==== 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 TRANSPORT PROTEIN 11-NOV-08 2W3C . COMPND 2 MOLECULE: GENERAL VESICULAR TRANSPORT FACTOR P115; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.STRIEGL,Y.ROSKE,D.KUMMEL,U.HEINEMANN, . 551 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24320.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 407 73.9 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 . 6 1.1 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 . 15 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 297 53.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 1 1 4 8 3 2 0 1 1 5 2 3 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 2 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 . 2 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 55 A L 0 0 137 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.3 -46.8 20.6 60.7 2 56 A E > + 0 0 94 1,-0.2 2,-1.1 2,-0.1 3,-0.6 0.792 360.0 80.5 -70.7 -29.1 -47.1 16.8 60.8 3 57 A V T 3> + 0 0 99 1,-0.3 4,-0.7 2,-0.1 3,-0.4 -0.124 44.0 113.0 -83.8 39.0 -50.8 17.2 60.4 4 58 A G T 34 S+ 0 0 31 -2,-1.1 -1,-0.3 -3,-0.4 -2,-0.1 0.471 75.8 69.7 -72.2 -7.1 -50.8 17.7 56.6 5 59 A I T X> S+ 0 0 28 -3,-0.6 4,-1.6 1,-0.1 3,-0.9 0.776 85.7 63.2 -75.5 -33.1 -52.6 14.4 57.2 6 60 A Q T 34 S+ 0 0 46 -3,-0.4 2,-1.1 1,-0.3 4,-0.4 0.945 101.1 48.8 -61.4 -51.3 -55.7 16.0 58.8 7 61 A A T 3< S+ 0 0 63 -4,-0.7 -1,-0.3 1,-0.2 -2,-0.1 -0.225 111.2 53.2 -86.0 47.3 -56.7 17.9 55.7 8 62 A M T X> S+ 0 0 4 -2,-1.1 4,-2.3 -3,-0.9 3,-1.6 0.422 93.8 61.1-142.2 -47.8 -56.4 14.8 53.5 9 63 A E H 3X S+ 0 0 144 -4,-1.6 4,-0.6 1,-0.3 -2,-0.1 0.604 107.8 55.4 -56.8 -10.8 -58.5 12.2 55.2 10 64 A H H 3> S+ 0 0 106 -4,-0.4 4,-0.7 2,-0.2 -1,-0.3 0.588 100.9 51.8-100.9 -20.1 -61.1 14.8 54.4 11 65 A L H <> S+ 0 0 8 -3,-1.6 4,-1.8 2,-0.2 3,-0.2 0.805 107.2 56.0 -79.5 -35.4 -60.4 15.0 50.7 12 66 A I H X S+ 0 0 15 -4,-2.3 4,-0.9 1,-0.2 -2,-0.2 0.915 101.9 57.2 -59.5 -41.6 -60.8 11.2 50.7 13 67 A H H X S+ 0 0 101 -4,-0.6 4,-1.8 1,-0.2 3,-0.4 0.837 103.9 51.5 -57.6 -39.6 -64.2 11.8 52.3 14 68 A V H X S+ 0 0 17 -4,-0.7 4,-2.8 1,-0.2 -1,-0.2 0.929 106.9 55.0 -59.8 -45.9 -65.2 14.0 49.3 15 69 A L H < S+ 0 0 5 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.642 111.4 44.2 -65.0 -19.0 -64.1 11.1 47.0 16 70 A Q H < S+ 0 0 98 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.860 128.0 20.9 -90.8 -39.1 -66.4 8.7 48.7 17 71 A T H < S+ 0 0 88 -4,-1.8 3,-0.3 -5,-0.1 -2,-0.2 0.685 115.7 55.3-106.9 -26.4 -69.6 10.7 49.1 18 72 A D >< + 0 0 66 -4,-2.8 3,-2.2 -5,-0.3 7,-0.2 0.068 62.0 127.7-107.7 24.8 -69.7 13.6 46.5 19 73 A R T 3 + 0 0 83 1,-0.3 -1,-0.2 -3,-0.2 3,-0.1 0.522 61.8 68.0 -68.7 -7.2 -69.2 11.6 43.3 20 74 A S T 3 S+ 0 0 130 -3,-0.3 2,-0.7 1,-0.2 -1,-0.3 0.562 92.1 68.6 -83.8 -9.6 -72.2 13.1 41.5 21 75 A D X> - 0 0 68 -3,-2.2 4,-1.6 1,-0.1 3,-0.6 -0.866 65.2-178.6-109.4 92.2 -70.3 16.4 41.5 22 76 A S H 3> S+ 0 0 29 -2,-0.7 4,-2.6 1,-0.2 -1,-0.1 0.769 77.0 62.5 -68.1 -28.3 -67.4 15.8 39.1 23 77 A E H 3> S+ 0 0 134 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.857 108.0 43.2 -64.4 -35.5 -65.8 19.2 39.5 24 78 A I H <> S+ 0 0 51 -3,-0.6 4,-1.9 -6,-0.2 -2,-0.2 0.822 112.4 52.0 -80.5 -33.0 -65.3 18.5 43.2 25 79 A I H X S+ 0 0 3 -4,-1.6 4,-2.6 -7,-0.2 5,-0.3 0.949 110.4 50.4 -63.1 -45.1 -64.0 15.0 42.6 26 80 A G H X S+ 0 0 8 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.824 111.5 47.6 -59.1 -36.1 -61.5 16.5 40.1 27 81 A Y H X S+ 0 0 133 -4,-1.0 4,-2.3 2,-0.2 -1,-0.2 0.843 111.9 49.1 -77.4 -40.7 -60.4 19.1 42.6 28 82 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.856 113.2 45.6 -69.5 -41.1 -59.9 16.6 45.4 29 83 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.901 115.2 48.8 -65.8 -41.7 -57.9 14.2 43.3 30 84 A D H X S+ 0 0 66 -4,-1.6 4,-1.6 -5,-0.3 -2,-0.2 0.890 113.9 45.3 -64.0 -40.8 -55.9 17.1 42.0 31 85 A T H X S+ 0 0 30 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.841 112.2 51.9 -71.9 -35.5 -55.3 18.4 45.5 32 86 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.900 108.1 51.5 -67.0 -42.2 -54.4 14.9 46.7 33 87 A Y H X S+ 0 0 62 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.880 108.3 53.5 -55.4 -43.5 -51.9 14.5 43.9 34 88 A N H X S+ 0 0 103 -4,-1.6 4,-1.2 2,-0.2 -2,-0.2 0.964 112.2 43.0 -56.1 -52.6 -50.4 17.8 45.0 35 89 A I H < S+ 0 0 42 -4,-2.1 -2,-0.2 1,-0.2 7,-0.2 0.890 120.9 39.5 -62.2 -45.3 -50.0 16.6 48.6 36 90 A I H < S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.776 113.7 53.4 -79.3 -28.3 -48.6 13.1 47.7 37 91 A S H < 0 0 47 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.722 360.0 360.0 -82.6 -22.7 -46.4 14.2 44.8 38 92 A N < 0 0 154 -4,-1.2 -4,-0.1 -5,-0.2 -3,-0.1 -0.004 360.0 360.0 83.2 360.0 -44.4 17.0 46.7 39 ! 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 40 111 A S > 0 0 57 0, 0.0 4,-0.7 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 161.6 -43.2 9.9 51.1 41 112 A Q H > + 0 0 134 2,-0.2 4,-0.8 1,-0.2 3,-0.5 0.916 360.0 49.5 -71.6 -49.4 -44.9 10.0 54.5 42 113 A F H > S+ 0 0 46 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.744 102.4 61.6 -66.8 -30.4 -48.5 10.8 53.2 43 114 A T H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.856 100.7 52.9 -64.3 -38.9 -48.5 7.9 50.6 44 115 A E H X S+ 0 0 99 -4,-0.7 4,-0.8 -3,-0.5 -1,-0.2 0.772 112.5 46.3 -69.3 -28.4 -48.0 5.2 53.3 45 116 A I H X S+ 0 0 87 -4,-0.8 4,-0.7 2,-0.2 -2,-0.2 0.872 108.8 53.6 -80.5 -44.9 -51.0 6.7 55.1 46 117 A F H < S+ 0 0 3 -4,-2.4 3,-0.5 1,-0.2 6,-0.2 0.909 115.0 41.4 -55.6 -44.6 -53.3 7.0 52.0 47 118 A I H < S+ 0 0 10 -4,-2.1 -1,-0.2 1,-0.2 6,-0.2 0.738 92.8 81.3 -80.2 -22.2 -52.7 3.3 51.2 48 119 A K H < S+ 0 0 173 -4,-0.8 2,-1.0 1,-0.2 -1,-0.2 0.814 90.4 57.5 -57.2 -33.4 -53.0 1.9 54.8 49 120 A Q S >< S- 0 0 117 -4,-0.7 3,-2.0 -3,-0.5 4,-0.4 -0.830 84.1-166.9 -90.7 92.1 -56.8 2.1 54.3 50 121 A Q T >> S+ 0 0 109 -2,-1.0 3,-1.5 1,-0.3 4,-1.3 0.750 75.9 69.5 -58.2 -34.8 -56.7 -0.2 51.2 51 122 A E H 3> S+ 0 0 108 1,-0.3 4,-0.6 2,-0.2 -1,-0.3 0.537 88.2 70.1 -65.7 -4.9 -60.3 0.5 50.0 52 123 A N H <> S+ 0 0 14 -3,-2.0 4,-1.6 -6,-0.2 -1,-0.3 0.869 98.9 46.8 -71.8 -41.6 -59.0 4.0 49.1 53 124 A V H <> S+ 0 0 0 -3,-1.5 4,-2.4 -4,-0.4 -2,-0.2 0.879 111.1 51.1 -66.6 -41.8 -56.9 2.4 46.3 54 125 A T H X S+ 0 0 57 -4,-1.3 4,-1.4 1,-0.2 -1,-0.2 0.711 108.7 53.2 -69.4 -20.9 -60.0 0.4 45.1 55 126 A L H X S+ 0 0 27 -4,-0.6 4,-2.3 -5,-0.2 -2,-0.2 0.841 107.9 49.4 -76.1 -38.8 -61.9 3.8 45.1 56 127 A L H X S+ 0 0 1 -4,-1.6 4,-1.2 2,-0.2 -2,-0.2 0.942 108.8 52.8 -63.4 -46.4 -59.3 5.4 42.9 57 128 A L H >< S+ 0 0 4 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.928 110.9 47.6 -53.4 -48.5 -59.6 2.4 40.6 58 129 A S H >< S+ 0 0 30 -4,-1.4 3,-1.3 1,-0.2 -1,-0.2 0.856 108.0 55.0 -58.4 -42.5 -63.4 3.0 40.5 59 130 A L H >< S+ 0 0 2 -4,-2.3 3,-0.9 1,-0.2 -1,-0.2 0.680 97.2 65.6 -64.8 -22.8 -62.9 6.7 39.9 60 131 A L T << S+ 0 0 8 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.428 87.5 68.2 -82.5 -7.7 -60.7 5.9 36.8 61 132 A E T < S+ 0 0 96 -3,-1.3 2,-0.4 -4,-0.2 -1,-0.2 0.512 78.3 104.1 -84.4 -9.6 -63.7 4.3 35.0 62 133 A E < - 0 0 70 -3,-0.9 6,-0.2 -4,-0.2 5,-0.1 -0.617 63.3-155.6 -74.0 125.0 -65.0 7.9 34.9 63 134 A F + 0 0 154 -2,-0.4 -1,-0.1 4,-0.1 -3,-0.0 0.724 56.5 118.3 -75.8 -19.1 -64.6 9.3 31.4 64 135 A D >> - 0 0 63 1,-0.1 4,-2.7 2,-0.1 3,-1.5 -0.247 62.7-143.0 -53.4 124.3 -64.6 12.9 32.6 65 136 A F H 3> S+ 0 0 70 1,-0.3 4,-2.4 2,-0.2 -1,-0.1 0.915 98.8 55.2 -53.2 -47.5 -61.3 14.4 31.6 66 137 A H H 34 S+ 0 0 63 1,-0.2 -1,-0.3 2,-0.2 -36,-0.2 0.476 115.9 37.9 -74.9 -5.6 -61.1 16.4 34.8 67 138 A V H <> S+ 0 0 3 -3,-1.5 4,-1.5 -5,-0.1 -1,-0.2 0.752 116.9 45.9-102.0 -51.7 -61.5 13.3 37.0 68 139 A R H X S+ 0 0 9 -4,-2.7 4,-3.0 2,-0.2 -2,-0.2 0.853 108.6 55.7 -65.8 -40.8 -59.5 10.6 35.1 69 140 A W H X S+ 0 0 79 -4,-2.4 4,-2.1 -5,-0.3 5,-0.2 0.981 112.2 38.7 -62.4 -58.6 -56.4 12.7 34.4 70 141 A P H > S+ 0 0 6 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.875 115.6 58.2 -58.6 -32.5 -55.6 13.7 38.1 71 142 A G H X S+ 0 0 0 -4,-1.5 4,-2.9 2,-0.2 5,-0.2 0.977 106.6 46.0 -55.3 -57.6 -56.7 10.1 38.9 72 143 A V H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.903 114.6 47.3 -49.2 -50.0 -54.0 8.7 36.6 73 144 A K H X S+ 0 0 32 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.826 112.0 50.0 -70.6 -35.0 -51.3 11.0 38.0 74 145 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.940 111.4 47.6 -66.8 -45.5 -52.3 10.2 41.6 75 146 A L H X S+ 0 0 0 -4,-2.9 4,-2.1 -5,-0.2 -2,-0.2 0.903 110.5 51.7 -69.6 -34.9 -52.2 6.4 41.1 76 147 A T H X S+ 0 0 13 -4,-2.3 4,-3.0 -5,-0.2 -1,-0.2 0.905 109.3 51.8 -57.4 -45.4 -48.8 6.7 39.2 77 148 A S H X S+ 0 0 11 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.916 110.6 46.6 -62.9 -44.2 -47.5 8.7 42.2 78 149 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 8,-0.2 0.893 115.5 48.2 -58.5 -41.7 -48.7 6.0 44.7 79 150 A L H < S+ 0 0 3 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.861 109.3 50.5 -71.0 -41.7 -47.1 3.4 42.4 80 151 A K H < S+ 0 0 158 -4,-3.0 3,-0.3 2,-0.1 -1,-0.2 0.860 118.4 39.4 -61.8 -37.8 -43.7 5.1 42.0 81 152 A Q H < S+ 0 0 60 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.1 0.882 133.5 16.9 -85.8 -45.8 -43.4 5.5 45.8 82 153 A L S X S+ 0 0 19 -4,-2.5 4,-2.5 -5,-0.2 5,-0.3 -0.544 77.3 161.0-127.1 66.3 -44.7 2.3 47.3 83 154 A G H > + 0 0 11 -3,-0.3 4,-2.7 1,-0.2 5,-0.2 0.896 67.6 47.2 -57.4 -58.8 -44.6 0.0 44.2 84 155 A P H > S+ 0 0 97 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.816 117.7 43.0 -53.7 -37.5 -44.8 -3.5 45.7 85 156 A Q H > S+ 0 0 99 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.922 116.0 44.1 -81.5 -47.7 -47.6 -2.7 48.0 86 157 A V H X S+ 0 0 0 -4,-2.5 4,-1.9 -8,-0.2 -3,-0.2 0.860 112.7 54.4 -66.1 -34.3 -49.8 -0.7 45.7 87 158 A Q H X S+ 0 0 8 -4,-2.7 4,-2.4 -5,-0.3 -1,-0.2 0.849 108.9 49.8 -62.3 -39.7 -49.2 -3.3 43.0 88 159 A Q H X S+ 0 0 95 -4,-1.2 4,-2.3 -5,-0.2 -2,-0.2 0.926 107.8 50.8 -63.4 -49.1 -50.4 -6.0 45.4 89 160 A I H X S+ 0 0 12 -4,-2.2 4,-0.7 1,-0.2 -2,-0.2 0.933 114.6 46.2 -56.0 -44.7 -53.6 -4.2 46.3 90 161 A I H >< S+ 0 0 0 -4,-1.9 3,-0.5 1,-0.2 6,-0.3 0.905 111.5 49.2 -67.1 -46.0 -54.3 -3.8 42.6 91 162 A L H 3< S+ 0 0 61 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.865 112.1 49.4 -58.9 -39.5 -53.5 -7.5 41.6 92 163 A V H 3< S+ 0 0 104 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.633 95.7 85.7 -77.3 -16.1 -55.7 -8.7 44.5 93 164 A S S X< S- 0 0 13 -4,-0.7 3,-1.7 -3,-0.5 4,-0.3 -0.770 92.1-110.8 -87.8 126.1 -58.6 -6.4 43.3 94 165 A P T 3 S+ 0 0 106 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.337 96.6 3.3 -70.8 140.5 -60.7 -8.1 40.6 95 166 A M T 3> S+ 0 0 139 -4,-0.1 4,-2.2 -2,-0.1 5,-0.2 0.566 95.0 135.0 60.5 13.9 -60.5 -6.7 37.0 96 167 A G H <> S+ 0 0 1 -3,-1.7 4,-1.3 -6,-0.3 -5,-0.1 0.912 70.8 32.8 -57.6 -54.1 -57.9 -4.3 38.6 97 168 A V H > S+ 0 0 8 -4,-0.3 4,-1.5 -7,-0.2 -1,-0.2 0.874 116.4 57.1 -71.9 -39.5 -55.2 -4.5 35.8 98 169 A S H > S+ 0 0 28 1,-0.2 4,-1.0 2,-0.2 3,-0.2 0.908 107.4 49.4 -54.2 -48.4 -57.7 -4.9 32.9 99 170 A R H >< S+ 0 0 53 -4,-2.2 3,-0.7 1,-0.2 4,-0.3 0.886 106.7 52.9 -62.3 -45.7 -59.4 -1.8 33.9 100 171 A L H >< S+ 0 0 3 -4,-1.3 3,-1.2 1,-0.2 4,-0.3 0.804 102.8 61.8 -61.3 -29.0 -56.1 0.2 34.1 101 172 A M H >< S+ 0 0 1 -4,-1.5 3,-1.8 1,-0.3 4,-0.4 0.806 87.1 71.0 -66.7 -33.9 -55.4 -1.1 30.5 102 173 A D G X< S+ 0 0 89 -4,-1.0 3,-0.7 -3,-0.7 -1,-0.3 0.672 85.6 69.4 -53.1 -17.9 -58.5 0.7 29.2 103 174 A L G X S+ 0 0 2 -3,-1.2 3,-1.0 -4,-0.3 -1,-0.3 0.776 91.1 58.4 -76.6 -25.6 -56.6 4.0 29.8 104 175 A L G < S+ 0 0 9 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.647 103.0 55.6 -71.1 -18.6 -54.3 3.0 26.9 105 176 A A G < S+ 0 0 61 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.2 0.364 79.5 121.9 -93.1 -0.1 -57.5 2.9 24.8 106 177 A D < - 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0 0 119 2,-0.0 2,-0.5 0, 0.0 -1,-0.0 -0.853 63.8-132.1-135.3 160.8 -4.2 -19.0 -4.2 337 412 A I - 0 0 163 -2,-0.3 2,-0.7 -3,-0.1 3,-0.1 -0.964 19.2-148.7-107.1 128.6 -2.5 -16.0 -5.7 338 413 A D - 0 0 68 -2,-0.5 -2,-0.0 1,-0.1 0, 0.0 -0.925 6.5-151.1-100.0 118.7 -4.6 -12.9 -6.3 339 414 A A S S+ 0 0 106 -2,-0.7 2,-0.4 2,-0.1 -1,-0.1 0.797 82.9 66.6 -55.3 -40.0 -3.1 -11.1 -9.3 340 415 A T S S- 0 0 83 1,-0.1 3,-0.4 -3,-0.1 -2,-0.0 -0.748 88.2-133.0 -81.0 132.1 -4.3 -7.7 -8.2 341 416 A G S S+ 0 0 80 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.1 0.326 82.1 102.3 -64.8 15.4 -2.4 -6.8 -5.0 342 417 A N + 0 0 103 2,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.967 48.0 73.8 -72.4 -70.7 -5.8 -5.9 -3.7 343 418 A S - 0 0 79 -3,-0.4 2,-0.3 1,-0.1 -5,-0.1 -0.109 52.2-160.4 -62.9 142.5 -7.7 -8.3 -1.4 344 419 A V - 0 0 51 4,-0.0 2,-0.3 3,-0.0 -53,-0.1 -0.901 13.1-150.1-114.0 150.4 -6.8 -8.8 2.3 345 420 A S > - 0 0 44 -2,-0.3 4,-2.1 -14,-0.1 5,-0.2 -0.751 26.7-107.4-120.5 166.1 -7.9 -11.9 4.2 346 421 A A H > S+ 0 0 6 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.926 116.6 52.2 -53.9 -54.3 -8.8 -12.9 7.8 347 422 A G H > S+ 0 0 2 -19,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.872 110.4 48.1 -50.4 -46.0 -5.6 -14.9 8.4 348 423 A Q H > S+ 0 0 138 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.901 111.3 48.9 -66.7 -44.3 -3.4 -12.0 7.2 349 424 A L H X S+ 0 0 29 -4,-2.1 4,-1.1 1,-0.2 -1,-0.2 0.877 114.1 47.4 -62.3 -38.1 -5.2 -9.4 9.4 350 425 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.855 110.7 50.1 -73.0 -38.9 -4.9 -11.7 12.4 351 426 A C H X S+ 0 0 24 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.851 110.9 50.6 -66.2 -32.6 -1.3 -12.5 11.9 352 427 A G H < S+ 0 0 43 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.793 112.1 48.4 -72.7 -28.2 -0.6 -8.8 11.6 353 428 A G H >< S+ 0 0 0 -4,-1.1 3,-1.1 2,-0.2 -2,-0.2 0.891 104.7 57.4 -77.4 -43.9 -2.5 -8.3 14.8 354 429 A L H 3< S+ 0 0 4 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.867 118.6 32.0 -53.0 -41.3 -0.6 -11.1 16.7 355 430 A F T 3< S+ 0 0 72 -4,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.162 91.3 118.4-112.7 17.8 2.7 -9.4 16.0 356 431 A S S < S- 0 0 31 -3,-1.1 -3,-0.1 2,-0.2 -58,-0.0 -0.022 72.4-120.5 -60.7 176.0 1.7 -5.7 16.0 357 432 A T S S+ 0 0 129 5,-0.0 2,-0.5 4,-0.0 -1,-0.1 0.631 91.7 92.2 -94.4 -19.3 3.2 -3.3 18.6 358 433 A D > - 0 0 27 1,-0.1 4,-1.5 -60,-0.1 -2,-0.2 -0.641 64.7-158.5 -72.8 122.1 -0.2 -2.5 19.9 359 434 A S H > S+ 0 0 10 -2,-0.5 4,-2.7 2,-0.2 5,-0.2 0.783 91.6 61.6 -74.4 -28.6 -1.1 -4.9 22.8 360 435 A L H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 108.2 45.0 -56.5 -46.8 -4.9 -4.3 22.3 361 436 A S H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.867 111.7 52.6 -62.4 -42.2 -4.4 -5.8 18.8 362 437 A N H X S+ 0 0 8 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.942 112.6 43.8 -59.7 -51.4 -2.2 -8.7 20.2 363 438 A W H X S+ 0 0 1 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.966 116.6 45.8 -59.7 -59.4 -4.8 -9.7 22.8 364 439 A C H X S+ 0 0 4 -4,-2.3 4,-3.2 1,-0.2 -2,-0.2 0.869 113.5 48.0 -48.5 -50.2 -7.8 -9.4 20.3 365 440 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.873 113.6 49.4 -63.4 -34.5 -6.1 -11.3 17.5 366 441 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 -5,-0.3 -2,-0.2 0.932 114.9 41.7 -75.8 -46.1 -5.1 -14.0 19.9 367 442 A V H X S+ 0 0 2 -4,-3.2 4,-2.4 2,-0.2 5,-0.2 0.947 112.0 56.0 -61.8 -46.1 -8.5 -14.4 21.4 368 443 A A H X S+ 0 0 0 -4,-3.2 4,-0.7 -5,-0.3 -2,-0.2 0.912 110.3 46.6 -50.7 -44.1 -10.1 -14.2 18.0 369 444 A L H >X S+ 0 0 0 -4,-2.1 3,-0.9 2,-0.2 4,-0.7 0.889 107.3 54.8 -64.0 -44.3 -7.8 -17.1 17.0 370 445 A A H >X S+ 0 0 3 -4,-2.2 4,-2.1 1,-0.3 3,-0.9 0.872 105.7 55.3 -56.8 -38.1 -8.6 -19.1 20.1 371 446 A H H 3< S+ 0 0 9 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.778 103.5 53.7 -64.6 -26.1 -12.3 -18.7 19.1 372 447 A A H << S+ 0 0 0 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.587 115.2 41.7 -85.4 -10.4 -11.5 -20.2 15.6 373 448 A L H X< S+ 0 0 0 -3,-0.9 3,-2.0 -4,-0.7 7,-0.3 0.706 80.5 126.7-104.6 -30.4 -9.9 -23.2 17.4 374 449 A Q T 3< S- 0 0 23 -4,-2.1 -54,-0.1 1,-0.3 5,-0.1 -0.040 89.9 -12.1 -43.7 125.7 -12.4 -24.0 20.2 375 450 A E T 3 S+ 0 0 124 50,-0.2 2,-0.4 1,-0.1 -1,-0.3 0.743 109.0 114.4 52.0 31.9 -13.6 -27.6 20.3 376 451 A N <> + 0 0 7 -3,-2.0 4,-1.9 1,-0.1 5,-0.1 -0.769 35.4 172.6-134.3 86.7 -12.2 -28.1 16.8 377 452 A A H > S+ 0 0 47 -2,-0.4 4,-2.0 1,-0.2 5,-0.2 0.848 80.8 60.6 -61.9 -36.1 -9.3 -30.6 16.8 378 453 A T H > S+ 0 0 93 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.944 109.9 39.7 -56.2 -53.3 -9.3 -30.5 12.9 379 454 A Q H > S+ 0 0 27 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.798 110.2 59.2 -67.4 -31.5 -8.5 -26.8 12.9 380 455 A K H X S+ 0 0 8 -4,-1.9 4,-0.7 -7,-0.3 -1,-0.2 0.892 110.7 44.1 -60.6 -39.6 -6.1 -27.1 15.9 381 456 A E H < S+ 0 0 89 -4,-2.0 4,-0.4 2,-0.2 3,-0.3 0.867 112.1 51.3 -71.9 -42.4 -4.1 -29.5 13.7 382 457 A Q H >< S+ 0 0 60 -4,-2.1 3,-1.9 1,-0.2 4,-0.4 0.909 104.1 57.3 -60.8 -42.3 -4.4 -27.4 10.6 383 458 A L H >< S+ 0 0 0 -4,-2.7 3,-1.1 1,-0.3 16,-0.3 0.793 94.7 68.7 -62.9 -24.3 -3.1 -24.3 12.5 384 459 A L T 3< S+ 0 0 21 -4,-0.7 -1,-0.3 -3,-0.3 -2,-0.2 0.709 93.4 58.2 -62.4 -23.5 0.0 -26.5 13.3 385 460 A R T < S+ 0 0 151 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.2 0.645 77.3 116.4 -83.2 -17.0 1.0 -26.3 9.6 386 461 A V < - 0 0 5 -3,-1.1 13,-1.6 -4,-0.4 2,-0.4 -0.309 46.9-167.4 -58.8 127.7 1.1 -22.4 9.5 387 462 A Q E -B 398 0B 123 -55,-0.3 2,-0.4 11,-0.3 11,-0.3 -0.931 5.9-149.6-117.0 142.1 4.7 -21.2 8.7 388 463 A L E -B 397 0B 29 9,-3.5 9,-1.6 -2,-0.4 2,-0.2 -0.877 17.1-118.8-112.8 147.0 5.8 -17.6 9.2 389 464 A A - 0 0 102 -2,-0.4 3,-0.1 7,-0.2 0, 0.0 -0.550 32.2-179.8 -75.9 147.9 8.5 -15.8 7.2 390 465 A T - 0 0 69 1,-0.4 2,-0.2 4,-0.4 -1,-0.1 0.395 47.1 -18.4-113.0-110.7 11.5 -14.5 9.1 391 466 A S S S- 0 0 65 4,-0.2 -1,-0.4 1,-0.0 3,-0.4 -0.619 72.1 -93.9-102.3 168.2 14.5 -12.6 7.7 392 467 A I S S+ 0 0 187 1,-0.2 -1,-0.0 -2,-0.2 -3,-0.0 0.412 124.5 25.0 -64.2 3.3 15.6 -12.3 4.1 393 468 A G S S+ 0 0 75 2,-0.1 -1,-0.2 0, 0.0 0, 0.0 0.530 102.7 93.8-134.7 -20.4 18.0 -15.2 4.6 394 469 A N S S- 0 0 109 -3,-0.4 -4,-0.4 1,-0.1 0, 0.0 -0.280 74.4 -98.8 -85.7 162.3 16.7 -17.4 7.5 395 470 A P - 0 0 93 0, 0.0 -4,-0.2 0, 0.0 -1,-0.1 -0.397 49.1 -92.4 -74.6 154.5 14.4 -20.5 7.7 396 471 A P - 0 0 77 0, 0.0 2,-0.4 0, 0.0 -7,-0.2 -0.268 32.0-145.8 -64.6 151.1 10.7 -20.2 8.5 397 472 A V E -B 388 0B 29 -9,-1.6 -9,-3.5 3,-0.0 2,-0.0 -0.941 21.4-115.0-115.6 141.0 9.3 -20.3 12.0 398 473 A S E > -B 387 0B 30 -2,-0.4 4,-2.1 -11,-0.3 -11,-0.3 -0.319 20.8-118.6 -70.1 158.2 5.8 -21.9 12.8 399 474 A L H > S+ 0 0 0 -13,-1.6 4,-2.4 -16,-0.3 5,-0.2 0.938 114.3 52.6 -59.9 -49.8 2.9 -19.8 14.2 400 475 A L H > S+ 0 0 7 -14,-0.3 4,-1.7 -17,-0.3 -1,-0.2 0.892 112.6 44.3 -52.2 -46.2 2.8 -21.9 17.4 401 476 A Q H > S+ 0 0 13 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.839 110.7 53.2 -74.9 -34.1 6.5 -21.4 18.0 402 477 A Q H X S+ 0 0 47 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.904 107.6 52.1 -66.7 -38.8 6.5 -17.7 17.2 403 478 A C H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.897 111.9 46.1 -59.7 -43.7 3.6 -17.2 19.7 404 479 A T H < S+ 0 0 3 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.770 108.2 59.8 -66.1 -30.3 5.7 -19.0 22.4 405 480 A N H >< S+ 0 0 47 -4,-1.6 3,-1.0 1,-0.2 4,-0.5 0.867 97.2 56.8 -68.9 -37.1 8.7 -16.9 21.3 406 481 A I H ><>S+ 0 0 20 -4,-1.8 3,-1.1 1,-0.2 5,-0.6 0.837 93.9 70.0 -67.0 -27.4 7.0 -13.6 22.1 407 482 A L T 3<5S+ 0 0 3 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.2 0.814 101.9 43.7 -56.6 -33.8 6.5 -14.8 25.7 408 483 A S T < 5S+ 0 0 78 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.475 97.7 90.9 -96.8 -3.2 10.2 -14.5 26.4 409 484 A Q T < 5S- 0 0 107 -3,-1.1 2,-0.5 -4,-0.5 -3,-0.0 -0.314 103.4 -93.0 -71.9 172.5 10.6 -11.2 24.7 410 485 A G T 5S+ 0 0 87 -2,-0.1 -3,-0.1 2,-0.0 -1,-0.1 0.053 74.0 157.0 -79.2 32.2 10.2 -8.1 26.8 411 486 A S < - 0 0 22 -5,-0.6 2,-0.1 -2,-0.5 5,-0.0 -0.147 47.6-103.0 -66.9 149.9 6.5 -8.0 25.9 412 487 A K >> - 0 0 132 1,-0.1 4,-1.5 4,-0.0 3,-0.8 -0.356 32.2-113.7 -68.5 151.5 3.8 -6.3 27.9 413 488 A I H 3> S+ 0 0 51 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.832 112.8 62.9 -60.6 -33.4 1.6 -8.7 30.1 414 489 A Q H 3> S+ 0 0 19 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.877 105.7 46.4 -59.4 -37.9 -1.6 -7.9 28.1 415 490 A T H <> S+ 0 0 6 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.895 114.5 47.1 -71.8 -36.3 0.0 -9.4 25.0 416 491 A R H X S+ 0 0 17 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.805 110.0 50.7 -78.5 -30.0 1.3 -12.5 26.9 417 492 A V H X S+ 0 0 2 -4,-3.1 4,-2.3 2,-0.2 5,-0.2 0.961 112.2 49.6 -64.2 -49.3 -2.0 -13.2 28.6 418 493 A G H X S+ 0 0 0 -4,-1.8 4,-1.8 -5,-0.3 -2,-0.2 0.928 116.1 43.1 -44.8 -51.9 -3.6 -12.9 25.1 419 494 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.828 112.2 50.8 -71.5 -39.0 -1.0 -15.4 23.8 420 495 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.811 107.4 54.1 -68.3 -31.5 -1.1 -17.8 26.7 421 496 A M H X S+ 0 0 4 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.931 112.8 45.2 -67.0 -43.2 -4.9 -18.0 26.4 422 497 A L H X S+ 0 0 0 -4,-1.8 4,-2.8 -5,-0.2 -2,-0.2 0.972 114.0 47.5 -57.9 -56.9 -4.4 -19.0 22.7 423 498 A L H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 5,-0.3 0.921 114.5 46.9 -55.6 -47.2 -1.6 -21.4 23.5 424 499 A C H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.928 116.1 44.3 -58.2 -52.7 -3.6 -23.1 26.4 425 500 A T H < S+ 0 0 5 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.856 113.6 52.6 -55.4 -38.4 -6.7 -23.3 24.2 426 501 A W H < S+ 0 0 0 -4,-2.8 -2,-0.2 -5,-0.2 7,-0.2 0.896 115.6 36.9 -72.0 -43.9 -4.6 -24.6 21.2 427 502 A L H >< S+ 0 0 0 -4,-2.5 3,-1.9 -5,-0.2 7,-0.3 0.781 92.4 109.1 -78.7 -29.9 -2.9 -27.4 23.1 428 503 A S T 3< S- 0 0 6 -4,-2.2 5,-0.1 1,-0.3 45,-0.0 -0.228 96.9 -4.6 -48.0 130.7 -6.1 -28.3 25.2 429 504 A N T 3 S+ 0 0 95 43,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.751 112.4 103.6 48.4 32.7 -7.6 -31.6 24.0 430 505 A C X> - 0 0 2 -3,-1.9 4,-1.4 1,-0.1 3,-0.7 -0.680 45.1-178.3-144.9 82.3 -5.1 -31.9 21.2 431 506 A P H 3> S+ 0 0 43 0, 0.0 4,-1.4 0, 0.0 47,-0.3 0.746 83.0 58.1 -52.3 -31.1 -2.2 -34.4 21.9 432 507 A I H 3> S+ 0 0 64 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.869 104.0 48.8 -71.2 -41.5 -0.5 -33.6 18.5 433 508 A A H <> S+ 0 0 0 -3,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.809 107.4 57.6 -67.7 -30.6 -0.1 -29.8 19.3 434 509 A V H X S+ 0 0 0 -4,-1.4 4,-2.6 -7,-0.3 -2,-0.2 0.917 107.4 47.9 -61.8 -43.2 1.3 -30.8 22.7 435 510 A T H X S+ 0 0 26 -4,-1.4 4,-1.4 2,-0.2 -2,-0.2 0.918 110.4 49.9 -64.0 -46.6 4.0 -32.9 20.7 436 511 A H H < S+ 0 0 100 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.817 114.9 46.0 -62.8 -31.1 4.8 -30.0 18.4 437 512 A F H >< S+ 0 0 0 -4,-1.7 3,-0.6 1,-0.2 6,-0.3 0.874 114.6 45.0 -75.5 -42.1 5.2 -27.7 21.5 438 513 A L H 3< S+ 0 0 3 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.607 99.3 73.0 -81.1 -12.3 7.3 -30.1 23.5 439 514 A H T 3< S+ 0 0 141 -4,-1.4 2,-0.7 -5,-0.2 -1,-0.2 0.737 81.6 76.4 -73.2 -27.9 9.5 -30.9 20.4 440 515 A N S X S- 0 0 57 -3,-0.6 3,-1.8 -4,-0.4 4,-0.5 -0.801 75.8-152.8 -85.0 114.4 11.2 -27.5 20.7 441 516 A S T 3 S+ 0 0 91 -2,-0.7 -1,-0.1 1,-0.3 -3,-0.0 0.611 86.9 69.3 -67.4 -12.3 13.6 -27.8 23.6 442 517 A A T 3> S+ 0 0 59 1,-0.1 4,-0.8 2,-0.1 -1,-0.3 0.686 91.0 65.7 -74.2 -17.4 13.5 -24.1 24.4 443 518 A N H <> S+ 0 0 4 -3,-1.8 4,-2.3 -6,-0.3 5,-0.2 0.931 95.9 43.0 -80.0 -56.2 9.9 -24.4 25.7 444 519 A V H > S+ 0 0 0 -4,-0.5 4,-2.6 1,-0.2 5,-0.3 0.923 114.6 52.1 -60.4 -48.0 9.7 -26.5 28.8 445 520 A P H > S+ 0 0 70 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.833 110.5 51.7 -56.2 -31.9 12.8 -24.9 30.3 446 521 A F H X S+ 0 0 38 -4,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.953 111.5 43.2 -66.2 -51.0 11.1 -21.5 29.7 447 522 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.950 114.1 51.1 -63.0 -51.6 7.8 -22.4 31.4 448 523 A T H X S+ 0 0 11 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.854 112.2 48.9 -45.5 -42.2 9.6 -24.1 34.3 449 524 A G H X S+ 0 0 30 -4,-1.4 4,-1.0 -5,-0.3 -2,-0.2 0.901 112.5 44.6 -73.1 -44.7 11.8 -20.9 34.7 450 525 A Q H < S+ 0 0 32 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.864 117.4 45.6 -63.6 -43.4 8.9 -18.4 34.6 451 526 A I H < S+ 0 0 0 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.836 112.3 51.6 -68.5 -35.7 6.8 -20.5 37.0 452 527 A A H < S+ 0 0 38 -4,-1.7 2,-0.6 -5,-0.3 -1,-0.2 0.687 90.5 83.3 -84.7 -20.4 9.6 -21.2 39.5 453 528 A E S < S- 0 0 119 -4,-1.0 2,-0.2 -3,-0.1 -1,-0.0 -0.794 81.6-121.8 -96.0 117.4 10.9 -17.6 40.1 454 529 A N + 0 0 144 -2,-0.6 2,-0.2 1,-0.1 -2,-0.1 -0.342 38.7 174.0 -47.3 113.9 9.2 -15.4 42.7 455 530 A L > - 0 0 35 1,-0.3 4,-0.7 -2,-0.2 8,-0.1 -0.578 38.3-102.2-138.0 70.2 8.1 -12.3 40.7 456 531 A G T 4 - 0 0 53 1,-0.2 -1,-0.3 -2,-0.2 0, 0.0 -0.188 53.8 -71.8 62.5-135.1 6.0 -9.8 42.7 457 532 A E T 4 S+ 0 0 63 3,-0.0 4,-0.4 2,-0.0 -1,-0.2 0.455 121.7 63.5-136.4 -22.0 2.2 -9.7 42.1 458 533 A E T >4 S+ 0 0 155 1,-0.2 3,-0.7 2,-0.1 4,-0.4 0.900 107.9 44.3 -70.9 -42.1 1.8 -8.2 38.7 459 534 A E T 3X S+ 0 0 50 -4,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.423 88.8 91.2 -87.7 0.8 3.6 -11.1 37.0 460 535 A Q H 3> S+ 0 0 65 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.866 83.8 55.0 -58.9 -38.7 1.6 -13.6 39.1 461 536 A L H <> S+ 0 0 5 -3,-0.7 4,-1.9 -4,-0.4 -1,-0.2 0.976 109.1 44.5 -63.3 -54.5 -1.0 -13.8 36.4 462 537 A V H > S+ 0 0 2 -4,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.894 112.5 53.8 -54.1 -43.8 1.5 -14.7 33.6 463 538 A Q H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.910 108.3 50.2 -55.3 -45.8 3.2 -17.3 35.9 464 539 A G H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.875 108.9 50.6 -61.4 -41.0 -0.2 -18.9 36.6 465 540 A L H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.866 108.0 53.3 -68.8 -36.9 -1.0 -19.2 32.8 466 541 A C H X S+ 0 0 0 -4,-2.1 4,-3.5 2,-0.2 -1,-0.2 0.887 107.8 51.5 -58.9 -46.6 2.4 -20.8 32.2 467 542 A A H X S+ 0 0 0 -4,-2.0 4,-3.4 2,-0.2 -2,-0.2 0.920 108.8 50.5 -53.8 -49.3 1.5 -23.4 34.9 468 543 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.916 113.6 46.2 -55.1 -45.9 -1.8 -24.0 33.1 469 544 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.957 114.6 45.1 -63.6 -52.8 0.2 -24.5 29.8 470 545 A L H X S+ 0 0 2 -4,-3.5 4,-1.0 1,-0.2 -2,-0.2 0.944 113.8 51.8 -54.6 -47.5 2.8 -26.7 31.3 471 546 A G H X S+ 0 0 1 -4,-3.4 4,-2.6 1,-0.2 3,-0.4 0.844 107.6 51.0 -56.7 -40.3 -0.1 -28.6 33.1 472 547 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.871 103.5 60.6 -63.8 -39.7 -1.9 -29.0 29.8 473 548 A S H < S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.749 113.1 37.9 -52.5 -32.9 1.4 -30.4 28.3 474 549 A I H >< S+ 0 0 2 -4,-1.0 3,-0.9 -3,-0.4 -2,-0.2 0.889 116.8 48.0 -88.1 -48.2 1.2 -33.2 30.9 475 550 A Y H 3< S+ 0 0 87 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.902 119.7 36.5 -65.7 -43.4 -2.5 -33.9 31.0 476 551 A F T 3< S+ 0 0 24 -4,-2.6 2,-0.3 -5,-0.2 -1,-0.2 0.278 88.8 126.0 -95.6 14.1 -3.0 -34.1 27.2 477 552 A N < - 0 0 11 -3,-0.9 -45,-0.1 -5,-0.1 9,-0.1 -0.548 44.0-165.5 -73.1 125.2 0.3 -35.8 26.6 478 553 A D - 0 0 81 -2,-0.3 -1,-0.1 -47,-0.3 7,-0.1 0.230 38.3-121.0 -98.4 14.6 0.0 -39.1 24.7 479 554 A N S S+ 0 0 72 5,-0.2 6,-0.1 1,-0.1 -2,-0.1 0.559 77.9 122.6 62.8 13.8 3.6 -40.2 25.6 480 555 A S + 0 0 86 1,-0.1 2,-0.8 4,-0.1 -1,-0.1 0.681 56.1 74.5 -80.9 -21.0 4.7 -40.4 21.9 481 556 A L - 0 0 23 3,-0.2 3,-0.4 1,-0.1 -2,-0.1 -0.874 67.2-164.5 -93.3 110.4 7.6 -37.9 22.4 482 557 A E S S+ 0 0 87 -2,-0.8 3,-0.4 1,-0.2 -1,-0.1 0.691 82.9 63.9 -69.6 -21.1 10.3 -39.9 24.3 483 558 A S S S+ 0 0 67 1,-0.3 2,-0.3 -3,-0.1 -1,-0.2 0.848 117.2 21.5 -72.8 -38.5 12.2 -36.6 25.2 484 559 A Y S S+ 0 0 31 -3,-0.4 -1,-0.3 -49,-0.0 -3,-0.2 -0.728 80.8 166.4-132.3 86.8 9.3 -35.2 27.3 485 560 A M > - 0 0 74 -3,-0.4 4,-2.2 -2,-0.3 5,-0.2 -0.429 48.9 -95.4 -92.3 173.2 6.9 -37.8 28.6 486 561 A K H > S+ 0 0 68 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.888 120.6 41.4 -53.1 -53.3 4.2 -37.5 31.3 487 562 A E H > S+ 0 0 95 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.842 114.0 52.6 -72.6 -34.0 6.1 -38.8 34.3 488 563 A K H > S+ 0 0 87 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.884 107.8 52.8 -65.1 -40.9 9.3 -37.0 33.3 489 564 A L H X S+ 0 0 1 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.845 108.8 49.5 -62.9 -36.8 7.4 -33.7 33.1 490 565 A K H X S+ 0 0 23 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.921 110.1 50.0 -68.2 -47.4 6.0 -34.3 36.7 491 566 A Q H X S+ 0 0 116 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.806 106.8 56.8 -59.6 -33.7 9.5 -35.0 38.0 492 567 A L H X S+ 0 0 33 -4,-1.8 4,-3.0 2,-0.2 5,-0.4 0.932 109.7 44.6 -59.1 -48.8 10.6 -31.7 36.3 493 568 A I H X>S+ 0 0 0 -4,-1.7 5,-3.2 2,-0.2 4,-2.6 0.956 113.8 50.1 -60.9 -50.6 8.0 -29.8 38.2 494 569 A E H <5S+ 0 0 86 -4,-2.8 -2,-0.2 3,-0.2 -1,-0.2 0.951 120.2 35.3 -51.6 -55.9 8.9 -31.6 41.5 495 570 A K H <5S+ 0 0 157 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.869 127.4 34.4 -68.4 -44.1 12.6 -30.9 41.1 496 571 A R H <5S+ 0 0 147 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.767 139.4 4.1 -84.2 -29.9 12.5 -27.4 39.5 497 572 A I T <5S- 0 0 19 -4,-2.6 -3,-0.2 -5,-0.4 -2,-0.1 0.715 93.7-111.2-127.2 -45.0 9.5 -25.9 41.1 498 573 A G >< - 0 0 14 -5,-3.2 4,-2.3 -6,-0.1 -4,-0.2 0.340 23.5-116.3 96.3 125.6 7.9 -28.1 43.8 499 574 A K H > S+ 0 0 33 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.862 114.1 47.8 -63.2 -43.9 4.4 -29.6 43.1 500 575 A E H > S+ 0 0 128 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.898 114.2 48.1 -62.3 -43.6 2.6 -27.8 45.9 501 576 A N H > S+ 0 0 64 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.864 110.3 53.5 -63.0 -39.6 4.2 -24.5 44.8 502 577 A F H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 3,-0.3 0.929 106.1 51.2 -59.9 -50.3 3.2 -25.3 41.2 503 578 A I H X S+ 0 0 36 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.745 106.9 55.3 -64.5 -22.9 -0.5 -25.8 42.1 504 579 A E H X S+ 0 0 116 -4,-1.1 4,-0.7 2,-0.2 -1,-0.2 0.858 106.4 48.8 -76.0 -38.2 -0.6 -22.5 43.9 505 580 A K H >< S+ 0 0 14 -4,-1.4 3,-0.6 -3,-0.3 4,-0.3 0.863 108.1 55.2 -66.8 -37.2 0.7 -20.5 40.8 506 581 A L H >< S+ 0 0 1 -4,-1.8 3,-1.0 1,-0.2 4,-0.5 0.843 103.9 56.8 -58.7 -37.9 -1.9 -22.3 38.7 507 582 A G H 3X S+ 0 0 5 -4,-0.9 4,-1.6 1,-0.2 -1,-0.2 0.698 84.4 80.7 -70.8 -22.1 -4.5 -21.0 41.3 508 583 A F T << S+ 0 0 22 -4,-0.7 4,-0.3 -3,-0.6 -1,-0.2 0.735 87.5 60.3 -55.6 -24.7 -3.4 -17.3 40.7 509 584 A I T X4 S+ 0 0 0 -3,-1.0 3,-2.0 -4,-0.3 6,-0.2 0.994 105.4 41.5 -68.1 -63.8 -5.6 -17.3 37.6 510 585 A S T 34 S+ 0 0 32 -4,-0.5 6,-0.2 1,-0.3 -2,-0.2 0.767 116.6 53.0 -52.4 -32.9 -9.0 -18.1 39.2 511 586 A K T 3< S+ 0 0 155 -4,-1.6 -1,-0.3 4,-0.1 -2,-0.2 0.414 76.4 121.7 -83.2 -7.5 -8.2 -15.7 42.0 512 587 A H S X> S- 0 0 39 -3,-2.0 3,-2.2 -4,-0.3 4,-0.5 -0.390 75.0-119.4 -61.0 137.3 -7.3 -12.7 39.9 513 588 A E T 34 S+ 0 0 157 1,-0.3 4,-0.3 2,-0.1 3,-0.2 0.797 112.2 44.8 -48.4 -29.9 -9.6 -9.8 40.8 514 589 A L T 3> S+ 0 0 40 1,-0.2 4,-1.6 2,-0.1 -1,-0.3 0.489 88.3 87.5 -93.5 -2.1 -11.0 -9.8 37.2 515 590 A Y H <> S+ 0 0 24 -3,-2.2 4,-1.3 -6,-0.2 -1,-0.2 0.947 85.0 53.0 -65.6 -47.9 -11.5 -13.5 36.7 516 591 A S H >< S+ 0 0 82 -4,-0.5 3,-0.6 1,-0.2 4,-0.3 0.891 109.9 44.6 -48.8 -58.0 -15.1 -13.6 38.3 517 592 A R H >> S+ 0 0 140 -4,-0.3 3,-1.5 1,-0.2 4,-0.6 0.863 108.1 58.6 -57.5 -44.3 -16.7 -10.9 36.2 518 593 A A H 3< S+ 0 0 19 -4,-1.6 -1,-0.2 1,-0.3 3,-0.2 0.859 104.4 54.6 -52.2 -35.5 -15.1 -12.2 33.0 519 594 A S T << S+ 0 0 51 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.487 92.1 72.6 -85.1 -7.9 -16.9 -15.5 33.7 520 595 A Q T <4 S+ 0 0 126 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.1 0.950 105.4 4.0 -69.5 -59.4 -20.5 -14.1 34.0 521 596 A K < - 0 0 117 -4,-0.6 4,-0.2 -3,-0.2 -1,-0.2 -0.894 64.8-119.2-133.9 158.0 -21.5 -13.2 30.4 522 597 A P S S+ 0 0 20 0, 0.0 14,-0.2 0, 0.0 15,-0.2 0.720 80.3 98.9 -73.0 -19.3 -20.0 -13.6 26.8 523 598 A Q S S- 0 0 67 1,-0.1 2,-0.5 13,-0.1 -2,-0.2 -0.471 88.9-104.5 -76.6 133.5 -19.9 -9.9 25.9 524 599 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 11,-0.1 -0.411 41.9-175.7 -51.7 106.6 -16.5 -8.2 26.3 525 600 A N + 0 0 88 -2,-0.5 7,-0.1 -4,-0.2 -2,-0.1 0.597 23.9 142.4 -88.0 -12.2 -17.2 -6.2 29.5 526 601 A F - 0 0 29 1,-0.1 6,-0.1 5,-0.1 -218,-0.1 0.024 40.0-155.8 -43.0 124.6 -14.0 -4.1 30.0 527 602 A P S S- 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -222,-0.1 0.726 80.0 -4.4 -68.0 -29.6 -14.4 -0.5 31.3 528 603 A S S > S- 0 0 40 -224,-0.1 3,-2.4 -223,-0.0 4,-0.3 -0.958 86.3 -88.4-161.7 162.2 -11.2 0.6 29.7 529 604 A P G > S+ 0 0 41 0, 0.0 3,-1.1 0, 0.0 -3,-0.1 0.728 119.2 65.0 -52.9 -29.6 -8.2 -1.0 27.8 530 605 A E G 3 S+ 0 0 152 1,-0.2 -4,-0.0 3,-0.0 0, 0.0 0.706 98.8 55.5 -67.0 -19.6 -6.3 -1.9 30.9 531 606 A Y G X S+ 0 0 105 -3,-2.4 2,-1.9 1,-0.1 3,-0.5 0.445 73.7 106.1 -93.5 -5.0 -9.1 -4.3 31.9 532 607 A M T < + 0 0 3 -3,-1.1 3,-0.1 -4,-0.3 -169,-0.1 -0.605 47.2 111.5 -75.4 86.4 -9.0 -6.3 28.7 533 608 A I T 3 + 0 0 17 -2,-1.9 2,-0.3 1,-0.4 -1,-0.2 0.679 62.2 43.0-126.2 -55.2 -7.3 -9.3 30.3 534 609 A F < - 0 0 6 -3,-0.5 2,-0.4 -20,-0.1 -1,-0.4 -0.742 62.8-146.7-103.2 149.0 -9.6 -12.3 30.5 535 610 A D >> - 0 0 10 -2,-0.3 4,-1.6 1,-0.1 3,-1.0 -0.944 22.6-124.8-109.2 132.9 -11.9 -13.7 27.8 536 611 A H H 3> S+ 0 0 22 -2,-0.4 4,-1.1 1,-0.2 3,-0.3 0.856 108.2 49.2 -36.2 -58.2 -15.2 -15.3 28.9 537 612 A E H 3> S+ 0 0 23 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.794 106.9 57.1 -63.6 -29.2 -14.7 -18.7 27.1 538 613 A F H X> S+ 0 0 4 -3,-1.0 4,-2.5 1,-0.2 3,-1.2 0.895 98.0 60.7 -66.0 -39.7 -11.1 -19.0 28.6 539 614 A T H 3X S+ 0 0 3 -4,-1.6 4,-2.3 -3,-0.3 -1,-0.2 0.874 103.9 52.4 -58.0 -32.6 -12.5 -18.7 32.1 540 615 A K H 3X S+ 0 0 82 -4,-1.1 4,-1.3 2,-0.2 -1,-0.3 0.720 105.9 51.3 -71.1 -27.5 -14.5 -21.9 31.3 541 616 A L H S+ 0 0 51 -4,-0.4 4,-2.2 -5,-0.3 -1,-0.2 0.921 115.8 44.1 -58.5 -51.6 -9.1 -29.5 39.0 548 623 A V H > S+ 0 0 52 -4,-0.4 4,-2.8 1,-0.2 -2,-0.2 0.885 111.0 54.3 -68.6 -39.0 -8.1 -32.4 36.7 549 624 A I H X S+ 0 0 0 -4,-2.8 4,-0.7 2,-0.2 -1,-0.2 0.854 110.0 48.4 -59.2 -39.4 -4.6 -31.0 36.1 550 625 A T H >< S+ 0 0 42 -4,-1.7 3,-0.8 -5,-0.3 -2,-0.2 0.931 112.1 48.2 -65.4 -46.5 -4.1 -30.8 39.9 551 626 A K H >< S+ 0 0 164 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.912 110.6 52.7 -59.1 -43.8 -5.3 -34.4 40.3 552 627 A A H 3< S+ 0 0 29 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.621 89.7 76.4 -69.4 -17.3 -3.0 -35.5 37.5 553 628 A I T << 0 0 1 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.532 360.0 360.0 -76.8 -1.2 0.1 -34.0 39.1 554 629 A Y < 0 0 163 -3,-1.3 -2,-0.2 -4,-0.2 -3,-0.1 0.412 360.0 360.0-132.1 360.0 0.2 -36.9 41.6