==== 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 3UI0 . 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) . 13744.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 252 86.9 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 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 23.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 57.9 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 2 0 0 0 0 2 0 0 0 2 4 0 2 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 85 0, 0.0 4,-2.2 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 165.6 13.7 -11.7 24.2 2 3 A V H > + 0 0 9 141,-0.4 4,-2.0 1,-0.2 5,-0.1 0.837 360.0 54.7 -60.8 -33.0 11.7 -8.5 24.5 3 4 A Y H > S+ 0 0 140 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.853 110.2 45.2 -70.4 -34.2 8.7 -10.4 25.8 4 5 A D H 4 S+ 0 0 106 -3,-0.4 4,-0.3 2,-0.2 -2,-0.2 0.838 112.6 51.9 -76.0 -33.7 10.8 -11.9 28.6 5 6 A A H >< S+ 0 0 17 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.861 105.2 54.5 -70.3 -37.0 12.4 -8.6 29.4 6 7 A A H >< S+ 0 0 13 -4,-2.0 3,-1.4 1,-0.3 -1,-0.2 0.807 99.5 63.2 -67.2 -27.5 9.0 -6.9 29.7 7 8 A A T 3< S+ 0 0 70 -4,-0.8 -1,-0.3 1,-0.3 -2,-0.2 0.636 89.0 70.6 -71.5 -12.0 8.1 -9.5 32.2 8 9 A Q T < S+ 0 0 104 -3,-1.3 2,-1.8 -4,-0.3 -1,-0.3 0.587 70.6 97.3 -80.2 -10.9 10.8 -8.2 34.5 9 10 A L < - 0 0 16 -3,-1.4 -1,-0.1 -4,-0.2 -3,-0.0 -0.596 64.8-173.3 -82.0 83.4 8.8 -5.0 35.1 10 11 A T > - 0 0 76 -2,-1.8 4,-2.5 1,-0.1 5,-0.2 -0.118 38.9 -89.2 -71.7 172.3 7.3 -6.1 38.4 11 12 A A H > S+ 0 0 77 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.895 126.3 40.0 -49.7 -53.3 4.7 -4.3 40.5 12 13 A D H > S+ 0 0 116 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.770 111.3 57.6 -73.3 -25.1 7.1 -2.2 42.5 13 14 A V H > S+ 0 0 15 2,-0.2 4,-1.9 -3,-0.2 -2,-0.2 0.930 108.9 46.3 -68.4 -43.5 9.4 -1.5 39.5 14 15 A K H X S+ 0 0 57 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.900 112.6 51.1 -64.2 -39.5 6.4 -0.0 37.6 15 16 A K H X S+ 0 0 106 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.925 110.1 47.6 -64.8 -44.8 5.5 2.0 40.7 16 17 A D H X S+ 0 0 20 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.830 110.3 54.0 -66.2 -30.8 9.0 3.4 41.2 17 18 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.929 111.7 44.3 -67.0 -45.1 9.1 4.3 37.5 18 19 A R H X S+ 0 0 77 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.920 112.3 50.6 -65.8 -46.4 5.8 6.2 37.7 19 20 A D H X S+ 0 0 60 -4,-2.6 4,-0.6 1,-0.2 -1,-0.2 0.879 115.7 42.1 -61.1 -39.5 6.8 8.1 41.0 20 21 A S H >X S+ 0 0 0 -4,-1.8 4,-2.7 -5,-0.2 3,-0.7 0.868 112.1 53.8 -76.0 -36.5 10.1 9.2 39.5 21 22 A W H 3X S+ 0 0 15 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.840 95.7 68.5 -66.0 -32.3 8.7 10.1 36.1 22 23 A K H 3< S+ 0 0 163 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.863 113.5 30.5 -54.5 -35.0 6.1 12.3 37.8 23 24 A V H X< S+ 0 0 62 -3,-0.7 3,-1.2 -4,-0.6 4,-0.4 0.917 123.3 45.3 -88.9 -52.7 9.0 14.6 38.7 24 25 A I H >< S+ 0 0 13 -4,-2.7 3,-1.1 1,-0.3 7,-0.2 0.885 112.1 51.8 -59.8 -42.2 11.4 14.0 35.8 25 26 A G G >< S+ 0 0 7 -4,-3.1 3,-0.5 1,-0.2 -1,-0.3 0.534 89.4 82.3 -74.5 -4.8 8.7 14.3 33.2 26 27 A S G < S+ 0 0 101 -3,-1.2 2,-0.3 1,-0.3 -1,-0.2 0.797 101.7 32.7 -68.5 -29.6 7.5 17.6 34.6 27 28 A D G <> + 0 0 80 -3,-1.1 4,-2.6 -4,-0.4 5,-0.4 -0.707 68.9 166.7-130.3 79.7 10.3 19.4 32.8 28 29 A K H <> S+ 0 0 36 -3,-0.5 4,-1.6 -2,-0.3 5,-0.2 0.862 77.6 48.4 -62.1 -39.9 10.9 17.6 29.5 29 30 A K H > S+ 0 0 65 2,-0.2 4,-2.0 3,-0.2 5,-0.2 0.968 117.5 39.5 -67.4 -52.2 12.9 20.3 27.9 30 31 A G H > S+ 0 0 21 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.936 122.8 38.8 -63.4 -49.9 15.2 20.9 30.9 31 32 A N H X S+ 0 0 11 -4,-2.6 4,-2.0 -7,-0.2 -1,-0.2 0.808 114.1 56.0 -72.6 -30.2 15.7 17.2 31.9 32 33 A G H X S+ 0 0 0 -4,-1.6 4,-1.9 -5,-0.4 -1,-0.2 0.932 111.2 42.7 -66.9 -45.3 15.8 16.1 28.3 33 34 A V H X S+ 0 0 11 -4,-2.0 4,-2.6 -5,-0.2 5,-0.2 0.870 112.4 54.0 -67.9 -37.3 18.7 18.4 27.5 34 35 A A H X S+ 0 0 32 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.896 107.3 52.5 -63.1 -38.9 20.4 17.5 30.8 35 36 A L H X S+ 0 0 10 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.924 112.8 42.9 -62.1 -47.5 20.2 13.9 29.8 36 37 A M H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.895 112.6 50.9 -68.1 -43.2 21.8 14.4 26.4 37 38 A T H X S+ 0 0 49 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.854 110.9 50.4 -64.3 -33.7 24.6 16.8 27.6 38 39 A T H X S+ 0 0 30 -4,-1.8 4,-2.8 -5,-0.2 5,-0.3 0.890 108.9 51.8 -70.6 -39.6 25.5 14.2 30.4 39 40 A L H X S+ 0 0 14 -4,-1.7 4,-2.2 1,-0.2 7,-0.2 0.935 112.0 45.6 -61.3 -47.5 25.7 11.4 27.8 40 41 A F H < S+ 0 0 4 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.794 114.9 48.9 -67.5 -28.4 28.0 13.4 25.6 41 42 A A H < S+ 0 0 64 -4,-1.5 3,-0.4 -5,-0.2 -2,-0.2 0.913 119.1 35.6 -77.3 -44.5 30.1 14.4 28.6 42 43 A D H < S+ 0 0 73 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.709 131.9 29.8 -82.5 -22.7 30.5 11.0 30.1 43 44 A N >< + 0 0 37 -4,-2.2 3,-2.4 -5,-0.3 4,-0.3 -0.545 62.7 169.8-138.7 70.9 30.7 9.2 26.7 44 45 A Q G > S+ 0 0 126 -3,-0.4 3,-1.3 1,-0.3 4,-0.4 0.717 72.6 74.4 -52.1 -25.0 32.2 11.5 24.1 45 46 A E G 3 S+ 0 0 103 1,-0.3 3,-0.4 2,-0.2 -1,-0.3 0.676 87.6 60.8 -66.1 -17.6 32.4 8.5 21.8 46 47 A T G X S+ 0 0 6 -3,-2.4 3,-1.5 -7,-0.2 4,-0.4 0.653 80.7 83.4 -83.7 -15.9 28.7 8.7 21.2 47 48 A I G X S+ 0 0 48 -3,-1.3 3,-1.9 -4,-0.3 -1,-0.2 0.843 77.6 70.1 -56.1 -34.1 28.8 12.2 19.7 48 49 A G G > S+ 0 0 39 -3,-0.4 3,-1.0 -4,-0.4 -1,-0.3 0.803 91.4 58.2 -54.5 -32.4 29.7 10.7 16.4 49 50 A Y G < S+ 0 0 105 -3,-1.5 -1,-0.3 1,-0.2 3,-0.3 0.695 103.7 55.0 -71.3 -18.5 26.2 9.3 16.0 50 51 A F G X + 0 0 44 -3,-1.9 3,-1.6 -4,-0.4 4,-0.4 -0.059 62.0 130.9-107.7 32.8 24.8 12.8 16.3 51 52 A K G X + 0 0 178 -3,-1.0 3,-1.5 1,-0.3 -1,-0.2 0.850 69.4 62.3 -51.5 -39.7 26.7 14.6 13.6 52 53 A R G 3 S+ 0 0 101 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.787 92.6 65.3 -59.2 -29.9 23.4 16.1 12.3 53 54 A L G < S- 0 0 6 -3,-1.6 12,-0.3 1,-0.2 -1,-0.3 0.673 92.2-154.3 -69.1 -18.6 22.9 18.0 15.5 54 55 A G < + 0 0 49 -3,-1.5 2,-1.5 -4,-0.4 -1,-0.2 -0.551 62.0 14.8 82.6-144.9 26.0 20.2 15.0 55 56 A D > - 0 0 90 -2,-0.2 3,-1.5 1,-0.2 4,-0.2 -0.523 64.9-176.9 -72.5 93.0 27.9 21.7 17.9 56 57 A V G > S+ 0 0 17 -2,-1.5 3,-1.3 1,-0.3 -1,-0.2 0.651 71.7 74.0 -65.4 -17.3 26.4 19.7 20.8 57 58 A S G 3 S+ 0 0 94 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.630 79.5 74.1 -74.1 -12.0 28.4 21.7 23.4 58 59 A Q G X S- 0 0 109 -3,-1.5 3,-1.7 1,-0.2 -1,-0.3 0.651 79.7-178.0 -73.4 -15.7 26.0 24.6 22.9 59 60 A G G X + 0 0 10 -3,-1.3 3,-2.1 1,-0.3 7,-0.3 -0.290 63.7 10.8 58.6-127.5 23.4 22.7 24.9 60 61 A M G 3 S+ 0 0 80 1,-0.3 -1,-0.3 -3,-0.1 6,-0.1 0.753 125.1 63.3 -54.6 -29.7 20.0 24.4 25.2 61 62 A A G < S+ 0 0 70 -3,-1.7 2,-0.9 4,-0.1 -1,-0.3 0.634 82.1 89.3 -73.0 -15.2 21.1 27.1 22.6 62 63 A N <> - 0 0 22 -3,-2.1 4,-2.7 1,-0.2 5,-0.2 -0.765 65.9-160.3 -86.8 107.2 21.4 24.4 19.9 63 64 A D H > S+ 0 0 82 -2,-0.9 4,-2.5 1,-0.2 -1,-0.2 0.868 89.6 49.6 -55.4 -41.5 17.9 24.3 18.4 64 65 A K H > S+ 0 0 99 -11,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.889 112.4 47.2 -67.1 -39.5 18.5 20.8 16.8 65 66 A L H > S+ 0 0 0 -12,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.913 113.0 49.5 -67.3 -41.8 19.7 19.4 20.1 66 67 A R H X S+ 0 0 18 -4,-2.7 4,-2.3 -7,-0.3 5,-0.2 0.917 110.8 50.0 -63.6 -43.0 16.8 21.0 22.0 67 68 A G H X S+ 0 0 1 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.916 114.0 44.8 -61.4 -44.1 14.4 19.6 19.5 68 69 A H H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.917 112.3 51.9 -65.6 -44.7 15.9 16.1 19.8 69 70 A S H X S+ 0 0 0 -4,-2.9 4,-1.2 2,-0.2 -2,-0.2 0.877 109.3 49.3 -60.7 -41.4 16.0 16.2 23.6 70 71 A I H X S+ 0 0 1 -4,-2.3 4,-0.9 1,-0.2 3,-0.5 0.941 111.3 49.5 -65.0 -45.7 12.4 17.2 23.9 71 72 A G H X S+ 0 0 26 -4,-1.9 4,-1.0 1,-0.2 3,-0.5 0.841 103.2 60.9 -62.2 -33.8 11.3 14.4 21.6 72 73 A L H >X S+ 0 0 41 -4,-2.0 4,-1.4 1,-0.2 3,-0.6 0.881 100.9 54.6 -61.0 -37.7 13.3 11.9 23.6 73 74 A M H 3X S+ 0 0 1 -4,-1.2 4,-1.8 -3,-0.5 -1,-0.2 0.777 102.9 55.5 -68.7 -27.0 11.2 12.7 26.7 74 75 A Y H 3X S+ 0 0 13 -4,-0.9 4,-1.8 -3,-0.5 -1,-0.2 0.719 102.8 56.3 -78.4 -19.5 8.0 11.9 24.8 75 76 A A H < S+ 0 0 8 -4,-2.1 3,-0.7 1,-0.2 4,-0.3 0.917 111.1 49.2 -56.2 -47.7 6.8 3.8 27.6 80 81 A I H >< S+ 0 0 5 -4,-2.6 3,-1.4 1,-0.2 4,-0.2 0.904 108.2 54.1 -59.9 -42.3 5.5 4.9 31.0 81 82 A D H 3< S+ 0 0 59 -4,-2.3 3,-0.4 1,-0.3 -1,-0.2 0.751 106.8 52.9 -65.3 -22.4 2.0 5.1 29.7 82 83 A Q T X< S+ 0 0 18 -4,-1.3 3,-1.1 -3,-0.7 7,-0.5 0.411 75.9 101.5 -93.8 2.3 2.2 1.6 28.4 83 84 A L T < S+ 0 0 5 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.787 75.5 60.6 -57.0 -29.6 3.2 -0.1 31.7 84 85 A D T 3 S+ 0 0 121 -3,-0.4 -1,-0.2 -4,-0.2 -2,-0.1 0.822 107.1 45.6 -68.0 -33.0 -0.3 -1.3 32.3 85 86 A N X> - 0 0 54 -3,-1.1 4,-2.3 1,-0.1 3,-0.7 -0.899 63.3-166.5-120.2 105.9 -0.4 -3.4 29.2 86 87 A P H 3> S+ 0 0 78 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.851 90.7 56.8 -54.2 -39.6 2.6 -5.6 28.3 87 88 A D H 3> S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.860 110.9 43.0 -63.1 -36.4 1.4 -6.2 24.8 88 89 A D H <> S+ 0 0 8 -3,-0.7 4,-1.9 -6,-0.2 -1,-0.2 0.859 111.2 54.4 -77.9 -36.1 1.3 -2.5 24.1 89 90 A L H X S+ 0 0 5 -4,-2.3 4,-2.2 -7,-0.5 -2,-0.2 0.937 109.9 48.6 -61.5 -44.9 4.6 -1.8 25.8 90 91 A V H X S+ 0 0 10 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.930 110.9 47.3 -62.0 -48.1 6.2 -4.5 23.6 91 92 A C H X S+ 0 0 7 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.841 114.0 48.9 -66.1 -29.6 4.8 -3.2 20.3 92 93 A V H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.871 111.5 49.5 -75.4 -35.8 5.8 0.4 21.2 93 94 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.907 111.7 47.7 -69.1 -41.5 9.3 -0.7 22.1 94 95 A E H X S+ 0 0 65 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.884 111.6 50.9 -66.5 -37.6 9.8 -2.7 18.9 95 96 A K H >X S+ 0 0 64 -4,-1.6 4,-0.5 -5,-0.2 3,-0.5 0.931 111.1 48.9 -62.8 -45.8 8.5 0.3 16.9 96 97 A F H 3X S+ 0 0 49 -4,-2.2 4,-0.7 1,-0.2 3,-0.3 0.845 106.7 57.3 -62.0 -36.4 11.0 2.6 18.7 97 98 A A H 3X S+ 0 0 1 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.785 86.2 80.3 -68.9 -28.5 13.8 0.1 18.0 98 99 A V H S+ 0 0 43 -4,-0.7 5,-2.7 -3,-0.3 -1,-0.2 0.842 108.7 49.9 -75.2 -31.0 17.9 2.8 16.2 101 102 A I H ><5S+ 0 0 83 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.894 107.7 54.9 -69.8 -39.4 18.6 -0.6 14.6 102 103 A T H 3<5S+ 0 0 106 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.780 106.9 50.2 -63.9 -28.2 18.9 1.2 11.3 103 104 A R T 3<5S- 0 0 108 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.451 116.9-117.0 -89.2 -1.4 21.6 3.5 12.8 104 105 A K T < 5 + 0 0 163 -3,-1.4 2,-0.8 1,-0.2 -3,-0.2 0.840 54.5 163.4 69.1 34.8 23.4 0.4 14.1 105 106 A I < - 0 0 21 -5,-2.7 -1,-0.2 -6,-0.1 -2,-0.1 -0.781 25.7-151.2 -85.6 113.3 22.9 1.4 17.8 106 107 A S > - 0 0 53 -2,-0.8 4,-2.8 -3,-0.1 5,-0.2 -0.308 26.6-105.2 -81.7 170.0 23.7 -1.9 19.7 107 108 A A H > S+ 0 0 35 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.895 123.9 50.1 -59.7 -40.4 22.3 -2.9 23.0 108 109 A A H 4 S+ 0 0 79 2,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.886 111.1 48.4 -65.4 -40.3 25.6 -2.1 24.6 109 110 A E H >4 S+ 0 0 38 1,-0.2 3,-1.5 2,-0.2 -2,-0.2 0.930 112.1 48.4 -65.8 -47.0 25.7 1.3 23.0 110 111 A F H >< S+ 0 0 37 -4,-2.8 3,-2.1 1,-0.3 -2,-0.2 0.874 100.3 67.0 -61.4 -39.0 22.1 2.1 24.1 111 112 A G G >< S+ 0 0 13 -4,-2.1 3,-1.4 1,-0.3 4,-0.3 0.596 79.0 81.6 -60.2 -11.0 22.9 1.0 27.6 112 113 A K G X S+ 0 0 58 -3,-1.5 3,-0.6 -4,-0.3 -1,-0.3 0.644 76.3 72.7 -70.5 -11.7 25.2 4.0 28.0 113 114 A I G <> S+ 0 0 26 -3,-2.1 4,-2.3 1,-0.2 -1,-0.3 0.681 77.6 78.6 -75.3 -17.4 22.1 6.1 28.7 114 115 A N H <> S+ 0 0 46 -3,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.862 89.7 53.4 -59.0 -38.7 21.9 4.4 32.1 115 116 A G H <> S+ 0 0 33 -3,-0.6 4,-2.2 -4,-0.3 -1,-0.2 0.976 110.3 45.2 -61.6 -56.4 24.6 6.6 33.6 116 117 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.882 113.0 51.9 -54.5 -41.8 23.0 9.9 32.5 117 118 A I H X S+ 0 0 13 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.935 108.8 50.0 -63.1 -45.1 19.6 8.7 33.8 118 119 A K H X S+ 0 0 96 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.902 112.2 48.3 -60.1 -41.2 21.0 7.8 37.2 119 120 A K 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