==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 31-MAY-13 4L0J . COMPND 2 MOLECULE: DNA HELICASE I; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.REDZEJ,A.ILANGOVAN,S.LANG,C.J.GRUBER,M.TOPF,K.ZANGGER,ZECH . 216 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12259.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 26.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 14 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.9 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 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 4 2 2 1 0 0 1 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 . 1 0 0 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 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 1 575 A D > 0 0 139 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 141.8 10.6 15.4 38.5 2 576 A R H > + 0 0 96 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.877 360.0 50.1 -61.4 -46.3 12.1 18.6 37.0 3 577 A N H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.875 114.4 47.3 -63.7 -35.8 9.2 21.0 37.4 4 578 A V H > S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.944 113.4 46.4 -64.4 -49.7 9.0 19.9 41.1 5 579 A R H X S+ 0 0 83 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.906 113.7 49.0 -63.7 -43.9 12.8 20.3 41.7 6 580 A Y H X S+ 0 0 7 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.856 107.2 55.5 -65.8 -39.9 12.8 23.7 39.9 7 581 A A H X S+ 0 0 57 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.910 110.9 44.9 -56.1 -45.3 9.9 25.0 41.9 8 582 A R H X S+ 0 0 131 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.904 111.7 51.4 -70.5 -39.2 11.7 24.2 45.1 9 583 A L H X S+ 0 0 8 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.939 111.0 50.1 -57.3 -47.6 15.0 25.7 43.8 10 584 A A H X S+ 0 0 1 -4,-2.7 4,-3.3 1,-0.2 5,-0.3 0.903 106.6 54.4 -58.5 -43.2 13.0 28.9 42.9 11 585 A G H X S+ 0 0 18 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.924 112.9 42.5 -57.6 -47.0 11.5 29.1 46.4 12 586 A D H X S+ 0 0 95 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.900 115.3 49.3 -63.6 -44.9 14.9 29.0 48.1 13 587 A F H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 5,-0.2 0.953 113.9 46.1 -62.5 -46.9 16.5 31.4 45.5 14 588 A A H X S+ 0 0 0 -4,-3.3 4,-2.9 1,-0.2 5,-0.2 0.901 108.5 54.5 -66.6 -40.6 13.6 33.9 45.9 15 589 A A H X S+ 0 0 47 -4,-2.1 4,-1.5 -5,-0.3 -1,-0.2 0.921 110.7 46.8 -59.5 -41.2 13.5 33.8 49.7 16 590 A S H <>S+ 0 0 4 -4,-2.0 5,-2.6 2,-0.2 4,-0.3 0.907 111.2 49.7 -69.9 -38.1 17.3 34.7 49.8 17 591 A V H ><5S+ 0 0 30 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.931 109.3 54.1 -62.0 -42.2 16.9 37.6 47.3 18 592 A K H 3<5S+ 0 0 134 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.862 107.6 50.6 -60.7 -34.1 13.9 38.9 49.4 19 593 A A T 3<5S- 0 0 64 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.437 116.4-114.5 -82.8 0.9 16.2 38.9 52.5 20 594 A G T < 5 + 0 0 68 -3,-1.7 -3,-0.2 -4,-0.3 2,-0.2 0.715 68.6 143.5 76.3 19.8 19.0 40.8 50.7 21 595 A E < - 0 0 113 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.1 -0.579 58.9 -98.9 -99.0 155.6 21.4 37.8 50.8 22 596 A E + 0 0 164 -2,-0.2 2,-0.3 194,-0.0 -1,-0.1 -0.499 53.6 160.3 -74.2 140.3 23.9 36.7 48.2 23 597 A S - 0 0 7 193,-0.2 2,-0.3 -2,-0.1 193,-0.2 -0.957 19.6-167.3-160.9 145.8 22.5 33.9 46.1 24 598 A V E -A 215 0A 47 191,-1.5 191,-3.0 -2,-0.3 2,-0.4 -0.961 8.7-151.8-141.2 146.4 23.4 32.5 42.8 25 599 A A E -A 214 0A 0 175,-0.4 177,-3.1 -2,-0.3 2,-0.3 -0.999 17.1-174.5-124.3 129.3 21.5 30.0 40.5 26 600 A Q E +A 213 0A 38 187,-2.8 187,-2.7 -2,-0.4 2,-0.3 -0.940 7.4 174.7-122.7 145.4 23.5 27.8 38.1 27 601 A V - 0 0 1 175,-0.4 178,-0.3 -2,-0.3 184,-0.1 -0.908 33.2-125.7-139.0 171.6 22.4 25.3 35.4 28 602 A S S S+ 0 0 56 182,-0.5 2,-0.3 -2,-0.3 183,-0.1 0.610 83.9 27.5-100.2 -7.0 24.2 23.2 32.8 29 603 A G S > S- 0 0 17 1,-0.1 4,-1.7 181,-0.1 5,-0.1 -0.957 75.1-111.3-148.8 166.2 22.5 24.3 29.6 30 604 A V H > S+ 0 0 103 -2,-0.3 4,-1.9 2,-0.2 5,-0.1 0.823 114.4 55.2 -72.6 -27.8 20.6 27.2 27.9 31 605 A R H > S+ 0 0 203 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.943 111.4 43.1 -65.9 -48.3 17.3 25.3 27.8 32 606 A E H > S+ 0 0 54 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.813 108.5 60.6 -60.8 -36.3 17.4 24.7 31.6 33 607 A Q H X S+ 0 0 31 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.947 108.5 43.9 -58.6 -43.6 18.6 28.3 32.0 34 608 A A H X S+ 0 0 46 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.927 115.5 47.3 -67.6 -44.9 15.2 29.5 30.4 35 609 A I H X S+ 0 0 47 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.924 115.0 44.1 -65.6 -42.1 13.1 27.0 32.4 36 610 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.854 110.4 57.2 -70.9 -34.3 14.6 27.8 35.8 37 611 A T H X S+ 0 0 20 -4,-2.0 4,-2.7 -5,-0.3 5,-0.2 0.957 107.4 48.1 -61.3 -44.6 14.5 31.6 34.9 38 612 A Q H X S+ 0 0 126 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.927 112.9 48.0 -61.0 -42.3 10.6 31.2 34.4 39 613 A A H X S+ 0 0 26 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.886 112.7 48.4 -66.4 -40.3 10.3 29.4 37.7 40 614 A I H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.915 110.7 49.5 -66.7 -45.4 12.4 31.9 39.6 41 615 A R H X S+ 0 0 19 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.938 110.3 52.6 -61.0 -40.5 10.5 35.0 38.1 42 616 A S H X S+ 0 0 75 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.950 113.6 42.6 -59.2 -47.1 7.1 33.3 39.1 43 617 A E H X S+ 0 0 57 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.875 109.1 56.0 -71.4 -35.7 8.3 32.8 42.6 44 618 A L H <>S+ 0 0 0 -4,-2.9 5,-2.4 2,-0.2 6,-1.5 0.852 109.8 49.1 -61.8 -33.6 9.9 36.3 43.0 45 619 A K H ><5S+ 0 0 28 -4,-2.1 3,-1.6 4,-0.2 -2,-0.2 0.953 110.9 48.8 -66.7 -48.8 6.4 37.7 42.0 46 620 A T H 3<5S+ 0 0 112 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.874 112.0 49.8 -60.3 -34.8 4.6 35.5 44.6 47 621 A Q T 3<5S- 0 0 41 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.445 117.3-111.8 -87.2 3.0 7.2 36.6 47.3 48 622 A G T < 5S+ 0 0 66 -3,-1.6 -3,-0.2 2,-0.2 -2,-0.1 0.623 88.8 108.4 87.6 7.4 6.7 40.3 46.5 49 623 A V S > - 0 0 70 -2,-0.3 4,-2.3 59,-0.0 3,-1.2 -0.833 55.9 -74.8-149.0-176.4 36.3 33.6 15.9 67 641 A S T 34 S+ 0 0 96 1,-0.3 4,-0.2 -2,-0.2 -2,-0.0 0.768 128.7 50.0 -62.9 -23.1 38.8 32.9 13.1 68 642 A R T 34 S+ 0 0 205 1,-0.1 -1,-0.3 2,-0.1 -3,-0.0 0.704 122.2 26.9 -84.3 -24.5 37.5 29.3 12.7 69 643 A S T X4 S+ 0 0 19 -3,-1.2 3,-2.0 2,-0.1 6,-0.2 0.656 94.5 86.8-109.0 -20.6 33.7 30.0 12.5 70 644 A R T 3< S+ 0 0 23 -4,-2.3 -3,-0.1 1,-0.3 54,-0.1 0.683 93.9 46.6 -62.1 -25.7 33.4 33.6 11.0 71 645 A Y T 3 S+ 0 0 94 -4,-0.2 2,-0.6 -5,-0.2 -1,-0.3 0.243 83.2 109.4-104.7 15.5 33.5 32.3 7.4 72 646 A L X - 0 0 102 -3,-2.0 3,-1.7 1,-0.1 4,-0.4 -0.798 64.3-142.9 -90.1 120.8 31.0 29.5 7.8 73 647 A R G > S+ 0 0 97 -2,-0.6 3,-2.0 1,-0.3 -1,-0.1 0.865 92.6 54.9 -55.9 -42.5 27.8 30.3 6.0 74 648 A D G 3 S+ 0 0 94 1,-0.3 -1,-0.3 3,-0.0 26,-0.0 0.485 86.2 79.3 -80.5 0.8 25.2 28.7 8.4 75 649 A X G < S+ 0 0 61 -3,-1.7 2,-0.4 -6,-0.2 -1,-0.3 0.734 90.1 69.0 -66.7 -22.6 26.5 30.7 11.4 76 650 A Y < - 0 0 4 -3,-2.0 24,-0.0 -4,-0.4 54,-0.0 -0.856 66.4-178.6-101.8 133.3 24.4 33.5 9.8 77 651 A R > - 0 0 142 -2,-0.4 3,-1.9 22,-0.1 20,-0.2 -0.966 37.9 -95.8-131.4 145.4 20.6 33.3 9.8 78 652 A P T 3 S+ 0 0 88 0, 0.0 20,-0.2 0, 0.0 3,-0.1 -0.326 110.4 29.7 -55.8 137.5 18.0 35.7 8.4 79 653 A G T 3 S+ 0 0 37 18,-3.6 2,-0.1 1,-0.4 19,-0.1 0.302 87.5 120.1 94.6 -11.6 16.8 38.1 11.2 80 654 A X < - 0 0 29 -3,-1.9 17,-2.8 17,-0.2 -1,-0.4 -0.387 62.1-121.0 -67.2 164.6 20.0 38.2 13.3 81 655 A V E -DE 96 131B 0 50,-2.3 50,-2.6 15,-0.2 2,-0.4 -0.877 23.6-165.8-111.2 140.9 21.7 41.5 13.8 82 656 A X E -DE 95 130B 0 13,-2.4 13,-3.1 -2,-0.4 2,-0.4 -0.973 1.1-162.6-124.8 149.8 25.2 42.5 12.8 83 657 A E E -DE 94 129B 5 46,-2.5 46,-2.6 -2,-0.4 2,-0.5 -0.989 4.1-157.8-128.3 139.3 27.3 45.4 13.8 84 658 A Q E -DE 93 128B 59 9,-2.5 9,-2.8 -2,-0.4 2,-0.3 -0.968 22.6-125.8-115.7 128.6 30.4 46.8 12.2 85 659 A W E -D 92 0B 116 42,-2.7 7,-0.2 -2,-0.5 3,-0.1 -0.555 20.3-149.9 -69.7 123.7 32.8 48.9 14.2 86 660 A N E > -D 91 0B 44 5,-3.3 5,-1.0 -2,-0.3 4,-0.2 -0.896 5.4-159.9 -95.6 120.8 33.4 52.2 12.4 87 661 A P T 5S+ 0 0 91 0, 0.0 2,-0.4 0, 0.0 3,-0.2 0.863 86.1 52.9 -74.1 -35.2 36.9 53.6 13.2 88 662 A E T 5S+ 0 0 152 1,-0.2 3,-0.4 -3,-0.1 0, 0.0 -0.857 116.2 27.2 -95.3 139.1 35.8 57.1 12.2 89 663 A T T 5S- 0 0 104 -2,-0.4 -1,-0.2 1,-0.2 3,-0.1 0.057 103.1-122.6 89.0 -14.9 32.6 58.1 14.1 90 664 A R T 5S+ 0 0 215 -3,-0.2 2,-0.3 -4,-0.2 -1,-0.2 0.926 72.6 133.7 39.2 51.4 33.9 55.7 16.8 91 665 A S E < -D 86 0B 45 -5,-1.0 -5,-3.3 -3,-0.4 2,-0.7 -0.924 64.8-125.1-134.5 146.6 30.5 54.1 16.2 92 666 A H E -D 85 0B 79 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.875 26.7-147.1 -89.4 110.8 28.9 50.6 15.7 93 667 A D E -D 84 0B 50 -9,-2.8 -9,-2.5 -2,-0.7 2,-0.4 -0.672 21.0-146.6 -75.5 128.4 26.9 50.6 12.4 94 668 A R E +D 83 0B 50 -2,-0.4 18,-0.5 -11,-0.2 2,-0.3 -0.808 22.5 168.3-110.6 138.8 23.9 48.2 12.8 95 669 A Y E -D 82 0B 26 -13,-3.1 -13,-2.4 -2,-0.4 2,-0.4 -0.954 28.6-131.9-135.3 163.3 22.0 45.9 10.4 96 670 A V E -DF 81 110B 6 14,-2.4 14,-2.4 -2,-0.3 2,-0.7 -0.913 29.3-123.1-107.6 137.3 19.5 43.1 10.2 97 671 A I E + F 0 109B 0 -17,-2.8 -18,-3.6 -2,-0.4 12,-0.2 -0.691 35.3 168.0 -76.0 113.1 20.3 40.0 8.0 98 672 A D E + 0 0 56 10,-2.9 2,-0.4 -2,-0.7 -1,-0.2 0.786 65.2 22.8 -89.2 -31.9 17.5 39.7 5.4 99 673 A R E - 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