3 2,-0.0 -0.951 35.9 -96.7-134.9 155.6 30.8 5.7 7.5 65 456 X P E S+J 119 0B 0 0, 0.0 54,-0.3 0, 0.0 9,-0.1 -0.398 93.2 34.8 -66.8 157.1 30.5 8.5 10.0 66 457 X G S S- 0 0 4 52,-2.7 54,-0.4 6,-0.1 -2,-0.3 -0.102 75.5-127.3 78.3 172.0 27.8 7.9 12.6 67 458 X T S S- 0 0 9 2,-0.2 53,-0.1 52,-0.1 5,-0.1 0.375 70.9 -14.3-122.0-104.3 26.8 4.6 14.1 68 459 X S S S+ 0 0 10 97,-0.1 98,-3.1 2,-0.0 2,-0.5 0.544 109.2 83.6 -89.2 -10.7 23.3 3.0 14.2 69 460 X R B S-k 166 0C 26 96,-0.2 -2,-0.2 2,-0.1 98,-0.2 -0.866 74.6-112.9-109.1 127.5 21.2 6.0 13.4 70 461 X K S S+ 0 0 73 96,-3.1 98,-0.4 -2,-0.5 2,-0.1 -0.756 84.0 45.6-104.7 152.4 20.4 7.3 9.9 71 462 X P S S- 0 0 71 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.500 83.4-134.1 -79.8 150.0 20.9 9.5 8.0 72 463 X Y + 0 0 49 -2,-0.1 2,-0.3 -6,-0.1 -6,-0.1 -0.370 32.4 171.4 -70.3 147.6 24.6 9.7 8.7 73 464 X R - 0 0 27 -2,-0.1 2,-0.3 16,-0.1 16,-0.1 -0.935 25.8-137.9-148.0 163.1 26.1 13.2 9.3 74 465 X V - 0 0 13 -2,-0.3 2,-0.3 14,-0.2 16,-0.1 -0.781 26.1-120.7-117.3 171.1 29.2 15.0 10.3 75 466 X N - 0 0 98 -2,-0.3 14,-0.1 14,-0.1 2,-0.0 -0.746 25.1-101.3-109.9 158.1 29.5 18.0 12.6 76 467 X N - 0 0 30 -2,-0.3 2,-0.4 12,-0.1 11,-0.2 -0.350 40.8-121.7 -66.4 160.2 30.9 21.4 12.2 77 468 X I E -E 86 0A 4 9,-2.8 8,-2.8 38,-0.1 9,-1.7 -0.917 32.1-173.2-114.5 136.9 34.3 21.9 13.7 78 469 X H E -E 84 0A 83 -2,-0.4 36,-0.4 36,-0.3 6,-0.2 -0.790 20.7-117.9-126.3 164.4 35.0 24.6 16.3 79 470 X D > - 0 0 29 4,-2.2 3,-1.9 -2,-0.3 34,-0.1 -0.248 53.0 -78.9 -89.1-172.1 37.8 26.2 18.2 80 471 X A T 3 S+ 0 0 105 1,-0.3 -1,-0.0 2,-0.1 33,-0.0 0.666 132.1 47.8 -64.8 -21.1 38.3 26.1 22.1 81 472 X N T 3 S- 0 0 137 2,-0.1 -1,-0.3 248,-0.0 0, 0.0 0.215 122.0-102.1-105.6 11.6 35.7 28.9 22.5 82 473 X G S < S+ 0 0 36 -3,-1.9 247,-0.2 1,-0.3 2,-0.2 0.520 70.2 149.3 84.1 6.0 33.0 27.3 20.2 83 474 X R - 0 0 46 1,-0.1 -4,-2.2 246,-0.1 2,-0.5 -0.529 54.2-110.9 -71.1 138.2 33.7 29.6 17.2 84 475 X T E +E 78 0A 3 -6,-0.2 20,-0.4 -2,-0.2 -6,-0.3 -0.604 37.4 175.0 -81.5 119.8 33.0 27.7 14.0 85 476 X I E S+ 0 0 0 -8,-2.8 17,-2.0 -2,-0.5 2,-0.3 0.862 70.2 1.1 -86.4 -43.3 36.2 26.9 12.0 86 477 X A E -EF 77 101A 0 -9,-1.7 -9,-2.8 15,-0.3 2,-0.5 -0.997 66.4-123.5-149.1 145.1 34.5 24.8 9.3 87 478 X I E - 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