==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 25-APR-01 1IJ5 . COMPND 2 MOLECULE: PLASMODIAL SPECIFIC LAV1-2 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSARUM POLYCEPHALUM; . AUTHOR W.IWASAKI,H.SASAKI,A.NAKAMURA,K.KOHAMA,M.TANOKURA . 302 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15326.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 243 80.5 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 2.0 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 . 16 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 55.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.0 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 1 1 0 1 0 2 4 1 0 1 0 0 0 0 0 1 0 0 0 1 0 0 0 0 0 1 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 33 A E 0 0 170 0, 0.0 2,-1.3 0, 0.0 120,-0.2 0.000 360.0 360.0 360.0 40.5 25.1 33.8 99.3 2 34 A I - 0 0 15 118,-1.8 2,-1.6 117,-0.1 5,-0.1 -0.739 360.0-179.4 -93.3 84.4 22.0 31.5 99.9 3 35 A F + 0 0 185 -2,-1.3 2,-0.7 4,-0.1 -1,-0.1 -0.336 25.1 141.5 -84.8 57.9 22.7 30.8 103.5 4 36 A S >> - 0 0 45 -2,-1.6 3,-2.4 1,-0.1 4,-1.5 -0.843 43.2-152.9-108.1 104.5 19.6 28.6 104.1 5 37 A Q H 3> S+ 0 0 121 -2,-0.7 4,-1.5 1,-0.3 -1,-0.1 0.610 90.7 62.5 -43.4 -25.8 20.2 25.6 106.4 6 38 A E H 3> S+ 0 0 93 2,-0.2 4,-0.8 1,-0.1 -1,-0.3 0.783 107.9 44.0 -77.4 -26.6 17.5 23.4 104.8 7 39 A L H X> S+ 0 0 6 -3,-2.4 4,-2.3 2,-0.2 3,-1.3 0.956 110.4 54.7 -76.4 -55.5 19.4 23.4 101.5 8 40 A T H 3X S+ 0 0 51 -4,-1.5 4,-2.2 1,-0.3 -2,-0.2 0.784 107.5 51.1 -45.1 -37.0 22.8 22.9 103.2 9 41 A Q H 3X S+ 0 0 115 -4,-1.5 4,-1.1 2,-0.2 -1,-0.3 0.819 107.9 50.9 -74.5 -31.8 21.4 19.8 104.9 10 42 A R H X S+ 0 0 87 -4,-1.1 4,-1.5 2,-0.2 3,-0.6 0.987 107.2 44.3 -68.4 -58.4 22.8 14.5 102.5 14 46 A V H 3X S+ 0 0 3 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.855 110.7 58.7 -54.3 -37.9 23.4 13.9 98.8 15 47 A K H 3X S+ 0 0 90 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.871 99.2 54.4 -63.1 -39.0 27.1 13.9 99.5 16 48 A K H X S+ 0 0 14 -4,-1.5 4,-2.2 1,-0.2 3,-1.0 0.968 112.7 47.1 -56.2 -58.0 25.3 9.0 99.3 18 50 A H H 3X S+ 0 0 33 -4,-2.5 4,-2.6 1,-0.3 -1,-0.2 0.873 106.6 57.4 -53.8 -42.5 27.7 9.9 96.6 19 51 A E H 3X S+ 0 0 118 -4,-2.9 4,-1.9 2,-0.2 -1,-0.3 0.836 108.9 49.6 -58.8 -31.0 30.7 9.2 98.8 20 52 A N H X S+ 0 0 21 -4,-2.1 4,-2.3 2,-0.2 3,-1.0 0.915 113.7 48.0 -40.1 -63.4 31.5 0.8 96.0 25 57 A Q H 3X S+ 0 0 36 -4,-2.8 4,-2.5 1,-0.3 5,-0.3 0.940 108.8 52.2 -42.4 -68.5 32.8 1.6 92.5 26 58 A K H 3< S+ 0 0 146 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.786 111.2 51.5 -39.4 -36.2 36.4 1.8 93.6 27 59 A K H XX S+ 0 0 132 -4,-2.2 3,-3.4 -3,-1.0 4,-0.8 0.991 112.7 39.6 -69.0 -61.6 35.9 -1.6 95.2 28 60 A L H 3< S+ 0 0 46 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.695 110.6 65.7 -60.3 -12.7 34.4 -3.3 92.2 29 61 A D T 3< S+ 0 0 114 -4,-2.5 -1,-0.3 -5,-0.4 -2,-0.2 0.372 110.4 34.5 -88.1 4.1 37.1 -1.3 90.5 30 62 A H T <4 S+ 0 0 149 -3,-3.4 2,-0.2 -5,-0.3 -2,-0.2 0.407 89.1 104.6-137.9 -0.7 39.6 -3.4 92.4 31 63 A T < - 0 0 86 -4,-0.8 2,-0.2 1,-0.1 0, 0.0 -0.583 68.8-116.3 -84.2 158.6 38.2 -6.9 92.7 32 64 A S - 0 0 85 -2,-0.2 2,-1.5 1,-0.1 -1,-0.1 -0.473 42.1 -68.4-102.6 178.7 39.7 -9.5 90.4 33 65 A F 0 0 116 -2,-0.2 -1,-0.1 0, 0.0 -2,-0.0 0.269 360.0 360.0 -62.3 -10.4 38.3 -11.6 87.5 34 66 A A 0 0 138 -2,-1.5 -3,-0.0 0, 0.0 0, 0.0 -0.420 360.0 360.0 -92.1 360.0 35.9 -13.9 89.6 35 ! 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 36 72 A D 0 0 159 0, 0.0 4,-0.2 0, 0.0 -8,-0.0 0.000 360.0 360.0 360.0 12.6 28.1 -8.3 90.0 37 73 A R > + 0 0 69 2,-0.1 4,-1.7 3,-0.1 5,-0.0 0.828 360.0 34.9 -90.9 -45.9 27.4 -8.0 93.7 38 74 A L H > S+ 0 0 23 2,-0.2 4,-3.3 1,-0.2 3,-0.3 0.971 114.5 55.8 -71.0 -55.6 28.9 -4.5 93.8 39 75 A E H > S+ 0 0 105 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.870 109.0 51.1 -43.4 -39.8 27.7 -3.6 90.3 40 76 A A H > S+ 0 0 60 -4,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.933 114.4 42.0 -63.6 -47.5 24.3 -4.5 91.7 41 77 A Q H >X S+ 0 0 83 -4,-1.7 3,-1.5 -3,-0.3 4,-1.3 0.982 113.1 52.8 -62.2 -59.4 24.8 -2.2 94.7 42 78 A I H 3X S+ 0 0 21 -4,-3.3 4,-1.9 1,-0.3 -2,-0.2 0.902 105.4 53.5 -42.0 -56.4 26.4 0.6 92.7 43 79 A A H 3X S+ 0 0 54 -4,-2.6 4,-1.1 -5,-0.3 -1,-0.3 0.830 107.7 56.1 -52.0 -31.7 23.5 0.7 90.2 44 80 A Q H XX S+ 0 0 139 -3,-1.5 3,-2.6 -4,-1.0 4,-1.5 0.993 105.6 44.8 -62.7 -76.2 21.3 1.1 93.3 45 81 A K H 3X S+ 0 0 42 -4,-1.3 4,-3.0 1,-0.3 5,-0.3 0.728 105.7 66.4 -38.3 -31.2 22.9 4.1 94.9 46 82 A E H 3X S+ 0 0 57 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.3 0.913 104.6 41.4 -62.7 -42.0 22.9 5.7 91.4 47 83 A Q H X S+ 0 0 90 -4,-1.5 4,-2.2 1,-0.2 3,-0.7 0.943 113.1 41.8 -52.4 -55.2 19.0 6.9 95.0 49 85 A Q H 3X S+ 0 0 2 -4,-3.0 4,-3.0 1,-0.3 5,-0.3 0.919 109.8 58.7 -58.9 -45.2 21.4 9.9 94.4 50 86 A K H 3X S+ 0 0 135 -4,-2.0 4,-1.1 -5,-0.3 -1,-0.3 0.806 110.6 44.9 -54.0 -29.3 19.6 10.6 91.1 51 87 A A H X S+ 0 0 82 -4,-2.2 4,-2.1 1,-0.2 3,-0.9 0.953 110.8 49.3 -64.9 -48.5 18.0 13.1 96.0 53 89 A L H 3X S+ 0 0 0 -4,-3.0 4,-3.2 1,-0.2 -1,-0.2 0.901 104.0 60.4 -57.0 -43.6 19.5 15.6 93.5 54 90 A A H 3X S+ 0 0 42 -4,-1.1 4,-1.3 -5,-0.3 -1,-0.2 0.799 110.5 40.9 -55.1 -32.7 16.2 15.9 91.7 55 91 A E H X S+ 0 0 6 -4,-3.2 4,-2.3 2,-0.2 3,-0.8 0.979 107.8 48.7 -57.1 -60.6 17.4 21.0 92.4 58 94 A Q H 3X S+ 0 0 100 -4,-1.3 4,-2.6 1,-0.3 5,-0.2 0.886 110.0 52.2 -44.5 -51.7 13.8 22.0 92.8 59 95 A K H 3X S+ 0 0 81 -4,-2.1 4,-2.0 1,-0.2 -1,-0.3 0.889 110.2 48.8 -55.4 -38.9 14.5 23.4 96.2 60 96 A V H X S+ 0 0 11 -4,-2.7 4,-1.9 2,-0.2 3,-0.9 0.962 111.3 47.7 -56.1 -54.0 14.6 37.2 91.6 69 105 A R H >X S+ 0 0 162 -4,-2.4 4,-2.5 1,-0.3 3,-0.7 0.946 110.7 52.0 -50.6 -52.8 11.2 38.5 92.6 70 106 A A H 3X S+ 0 0 42 -4,-1.7 4,-1.6 -5,-0.4 -1,-0.3 0.791 108.3 53.6 -55.5 -27.0 12.8 40.2 95.6 71 107 A E H < S+ 0 0 31 -4,-1.8 3,-2.0 1,-0.2 4,-0.3 0.948 110.6 47.8 -53.5 -54.5 14.5 47.9 91.3 76 112 A A H >< S+ 0 0 46 -4,-2.2 3,-2.2 1,-0.3 5,-0.2 0.940 105.7 57.6 -52.4 -52.6 11.0 49.4 91.3 77 113 A A T 3< S+ 0 0 93 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.475 110.9 47.9 -61.2 3.3 11.5 50.9 94.7 78 114 A R T < S- 0 0 86 -3,-2.0 2,-0.3 1,-0.2 -1,-0.3 0.382 123.7 -29.4-125.3 1.7 14.5 52.7 93.1 79 115 A G S < S- 0 0 44 -3,-2.2 2,-0.9 -4,-0.3 -1,-0.2 -0.981 98.6 -19.0 173.0-168.3 13.2 54.1 89.9 80 116 A D > - 0 0 67 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 -0.503 48.0-168.8 -66.5 100.5 10.7 53.9 87.1 81 117 A A H > S+ 0 0 52 -2,-0.9 4,-2.4 1,-0.2 5,-0.3 0.958 87.4 55.9 -53.2 -54.7 9.5 50.2 87.2 82 118 A A H > S+ 0 0 71 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.877 106.1 52.8 -45.2 -45.4 7.8 50.6 83.9 83 119 A A H >> S+ 0 0 43 1,-0.2 3,-3.3 2,-0.2 4,-1.5 0.991 107.1 50.1 -53.9 -67.3 11.1 51.7 82.5 84 120 A E H 3X S+ 0 0 57 -4,-2.1 4,-2.2 1,-0.3 5,-0.3 0.780 104.4 58.6 -41.0 -40.3 13.0 48.7 83.8 85 121 A K H 3X S+ 0 0 64 -4,-2.4 4,-0.6 1,-0.2 -1,-0.3 0.792 106.4 49.9 -65.4 -24.6 10.4 46.3 82.3 86 122 A Q H X S+ 0 0 11 -4,-2.4 3,-2.6 -5,-0.2 4,-0.7 0.992 106.4 50.6 -63.6 -67.7 17.1 42.7 75.8 92 128 A L H >< S+ 0 0 27 -4,-2.2 3,-0.5 1,-0.3 -1,-0.2 0.721 104.5 65.9 -46.0 -19.7 15.2 39.4 75.9 93 129 A K H 3< S+ 0 0 168 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.846 84.0 68.5 -73.1 -33.6 14.1 40.3 72.4 94 130 A D H << 0 0 55 -3,-2.6 -1,-0.2 -4,-0.7 -2,-0.2 0.785 360.0 360.0 -55.7 -25.5 17.6 40.0 71.0 95 131 A L << 0 0 29 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.786 360.0 360.0 -62.8 360.0 17.1 36.4 71.7 96 ! 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 97 145 A K 0 0 160 0, 0.0 -2,-0.0 0, 0.0 38,-0.0 0.000 360.0 360.0 360.0 145.2 19.1 31.7 67.2 98 146 A P - 0 0 30 0, 0.0 2,-0.7 0, 0.0 37,-0.1 0.004 360.0 -99.3 -76.5-179.2 17.0 28.9 68.9 99 147 A M - 0 0 165 35,-0.3 36,-0.0 0, 0.0 35,-0.0 -0.538 52.1-172.9-101.9 60.6 13.3 28.2 69.4 100 148 A L - 0 0 38 -2,-0.7 2,-0.2 -5,-0.2 31,-0.0 -0.210 10.0-143.9 -61.2 145.6 13.1 29.4 72.9 101 149 A S > - 0 0 28 1,-0.1 4,-2.3 0, 0.0 5,-0.1 -0.471 30.5-101.8-100.8 175.1 9.9 29.0 75.0 102 150 A E H > S+ 0 0 66 2,-0.2 4,-1.1 1,-0.2 -1,-0.1 0.920 127.5 47.2 -63.6 -40.4 8.3 31.2 77.5 103 151 A E H >> S+ 0 0 121 1,-0.2 4,-1.8 2,-0.2 3,-0.7 0.942 111.1 50.0 -65.0 -48.7 9.8 28.9 80.2 104 152 A D H 3> S+ 0 0 1 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.841 106.7 56.9 -59.6 -34.3 13.2 28.9 78.5 105 153 A T H 3X S+ 0 0 34 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.794 105.0 50.5 -70.5 -26.9 13.2 32.7 78.3 106 154 A N H S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.6 0.878 112.2 49.4 -63.7 -40.2 17.7 32.8 80.7 109 157 A R H X>S+ 0 0 94 -4,-1.9 5,-1.2 3,-0.2 4,-0.9 0.833 114.2 47.2 -71.2 -28.6 16.4 36.1 82.1 110 158 A Q H <5S+ 0 0 11 -4,-2.6 7,-0.6 3,-0.2 6,-0.5 0.919 117.9 40.7 -75.9 -45.4 17.1 34.8 85.6 111 159 A L H <5S+ 0 0 5 -4,-2.9 7,-0.3 -5,-0.2 -2,-0.2 0.975 134.6 16.4 -66.9 -56.3 20.6 33.6 84.8 112 160 A F H <5S+ 0 0 1 -4,-2.7 66,-3.7 -5,-0.2 67,-0.3 0.582 133.6 38.0 -99.5 -9.6 21.8 36.4 82.6 113 161 A L T < S+ 0 0 2 -7,-0.6 3,-2.2 -6,-0.1 4,-0.5 0.856 98.9 96.4 -92.1 -47.8 21.8 33.0 90.6 118 166 A S T 3 S- 0 0 31 -7,-0.3 55,-0.2 1,-0.3 58,-0.1 -0.176 106.1 -3.4 -44.1 120.8 24.9 35.0 90.1 119 167 A G T 3 S+ 0 0 46 53,-1.4 -1,-0.3 50,-0.2 54,-0.1 0.246 95.2 116.4 79.2 -15.5 26.9 34.7 93.3 120 168 A S S < S- 0 0 3 -3,-2.2 -118,-1.8 2,-0.2 -2,-0.1 0.726 79.2-126.3 -59.3 -22.3 24.4 32.6 95.3 121 169 A G S S+ 0 0 27 -4,-0.5 48,-0.4 1,-0.3 2,-0.3 0.658 80.7 88.5 82.3 15.6 26.8 29.8 95.4 122 170 A K - 0 0 20 -5,-0.4 -1,-0.3 46,-0.2 2,-0.3 -0.915 51.7-174.5-139.0 164.0 24.2 27.4 94.0 123 171 A F - 0 0 2 -2,-0.3 2,-0.5 41,-0.3 45,-0.1 -0.971 21.3-126.9-160.0 148.1 23.1 26.4 90.5 124 172 A S > - 0 0 2 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 -0.877 7.1-164.8-104.5 126.9 20.3 24.3 89.0 125 173 A F H > S+ 0 0 7 -2,-0.5 4,-3.2 2,-0.2 5,-0.3 0.908 91.6 59.3 -72.6 -38.1 21.1 21.5 86.5 126 174 A Q H > S+ 0 0 89 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.924 105.3 46.9 -56.0 -47.8 17.5 21.3 85.5 127 175 A D H > S+ 0 0 16 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.935 116.5 45.3 -60.3 -44.9 17.5 24.9 84.3 128 176 A L H X S+ 0 0 0 -4,-1.5 4,-3.5 1,-0.2 3,-0.4 0.988 112.0 49.8 -58.6 -63.1 20.7 24.5 82.4 129 177 A K H X S+ 0 0 85 -4,-3.2 4,-2.4 1,-0.3 -1,-0.2 0.828 109.0 53.1 -45.0 -45.3 19.8 21.1 80.8 130 178 A Q H X S+ 0 0 69 -4,-2.3 4,-1.1 -5,-0.3 -1,-0.3 0.941 116.2 38.5 -59.6 -49.2 16.5 22.5 79.6 131 179 A V H X S+ 0 0 0 -4,-1.9 4,-1.1 -3,-0.4 -2,-0.2 0.898 112.9 55.2 -69.8 -43.0 18.2 25.5 77.9 132 180 A L H >X S+ 0 0 1 -4,-3.5 4,-2.0 1,-0.2 3,-1.3 0.938 100.2 63.6 -54.7 -45.2 21.2 23.5 76.7 133 181 A A H 3X S+ 0 0 32 -4,-2.4 4,-0.7 -5,-0.3 3,-0.4 0.913 106.9 41.2 -44.4 -54.0 18.8 21.2 75.0 134 182 A K H 3< S+ 0 0 78 -4,-1.1 4,-0.4 1,-0.2 -35,-0.3 0.603 113.3 52.1 -76.3 -11.6 17.5 23.9 72.7 135 183 A Y H << S+ 0 0 8 -3,-1.3 4,-0.4 -4,-1.1 -1,-0.2 0.701 91.7 73.4 -95.4 -20.1 20.9 25.5 71.9 136 184 A A H >< S+ 0 0 4 -4,-2.0 3,-1.6 -3,-0.4 -2,-0.2 0.919 96.5 51.8 -56.6 -44.3 22.6 22.3 70.9 137 185 A D T 3< S+ 0 0 138 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.2 0.868 98.5 63.2 -61.3 -37.2 20.6 22.4 67.6 138 186 A T T 3 S+ 0 0 51 -4,-0.4 -1,-0.3 2,-0.1 -2,-0.2 0.667 94.6 85.8 -60.9 -12.7 21.7 26.0 67.0 139 187 A I S < S- 0 0 14 -3,-1.6 2,-0.2 -4,-0.4 3,-0.1 -0.772 90.7-114.7 -97.3 131.6 25.1 24.3 66.8 140 188 A P - 0 0 110 0, 0.0 5,-0.4 0, 0.0 -2,-0.1 -0.445 47.8 -94.4 -62.7 125.2 26.5 22.8 63.6 141 189 A E S S+ 0 0 145 -2,-0.2 3,-0.1 -4,-0.1 -4,-0.0 -0.151 84.4 105.2 -40.9 122.5 26.9 19.1 64.1 142 190 A G S > S- 0 0 22 1,-0.2 4,-1.5 -3,-0.1 3,-0.5 -0.977 84.8 -59.5 176.7-179.6 30.5 18.8 65.2 143 191 A P H >> S+ 0 0 28 0, 0.0 3,-2.4 0, 0.0 4,-1.4 0.952 127.6 52.6 -44.7 -69.8 32.9 18.2 68.1 144 192 A L H >> S+ 0 0 27 1,-0.3 4,-1.5 2,-0.2 3,-0.5 0.812 107.6 54.0 -35.0 -44.6 31.7 21.2 70.1 145 193 A K H 3> S+ 0 0 20 -3,-0.5 4,-2.7 -5,-0.4 -1,-0.3 0.828 102.5 55.6 -65.7 -32.4 28.2 19.9 69.8 146 194 A K H S+ 0 0 2 -3,-0.3 3,-3.0 1,-0.1 2,-1.1 -0.739 96.6 124.1 90.6 -68.3 23.9 11.5 87.2 158 206 A R T 3> S+ 0 0 136 -2,-1.2 4,-2.8 1,-0.3 5,-0.2 0.007 81.1 41.9 -14.3 -53.6 27.5 12.6 87.0 159 207 A M H 3> S+ 0 0 3 -2,-1.1 4,-2.1 -4,-0.4 -1,-0.3 0.926 116.8 49.9 -63.1 -45.4 26.6 15.9 85.2 160 208 A S H <> S+ 0 0 16 -3,-3.0 4,-2.2 1,-0.2 5,-0.3 0.953 113.7 45.4 -56.2 -51.4 23.7 16.3 87.5 161 209 A Y H >>S+ 0 0 18 1,-0.2 4,-2.3 2,-0.2 5,-1.6 0.876 112.5 48.5 -62.2 -43.3 25.9 15.7 90.6 162 210 A I H <>S+ 0 0 20 -4,-2.8 5,-3.9 3,-0.2 -1,-0.2 0.881 113.9 47.3 -66.6 -38.7 28.8 18.0 89.6 163 211 A T H <5S+ 0 0 0 -4,-2.1 -2,-0.2 -5,-0.2 8,-0.2 0.937 118.8 38.1 -68.9 -48.5 26.5 20.9 88.7 164 212 A L H <5S- 0 0 2 -4,-2.2 -41,-0.3 -5,-0.2 -2,-0.2 0.843 141.3 -2.0 -72.7 -36.2 24.3 20.8 91.8 165 213 A V T <5S+ 0 0 13 -4,-2.3 3,-0.5 -5,-0.3 4,-0.3 0.748 121.9 58.4-120.6 -60.0 27.1 19.9 94.3 166 214 A A T S+ 0 0 4 -3,-0.5 4,-2.2 1,-0.2 -46,-0.2 0.897 78.0 52.6 -57.4 -46.0 27.7 24.9 92.0 169 217 A N H > S+ 0 0 58 -48,-0.4 4,-1.0 -4,-0.3 -48,-0.3 0.907 110.9 47.5 -57.5 -43.9 29.6 27.9 93.5 170 218 A D H 4 S+ 0 0 82 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.766 111.7 48.7 -71.1 -27.2 31.9 28.1 90.5 171 219 A L H >< S+ 0 0 0 -4,-1.6 3,-0.7 -3,-0.2 4,-0.3 0.823 108.5 54.9 -80.0 -31.5 29.1 27.8 87.9 172 220 A A H 3< S+ 0 0 0 -4,-2.2 -53,-1.4 1,-0.2 3,-0.4 0.753 106.0 54.0 -69.9 -24.7 27.2 30.5 89.8 173 221 A A T 3< S+ 0 0 53 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.577 98.5 60.0 -87.7 -11.3 30.3 32.8 89.5 174 222 A L S < S+ 0 0 18 -3,-0.7 2,-0.3 -4,-0.4 -1,-0.2 0.478 96.4 79.9 -91.3 -5.5 30.6 32.5 85.7 175 223 A V + 0 0 2 -3,-0.4 2,-0.3 -4,-0.3 -56,-0.2 -0.776 57.0 163.4-105.6 148.5 27.2 34.0 85.4 176 224 A A - 0 0 16 -2,-0.3 2,-0.7 -58,-0.1 -62,-0.1 -0.990 43.8 -89.0-159.2 161.0 26.2 37.6 85.6 177 225 A D >> - 0 0 7 -2,-0.3 3,-2.1 1,-0.2 4,-1.2 -0.644 28.6-149.0 -76.8 111.4 23.6 40.2 84.8 178 226 A F H >> S+ 0 0 0 -66,-3.7 4,-3.6 -2,-0.7 3,-1.2 0.900 98.5 58.1 -45.3 -48.1 24.1 41.6 81.3 179 227 A R H 34 S+ 0 0 31 1,-0.3 -1,-0.3 -67,-0.3 6,-0.1 0.758 104.2 52.2 -55.8 -26.5 22.7 44.9 82.5 180 228 A K H <4 S+ 0 0 169 -3,-2.1 -1,-0.3 1,-0.1 -2,-0.2 0.741 112.8 42.6 -84.1 -23.5 25.4 45.1 85.2 181 229 A I H << S+ 0 0 20 -4,-1.2 2,-2.5 -3,-1.2 -2,-0.2 0.903 104.7 72.7 -81.2 -47.3 28.2 44.5 82.7 182 230 A D >< + 0 0 4 -4,-3.6 3,-0.7 -5,-0.2 2,-0.3 -0.388 64.5 171.8 -69.2 68.0 26.5 46.9 80.3 183 231 A T T 3 S+ 0 0 94 -2,-2.5 3,-0.5 1,-0.2 4,-0.1 -0.535 70.1 43.7 -70.3 154.6 27.1 50.3 81.9 184 232 A N T 3 S- 0 0 123 -2,-0.3 -1,-0.2 1,-0.2 -2,-0.1 -0.306 109.3-119.2 -46.0 -12.1 26.1 53.1 79.5 185 233 A S < + 0 0 74 -3,-0.7 -1,-0.2 -6,-0.1 -2,-0.1 0.775 68.0 142.6 77.0 36.0 23.0 50.9 78.9 186 234 A N - 0 0 105 -3,-0.5 -2,-0.1 2,-0.2 3,-0.1 0.700 62.5-124.2 -82.7 -16.6 23.8 50.5 75.1 187 235 A G S S+ 0 0 21 -5,-0.1 39,-0.8 -4,-0.1 2,-0.3 0.634 87.3 77.0 85.6 10.9 22.7 46.8 75.0 188 236 A T E S-A 225 0A 50 37,-0.2 37,-0.3 38,-0.1 -2,-0.2 -0.888 75.2-135.1-155.2 120.1 26.0 45.7 73.6 189 237 A L E -A 224 0A 1 35,-3.0 35,-2.0 -2,-0.3 2,-0.2 -0.369 22.1-136.2 -72.8 157.5 29.2 45.2 75.5 190 238 A S > - 0 0 48 33,-0.2 4,-4.2 1,-0.1 5,-0.2 -0.706 26.5-102.2-111.4 163.8 32.4 46.6 74.1 191 239 A R H > S+ 0 0 72 31,-0.4 4,-3.2 -2,-0.2 5,-0.3 0.954 125.7 51.5 -48.1 -53.0 35.9 45.0 73.9 192 240 A K H > S+ 0 0 67 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.947 115.3 40.2 -48.4 -57.2 36.9 47.3 76.8 193 241 A E H > S+ 0 0 26 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.898 114.7 54.0 -59.4 -44.6 33.9 46.1 78.8 194 242 A F H X S+ 0 0 2 -4,-4.2 4,-2.6 2,-0.2 5,-0.2 0.974 110.2 45.6 -53.2 -62.0 34.3 42.5 77.7 195 243 A R H X S+ 0 0 68 -4,-3.2 4,-0.8 1,-0.2 5,-0.2 0.923 111.4 53.3 -46.9 -55.0 37.9 42.4 78.8 196 244 A E H >X S+ 0 0 143 -4,-2.4 4,-1.3 -5,-0.3 3,-0.9 0.910 112.3 43.7 -46.7 -55.0 37.1 44.0 82.1 197 245 A H H 3X S+ 0 0 32 -4,-2.5 4,-1.2 1,-0.2 3,-0.3 0.922 113.1 50.1 -60.1 -49.6 34.4 41.5 83.0 198 246 A F H 3<>S+ 0 0 5 -4,-2.6 5,-2.0 1,-0.2 -1,-0.2 0.464 101.8 61.7 -74.8 0.6 36.3 38.4 81.9 199 247 A V H X<5S+ 0 0 69 -3,-0.9 3,-1.5 -4,-0.8 -1,-0.2 0.842 101.8 53.6 -86.6 -39.8 39.4 39.4 83.8 200 248 A R H 3<5S+ 0 0 86 -4,-1.3 -2,-0.2 -3,-0.3 -3,-0.1 0.865 107.0 51.3 -59.1 -37.2 37.2 39.1 86.9 201 249 A L T 3<5S- 0 0 42 -4,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.497 130.3 -92.9 -80.1 -3.9 36.2 35.6 86.0 202 250 A G T < 5S+ 0 0 39 -3,-1.5 2,-1.6 1,-0.2 -3,-0.2 0.324 87.6 124.1 114.4 -11.5 39.8 34.6 85.5 203 251 A F < + 0 0 2 -5,-2.0 -1,-0.2 1,-0.2 -2,-0.1 -0.650 22.1 155.4 -86.7 88.5 40.6 35.1 81.8 204 252 A D + 0 0 105 -2,-1.6 2,-0.6 -5,-0.1 -1,-0.2 0.368 41.6 95.7 -94.2 2.7 43.5 37.4 82.3 205 253 A K >> - 0 0 58 1,-0.2 4,-3.4 -3,-0.1 3,-0.6 -0.864 61.3-153.5-103.1 121.1 45.1 36.6 78.9 206 254 A K H 3> S+ 0 0 157 -2,-0.6 4,-4.0 1,-0.3 5,-0.4 0.939 98.7 58.0 -47.7 -55.2 44.5 38.9 75.9 207 255 A S H 3> S+ 0 0 70 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.835 113.9 36.0 -43.5 -46.6 45.1 35.9 73.6 208 256 A V H <> S+ 0 0 5 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.869 114.7 56.6 -78.5 -39.8 42.3 33.9 75.3 209 257 A Q H X S+ 0 0 8 -4,-3.4 4,-2.7 1,-0.2 -2,-0.2 0.947 108.6 47.2 -54.8 -50.5 40.1 37.0 75.8 210 258 A D H X S+ 0 0 48 -4,-4.0 4,-2.7 1,-0.2 -1,-0.2 0.865 107.9 57.3 -58.4 -37.6 40.3 37.6 72.0 211 259 A A H X S+ 0 0 11 -4,-1.1 4,-1.4 -5,-0.4 -1,-0.2 0.914 110.1 43.7 -61.0 -43.5 39.5 34.0 71.5 212 260 A L H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 3,-0.4 0.957 112.5 50.3 -65.7 -52.9 36.3 34.3 73.5 213 261 A F H X S+ 0 0 2 -4,-2.7 4,-2.5 1,-0.3 -2,-0.2 0.898 109.6 52.9 -50.9 -45.8 35.3 37.6 71.9 214 262 A R H < S+ 0 0 173 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.866 110.7 48.6 -58.8 -38.1 35.9 36.0 68.5 215 263 A Y H < S+ 0 0 53 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.897 112.7 45.1 -72.1 -42.2 33.6 33.2 69.6 216 264 A A H < S+ 0 0 3 -4,-2.6 2,-2.3 1,-0.2 3,-0.2 0.918 97.1 73.7 -70.3 -44.6 30.7 35.3 70.9 217 265 A D >< + 0 0 13 -4,-2.5 3,-1.8 -5,-0.2 5,-0.2 -0.379 47.9 155.5 -76.4 71.4 30.5 37.8 68.1 218 266 A E T 3 S+ 0 0 88 -2,-2.3 -1,-0.2 1,-0.3 -2,-0.1 0.778 70.9 65.3 -63.6 -27.4 28.9 35.7 65.3 219 267 A D T 3 S- 0 0 79 -3,-0.2 -1,-0.3 4,-0.2 -2,-0.1 0.458 103.2-133.9 -75.5 0.1 27.6 38.9 63.8 220 268 A E < + 0 0 177 -3,-1.8 -2,-0.1 -6,-0.1 -6,-0.0 0.900 68.1 122.4 47.0 53.8 31.2 39.9 63.1 221 269 A S S S- 0 0 56 2,-0.3 -1,-0.1 -4,-0.1 3,-0.1 0.196 79.4-116.4-125.9 13.8 30.8 43.5 64.4 222 270 A D S S+ 0 0 95 -5,-0.2 -31,-0.4 1,-0.2 2,-0.3 0.861 86.0 101.2 51.3 38.5 33.4 43.6 67.1 223 271 A D - 0 0 44 -33,-0.1 2,-0.6 -10,-0.1 -2,-0.3 -0.977 66.3-136.5-152.6 136.9 30.6 44.1 69.6 224 272 A V E -A 189 0A 0 -35,-2.0 -35,-3.0 -2,-0.3 2,-0.3 -0.854 20.2-167.6-102.1 121.3 28.9 41.8 72.0 225 273 A G E >> -A 188 0A 4 -2,-0.6 4,-2.6 -37,-0.3 3,-1.2 -0.806 39.8 -99.6-107.1 148.2 25.1 41.9 72.4 226 274 A F H 3> S+ 0 0 0 -39,-0.8 4,-3.0 -2,-0.3 5,-0.2 0.801 123.4 52.2 -25.9 -58.6 23.0 40.2 75.1 227 275 A S H 3> S+ 0 0 15 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.907 113.3 41.0 -50.7 -51.4 22.2 37.4 72.7 228 276 A E H <> S+ 0 0 23 -3,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.854 112.7 57.7 -66.4 -33.2 25.8 36.6 71.8 229 277 A Y H X S+ 0 0 9 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.946 104.9 50.0 -59.7 -48.5 26.7 37.1 75.4 230 278 A V H X S+ 0 0 0 -4,-3.0 4,-1.6 -5,-0.3 -1,-0.2 0.831 108.9 53.0 -59.9 -34.1 24.2 34.4 76.4 231 279 A H H X S+ 0 0 48 -4,-1.4 4,-1.0 -5,-0.2 -1,-0.2 0.890 111.4 44.5 -70.6 -41.3 25.8 32.1 73.8 232 280 A L H X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 3,-0.2 0.917 112.7 52.7 -69.2 -42.9 29.3 32.5 75.2 233 281 A G H X S+ 0 0 9 -4,-2.8 4,-1.3 1,-0.2 -2,-0.2 0.812 107.8 49.1 -63.4 -33.8 28.1 32.2 78.7 234 282 A L H X S+ 0 0 2 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.761 110.2 54.1 -75.7 -24.5 26.3 28.9 78.1 235 283 A C H X S+ 0 0 3 -4,-1.0 4,-2.1 -3,-0.2 -2,-0.2 0.902 107.5 49.1 -73.7 -41.5 29.4 27.7 76.4 236 284 A L H X S+ 0 0 1 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.802 107.0 55.0 -68.7 -30.4 31.5 28.5 79.5 237 285 A L H X S+ 0 0 0 -4,-1.3 4,-1.2 2,-0.2 -1,-0.2 0.878 109.7 47.9 -70.4 -35.9 29.2 26.7 81.8 238 286 A V H X S+ 0 0 0 -4,-1.2 4,-3.0 2,-0.2 5,-0.2 0.945 112.3 46.5 -68.6 -50.9 29.5 23.5 79.8 239 287 A L H X S+ 0 0 1 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.839 112.6 51.0 -62.7 -31.7 33.3 23.6 79.6 240 288 A R H X S+ 0 0 35 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.810 111.7 48.2 -74.2 -28.8 33.5 24.3 83.3 241 289 A I H X S+ 0 0 0 -4,-1.2 4,-1.1 -3,-0.2 -2,-0.2 0.918 114.1 44.9 -76.0 -43.6 31.2 21.4 84.0 242 290 A L H X S+ 0 0 0 -4,-3.0 4,-1.2 2,-0.2 3,-0.4 0.910 106.0 62.4 -66.4 -39.4 33.2 19.1 81.7 243 291 A Y H >< S+ 0 0 11 -4,-2.5 3,-1.0 1,-0.3 -1,-0.2 0.931 110.3 38.8 -49.7 -50.4 36.5 20.4 83.2 244 292 A A H >< S+ 0 0 25 -4,-1.3 3,-0.8 1,-0.2 -1,-0.3 0.686 106.6 67.2 -73.8 -19.4 35.4 19.0 86.6 245 293 A F H 3< S+ 0 0 36 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.696 104.0 46.1 -72.7 -18.0 33.9 16.0 84.9 246 294 A A T << S+ 0 0 12 -4,-1.2 2,-1.5 -3,-1.0 9,-0.3 0.312 79.0 104.6-107.9 8.1 37.5 15.0 84.0 247 295 A D < + 0 0 31 -3,-0.8 -1,-0.1 1,-0.2 5,-0.1 -0.467 41.5 175.2 -91.4 66.9 39.3 15.5 87.2 248 296 A F S S+ 0 0 101 -2,-1.5 -1,-0.2 2,-0.1 2,-0.0 0.870 74.0 30.7 -31.2 -67.5 39.7 11.9 88.3 249 297 A D S S- 0 0 65 -3,-0.2 3,-0.4 1,-0.1 0, 0.0 -0.198 101.7-102.6 -83.0-176.5 41.7 12.9 91.3 250 298 A K S S+ 0 0 99 1,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.192 75.6 135.0 -93.2 18.1 41.1 16.2 93.1 251 299 A S - 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