==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN/DNA 17-APR-03 1P3F . COMPND 2 MOLECULE: PALINDROMIC 146BP HUMAN ALPHA-SATELLITE DNA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR U.M.MUTHURAJAN,Y.BAO,L.J.FORSBERG,R.S.EDAYATHUMANGALAM, . 757 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35949.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 569 75.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 24 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 408 53.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.2 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 1 2 0 0 2 5 7 3 1 0 0 0 0 0 2 0 0 0 0 0 0 3 1 4 0 0 RESIDUES PER ALPHA HELIX . 0 9 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 10 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 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 1 437 A K 0 0 262 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -69.1 -62.3 29.6 -80.3 2 438 A P + 0 0 128 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.220 360.0 154.2 -30.7 106.5 -58.5 28.7 -80.7 3 439 A H + 0 0 141 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.863 6.0 162.8-125.4 162.7 -56.1 29.9 -78.0 4 440 A R - 0 0 220 -2,-0.3 2,-0.3 3,-0.0 0, 0.0 -0.740 32.7-130.9 177.3 120.3 -53.0 28.3 -77.2 5 441 A Y - 0 0 119 -2,-0.3 3,-0.1 1,-0.1 -2,-0.0 -0.614 32.9-108.9 -78.9 150.5 -50.2 29.7 -75.4 6 442 A R >> - 0 0 204 -2,-0.3 3,-2.4 1,-0.1 4,-0.5 -0.418 48.6 -78.1 -77.1 151.3 -46.8 29.4 -77.0 7 443 A P T 34 S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.264 119.5 24.8 -51.4 125.7 -44.2 27.0 -75.5 8 444 A G T 3> S+ 0 0 15 114,-0.1 4,-2.2 -3,-0.1 5,-0.2 0.058 94.9 92.0 110.7 -21.4 -42.7 28.7 -72.5 9 445 A T H <> S+ 0 0 56 -3,-2.4 4,-1.9 1,-0.2 5,-0.1 0.890 93.6 38.4 -75.8 -37.4 -45.5 31.0 -71.5 10 446 A V H X S+ 0 0 54 -4,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.819 112.7 56.8 -81.4 -29.4 -47.2 28.8 -69.2 11 447 A A H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.988 110.9 46.0 -59.1 -52.1 -44.0 27.4 -67.9 12 448 A L H X S+ 0 0 6 -4,-2.2 4,-2.8 1,-0.3 5,-0.2 0.884 109.5 53.2 -54.7 -44.9 -43.0 31.1 -67.1 13 449 A R H X S+ 0 0 106 -4,-1.9 4,-3.1 1,-0.2 -1,-0.3 0.961 109.5 49.6 -56.6 -48.0 -46.4 31.7 -65.5 14 450 A E H X S+ 0 0 48 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.885 108.9 52.1 -59.8 -45.8 -45.8 28.6 -63.3 15 451 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-0.4 0.999 110.8 47.4 -57.5 -62.3 -42.3 29.8 -62.3 16 452 A R H X S+ 0 0 109 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.910 114.3 49.3 -43.6 -47.8 -43.7 33.1 -61.3 17 453 A R H >X S+ 0 0 134 -4,-3.1 4,-1.8 -5,-0.2 3,-1.3 0.959 113.2 42.1 -55.3 -59.2 -46.4 31.4 -59.4 18 454 A Y H 3< S+ 0 0 14 -4,-2.8 638,-0.2 1,-0.3 -1,-0.2 0.737 107.1 58.6 -65.8 -25.1 -44.4 28.9 -57.5 19 455 A Q H 3< S+ 0 0 10 -4,-2.3 637,-0.4 -5,-0.3 -1,-0.3 0.698 107.1 54.9 -76.2 -11.9 -41.6 31.3 -56.5 20 456 A K H << S+ 0 0 138 -3,-1.3 -2,-0.2 -4,-0.7 -1,-0.1 0.964 106.8 51.5 -82.9 -50.8 -44.5 33.2 -54.9 21 457 A S < - 0 0 31 -4,-1.8 635,-0.4 1,-0.1 633,-0.0 -0.082 60.3-154.4 -82.0-176.4 -45.8 30.4 -52.8 22 458 A T + 0 0 29 633,-0.1 633,-0.3 2,-0.1 631,-0.1 0.273 45.9 126.4-137.1 5.9 -44.3 28.1 -50.3 23 459 A E - 0 0 70 1,-0.1 2,-0.1 631,-0.1 -2,-0.0 -0.202 69.1 -98.8 -63.0 161.2 -46.5 25.0 -50.1 24 460 A L - 0 0 32 1,-0.1 -1,-0.1 2,-0.1 4,-0.1 -0.415 28.0-154.5 -74.6 162.5 -44.9 21.7 -50.6 25 461 A L + 0 0 4 -2,-0.1 2,-0.4 -3,-0.1 89,-0.1 0.456 67.9 83.4-121.8 -5.0 -45.3 20.4 -54.1 26 462 A I S S- 0 0 6 88,-0.1 2,-0.3 81,-0.1 81,-0.1 -0.851 89.5-108.3 -98.2 138.8 -45.0 16.7 -53.6 27 463 A R > - 0 0 133 -2,-0.4 4,-2.2 79,-0.2 5,-0.2 -0.489 27.4-130.6 -72.7 127.5 -48.2 15.0 -52.5 28 464 A K H > S+ 0 0 129 -2,-0.3 4,-4.0 1,-0.2 5,-0.3 0.868 95.0 46.0 -38.6 -66.6 -48.1 13.9 -48.9 29 465 A L H > S+ 0 0 102 1,-0.3 4,-3.2 2,-0.2 -1,-0.2 0.919 111.8 48.7 -58.5 -47.7 -49.2 10.3 -48.9 30 466 A P H > S+ 0 0 9 0, 0.0 4,-2.6 0, 0.0 -1,-0.3 0.965 116.8 47.5 -55.4 -43.3 -47.1 9.1 -51.8 31 467 A F H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 5,-0.3 0.938 108.4 52.1 -59.9 -47.9 -44.3 10.8 -50.0 32 468 A Q H X S+ 0 0 58 -4,-4.0 4,-2.6 1,-0.2 -1,-0.2 0.916 110.3 51.0 -56.4 -39.6 -45.1 9.3 -46.7 33 469 A R H X S+ 0 0 92 -4,-3.2 4,-2.3 -5,-0.3 -1,-0.2 0.922 108.4 50.0 -60.8 -48.7 -45.1 6.0 -48.5 34 470 A L H X S+ 0 0 2 -4,-2.6 4,-1.9 69,-0.2 -2,-0.2 0.905 112.0 47.9 -58.7 -45.7 -41.7 6.5 -50.0 35 471 A V H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 3,-0.3 0.960 111.5 49.5 -58.5 -53.7 -40.2 7.5 -46.8 36 472 A R H X S+ 0 0 94 -4,-2.6 4,-1.5 -5,-0.3 -2,-0.2 0.882 111.8 50.3 -55.3 -36.6 -41.7 4.6 -44.9 37 473 A E H < S+ 0 0 71 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.815 110.4 46.9 -70.4 -37.3 -40.4 2.2 -47.6 38 474 A I H >< S+ 0 0 8 -4,-1.9 3,-1.4 -3,-0.3 4,-0.3 0.891 114.2 48.9 -70.0 -42.0 -36.9 3.5 -47.6 39 475 A A H >X S+ 0 0 1 -4,-2.6 3,-1.9 1,-0.3 4,-1.8 0.775 94.4 72.9 -69.9 -30.9 -36.8 3.3 -43.9 40 476 A Q T 3< S+ 0 0 90 -4,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.547 92.4 58.2 -63.3 -7.7 -38.2 -0.1 -43.8 41 477 A D T <4 S+ 0 0 129 -3,-1.4 -1,-0.3 1,-0.1 -2,-0.2 0.644 106.5 49.0 -95.0 -13.1 -34.8 -1.3 -45.0 42 478 A F T <4 S- 0 0 62 -3,-1.9 2,-0.3 1,-0.4 -2,-0.2 0.873 130.4 -11.6 -90.8 -37.2 -33.1 0.3 -42.1 43 479 A K S < S- 0 0 61 -4,-1.8 -1,-0.4 114,-0.0 3,-0.3 -0.959 74.2-119.1-157.4 150.0 -35.2 -1.0 -39.2 44 480 A T S S+ 0 0 87 -2,-0.3 -3,-0.1 1,-0.2 -4,-0.0 -0.555 80.3 19.8 -97.4 164.0 -38.6 -2.8 -39.2 45 481 A D S S+ 0 0 99 -2,-0.2 2,-0.2 1,-0.2 -1,-0.2 0.930 81.3 167.6 48.1 60.4 -42.0 -2.0 -37.8 46 482 A L - 0 0 21 -3,-0.3 2,-0.4 -10,-0.1 112,-0.2 -0.664 26.5-155.4-104.0 157.4 -41.3 1.6 -37.4 47 483 A R E -a 158 0A 159 110,-2.9 112,-2.7 -2,-0.2 2,-0.4 -0.933 9.2-149.6-125.0 155.1 -43.7 4.4 -36.7 48 484 A F E -a 159 0A 17 -2,-0.4 112,-0.2 110,-0.3 110,-0.1 -0.985 17.0-122.7-127.1 126.1 -43.1 8.0 -37.7 49 485 A Q > - 0 0 82 110,-2.2 4,-1.5 -2,-0.4 5,-0.2 -0.362 31.0-118.3 -59.6 151.6 -44.3 11.2 -35.8 50 486 A S H > S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.884 115.1 56.2 -60.7 -33.5 -46.3 13.2 -38.2 51 487 A S H > S+ 0 0 37 1,-0.2 4,-4.2 2,-0.2 -1,-0.2 0.869 99.3 57.4 -67.7 -37.4 -43.7 15.9 -37.7 52 488 A A H > S+ 0 0 0 107,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.886 110.5 43.6 -64.8 -33.4 -40.8 13.8 -38.7 53 489 A V H X S+ 0 0 6 -4,-1.5 4,-3.4 2,-0.2 5,-0.3 0.968 113.8 49.9 -74.8 -46.1 -42.4 13.1 -42.1 54 490 A M H X S+ 0 0 40 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.928 113.2 47.8 -55.5 -44.6 -43.4 16.7 -42.5 55 491 A A H X S+ 0 0 0 -4,-4.2 4,-1.9 1,-0.2 -1,-0.2 0.947 112.2 48.4 -62.9 -48.5 -39.7 17.7 -41.6 56 492 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.894 113.5 48.6 -54.5 -43.8 -38.2 15.2 -44.0 57 493 A Q H X S+ 0 0 2 -4,-3.4 4,-2.1 1,-0.2 5,-0.3 0.967 110.1 49.9 -66.2 -45.6 -40.5 16.4 -46.7 58 494 A E H X S+ 0 0 16 -4,-2.5 4,-1.2 -5,-0.3 -1,-0.2 0.838 111.2 49.8 -59.4 -32.2 -39.8 19.9 -46.1 59 495 A A H X S+ 0 0 6 -4,-1.9 4,-0.9 2,-0.2 -1,-0.2 0.822 109.2 51.3 -75.8 -35.4 -36.1 19.2 -46.2 60 496 A S H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.868 107.8 50.8 -72.1 -35.7 -36.2 17.2 -49.5 61 497 A E H X S+ 0 0 6 -4,-2.1 4,-4.1 1,-0.2 5,-0.3 0.966 109.2 49.9 -70.2 -37.7 -38.1 19.8 -51.4 62 498 A A H X S+ 0 0 33 -4,-1.2 4,-1.3 -5,-0.3 -1,-0.2 0.788 113.6 49.4 -67.2 -24.0 -35.7 22.5 -50.5 63 499 A Y H X S+ 0 0 9 -4,-0.9 4,-2.3 2,-0.2 5,-0.3 0.968 114.9 40.6 -77.8 -60.6 -32.9 20.3 -51.5 64 500 A L H X S+ 0 0 3 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.868 112.6 55.5 -58.2 -38.2 -34.4 19.4 -54.8 65 501 A V H X S+ 0 0 6 -4,-4.1 4,-1.9 -5,-0.3 -1,-0.2 0.920 112.3 44.2 -61.2 -42.1 -35.6 22.9 -55.5 66 502 A A H X S+ 0 0 24 -4,-1.3 4,-1.9 -5,-0.3 -1,-0.2 0.853 109.5 54.7 -66.1 -38.3 -32.0 24.1 -54.9 67 503 A L H X S+ 0 0 3 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.750 104.8 56.4 -67.2 -23.7 -30.5 21.3 -57.0 68 504 A F H X S+ 0 0 4 -4,-1.5 4,-2.9 -5,-0.3 5,-0.3 0.955 103.4 52.8 -73.4 -44.5 -32.8 22.6 -59.6 69 505 A E H X S+ 0 0 73 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.915 112.6 44.5 -58.3 -36.1 -31.3 26.1 -59.4 70 506 A D H X S+ 0 0 20 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.912 113.3 51.2 -79.2 -27.6 -27.8 24.7 -59.9 71 507 A T H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.975 108.2 50.8 -65.4 -49.2 -29.0 22.4 -62.7 72 508 A N H X S+ 0 0 5 -4,-2.9 4,-2.5 1,-0.3 -1,-0.2 0.853 111.1 50.2 -54.6 -38.7 -30.6 25.3 -64.5 73 509 A L H X S+ 0 0 19 -4,-1.5 4,-2.4 -5,-0.3 -1,-0.3 0.962 108.7 51.2 -68.4 -47.0 -27.4 27.2 -64.2 74 510 A C H X S+ 0 0 0 -4,-2.9 4,-0.7 1,-0.2 -2,-0.2 0.840 110.6 49.5 -58.0 -32.8 -25.5 24.3 -65.5 75 511 A A H ><>S+ 0 0 0 -4,-2.6 5,-2.3 1,-0.2 3,-1.2 0.935 109.6 50.0 -71.9 -44.7 -27.8 24.1 -68.5 76 512 A I H ><5S+ 0 0 40 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.882 103.0 61.2 -62.0 -28.6 -27.5 27.7 -69.3 77 513 A H H 3<5S+ 0 0 29 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.849 104.1 49.7 -66.9 -23.3 -23.7 27.5 -69.1 78 514 A A T <<5S- 0 0 22 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.205 124.3-111.5 -97.0 12.1 -24.0 25.0 -72.0 79 515 A K T < 5S+ 0 0 183 -3,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.898 79.8 122.3 57.8 43.2 -26.1 27.6 -73.6 80 516 A R < - 0 0 54 -5,-2.3 -1,-0.2 -8,-0.1 -2,-0.1 -0.759 52.9-156.1-121.4 173.8 -29.2 25.5 -73.3 81 517 A V S S+ 0 0 52 -2,-0.3 42,-0.9 -3,-0.1 2,-0.6 0.146 74.8 84.9-132.2 9.1 -32.5 26.4 -71.6 82 518 A T E S-b 123 0B 48 -7,-0.1 42,-0.2 40,-0.1 -1,-0.1 -0.919 76.5-134.9-115.4 110.9 -33.5 22.8 -71.1 83 519 A I E -b 124 0B 0 40,-1.7 42,-1.5 -2,-0.6 45,-0.2 -0.294 27.6-170.6 -63.8 143.2 -32.2 21.1 -68.1 84 520 A M > - 0 0 46 -13,-0.2 4,-1.6 40,-0.1 5,-0.3 -0.836 38.9-100.9-131.1 167.6 -30.8 17.6 -68.6 85 521 A P H >> S+ 0 0 21 0, 0.0 4,-3.0 0, 0.0 3,-1.0 0.951 122.9 52.4 -49.5 -49.5 -29.6 14.6 -66.7 86 522 A K H 3> S+ 0 0 87 1,-0.3 4,-3.2 2,-0.2 5,-0.3 0.930 103.2 58.4 -57.2 -40.6 -26.1 15.6 -67.4 87 523 A D H 3> S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.858 110.4 43.1 -54.4 -36.5 -26.8 19.1 -66.0 88 524 A I H S+ 0 0 29 -4,-2.4 5,-2.1 1,-0.2 4,-1.0 0.853 110.3 54.4 -65.0 -26.8 -23.9 17.1 -58.0 93 529 A R H ><5S+ 0 0 97 -4,-2.0 3,-1.4 -5,-0.3 5,-0.4 0.990 109.8 43.4 -68.6 -52.4 -20.4 16.5 -59.0 94 530 A I H 3<5S+ 0 0 8 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.815 109.9 61.0 -59.2 -22.0 -19.2 20.0 -58.2 95 531 A R H 3<5S- 0 0 50 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.766 118.2-107.7 -77.5 -25.6 -21.2 19.8 -55.0 96 532 A G T <<5S+ 0 0 64 -3,-1.4 -3,-0.2 -4,-1.0 -2,-0.1 0.661 93.6 97.8 107.7 19.4 -19.3 16.8 -53.7 97 533 A E < + 0 0 70 -5,-2.1 -4,-0.2 -4,-0.1 -3,-0.1 0.164 65.9 91.9-120.1 35.0 -21.7 14.0 -54.0 98 534 A R 0 0 66 -5,-0.4 -5,-0.1 -6,-0.2 -6,-0.1 0.943 360.0 360.0-129.4 -41.4 -20.7 12.2 -57.3 99 535 A A 0 0 157 -6,-0.1 -1,-0.1 0, 0.0 -6,-0.0 -0.437 360.0 360.0 77.4 360.0 -18.7 9.5 -59.7 100 !* 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 0.0 101 23 B R 0 0 212 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 162.6 -47.6 1.1 -58.7 102 24 B D > - 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