==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE, OXYGEN TRANSPORT 03-NOV-11 3UHD . COMPND 2 MOLECULE: GLOBIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: SCAPHARCA INAEQUIVALVIS; . AUTHOR Z.REN,V.SRAJER,J.E.KNAPP,W.E.ROYER JR. . 289 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13899.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 83.4 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 . 10 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 21.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 163 56.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 1 0 0 2 0 0 1 0 1 3 3 0 0 2 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 2 A S > 0 0 95 0, 0.0 4,-2.0 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 123.2 38.5 -21.7 23.8 2 3 A V H > + 0 0 13 141,-0.3 4,-2.0 1,-0.2 5,-0.1 0.813 360.0 55.5 -62.4 -29.4 36.7 -18.4 24.0 3 4 A Y H > S+ 0 0 120 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.866 107.3 46.2 -72.7 -37.4 33.7 -20.3 25.4 4 5 A D H 4 S+ 0 0 114 2,-0.2 4,-0.5 -3,-0.2 -2,-0.2 0.853 112.4 52.7 -72.6 -32.9 35.7 -21.8 28.3 5 6 A A H >< S+ 0 0 18 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.910 106.9 51.7 -66.6 -42.5 37.2 -18.4 29.0 6 7 A A H >< S+ 0 0 9 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.830 101.6 62.0 -63.0 -32.4 33.8 -16.8 29.2 7 8 A A T 3< S+ 0 0 69 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.692 89.5 70.9 -67.1 -18.8 32.8 -19.5 31.7 8 9 A Q T < S+ 0 0 104 -3,-1.3 2,-1.7 -4,-0.5 -1,-0.3 0.572 72.4 95.6 -74.5 -9.2 35.5 -18.2 34.0 9 10 A L < + 0 0 15 -3,-1.6 -1,-0.1 -4,-0.2 -3,-0.0 -0.615 62.6 178.7 -85.7 83.1 33.4 -15.1 34.6 10 11 A T > - 0 0 71 -2,-1.7 4,-2.8 1,-0.1 5,-0.2 -0.147 45.5 -90.4 -77.6 175.9 31.7 -16.2 37.8 11 12 A A H > S+ 0 0 75 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.914 127.4 47.5 -53.3 -49.6 29.2 -14.3 39.9 12 13 A D H > S+ 0 0 127 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.907 112.4 49.3 -61.0 -43.5 32.0 -12.7 42.0 13 14 A V H > S+ 0 0 19 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.917 110.8 49.9 -62.9 -44.2 34.0 -11.8 39.0 14 15 A K H X S+ 0 0 60 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.892 109.4 51.3 -62.8 -40.2 31.1 -10.1 37.3 15 16 A K H X S+ 0 0 115 -4,-2.2 4,-3.0 -5,-0.2 -1,-0.2 0.921 110.3 48.9 -63.6 -44.0 30.2 -8.1 40.4 16 17 A D H X S+ 0 0 28 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.859 110.6 51.1 -64.1 -36.4 33.7 -6.8 40.7 17 18 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.948 114.1 43.6 -66.0 -47.4 33.8 -5.8 37.0 18 19 A R H X S+ 0 0 79 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.936 113.0 51.3 -62.8 -48.8 30.5 -3.9 37.3 19 20 A D H X S+ 0 0 55 -4,-3.0 4,-0.6 1,-0.2 -1,-0.2 0.904 116.0 40.2 -56.6 -45.5 31.4 -2.2 40.6 20 21 A S H >X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.2 3,-0.7 0.837 110.9 58.3 -74.6 -31.9 34.7 -1.0 39.3 21 22 A W H 3X S+ 0 0 17 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.835 94.1 66.4 -66.7 -30.7 33.2 -0.1 35.9 22 23 A K H 3< S+ 0 0 161 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.858 111.9 35.1 -57.2 -33.7 30.7 2.2 37.6 23 24 A V H X< S+ 0 0 56 -3,-0.7 3,-1.0 -4,-0.6 4,-0.3 0.944 123.3 36.8 -86.8 -56.0 33.7 4.4 38.5 24 25 A I H >< S+ 0 0 11 -4,-2.1 3,-0.6 1,-0.2 7,-0.2 0.727 114.0 58.2 -72.1 -21.9 36.2 4.2 35.7 25 26 A G T 3< S+ 0 0 4 -4,-2.1 3,-0.5 -5,-0.3 -1,-0.2 0.546 87.9 76.9 -84.6 -6.1 33.5 4.2 33.1 26 27 A S T < S+ 0 0 96 -3,-1.0 2,-0.3 1,-0.3 -1,-0.2 0.699 101.9 38.4 -74.3 -22.0 32.1 7.5 34.3 27 28 A D <> + 0 0 76 -3,-0.6 4,-2.6 -4,-0.3 5,-0.4 -0.661 67.8 165.2-130.5 77.1 34.9 9.4 32.6 28 29 A K H > S+ 0 0 36 -3,-0.5 4,-1.5 -2,-0.3 5,-0.2 0.863 76.7 48.0 -61.2 -39.9 35.6 7.6 29.3 29 30 A K H > S+ 0 0 60 2,-0.2 4,-2.1 3,-0.2 5,-0.3 0.967 116.9 41.1 -67.5 -52.2 37.6 10.4 27.7 30 31 A G H > S+ 0 0 22 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.945 122.9 36.9 -61.5 -53.5 39.9 10.9 30.8 31 32 A N H X S+ 0 0 11 -4,-2.6 4,-2.2 -7,-0.2 -1,-0.2 0.777 114.0 58.0 -72.7 -26.9 40.4 7.3 31.7 32 33 A G H X S+ 0 0 0 -4,-1.5 4,-2.0 -5,-0.4 -2,-0.2 0.943 110.6 41.0 -67.6 -47.9 40.5 6.1 28.1 33 34 A V H X S+ 0 0 9 -4,-2.1 4,-2.9 -5,-0.2 5,-0.3 0.849 112.4 57.8 -67.5 -32.9 43.4 8.4 27.2 34 35 A A H X S+ 0 0 32 -4,-1.6 4,-1.8 -5,-0.3 -2,-0.2 0.923 106.1 48.8 -62.5 -44.4 45.0 7.5 30.5 35 36 A L H X S+ 0 0 11 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.943 114.5 45.0 -59.9 -49.3 45.0 3.8 29.6 36 37 A M H X S+ 0 0 3 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.916 112.1 49.2 -63.6 -46.3 46.5 4.5 26.2 37 38 A T H X S+ 0 0 50 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.843 112.0 50.5 -63.9 -32.1 49.2 6.9 27.4 38 39 A T H X S+ 0 0 29 -4,-1.8 4,-2.9 -5,-0.3 5,-0.3 0.898 108.5 52.3 -71.0 -40.3 50.2 4.4 30.1 39 40 A L H X S+ 0 0 17 -4,-2.1 4,-2.5 1,-0.2 7,-0.2 0.932 112.2 44.9 -59.7 -47.3 50.4 1.6 27.5 40 41 A F H < S+ 0 0 11 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.802 115.2 48.6 -68.3 -29.9 52.7 3.7 25.3 41 42 A A H < S+ 0 0 72 -4,-1.5 3,-0.4 -5,-0.2 -2,-0.2 0.900 119.8 35.5 -76.6 -42.9 54.8 4.7 28.3 42 43 A D H < S+ 0 0 73 -4,-2.9 2,-0.2 1,-0.2 -2,-0.2 0.769 129.3 33.6 -82.5 -28.7 55.2 1.2 29.8 43 44 A N >< + 0 0 34 -4,-2.5 3,-2.4 -5,-0.3 4,-0.3 -0.569 63.2 168.8-129.5 70.9 55.4 -0.6 26.5 44 45 A Q G > S+ 0 0 151 -3,-0.4 3,-1.4 1,-0.3 4,-0.4 0.761 72.1 71.8 -50.7 -30.2 57.2 1.6 24.0 45 46 A E G 3 S+ 0 0 108 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.586 91.1 59.3 -66.6 -8.7 57.5 -1.3 21.5 46 47 A T G X S+ 0 0 7 -3,-2.4 3,-1.3 -7,-0.2 4,-0.5 0.605 79.6 85.4 -94.6 -13.9 53.7 -1.1 20.9 47 48 A I G X S+ 0 0 61 -3,-1.4 3,-1.8 -4,-0.3 -1,-0.2 0.844 77.8 67.5 -56.1 -36.8 53.7 2.5 19.6 48 49 A G G > S+ 0 0 58 -4,-0.4 3,-0.9 1,-0.3 -1,-0.3 0.791 91.2 62.0 -55.5 -31.3 54.5 1.4 16.1 49 50 A Y G < S+ 0 0 99 -3,-1.3 3,-0.3 1,-0.2 -1,-0.3 0.753 96.9 60.7 -67.0 -23.8 51.2 -0.4 15.7 50 51 A F G X + 0 0 50 -3,-1.8 3,-1.4 -4,-0.5 4,-0.4 -0.076 60.4 135.7 -98.8 35.1 49.4 3.0 16.1 51 52 A K G X + 0 0 179 -3,-0.9 3,-2.3 1,-0.3 -1,-0.2 0.890 66.1 61.4 -44.8 -51.5 50.8 4.8 13.1 52 53 A R G 3 S+ 0 0 99 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.766 93.6 62.5 -51.5 -32.5 47.5 6.2 12.1 53 54 A L G < S- 0 0 5 -3,-1.4 12,-0.4 1,-0.2 -1,-0.3 0.578 94.3-150.1 -73.3 -8.9 47.0 8.2 15.3 54 55 A G < + 0 0 51 -3,-2.3 2,-1.4 -4,-0.4 -1,-0.2 -0.535 63.7 10.3 79.1-141.8 50.1 10.3 14.6 55 56 A D > - 0 0 92 -2,-0.2 3,-1.5 1,-0.2 10,-0.1 -0.616 64.0-179.6 -79.1 93.2 52.1 11.7 17.5 56 57 A V G > S+ 0 0 12 -2,-1.4 3,-1.8 1,-0.3 -1,-0.2 0.654 70.7 78.4 -68.0 -16.5 50.6 9.8 20.5 57 58 A S G 3 S+ 0 0 96 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.660 79.9 72.6 -67.7 -12.8 53.0 11.6 22.9 58 59 A Q G X S- 0 0 110 -3,-1.5 3,-1.9 1,-0.2 -1,-0.3 0.582 81.0-176.5 -77.0 -9.8 50.6 14.6 22.6 59 60 A G G X + 0 0 10 -3,-1.8 3,-2.0 1,-0.3 7,-0.2 -0.218 65.2 8.1 53.8-128.8 48.0 12.7 24.7 60 61 A M G 3 S+ 0 0 83 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.717 124.8 65.5 -56.7 -25.5 44.7 14.5 25.0 61 62 A A G < S+ 0 0 74 -3,-1.9 2,-0.8 4,-0.0 -1,-0.3 0.686 81.9 89.3 -73.0 -18.3 45.8 17.2 22.5 62 63 A N <> - 0 0 21 -3,-2.0 4,-2.5 1,-0.2 5,-0.2 -0.728 64.7-160.7 -84.2 110.9 45.8 14.5 19.8 63 64 A D H > S+ 0 0 89 -2,-0.8 4,-2.4 1,-0.2 5,-0.2 0.887 90.2 49.1 -59.0 -42.8 42.4 14.5 18.2 64 65 A K H > S+ 0 0 105 -11,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.887 112.2 48.1 -66.2 -38.5 42.8 11.0 16.7 65 66 A L H > S+ 0 0 0 -12,-0.4 4,-2.9 2,-0.2 -2,-0.2 0.910 111.9 50.0 -67.8 -40.6 44.1 9.5 19.9 66 67 A R H X S+ 0 0 23 -4,-2.5 4,-2.4 -7,-0.2 5,-0.2 0.914 111.6 47.8 -64.0 -42.6 41.2 11.1 21.8 67 68 A G H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.891 114.1 47.7 -64.9 -38.8 38.7 9.7 19.4 68 69 A H H X S+ 0 0 36 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.922 112.1 49.4 -66.2 -46.3 40.3 6.3 19.5 69 70 A S H X S+ 0 0 0 -4,-2.9 4,-1.7 2,-0.2 -2,-0.2 0.893 110.5 48.3 -62.0 -45.0 40.5 6.3 23.3 70 71 A I H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 3,-0.3 0.948 112.7 49.5 -61.2 -47.8 36.8 7.2 23.8 71 72 A T H X S+ 0 0 22 -4,-1.8 4,-0.8 1,-0.2 3,-0.4 0.872 105.7 56.8 -59.3 -38.5 35.8 4.6 21.4 72 73 A L H >X S+ 0 0 49 -4,-2.2 4,-1.5 1,-0.2 3,-1.0 0.900 103.0 55.0 -61.1 -39.2 37.9 2.0 23.1 73 74 A M H 3X S+ 0 0 2 -4,-1.7 4,-1.9 1,-0.3 -1,-0.2 0.803 103.0 55.8 -65.2 -27.9 36.0 2.7 26.4 74 75 A Y H 3X S+ 0 0 11 -4,-1.1 4,-1.6 -3,-0.4 -1,-0.3 0.680 101.5 57.8 -77.8 -16.0 32.7 2.0 24.6 75 76 A A H < S+ 0 0 14 -4,-2.1 3,-0.7 1,-0.2 4,-0.4 0.912 110.6 50.7 -57.7 -46.7 31.5 -6.2 27.2 80 81 A I H >< S+ 0 0 6 -4,-2.5 3,-1.5 1,-0.2 4,-0.2 0.924 108.3 52.3 -59.4 -44.1 30.1 -5.2 30.6 81 82 A D H 3< S+ 0 0 67 -4,-2.4 3,-0.4 1,-0.3 -1,-0.2 0.720 107.9 53.1 -65.8 -20.3 26.6 -5.0 29.2 82 83 A Q T X< S+ 0 0 21 -4,-1.1 3,-1.6 -3,-0.7 7,-0.5 0.401 76.1 102.1 -95.3 2.2 26.9 -8.5 27.7 83 84 A L T < S+ 0 0 7 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.1 0.784 73.9 61.6 -56.5 -29.7 28.0 -10.2 30.9 84 85 A D T 3 S+ 0 0 124 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.722 109.8 41.4 -70.5 -21.1 24.5 -11.6 31.5 85 86 A N X> - 0 0 55 -3,-1.6 4,-2.4 1,-0.1 3,-0.7 -0.877 61.6-168.2-133.1 103.5 24.7 -13.6 28.3 86 87 A P H 3> S+ 0 0 72 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.804 89.3 61.2 -59.7 -28.2 27.8 -15.4 27.2 87 88 A D H 3> S+ 0 0 94 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.905 111.3 38.9 -66.1 -37.2 26.5 -16.1 23.7 88 89 A D H <> S+ 0 0 9 -3,-0.7 4,-1.6 2,-0.2 5,-0.2 0.854 113.8 54.6 -79.0 -34.8 26.3 -12.3 23.1 89 90 A L H X S+ 0 0 3 -4,-2.4 4,-2.3 -7,-0.5 3,-0.2 0.942 108.8 50.5 -62.1 -45.6 29.5 -11.6 25.0 90 91 A V H X S+ 0 0 1 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.917 108.0 50.2 -61.0 -44.4 31.3 -14.0 22.7 91 92 A C H X S+ 0 0 6 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.814 113.5 45.3 -68.5 -26.7 30.0 -12.6 19.4 92 93 A V H X S+ 0 0 0 -4,-1.6 4,-1.8 -3,-0.2 -1,-0.2 0.858 111.5 53.4 -81.0 -34.2 31.0 -9.1 20.3 93 94 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.905 108.4 49.9 -63.6 -40.9 34.4 -10.2 21.6 94 95 A E H X S+ 0 0 63 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.809 105.3 57.8 -68.7 -28.3 35.1 -12.0 18.3 95 96 A K H X S+ 0 0 50 -4,-0.9 4,-1.1 1,-0.2 -1,-0.2 0.937 112.8 39.5 -66.5 -44.6 34.1 -8.9 16.4 96 97 A F H X S+ 0 0 40 -4,-1.8 4,-1.0 2,-0.2 -2,-0.2 0.768 110.2 60.1 -75.8 -24.7 36.8 -6.9 18.2 97 98 A A H >X S+ 0 0 2 -4,-1.8 4,-2.4 1,-0.2 3,-0.7 0.920 103.4 51.6 -67.1 -42.7 39.3 -9.9 18.0 98 99 A V H 3X S+ 0 0 50 -4,-2.0 4,-2.1 1,-0.3 -1,-0.2 0.874 103.8 58.4 -60.0 -38.0 39.0 -9.7 14.2 99 100 A A H 3< S+ 0 0 26 -4,-1.1 4,-0.3 1,-0.2 -1,-0.3 0.794 113.6 38.6 -63.8 -28.4 39.8 -6.0 14.4 100 101 A H H <<>S+ 0 0 68 -4,-1.0 5,-2.6 -3,-0.7 -2,-0.2 0.760 109.1 59.1 -93.6 -26.3 43.1 -6.8 16.2 101 102 A I H ><5S+ 0 0 79 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.885 105.0 51.8 -67.3 -37.7 43.9 -10.0 14.2 102 103 A T T 3<5S+ 0 0 96 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.769 107.0 54.1 -68.1 -25.6 44.0 -7.9 11.0 103 104 A R T 3 5S- 0 0 142 -4,-0.3 -1,-0.3 -5,-0.2 -2,-0.2 0.332 119.2-114.5 -89.0 5.2 46.3 -5.5 12.8 104 105 A K T < 5 + 0 0 167 -3,-1.5 2,-0.6 1,-0.2 -3,-0.2 0.831 60.7 156.4 65.7 35.6 48.6 -8.4 13.6 105 106 A I < - 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