==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (MOLECULAR CHAPERONE/PEPTIDE) 03-JUN-96 1DKY . COMPND 2 MOLECULE: DNAK; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR X.ZHU,X.ZHAO,W.F.BURKHOLDER,A.GRAGEROV,C.M.OGATA, . 422 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20429.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 78.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 21.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.9 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-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 . 45 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 31.8 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 1 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 3 0 2 2 0 2 6 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 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 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 1 389 A V 0 0 144 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -32.8 29.6 62.5 -2.2 2 390 A L + 0 0 178 1,-0.4 2,-0.3 0, 0.0 0, 0.0 0.624 360.0 13.4-109.2 -26.0 29.1 64.7 0.9 3 391 A L - 0 0 140 2,-0.0 2,-0.4 0, 0.0 -1,-0.4 -0.989 57.8-162.8-150.9 149.1 29.2 61.9 3.5 4 392 A L - 0 0 121 -2,-0.3 2,-0.6 -3,-0.1 0, 0.0 -0.998 21.6-135.6-133.3 125.0 30.2 58.2 3.6 5 393 A D + 0 0 93 -2,-0.4 25,-1.2 25,-0.1 2,-0.3 -0.731 42.5 174.3 -80.7 122.8 29.1 56.0 6.4 6 394 A V B -A 29 0A 48 -2,-0.6 23,-0.3 23,-0.3 20,-0.1 -0.960 38.3 -98.6-134.1 158.8 32.4 54.1 7.2 7 395 A T - 0 0 9 21,-3.1 20,-2.5 -2,-0.3 21,-0.2 -0.562 25.7-158.0 -76.5 123.8 33.8 51.6 9.7 8 396 A P S S+ 0 0 55 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.834 75.2 15.5 -69.1 -35.3 35.8 53.4 12.4 9 397 A L S S- 0 0 0 17,-0.1 19,-0.2 16,-0.1 18,-0.1 -0.911 93.2 -86.4-135.9 162.6 37.9 50.4 13.4 10 398 A S - 0 0 10 -2,-0.3 45,-2.4 45,-0.2 2,-0.4 -0.322 34.9-150.2 -71.8 151.1 38.7 47.0 11.9 11 399 A L E +BC 24 54B 12 13,-2.9 13,-2.8 43,-0.2 12,-2.6 -0.992 35.0 123.4-124.5 129.6 36.4 44.1 12.4 12 400 A G E -BC 22 53B 0 41,-2.6 41,-2.7 -2,-0.4 2,-0.3 -0.795 49.2 -88.7-159.6-161.3 37.6 40.5 12.5 13 401 A I E -BC 21 52B 0 8,-3.3 8,-3.5 -2,-0.2 2,-0.4 -0.917 34.6-108.4-128.8 154.4 37.9 37.2 14.4 14 402 A E E -B 20 0B 68 37,-1.4 37,-0.4 -2,-0.3 6,-0.3 -0.666 43.1-179.4 -79.2 133.7 40.3 35.8 16.9 15 403 A T > - 0 0 13 4,-1.2 3,-1.7 -2,-0.4 4,-0.4 -0.611 38.6 -43.5-123.9-176.0 42.4 33.0 15.5 16 404 A M T 3 S+ 0 0 33 402,-2.4 3,-0.4 1,-0.2 -1,-0.2 -0.170 119.5 36.0 -51.8 136.0 45.1 30.6 16.7 17 405 A G T 3 S- 0 0 21 1,-0.2 -1,-0.2 -3,-0.1 3,-0.1 0.036 122.7 -83.4 107.6 -21.0 47.9 32.2 18.7 18 406 A G S < S+ 0 0 24 -3,-1.7 42,-2.5 1,-0.2 43,-0.6 0.467 97.3 129.4 95.7 7.6 45.7 34.7 20.5 19 407 A V B -E 59 0C 30 -4,-0.4 -4,-1.2 -3,-0.4 2,-0.4 -0.087 55.9-123.1 -83.0-177.8 46.0 36.9 17.4 20 408 A M E -B 14 0B 16 38,-0.5 2,-0.6 -6,-0.3 -6,-0.3 -0.937 9.4-146.5-138.1 119.8 43.1 38.5 15.6 21 409 A T E -B 13 0B 28 -8,-3.5 -8,-3.3 -2,-0.4 2,-0.4 -0.733 17.7-138.8 -89.4 122.2 42.2 38.1 11.9 22 410 A T E +B 12 0B 58 -2,-0.6 -10,-0.3 -10,-0.3 3,-0.2 -0.653 25.8 172.2 -78.8 122.5 40.6 41.2 10.3 23 411 A L E S+ 0 0 12 -12,-2.6 2,-0.5 -2,-0.4 -11,-0.2 0.717 79.0 29.8-100.1 -33.9 37.7 40.5 7.9 24 412 A I E S-B 11 0B 0 -13,-2.8 -13,-2.9 10,-0.0 -1,-0.3 -0.934 89.3-142.9-127.3 103.9 36.6 44.1 7.3 25 413 A A > - 0 0 51 -2,-0.5 3,-0.5 -15,-0.2 -18,-0.2 -0.252 33.5 -72.2 -66.6 157.9 39.5 46.5 7.6 26 414 A K T 3 S+ 0 0 63 1,-0.2 -1,-0.1 29,-0.1 -16,-0.1 -0.163 112.3 16.2 -53.7 137.9 39.3 50.0 9.1 27 415 A N T 3 S+ 0 0 106 -20,-2.5 2,-0.4 1,-0.3 -1,-0.2 0.843 81.2 155.2 65.6 39.5 37.6 52.8 7.3 28 416 A T < - 0 0 32 -3,-0.5 -21,-3.1 -19,-0.2 2,-0.6 -0.758 54.4-107.5 -93.1 140.1 35.7 50.6 4.9 29 417 A T B -A 6 0A 68 -2,-0.4 -23,-0.3 -23,-0.3 -1,-0.0 -0.619 42.3-118.6 -69.8 114.1 32.5 52.1 3.6 30 418 A I S S+ 0 0 9 -25,-1.2 61,-0.1 -2,-0.6 -25,-0.1 -0.814 94.6 75.9 -89.2 120.4 29.7 50.2 5.3 31 419 A P S S+ 0 0 93 0, 0.0 2,-0.3 0, 0.0 60,-0.2 -0.383 78.6 127.2 -34.9 85.5 27.5 48.3 3.1 32 420 A T E -F 90 0D 25 58,-1.4 58,-2.5 59,-0.1 2,-0.3 -0.910 42.1-164.7-140.3 160.7 30.3 45.7 2.7 33 421 A K E +F 89 0D 54 -2,-0.3 2,-0.4 56,-0.2 56,-0.2 -0.951 10.0 175.1-149.7 123.7 30.6 41.9 3.1 34 422 A H E -F 88 0D 53 54,-2.4 54,-2.5 -2,-0.3 2,-0.4 -0.981 5.0-173.3-131.9 143.7 33.8 39.8 3.3 35 423 A S E -F 87 0D 31 -2,-0.4 2,-0.3 52,-0.2 52,-0.2 -0.977 2.5-178.5-135.1 149.6 34.3 36.2 3.9 36 424 A Q E -F 86 0D 16 50,-1.8 50,-2.3 -2,-0.4 2,-0.4 -0.979 26.7-121.2-147.1 141.1 37.4 34.2 4.4 37 425 A V E +F 85 0D 6 -2,-0.3 48,-0.3 48,-0.2 2,-0.2 -0.774 32.7 175.4 -91.6 133.4 37.8 30.4 4.9 38 426 A F E -F 84 0D 0 46,-4.1 46,-2.6 -2,-0.4 2,-0.2 -0.587 10.3-156.3-119.3-174.9 39.4 29.1 8.1 39 427 A S E -i 418 0E 1 378,-1.6 380,-1.5 44,-0.2 2,-0.2 -0.776 28.8 -73.7-149.1-168.8 39.9 25.6 9.5 40 428 A T E -i 419 0E 0 42,-0.3 40,-0.6 378,-0.3 380,-0.2 -0.505 20.3-148.5 -96.1 165.4 40.5 23.9 12.8 41 429 A A S S+ 0 0 17 378,-1.1 2,-0.3 -2,-0.2 379,-0.1 0.756 76.9 52.5-101.0 -33.5 43.6 23.8 15.0 42 430 A E S > S- 0 0 46 377,-0.3 3,-1.4 36,-0.1 38,-0.2 -0.722 88.9 -99.3-107.5 155.3 43.3 20.3 16.6 43 431 A D T 3 S+ 0 0 114 1,-0.3 3,-0.1 -2,-0.3 -2,-0.1 -0.513 109.1 9.2 -71.3 135.6 42.8 16.8 15.2 44 432 A N T 3 S+ 0 0 58 33,-3.3 -1,-0.3 1,-0.2 2,-0.2 0.716 85.5 171.3 66.3 23.6 39.2 15.7 15.4 45 433 A Q < - 0 0 24 -3,-1.4 -1,-0.2 32,-0.5 32,-0.2 -0.502 14.4-172.0 -68.1 127.7 38.1 19.1 16.4 46 434 A S + 0 0 69 -2,-0.2 28,-3.6 1,-0.2 2,-0.3 0.605 61.3 27.2 -96.5 -21.6 34.3 19.1 16.4 47 435 A A - 0 0 25 25,-0.2 2,-0.4 26,-0.2 25,-0.3 -0.975 58.7-151.3-143.2 155.3 33.5 22.8 16.9 48 436 A V E - D 0 71B 0 23,-1.7 23,-2.8 -2,-0.3 2,-0.6 -0.966 17.0-136.4-126.2 141.4 35.0 26.2 16.3 49 437 A S E - D 0 70B 48 371,-2.2 2,-1.0 -2,-0.4 371,-0.3 -0.912 10.9-152.0-102.2 117.3 34.3 29.3 18.4 50 438 A I E - D 0 69B 1 19,-4.0 19,-2.1 -2,-0.6 2,-0.8 -0.823 14.5-171.3 -89.0 99.6 33.8 32.5 16.3 51 439 A H E - D 0 68B 52 -2,-1.0 -37,-1.4 -37,-0.4 17,-0.3 -0.852 12.8-147.0 -97.1 105.6 34.9 35.3 18.6 52 440 A V E -CD 13 67B 0 15,-2.3 14,-1.4 -2,-0.8 15,-1.0 -0.470 21.1-177.7 -74.6 138.1 34.0 38.6 17.0 53 441 A L E -CD 12 65B 1 -41,-2.7 -41,-2.6 12,-0.2 2,-0.5 -0.990 24.9-159.6-142.8 149.8 36.3 41.6 17.6 54 442 A Q E +CD 11 64B 16 10,-2.9 10,-3.7 -2,-0.3 2,-0.3 -0.988 50.6 88.0-123.4 121.6 36.6 45.3 16.8 55 443 A G - 0 0 0 -45,-2.4 -45,-0.2 -2,-0.5 8,-0.1 -0.958 66.1-119.8 168.3 174.9 40.1 46.7 17.1 56 444 A E S S+ 0 0 48 6,-0.3 7,-0.1 -2,-0.3 -1,-0.1 0.392 75.8 99.3-119.5 -4.5 43.5 47.6 15.6 57 445 A R S S- 0 0 40 5,-0.3 -37,-0.1 2,-0.2 -2,-0.1 -0.055 71.9-128.7 -77.1 179.6 45.8 45.6 17.9 58 446 A K S S+ 0 0 21 -39,-0.1 2,-0.6 1,-0.1 -38,-0.5 0.657 90.2 78.9-101.2 -26.3 47.3 42.2 17.1 59 447 A R B > S-E 19 0C 104 -40,-0.2 3,-2.2 1,-0.2 -40,-0.2 -0.768 72.7-149.0 -82.3 120.8 46.2 40.6 20.4 60 448 A A G > S+ 0 0 3 -42,-2.5 3,-0.9 -2,-0.6 -1,-0.2 0.773 100.7 64.1 -59.4 -19.3 42.5 39.6 20.1 61 449 A A G 3 S+ 0 0 85 -43,-0.6 -1,-0.3 1,-0.2 4,-0.1 0.699 94.6 56.3 -75.1 -23.3 42.6 40.4 23.9 62 450 A D G < S+ 0 0 63 -3,-2.2 -5,-0.3 2,-0.1 -6,-0.3 -0.031 101.2 76.8 -96.3 25.8 43.5 44.1 23.3 63 451 A N S < S- 0 0 20 -3,-0.9 2,-0.5 -8,-0.1 -8,-0.2 -0.739 90.6 -86.7-129.6 175.1 40.3 44.5 21.1 64 452 A K E -D 54 0B 85 -10,-3.7 -10,-2.9 -2,-0.2 2,-0.7 -0.777 33.5-140.3 -88.2 128.7 36.6 45.0 21.6 65 453 A S E +D 53 0B 60 -2,-0.5 -12,-0.2 -12,-0.2 53,-0.1 -0.799 22.1 177.0 -90.1 113.7 34.6 41.8 21.8 66 454 A L E - 0 0 26 -14,-1.4 2,-0.3 -2,-0.7 -1,-0.2 0.589 62.7 -53.2 -90.3 -15.5 31.4 42.3 19.9 67 455 A G E -D 52 0B 17 -15,-1.0 -15,-2.3 -3,-0.1 -1,-0.4 -0.916 46.3-130.2 160.2 174.4 30.2 38.7 20.5 68 456 A Q E +D 51 0B 58 -2,-0.3 2,-0.3 -17,-0.3 -17,-0.2 -0.983 19.4 173.5-155.3 143.2 31.1 35.0 20.3 69 457 A F E -D 50 0B 21 -19,-2.1 -19,-4.0 -2,-0.3 2,-0.4 -0.992 23.0-125.6-151.4 156.5 29.4 31.9 18.9 70 458 A N E -D 49 0B 89 -2,-0.3 2,-0.7 -21,-0.3 -21,-0.2 -0.863 7.0-164.0-109.5 135.5 30.1 28.2 18.3 71 459 A L E +D 48 0B 5 -23,-2.8 -23,-1.7 -2,-0.4 3,-0.2 -0.922 30.4 168.6-115.0 99.4 29.7 26.2 15.1 72 460 A D + 0 0 102 -2,-0.7 -25,-0.2 -25,-0.3 30,-0.1 -0.167 40.1 73.0 -98.9-168.8 29.8 22.6 16.2 73 461 A G + 0 0 46 1,-0.3 2,-0.5 -2,-0.1 -26,-0.2 0.682 55.8 159.4 75.5 16.3 29.0 19.2 14.5 74 462 A I - 0 0 5 -28,-3.6 -1,-0.3 -3,-0.2 3,-0.1 -0.650 47.0-119.0 -74.4 117.2 32.2 19.4 12.5 75 463 A N - 0 0 118 -2,-0.5 -31,-0.1 1,-0.1 -30,-0.1 -0.441 42.6 -85.2 -59.3 133.6 32.8 15.8 11.6 76 464 A P + 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -30,-0.1 -0.051 64.4 161.1 -43.8 130.1 36.1 14.5 13.0 77 465 A A - 0 0 34 -35,-0.2 -33,-3.3 -32,-0.2 -32,-0.5 -0.987 48.2 -82.8-153.1 160.0 39.0 15.3 10.7 78 466 A P > - 0 0 54 0, 0.0 3,-1.7 0, 0.0 -38,-0.2 -0.464 69.2 -90.2 -62.1 131.2 42.8 15.7 10.6 79 467 A R T 3 S+ 0 0 27 1,-0.2 -36,-0.1 2,-0.1 -38,-0.1 -0.052 112.9 27.2 -45.7 142.3 43.6 19.2 11.8 80 468 A G T 3 S+ 0 0 10 -40,-0.6 -1,-0.2 -38,-0.2 289,-0.1 0.336 103.2 88.0 84.8 -4.7 43.7 21.9 9.1 81 469 A M < + 0 0 40 -3,-1.7 -2,-0.1 288,-0.1 -1,-0.0 0.755 58.4 86.5 -96.9 -35.6 41.3 19.9 6.9 82 470 A P S S- 0 0 13 0, 0.0 2,-0.5 0, 0.0 -42,-0.3 -0.393 72.8-135.9 -63.8 154.7 37.7 21.0 7.9 83 471 A Q + 0 0 14 -44,-0.1 20,-2.4 330,-0.0 2,-0.5 -0.954 24.8 177.6-117.9 117.0 36.6 24.1 6.0 84 472 A I E -FG 38 102D 0 -46,-2.6 -46,-4.1 -2,-0.5 2,-0.5 -0.980 13.6-155.2-121.1 128.2 34.8 26.9 8.0 85 473 A E E -FG 37 101D 55 16,-1.8 16,-2.1 -2,-0.5 2,-0.5 -0.902 3.4-163.2-106.3 125.1 33.8 30.1 6.3 86 474 A V E -FG 36 100D 0 -50,-2.3 -50,-1.8 -2,-0.5 2,-0.5 -0.957 8.4-167.1-107.6 125.9 33.3 33.2 8.4 87 475 A T E -FG 35 99D 28 12,-2.7 12,-2.1 -2,-0.5 2,-0.5 -0.962 7.5-163.2-121.4 113.8 31.4 35.9 6.7 88 476 A F E +FG 34 98D 0 -54,-2.5 -54,-2.4 -2,-0.5 2,-0.4 -0.856 15.7 178.8 -94.2 127.6 31.3 39.5 8.1 89 477 A D E -FG 33 97D 59 8,-1.1 8,-2.7 -2,-0.5 2,-0.5 -0.966 11.0-178.0-137.1 114.7 28.4 41.4 6.7 90 478 A I E -FG 32 96D 11 -58,-2.5 -58,-1.4 -2,-0.4 6,-0.2 -0.968 14.5-157.5-114.3 121.2 27.5 45.1 7.6 91 479 A D > - 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