==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTITUMOR PROTEIN 07-NOV-06 2NTE . COMPND 2 MOLECULE: BRCA1-ASSOCIATED RING DOMAIN PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.BIRRANE,A.K.VARMA,A.SONI,J.A.A.LADIAS . 419 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21194.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 62.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 12.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 2.4 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 . 2 0.5 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 . 25 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 24.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 3.3 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 1 0 0 1 3 6 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 4 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 PARALLEL BRIDGES PER LADDER . 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 1 568 A G 0 0 118 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-179.5 27.5 1.3 45.5 2 569 A P - 0 0 105 0, 0.0 2,-0.2 0, 0.0 25,-0.1 -0.485 360.0-112.0 -54.4 136.0 27.7 5.2 45.3 3 570 A L - 0 0 40 22,-0.3 25,-2.4 -2,-0.2 2,-0.4 -0.501 25.3-161.3 -76.6 142.8 25.0 7.0 43.2 4 571 A V E -a 28 0A 9 23,-0.2 34,-3.0 -2,-0.2 35,-1.9 -0.985 12.5-163.8-133.4 114.6 26.0 8.7 40.0 5 572 A L E +ab 29 39A 0 23,-3.1 25,-2.6 -2,-0.4 2,-0.3 -0.686 12.1 174.9-102.2 149.3 23.6 11.2 38.7 6 573 A I E -ab 30 40A 0 33,-1.5 35,-2.8 -2,-0.3 2,-0.4 -0.981 19.6-135.8-150.8 149.8 23.2 12.9 35.4 7 574 A G E - b 0 41A 0 23,-0.6 2,-0.4 -2,-0.3 35,-0.2 -0.831 8.5-162.7-106.1 142.9 20.8 15.3 33.8 8 575 A S S S- 0 0 4 33,-3.0 40,-0.0 -2,-0.4 -2,-0.0 -0.959 78.6 -9.4-123.6 117.6 19.1 15.2 30.4 9 576 A G S S+ 0 0 48 -2,-0.4 2,-0.2 1,-0.3 -1,-0.1 0.715 92.0 151.1 77.2 23.8 17.5 18.3 29.0 10 577 A L - 0 0 24 31,-0.1 -1,-0.3 1,-0.1 2,-0.1 -0.562 45.5-118.7 -83.1 150.7 17.9 20.2 32.3 11 578 A S > - 0 0 54 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.325 34.3-100.6 -73.9 170.4 18.2 24.0 32.4 12 579 A S H > S+ 0 0 89 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.931 127.1 51.8 -57.7 -41.0 21.4 25.5 34.0 13 580 A E H > S+ 0 0 120 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.852 110.0 48.8 -64.1 -40.0 19.3 26.2 37.2 14 581 A Q H > S+ 0 0 35 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.918 108.8 52.1 -63.1 -44.3 18.3 22.6 37.2 15 582 A Q H X S+ 0 0 34 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.889 109.3 50.5 -62.6 -40.1 21.9 21.3 36.7 16 583 A K H X S+ 0 0 138 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.939 110.6 49.9 -57.9 -45.4 23.1 23.4 39.7 17 584 A M H X S+ 0 0 38 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.891 108.7 51.9 -65.1 -38.6 20.3 21.9 41.7 18 585 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.924 110.4 48.2 -62.1 -43.5 21.3 18.5 40.7 19 586 A S H X S+ 0 0 50 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.930 108.6 55.0 -62.7 -42.6 24.9 19.2 41.8 20 587 A E H X S+ 0 0 98 -4,-3.0 4,-1.6 1,-0.2 -1,-0.2 0.880 110.1 46.4 -54.4 -42.5 23.6 20.5 45.0 21 588 A L H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.875 105.1 58.8 -69.0 -40.9 21.8 17.2 45.6 22 589 A A H <>S+ 0 0 5 -4,-2.1 5,-2.8 1,-0.2 4,-0.5 0.909 106.3 50.6 -57.6 -37.9 24.8 15.1 44.6 23 590 A V H ><5S+ 0 0 110 -4,-2.0 3,-1.4 3,-0.2 -1,-0.2 0.961 110.5 48.4 -63.9 -46.0 26.6 16.8 47.5 24 591 A I H 3<5S+ 0 0 62 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.937 117.6 41.3 -60.5 -46.3 23.8 16.1 49.9 25 592 A L T 3<5S- 0 0 33 -4,-2.9 -22,-0.3 52,-0.1 -1,-0.3 0.351 108.3-120.7 -80.7 -0.2 23.7 12.4 48.8 26 593 A K T < 5S+ 0 0 183 -3,-1.4 2,-0.2 -4,-0.5 -3,-0.2 0.869 71.1 136.6 58.7 37.9 27.5 11.9 48.7 27 594 A A < - 0 0 15 -5,-2.8 2,-0.3 -6,-0.2 -23,-0.2 -0.606 57.5-108.5-111.1 165.1 26.9 11.1 45.0 28 595 A K E -a 4 0A 121 -25,-2.4 -23,-3.1 -2,-0.2 2,-0.4 -0.708 21.5-157.5 -85.6 150.5 28.6 11.9 41.7 29 596 A K E -a 5 0A 47 -2,-0.3 -23,-0.2 -25,-0.2 2,-0.2 -0.955 17.1-176.1-129.4 117.7 27.1 14.2 39.2 30 597 A Y E -a 6 0A 79 -25,-2.6 -23,-0.6 -2,-0.4 3,-0.1 -0.562 30.2-156.2-104.6 168.6 28.3 13.9 35.6 31 598 A T S S+ 0 0 87 -2,-0.2 2,-0.4 1,-0.2 -1,-0.1 0.484 83.8 58.1-115.0 -14.9 27.7 15.7 32.4 32 599 A E S S- 0 0 144 20,-0.0 -1,-0.2 -26,-0.0 2,-0.1 -0.974 90.0-112.7-119.0 134.6 28.7 12.8 30.2 33 600 A F + 0 0 37 -2,-0.4 2,-0.3 -3,-0.1 -27,-0.0 -0.377 39.7 168.6 -65.8 144.1 27.0 9.4 30.3 34 601 A D > - 0 0 75 -2,-0.1 3,-1.9 -4,-0.0 -4,-0.1 -0.930 50.6-104.0-148.0 155.3 28.9 6.4 31.5 35 602 A S T 3 S+ 0 0 92 -2,-0.3 -2,-0.1 1,-0.3 0, 0.0 0.576 116.7 66.5 -62.2 -7.4 28.0 2.8 32.5 36 603 A T T 3 S+ 0 0 68 -33,-0.0 -1,-0.3 2,-0.0 -32,-0.2 0.530 73.1 115.9 -90.4 -7.3 28.4 3.9 36.2 37 604 A V < + 0 0 7 -3,-1.9 -32,-0.2 1,-0.1 3,-0.1 -0.408 36.6 174.9 -64.1 130.9 25.4 6.2 36.0 38 605 A T + 0 0 45 -34,-3.0 24,-2.4 1,-0.3 2,-0.4 0.695 63.5 35.1-106.2 -26.0 22.7 5.1 38.2 39 606 A H E -bc 5 62A 3 -35,-1.9 -33,-1.5 22,-0.2 2,-0.5 -0.998 56.4-168.0-141.6 124.5 20.1 8.0 37.9 40 607 A V E -bc 6 63A 0 22,-3.4 24,-2.9 -2,-0.4 2,-0.5 -0.982 15.2-155.4-113.1 126.6 19.1 10.1 34.9 41 608 A V E -bc 7 64A 0 -35,-2.8 -33,-3.0 -2,-0.5 24,-0.2 -0.887 6.0-163.2-107.6 132.0 17.0 13.1 35.7 42 609 A V E - c 0 65A 0 22,-2.6 24,-0.5 -2,-0.5 -33,-0.2 -0.704 26.1-118.1-106.3 161.3 14.7 14.8 33.1 43 610 A P S S+ 0 0 41 0, 0.0 2,-0.1 0, 0.0 -34,-0.1 0.620 89.7 8.9 -76.3 -20.2 13.1 18.2 33.3 44 611 A G S S- 0 0 38 2,-0.4 22,-1.1 22,-0.1 23,-0.4 -0.064 104.2 -68.2-131.7-136.4 9.5 17.4 33.3 45 612 A D S S+ 0 0 90 20,-0.2 2,-0.3 -2,-0.1 20,-0.1 -0.079 102.2 79.0-121.2 29.6 7.5 14.2 33.6 46 613 A A S S- 0 0 58 18,-0.1 -2,-0.4 40,-0.1 2,-0.1 -0.989 80.6-104.4-142.6 146.3 8.5 12.7 30.3 47 614 A V - 0 0 32 -2,-0.3 2,-0.4 40,-0.2 -2,-0.1 -0.336 32.6-129.9 -66.6 147.9 11.4 10.9 28.7 48 615 A Q - 0 0 54 2,-0.1 2,-1.9 -2,-0.1 5,-0.1 -0.862 10.3-132.4 -98.5 133.1 13.7 12.8 26.4 49 616 A S + 0 0 91 -2,-0.4 2,-0.3 4,-0.1 3,-0.0 -0.614 68.2 122.7 -81.7 71.8 14.6 11.3 23.0 50 617 A T S > S- 0 0 46 -2,-1.9 4,-2.6 1,-0.1 5,-0.2 -0.900 77.1-110.6-129.4 161.7 18.3 12.0 23.6 51 618 A L H > S+ 0 0 46 -2,-0.3 4,-3.3 1,-0.2 5,-0.2 0.872 116.5 54.4 -61.3 -39.6 21.3 9.8 23.7 52 619 A K H > S+ 0 0 59 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.887 111.4 42.9 -63.3 -46.7 21.7 10.3 27.4 53 620 A C H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 114.6 50.4 -66.7 -40.6 18.3 9.2 28.2 54 621 A M H X S+ 0 0 15 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.946 111.1 48.4 -66.0 -45.1 18.4 6.3 25.7 55 622 A L H X S+ 0 0 19 -4,-3.3 4,-2.1 2,-0.2 -1,-0.2 0.907 110.1 54.0 -57.8 -38.1 21.7 5.1 27.2 56 623 A G H <>S+ 0 0 0 -4,-2.0 5,-2.4 1,-0.2 4,-0.3 0.918 110.0 46.1 -63.4 -44.2 20.1 5.4 30.6 57 624 A I H ><5S+ 0 0 0 -4,-2.4 3,-1.9 3,-0.2 -2,-0.2 0.943 110.9 51.1 -60.6 -47.9 17.2 3.2 29.5 58 625 A L H 3<5S+ 0 0 7 -4,-3.0 46,-0.2 1,-0.3 -2,-0.2 0.865 112.3 49.5 -65.2 -26.1 19.5 0.6 27.9 59 626 A N T 3<5S- 0 0 46 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.435 112.1-121.1 -84.9 -2.0 21.4 0.5 31.2 60 627 A G T < 5 + 0 0 1 -3,-1.9 -3,-0.2 -4,-0.3 -2,-0.1 0.788 55.9 161.0 63.4 27.9 18.3 0.1 33.4 61 628 A C < - 0 0 6 -5,-2.4 2,-0.4 -6,-0.2 -22,-0.2 -0.301 52.2 -90.9 -66.4 163.8 19.0 3.3 35.3 62 629 A W E -c 39 0A 42 -24,-2.4 -22,-3.4 32,-0.1 2,-0.6 -0.663 38.7-162.1 -68.0 122.2 16.4 5.2 37.3 63 630 A I E -c 40 0A 0 -2,-0.4 23,-2.5 -24,-0.2 2,-0.3 -0.963 23.1-177.2-109.3 107.4 14.9 7.7 34.8 64 631 A L E -cD 41 85A 0 -24,-2.9 -22,-2.6 -2,-0.6 21,-0.2 -0.815 29.2-114.2-122.5 149.1 13.3 10.2 37.1 65 632 A K E > -c 42 0A 30 19,-2.8 3,-2.2 -2,-0.3 4,-0.4 -0.376 36.4-111.7 -73.8 152.1 11.2 13.4 36.9 66 633 A F T >> S+ 0 0 8 -22,-1.1 4,-1.7 -24,-0.5 3,-1.1 0.780 111.1 77.6 -58.0 -25.8 12.8 16.6 38.1 67 634 A E H 3> S+ 0 0 95 -23,-0.4 4,-2.2 1,-0.2 -1,-0.3 0.804 84.8 65.3 -53.6 -27.9 10.3 16.7 41.0 68 635 A W H <> S+ 0 0 0 -3,-2.2 4,-2.8 2,-0.2 11,-0.3 0.896 99.9 48.9 -59.4 -41.4 12.6 14.0 42.6 69 636 A V H <> S+ 0 0 0 -3,-1.1 4,-2.4 -4,-0.4 5,-0.3 0.956 112.3 49.0 -64.3 -48.9 15.5 16.5 42.8 70 637 A K H X S+ 0 0 106 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.905 113.8 46.2 -54.6 -43.7 13.1 19.1 44.4 71 638 A A H X S+ 0 0 1 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.942 112.1 48.8 -69.0 -43.2 11.8 16.6 46.9 72 639 A C H X>S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 5,-1.5 0.874 112.3 49.6 -63.4 -37.4 15.2 15.2 47.9 73 640 A L H <5S+ 0 0 18 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.812 109.2 50.9 -73.6 -33.8 16.5 18.7 48.4 74 641 A R H <5S+ 0 0 167 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.842 123.3 31.6 -71.8 -25.5 13.6 19.7 50.5 75 642 A R H <5S- 0 0 173 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.595 97.0-132.3-101.7 -18.9 14.1 16.6 52.7 76 643 A K T <5S+ 0 0 119 -4,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.857 73.8 107.6 60.4 44.0 17.9 16.2 52.4 77 644 A V S - 0 0 104 1,-0.2 3,-1.8 2,-0.1 4,-0.2 -0.259 42.7-149.4 -60.8 114.0 12.1 6.7 47.0 81 648 A E G >> S+ 0 0 32 1,-0.3 3,-2.0 -2,-0.2 4,-0.6 0.793 87.0 65.1 -60.8 -37.6 13.0 6.6 43.3 82 649 A E G 34 S+ 0 0 90 1,-0.3 3,-0.3 2,-0.2 -1,-0.3 0.726 94.1 61.6 -56.5 -25.1 10.0 4.5 42.2 83 650 A K G <4 S+ 0 0 118 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.490 114.1 33.7 -81.8 -5.2 7.6 7.2 43.1 84 651 A Y T <4 S+ 0 0 33 -3,-2.0 -19,-2.8 -4,-0.2 -16,-0.2 0.290 89.4 125.2-126.4 2.4 9.2 9.6 40.6 85 652 A E B < -D 64 0A 6 -4,-0.6 -21,-0.2 -3,-0.3 -23,-0.0 -0.417 65.4-114.3 -75.7 140.0 10.2 7.2 37.8 86 653 A I > - 0 0 7 -23,-2.5 5,-0.6 -2,-0.1 -23,-0.2 -0.601 39.4-127.9 -72.1 130.6 9.0 7.7 34.3 87 654 A P T 5 + 0 0 46 0, 0.0 2,-0.4 0, 0.0 -40,-0.2 -0.184 68.1 25.7 -80.2 177.9 6.7 5.0 33.3 88 655 A E T >5S+ 0 0 126 1,-0.2 4,-2.3 2,-0.1 3,-0.4 -0.641 123.7 17.3 75.7-119.8 6.6 2.6 30.3 89 656 A G H >5S+ 0 0 1 -2,-0.4 4,-2.3 112,-0.3 -1,-0.2 0.855 127.0 47.6 -54.9 -55.7 10.2 2.1 28.8 90 657 A P H >5S+ 0 0 3 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.889 116.1 44.8 -47.3 -46.8 12.4 3.3 31.7 91 658 A R H >S+ 0 0 15 -4,-2.3 5,-2.0 -5,-0.2 -2,-0.2 0.914 110.8 41.0 -52.4 -46.5 14.5 -6.0 33.7 97 664 A R H ><5S+ 0 0 111 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.847 107.3 59.9 -79.1 -25.2 17.9 -5.4 35.0 98 665 A E H 3<5S+ 0 0 88 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.884 107.7 49.0 -62.3 -33.4 17.0 -5.8 38.7 99 666 A Q T 3<5S- 0 0 117 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.403 114.1-121.8 -89.0 3.4 15.9 -9.3 37.8 100 667 A L T < 5 + 0 0 158 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.773 58.6 154.8 61.1 34.5 19.2 -9.9 35.9 101 668 A L < - 0 0 59 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.0 -0.335 51.0 -71.0 -85.8 165.1 17.4 -10.7 32.7 102 669 A P - 0 0 38 0, 0.0 -1,-0.2 0, 0.0 30,-0.0 -0.208 53.6-104.9 -57.6 145.7 18.9 -10.3 29.2 103 670 A K > - 0 0 109 1,-0.1 3,-2.1 -3,-0.1 53,-0.2 -0.252 41.5 -95.0 -67.0 164.3 19.4 -6.8 27.8 104 671 A L T 3 S+ 0 0 1 1,-0.3 52,-0.3 -46,-0.2 28,-0.2 0.810 123.1 37.0 -51.3 -45.4 17.0 -5.5 25.1 105 672 A F T > S+ 0 0 0 26,-2.9 3,-2.5 23,-0.2 -1,-0.3 0.200 80.1 145.0 -97.2 19.5 19.1 -6.5 22.1 106 673 A D T < S+ 0 0 69 -3,-2.1 50,-0.3 25,-0.3 49,-0.2 -0.293 75.2 16.6 -55.5 134.3 20.4 -9.8 23.5 107 674 A G T 3 S+ 0 0 16 25,-0.5 -1,-0.3 1,-0.3 2,-0.3 0.427 105.7 116.5 80.1 5.4 20.8 -12.3 20.7 108 675 A C < - 0 0 2 -3,-2.5 26,-1.8 24,-0.2 2,-0.3 -0.714 47.2-160.8-112.8 150.4 20.5 -9.5 18.0 109 676 A Y E -ef 134 168B 41 58,-2.0 60,-1.8 -2,-0.3 2,-0.4 -0.972 5.6-159.8-130.7 145.0 23.0 -8.4 15.5 110 677 A F E -ef 135 169B 0 24,-2.9 26,-3.3 -2,-0.3 2,-0.5 -0.993 9.3-168.1-137.8 134.0 23.1 -5.1 13.6 111 678 A Y E -ef 136 170B 13 58,-3.0 60,-2.4 -2,-0.4 2,-0.9 -0.969 20.6-141.1-119.2 126.4 24.8 -4.0 10.4 112 679 A L E - 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