==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 07-MAR-79 1ECD . COMPND 2 MOLECULE: ERYTHROCRUORIN (AQUO MET); . SOURCE 2 ORGANISM_SCIENTIFIC: CHIRONOMUS THUMMI THUMMI; . AUTHOR W.STEIGEMANN,E.WEBER . 136 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7063.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 80.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 4 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 84 61.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 2 0 0 0 0 0 0 2 1 0 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 . 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 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 1 A L 0 0 69 0, 0.0 2,-0.2 0, 0.0 119,-0.0 0.000 360.0 360.0 360.0 102.2 -14.2 10.7 26.4 2 2 A S >> - 0 0 60 1,-0.0 4,-2.1 72,-0.0 3,-0.6 -0.610 360.0 -89.6-120.0 176.0 -16.0 7.4 25.7 3 3 A A H 3> S+ 0 0 77 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.771 120.1 57.5 -61.8 -30.4 -15.1 4.3 23.7 4 4 A D H 3> S+ 0 0 96 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.918 112.4 40.5 -68.4 -43.2 -16.5 5.4 20.4 5 5 A Q H <> S+ 0 0 49 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.837 113.1 55.4 -72.1 -33.7 -14.3 8.5 20.4 6 6 A I H X S+ 0 0 21 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.901 108.1 48.4 -69.3 -40.5 -11.3 6.6 21.7 7 7 A S H X S+ 0 0 63 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.864 109.4 53.1 -68.8 -37.1 -11.4 4.1 18.9 8 8 A T H X S+ 0 0 53 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.900 111.2 45.2 -58.9 -45.3 -11.7 6.8 16.3 9 9 A V H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.872 113.2 50.7 -68.4 -35.3 -8.6 8.6 17.6 10 10 A Q H X S+ 0 0 68 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.844 110.0 48.6 -80.8 -34.2 -6.7 5.4 17.8 11 11 A A H X S+ 0 0 63 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.883 113.5 49.4 -62.0 -41.8 -7.5 4.4 14.3 12 12 A S H >< S+ 0 0 13 -4,-1.9 3,-0.6 1,-0.2 4,-0.4 0.920 111.7 47.3 -64.9 -46.1 -6.5 7.8 13.2 13 13 A F H >X S+ 0 0 7 -4,-2.9 4,-1.6 1,-0.2 3,-1.2 0.779 98.7 68.4 -64.5 -29.8 -3.2 7.7 15.0 14 14 A D H 3< S+ 0 0 96 -4,-1.3 4,-0.3 1,-0.3 -1,-0.2 0.830 95.1 59.0 -64.0 -31.5 -2.3 4.3 13.7 15 15 A K T << S+ 0 0 147 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.749 117.7 27.1 -64.6 -26.8 -2.0 5.8 10.3 16 16 A V T X4 S+ 0 0 7 -3,-1.2 3,-2.3 -4,-0.4 -2,-0.2 0.477 87.6 98.6-116.8 -6.5 0.8 8.3 11.3 17 17 A K T 3< S+ 0 0 102 -4,-1.6 -3,-0.1 1,-0.3 -2,-0.1 0.658 77.3 65.4 -66.1 -16.5 2.6 6.7 14.3 18 18 A G T 3 S+ 0 0 77 -4,-0.3 -1,-0.3 1,-0.2 3,-0.2 0.403 91.5 68.2 -82.2 1.6 5.3 5.5 12.0 19 19 A D <> + 0 0 56 -3,-2.3 4,-1.4 1,-0.1 -1,-0.2 -0.400 50.7 147.9-120.5 55.4 6.4 9.1 11.2 20 20 A P H > S+ 0 0 11 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.859 73.3 55.4 -45.5 -44.2 7.8 10.4 14.5 21 21 A V H > S+ 0 0 26 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.919 107.7 49.1 -63.9 -43.5 10.3 12.7 12.7 22 22 A G H > S+ 0 0 9 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.822 110.8 49.3 -66.1 -32.0 7.6 14.4 10.7 23 23 A I H X S+ 0 0 5 -4,-1.4 4,-1.6 2,-0.2 -1,-0.2 0.898 112.6 47.3 -75.7 -40.3 5.4 15.0 13.7 24 24 A L H X S+ 0 0 5 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.879 109.2 54.6 -72.2 -38.4 8.3 16.5 15.7 25 25 A Y H X S+ 0 0 38 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.920 106.4 52.0 -55.1 -47.0 9.3 18.7 12.7 26 26 A A H X S+ 0 0 12 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.862 111.1 47.6 -59.6 -38.0 5.7 20.1 12.6 27 27 A V H X S+ 0 0 1 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.942 112.2 47.1 -69.4 -50.2 5.9 20.9 16.3 28 28 A F H < S+ 0 0 1 -4,-2.7 7,-0.3 1,-0.2 -2,-0.2 0.838 111.5 53.4 -58.1 -35.5 9.3 22.6 16.1 29 29 A K H < S+ 0 0 119 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.845 105.0 53.2 -70.9 -35.5 8.2 24.6 13.1 30 30 A A H < S+ 0 0 48 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.814 128.9 14.3 -66.9 -31.9 5.1 25.9 14.8 31 31 A D >X - 0 0 20 -4,-1.4 3,-2.1 -5,-0.1 4,-0.9 -0.697 59.6-170.6-150.6 94.9 7.2 27.2 17.7 32 32 A P H 3> S+ 0 0 85 0, 0.0 4,-1.9 0, 0.0 -3,-0.1 0.625 84.5 72.3 -57.8 -16.3 11.0 27.6 17.4 33 33 A S H 34 S+ 0 0 51 2,-0.2 4,-0.2 1,-0.2 -5,-0.1 0.708 93.7 55.2 -74.6 -21.2 11.3 28.3 21.1 34 34 A I H X4 S+ 0 0 22 -3,-2.1 3,-1.3 -6,-0.2 4,-0.3 0.919 107.5 49.1 -69.7 -48.9 10.5 24.7 21.8 35 35 A M H >< S+ 0 0 19 -4,-0.9 3,-1.7 -7,-0.3 6,-0.3 0.864 102.1 64.1 -55.9 -39.8 13.4 23.7 19.5 36 36 A A T 3< S+ 0 0 61 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.576 89.8 66.5 -64.3 -12.1 15.7 26.1 21.4 37 37 A K T < S+ 0 0 98 -3,-1.3 2,-0.7 -4,-0.2 -1,-0.3 0.587 83.4 84.4 -79.9 -12.8 15.3 24.2 24.6 38 38 A F X> - 0 0 47 -3,-1.7 4,-2.4 -4,-0.3 3,-1.2 -0.840 68.2-155.6 -96.1 116.7 17.2 21.2 23.2 39 39 A T T 34 S+ 0 0 140 -2,-0.7 -1,-0.2 1,-0.3 -4,-0.0 0.836 94.1 57.9 -61.5 -32.5 20.9 21.8 23.5 40 40 A Q T 34 S+ 0 0 88 1,-0.2 -1,-0.3 -3,-0.1 15,-0.1 0.701 119.1 26.2 -71.6 -21.6 21.4 19.4 20.5 41 41 A F T X4 S+ 0 0 2 -3,-1.2 3,-1.6 -6,-0.3 -2,-0.2 0.561 86.1 118.4-113.7 -13.9 19.3 21.5 18.2 42 42 A A T 3< S+ 0 0 45 -4,-2.4 -6,-0.1 1,-0.3 3,-0.1 -0.275 84.1 15.4 -59.6 139.8 19.4 25.1 19.4 43 43 A G T 3 S+ 0 0 88 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.607 103.0 108.9 69.5 14.6 21.0 27.4 16.9 44 44 A K S < S- 0 0 115 -3,-1.6 2,-0.6 2,-0.0 -1,-0.2 -0.665 77.6 -94.7-116.7 175.4 20.7 25.1 13.9 45 45 A D >> - 0 0 83 -2,-0.2 4,-1.6 1,-0.2 3,-0.9 -0.791 26.0-147.0 -98.0 121.6 18.5 25.1 10.8 46 46 A L H 3> S+ 0 0 20 -2,-0.6 4,-1.7 1,-0.3 3,-0.2 0.875 98.6 57.2 -54.4 -41.1 15.4 22.9 11.3 47 47 A E H 34 S+ 0 0 109 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.786 109.5 47.0 -65.2 -28.4 15.4 21.9 7.7 48 48 A S H <4 S+ 0 0 81 -3,-0.9 -1,-0.2 1,-0.1 -2,-0.2 0.744 113.4 43.3 -82.4 -27.4 18.9 20.6 8.0 49 49 A I H >< S+ 0 0 11 -4,-1.6 3,-2.1 -3,-0.2 6,-0.4 0.632 89.4 88.8 -90.3 -17.2 18.6 18.6 11.2 50 50 A K T 3< S+ 0 0 79 -4,-1.7 -1,-0.1 1,-0.3 -2,-0.1 0.808 92.3 43.0 -51.3 -37.9 15.3 17.0 10.3 51 51 A G T 3 S+ 0 0 77 -4,-0.3 -1,-0.3 -3,-0.2 2,-0.2 0.172 94.1 105.3 -93.8 17.9 17.0 14.1 8.6 52 52 A T S <> S- 0 0 55 -3,-2.1 4,-1.7 1,-0.1 3,-0.3 -0.580 78.0-113.0-100.9 162.3 19.7 13.3 11.1 53 53 A A H > S+ 0 0 70 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.834 112.7 54.3 -64.1 -37.4 20.1 10.5 13.7 54 54 A P H > S+ 0 0 53 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.868 106.6 52.1 -61.4 -39.2 19.8 12.7 16.8 55 55 A F H > S+ 0 0 0 -6,-0.4 4,-2.5 -3,-0.3 -2,-0.2 0.910 110.4 48.6 -64.3 -42.6 16.5 14.2 15.6 56 56 A E H X S+ 0 0 98 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.870 108.7 53.1 -66.2 -38.9 15.1 10.7 15.0 57 57 A T H X S+ 0 0 66 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.940 114.0 42.1 -61.0 -49.6 16.2 9.5 18.4 58 58 A H H X S+ 0 0 45 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.895 113.5 52.0 -60.7 -42.7 14.5 12.4 20.1 59 59 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.5 0.882 107.6 53.2 -66.2 -37.7 11.4 12.2 18.0 60 60 A N H X S+ 0 0 77 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.875 111.4 45.5 -67.4 -39.1 11.1 8.5 18.8 61 61 A R H X S+ 0 0 162 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.901 117.3 42.4 -62.6 -44.4 11.2 9.2 22.5 62 62 A I H X S+ 0 0 50 -4,-2.3 4,-1.8 2,-0.2 3,-0.3 0.949 121.1 38.1 -79.1 -50.4 8.7 12.0 22.5 63 63 A V H X S+ 0 0 10 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.795 111.4 62.9 -71.5 -29.6 6.2 10.6 20.1 64 64 A G H X S+ 0 0 40 -4,-1.1 4,-1.3 -5,-0.5 -1,-0.2 0.852 105.9 43.6 -55.3 -40.2 6.7 7.2 21.7 65 65 A F H X S+ 0 0 65 -4,-1.4 4,-1.5 -3,-0.3 -2,-0.2 0.865 111.5 53.1 -75.2 -39.0 5.4 8.5 25.0 66 66 A F H X S+ 0 0 16 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.906 107.2 54.5 -59.9 -41.6 2.6 10.3 23.4 67 67 A S H X S+ 0 0 44 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.860 103.3 54.4 -59.3 -39.2 1.8 6.9 21.8 68 68 A K H X S+ 0 0 96 -4,-1.3 4,-1.2 2,-0.2 -1,-0.2 0.898 109.7 48.9 -53.6 -41.3 1.7 5.3 25.2 69 69 A I H >< S+ 0 0 6 -4,-1.5 3,-0.5 1,-0.2 4,-0.4 0.921 110.7 47.6 -77.2 -44.1 -0.9 7.9 26.2 70 70 A I H >< S+ 0 0 6 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.879 109.1 56.9 -63.5 -38.9 -3.1 7.4 23.2 71 71 A G H 3< S+ 0 0 53 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.760 110.6 42.1 -61.0 -29.2 -2.9 3.7 23.6 72 72 A E T X< S- 0 0 43 -4,-1.2 3,-2.6 -3,-0.5 -1,-0.2 0.264 89.7-176.2-105.3 11.3 -4.3 3.8 27.2 73 73 A L T < + 0 0 17 -3,-0.9 -3,-0.0 -4,-0.4 51,-0.0 -0.251 63.0 17.1 -54.6 142.0 -7.1 6.3 27.0 74 74 A P T 3 S+ 0 0 79 0, 0.0 2,-1.8 0, 0.0 -1,-0.4 -0.958 110.1 72.8-100.1 23.2 -8.6 7.2 29.0 75 75 A N < + 0 0 121 -3,-2.6 4,-0.2 1,-0.2 3,-0.1 -0.554 59.4 129.1 -96.1 73.8 -6.5 6.1 32.0 76 76 A I > + 0 0 3 -2,-1.8 4,-2.0 1,-0.1 3,-0.3 0.462 28.7 100.2-110.6 -3.6 -3.8 8.7 31.5 77 77 A E H > S+ 0 0 108 -3,-0.2 4,-2.2 1,-0.2 5,-0.1 0.841 81.5 52.1 -54.9 -43.6 -3.2 10.4 34.9 78 78 A A H > S+ 0 0 64 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.893 112.0 47.6 -64.5 -40.4 -0.1 8.6 36.0 79 79 A D H > S+ 0 0 18 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.840 109.3 52.0 -71.1 -35.3 1.7 9.3 32.7 80 80 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.875 107.7 54.5 -63.8 -39.2 0.7 13.0 32.8 81 81 A N H X S+ 0 0 78 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.929 109.0 47.1 -59.2 -47.7 2.2 13.1 36.3 82 82 A T H X S+ 0 0 82 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.899 111.0 52.4 -59.7 -43.8 5.4 11.7 35.0 83 83 A F H X S+ 0 0 30 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.907 109.7 48.0 -55.6 -45.8 5.4 14.2 32.1 84 84 A V H X S+ 0 0 17 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.895 107.7 56.6 -66.0 -41.0 4.9 17.1 34.6 85 85 A A H < S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.837 115.0 36.6 -58.8 -36.6 7.7 15.8 36.8 86 86 A S H < S+ 0 0 48 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.755 126.1 37.4 -87.4 -27.9 10.3 15.9 33.9 87 87 A H H ><>S+ 0 0 49 -4,-2.1 5,-1.3 -5,-0.2 3,-0.6 0.722 98.1 70.8-100.0 -25.3 9.0 19.0 32.2 88 88 A K G ><5S+ 0 0 132 -4,-2.9 3,-1.3 1,-0.2 -3,-0.1 0.893 100.3 51.5 -56.7 -43.6 7.9 21.4 34.9 89 89 A P G 3 5S+ 0 0 106 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.628 101.1 61.5 -71.2 -15.6 11.6 22.0 35.9 90 90 A R G < 5S- 0 0 145 -3,-0.6 -2,-0.2 -4,-0.1 -3,-0.1 0.373 112.4-120.0 -84.2 2.7 12.5 22.7 32.3 91 91 A G T < 5 + 0 0 39 -3,-1.3 -3,-0.2 1,-0.2 2,-0.1 0.734 43.4 177.5 63.7 27.5 10.1 25.7 32.4 92 92 A V < - 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