==== 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 3UHH . COMPND 2 MOLECULE: GLOBIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: SCAPHARCA INAEQUIVALVIS; . AUTHOR Z.REN,V.SRAJER,J.E.KNAPP,W.E.ROYER JR. . 290 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13808.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 246 84.8 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 . 9 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 22.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 166 57.2 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 0 2 0 0 0 2 4 2 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 89 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 123.9 38.4 -21.8 23.7 2 3 A V H > + 0 0 12 141,-0.3 4,-2.1 1,-0.2 5,-0.1 0.814 360.0 54.6 -62.7 -30.0 36.5 -18.5 23.9 3 4 A Y H > S+ 0 0 127 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.877 108.2 46.3 -72.3 -38.8 33.6 -20.4 25.3 4 5 A D H 4 S+ 0 0 113 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.877 112.6 51.8 -70.7 -35.5 35.6 -21.9 28.1 5 6 A A H >< S+ 0 0 18 -4,-2.3 3,-1.4 1,-0.2 4,-0.2 0.915 107.1 51.9 -65.3 -43.6 37.2 -18.5 28.9 6 7 A A H >< S+ 0 0 12 -4,-2.1 3,-1.6 1,-0.3 -1,-0.2 0.828 101.3 63.1 -61.6 -31.8 33.7 -16.9 29.1 7 8 A A T 3< S+ 0 0 70 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.688 89.2 69.4 -66.8 -18.8 32.8 -19.6 31.6 8 9 A Q T < S+ 0 0 114 -3,-1.4 2,-1.8 -4,-0.5 -1,-0.3 0.583 72.4 96.6 -76.1 -10.4 35.4 -18.3 33.9 9 10 A L < - 0 0 16 -3,-1.6 -1,-0.1 -4,-0.2 -3,-0.0 -0.590 62.9-179.3 -83.6 82.0 33.3 -15.2 34.5 10 11 A T > - 0 0 68 -2,-1.8 4,-2.9 1,-0.1 5,-0.2 -0.152 44.7 -92.1 -75.3 173.2 31.7 -16.3 37.7 11 12 A A H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.893 127.6 48.6 -53.8 -44.5 29.1 -14.4 39.8 12 13 A D H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.888 111.9 48.4 -65.4 -40.3 31.9 -12.9 41.9 13 14 A V H > S+ 0 0 14 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.924 111.0 50.5 -66.4 -44.0 34.0 -11.9 38.9 14 15 A K H X S+ 0 0 60 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.888 109.6 51.2 -61.6 -39.1 31.0 -10.3 37.2 15 16 A K H X S+ 0 0 111 -4,-2.0 4,-3.0 -5,-0.2 -1,-0.2 0.924 110.0 48.8 -64.4 -44.7 30.1 -8.3 40.3 16 17 A D H X S+ 0 0 23 -4,-2.0 4,-2.0 1,-0.2 5,-0.2 0.864 111.2 50.7 -64.0 -36.6 33.7 -6.9 40.6 17 18 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.932 113.8 44.4 -66.6 -45.2 33.7 -6.0 37.0 18 19 A R H X S+ 0 0 81 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.923 112.8 51.0 -65.2 -45.4 30.4 -4.1 37.3 19 20 A D H X S+ 0 0 58 -4,-3.0 4,-0.5 1,-0.2 -1,-0.2 0.895 115.7 40.8 -60.8 -42.6 31.3 -2.4 40.5 20 21 A S H >X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 3,-0.8 0.854 111.3 57.1 -75.7 -33.2 34.6 -1.1 39.2 21 22 A W H 3X S+ 0 0 14 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.838 93.8 66.9 -66.2 -32.3 33.2 -0.2 35.8 22 23 A K H 3< S+ 0 0 171 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.848 112.5 34.9 -56.8 -30.7 30.6 2.1 37.5 23 24 A V H X< S+ 0 0 55 -3,-0.8 3,-1.1 -4,-0.5 4,-0.3 0.939 123.2 37.9 -88.5 -57.1 33.6 4.3 38.4 24 25 A I H >< S+ 0 0 12 -4,-2.3 3,-0.9 1,-0.2 7,-0.2 0.818 114.6 56.7 -67.3 -30.1 36.1 4.0 35.6 25 26 A G T 3< S+ 0 0 5 -4,-2.5 3,-0.5 -5,-0.3 -1,-0.2 0.568 88.7 77.1 -77.1 -7.5 33.3 4.0 33.0 26 27 A S T < S+ 0 0 95 -3,-1.1 2,-0.3 1,-0.3 -1,-0.2 0.702 101.9 37.4 -74.4 -21.2 31.9 7.3 34.3 27 28 A D <> + 0 0 71 -3,-0.9 4,-2.5 -4,-0.3 5,-0.4 -0.699 68.2 165.5-131.2 78.6 34.7 9.3 32.6 28 29 A K H > S+ 0 0 36 -3,-0.5 4,-1.5 -2,-0.3 5,-0.2 0.869 76.8 47.1 -63.8 -39.3 35.3 7.5 29.2 29 30 A K H > S+ 0 0 62 2,-0.2 4,-2.0 3,-0.2 5,-0.2 0.967 117.6 40.8 -68.2 -51.9 37.3 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 0.945 123.3 37.1 -62.3 -51.5 39.6 10.9 30.7 31 32 A N H X S+ 0 0 12 -4,-2.5 4,-2.2 -7,-0.2 -1,-0.2 0.780 113.6 57.5 -74.5 -26.3 40.1 7.3 31.6 32 33 A G H X S+ 0 0 0 -4,-1.5 4,-2.3 -5,-0.4 -1,-0.2 0.925 110.1 43.4 -68.8 -44.0 40.3 6.1 28.0 33 34 A V H X S+ 0 0 9 -4,-2.0 4,-2.8 -5,-0.2 5,-0.3 0.868 112.4 54.4 -68.3 -34.7 43.1 8.4 27.2 34 35 A A H X S+ 0 0 32 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.918 109.2 48.3 -63.9 -43.0 44.8 7.5 30.5 35 36 A L H X S+ 0 0 11 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.940 115.0 44.2 -62.6 -49.5 44.6 3.8 29.5 36 37 A A H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.931 114.0 48.0 -63.0 -48.2 46.0 4.4 26.0 37 38 A T H X S+ 0 0 46 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.840 110.4 53.0 -64.0 -32.3 48.8 6.7 27.1 38 39 A T H X S+ 0 0 31 -4,-1.9 4,-2.8 -5,-0.3 5,-0.3 0.901 107.7 51.7 -69.0 -39.0 49.8 4.3 29.8 39 40 A L H X S+ 0 0 23 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.938 112.3 45.7 -60.7 -46.9 50.0 1.5 27.3 40 41 A F H < S+ 0 0 10 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.867 115.6 46.5 -65.1 -38.0 52.3 3.6 25.0 41 42 A A H < S+ 0 0 65 -4,-2.2 3,-0.5 -5,-0.2 -2,-0.2 0.916 119.7 37.2 -71.7 -44.8 54.5 4.7 27.9 42 43 A D H < S+ 0 0 76 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.717 128.3 34.2 -81.0 -23.3 55.0 1.3 29.5 43 44 A N >< + 0 0 30 -4,-2.1 3,-2.2 -5,-0.3 4,-0.3 -0.541 64.6 167.2-132.7 68.6 55.1 -0.6 26.3 44 45 A Q G > S+ 0 0 144 -3,-0.5 3,-1.4 1,-0.3 4,-0.3 0.740 70.1 72.9 -53.1 -27.8 56.9 1.6 23.7 45 46 A E G 3 S+ 0 0 110 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.547 92.1 57.8 -68.4 -4.7 57.3 -1.3 21.4 46 47 A T G X S+ 0 0 8 -3,-2.2 3,-1.3 -7,-0.2 4,-0.5 0.585 78.8 88.0 -99.8 -12.2 53.6 -1.2 20.6 47 48 A I G X S+ 0 0 61 -3,-1.4 3,-1.5 -4,-0.3 -2,-0.1 0.820 76.4 68.3 -56.6 -33.2 53.5 2.4 19.4 48 49 A G G > S+ 0 0 60 -4,-0.3 3,-1.2 1,-0.3 -1,-0.3 0.842 91.5 60.3 -56.3 -35.6 54.3 1.3 15.8 49 50 A Y G < S+ 0 0 97 -3,-1.3 3,-0.3 1,-0.3 -1,-0.3 0.748 99.4 59.0 -63.6 -24.5 50.9 -0.4 15.5 50 51 A F G X + 0 0 49 -3,-1.5 3,-1.6 -4,-0.5 4,-0.3 -0.003 62.3 130.3 -98.0 29.7 49.2 3.0 16.1 51 52 A K G X + 0 0 181 -3,-1.2 3,-1.4 1,-0.3 -1,-0.2 0.792 65.2 64.4 -51.4 -35.2 50.7 4.8 13.2 52 53 A R G 3 S+ 0 0 96 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.801 94.8 59.8 -62.0 -29.9 47.3 6.1 12.0 53 54 A L G < S- 0 0 6 -3,-1.6 12,-0.3 1,-0.2 -1,-0.3 0.557 96.1-149.7 -77.6 -7.9 46.8 8.1 15.2 54 55 A G < + 0 0 51 -3,-1.4 2,-1.3 -4,-0.3 -1,-0.2 -0.530 63.6 10.8 79.0-140.7 49.9 10.2 14.6 55 56 A D > - 0 0 92 -2,-0.2 3,-1.5 1,-0.2 4,-0.1 -0.619 63.2-178.7 -79.9 93.9 52.0 11.6 17.5 56 57 A V G > S+ 0 0 11 -2,-1.3 3,-1.6 1,-0.3 -1,-0.2 0.639 71.3 77.9 -68.7 -14.7 50.5 9.8 20.4 57 58 A S G 3 S+ 0 0 99 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.675 80.2 72.5 -69.0 -13.8 52.8 11.6 22.9 58 59 A Q G X S- 0 0 113 -3,-1.5 3,-1.6 1,-0.2 -1,-0.3 0.630 80.8-177.6 -74.2 -14.3 50.4 14.5 22.5 59 60 A G G X + 0 0 11 -3,-1.6 3,-2.0 1,-0.3 7,-0.2 -0.250 63.9 8.5 57.0-129.6 47.8 12.7 24.6 60 61 A M G 3 S+ 0 0 83 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.753 124.9 64.6 -55.0 -29.5 44.5 14.5 25.0 61 62 A A G < S+ 0 0 67 -3,-1.6 2,-0.8 4,-0.1 -1,-0.3 0.675 82.6 88.5 -70.4 -18.1 45.6 17.2 22.5 62 63 A N <> - 0 0 20 -3,-2.0 4,-2.5 1,-0.2 5,-0.2 -0.748 65.2-160.9 -86.0 108.4 45.6 14.6 19.7 63 64 A D H > S+ 0 0 88 -2,-0.8 4,-2.5 1,-0.2 5,-0.2 0.857 89.6 50.0 -57.5 -41.1 42.1 14.4 18.2 64 65 A K H > S+ 0 0 109 -11,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.895 111.8 48.6 -66.8 -39.0 42.6 11.0 16.6 65 66 A L H > S+ 0 0 0 -12,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.911 111.6 49.8 -66.7 -40.9 43.9 9.6 19.8 66 67 A R H X S+ 0 0 22 -4,-2.5 4,-2.4 -7,-0.2 5,-0.2 0.927 111.9 47.6 -63.9 -43.9 41.0 11.1 21.8 67 68 A G H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.905 114.5 47.2 -62.8 -41.3 38.5 9.7 19.3 68 69 A H H X S+ 0 0 42 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.916 112.7 48.8 -65.0 -45.2 40.1 6.3 19.4 69 70 A S H X S+ 0 0 0 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.870 110.1 49.5 -65.9 -40.8 40.3 6.2 23.2 70 71 A I H X S+ 0 0 1 -4,-2.4 4,-1.1 1,-0.2 3,-0.3 0.938 112.2 49.5 -63.9 -44.7 36.7 7.2 23.8 71 72 A T H X S+ 0 0 22 -4,-1.8 4,-0.9 -5,-0.2 3,-0.4 0.859 104.4 58.6 -62.7 -35.9 35.6 4.5 21.3 72 73 A L H >X S+ 0 0 49 -4,-2.0 4,-1.5 1,-0.2 3,-0.8 0.902 102.7 54.2 -60.6 -39.5 37.8 1.9 23.1 73 74 A M H 3X S+ 0 0 6 -4,-1.5 4,-2.0 -3,-0.3 -1,-0.2 0.803 103.0 55.9 -66.0 -28.4 35.8 2.6 26.3 74 75 A Y H 3X S+ 0 0 11 -4,-1.1 4,-1.7 -3,-0.4 -1,-0.3 0.713 101.6 57.4 -76.7 -18.6 32.6 1.9 24.5 75 76 A A H < S+ 0 0 13 -4,-2.2 3,-0.8 1,-0.2 4,-0.3 0.919 111.0 50.6 -55.6 -47.8 31.4 -6.3 27.1 80 81 A I H >< S+ 0 0 6 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.907 108.4 52.4 -59.5 -42.1 30.0 -5.3 30.5 81 82 A D H 3< S+ 0 0 64 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.716 107.8 53.0 -67.9 -19.7 26.5 -5.0 29.1 82 83 A Q T X< S+ 0 0 20 -4,-1.2 3,-0.9 -3,-0.8 7,-0.5 0.379 75.5 102.2 -96.5 4.2 26.8 -8.6 27.7 83 84 A L T < S+ 0 0 7 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.1 0.785 75.6 59.8 -58.8 -28.1 27.8 -10.3 30.9 84 85 A D T 3 S+ 0 0 126 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.848 107.5 46.1 -69.1 -34.5 24.3 -11.7 31.4 85 86 A N X> - 0 0 57 -3,-0.9 4,-2.1 1,-0.1 3,-0.8 -0.890 64.5-166.2-117.8 104.8 24.3 -13.6 28.2 86 87 A P H 3> S+ 0 0 77 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.849 89.6 55.7 -52.6 -42.0 27.4 -15.7 27.3 87 88 A D H 3> S+ 0 0 100 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.843 110.7 44.5 -63.8 -34.2 26.4 -16.2 23.7 88 89 A D H <> S+ 0 0 9 -3,-0.8 4,-1.6 -6,-0.2 -1,-0.2 0.839 111.1 53.2 -79.5 -32.9 26.1 -12.4 23.1 89 90 A L H X S+ 0 0 4 -4,-2.1 4,-2.3 -7,-0.5 5,-0.2 0.941 108.9 51.1 -64.9 -44.8 29.4 -11.7 24.9 90 91 A V H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.909 108.4 50.1 -60.0 -43.4 31.2 -14.2 22.7 91 92 A C H X S+ 0 0 6 -4,-1.5 4,-1.1 1,-0.2 -1,-0.2 0.843 113.3 44.8 -68.2 -31.6 29.9 -12.7 19.4 92 93 A V H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.849 112.6 52.2 -78.4 -33.7 30.9 -9.1 20.3 93 94 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.918 108.7 50.5 -66.2 -42.0 34.3 -10.3 21.6 94 95 A E H X S+ 0 0 62 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.831 106.6 56.1 -65.9 -29.4 34.9 -12.1 18.3 95 96 A K H X S+ 0 0 33 -4,-1.1 4,-1.2 1,-0.2 -1,-0.2 0.943 112.0 40.9 -66.8 -46.8 33.9 -9.0 16.4 96 97 A F H X S+ 0 0 33 -4,-1.9 4,-1.1 1,-0.2 -2,-0.2 0.799 108.3 62.0 -72.1 -27.1 36.6 -6.9 18.2 97 98 A A H >X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 3,-0.5 0.908 101.2 53.1 -63.4 -40.7 39.1 -9.8 18.0 98 99 A V H 3X S+ 0 0 43 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.890 101.9 59.0 -60.8 -40.0 38.8 -9.5 14.2 99 100 A N H 3< S+ 0 0 39 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.826 114.5 37.4 -58.5 -32.7 39.7 -5.8 14.4 100 101 A H H <<>S+ 0 0 64 -4,-1.1 5,-2.4 -3,-0.5 3,-0.5 0.777 109.6 59.3 -91.4 -29.4 42.9 -6.8 16.1 101 102 A I H ><5S+ 0 0 79 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.909 103.9 53.3 -64.3 -40.0 43.7 -9.9 14.1 102 103 A T T 3<5S+ 0 0 95 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.704 106.8 53.7 -67.3 -18.8 43.7 -7.8 10.9 103 104 A R T 3 5S- 0 0 129 -3,-0.5 -1,-0.3 -5,-0.2 -2,-0.2 0.285 118.6-113.2 -97.1 7.7 46.3 -5.5 12.7 104 105 A K T < 5 + 0 0 168 -3,-1.8 2,-0.6 1,-0.2 -3,-0.2 0.817 61.2 157.1 65.2 33.7 48.5 -8.5 13.5 105 106 A I < - 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