==== 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 2HZ3 . 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) . 7319.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 94 76.4 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 . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 56.1 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 1 0 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 0 132 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 147.6 22.0 -8.6 9.0 2 3 A T >> - 0 0 86 3,-0.1 4,-1.5 54,-0.0 3,-0.5 0.417 360.0 -79.5 -96.9-166.6 19.0 -6.9 10.8 3 4 A L H 3> S+ 0 0 10 1,-0.2 4,-1.9 2,-0.2 5,-0.5 0.916 119.0 66.8 -54.2 -50.6 17.2 -5.5 13.8 4 5 A Y H 34>S+ 0 0 150 1,-0.2 5,-2.2 2,-0.2 4,-0.4 0.786 105.9 45.0 -41.7 -34.3 16.2 -9.1 14.7 5 6 A E H <45S+ 0 0 123 -3,-0.5 3,-0.2 3,-0.2 -1,-0.2 0.956 111.4 48.4 -76.1 -53.1 20.0 -9.5 15.4 6 7 A K H <5S+ 0 0 90 -4,-1.5 -2,-0.2 1,-0.2 -3,-0.1 0.665 117.9 36.4 -70.3 -28.4 20.8 -6.3 17.4 7 8 A L T <5S- 0 0 33 -4,-1.9 -1,-0.2 2,-0.0 -3,-0.1 0.562 119.3-102.4 -96.5 -18.6 18.0 -6.4 20.0 8 9 A G T 5 - 0 0 59 -5,-0.5 4,-0.3 -4,-0.4 3,-0.2 0.851 63.2 -46.7 102.5 40.6 18.0 -10.2 20.4 9 10 A G S > S+ 0 0 103 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.846 128.4 47.6 -59.2 -45.5 11.4 -11.9 18.1 11 12 A T H > S+ 0 0 119 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.915 112.6 48.2 -69.9 -44.6 10.3 -11.2 21.6 12 13 A A H > S+ 0 0 22 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.912 115.0 46.3 -58.4 -44.9 12.8 -8.4 22.2 13 14 A V H X S+ 0 0 16 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.940 111.8 51.5 -66.2 -45.2 11.8 -6.8 18.8 14 15 A D H X S+ 0 0 73 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.919 110.4 48.2 -59.1 -45.9 8.1 -7.2 19.7 15 16 A L H X S+ 0 0 83 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.941 113.0 49.0 -55.8 -50.0 8.6 -5.5 23.1 16 17 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.931 115.8 42.1 -53.7 -50.4 10.5 -2.6 21.5 17 18 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.861 113.7 50.5 -70.0 -42.9 8.0 -2.0 18.8 18 19 A D H X S+ 0 0 62 -4,-2.6 4,-2.7 -5,-0.3 -1,-0.2 0.912 113.5 45.7 -64.1 -41.7 4.8 -2.4 21.0 19 20 A K H X S+ 0 0 73 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.904 114.8 47.5 -68.4 -42.2 6.2 0.1 23.6 20 21 A F H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.945 113.5 48.6 -63.1 -49.2 7.3 2.6 20.9 21 22 A Y H X S+ 0 0 38 -4,-3.0 4,-3.0 2,-0.2 -2,-0.2 0.939 110.8 51.1 -53.1 -49.9 3.8 2.2 19.2 22 23 A E H X S+ 0 0 95 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.885 111.5 47.7 -59.3 -42.5 2.1 2.7 22.6 23 24 A R H < S+ 0 0 81 -4,-2.3 3,-0.4 2,-0.2 -1,-0.2 0.933 113.4 46.0 -66.7 -44.6 4.1 5.9 23.3 24 25 A V H >< S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.913 107.4 58.5 -65.4 -39.6 3.4 7.4 19.8 25 26 A L H 3< S+ 0 0 63 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.815 111.8 41.3 -55.1 -35.1 -0.3 6.5 20.0 26 27 A Q T 3< S+ 0 0 136 -4,-1.1 2,-0.8 -3,-0.4 -1,-0.3 0.256 88.8 108.0 -97.6 8.3 -0.6 8.6 23.2 27 28 A D X> - 0 0 15 -3,-1.7 4,-2.0 -4,-0.2 3,-1.6 -0.803 50.2-166.1-101.4 104.2 1.7 11.5 22.0 28 29 A D T 34 S+ 0 0 120 -2,-0.8 4,-0.3 1,-0.3 -1,-0.1 0.598 83.8 66.4 -65.8 -16.2 -0.5 14.6 21.2 29 30 A R T 34 S+ 0 0 97 1,-0.1 -1,-0.3 2,-0.1 56,-0.1 0.822 120.9 14.4 -71.4 -30.5 2.2 16.3 19.4 30 31 A I T X4 S+ 0 0 2 -3,-1.6 3,-1.7 -6,-0.2 4,-0.4 0.485 95.1 95.3-127.7 -10.6 2.2 13.7 16.6 31 32 A K G >< S+ 0 0 87 -4,-2.0 3,-2.1 1,-0.3 -3,-0.1 0.852 78.0 65.3 -58.2 -34.4 -1.0 11.6 16.8 32 33 A H G > S+ 0 0 86 -4,-0.3 3,-1.0 1,-0.3 -1,-0.3 0.638 88.7 68.2 -67.8 -13.9 -2.9 13.6 14.2 33 34 A F G < S+ 0 0 12 -3,-1.7 3,-0.3 1,-0.2 -1,-0.3 0.773 103.2 46.0 -71.7 -19.6 -0.5 12.6 11.5 34 35 A F G X S+ 0 0 27 -3,-2.1 3,-2.0 -4,-0.4 -1,-0.2 0.151 78.3 113.5-102.5 14.7 -1.9 9.1 11.8 35 36 A A T < S+ 0 0 81 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.832 81.3 42.5 -59.8 -32.0 -5.5 10.2 11.8 36 37 A D T 3 S+ 0 0 116 -3,-0.3 2,-0.4 -4,-0.2 -1,-0.3 0.231 103.3 86.9 -99.0 17.4 -6.2 8.6 8.5 37 38 A V S < S- 0 0 47 -3,-2.0 -3,-0.0 1,-0.0 -4,-0.0 -0.904 72.2-127.2-125.6 132.2 -4.3 5.4 9.4 38 39 A D > - 0 0 111 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.223 32.7-101.9 -78.8 173.7 -5.5 2.2 11.2 39 40 A M H > S+ 0 0 137 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.887 120.0 53.2 -65.3 -40.5 -3.8 0.7 14.2 40 41 A A H > S+ 0 0 75 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.909 113.1 44.2 -56.6 -41.9 -2.1 -2.1 12.2 41 42 A K H > S+ 0 0 128 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.871 111.9 52.2 -75.7 -35.7 -0.6 0.4 9.8 42 43 A Q H X S+ 0 0 13 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.938 111.4 48.4 -63.8 -42.2 0.5 2.8 12.6 43 44 A R H X S+ 0 0 67 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.932 108.1 53.4 -65.2 -41.3 2.2 -0.1 14.3 44 45 A A H X S+ 0 0 41 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.854 106.1 54.8 -62.9 -30.2 3.9 -1.0 11.1 45 46 A H H X S+ 0 0 58 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.903 107.1 48.5 -65.3 -44.1 5.2 2.5 10.8 46 47 A Q H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.876 110.1 52.9 -68.2 -33.0 6.8 2.4 14.2 47 48 A K H X S+ 0 0 97 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.930 111.1 47.3 -64.9 -42.1 8.3 -0.9 13.3 48 49 A A H X S+ 0 0 27 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.925 112.8 47.0 -60.1 -51.5 9.8 0.7 10.2 49 50 A F H X S+ 0 0 24 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.930 114.0 48.3 -57.1 -47.6 11.1 3.8 12.0 50 51 A L H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.913 111.4 50.7 -59.6 -42.6 12.6 1.6 14.7 51 52 A T H <>S+ 0 0 29 -4,-2.4 5,-1.8 1,-0.2 -1,-0.2 0.898 111.7 48.0 -64.4 -43.7 14.2 -0.6 12.0 52 53 A Y H ><5S+ 0 0 20 -4,-2.7 3,-1.5 1,-0.2 5,-0.4 0.921 110.4 51.5 -57.3 -47.1 15.6 2.5 10.3 53 54 A A H 3<5S+ 0 0 1 -4,-2.7 58,-0.3 1,-0.3 57,-0.3 0.714 101.4 60.6 -71.9 -22.1 17.0 3.8 13.5 54 55 A F T 3<5S- 0 0 16 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.261 131.6 -84.3 -90.0 8.8 18.8 0.6 14.4 55 56 A G T < 5S+ 0 0 35 -3,-1.5 3,-0.4 -5,-0.1 -3,-0.2 0.519 96.5 119.3 107.2 8.1 20.9 0.8 11.3 56 57 A G > < + 0 0 17 -5,-1.8 3,-1.3 1,-0.2 -3,-0.1 -0.151 22.7 136.6 -91.8 37.3 18.7 -0.8 8.6 57 58 A T G > + 0 0 64 -5,-0.4 3,-2.5 1,-0.3 -1,-0.2 0.768 47.3 99.2 -48.9 -32.1 18.6 2.5 6.5 58 59 A D G 3 S+ 0 0 140 -3,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.621 83.8 35.7 -17.4 -48.9 19.1 0.0 3.7 59 60 A K G < S+ 0 0 172 -3,-1.3 -1,-0.3 1,-0.2 2,-0.3 0.168 97.5 81.1-112.6 16.4 15.4 -0.1 2.6 60 61 A Y < - 0 0 56 -3,-2.5 -1,-0.2 -4,-0.1 5,-0.1 -0.644 65.8-165.8-121.0 67.9 14.2 3.5 3.1 61 62 A D >> - 0 0 73 -2,-0.3 4,-2.2 1,-0.1 3,-0.7 -0.288 27.6-122.9 -43.2 132.0 15.5 5.3 0.0 62 63 A G H 3> S+ 0 0 18 1,-0.2 4,-2.4 2,-0.2 -1,-0.1 0.787 112.1 57.4 -55.7 -31.0 15.3 9.1 0.5 63 64 A R H 3> S+ 0 0 191 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.850 107.1 47.0 -70.2 -35.7 13.1 9.4 -2.5 64 65 A Y H <> S+ 0 0 141 -3,-0.7 4,-2.8 2,-0.2 -2,-0.2 0.886 112.0 51.8 -66.1 -41.4 10.6 7.0 -1.0 65 66 A M H X S+ 0 0 25 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.909 109.6 50.0 -64.0 -39.5 10.8 8.9 2.2 66 67 A R H X S+ 0 0 85 -4,-2.4 4,-0.7 1,-0.2 3,-0.5 0.966 116.6 39.0 -65.6 -48.2 10.1 12.2 0.4 67 68 A E H >< S+ 0 0 136 -4,-2.0 3,-0.8 1,-0.2 4,-0.5 0.905 111.5 59.0 -67.0 -39.8 7.1 10.9 -1.5 68 69 A A H 3< S+ 0 0 55 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.779 117.3 31.4 -63.5 -27.9 5.7 8.9 1.5 69 70 A H H 3X S+ 0 0 22 -4,-1.2 4,-2.2 -3,-0.5 3,-0.3 0.391 86.3 103.9-112.1 2.5 5.5 12.1 3.6 70 71 A K H >S+ 0 0 142 -4,-0.5 4,-2.5 1,-0.2 5,-0.7 0.865 110.0 53.4 -68.4 -29.1 1.1 15.0 2.0 72 73 A L H >5S+ 0 0 37 -3,-0.3 6,-2.3 3,-0.2 4,-1.4 0.922 111.7 45.5 -65.3 -43.7 2.0 15.3 5.7 73 74 A V H <5S+ 0 0 36 -4,-2.2 4,-0.3 4,-0.2 -2,-0.2 0.926 122.6 34.3 -65.4 -42.5 4.4 18.1 5.0 74 75 A E H <5S+ 0 0 109 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.861 134.2 21.6 -82.9 -34.9 1.9 20.0 2.7 75 76 A N H <5S+ 0 0 121 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.599 127.6 39.2-116.0 -23.3 -1.4 19.2 4.4 76 77 A H S <> - 0 0 69 -2,-0.1 4,-1.9 1,-0.0 3,-0.5 -0.825 60.0 -70.2-150.8-173.8 8.1 19.8 10.4 80 81 A G H 3> S+ 0 0 17 1,-0.3 4,-2.9 -2,-0.2 5,-0.2 0.817 122.0 58.2 -57.4 -41.1 11.2 19.3 12.5 81 82 A E H 3> S+ 0 0 141 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.916 110.0 45.6 -52.6 -48.0 9.5 19.5 15.9 82 83 A H H <> S+ 0 0 25 -3,-0.5 4,-1.6 2,-0.2 -2,-0.2 0.912 111.9 50.3 -63.6 -48.4 7.3 16.6 14.9 83 84 A F H X S+ 0 0 13 -4,-1.9 4,-2.0 1,-0.2 3,-0.5 0.954 110.5 50.6 -52.0 -48.8 10.2 14.5 13.5 84 85 A D H X S+ 0 0 81 -4,-2.9 4,-3.1 1,-0.2 -1,-0.2 0.840 105.1 57.2 -63.4 -34.5 12.2 15.1 16.7 85 86 A A H X S+ 0 0 2 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.849 106.4 49.9 -63.4 -38.5 9.2 14.0 18.9 86 87 A V H X S+ 0 0 18 -4,-1.6 4,-1.9 -3,-0.5 -2,-0.2 0.911 113.6 43.9 -64.6 -49.0 9.2 10.6 17.1 87 88 A A H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 3,-0.2 0.969 114.3 50.8 -61.0 -50.4 12.9 10.1 17.6 88 89 A E H X S+ 0 0 104 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.882 108.5 52.6 -50.9 -43.7 12.5 11.3 21.3 89 90 A D H X S+ 0 0 6 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.883 108.7 50.4 -63.5 -42.0 9.6 8.8 21.8 90 91 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 -3,-0.2 -2,-0.2 0.938 111.2 47.2 -59.8 -49.2 11.8 6.0 20.5 91 92 A L H X S+ 0 0 43 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.866 110.7 52.2 -63.4 -34.9 14.7 6.8 22.8 92 93 A A H X S+ 0 0 32 -4,-2.3 4,-1.6 -5,-0.2 -1,-0.2 0.881 109.7 50.6 -67.9 -36.0 12.4 7.1 25.8 93 94 A T H X S+ 0 0 0 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.909 109.5 49.0 -64.1 -46.4 11.0 3.7 25.0 94 95 A L H <>S+ 0 0 0 -4,-2.4 5,-2.2 1,-0.2 3,-0.3 0.857 109.9 52.0 -65.8 -37.8 14.4 2.1 24.8 95 96 A K H ><5S+ 0 0 141 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.836 106.0 53.1 -68.4 -37.6 15.5 3.6 28.1 96 97 A E H 3<5S+ 0 0 109 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.738 108.2 54.4 -63.3 -25.7 12.4 2.3 29.9 97 98 A M T 3<5S- 0 0 48 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.067 118.2-111.2 -98.4 12.5 13.3 -1.2 28.5 98 99 A G T < 5 + 0 0 62 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.589 54.6 166.1 67.3 14.8 16.9 -1.1 30.0 99 100 A V < - 0 0 18 -5,-2.2 -1,-0.2 1,-0.1 5,-0.1 -0.412 51.5 -93.8 -61.4 134.7 18.7 -0.8 26.6 100 101 A P >> - 0 0 59 0, 0.0 4,-2.4 0, 0.0 3,-0.8 -0.208 27.8-125.9 -52.8 139.4 22.3 0.2 27.4 101 102 A E H 3> S+ 0 0 114 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.820 110.9 57.8 -66.2 -28.6 22.8 4.0 27.3 102 103 A D H 3> S+ 0 0 115 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.848 108.8 45.5 -60.1 -41.6 25.7 3.6 24.8 103 104 A L H <> S+ 0 0 65 -3,-0.8 4,-2.5 2,-0.2 5,-0.3 0.923 109.3 53.2 -73.2 -43.1 23.3 1.8 22.4 104 105 A I H X S+ 0 0 6 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.906 108.5 52.7 -55.0 -39.2 20.5 4.3 22.8 105 106 A A H X S+ 0 0 60 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.2 0.896 107.7 51.2 -67.2 -39.3 23.1 7.0 21.9 106 107 A E H X S+ 0 0 121 -4,-1.5 4,-1.0 2,-0.2 -1,-0.2 0.893 114.0 42.5 -60.4 -46.0 24.0 5.0 18.7 107 108 A V H >X S+ 0 0 2 -4,-2.5 4,-3.1 1,-0.2 3,-0.6 0.913 107.2 61.9 -71.1 -32.8 20.3 4.8 17.6 108 109 A A H 3X S+ 0 0 33 -4,-2.9 4,-2.2 -5,-0.3 -2,-0.2 0.910 103.0 52.6 -54.3 -38.5 19.9 8.5 18.6 109 110 A A H 3< S+ 0 0 71 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.768 114.4 39.3 -71.0 -31.8 22.5 9.3 15.9 110 111 A V H X< S+ 0 0 35 -4,-1.0 3,-1.9 -3,-0.6 -2,-0.2 0.891 113.8 53.4 -80.2 -48.3 20.7 7.4 13.2 111 112 A A H 3< S+ 0 0 0 -4,-3.1 -2,-0.2 -58,-0.3 -3,-0.2 0.891 118.2 37.9 -50.6 -43.6 17.2 8.4 14.2 112 113 A G T 3< S+ 0 0 41 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.154 83.4 142.5 -96.2 17.9 18.3 12.1 14.1 113 114 A A <> - 0 0 27 -3,-1.9 4,-1.5 1,-0.1 5,-0.2 -0.358 49.9-133.9 -67.8 135.5 20.5 11.8 11.0 114 115 A P H > S+ 0 0 91 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.858 92.2 52.2 -63.4 -43.8 20.2 14.9 8.9 115 116 A A H > S+ 0 0 48 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.889 112.4 43.8 -70.3 -40.3 19.9 13.7 5.3 116 117 A A H > S+ 0 0 22 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.879 112.8 54.8 -69.4 -34.8 16.9 11.3 5.9 117 118 A K H X S+ 0 0 49 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.931 107.2 49.1 -61.6 -45.8 15.3 13.9 8.0 118 119 A R H <>S+ 0 0 117 -4,-2.3 5,-2.8 2,-0.2 4,-0.3 0.870 111.7 50.2 -64.4 -30.4 15.5 16.5 5.2 119 120 A D H ><5S+ 0 0 35 -4,-1.5 3,-1.8 3,-0.2 -2,-0.2 0.981 112.4 45.5 -71.0 -53.2 14.0 13.9 2.8 120 121 A V H 3<5S+ 0 0 16 -4,-2.7 -2,-0.2 1,-0.3 -47,-0.2 0.899 115.0 48.6 -50.2 -47.7 11.0 13.0 5.2 121 122 A L T 3<5S- 0 0 6 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.463 109.2-126.0 -77.1 -0.8 10.5 16.7 5.8 122 123 A N T < 5 0 0 40 -3,-1.8 -3,-0.2 -4,-0.3 -2,-0.1 0.897 360.0 360.0 57.5 42.7 10.6 17.5 2.0 123 124 A Q < 0 0 154 -5,-2.8 -1,-0.2 -6,-0.1 -57,-0.0 -0.514 360.0 360.0 -94.0 360.0 13.3 20.1 2.6