==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 08-AUG-06 2HZ2 . COMPND 2 MOLECULE: CYANOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR J.A.HOY . 123 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7295.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 93 75.6 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 . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 70 56.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 4.1 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 1 0 1 0 0 0 1 0 0 1 1 1 1 0 0 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 0 123 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -55.2 22.7 -7.1 10.4 2 3 A T > - 0 0 82 1,-0.1 4,-2.1 4,-0.0 5,-0.1 -0.075 360.0-118.9 -73.4 164.0 19.0 -7.3 11.1 3 4 A L H > S+ 0 0 19 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.933 115.9 60.5 -57.5 -48.6 16.9 -5.6 13.8 4 5 A Y H >>S+ 0 0 142 1,-0.2 5,-3.3 2,-0.2 4,-0.9 0.868 108.6 42.4 -45.6 -47.8 16.0 -9.2 15.0 5 6 A E H 45S+ 0 0 125 3,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.956 112.1 50.1 -71.3 -55.7 19.7 -9.9 15.6 6 7 A K H <5S+ 0 0 105 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.823 119.2 38.1 -52.3 -41.6 20.7 -6.5 17.3 7 8 A L H <5S- 0 0 29 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.585 118.4-110.7 -88.2 -12.9 17.8 -6.6 19.8 8 9 A G T <5 - 0 0 62 -4,-0.9 4,-0.3 -3,-0.4 -3,-0.2 0.856 64.6 -38.1 89.7 37.2 18.0 -10.4 20.3 9 10 A G S > S+ 0 0 101 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.814 125.9 48.5 -55.6 -42.8 11.2 -11.9 18.0 11 12 A T H > S+ 0 0 118 2,-0.2 4,-2.5 -3,-0.2 -1,-0.2 0.924 111.7 48.9 -72.3 -45.9 10.1 -11.1 21.5 12 13 A A H > S+ 0 0 24 -4,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.914 113.7 47.1 -56.3 -45.5 12.6 -8.3 22.0 13 14 A V H X S+ 0 0 13 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.942 111.5 51.0 -63.8 -43.9 11.5 -6.7 18.7 14 15 A D H X S+ 0 0 73 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.917 110.9 48.9 -61.1 -44.4 7.8 -7.1 19.5 15 16 A L H X S+ 0 0 79 -4,-2.5 4,-2.2 2,-0.2 5,-0.3 0.929 113.2 47.3 -56.6 -47.7 8.3 -5.4 22.9 16 17 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.933 116.1 43.4 -61.2 -50.1 10.3 -2.5 21.3 17 18 A V H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.900 114.7 47.8 -65.6 -48.7 7.7 -2.0 18.6 18 19 A D H X S+ 0 0 63 -4,-2.8 4,-2.3 -5,-0.3 -1,-0.2 0.897 115.2 45.0 -60.9 -40.7 4.6 -2.3 20.8 19 20 A K H X S+ 0 0 76 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.890 115.5 47.8 -70.9 -41.1 6.0 0.1 23.5 20 21 A F H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.913 113.1 48.4 -64.4 -42.1 7.2 2.6 20.8 21 22 A Y H X S+ 0 0 43 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.949 110.8 51.3 -66.1 -44.6 3.8 2.4 19.0 22 23 A E H X S+ 0 0 92 -4,-2.3 4,-1.0 -5,-0.2 -2,-0.2 0.915 111.3 48.1 -55.1 -44.3 2.0 2.9 22.3 23 24 A R H < S+ 0 0 78 -4,-2.1 4,-0.4 1,-0.2 3,-0.3 0.889 111.5 48.0 -70.0 -39.2 4.1 6.0 23.1 24 25 A V H >< S+ 0 0 2 -4,-2.4 3,-1.4 1,-0.2 6,-0.2 0.926 107.2 57.2 -65.9 -44.7 3.6 7.5 19.6 25 26 A L H 3< S+ 0 0 70 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.738 112.6 41.9 -48.3 -35.9 -0.2 6.9 19.9 26 27 A Q T 3< S+ 0 0 133 -4,-1.0 2,-0.8 -3,-0.3 -1,-0.3 0.348 87.8 104.8 -96.3 -0.6 -0.3 8.9 23.1 27 28 A D X> - 0 0 15 -3,-1.4 4,-2.2 -4,-0.4 3,-1.4 -0.789 54.3-162.0 -93.6 104.4 2.1 11.8 22.0 28 29 A D T 34 S+ 0 0 125 -2,-0.8 4,-0.3 1,-0.3 -1,-0.2 0.618 85.0 66.7 -59.7 -19.0 -0.1 14.9 21.2 29 30 A R T 34 S+ 0 0 101 1,-0.1 -1,-0.3 2,-0.1 56,-0.1 0.831 121.1 12.1 -69.3 -33.1 2.7 16.4 19.2 30 31 A I T X4 S+ 0 0 2 -3,-1.4 3,-1.7 -6,-0.2 4,-0.4 0.519 94.9 97.6-129.4 -7.0 2.5 13.8 16.5 31 32 A K G >< S+ 0 0 89 -4,-2.2 3,-2.2 1,-0.3 -3,-0.1 0.874 79.0 62.5 -55.4 -38.8 -0.6 11.7 16.8 32 33 A H G > S+ 0 0 80 1,-0.3 3,-1.0 -4,-0.3 -1,-0.3 0.619 86.9 71.4 -68.2 -15.0 -2.7 13.6 14.2 33 34 A F G < S+ 0 0 10 -3,-1.7 -1,-0.3 1,-0.2 3,-0.3 0.778 100.9 48.3 -65.9 -22.9 -0.3 12.7 11.5 34 35 A F G X S+ 0 0 29 -3,-2.2 3,-1.9 -4,-0.4 -1,-0.2 0.171 77.8 111.8 -99.6 13.7 -1.8 9.2 11.8 35 36 A A T < S+ 0 0 83 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.871 85.9 35.1 -58.5 -39.9 -5.4 10.4 11.7 36 37 A D T 3 S+ 0 0 116 -3,-0.3 2,-0.5 -4,-0.2 -1,-0.3 0.049 101.7 97.7-103.9 23.6 -6.2 8.9 8.3 37 38 A V S < S- 0 0 44 -3,-1.9 -3,-0.0 2,-0.0 5,-0.0 -0.950 72.9-127.8-117.4 122.4 -3.9 5.8 9.0 38 39 A D > - 0 0 105 -2,-0.5 4,-2.2 1,-0.1 3,-0.3 -0.291 30.8-105.4 -67.4 158.6 -5.4 2.5 10.2 39 40 A M H > S+ 0 0 135 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.645 118.6 57.5 -67.3 -17.3 -3.9 0.9 13.2 40 41 A A H > S+ 0 0 66 2,-0.2 4,-2.6 3,-0.1 -1,-0.2 0.916 111.0 42.5 -72.9 -49.8 -2.1 -1.8 11.2 41 42 A K H > S+ 0 0 129 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.851 112.1 56.9 -61.5 -34.9 -0.3 0.8 9.1 42 43 A Q H X S+ 0 0 21 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.953 111.2 40.9 -65.2 -48.0 0.4 2.8 12.3 43 44 A R H X S+ 0 0 69 -4,-1.7 4,-2.0 1,-0.2 3,-0.3 0.943 112.8 54.2 -67.7 -44.4 2.1 -0.0 14.0 44 45 A A H X S+ 0 0 43 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.826 105.2 56.8 -53.0 -32.2 4.0 -1.0 10.8 45 46 A H H X S+ 0 0 60 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.905 106.2 47.1 -68.9 -44.3 5.2 2.6 10.6 46 47 A Q H X S+ 0 0 2 -4,-1.7 4,-2.4 -3,-0.3 -1,-0.2 0.889 111.2 52.0 -62.9 -38.8 6.8 2.5 14.1 47 48 A K H X S+ 0 0 90 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.906 110.9 50.3 -65.3 -36.1 8.4 -0.9 13.2 48 49 A A H X S+ 0 0 23 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.951 111.0 44.9 -60.8 -55.5 9.8 0.8 10.1 49 50 A F H X S+ 0 0 24 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.876 114.8 50.7 -55.9 -40.6 11.2 3.8 11.9 50 51 A L H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.925 109.8 49.8 -63.3 -43.1 12.7 1.4 14.5 51 52 A T H <>S+ 0 0 35 -4,-2.5 5,-2.1 1,-0.2 3,-0.3 0.910 112.8 48.0 -63.7 -43.7 14.2 -0.7 11.7 52 53 A Y H ><5S+ 0 0 19 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.939 109.4 51.4 -55.7 -51.8 15.7 2.5 10.2 53 54 A A H 3<5S+ 0 0 0 -4,-2.8 58,-0.4 1,-0.3 57,-0.3 0.654 103.5 57.3 -70.8 -22.6 17.1 3.8 13.4 54 55 A F T 3<5S- 0 0 20 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.434 132.4 -86.8 -88.0 -2.0 18.9 0.5 14.3 55 56 A G T < 5S+ 0 0 32 -3,-1.8 2,-0.7 -4,-0.2 3,-0.3 0.616 92.2 123.4 110.8 18.6 20.8 0.8 10.9 56 57 A G > < + 0 0 11 -5,-2.1 3,-0.6 -6,-0.2 -3,-0.1 -0.568 22.3 138.4-101.1 67.2 18.5 -0.9 8.4 57 58 A T G > + 0 0 52 -2,-0.7 3,-3.1 1,-0.2 -1,-0.2 0.683 43.1 95.5 -88.1 -28.9 18.3 2.1 6.1 58 59 A D G 3 S+ 0 0 129 1,-0.3 -1,-0.2 -3,-0.3 3,-0.2 0.561 85.9 48.7 -11.8 -37.1 18.6 -0.1 3.0 59 60 A K G < S+ 0 0 150 -3,-0.6 -1,-0.3 1,-0.2 2,-0.2 0.444 100.9 67.3-100.1 -4.9 14.7 -0.1 2.8 60 61 A Y < - 0 0 46 -3,-3.1 -1,-0.2 -8,-0.1 -2,-0.1 -0.544 65.2-175.1-129.3 59.8 14.2 3.6 3.1 61 62 A D >> - 0 0 73 -2,-0.2 4,-2.4 -3,-0.2 3,-0.9 -0.304 35.4-120.7 -47.6 132.9 15.7 5.3 -0.0 62 63 A G H 3> S+ 0 0 20 1,-0.3 4,-2.4 2,-0.2 -1,-0.1 0.777 112.1 57.4 -54.1 -27.6 15.4 9.0 0.4 63 64 A R H 3> S+ 0 0 192 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.835 107.9 46.3 -75.7 -34.2 13.3 9.4 -2.7 64 65 A Y H <> S+ 0 0 139 -3,-0.9 4,-3.0 2,-0.2 -2,-0.2 0.892 112.8 51.0 -68.4 -41.0 10.7 7.0 -1.2 65 66 A M H X S+ 0 0 25 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.908 109.5 50.6 -62.5 -42.0 10.9 8.9 2.1 66 67 A R H X S+ 0 0 90 -4,-2.4 4,-0.6 -5,-0.2 3,-0.4 0.969 116.0 39.8 -65.5 -50.1 10.4 12.2 0.3 67 68 A E H >< S+ 0 0 137 -4,-2.0 3,-0.9 1,-0.2 4,-0.5 0.908 111.2 58.0 -62.8 -41.1 7.2 10.9 -1.6 68 69 A A H 3< S+ 0 0 55 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.814 116.0 34.6 -64.5 -30.0 5.8 9.0 1.4 69 70 A H H 3X S+ 0 0 22 -4,-1.3 4,-2.3 -3,-0.4 3,-0.4 0.368 86.3 102.6-105.2 3.8 5.7 12.1 3.6 70 71 A K H >S+ 0 0 142 -4,-0.5 4,-2.5 1,-0.2 5,-0.6 0.842 110.3 53.0 -66.1 -31.2 1.2 15.0 2.0 72 73 A L H >5S+ 0 0 37 -3,-0.4 6,-2.2 3,-0.2 4,-1.5 0.926 111.7 45.8 -63.4 -42.6 2.2 15.3 5.6 73 74 A V H <5S+ 0 0 36 -4,-2.3 4,-0.4 4,-0.2 -2,-0.2 0.939 121.4 36.4 -66.6 -43.3 4.5 18.1 4.9 74 75 A E H <5S+ 0 0 116 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.829 133.2 20.5 -82.2 -32.4 2.1 20.0 2.6 75 76 A N H <5S+ 0 0 124 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.577 127.6 40.2-118.1 -20.2 -1.3 19.4 4.4 76 77 A H S < - 0 0 69 -2,-0.1 4,-2.1 1,-0.0 3,-0.5 -0.822 57.2 -75.0-145.2 178.3 8.3 19.8 10.4 80 81 A G H > S+ 0 0 19 -2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.799 122.4 57.9 -45.7 -44.4 11.5 19.3 12.3 81 82 A E H > S+ 0 0 155 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.928 109.2 46.2 -55.5 -47.1 9.9 19.4 15.7 82 83 A H H > S+ 0 0 30 -3,-0.5 4,-1.6 2,-0.2 -2,-0.2 0.929 111.6 50.8 -62.1 -45.8 7.6 16.5 14.7 83 84 A F H X S+ 0 0 12 -4,-2.1 4,-1.7 1,-0.2 3,-0.3 0.931 111.8 47.7 -57.9 -47.5 10.5 14.6 13.3 84 85 A D H X S+ 0 0 79 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.862 105.9 59.0 -62.2 -38.2 12.5 15.1 16.5 85 86 A A H X S+ 0 0 2 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.878 103.5 51.8 -61.3 -36.3 9.5 14.0 18.6 86 87 A V H X S+ 0 0 19 -4,-1.6 4,-2.1 -3,-0.3 -1,-0.2 0.937 111.9 45.8 -67.7 -47.1 9.4 10.6 16.9 87 88 A A H X S+ 0 0 10 -4,-1.7 4,-2.3 1,-0.2 5,-0.2 0.932 112.0 50.9 -59.4 -44.5 13.1 10.0 17.6 88 89 A E H X S+ 0 0 102 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.858 108.5 53.3 -61.8 -35.8 12.8 11.1 21.2 89 90 A D H X S+ 0 0 8 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.901 109.2 49.2 -65.8 -41.7 9.8 8.8 21.6 90 91 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.906 111.3 47.5 -61.3 -45.7 11.9 5.9 20.3 91 92 A L H X S+ 0 0 40 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.838 110.6 52.5 -70.2 -31.4 14.9 6.6 22.6 92 93 A A H X S+ 0 0 32 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.911 109.9 50.1 -67.6 -39.8 12.5 7.0 25.6 93 94 A T H X S+ 0 0 0 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.931 110.4 48.0 -60.5 -50.5 11.0 3.5 24.7 94 95 A L H <>S+ 0 0 0 -4,-2.3 5,-2.6 1,-0.2 -1,-0.2 0.810 109.5 53.9 -61.3 -34.1 14.4 1.8 24.4 95 96 A K H ><5S+ 0 0 138 -4,-1.4 3,-1.8 1,-0.2 -1,-0.2 0.912 105.1 53.0 -67.6 -43.6 15.5 3.3 27.8 96 97 A E H 3<5S+ 0 0 101 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.703 107.2 53.0 -69.7 -17.7 12.5 1.9 29.5 97 98 A M T 3<5S- 0 0 47 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.083 121.2-109.4-100.6 20.1 13.3 -1.6 28.1 98 99 A G T < 5 + 0 0 59 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.644 54.8 168.9 68.8 22.3 16.8 -1.3 29.6 99 100 A V < - 0 0 19 -5,-2.6 -1,-0.2 1,-0.1 5,-0.1 -0.492 49.1 -94.0 -65.2 133.9 18.7 -0.9 26.3 100 101 A P >> - 0 0 65 0, 0.0 4,-2.4 0, 0.0 3,-0.5 -0.165 28.7-124.0 -47.3 139.0 22.3 0.2 27.2 101 102 A E H 3> S+ 0 0 113 1,-0.3 4,-1.3 2,-0.2 5,-0.1 0.801 111.6 53.9 -65.4 -26.7 22.8 4.0 27.1 102 103 A D H 3> S+ 0 0 112 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.857 109.1 48.8 -73.1 -36.0 25.7 3.6 24.6 103 104 A L H <> S+ 0 0 63 -3,-0.5 4,-2.1 2,-0.2 -2,-0.2 0.921 108.4 53.2 -71.1 -39.5 23.4 1.7 22.3 104 105 A I H X S+ 0 0 6 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.855 107.8 51.7 -56.8 -34.8 20.6 4.3 22.6 105 106 A A H X S+ 0 0 59 -4,-1.3 4,-1.7 -5,-0.2 -1,-0.2 0.909 107.0 53.8 -76.1 -34.7 23.2 6.9 21.6 106 107 A E H X S+ 0 0 115 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.913 112.2 42.9 -58.4 -48.4 24.1 4.9 18.6 107 108 A V H X S+ 0 0 5 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.871 108.1 60.5 -71.0 -29.0 20.4 4.7 17.5 108 109 A A H X S+ 0 0 36 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.896 102.7 53.6 -59.3 -34.7 20.0 8.4 18.4 109 110 A A H < S+ 0 0 68 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.876 113.8 39.3 -73.2 -38.9 22.7 9.1 15.7 110 111 A V H >< S+ 0 0 44 -4,-1.3 3,-1.8 -57,-0.3 -2,-0.2 0.925 114.1 53.8 -72.9 -46.2 20.9 7.2 12.9 111 112 A A H 3< S+ 0 0 0 -4,-2.9 -2,-0.2 -58,-0.4 -3,-0.2 0.896 117.2 37.9 -54.0 -45.3 17.4 8.4 13.9 112 113 A G T 3< S+ 0 0 41 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.140 82.6 142.8 -94.4 15.8 18.5 12.0 13.8 113 114 A A <> - 0 0 28 -3,-1.8 4,-1.5 1,-0.1 -3,-0.1 -0.401 49.6-134.9 -61.3 134.6 20.7 11.7 10.8 114 115 A P H > S+ 0 0 87 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.825 92.0 53.6 -66.3 -45.6 20.4 14.8 8.7 115 116 A A H > S+ 0 0 45 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.902 112.1 44.9 -64.3 -41.9 20.1 13.6 5.0 116 117 A A H > S+ 0 0 21 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.885 111.4 55.3 -65.3 -36.8 17.1 11.3 5.7 117 118 A K H X S+ 0 0 48 -4,-1.5 4,-2.7 1,-0.2 -2,-0.2 0.937 105.8 51.2 -59.8 -46.2 15.5 14.1 7.8 118 119 A R H <>S+ 0 0 131 -4,-2.2 5,-2.9 2,-0.2 4,-0.3 0.850 111.7 48.3 -58.3 -39.4 15.8 16.4 4.8 119 120 A D H ><5S+ 0 0 37 -4,-1.5 3,-1.4 3,-0.2 -2,-0.2 0.958 112.4 45.5 -68.8 -53.1 14.1 13.8 2.6 120 121 A V H 3<5S+ 0 0 16 -4,-2.7 -47,-0.2 1,-0.3 -2,-0.2 0.927 116.1 47.8 -52.7 -47.8 11.2 13.0 5.0 121 122 A L T 3<5S- 0 0 7 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.502 108.8-128.3 -76.7 -1.7 10.7 16.8 5.6 122 123 A N T < 5 0 0 39 -3,-1.4 -3,-0.2 -4,-0.3 -4,-0.1 0.902 360.0 360.0 56.6 44.4 10.8 17.4 1.8 123 124 A Q < 0 0 157 -5,-2.9 -1,-0.2 -6,-0.2 -57,-0.0 -0.452 360.0 360.0 -93.4 360.0 13.4 20.1 2.3