==== 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 LYASE 19-DEC-05 2FFC . COMPND 2 MOLECULE: OROTIDINE 5-MONOPHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM VIVAX; . AUTHOR A.DONG,G.WASNEY,M.VEDADI,J.LEW,I.KOEIERADZKI,Y.ZHAO,A.M.EDWA . 318 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14324.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 239 75.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 20 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 39.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 2 0 1 0 2 0 1 1 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 3 3 1 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 . 1 1 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 . 1 0 0 0 0 0 0 1 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 20 A N > 0 0 104 0, 0.0 4,-1.9 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 134.0 -7.4 23.7 12.5 2 21 A L H > + 0 0 6 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.755 360.0 61.1 -69.8 -33.5 -4.1 22.5 11.2 3 22 A K H > S+ 0 0 46 231,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.940 112.1 40.3 -62.0 -45.1 -3.4 24.7 8.2 4 23 A I H > S+ 0 0 76 -3,-0.4 4,-3.2 230,-0.2 5,-0.3 0.908 113.6 55.3 -65.9 -41.9 -3.5 27.9 10.4 5 24 A K H X S+ 0 0 38 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.931 110.6 44.5 -59.1 -45.6 -1.6 26.1 13.2 6 25 A L H X S+ 0 0 4 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.903 113.2 51.1 -66.4 -39.6 1.2 25.2 10.7 7 26 A Q H X S+ 0 0 63 -4,-2.0 4,-1.9 -5,-0.3 -2,-0.2 0.963 112.5 46.0 -62.9 -48.9 1.2 28.7 9.2 8 27 A K H X S+ 0 0 134 -4,-3.2 4,-1.2 1,-0.2 -2,-0.2 0.893 114.8 46.9 -55.9 -46.1 1.5 30.3 12.7 9 28 A R H X S+ 0 0 24 -4,-2.4 4,-2.4 -5,-0.3 3,-0.4 0.917 107.7 56.8 -63.8 -42.7 4.2 27.9 13.8 10 29 A R H X S+ 0 0 33 -4,-2.7 4,-2.1 1,-0.3 5,-0.4 0.903 108.1 47.5 -55.9 -45.3 6.2 28.5 10.6 11 30 A D H < S+ 0 0 81 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.782 112.1 51.8 -68.2 -26.6 6.3 32.2 11.3 12 31 A E H < S+ 0 0 134 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.883 124.9 22.1 -75.9 -41.4 7.4 31.6 14.9 13 32 A V H < S- 0 0 9 -4,-2.4 -2,-0.2 2,-0.2 -3,-0.2 0.509 91.8-139.4-107.4 -10.2 10.3 29.3 14.2 14 33 A N < + 0 0 89 -4,-2.1 2,-0.3 -5,-0.4 -3,-0.1 0.878 66.5 88.4 53.0 52.2 11.0 30.3 10.6 15 34 A T - 0 0 0 -5,-0.4 -1,-0.2 -6,-0.1 -2,-0.2 -0.967 68.6-140.1-161.1 167.9 11.7 26.7 9.3 16 35 A C + 0 0 0 -2,-0.3 274,-1.9 -3,-0.1 2,-0.2 0.166 55.5 137.9-121.0 19.3 10.1 23.7 7.9 17 36 A L E -a 290 0A 0 80,-0.3 82,-3.0 272,-0.2 83,-1.0 -0.428 35.7-164.0 -68.2 129.9 12.3 21.3 9.9 18 37 A C E -ab 291 100A 0 272,-2.7 274,-2.7 81,-0.2 2,-0.6 -0.978 13.9-140.0-114.2 119.7 10.2 18.4 11.4 19 38 A I E -ab 292 101A 0 81,-2.7 83,-2.0 -2,-0.5 2,-0.4 -0.797 10.5-144.5 -86.5 123.7 12.0 16.5 14.1 20 39 A G E - b 0 102A 0 272,-2.2 2,-0.7 -2,-0.6 277,-0.3 -0.684 9.4-164.2 -85.6 128.6 11.6 12.7 14.0 21 40 A L E + b 0 103A 0 81,-2.8 83,-0.5 -2,-0.4 86,-0.1 -0.833 29.6 146.4-117.2 90.3 11.4 11.1 17.5 22 41 A D - 0 0 25 -2,-0.7 2,-0.3 81,-0.2 81,-0.1 -0.698 28.9-166.5-121.7 70.8 12.0 7.4 16.9 23 42 A P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.463 1.3-162.0 -74.2 132.0 13.9 6.2 20.0 24 43 A D > - 0 0 48 -2,-0.3 4,-2.2 1,-0.1 3,-0.2 -0.512 36.3 -98.2-101.6 175.3 15.5 2.8 19.9 25 44 A E H > S+ 0 0 115 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.899 124.2 51.3 -59.7 -41.6 16.7 0.6 22.8 26 45 A A H > S+ 0 0 64 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.855 108.3 52.7 -61.2 -39.6 20.3 1.8 22.4 27 46 A D H > S+ 0 0 15 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.923 113.7 42.3 -58.8 -50.5 19.2 5.5 22.5 28 47 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.941 116.6 46.7 -63.6 -50.5 17.3 4.9 25.7 29 48 A K H X S+ 0 0 75 -4,-2.9 4,-2.5 -5,-0.2 -2,-0.2 0.903 113.7 49.5 -60.8 -41.3 20.1 2.7 27.4 30 49 A S H X S+ 0 0 66 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.914 111.0 48.0 -64.8 -45.3 22.8 5.2 26.3 31 50 A F H X S+ 0 0 9 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.917 111.6 51.8 -61.3 -43.8 20.8 8.2 27.7 32 51 A M H X S+ 0 0 9 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.917 110.5 48.7 -56.5 -47.7 20.3 6.3 30.9 33 52 A Q H X S+ 0 0 123 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.953 113.6 44.7 -57.3 -53.8 24.1 5.5 31.2 34 53 A S H X S+ 0 0 52 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.819 112.6 51.8 -67.1 -31.1 25.1 9.1 30.6 35 54 A E H X>S+ 0 0 0 -4,-2.3 5,-4.0 2,-0.2 4,-0.5 0.888 107.3 52.3 -70.6 -39.9 22.5 10.5 33.0 36 55 A K H <5S+ 0 0 62 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.854 115.6 43.1 -59.6 -36.0 23.6 8.1 35.8 37 56 A Q H <5S+ 0 0 167 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.793 116.1 43.8 -82.9 -33.7 27.2 9.4 35.2 38 57 A N H <5S- 0 0 51 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.359 118.5-107.3 -93.0 3.9 26.5 13.1 34.9 39 58 A G T <5 - 0 0 50 -4,-0.5 -3,-0.2 1,-0.2 -4,-0.1 0.863 67.7 -58.5 71.5 40.8 24.1 13.0 37.8 40 59 A Y S > S+ 0 0 120 -6,-0.2 4,-1.7 2,-0.2 5,-0.1 0.863 71.7 47.5 -62.0 -40.9 21.6 16.7 34.2 42 61 A S H > S+ 0 0 10 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.902 110.8 50.7 -75.6 -39.0 19.1 16.3 31.3 43 62 A V H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.937 106.7 55.7 -61.9 -40.8 16.2 15.2 33.6 44 63 A K H X S+ 0 0 160 -4,-2.1 4,-1.3 1,-0.2 5,-0.2 0.935 109.4 46.3 -55.5 -46.6 16.8 18.2 35.8 45 64 A K H X S+ 0 0 76 -4,-1.7 4,-3.0 1,-0.2 3,-0.4 0.905 109.3 55.7 -58.8 -43.3 16.4 20.4 32.7 46 65 A N H < S+ 0 0 6 -4,-2.4 4,-0.2 1,-0.2 -2,-0.2 0.902 108.3 49.1 -54.9 -41.2 13.3 18.4 31.7 47 66 A L H < S+ 0 0 49 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.731 121.7 31.5 -73.5 -25.4 11.8 19.2 35.1 48 67 A S H < S+ 0 0 68 -4,-1.3 3,-0.3 -3,-0.4 -2,-0.2 0.704 117.5 52.9-102.3 -26.2 12.5 22.9 35.1 49 68 A N S < S+ 0 0 77 -4,-3.0 -2,-0.1 -5,-0.2 -3,-0.1 0.148 75.2 100.7-102.9 21.5 12.2 23.7 31.4 50 69 A S 0 0 8 -4,-0.2 5,-0.2 1,-0.2 -1,-0.2 0.204 360.0 360.0 -94.2 14.6 8.8 22.2 30.6 51 70 A G 0 0 40 -3,-0.3 -1,-0.2 3,-0.2 -2,-0.1 0.848 360.0 360.0 -61.4 360.0 6.8 25.4 30.6 52 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 53 84 A E 0 0 195 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -10.3 2.5 26.1 33.4 54 85 A L - 0 0 101 1,-0.1 2,-0.2 -7,-0.0 -3,-0.2 -0.392 360.0 -98.0 -62.3 151.5 5.1 23.3 33.9 55 86 A F - 0 0 20 -5,-0.2 -1,-0.1 -2,-0.1 -5,-0.1 -0.496 29.1-160.1 -79.9 138.9 4.0 20.0 32.3 56 87 A A - 0 0 65 -2,-0.2 5,-0.1 -3,-0.1 6,-0.1 -0.912 16.9-139.8-117.8 101.9 2.4 17.3 34.4 57 88 A P - 0 0 11 0, 0.0 4,-0.2 0, 0.0 8,-0.1 -0.302 4.1-153.2 -55.3 136.8 2.6 13.8 32.7 58 89 A Q S S+ 0 0 113 1,-0.2 2,-0.8 2,-0.1 3,-0.2 0.716 80.6 64.9 -83.8 -27.5 -0.6 11.8 33.1 59 90 A M S S- 0 0 35 1,-0.2 -1,-0.2 58,-0.2 62,-0.1 -0.874 132.2 -19.3-104.2 106.6 1.0 8.4 32.8 60 91 A G S > S+ 0 0 38 -2,-0.8 4,-2.4 3,-0.1 5,-0.2 0.799 86.5 157.8 71.3 28.1 3.4 7.8 35.7 61 92 A G H > + 0 0 11 -4,-0.2 4,-2.5 1,-0.2 5,-0.2 0.888 65.3 51.7 -54.0 -50.1 3.6 11.5 36.4 62 93 A Q H > S+ 0 0 186 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.933 114.0 43.5 -55.6 -47.5 4.7 11.3 40.1 63 94 A M H >4 S+ 0 0 47 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.902 115.0 48.8 -69.4 -35.5 7.6 9.0 39.3 64 95 A L H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.850 109.7 52.5 -70.0 -34.1 8.7 11.0 36.2 65 96 A L H 3< 0 0 82 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.506 360.0 360.0 -83.2 -8.0 8.5 14.3 38.2 66 97 A A << 0 0 42 -4,-0.7 -19,-0.0 -3,-0.6 -3,-0.0 -0.440 360.0 360.0 -68.9 360.0 10.8 12.9 40.9 67 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 68 99 A T 0 0 122 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 140.7 15.1 10.9 42.5 69 100 A P - 0 0 13 0, 0.0 9,-0.1 0, 0.0 -5,-0.1 -0.134 360.0 -82.5 -53.1 156.4 14.9 8.2 39.6 70 101 A P - 0 0 27 0, 0.0 2,-0.1 0, 0.0 -7,-0.0 -0.281 53.2 -97.9 -61.9 153.9 13.7 4.6 40.1 71 102 A K > - 0 0 132 1,-0.1 3,-1.7 -3,-0.1 7,-0.3 -0.408 26.7-116.3 -73.8 150.9 16.1 2.1 41.6 72 103 A E T 3 S+ 0 0 127 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 0.769 113.9 67.3 -59.1 -27.1 18.0 -0.3 39.2 73 104 A A T 3 S+ 0 0 86 1,-0.2 2,-1.4 2,-0.1 -1,-0.3 0.812 90.2 66.2 -62.2 -30.5 16.2 -3.2 40.9 74 105 A Q S <> S+ 0 0 94 -3,-1.7 4,-2.7 1,-0.2 -1,-0.2 -0.610 70.1 171.2 -90.4 76.2 12.9 -1.8 39.4 75 106 A E H > S+ 0 0 134 -2,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.860 71.5 46.2 -63.8 -43.4 14.1 -2.6 35.8 76 107 A K H > S+ 0 0 131 2,-0.2 4,-2.6 -3,-0.2 -1,-0.2 0.936 114.9 46.0 -62.4 -49.4 10.7 -1.8 34.1 77 108 A D H > S+ 0 0 80 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.895 113.2 51.0 -62.4 -39.4 10.1 1.5 36.0 78 109 A E H X S+ 0 0 9 -4,-2.7 4,-2.6 -7,-0.3 5,-0.3 0.942 110.4 48.7 -61.8 -49.6 13.7 2.6 35.4 79 110 A F H X S+ 0 0 15 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.929 112.2 48.3 -58.3 -46.9 13.3 1.9 31.7 80 111 A F H X S+ 0 0 18 -4,-2.6 4,-2.6 2,-0.2 5,-0.3 0.919 110.9 52.1 -57.4 -45.1 10.0 3.8 31.5 81 112 A Y H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.955 114.7 40.9 -58.2 -50.1 11.6 6.7 33.4 82 113 A F H X S+ 0 0 1 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.795 112.5 54.9 -74.7 -28.6 14.6 7.0 31.0 83 114 A F H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.963 112.7 42.9 -64.1 -53.1 12.4 6.4 27.9 84 115 A N H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.932 116.1 47.7 -57.5 -46.7 10.1 9.3 28.8 85 116 A H H X S+ 0 0 2 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.834 107.8 55.6 -72.2 -29.1 13.0 11.6 29.9 86 117 A F H X S+ 0 0 8 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.946 111.0 45.6 -58.5 -50.4 15.0 10.8 26.6 87 118 A C H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.925 113.6 47.8 -58.5 -46.2 11.9 11.9 24.6 88 119 A F H X S+ 0 0 13 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.876 109.9 55.0 -65.3 -36.5 11.5 15.1 26.7 89 120 A Y H X S+ 0 0 38 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.919 108.2 47.2 -61.3 -44.7 15.2 15.8 26.4 90 121 A I H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.950 114.2 48.2 -65.0 -43.5 15.0 15.7 22.6 91 122 A I H >X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 3,-0.7 0.959 114.0 44.8 -61.9 -52.0 12.0 17.9 22.6 92 123 A N H 3< S+ 0 0 18 -4,-2.9 4,-0.3 1,-0.2 -1,-0.2 0.830 113.4 50.8 -64.0 -31.6 13.5 20.4 25.0 93 124 A E H 3< S+ 0 0 29 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.733 126.0 23.7 -75.1 -21.2 16.8 20.5 23.1 94 125 A T H X< S+ 0 0 0 -4,-1.4 3,-2.2 -3,-0.7 4,-0.4 0.544 86.0 99.8-124.9 -12.3 15.2 21.1 19.7 95 126 A K G >< S+ 0 0 48 -4,-2.5 3,-1.4 1,-0.3 -3,-0.1 0.837 79.2 63.4 -56.7 -32.7 11.7 22.7 20.1 96 127 A E G 3 S+ 0 0 102 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.782 111.8 39.3 -61.2 -21.1 13.1 26.2 19.2 97 128 A Y G < S+ 0 0 32 -3,-2.2 2,-0.5 -81,-0.0 -80,-0.3 0.372 97.0 99.7-107.0 2.1 14.0 24.8 15.8 98 129 A A < - 0 0 0 -3,-1.4 -80,-0.2 -4,-0.4 3,-0.1 -0.827 40.7-177.1-106.9 121.8 11.0 22.6 15.1 99 130 A L S S- 0 0 0 -82,-3.0 2,-0.3 -2,-0.5 -81,-0.2 0.809 84.4 -15.3 -70.0 -33.0 7.9 23.3 12.9 100 131 A A E -b 18 0A 1 -83,-1.0 -81,-2.7 31,-0.1 2,-0.4 -0.966 60.7-125.8-159.0 166.5 6.6 19.9 14.0 101 132 A Y E -bc 19 133A 0 31,-1.8 33,-2.0 -2,-0.3 2,-0.5 -0.977 16.4-160.2-119.7 141.6 7.5 16.5 15.6 102 133 A K E -bc 20 134A 5 -83,-2.0 -81,-2.8 -2,-0.4 2,-0.5 -0.991 5.2-165.2-121.3 124.0 6.8 13.1 13.9 103 134 A M E -bc 21 135A 0 31,-2.5 33,-2.5 -2,-0.5 2,-0.7 -0.939 15.4-139.4-109.6 122.7 6.8 10.1 16.2 104 135 A N E > - c 0 136A 24 -83,-0.5 3,-1.4 -2,-0.5 4,-0.4 -0.764 8.5-145.9 -88.1 121.4 7.0 6.7 14.5 105 136 A F G > S+ 0 0 39 31,-2.0 3,-1.8 -2,-0.7 4,-0.2 0.782 90.3 69.4 -54.7 -38.2 4.5 4.3 16.2 106 137 A A G > S+ 0 0 54 30,-0.4 3,-1.5 1,-0.3 -1,-0.3 0.847 92.8 57.8 -52.6 -40.0 6.7 1.2 15.7 107 138 A F G < S+ 0 0 69 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.716 102.5 54.9 -64.8 -20.3 9.4 2.5 18.2 108 139 A Y G < S+ 0 0 0 -3,-1.8 -1,-0.3 -4,-0.4 11,-0.2 0.322 101.2 62.7 -98.9 7.9 6.8 2.7 21.0 109 140 A L S X S+ 0 0 79 -3,-1.5 3,-1.7 -4,-0.2 -1,-0.2 0.650 70.5 81.8-106.7 -26.0 5.7 -0.9 20.7 110 141 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.670 96.4 49.2 -64.6 -12.5 8.5 -3.4 21.4 111 142 A Y T > S- 0 0 55 1,-0.4 3,-0.8 -3,-0.1 2,-0.1 0.136 107.5-126.1-107.0 12.7 8.0 -3.2 25.3 112 143 A G T X> S- 0 0 41 -3,-1.7 3,-0.9 1,-0.2 4,-0.7 -0.404 73.2 -10.2 70.4-146.5 4.3 -3.7 25.3 113 144 A S H >> S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 3,-0.6 0.772 122.4 75.9 -62.7 -25.1 2.0 -1.2 27.0 114 145 A L H <> S+ 0 0 11 -3,-0.8 4,-1.9 1,-0.3 3,-0.3 0.920 96.7 46.7 -48.0 -54.3 5.0 0.6 28.6 115 146 A G H <> S+ 0 0 0 -3,-0.9 4,-2.3 1,-0.2 -1,-0.3 0.761 107.0 56.7 -65.1 -27.4 5.9 2.3 25.4 116 147 A V H S+ 0 0 0 -4,-2.6 5,-1.9 1,-0.2 4,-0.8 0.885 111.2 51.7 -60.4 -37.1 3.7 18.4 22.6 127 158 A H H <5S+ 0 0 79 -4,-2.4 3,-0.5 -5,-0.2 -1,-0.2 0.916 108.4 51.3 -64.3 -42.4 0.0 19.3 23.1 128 159 A H H <5S+ 0 0 69 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.894 115.7 41.2 -56.6 -43.6 1.1 21.3 26.3 129 160 A L H <5S- 0 0 37 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.565 107.3-131.8 -80.8 -10.8 3.7 23.1 24.2 130 161 A N T <5 + 0 0 98 -4,-0.8 -3,-0.2 -3,-0.5 -4,-0.1 0.742 50.9 154.5 57.3 31.7 1.2 23.4 21.3 131 162 A V < - 0 0 3 -5,-1.9 -1,-0.2 -6,-0.2 -31,-0.1 -0.740 52.8-100.0 -87.1 134.9 3.8 22.2 18.8 132 163 A P - 0 0 3 0, 0.0 -31,-1.8 0, 0.0 2,-0.4 -0.161 45.0-155.9 -53.9 140.2 2.4 20.5 15.6 133 164 A T E -c 101 0A 6 -33,-0.2 28,-0.9 25,-0.1 2,-0.4 -0.955 17.9-171.2-129.5 147.7 2.4 16.7 15.8 134 165 A I E -cd 102 161A 3 -33,-2.0 -31,-2.5 -2,-0.4 2,-0.6 -1.000 12.1-152.8-136.1 130.0 2.4 13.8 13.4 135 166 A L E -cd 103 162A 0 26,-1.9 28,-1.5 -2,-0.4 2,-1.3 -0.938 13.1-148.1-100.8 120.5 2.0 10.1 14.2 136 167 A D E +c 104 0A 21 -33,-2.5 -31,-2.0 -2,-0.6 -30,-0.4 -0.733 49.2 134.6 -90.4 93.5 3.8 8.0 11.6 137 168 A I E - 0 0 17 -2,-1.3 -1,-0.2 26,-0.3 3,-0.1 0.519 52.5-145.3-116.8 -18.8 1.5 5.0 11.7 138 169 A K E - 0 0 62 -3,-0.3 26,-0.3 1,-0.2 27,-0.2 0.855 32.1-162.2 55.5 39.0 1.0 4.3 7.9 139 170 A M E + d 0 164A 2 24,-1.8 26,-2.4 25,-0.1 2,-0.3 -0.162 20.9 164.6 -65.2 141.6 -2.6 3.2 8.8 140 171 A N + 0 0 65 24,-0.2 2,-0.3 -3,-0.1 26,-0.1 -0.843 15.5 107.0-159.1 122.7 -4.6 1.2 6.4 141 172 A D - 0 0 52 -2,-0.3 2,-0.1 24,-0.1 27,-0.0 -0.959 65.3 -57.4-169.3-174.8 -7.8 -0.9 6.8 142 173 A I >> - 0 0 98 -2,-0.3 4,-2.7 1,-0.1 3,-0.7 -0.388 60.4 -99.6 -75.3 160.8 -11.5 -1.1 6.0 143 174 A G H 3> S+ 0 0 21 1,-0.3 4,-1.9 2,-0.2 -1,-0.1 0.857 119.4 53.4 -50.4 -47.6 -13.7 1.8 7.2 144 175 A N H 3> S+ 0 0 100 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.895 115.3 40.9 -57.3 -42.1 -15.0 0.1 10.3 145 176 A T H X> S+ 0 0 49 -3,-0.7 3,-1.6 1,-0.2 4,-1.3 0.921 107.6 61.6 -71.8 -43.7 -11.5 -0.7 11.6 146 177 A V H 3X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.3 -2,-0.2 0.831 93.4 66.3 -51.0 -37.5 -10.2 2.7 10.5 147 178 A K H 3X S+ 0 0 73 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.3 0.886 101.0 49.3 -53.7 -36.3 -12.7 4.3 13.0 148 179 A H H S+ 0 0 1 -4,-3.1 4,-2.9 1,-0.2 5,-0.8 0.904 106.2 51.3 -53.2 -47.3 -9.0 7.4 14.3 151 182 A K H X>S+ 0 0 86 -4,-2.0 5,-2.6 3,-0.2 4,-1.2 0.941 114.3 42.8 -57.1 -51.3 -10.0 7.2 18.0 152 183 A F H <>S+ 0 0 44 -4,-2.0 5,-2.5 3,-0.2 6,-0.2 0.945 121.0 40.1 -57.7 -50.8 -6.5 6.3 19.1 153 184 A I H <5S+ 0 0 0 -4,-3.0 6,-2.5 3,-0.2 -2,-0.2 0.924 131.3 20.7 -69.4 -45.6 -4.7 8.8 16.9 154 185 A F H <5S+ 0 0 11 -4,-2.9 -3,-0.2 -5,-0.3 -2,-0.1 0.786 131.5 33.7-102.0 -33.7 -7.0 11.8 17.2 155 186 A D T < + 0 0 10 -2,-0.5 3,-1.5 25,-0.4 5,-0.1 0.091 47.7 121.7-106.2 26.5 -4.0 4.0 0.6 167 198 A Y T 3 S+ 0 0 203 1,-0.3 -1,-0.2 3,-0.1 3,-0.1 0.872 78.2 56.5 -52.8 -34.4 -3.2 0.7 -1.3 168 199 A M T 3 S- 0 0 96 -3,-0.4 -1,-0.3 1,-0.3 2,-0.2 0.763 124.4 -85.7 -68.2 -25.7 -6.8 -0.3 -0.3 169 200 A G < - 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0 0 56 1,-0.1 4,-2.8 -5,-0.1 -1,-0.3 -0.789 64.6-170.1-145.8 95.9 24.3 17.1 20.4 302 333 A P H > S+ 0 0 3 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.888 92.2 53.4 -54.4 -40.9 20.7 17.1 19.3 303 334 A Q H > S+ 0 0 69 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.954 111.8 43.8 -62.6 -48.3 20.4 20.8 19.9 304 335 A Q H > S+ 0 0 75 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.916 114.2 50.7 -61.9 -42.8 23.5 21.6 17.7 305 336 A A H X S+ 0 0 16 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.898 112.0 46.6 -60.1 -42.5 22.3 19.1 15.0 306 337 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.913 110.9 52.5 -66.2 -42.0 18.9 20.7 14.9 307 338 A R H X S+ 0 0 90 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.906 108.6 52.1 -62.1 -39.5 20.4 24.2 14.7 308 339 A E H X S+ 0 0 85 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.887 111.4 44.0 -62.2 -47.5 22.5 23.1 11.8 309 340 A Y H X S+ 0 0 34 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.914 111.7 54.9 -64.8 -40.0 19.6 21.8 9.8 310 341 A H H X S+ 0 0 26 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.943 110.9 46.2 -56.9 -43.8 17.6 24.9 10.7 311 342 A Q H X S+ 0 0 47 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.931 111.7 49.7 -66.2 -47.3 20.5 27.0 9.3 312 343 A Q H X S+ 0 0 71 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.897 111.5 48.6 -57.5 -45.9 20.8 24.9 6.1 313 344 A I H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.937 110.1 51.9 -64.3 -43.4 17.1 25.1 5.4 314 345 A K H X S+ 0 0 98 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.927 111.4 47.8 -53.2 -50.4 17.2 28.9 6.0 315 346 A E H X S+ 0 0 101 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.873 114.0 46.0 -61.4 -40.0 20.1 29.3 3.5 316 347 A V H X S+ 0 0 4 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.892 111.6 51.0 -70.9 -39.3 18.3 27.1 0.9 317 348 A L H < S+ 0 0 22 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.919 107.8 54.3 -63.3 -42.5 15.0 28.9 1.4 318 349 A A H < S+ 0 0 83 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.902 105.5 52.5 -55.0 -44.5 16.9 32.2 0.9 319 350 A E H < 0 0 115 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.851 360.0 360.0 -56.7 -38.4 18.3 30.9 -2.5 320 351 A L < 0 0 73 -4,-1.6 -1,-0.2 -3,-0.1 -2,-0.2 0.657 360.0 360.0 -87.1 360.0 14.7 30.1 -3.5