==== 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 10-DEC-03 1RTX . COMPND 2 MOLECULE: CYANOGLOBIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR J.A.HOY,S.KUNDU,J.T.TRENT,S.RAMASWAMY,M.S.HARGROVE . 123 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7114.0 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 . 16 13.0 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 0 1 1 2 0 0 0 1 0 0 0 0 3 0 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 0 120 0, 0.0 55,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-136.4 22.3 -7.9 8.4 2 3 A T > - 0 0 55 3,-0.1 4,-1.9 4,-0.1 3,-0.2 0.610 360.0 -44.7 -95.0-142.5 19.1 -6.3 9.8 3 4 A L H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.824 116.5 53.8 -67.6 -50.6 16.5 -6.0 12.6 4 5 A Y H >>S+ 0 0 154 1,-0.2 5,-3.9 2,-0.2 4,-1.2 0.920 118.0 39.1 -48.4 -49.4 15.7 -9.5 13.7 5 6 A E H 45S+ 0 0 124 -3,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.811 112.8 54.1 -78.6 -29.2 19.5 -10.2 14.3 6 7 A K H <5S+ 0 0 82 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.833 117.3 36.4 -70.3 -35.4 20.4 -6.8 15.8 7 8 A L H <5S- 0 0 35 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.641 121.7-103.0 -93.9 -17.6 17.7 -7.0 18.5 8 9 A G T <5 - 0 0 62 -4,-1.2 4,-0.2 -5,-0.3 -3,-0.2 0.799 68.2 -50.6 98.8 38.0 18.1 -10.7 19.0 9 10 A G S > S+ 0 0 102 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.813 126.0 44.2 -50.1 -51.4 11.3 -12.4 16.8 11 12 A T H > S+ 0 0 120 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.903 113.8 50.6 -67.0 -44.4 10.1 -11.6 20.4 12 13 A A H > S+ 0 0 29 -4,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.879 110.8 48.9 -63.4 -39.9 12.7 -8.8 20.9 13 14 A V H X S+ 0 0 11 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.932 111.9 48.6 -66.1 -44.3 11.7 -7.1 17.6 14 15 A D H X S+ 0 0 73 -4,-2.0 4,-3.0 2,-0.2 5,-0.2 0.900 110.5 52.4 -62.0 -42.8 8.0 -7.3 18.5 15 16 A L H X S+ 0 0 84 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.949 111.8 44.7 -57.1 -50.2 8.7 -5.8 21.9 16 17 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.944 116.3 46.5 -61.0 -47.8 10.7 -2.9 20.4 17 18 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.927 114.1 47.1 -62.2 -46.6 8.0 -2.3 17.7 18 19 A D H X S+ 0 0 60 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.919 113.2 47.5 -63.9 -43.9 5.1 -2.5 20.1 19 20 A K H X S+ 0 0 75 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.912 114.4 47.5 -61.7 -43.0 6.6 -0.2 22.8 20 21 A F H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 5,-0.2 0.939 112.8 49.0 -62.1 -48.2 7.5 2.4 20.0 21 22 A Y H X S+ 0 0 45 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.903 111.4 50.5 -57.4 -43.9 4.0 2.1 18.6 22 23 A E H X S+ 0 0 99 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.927 110.9 47.2 -62.5 -48.6 2.5 2.6 22.1 23 24 A R H < S+ 0 0 65 -4,-2.5 3,-0.3 1,-0.2 4,-0.2 0.917 114.0 46.5 -61.8 -44.9 4.6 5.7 22.9 24 25 A V H >< S+ 0 0 0 -4,-2.4 3,-1.3 1,-0.2 6,-0.2 0.895 108.6 56.3 -66.0 -37.4 3.9 7.4 19.6 25 26 A L H 3< S+ 0 0 60 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.804 112.3 42.3 -63.2 -30.2 0.1 6.6 19.8 26 27 A Q T 3< S+ 0 0 133 -4,-1.3 2,-0.9 -3,-0.3 -1,-0.3 0.326 89.6 104.5 -97.9 3.2 -0.0 8.4 23.2 27 28 A D X> - 0 0 17 -3,-1.3 4,-2.2 -4,-0.2 3,-1.6 -0.795 53.0-166.1 -95.6 101.6 2.2 11.3 22.1 28 29 A D T 34 S+ 0 0 114 -2,-0.9 4,-0.3 1,-0.3 -1,-0.2 0.663 82.6 69.1 -63.1 -17.7 -0.1 14.2 21.5 29 30 A R T 34 S+ 0 0 98 1,-0.1 -1,-0.3 2,-0.1 56,-0.1 0.825 123.8 4.5 -66.2 -29.9 2.6 16.1 19.7 30 31 A I T X4 S+ 0 0 1 -3,-1.6 3,-1.6 -6,-0.2 4,-0.3 0.427 94.8 101.4-140.9 -4.2 2.5 13.7 16.8 31 32 A K G >< S+ 0 0 89 -4,-2.2 3,-1.7 1,-0.3 -3,-0.1 0.842 78.8 66.7 -63.0 -28.1 -0.3 11.1 17.1 32 33 A H G > S+ 0 0 79 -4,-0.3 3,-1.4 1,-0.3 4,-0.3 0.658 82.3 73.3 -65.5 -17.7 -2.5 13.2 14.6 33 34 A F G < S+ 0 0 14 -3,-1.6 -1,-0.3 1,-0.3 3,-0.2 0.734 101.5 46.3 -68.6 -15.5 -0.1 12.4 11.7 34 35 A F G X S+ 0 0 26 -3,-1.7 3,-1.7 -4,-0.3 -1,-0.3 0.295 79.6 107.4-105.9 6.6 -1.6 9.0 11.9 35 36 A A T < S+ 0 0 82 -3,-1.4 -1,-0.1 1,-0.3 -2,-0.1 0.782 79.3 47.2 -60.6 -32.7 -5.3 10.0 12.1 36 37 A D T 3 S+ 0 0 113 -4,-0.3 2,-0.3 -3,-0.2 -1,-0.3 0.196 103.6 73.3 -96.1 15.7 -6.3 8.9 8.5 37 38 A V S < S- 0 0 55 -3,-1.7 -3,-0.0 1,-0.0 2,-0.0 -0.897 84.7-106.2-127.5 154.9 -4.6 5.5 8.7 38 39 A D > - 0 0 97 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.242 31.9-105.4 -78.9 172.6 -5.6 2.4 10.5 39 40 A M H > S+ 0 0 110 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.874 119.3 54.8 -65.1 -33.9 -4.0 0.9 13.6 40 41 A A H > S+ 0 0 73 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.923 110.4 46.0 -65.5 -42.4 -2.3 -1.9 11.7 41 42 A K H > S+ 0 0 122 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.858 107.8 56.6 -71.5 -34.1 -0.7 0.7 9.3 42 43 A Q H X S+ 0 0 4 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.916 111.0 44.3 -58.5 -43.8 0.4 2.9 12.2 43 44 A R H X S+ 0 0 69 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.902 108.8 56.4 -69.3 -39.0 2.3 -0.0 13.8 44 45 A A H X S+ 0 0 37 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.853 106.7 52.3 -57.4 -37.5 3.7 -1.0 10.4 45 46 A H H X S+ 0 0 57 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.927 106.4 50.0 -65.5 -49.6 5.1 2.5 10.2 46 47 A Q H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.859 110.8 52.7 -58.6 -32.6 6.8 2.4 13.6 47 48 A K H X S+ 0 0 91 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.918 109.9 47.4 -65.3 -45.7 8.3 -0.9 12.5 48 49 A A H X S+ 0 0 28 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.930 112.3 48.6 -60.6 -47.1 9.7 0.7 9.3 49 50 A F H X S+ 0 0 25 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.906 113.0 48.5 -57.3 -46.3 11.1 3.7 11.2 50 51 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.903 110.4 50.8 -62.0 -45.3 12.8 1.3 13.7 51 52 A T H X>S+ 0 0 21 -4,-2.5 5,-3.0 1,-0.2 4,-0.7 0.896 112.5 47.4 -59.7 -45.5 14.2 -0.9 10.9 52 53 A Y H ><5S+ 0 0 29 -4,-2.5 3,-1.2 3,-0.2 5,-0.3 0.951 110.3 51.1 -59.4 -50.8 15.6 2.2 9.3 53 54 A A H 3<5S+ 0 0 1 -4,-2.7 58,-0.3 1,-0.3 57,-0.3 0.806 108.5 51.5 -61.4 -34.9 17.1 3.6 12.5 54 55 A F H 3<5S- 0 0 31 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.572 133.8 -86.4 -83.2 -11.9 18.9 0.3 13.2 55 56 A G T <<5S+ 0 0 39 -3,-1.2 2,-0.9 -4,-0.7 3,-0.4 0.512 89.5 125.5 126.8 8.6 20.3 0.3 9.7 56 57 A G > < + 0 0 7 -5,-3.0 3,-0.8 1,-0.2 4,-0.2 -0.282 29.0 142.2 -83.7 47.2 17.9 -1.2 7.2 57 58 A T G > + 0 0 55 -2,-0.9 3,-2.4 -5,-0.3 -1,-0.2 0.811 45.7 84.6 -56.0 -35.9 18.2 1.9 5.2 58 59 A D G 3 S+ 0 0 144 -3,-0.4 -1,-0.2 1,-0.3 3,-0.2 0.720 88.2 46.5 -40.3 -45.3 18.1 0.0 1.8 59 60 A K G < S+ 0 0 154 -3,-0.8 2,-0.3 1,-0.2 -1,-0.3 0.427 101.4 71.1 -87.8 1.4 14.3 -0.4 1.4 60 61 A Y S < S- 0 0 45 -3,-2.4 -1,-0.2 -4,-0.2 -2,-0.1 -0.618 71.5-168.3-123.6 64.1 13.6 3.3 2.3 61 62 A D > - 0 0 67 -2,-0.3 4,-2.6 -3,-0.2 3,-0.4 -0.285 29.3-122.7 -44.2 129.3 14.9 5.2 -0.7 62 63 A G H > S+ 0 0 23 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.819 113.1 54.5 -45.1 -41.6 15.1 9.0 -0.1 63 64 A R H > S+ 0 0 190 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.884 109.0 47.5 -66.6 -38.5 12.8 9.6 -3.0 64 65 A Y H > S+ 0 0 142 -3,-0.4 4,-3.1 2,-0.2 -2,-0.2 0.893 110.6 52.9 -66.7 -38.6 10.2 7.2 -1.5 65 66 A M H X S+ 0 0 15 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.951 108.8 49.9 -61.7 -46.8 10.6 9.0 1.8 66 67 A R H < S+ 0 0 77 -4,-2.8 4,-0.3 1,-0.2 3,-0.2 0.941 117.4 39.1 -54.2 -52.6 10.0 12.4 0.2 67 68 A E H >< S+ 0 0 127 -4,-2.2 3,-1.1 1,-0.2 4,-0.5 0.885 110.6 58.4 -66.5 -41.0 6.8 11.2 -1.5 68 69 A A H 3< S+ 0 0 55 -4,-3.1 -1,-0.2 1,-0.3 4,-0.2 0.793 115.8 35.3 -63.1 -30.4 5.6 9.0 1.4 69 70 A H T 3X S+ 0 0 18 -4,-1.6 4,-2.3 -3,-0.2 -1,-0.3 0.318 86.7 103.5-103.2 5.3 5.5 12.0 3.8 70 71 A K H <> S+ 0 0 73 -3,-1.1 4,-3.2 -4,-0.3 5,-0.2 0.907 81.8 48.7 -59.6 -45.8 4.4 14.7 1.3 71 72 A E H >>S+ 0 0 125 -4,-0.5 4,-3.5 2,-0.2 5,-1.0 0.876 109.3 53.7 -63.3 -36.3 0.8 14.8 2.5 72 73 A L H >5S+ 0 0 34 3,-0.2 6,-2.6 2,-0.2 4,-1.1 0.939 114.3 42.4 -57.6 -47.5 2.0 15.1 6.1 73 74 A V H <5S+ 0 0 38 -4,-2.3 4,-0.4 4,-0.2 -2,-0.2 0.945 126.1 32.9 -65.3 -45.4 4.2 18.1 5.1 74 75 A E H <5S+ 0 0 119 -4,-3.2 -2,-0.2 -5,-0.2 -3,-0.2 0.812 135.0 21.3 -81.8 -32.4 1.5 19.7 2.9 75 76 A N H <5S+ 0 0 114 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.1 0.689 126.6 39.6-114.9 -28.7 -1.7 18.7 4.7 76 77 A H S < - 0 0 71 -2,-0.1 4,-2.0 1,-0.0 3,-0.5 -0.738 56.1 -81.7-135.2-172.7 7.8 20.0 10.5 80 81 A G H > S+ 0 0 19 1,-0.2 4,-3.1 -2,-0.2 5,-0.2 0.802 121.0 61.9 -64.0 -34.5 11.1 19.3 12.4 81 82 A E H > S+ 0 0 134 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.887 110.1 43.7 -57.4 -37.8 9.7 19.7 15.8 82 83 A H H > S+ 0 0 24 -3,-0.5 4,-1.7 2,-0.2 -2,-0.2 0.891 110.9 52.7 -73.8 -44.4 7.5 16.7 14.9 83 84 A F H X S+ 0 0 8 -4,-2.0 4,-2.1 1,-0.2 3,-0.4 0.948 110.7 48.7 -54.3 -49.7 10.2 14.7 13.3 84 85 A D H X S+ 0 0 78 -4,-3.1 4,-3.0 1,-0.2 -1,-0.2 0.859 105.1 58.5 -61.6 -37.3 12.3 15.2 16.5 85 86 A A H X S+ 0 0 2 -4,-1.4 4,-2.0 -5,-0.2 -1,-0.2 0.881 108.2 45.9 -59.9 -40.4 9.4 14.1 18.7 86 87 A V H X S+ 0 0 16 -4,-1.7 4,-2.1 -3,-0.4 -2,-0.2 0.923 112.9 49.2 -68.7 -46.0 9.2 10.7 16.9 87 88 A A H X S+ 0 0 16 -4,-2.1 4,-1.9 1,-0.2 3,-0.2 0.955 112.4 49.2 -56.9 -48.2 13.0 10.2 17.0 88 89 A E H X S+ 0 0 107 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.837 107.4 54.7 -61.0 -38.6 12.9 11.1 20.8 89 90 A D H X S+ 0 0 7 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.875 107.2 51.3 -59.7 -43.7 10.1 8.6 21.3 90 91 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 -3,-0.2 -2,-0.2 0.927 111.7 46.2 -58.7 -44.5 12.2 5.8 19.7 91 92 A L H X S+ 0 0 46 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.892 110.7 52.2 -72.9 -34.7 15.1 6.5 22.0 92 93 A A H X S+ 0 0 31 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.892 109.5 51.3 -65.2 -38.7 12.9 6.7 25.1 93 94 A T H < S+ 0 0 0 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.908 110.2 48.5 -61.1 -46.1 11.5 3.3 24.1 94 95 A L H ><>S+ 0 0 0 -4,-2.3 5,-1.6 1,-0.2 3,-0.8 0.857 110.6 50.5 -67.7 -35.2 15.0 1.8 23.7 95 96 A K H ><5S+ 0 0 129 -4,-2.2 3,-2.1 1,-0.2 -1,-0.2 0.923 106.8 54.7 -62.9 -44.2 16.1 3.3 27.1 96 97 A E T 3<5S+ 0 0 118 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.426 108.6 51.3 -68.7 -0.4 12.9 1.7 28.6 97 98 A M T < 5S- 0 0 53 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.271 117.4-114.7-113.7 -1.2 14.2 -1.6 27.2 98 99 A G T < 5 + 0 0 63 -3,-2.1 -3,-0.2 1,-0.2 3,-0.1 0.388 55.7 162.9 77.3 -3.1 17.7 -1.2 28.7 99 100 A V < - 0 0 25 -5,-1.6 -1,-0.2 -6,-0.2 -2,-0.1 -0.228 53.1 -92.2 -44.8 131.7 19.4 -0.8 25.3 100 101 A P >> - 0 0 58 0, 0.0 4,-1.9 0, 0.0 3,-0.8 -0.297 26.0-126.1 -65.6 136.0 22.9 0.7 26.1 101 102 A E H 3> S+ 0 0 98 1,-0.3 4,-1.1 2,-0.2 -2,-0.1 0.720 111.7 51.8 -53.9 -30.9 23.1 4.5 25.9 102 103 A D H 3> S+ 0 0 101 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.903 111.2 46.5 -65.0 -46.0 26.0 4.3 23.5 103 104 A L H <> S+ 0 0 77 -3,-0.8 4,-1.4 1,-0.2 -2,-0.2 0.713 108.6 55.1 -74.9 -23.9 24.1 1.9 21.2 104 105 A I H X S+ 0 0 3 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.829 104.6 55.2 -72.4 -35.5 21.0 4.1 21.3 105 106 A A H X S+ 0 0 53 -4,-1.1 4,-2.0 -5,-0.3 -2,-0.2 0.856 102.6 57.8 -63.6 -36.1 23.2 7.0 20.2 106 107 A E H X S+ 0 0 117 -4,-1.3 4,-0.8 2,-0.2 -2,-0.2 0.939 113.2 36.3 -58.7 -54.0 24.2 4.8 17.2 107 108 A V H X S+ 0 0 9 -4,-1.4 4,-2.7 1,-0.2 5,-0.3 0.817 111.6 63.4 -69.3 -28.9 20.6 4.5 16.0 108 109 A A H X S+ 0 0 31 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.871 102.6 49.6 -61.8 -39.7 19.9 8.1 17.1 109 110 A A H < S+ 0 0 69 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.758 115.8 43.3 -68.4 -28.1 22.4 9.3 14.5 110 111 A V H >< S+ 0 0 43 -4,-0.8 3,-1.8 -57,-0.3 -2,-0.2 0.959 114.1 45.3 -81.9 -58.8 20.8 7.2 11.8 111 112 A A H 3< S+ 0 0 2 -4,-2.7 -3,-0.2 -58,-0.3 -2,-0.2 0.821 122.4 40.4 -51.5 -37.3 17.1 7.9 12.5 112 113 A G T 3< S+ 0 0 33 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.184 83.6 140.8-103.4 17.2 17.8 11.6 12.8 113 114 A A X> - 0 0 28 -3,-1.8 4,-2.7 1,-0.1 3,-0.8 -0.332 59.2-120.1 -69.2 139.3 20.4 12.0 10.0 114 115 A P H 3> S+ 0 0 92 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.788 108.8 51.9 -48.1 -45.4 20.1 15.2 8.0 115 116 A A H 3> S+ 0 0 58 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.861 115.1 43.0 -66.8 -34.5 19.5 13.6 4.5 116 117 A H H <> S+ 0 0 14 -3,-0.8 4,-3.1 2,-0.2 5,-0.3 0.925 114.3 48.5 -75.3 -45.1 16.6 11.5 5.9 117 118 A K H X S+ 0 0 58 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.955 112.0 51.9 -58.7 -45.2 15.1 14.4 8.0 118 119 A R H <>S+ 0 0 115 -4,-3.1 5,-3.0 -5,-0.2 4,-0.3 0.899 112.4 45.0 -54.1 -44.8 15.4 16.5 4.8 119 120 A D H ><5S+ 0 0 30 -4,-1.8 3,-1.1 3,-0.2 -2,-0.2 0.943 114.6 46.8 -66.0 -49.6 13.5 13.9 2.7 120 121 A V H 3<5S+ 0 0 8 -4,-3.1 -47,-0.2 1,-0.3 -2,-0.2 0.927 115.8 46.2 -59.7 -44.0 10.8 13.3 5.4 121 122 A L T 3<5S- 0 0 11 -4,-2.9 -1,-0.3 -5,-0.3 -2,-0.2 0.431 110.0-123.1 -80.8 -0.4 10.3 17.1 5.8 122 123 A N T < 5 0 0 35 -3,-1.1 -3,-0.2 -4,-0.3 -4,-0.1 0.918 360.0 360.0 58.8 41.8 10.3 17.7 2.0 123 124 A Q < 0 0 160 -5,-3.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.799 360.0 360.0 -80.1 360.0 13.2 20.1 2.3