==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-MAR-09 3A0Y . COMPND 2 MOLECULE: SENSOR PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR S.YAMADA,H.SUGIMOTO,M.KOBAYASHI,A.OHNO,H.NAKAMURA,Y.SHIRO . 297 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15597.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 21.9 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 . 4 1.3 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 . 1 0.3 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 . 23 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.7 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 1 0 0 0 0 0 0 0 0 2 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 1 0 0 2 0 0 3 1 2 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 0 0 0 0 0 0 1 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 1 604 A M 0 0 144 0, 0.0 2,-0.5 0, 0.0 43,-0.0 0.000 360.0 360.0 360.0-153.0 52.4 56.9 -17.6 2 605 A E - 0 0 138 2,-0.0 43,-0.5 0, 0.0 2,-0.4 -0.810 360.0-173.1-125.8 93.6 51.3 60.4 -16.4 3 606 A F + 0 0 66 -2,-0.5 2,-0.3 41,-0.2 41,-0.2 -0.675 12.3 158.8 -91.2 133.6 53.8 62.5 -14.4 4 607 A T E -A 43 0A 62 39,-2.4 39,-2.6 -2,-0.4 2,-0.5 -0.889 39.6-113.7-137.1 169.1 52.8 65.7 -12.7 5 608 A E E +A 42 0A 105 -2,-0.3 2,-0.3 37,-0.2 37,-0.2 -0.946 48.0 153.7-110.6 126.1 54.4 67.8 -9.9 6 609 A F E -A 41 0A 22 35,-2.2 35,-2.1 -2,-0.5 2,-0.9 -0.915 52.8 -87.0-143.7 164.9 52.2 68.0 -6.8 7 610 A N E >> -A 40 0A 36 -2,-0.3 4,-1.4 33,-0.2 3,-1.0 -0.723 33.9-158.9 -78.4 107.6 52.3 68.5 -3.0 8 611 A L H 3> S+ 0 0 0 31,-3.0 4,-2.3 -2,-0.9 -1,-0.2 0.818 89.2 61.1 -57.7 -31.7 52.8 65.0 -1.7 9 612 A N H 3> S+ 0 0 0 30,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.825 99.4 54.6 -69.9 -30.3 51.5 66.0 1.7 10 613 A E H <> S+ 0 0 95 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.900 108.4 50.2 -66.5 -38.5 48.1 66.9 0.2 11 614 A L H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.923 108.9 50.8 -62.1 -45.1 48.0 63.4 -1.2 12 615 A I H X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.942 110.2 50.2 -60.6 -44.5 48.8 61.9 2.2 13 616 A R H X S+ 0 0 81 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.899 107.0 54.9 -58.0 -41.9 46.0 64.0 3.7 14 617 A E H X S+ 0 0 66 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.900 109.4 47.3 -56.4 -42.1 43.6 62.8 1.0 15 618 A V H X S+ 0 0 2 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.874 108.9 53.8 -71.3 -38.2 44.4 59.2 1.9 16 619 A Y H >X S+ 0 0 70 -4,-2.3 4,-1.1 1,-0.2 3,-0.7 0.957 106.8 52.6 -57.5 -49.2 43.9 59.9 5.6 17 620 A V H >< S+ 0 0 93 -4,-2.6 3,-0.7 1,-0.3 4,-0.4 0.891 104.5 55.7 -56.0 -41.3 40.5 61.3 4.8 18 621 A L H 3< S+ 0 0 109 -4,-1.7 -1,-0.3 1,-0.2 4,-0.2 0.875 118.8 33.6 -55.3 -37.8 39.5 58.1 3.0 19 622 A F H S+ 0 0 123 -4,-0.4 4,-2.9 -3,-0.2 -1,-0.2 0.931 114.2 46.5 -62.7 -43.1 36.1 56.8 9.7 22 625 A K H > S+ 0 0 89 -4,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.916 113.5 48.1 -63.9 -47.2 37.8 53.4 10.0 23 626 A I H <>S+ 0 0 6 -4,-2.8 5,-2.3 2,-0.2 4,-0.3 0.938 115.3 45.1 -57.9 -49.6 40.7 54.8 12.0 24 627 A R H ><5S+ 0 0 167 -4,-2.8 3,-1.6 -5,-0.2 -2,-0.2 0.921 110.4 55.2 -57.7 -50.8 38.3 56.6 14.4 25 628 A K H 3<5S+ 0 0 147 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.889 111.8 43.8 -43.3 -50.9 36.0 53.5 14.6 26 629 A M T 3<5S- 0 0 38 -4,-2.0 40,-3.0 -5,-0.2 41,-0.4 0.391 108.6-123.2 -88.9 2.2 39.0 51.4 15.8 27 630 A N T < 5 + 0 0 97 -3,-1.6 2,-0.3 -4,-0.3 -3,-0.2 0.833 49.5 170.0 55.1 37.8 40.3 54.0 18.2 28 631 A I < - 0 0 12 -5,-2.3 2,-0.9 -6,-0.2 40,-0.2 -0.633 37.2-128.6 -78.9 131.7 43.6 54.0 16.4 29 632 A D E -b 68 0B 101 38,-2.7 40,-2.6 -2,-0.3 2,-0.4 -0.765 34.2-170.0 -81.0 106.2 46.1 56.7 17.4 30 633 A F E +b 69 0B 49 -2,-0.9 2,-0.4 38,-0.2 40,-0.2 -0.878 9.7 179.1-106.6 133.1 47.0 58.2 14.0 31 634 A C E -b 70 0B 47 38,-2.2 40,-2.8 -2,-0.4 2,-0.4 -0.995 9.2-172.3-133.1 136.0 49.8 60.8 13.6 32 635 A F E +b 71 0B 52 -2,-0.4 2,-0.3 38,-0.2 40,-0.2 -0.991 12.8 173.6-128.9 122.1 51.1 62.5 10.4 33 636 A E E -b 72 0B 103 38,-2.5 40,-1.9 -2,-0.4 2,-0.3 -0.949 5.4-178.1-126.5 148.3 54.3 64.6 10.6 34 637 A T E -b 73 0B 38 -2,-0.3 40,-0.2 38,-0.2 3,-0.1 -0.970 27.2-148.5-140.3 155.8 56.3 66.3 7.9 35 638 A D S S+ 0 0 67 38,-1.4 2,-0.3 -2,-0.3 39,-0.1 0.331 94.2 36.8-103.4 4.6 59.5 68.4 7.7 36 639 A N - 0 0 61 37,-0.3 -1,-0.3 1,-0.1 3,-0.2 -0.809 67.2-155.3-154.7 114.8 58.3 70.5 4.7 37 640 A E S S+ 0 0 129 -2,-0.3 2,-1.1 1,-0.3 -28,-0.2 0.885 94.4 47.8 -60.0 -43.9 54.7 71.5 4.3 38 641 A D S S+ 0 0 63 -29,-0.1 2,-1.3 -30,-0.1 -1,-0.3 -0.737 75.9 180.0 -99.5 85.4 54.9 71.9 0.6 39 642 A L - 0 0 0 -2,-1.1 -31,-3.0 -3,-0.2 2,-0.3 -0.678 13.1-161.8 -92.7 87.4 56.6 68.6 -0.2 40 643 A R E +A 7 0A 129 -2,-1.3 2,-0.3 -33,-0.2 -33,-0.2 -0.528 16.6 166.5 -81.8 133.2 56.9 68.9 -4.0 41 644 A V E -A 6 0A 1 -35,-2.1 -35,-2.2 -2,-0.3 2,-0.6 -0.994 34.3-133.9-142.8 145.2 57.4 65.7 -6.0 42 645 A E E +A 5 0A 68 104,-1.6 2,-0.3 -2,-0.3 -37,-0.2 -0.911 57.0 119.3 -97.1 118.8 57.2 64.8 -9.7 43 646 A A E S-A 4 0A 0 -39,-2.6 -39,-2.4 -2,-0.6 2,-1.1 -0.969 75.5 -79.1-165.3 168.9 55.4 61.5 -9.9 44 647 A D > - 0 0 15 -2,-0.3 4,-2.5 -41,-0.2 5,-0.3 -0.789 45.1-159.4 -83.6 104.7 52.4 59.7 -11.2 45 648 A R H > S+ 0 0 67 -2,-1.1 4,-2.4 -43,-0.5 -1,-0.2 0.849 85.7 51.0 -57.0 -41.1 49.9 60.9 -8.6 46 649 A T H > S+ 0 0 95 -44,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.912 112.4 47.3 -63.9 -42.9 47.3 58.2 -9.1 47 650 A R H > S+ 0 0 49 2,-0.2 4,-1.9 -3,-0.2 -2,-0.2 0.885 112.1 48.0 -69.0 -40.4 50.0 55.5 -8.7 48 651 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.898 109.6 55.3 -66.6 -36.8 51.6 57.0 -5.6 49 652 A K H X S+ 0 0 52 -4,-2.4 4,-3.0 -5,-0.3 5,-0.2 0.929 105.2 52.5 -57.8 -46.5 48.0 57.3 -4.2 50 653 A Q H X S+ 0 0 90 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.909 108.8 49.7 -55.0 -45.5 47.6 53.6 -4.8 51 654 A V H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.951 112.9 47.0 -59.1 -49.7 50.8 52.9 -2.8 52 655 A L H X S+ 0 0 1 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.902 111.2 50.2 -60.9 -45.0 49.7 55.1 0.1 53 656 A I H X S+ 0 0 54 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.942 112.5 48.6 -59.2 -45.0 46.2 53.5 0.2 54 657 A N H X S+ 0 0 38 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.940 113.2 46.0 -59.5 -47.0 47.8 50.1 0.2 55 658 A L H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.888 114.8 47.0 -67.2 -38.7 50.2 50.9 3.0 56 659 A V H X S+ 0 0 2 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.935 112.2 50.0 -69.9 -42.4 47.6 52.6 5.1 57 660 A Q H X S+ 0 0 70 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.937 112.8 47.4 -57.9 -47.5 45.1 49.7 4.7 58 661 A N H X S+ 0 0 18 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.907 110.6 52.3 -60.5 -42.2 47.8 47.2 5.7 59 662 A A H X S+ 0 0 2 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.918 111.3 46.2 -61.9 -43.4 48.7 49.4 8.7 60 663 A I H X S+ 0 0 5 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.943 113.8 48.0 -66.0 -47.1 45.1 49.5 9.9 61 664 A E H < S+ 0 0 126 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.895 117.1 43.7 -56.6 -43.0 44.6 45.8 9.4 62 665 A A H < S+ 0 0 46 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.873 112.2 49.4 -74.4 -38.0 47.9 44.9 11.2 63 666 A T H < S- 0 0 18 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.818 89.5-169.3 -77.2 -33.3 47.6 47.3 14.2 64 667 A G >< - 0 0 24 -4,-1.7 3,-1.6 -5,-0.2 -1,-0.1 -0.074 41.5 -12.4 72.4-171.5 44.1 46.4 15.2 65 668 A E T 3 S+ 0 0 160 1,-0.3 -38,-0.2 -37,-0.1 -39,-0.1 -0.316 135.6 11.9 -66.3 138.2 41.8 48.1 17.7 66 669 A N T 3 S+ 0 0 104 -40,-3.0 -1,-0.3 1,-0.1 -38,-0.2 0.651 101.5 144.1 66.2 18.9 43.5 50.7 19.9 67 670 A G < - 0 0 3 -3,-1.6 -38,-2.7 -41,-0.4 2,-0.4 0.116 44.8-122.3 -75.8-169.0 46.5 50.5 17.6 68 671 A K E -b 29 0B 96 19,-0.3 19,-2.0 -40,-0.2 2,-0.4 -0.999 21.1-178.3-143.6 135.3 48.9 53.2 16.5 69 672 A I E -bC 30 86B 2 -40,-2.6 -38,-2.2 -2,-0.4 2,-0.4 -1.000 2.7-173.7-135.0 133.7 49.9 54.5 13.0 70 673 A K E -bC 31 85B 74 15,-2.3 15,-3.0 -2,-0.4 2,-0.5 -0.993 3.3-168.9-128.0 127.6 52.5 57.2 12.2 71 674 A I E -bC 32 84B 4 -40,-2.8 -38,-2.5 -2,-0.4 2,-0.4 -0.952 8.5-175.9-108.9 132.2 53.2 58.6 8.8 72 675 A T E -bC 33 83B 27 11,-2.3 11,-2.6 -2,-0.5 2,-0.4 -0.986 7.4-166.1-125.4 138.3 56.2 60.8 8.2 73 676 A S E -bC 34 82B 0 -40,-1.9 -38,-1.4 -2,-0.4 2,-0.4 -0.986 10.5-172.0-124.4 138.4 57.2 62.6 5.1 74 677 A E E - C 0 81B 19 7,-2.6 7,-2.6 -2,-0.4 2,-0.7 -0.993 22.2-139.7-139.0 134.4 60.6 64.1 4.6 75 678 A D E + C 0 80B 26 -2,-0.4 5,-0.2 5,-0.2 3,-0.1 -0.829 22.4 177.4 -93.4 111.7 62.3 66.3 2.0 76 679 A M - 0 0 2 3,-2.5 2,-2.0 -2,-0.7 150,-0.3 -0.115 43.7-111.6-113.3 36.0 65.8 65.0 1.4 77 680 A Y S S+ 0 0 119 1,-0.3 -1,-0.1 148,-0.2 148,-0.1 -0.505 109.5 26.5 89.1 -84.7 67.1 67.3 -1.3 78 681 A T S S+ 0 0 100 -2,-2.0 68,-1.7 67,-0.1 69,-0.4 0.365 132.9 24.9 -98.3 3.1 67.3 64.9 -4.3 79 682 A K E - D 0 145B 34 66,-0.3 -3,-2.5 67,-0.1 2,-0.4 -0.975 67.8-133.1-157.8 161.0 64.6 62.6 -3.0 80 683 A V E -CD 75 144B 0 64,-2.4 64,-1.9 -2,-0.3 2,-0.4 -0.940 19.6-151.8-120.1 148.9 61.5 62.5 -0.8 81 684 A R E -CD 74 143B 15 -7,-2.6 -7,-2.6 -2,-0.4 2,-0.4 -0.974 9.1-171.0-124.4 133.9 60.9 59.8 1.8 82 685 A V E -CD 73 142B 0 60,-2.7 60,-2.8 -2,-0.4 2,-0.4 -0.993 6.1-170.1-121.5 131.3 57.6 58.5 3.2 83 686 A S E -CD 72 141B 10 -11,-2.6 -11,-2.3 -2,-0.4 2,-0.5 -0.980 5.5-168.6-120.9 132.2 57.5 56.2 6.2 84 687 A V E +CD 71 140B 2 56,-3.0 56,-2.4 -2,-0.4 2,-0.4 -0.960 14.9 180.0-121.6 111.2 54.3 54.4 7.3 85 688 A W E +CD 70 139B 48 -15,-3.0 -15,-2.3 -2,-0.5 2,-0.3 -0.863 7.1 178.8-112.7 144.4 54.7 52.7 10.7 86 689 A N E -CD 69 138B 8 52,-2.2 52,-2.4 -2,-0.4 -17,-0.2 -0.998 32.2-117.0-137.3 144.4 52.2 50.7 12.7 87 690 A S E S+ D 0 137B 22 -19,-2.0 50,-0.3 -2,-0.3 -19,-0.3 -0.556 71.1 87.6 -67.0 143.2 52.3 49.0 16.1 88 691 A G S S- 0 0 24 48,-2.3 -25,-0.1 -2,-0.2 -26,-0.1 -0.952 76.4 -18.0 154.3-168.2 51.8 45.3 15.5 89 692 A P - 0 0 85 0, 0.0 2,-0.1 0, 0.0 -27,-0.0 -0.314 65.9-115.0 -70.3 146.1 53.5 41.9 14.7 90 693 A P - 0 0 85 0, 0.0 48,-0.1 0, 0.0 43,-0.1 -0.363 25.8-105.9 -75.8 156.1 57.0 42.0 13.1 91 694 A I - 0 0 29 46,-0.2 5,-0.1 -2,-0.1 42,-0.1 -0.749 44.4-112.3 -75.7 123.2 57.8 40.8 9.6 92 695 A P > - 0 0 58 0, 0.0 3,-2.2 0, 0.0 4,-0.4 -0.311 23.0-122.2 -55.7 140.1 59.6 37.5 10.1 93 696 A E G > S+ 0 0 120 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.859 111.2 57.3 -55.9 -37.9 63.3 37.9 9.1 94 697 A E G 3 S+ 0 0 156 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.570 108.2 48.6 -70.1 -9.2 63.0 35.1 6.5 95 698 A L G <> S+ 0 0 54 -3,-2.2 4,-2.7 2,-0.1 -1,-0.3 0.357 75.2 107.5-110.6 2.4 60.1 37.0 4.8 96 699 A K T <4 S+ 0 0 29 -3,-1.3 35,-0.1 -4,-0.4 -2,-0.1 0.835 97.7 21.6 -53.6 -41.8 61.7 40.5 4.6 97 700 A E T >4 S+ 0 0 128 -4,-0.3 3,-2.0 -3,-0.1 -1,-0.2 0.833 118.4 63.3 -90.6 -38.8 62.2 40.2 0.8 98 701 A K G >4 S+ 0 0 93 -4,-0.3 3,-2.3 1,-0.3 6,-0.2 0.795 88.6 68.6 -61.1 -32.8 59.6 37.6 0.1 99 702 A I G 3< S+ 0 0 8 -4,-2.7 13,-0.4 1,-0.3 15,-0.3 0.726 97.7 55.8 -60.8 -16.6 56.7 39.8 1.2 100 703 A F G < S+ 0 0 9 -3,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.463 86.6 102.9 -91.1 -0.5 57.5 41.9 -1.9 101 704 A S S X S- 0 0 37 -3,-2.3 3,-1.7 -4,-0.2 14,-0.3 -0.557 78.1-130.0 -79.7 144.7 57.1 38.9 -4.3 102 705 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 11,-0.1 0.727 108.9 62.1 -64.0 -12.9 53.9 38.6 -6.3 103 706 A F T 3 S+ 0 0 172 -5,-0.1 2,-0.5 2,-0.0 8,-0.1 0.456 76.2 106.6 -94.9 0.9 53.8 35.0 -5.0 104 707 A F < + 0 0 26 -3,-1.7 2,-0.3 -6,-0.2 8,-0.1 -0.656 45.8 161.3 -78.2 126.5 53.5 36.0 -1.4 105 708 A T - 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