==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN, TRANSPORT PROTEIN 17-MAY-13 4KSD . COMPND 2 MOLECULE: MULTIDRUG RESISTANCE PROTEIN 1A; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR A.WARD,P.SZEWCZYK,V.GRIMARD,C-W.LEE,L.MARTINEZ,R.DOSHI,A.CAY . 1300 3 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 64230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 928 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 75 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 63 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 628 48.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 1.5 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 4 3 3 5 2 1 1 2 0 0 4 0 1 1 0 0 0 0 1 0 0 0 0 0 0 0 10 RESIDUES PER ALPHA HELIX . 4 1 1 4 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 . 6 2 3 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 2 2 1 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 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 V >> 0 0 125 0, 0.0 5,-1.0 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0-124.7 -10.2 56.0 111.4 2 34 A S T 45 + 0 0 60 1,-0.2 5,-0.2 3,-0.2 328,-0.1 0.749 360.0 59.9 -56.9 -25.6 -8.8 56.7 114.9 3 35 A V T 45S+ 0 0 36 3,-0.1 -1,-0.2 2,-0.1 324,-0.2 0.957 127.6 0.6 -66.6 -52.4 -6.0 54.3 114.1 4 36 A L T >5S+ 0 0 86 -3,-0.4 4,-2.2 3,-0.1 5,-0.2 0.879 122.7 58.1-107.7 -60.3 -4.5 56.1 111.0 5 37 A T T <5S+ 0 0 74 -4,-0.9 -3,-0.2 1,-0.3 -2,-0.1 0.852 112.9 42.7 -49.0 -45.1 -6.4 59.4 110.1 6 38 A M T >4 - 0 0 9 3,-0.1 4,-4.4 95,-0.1 5,-0.3 0.973 35.0-174.1 59.8 58.0 -1.3 69.1 107.8 12 44 A W H > S+ 0 0 195 1,-0.2 4,-0.7 2,-0.2 -2,-0.0 0.916 87.6 21.5 -50.6 -56.2 -3.2 70.4 104.8 13 45 A L H > S+ 0 0 126 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.686 121.4 64.9 -83.1 -20.0 -0.2 71.1 102.7 14 46 A D H > S+ 0 0 20 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.899 99.5 49.9 -66.9 -45.8 1.8 68.7 104.8 15 47 A R H X S+ 0 0 129 -4,-4.4 4,-1.5 2,-0.2 -1,-0.2 0.863 110.7 53.0 -60.3 -34.2 -0.4 65.8 103.6 16 48 A L H X S+ 0 0 88 -4,-0.7 4,-2.0 -5,-0.3 3,-0.2 0.936 111.2 42.2 -68.9 -49.1 0.3 67.0 100.0 17 49 A Y H X S+ 0 0 59 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.820 108.5 63.0 -66.5 -29.8 4.0 67.1 100.4 18 50 A M H X S+ 0 0 18 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.882 107.3 43.6 -59.1 -36.7 3.7 63.7 102.2 19 51 A L H X S+ 0 0 97 -4,-1.5 4,-2.6 -3,-0.2 -2,-0.2 0.855 111.2 52.4 -78.6 -35.9 2.3 62.4 98.9 20 52 A V H X S+ 0 0 81 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.951 113.5 45.0 -61.6 -47.6 4.9 64.1 96.7 21 53 A G H X S+ 0 0 1 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.878 110.8 53.8 -60.8 -44.2 7.6 62.5 98.9 22 54 A T H X S+ 0 0 23 -4,-1.8 4,-2.1 -5,-0.2 3,-0.3 0.953 108.4 49.6 -55.0 -50.8 5.8 59.2 98.8 23 55 A L H X S+ 0 0 111 -4,-2.6 4,-2.5 1,-0.3 5,-0.2 0.896 110.1 50.4 -56.0 -42.7 5.7 59.3 95.0 24 56 A A H X S+ 0 0 9 -4,-2.2 4,-1.5 1,-0.2 -1,-0.3 0.825 107.1 54.9 -67.0 -29.7 9.4 60.1 94.9 25 57 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 -3,-0.3 -1,-0.2 0.894 107.3 51.5 -68.2 -38.7 10.0 57.2 97.2 26 58 A I H X S+ 0 0 60 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.973 111.5 43.9 -60.7 -56.8 8.2 54.9 94.7 27 59 A I H X S+ 0 0 80 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.778 111.6 57.6 -65.8 -21.3 10.3 56.1 91.8 28 60 A H H X S+ 0 0 13 -4,-1.5 4,-0.9 -5,-0.2 -1,-0.2 0.953 109.6 41.6 -67.3 -52.5 13.4 55.7 94.0 29 61 A G H < S+ 0 0 0 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.870 114.0 54.5 -62.7 -36.0 12.7 52.1 94.7 30 62 A V H X S+ 0 0 52 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.853 99.6 63.7 -62.8 -36.0 11.8 51.6 91.1 31 63 A A H X S+ 0 0 15 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.2 0.828 90.7 64.8 -60.1 -37.2 15.1 53.1 90.0 32 64 A L H X S+ 0 0 67 -4,-0.9 4,-1.5 -3,-0.4 -1,-0.2 0.911 103.9 41.6 -61.1 -50.4 17.3 50.3 91.6 33 65 A P H > S+ 0 0 14 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.856 112.2 57.3 -66.5 -30.4 16.2 47.3 89.5 34 66 A L H X S+ 0 0 70 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.868 104.7 51.9 -60.8 -38.4 16.3 49.6 86.4 35 67 A M H X S+ 0 0 10 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.853 114.1 42.8 -63.3 -36.1 19.9 50.2 87.3 36 68 A M H X S+ 0 0 18 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.676 107.0 60.0 -83.3 -20.9 20.3 46.4 87.4 37 69 A L H >X S+ 0 0 32 -4,-2.1 4,-1.7 2,-0.2 3,-0.5 0.878 104.6 51.1 -66.9 -39.7 18.2 46.1 84.2 38 70 A I H 3X S+ 0 0 18 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.868 101.6 62.4 -59.1 -38.4 20.9 48.2 82.7 39 71 A F H 3X S+ 0 0 25 -4,-0.9 4,-1.0 1,-0.2 -1,-0.2 0.800 105.1 45.9 -60.9 -32.2 23.4 45.8 84.2 40 72 A G H < S+ 0 0 32 -4,-1.4 3,-0.5 1,-0.2 4,-0.3 0.874 110.5 35.8 -69.1 -38.6 36.5 37.6 70.2 54 86 A K T 3< S+ 0 0 124 -4,-1.5 597,-0.2 1,-0.2 -1,-0.2 0.625 108.1 69.6 -84.1 -12.9 37.5 34.1 71.2 55 87 A N T 3 S+ 0 0 89 -4,-0.4 -1,-0.2 -5,-0.2 -2,-0.2 0.384 85.0 79.5 -87.5 5.8 35.8 32.6 68.1 56 88 A S < + 0 0 27 -3,-0.5 -2,-0.1 -4,-0.1 -1,-0.1 0.979 31.3 147.8 -80.9 -83.1 38.5 34.2 65.9 57 89 A T S S+ 0 0 121 -4,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.737 87.0 48.1 45.4 27.4 41.8 32.3 65.7 58 90 A N S S+ 0 0 152 1,-0.6 2,-0.3 0, 0.0 -1,-0.2 0.286 108.5 37.8-147.5 -68.5 41.8 33.7 62.1 59 91 A M + 0 0 98 1,-0.1 -1,-0.6 2,-0.0 -2,-0.2 -0.747 48.0 168.1-102.0 145.7 41.0 37.4 62.0 60 92 A S S >> S+ 0 0 61 -2,-0.3 4,-1.2 -4,-0.1 3,-1.1 0.694 72.7 56.1-119.5 -59.9 42.1 40.0 64.5 61 93 A E H 3> S+ 0 0 104 1,-0.3 4,-0.6 2,-0.2 -2,-0.0 0.749 101.0 62.4 -49.6 -31.4 41.4 43.5 63.2 62 94 A A H >>>S+ 0 0 14 1,-0.2 4,-2.1 2,-0.2 3,-0.8 0.906 102.9 48.5 -64.4 -41.5 37.7 42.6 62.7 63 95 A D H <4>S+ 0 0 19 -3,-1.1 5,-0.5 1,-0.3 4,-0.2 0.785 108.4 56.3 -65.0 -27.1 37.4 42.1 66.5 64 96 A K H 3<5S+ 0 0 114 -4,-1.2 -1,-0.3 3,-0.1 -2,-0.2 0.671 115.1 39.7 -76.2 -17.1 39.2 45.5 66.7 65 97 A R H X S+ 0 0 28 -4,-2.7 4,-2.4 1,-0.3 3,-0.5 0.877 102.0 55.0 -49.7 -47.5 26.8 54.0 80.2 79 111 A A H 3X S+ 0 0 31 -4,-2.2 4,-0.9 1,-0.3 -1,-0.3 0.870 111.1 42.9 -59.8 -40.0 27.2 57.8 80.3 80 112 A Y H 3X S+ 0 0 169 -4,-0.9 4,-1.3 -3,-0.5 -1,-0.3 0.637 114.8 57.4 -80.5 -9.2 23.5 58.3 80.0 81 113 A Y H S+ 0 0 5 -4,-1.5 4,-1.0 -5,-0.3 5,-0.8 0.816 98.7 57.6 -60.4 -28.1 12.2 65.8 103.5 99 131 A F H X>S+ 0 0 7 -4,-1.4 5,-0.8 1,-0.2 4,-0.6 0.940 101.6 54.7 -60.3 -48.2 9.3 63.5 104.4 100 132 A W H <5S+ 0 0 53 -4,-0.9 -2,-0.2 51,-0.1 -1,-0.2 0.802 126.1 18.5 -57.0 -31.3 11.3 62.4 107.5 101 133 A C H X5S+ 0 0 1 -4,-1.6 4,-2.8 742,-0.1 5,-0.2 0.872 118.1 48.8-107.8 -67.7 11.6 66.0 108.6 102 134 A L H X5S+ 0 0 64 -4,-1.0 4,-1.1 1,-0.2 -3,-0.2 0.807 118.9 39.5 -51.1 -40.5 9.3 68.7 107.2 103 135 A A H X< S+ 0 0 25 -4,-2.4 3,-1.3 1,-0.2 4,-0.5 0.956 111.0 39.9 -59.4 -51.5 -3.1 67.9 130.0 120 152 A M H 3< S+ 0 0 7 -4,-0.8 3,-0.3 1,-0.2 -1,-0.2 0.702 112.2 60.9 -67.9 -19.0 -3.6 71.2 131.9 121 153 A N T 3< S+ 0 0 8 -4,-1.0 221,-0.3 1,-0.2 -1,-0.2 0.498 90.0 67.2 -88.0 -6.0 -7.1 71.2 130.5 122 154 A Q S X S+ 0 0 63 -3,-1.3 3,-1.4 -4,-0.5 -1,-0.2 0.722 77.3 169.9 -80.5 -22.8 -8.0 67.9 132.3 123 155 A E T >> + 0 0 7 -4,-0.5 3,-1.1 -3,-0.3 4,-0.5 -0.265 60.5 19.5 52.8-118.5 -7.7 69.7 135.6 124 156 A I H >> S+ 0 0 11 1,-0.2 4,-1.9 2,-0.2 3,-1.4 0.788 109.8 76.1 -50.7 -39.8 -9.0 67.6 138.6 125 157 A G H <> S+ 0 0 13 -3,-1.4 4,-2.4 1,-0.3 -1,-0.2 0.789 88.7 55.3 -50.0 -40.8 -8.7 64.2 136.8 126 158 A W H <4 S+ 0 0 30 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.860 110.7 46.6 -65.5 -30.2 -4.9 63.9 137.1 127 159 A F H << S+ 0 0 83 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.823 111.2 53.8 -78.6 -31.0 -5.2 64.3 140.9 128 160 A D H < S- 0 0 50 -4,-1.9 2,-0.2 1,-0.1 -2,-0.2 0.901 120.5 -3.2 -64.6 -42.0 -8.1 61.9 140.9 129 161 A V S < S+ 0 0 77 -4,-2.4 3,-0.3 -5,-0.2 -1,-0.1 -0.772 89.0 27.8-147.8-177.3 -6.1 59.1 139.1 130 162 A H S S- 0 0 122 -2,-0.2 -4,-0.0 1,-0.2 0, 0.0 -0.076 90.3 -48.1 55.2-148.0 -3.1 57.5 137.3 131 163 A D > - 0 0 72 2,-0.0 3,-0.7 0, 0.0 -1,-0.2 0.600 47.7-154.9-102.9 -18.5 0.6 58.3 137.7 132 164 A V T 3 S+ 0 0 72 -3,-0.3 -2,-0.1 1,-0.3 -6,-0.0 0.830 89.9 14.1 47.3 53.7 1.0 62.1 137.5 133 165 A G T 3> S+ 0 0 20 677,-0.0 4,-0.6 0, 0.0 -1,-0.3 -0.151 121.7 57.9 143.3 -52.1 4.6 62.0 136.3 134 166 A E H <> S+ 0 0 106 -3,-0.7 4,-2.6 2,-0.2 5,-0.2 0.839 110.3 52.3 -75.2 -31.7 5.3 58.4 135.2 135 167 A L H > S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.945 109.2 44.9 -64.7 -53.0 2.4 59.0 132.8 136 168 A N H > S+ 0 0 26 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.624 113.0 55.8 -72.5 -11.0 3.8 62.2 131.4 137 169 A T H X S+ 0 0 75 -4,-0.6 4,-1.5 2,-0.2 3,-0.3 0.952 112.3 37.4 -76.4 -64.6 7.2 60.4 131.1 138 170 A R H X S+ 0 0 137 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.834 114.1 58.3 -56.8 -37.9 5.9 57.4 129.1 139 171 A L H X S+ 0 0 17 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.904 106.6 46.3 -62.0 -42.6 3.6 59.7 127.1 140 172 A T H X S+ 0 0 47 -4,-0.8 4,-0.9 -3,-0.3 -1,-0.2 0.754 110.1 55.2 -73.9 -20.5 6.5 61.9 125.9 141 173 A D H X S+ 0 0 86 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.846 107.7 49.9 -75.1 -32.7 8.4 58.7 125.1 142 174 A D H X S+ 0 0 24 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.885 109.5 48.8 -69.7 -40.2 5.4 57.7 122.9 143 175 A V H X S+ 0 0 4 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.780 109.0 55.3 -71.4 -23.7 5.4 61.0 121.2 144 176 A S H X S+ 0 0 57 -4,-0.9 4,-0.7 1,-0.2 3,-0.3 0.863 105.1 52.4 -70.4 -36.9 9.1 60.4 120.8 145 177 A K H X S+ 0 0 73 -4,-1.5 4,-1.4 1,-0.2 3,-0.3 0.767 98.1 66.9 -65.5 -28.7 8.1 57.1 119.1 146 178 A I H X S+ 0 0 11 -4,-1.3 4,-3.1 1,-0.2 5,-0.3 0.889 92.4 58.4 -62.1 -41.8 5.8 59.0 116.7 147 179 A N H < S+ 0 0 44 -4,-0.9 4,-0.4 -3,-0.3 -1,-0.2 0.849 109.8 45.3 -55.6 -35.6 8.8 60.7 115.1 148 180 A E H < S+ 0 0 115 -4,-0.7 -1,-0.3 -3,-0.3 -2,-0.2 0.760 114.6 50.4 -75.5 -27.9 10.0 57.2 114.3 149 181 A G H < S+ 0 0 0 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.2 0.900 117.4 33.3 -79.5 -42.7 6.5 56.2 113.1 150 182 A I S < S+ 0 0 13 -4,-3.1 -1,-0.2 -5,-0.1 -3,-0.1 0.385 101.9 99.7 -95.4 3.2 5.7 59.1 110.7 151 183 A G S > S- 0 0 0 -4,-0.4 3,-1.8 -5,-0.3 4,-0.5 0.155 100.4 -65.5 -76.6-163.3 9.2 59.5 109.5 152 184 A D T 3> S+ 0 0 38 1,-0.3 4,-3.7 2,-0.2 5,-0.3 0.512 113.1 92.6 -66.4 -6.5 11.0 58.4 106.3 153 185 A K H 3> S+ 0 0 65 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.886 89.5 47.3 -51.0 -41.5 10.6 54.8 107.6 154 186 A I H <> S+ 0 0 23 -3,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.887 110.5 51.0 -63.6 -43.7 7.3 55.0 105.6 155 187 A G H > S+ 0 0 1 -4,-0.5 4,-1.9 1,-0.2 -2,-0.2 0.893 111.5 47.0 -61.8 -41.1 9.3 56.4 102.6 156 188 A M H X S+ 0 0 49 -4,-3.7 4,-2.5 2,-0.2 -1,-0.2 0.830 109.1 57.2 -65.1 -35.6 11.8 53.6 102.9 157 189 A F H X S+ 0 0 45 -4,-1.5 4,-2.4 -5,-0.3 -2,-0.2 0.943 110.1 41.5 -62.0 -50.3 8.8 51.2 103.2 158 190 A F H X S+ 0 0 63 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.835 112.7 55.7 -65.8 -35.5 7.4 52.4 99.8 159 191 A Q H X S+ 0 0 31 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.938 109.0 47.7 -58.7 -46.2 10.9 52.4 98.3 160 192 A A H X S+ 0 0 8 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.920 110.9 49.6 -61.0 -49.9 11.2 48.7 99.4 161 193 A M H X>S+ 0 0 84 -4,-2.4 4,-2.2 1,-0.2 5,-0.8 0.828 107.4 56.0 -60.9 -34.1 7.8 47.8 98.0 162 194 A A H X5S+ 0 0 10 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.898 110.7 44.3 -63.6 -39.1 8.8 49.5 94.7 163 195 A T H X5S+ 0 0 12 -4,-2.0 4,-0.5 3,-0.2 -2,-0.2 0.821 119.5 43.9 -72.8 -27.9 11.9 47.3 94.6 164 196 A F H X5S+ 0 0 85 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.989 124.6 27.3 -79.8 -70.7 9.8 44.2 95.5 165 197 A F H X5S+ 0 0 137 -4,-2.2 4,-1.8 1,-0.2 -3,-0.2 0.909 127.2 48.2 -62.5 -42.2 6.7 44.5 93.4 166 198 A G H X S+ 0 0 189 -2,-0.2 4,-1.3 -3,-0.2 -4,-0.1 0.525 89.0 64.5-100.1 -6.1 8.0 32.9 84.2 177 209 A K H >> S+ 0 0 84 2,-0.2 4,-2.1 1,-0.1 3,-0.6 0.983 100.7 44.2 -80.0 -67.6 10.2 29.9 84.8 178 210 A L H 3> S+ 0 0 17 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.835 112.0 58.5 -45.7 -37.4 13.1 31.2 86.8 179 211 A T H 3> S+ 0 0 4 -4,-0.3 4,-2.7 1,-0.2 -1,-0.3 0.956 105.0 48.9 -54.5 -54.1 10.4 33.1 88.8 180 212 A L H S+ 0 0 83 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.881 116.8 55.5 -68.1 -31.4 9.5 28.7 101.3 188 220 A V H X S+ 0 0 55 -4,-0.7 4,-2.2 2,-0.3 -2,-0.2 0.902 110.7 41.9 -63.6 -45.6 12.7 26.7 101.4 189 221 A L H X S+ 0 0 44 -4,-3.3 4,-1.2 1,-0.2 -1,-0.2 0.812 118.5 48.1 -68.8 -30.4 14.8 29.7 102.5 190 222 A G H < S+ 0 0 45 -4,-1.9 4,-0.5 -5,-0.3 -2,-0.3 0.708 108.2 57.0 -76.6 -23.7 11.8 30.5 104.7 191 223 A L H X S+ 0 0 123 -4,-1.6 4,-1.1 2,-0.2 3,-0.3 0.914 106.2 46.3 -73.5 -46.3 11.8 26.9 105.9 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A V - 0 0 21 58,-0.1 2,-0.5 59,-0.1 -4,-0.1 -0.994 2.7-161.6-141.4 133.9 5.3 77.3 146.8 443 475 A L - 0 0 3 -2,-0.4 50,-0.0 3,-0.0 5,-0.0 -0.968 16.7-134.4-119.0 127.7 7.3 79.7 144.7 444 476 A F - 0 0 10 -2,-0.5 2,-1.0 1,-0.1 44,-0.2 -0.310 40.7 -92.7 -68.2 160.3 8.0 79.1 141.0 445 477 A A S S+ 0 0 52 42,-0.1 2,-0.3 5,-0.1 -1,-0.1 -0.694 90.0 85.4 -88.4 108.9 11.6 79.7 139.9 446 478 A T S S- 0 0 22 -2,-1.0 42,-1.5 40,-0.1 2,-0.0 -0.890 87.3 -52.7 179.3 175.9 11.5 83.4 138.8 447 479 A T B > -K 487 0E 22 -2,-0.3 4,-2.4 40,-0.2 40,-0.2 -0.330 48.6-116.9 -67.3 157.4 11.9 86.8 140.3 448 480 A I H > S+ 0 0 11 38,-1.2 4,-2.0 36,-0.6 5,-0.2 0.867 121.4 58.7 -63.0 -32.0 9.6 87.7 143.2 449 481 A A H > S+ 0 0 14 35,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.861 107.3 44.8 -60.7 -40.9 8.3 90.3 140.8 450 482 A E H > S+ 0 0 60 34,-0.3 4,-1.3 2,-0.2 -2,-0.2 0.870 108.2 55.3 -74.8 -39.4 7.4 87.5 138.4 451 483 A N H < S+ 0 0 1 -4,-2.4 4,-0.3 2,-0.2 -2,-0.2 0.854 114.1 42.6 -61.2 -34.8 5.8 85.3 141.0 452 484 A I H >X S+ 0 0 2 -4,-2.0 3,-2.1 2,-0.2 4,-1.3 0.892 109.2 57.5 -71.3 -42.7 3.6 88.3 141.9 453 485 A R H 3< S+ 0 0 83 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.703 97.4 63.7 -59.7 -21.2 3.2 88.9 138.1 454 486 A Y T 3< S+ 0 0 15 -4,-1.3 -1,-0.3 1,-0.2 3,-0.2 0.720 96.5 57.7 -74.0 -23.1 1.8 85.3 138.1 455 487 A G T <4 S+ 0 0 2 -3,-2.1 2,-0.4 1,-0.3 -2,-0.2 0.939 128.5 6.2 -68.7 -50.0 -0.9 86.6 140.3 456 488 A R < - 0 0 78 -4,-1.3 -1,-0.3 1,-0.1 55,-0.0 -0.977 64.8-151.0-138.0 127.3 -1.9 89.2 137.7 457 489 A E S S+ 0 0 101 -2,-0.4 2,-0.8 -3,-0.2 -1,-0.1 0.933 88.4 53.7 -58.9 -52.7 -0.4 89.4 134.2 458 490 A D S S+ 0 0 129 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.776 79.8 121.3 -92.4 109.4 -0.9 93.2 133.7 459 491 A V - 0 0 21 -2,-0.8 2,-0.3 4,-0.0 -6,-0.0 -0.980 47.0-135.7-160.2 159.7 0.7 95.0 136.6 460 492 A T >> - 0 0 81 -2,-0.3 4,-1.5 1,-0.0 3,-1.5 -0.914 33.4-108.9-124.9 155.0 3.4 97.6 137.4 461 493 A M H 3> S+ 0 0 100 -2,-0.3 4,-2.3 1,-0.3 5,-0.1 0.668 115.5 66.5 -56.7 -21.7 6.0 97.6 140.1 462 494 A D H 3> S+ 0 0 94 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.909 103.6 44.3 -63.2 -44.1 4.1 100.3 142.0 463 495 A E H <> S+ 0 0 69 -3,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.836 110.9 54.8 -67.6 -36.3 1.3 97.9 142.6 464 496 A I H X S+ 0 0 5 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.932 109.4 49.0 -57.8 -45.3 3.9 95.3 143.6 465 497 A E H X S+ 0 0 70 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.930 111.7 46.0 -61.4 -51.7 5.2 97.8 146.1 466 498 A K H X S+ 0 0 136 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.866 112.4 54.5 -61.6 -34.5 1.8 98.6 147.5 467 499 A A H X S+ 0 0 3 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.970 115.2 34.7 -63.4 -58.3 1.1 94.9 147.7 468 500 A V H <>S+ 0 0 2 -4,-2.7 5,-3.4 1,-0.2 6,-0.7 0.838 115.7 57.5 -68.1 -33.3 4.1 93.8 149.7 469 501 A K H ><5S+ 0 0 132 -4,-2.5 3,-0.7 -5,-0.3 -1,-0.2 0.859 110.1 43.5 -65.7 -37.1 4.1 97.0 151.7 470 502 A E H 3<5S+ 0 0 85 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.724 115.4 49.8 -77.5 -22.1 0.5 96.3 152.8 471 503 A A T 3<5S- 0 0 3 -4,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.306 111.1-128.5 -93.1 5.4 1.7 92.7 153.4 472 504 A N T < 5S+ 0 0 33 -3,-0.7 3,-0.3 1,-0.1 -3,-0.2 0.768 76.8 121.9 47.2 34.3 4.7 94.2 155.3 473 505 A A >< + 0 0 0 -5,-3.4 4,-0.9 1,-0.2 -4,-0.2 0.341 43.8 92.4 -96.3 3.6 6.9 92.1 153.1 474 506 A Y T 4 S+ 0 0 60 -6,-0.7 4,-0.4 1,-0.1 -1,-0.2 0.408 73.8 66.6 -83.5 2.3 8.8 95.2 152.0 475 507 A D T >> S+ 0 0 90 -3,-0.3 4,-1.8 -7,-0.2 3,-0.6 0.959 102.3 34.5 -86.3 -67.6 11.4 94.9 154.7 476 508 A F H 3> S+ 0 0 25 1,-0.2 4,-1.7 2,-0.2 -2,-0.1 0.797 115.2 58.8 -61.5 -29.5 13.6 91.8 154.1 477 509 A I H 3< S+ 0 0 5 -4,-0.9 6,-0.3 2,-0.2 -1,-0.2 0.858 106.4 46.3 -69.0 -36.7 13.3 92.2 150.3 478 510 A M H <4 S+ 0 0 69 -3,-0.6 -2,-0.2 -4,-0.4 -1,-0.2 0.928 113.1 48.4 -70.0 -46.9 14.9 95.7 150.2 479 511 A K H < S+ 0 0 190 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.2 0.839 101.5 85.4 -58.0 -35.2 17.6 94.6 152.5 480 512 A L S >< S- 0 0 63 -4,-1.7 3,-1.0 -5,-0.2 6,-0.1 -0.492 90.1-114.2 -68.1 134.9 17.9 91.6 150.1 481 513 A P T 3 S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.219 97.9 29.1 -66.2 162.5 20.2 92.3 147.0 482 514 A H T > S- 0 0 139 3,-0.1 3,-2.2 4,-0.1 4,-0.1 0.290 94.9-149.8 68.4 -10.1 18.7 92.4 143.5 483 515 A Q G X - 0 0 68 -3,-1.0 3,-1.5 -6,-0.3 -35,-0.2 -0.215 69.6 -4.1 53.4-129.4 15.5 93.6 145.2 484 516 A F G 3 S+ 0 0 18 1,-0.3 -35,-1.9 -36,-0.1 -36,-0.6 0.664 131.6 65.8 -66.1 -19.5 12.3 92.5 143.4 485 517 A D G < S+ 0 0 116 -3,-2.2 2,-0.4 -38,-0.2 -1,-0.3 0.362 72.3 126.2 -87.2 5.3 14.5 91.1 140.6 486 518 A T < - 0 0 13 -3,-1.5 -38,-1.2 -4,-0.1 -37,-0.2 -0.515 55.4-141.5 -68.1 122.1 15.8 88.5 143.1 487 519 A L B -K 447 0E 107 -2,-0.4 2,-0.8 -40,-0.2 -40,-0.2 -0.471 11.2-124.7 -78.3 154.0 15.3 85.0 141.6 488 520 A V - 0 0 3 -42,-1.5 3,-0.3 -44,-0.2 2,-0.2 -0.893 38.1-148.1-100.1 106.6 14.2 82.2 143.8 489 521 A G + 0 0 37 -2,-0.8 4,-0.1 1,-0.2 -43,-0.0 -0.479 61.4 7.8 -86.2 146.2 17.0 79.7 143.1 490 522 A E S > S- 0 0 175 -2,-0.2 3,-0.8 2,-0.1 -1,-0.2 0.980 123.9 -56.8 52.7 72.0 16.8 75.9 143.0 491 523 A R T 3 S- 0 0 140 -3,-0.3 -49,-0.0 1,-0.2 0, 0.0 -0.360 99.9 -40.8 58.9-137.7 13.0 75.5 143.4 492 524 A G T 3 S+ 0 0 5 -47,-0.1 2,-1.1 1,-0.1 3,-0.3 0.493 104.1 98.9-106.2 -2.4 11.6 77.2 146.5 493 525 A A < + 0 0 86 -3,-0.8 3,-0.1 1,-0.2 -1,-0.1 -0.733 49.9 96.5 -93.2 102.8 14.0 76.6 149.3 494 526 A Q S S+ 0 0 104 -2,-1.1 -1,-0.2 1,-0.5 2,-0.1 0.397 79.6 20.1-137.2 -63.7 16.1 79.6 149.7 495 527 A L S S- 0 0 44 -3,-0.3 -1,-0.5 1,-0.2 5,-0.1 -0.355 101.6 -46.1-111.1-176.9 14.9 82.0 152.4 496 528 A S > - 0 0 50 1,-0.1 4,-1.7 -2,-0.1 3,-0.3 -0.236 44.8-133.6 -56.5 139.2 12.6 81.8 155.5 497 529 A G H > S+ 0 0 33 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.822 105.8 58.3 -63.1 -35.8 9.3 80.0 155.0 498 530 A G H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.869 106.9 48.6 -62.4 -36.4 7.4 82.8 156.7 499 531 A Q H > S+ 0 0 46 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.872 109.6 53.3 -69.6 -38.1 8.8 85.2 154.2 500 532 A K H X S+ 0 0 26 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.945 111.6 43.8 -59.6 -52.5 7.8 82.8 151.4 501 533 A Q H X S+ 0 0 4 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.895 110.3 56.2 -61.4 -42.0 4.2 82.6 152.6 502 534 A R H X S+ 0 0 12 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.884 107.6 49.1 -58.7 -38.5 4.2 86.4 153.2 503 535 A I H X S+ 0 0 3 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.904 106.9 54.8 -66.2 -41.6 5.1 86.8 149.5 504 536 A A H X S+ 0 0 4 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.876 106.8 52.9 -58.5 -36.8 2.3 84.4 148.5 505 537 A I H X S+ 0 0 7 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.889 106.1 51.6 -62.9 -43.9 0.0 86.7 150.4 506 538 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.897 108.6 52.9 -62.0 -35.7 1.3 89.7 148.5 507 539 A R H X S+ 0 0 36 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.908 111.0 44.5 -63.3 -45.4 0.5 87.7 145.3 508 540 A A H < S+ 0 0 9 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.748 109.0 59.4 -70.2 -23.5 -3.0 87.0 146.4 509 541 A L H >< S+ 0 0 23 -4,-1.6 3,-0.9 1,-0.2 -2,-0.2 0.853 101.8 51.8 -73.6 -35.7 -3.3 90.6 147.4 510 542 A V H 3< S+ 0 0 9 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.853 101.3 63.4 -64.6 -33.9 -2.5 91.8 143.9 511 543 A R T 3< S- 0 0 21 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.714 91.2-156.0 -59.3 -22.4 -5.3 89.4 142.8 512 544 A N < - 0 0 61 -3,-0.9 -3,-0.1 -4,-0.4 -2,-0.1 0.895 20.1-172.2 37.5 58.3 -7.7 91.6 144.8 513 545 A P - 0 0 2 0, 0.0 -80,-0.2 0, 0.0 -79,-0.2 -0.382 30.3-142.1 -76.3 157.0 -10.2 88.8 145.2 514 546 A K S S+ 0 0 58 -81,-0.7 31,-0.9 30,-0.1 2,-0.4 0.500 93.1 50.5 -92.8 -5.5 -13.6 89.4 146.8 515 547 A I E S-hi 434 545D 2 -82,-1.7 -80,-2.6 29,-0.1 2,-0.5 -0.995 73.6-162.0-128.0 135.8 -13.3 86.0 148.5 516 548 A L E -hi 435 546D 10 29,-2.0 31,-2.0 -2,-0.4 2,-0.6 -0.979 0.9-164.4-124.2 128.7 -10.3 85.1 150.5 517 549 A L E -hi 436 547D 0 -82,-1.9 -80,-3.9 -2,-0.5 2,-0.6 -0.933 5.8-176.8-116.7 114.1 -9.4 81.5 151.5 518 550 A L E -hi 437 548D 6 29,-1.8 31,-2.6 -2,-0.6 2,-0.8 -0.914 2.6-173.1-112.2 109.9 -6.9 80.8 154.2 519 551 A D E S- i 0 549D 22 -82,-3.1 -80,-0.4 -2,-0.6 31,-0.2 -0.861 72.5 -48.1-106.4 105.8 -6.0 77.1 154.9 520 552 A E S S+ 0 0 35 29,-4.1 3,-0.5 -2,-0.8 30,-0.1 0.759 82.2 156.0 46.5 33.3 -3.8 76.8 158.0 521 553 A A S S+ 0 0 4 -84,-0.3 -1,-0.1 1,-0.3 -83,-0.1 0.857 77.1 42.7 -57.6 -37.1 -1.6 79.5 156.6 522 554 A T S S+ 0 0 6 30,-0.1 -1,-0.3 11,-0.1 3,-0.3 0.709 99.3 95.6 -78.4 -24.7 -0.4 80.2 160.1 523 555 A S S S+ 0 0 6 -3,-0.5 3,-0.1 1,-0.2 -4,-0.0 -0.253 80.1 28.0 -67.9 158.7 -0.1 76.5 160.9 524 556 A A S S+ 0 0 81 1,-0.2 2,-0.3 -84,-0.0 -1,-0.2 0.937 99.1 117.5 55.0 52.7 3.3 74.8 160.5 525 557 A L S S- 0 0 35 -3,-0.3 -1,-0.2 -27,-0.0 -3,-0.0 -0.997 71.5 -95.6-149.2 150.8 5.3 77.9 161.2 526 558 A D > - 0 0 74 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.324 41.5-116.5 -61.2 149.2 7.8 79.4 163.7 527 559 A T H > S+ 0 0 62 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.850 108.0 47.5 -60.0 -39.8 6.2 81.5 166.4 528 560 A E H > S+ 0 0 116 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.969 117.0 39.0 -69.1 -55.0 7.8 84.8 165.4 529 561 A S H > S+ 0 0 3 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.797 111.9 63.2 -68.2 -26.9 7.2 84.8 161.7 530 562 A E H X S+ 0 0 12 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.955 104.8 44.0 -57.3 -52.3 3.9 83.3 162.6 531 563 A A H X S+ 0 0 36 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.868 115.8 48.9 -62.6 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H < S+ 0 0 4 -4,-2.3 -2,-0.2 2,-0.2 -3,-0.2 0.821 116.8 54.2 -67.5 -35.9 -9.3 73.5 176.8 592 624 A T H < S+ 0 0 65 -4,-2.3 -1,-0.2 -5,-0.4 -3,-0.2 0.891 121.5 33.0 -65.8 -38.5 -8.3 69.8 176.5 593 625 A Q < 0 0 47 -4,-1.4 696,-0.4 -5,-0.3 -1,-0.2 0.554 360.0 360.0 -93.2 -0.8 -5.5 70.8 174.3 594 626 A T 0 0 2 -4,-0.4 -1,-0.3 694,-0.1 -2,-0.1 -0.435 360.0 360.0 56.4 360.0 -5.3 74.0 176.3 595 ! 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 0.0 596 684 A L 0 0 169 0, 0.0 2,-0.3 0, 0.0 121,-0.0 0.000 360.0 360.0 360.0 110.7 18.5 50.1 140.4 597 685 A D + 0 0 159 1,-0.0 2,-0.2 0, 0.0 124,-0.1 -0.805 360.0 171.3-130.0 167.8 21.5 50.9 138.1 598 686 A E + 0 0 71 -2,-0.3 -1,-0.0 1,-0.1 123,-0.0 -0.522 28.5 101.2-146.8-162.6 25.1 49.9 137.8 599 687 A D - 0 0 83 -2,-0.2 -1,-0.1 1,-0.1 313,-0.0 0.984 46.6-145.5 67.3 74.4 28.4 50.1 135.8 600 688 A V - 0 0 90 1,-0.1 -1,-0.1 311,-0.1 315,-0.0 -0.294 28.9-108.8 -55.5 153.2 30.9 52.6 137.0 601 689 A P S S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 313,-0.1 0.829 77.5 109.8 -59.8 -46.1 32.9 54.2 134.1 602 690 A P - 0 0 75 0, 0.0 2,-0.0 0, 0.0 -2,-0.0 0.005 56.4-147.2 -51.4 138.6 36.5 52.8 134.3 603 691 A A - 0 0 74 1,-0.1 308,-0.1 311,-0.0 307,-0.0 -0.117 17.6-114.2 -98.2-172.6 37.3 50.4 131.4 604 692 A S - 0 0 15 306,-0.1 3,-0.3 -2,-0.0 -1,-0.1 0.928 29.3-161.0 -85.8 -59.4 39.3 47.3 130.6 605 693 A F S S- 0 0 169 1,-0.2 -2,-0.0 2,-0.1 305,-0.0 0.998 71.2 -44.7 63.4 70.2 42.0 48.4 128.1 606 694 A W S > S+ 0 0 134 1,-0.2 4,-0.9 4,-0.0 -1,-0.2 0.354 110.4 111.2 66.0 -5.7 43.1 45.1 126.4 607 695 A R H > + 0 0 95 -3,-0.3 4,-2.7 1,-0.2 5,-0.3 0.734 66.6 75.9 -66.6 -19.7 43.3 43.3 129.8 608 696 A I H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.973 96.9 36.5 -53.2 -69.9 40.3 41.4 128.3 609 697 A L H > S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.736 115.2 59.9 -60.9 -24.2 42.1 39.1 125.8 610 698 A K H X S+ 0 0 136 -4,-0.9 4,-1.6 2,-0.2 -1,-0.2 0.965 112.1 35.3 -67.3 -53.5 45.0 38.8 128.2 611 699 A L H X S+ 0 0 46 -4,-2.7 4,-1.8 2,-0.2 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5,-0.1 0.841 99.9 53.7 -79.2 -33.0 41.9 25.2 115.0 622 710 A G H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.961 114.8 39.0 -64.0 -52.7 38.7 27.3 115.4 623 711 A I H X S+ 0 0 53 -4,-0.7 4,-1.3 2,-0.2 -2,-0.2 0.873 115.8 51.2 -68.8 -38.2 40.4 30.5 114.3 624 712 A F H X S+ 0 0 132 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.876 110.0 50.7 -65.5 -35.0 42.5 28.8 111.6 625 713 A C H X S+ 0 0 7 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.806 107.0 54.5 -69.0 -28.7 39.3 27.2 110.3 626 714 A A H X S+ 0 0 0 -4,-1.3 4,-1.3 2,-0.2 -1,-0.2 0.780 107.5 51.7 -72.5 -28.5 37.8 30.7 110.4 627 715 A I H X S+ 0 0 43 -4,-1.3 4,-2.8 2,-0.2 5,-0.3 0.935 109.8 45.8 -72.6 -49.8 40.8 31.7 108.2 628 716 A I H < S+ 0 0 73 -4,-2.4 4,-0.3 1,-0.2 -2,-0.2 0.818 115.7 48.1 -64.6 -28.3 40.3 29.0 105.6 629 717 A N H X S+ 0 0 12 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.825 108.3 56.0 -75.9 -30.5 36.6 29.9 105.6 630 718 A G H >< S+ 0 0 0 -4,-1.3 3,-0.6 1,-0.2 -2,-0.2 0.968 112.6 39.2 -62.8 -54.8 37.6 33.5 105.3 631 719 A G T 3X S+ 0 0 26 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.615 109.2 66.6 -69.8 -12.3 39.5 32.7 102.1 632 720 A L H 3> S+ 0 0 19 -4,-0.3 4,-0.9 -5,-0.3 3,-0.4 0.866 90.5 63.3 -73.8 -38.8 36.7 30.4 101.2 633 721 A Q H XX S+ 0 0 37 -4,-1.8 4,-1.0 -3,-0.6 3,-0.7 0.893 99.6 49.5 -54.2 -48.8 34.2 33.2 100.8 634 722 A P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.794 96.3 71.4 -65.1 -28.6 36.0 35.0 97.9 635 723 A A H 3X S+ 0 0 30 -4,-0.6 4,-3.9 -3,-0.4 5,-0.2 0.879 97.1 51.4 -53.3 -43.5 36.3 31.8 95.8 636 724 A F H S+ 0 0 84 0, 0.0 3,-0.7 0, 0.0 4,-0.3 0.796 102.5 79.5 -51.3 -35.6 30.7 28.3 71.1 653 741 A P T 3 S+ 0 0 86 0, 0.0 -2,-0.2 0, 0.0 0, 0.0 -0.444 99.8 13.2 -73.0 156.5 33.0 25.3 71.6 654 742 A E T 3> S+ 0 0 136 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 0.370 87.0 119.6 68.2 -3.6 33.9 24.1 75.1 655 743 A T H <> S+ 0 0 29 -3,-0.7 4,-2.6 -4,-0.2 5,-0.3 0.901 73.1 52.2 -57.9 -40.1 31.1 26.2 76.7 656 744 A Q H > S+ 0 0 100 -4,-0.3 4,-2.5 2,-0.2 5,-0.2 0.929 111.4 43.7 -63.3 -48.8 29.4 23.1 78.1 657 745 A R H > S+ 0 0 167 2,-0.2 4,-2.9 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20.8 168.5 1061 1149 A N T <5S+ 0 0 36 -4,-1.2 3,-0.4 -3,-0.2 -3,-0.2 0.710 80.6 114.1 59.6 23.3 9.9 19.2 168.6 1062 1150 A I >>< + 0 0 5 -5,-0.9 4,-1.1 -6,-0.2 3,-0.7 0.446 48.2 93.5 -92.7 -4.6 9.8 19.2 164.8 1063 1151 A H H 3> + 0 0 22 -6,-1.2 4,-2.5 1,-0.2 -1,-0.2 0.647 67.1 75.7 -63.5 -17.4 10.0 15.4 165.0 1064 1152 A Q H 3> S+ 0 0 115 -3,-0.4 4,-1.2 2,-0.2 -1,-0.2 0.962 101.6 37.4 -56.6 -55.6 6.1 15.4 164.8 1065 1153 A F H <4 S+ 0 0 85 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.791 115.4 58.5 -65.5 -30.0 6.2 16.1 161.1 1066 1154 A I H < S+ 0 0 13 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.870 99.0 55.4 -69.7 -41.0 9.2 13.8 160.8 1067 1155 A D H < S+ 0 0 103 -4,-2.5 -2,-0.2 5,-0.1 -1,-0.2 0.955 115.7 32.5 -55.5 -54.4 7.6 10.6 162.2 1068 1156 A S S < S+ 0 0 64 -4,-1.2 4,-0.1 -5,-0.2 0, 0.0 -0.124 85.9 64.1 -94.4-170.9 4.8 10.7 159.7 1069 1157 A L S > S- 0 0 109 2,-0.1 3,-0.8 -2,-0.0 6,-0.1 0.449 86.4 -62.5 70.7 152.5 4.3 11.7 156.0 1070 1158 A P T 3 S+ 0 0 91 0, 0.0 5,-0.1 0, 0.0 -2,-0.0 -0.250 116.8 10.1 -69.6 152.6 6.0 10.3 152.9 1071 1159 A D T > S- 0 0 110 3,-0.1 3,-3.2 4,-0.1 4,-0.2 0.219 88.5-159.2 67.5 -13.9 9.8 10.3 152.4 1072 1160 A K G X S+ 0 0 76 -3,-0.8 3,-1.6 1,-0.3 -5,-0.1 -0.201 74.6 5.5 47.8-120.9 10.0 11.5 156.0 1073 1161 A Y G 3 S+ 0 0 6 1,-0.3 -37,-1.4 -7,-0.2 -1,-0.3 0.717 128.9 65.0 -59.4 -24.6 13.4 13.2 156.5 1074 1162 A N G < S+ 0 0 125 -3,-3.2 -1,-0.3 -39,-0.1 2,-0.2 0.412 75.0 124.0 -84.3 2.5 14.0 12.8 152.7 1075 1163 A T < - 0 0 31 -3,-1.6 -40,-2.0 -4,-0.2 -39,-0.2 -0.469 61.2-129.6 -68.5 127.5 11.1 15.2 152.0 1076 1164 A R B -U 1034 0I 159 -2,-0.2 -42,-0.2 -42,-0.2 -1,-0.1 -0.345 23.1-110.3 -71.5 159.3 12.0 18.2 149.9 1077 1165 A V > - 0 0 3 -44,-0.9 6,-0.8 -46,-0.1 5,-0.7 0.577 50.0-121.6 -70.2 -7.9 11.1 21.6 151.0 1078 1166 A G T >5S- 0 0 35 3,-0.2 4,-1.0 4,-0.1 5,-0.1 0.984 71.5 -31.0 67.9 60.7 8.6 21.8 148.1 1079 1167 A D T 45S- 0 0 103 2,-0.1 3,-0.0 1,-0.1 -1,-0.0 0.996 133.2 -23.3 62.7 73.7 9.6 24.8 146.1 1080 1168 A K T 45S- 0 0 140 1,-0.2 -1,-0.1 2,-0.1 -50,-0.1 0.807 118.9 -60.1 67.5 35.5 11.1 27.3 148.6 1081 1169 A G T >45S+ 0 0 7 -4,-0.1 3,-0.5 1,-0.1 -1,-0.2 0.950 80.5 154.4 60.7 53.9 9.3 25.9 151.7 1082 1170 A T T 3<< + 0 0 109 -4,-1.0 -4,-0.1 -5,-0.7 -3,-0.1 0.595 67.9 60.8 -87.1 -10.8 5.8 26.5 150.5 1083 1171 A Q T 3 S+ 0 0 102 -6,-0.8 2,-0.4 -5,-0.1 -1,-0.2 0.434 93.8 72.5 -96.2 -0.9 4.6 23.7 152.8 1084 1172 A L < - 0 0 32 -3,-0.5 2,-0.1 -7,-0.2 -7,-0.0 -0.894 63.9-143.3-123.4 148.9 5.6 25.1 156.2 1085 1173 A S > - 0 0 66 -2,-0.4 4,-2.0 1,-0.0 3,-0.3 -0.374 44.6 -90.0 -92.8 179.0 4.4 27.9 158.4 1086 1174 A G H > S+ 0 0 34 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.887 124.6 56.5 -60.5 -42.7 6.7 30.1 160.4 1087 1175 A G H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.876 108.7 46.5 -56.5 -41.2 6.7 27.9 163.5 1088 1176 A Q H > S+ 0 0 30 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.929 112.6 47.9 -67.5 -48.6 7.9 24.8 161.5 1089 1177 A K H X S+ 0 0 43 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.907 112.8 50.7 -58.2 -44.4 10.7 26.7 159.7 1090 1178 A Q H X S+ 0 0 4 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.888 105.8 54.5 -62.2 -42.6 11.7 28.1 163.1 1091 1179 A R H X S+ 0 0 19 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.918 109.9 48.3 -55.3 -43.2 11.7 24.6 164.6 1092 1180 A I H X S+ 0 0 7 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.892 108.5 53.2 -63.7 -42.4 14.1 23.5 161.8 1093 1181 A A H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.893 107.7 51.6 -59.1 -42.3 16.3 26.6 162.5 1094 1182 A I H X S+ 0 0 4 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.900 107.8 52.2 -59.3 -42.4 16.4 25.6 166.1 1095 1183 A A H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.903 107.4 52.2 -64.3 -35.2 17.5 22.1 165.0 1096 1184 A R H X S+ 0 0 14 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.870 111.2 49.4 -64.0 -36.8 20.2 23.7 162.9 1097 1185 A A H >< S+ 0 0 8 -4,-1.8 3,-0.6 1,-0.2 4,-0.4 0.977 114.4 39.8 -67.5 -56.9 21.3 25.6 166.0 1098 1186 A L H 3< S+ 0 0 18 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.584 102.4 72.2 -76.9 -8.7 21.5 22.7 168.4 1099 1187 A V H 3< S+ 0 0 23 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.930 98.2 48.6 -63.8 -44.5 23.0 20.3 165.8 1100 1188 A R S << S- 0 0 39 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.654 104.2-137.1 -68.5 -16.3 26.3 22.2 166.0 1101 1189 A Q - 0 0 104 -4,-0.4 -3,-0.1 1,-0.1 2,-0.1 0.972 28.7-164.0 52.1 61.7 26.2 22.0 169.8 1102 1190 A P - 0 0 5 0, 0.0 -1,-0.1 0, 0.0 -82,-0.1 -0.461 28.1-147.2 -75.3 146.3 27.3 25.6 170.3 1103 1191 A H S S+ 0 0 63 1,-0.2 31,-1.3 -2,-0.1 2,-0.4 0.547 93.8 53.5 -81.5 -8.4 28.5 26.8 173.7 1104 1192 A I E S- r 01134G 16 29,-0.2 2,-0.3 -134,-0.1 -82,-0.3 -0.982 70.4-169.0-132.1 122.1 26.9 30.0 172.6 1105 1193 A L E - r 01135G 14 29,-2.4 31,-2.0 -2,-0.4 2,-0.4 -0.842 2.9-163.1-109.8 147.3 23.4 30.5 171.4 1106 1194 A L E - r 01136G 0 -84,-0.5 -82,-1.0 -2,-0.3 2,-0.6 -0.978 3.5-172.2-133.0 121.5 21.9 33.7 169.8 1107 1195 A L E -qr10241137G 16 29,-2.8 31,-2.1 -2,-0.4 2,-0.8 -0.929 2.0-171.7-117.5 111.7 18.2 34.4 169.5 1108 1196 A D S S- 0 0 21 -84,-2.8 4,-0.1 -2,-0.6 29,-0.1 -0.865 73.7 -49.3-102.5 103.4 17.1 37.4 167.4 1109 1197 A E S > S+ 0 0 29 -2,-0.8 3,-1.1 1,-0.1 4,-0.4 0.837 78.5 166.4 41.5 48.4 13.3 37.9 167.9 1110 1198 A A T 3 S+ 0 0 1 1,-0.3 3,-0.4 2,-0.1 -1,-0.1 0.894 75.5 37.7 -60.7 -43.8 12.7 34.2 167.2 1111 1199 A T T 3 S+ 0 0 2 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.324 85.6 106.5 -92.0 5.3 9.1 34.3 168.5 1112 1200 A S S < S+ 0 0 53 -3,-1.1 2,-0.7 1,-0.2 -1,-0.2 0.908 83.7 40.7 -51.2 -50.4 8.4 37.8 167.1 1113 1201 A A S S+ 0 0 69 -4,-0.4 2,-0.3 -3,-0.4 -1,-0.2 -0.889 97.1 85.0-104.7 107.2 6.2 36.4 164.3 1114 1202 A L - 0 0 28 -2,-0.7 2,-0.3 -3,-0.1 -3,-0.0 -0.968 48.4-148.1 178.4 174.1 4.0 33.5 165.7 1115 1203 A D >> - 0 0 100 -2,-0.3 4,-1.0 0, 0.0 3,-0.9 -0.977 47.1 -15.9-157.7 164.0 0.8 32.6 167.4 1116 1204 A T H >> S- 0 0 106 -2,-0.3 4,-0.9 1,-0.2 3,-0.8 0.087 120.4 -3.8 43.8-133.2 -1.1 30.2 169.8 1117 1205 A E H 3> S+ 0 0 156 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.779 125.7 69.2 -61.7 -31.1 0.5 26.8 170.6 1118 1206 A S H <> S+ 0 0 23 -3,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.901 97.8 51.8 -55.6 -40.5 3.4 27.5 168.1 1119 1207 A E H S+ 0 0 33 1,-0.2 3,-0.6 2,-0.1 -2,-0.2 0.448 101.2 73.8 -95.2 -3.8 8.8 34.9 178.2 1145 1233 A I T 3 + 0 0 4 1,-0.2 -1,-0.2 -4,-0.2 -2,-0.1 0.585 67.9 95.2 -82.5 -10.6 11.7 37.0 179.5 1146 1234 A Q T 3 S+ 0 0 127 -3,-0.4 2,-0.8 -4,-0.3 -1,-0.2 0.728 77.5 63.0 -57.8 -24.9 10.6 36.4 183.1 1147 1235 A N S < S+ 0 0 70 -3,-0.6 2,-0.3 18,-0.1 -1,-0.2 -0.884 75.4 122.5-100.7 103.2 13.0 33.5 183.2 1148 1236 A A - 0 0 20 -2,-0.8 17,-0.4 1,-0.1 3,-0.2 -0.975 56.2-142.9-156.3 147.8 16.5 34.9 182.7 1149 1237 A D S S+ 0 0 63 -176,-1.1 2,-0.4 1,-0.3 -175,-0.2 0.927 96.1 13.7 -78.0 -46.7 19.7 34.9 184.7 1150 1238 A L B -p 974 0G 43 -177,-1.6 -175,-2.7 14,-0.1 2,-0.5 -0.964 68.8-164.4-134.0 117.1 20.6 38.5 183.8 1151 1239 A I E - T 01163H 0 12,-1.9 12,-2.4 -2,-0.4 2,-0.5 -0.863 11.7-160.9-100.0 133.4 18.2 41.0 182.2 1152 1240 A V E - T 01162H 2 -2,-0.5 -175,-1.5 -177,-0.4 2,-0.8 -0.954 12.3-154.1-122.9 124.5 19.7 44.1 180.7 1153 1241 A V E -sT 9771161H 4 8,-2.5 7,-2.4 -2,-0.5 8,-1.7 -0.860 19.2-167.5 -93.8 110.7 18.1 47.4 179.8 1154 1242 A I E - T 01159H 16 -177,-1.8 2,-0.7 -2,-0.8 -175,-0.4 -0.874 8.6-159.6-101.7 121.9 20.0 49.0 177.0 1155 1243 A Q E > - T 01158H 77 3,-3.2 3,-2.6 -2,-0.5 -177,-0.1 -0.876 64.7 -53.8-105.7 103.3 19.3 52.7 176.1 1156 1244 A N T 3 S- 0 0 94 -2,-0.7 -1,-0.1 1,-0.3 3,-0.1 0.816 120.6 -28.9 37.6 64.0 20.5 53.5 172.6 1157 1245 A G T 3 S+ 0 0 2 -196,-0.2 2,-0.6 1,-0.1 -1,-0.3 0.096 126.4 92.3 89.6 -19.7 24.1 52.3 172.8 1158 1246 A K E < S-T 1155 0H 104 -3,-2.6 -3,-3.2 -194,-0.1 2,-0.4 -0.922 76.5-132.2-112.3 116.4 24.3 53.0 176.5 1159 1247 A V E +T 1154 0H 42 -2,-0.6 -5,-0.3 -196,-0.5 3,-0.1 -0.541 29.7 177.5 -65.0 124.0 23.5 50.2 178.9 1160 1248 A K E + 0 0 141 -7,-2.4 2,-0.3 -2,-0.4 -6,-0.2 0.908 56.1 10.4 -94.0 -64.3 21.1 51.8 181.4 1161 1249 A E E -T 1153 0H 28 -8,-1.7 -8,-2.5 2,-0.0 2,-0.3 -0.859 60.1-175.9-121.1 151.7 20.0 49.1 183.9 1162 1250 A H E +T 1152 0H 124 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.987 29.1 76.3-147.9 143.2 21.1 45.6 184.6 1163 1251 A G E S-T 1151 0H 3 -12,-2.4 -12,-1.9 -2,-0.3 -2,-0.0 -0.880 70.7 -39.2 151.8 178.3 20.0 42.8 186.9 1164 1252 A T > - 0 0 36 -2,-0.3 4,-2.4 -14,-0.2 5,-0.3 -0.237 62.1-101.6 -68.2 161.2 17.5 40.0 187.7 1165 1253 A H H > S+ 0 0 30 -17,-0.4 4,-2.1 1,-0.2 5,-0.2 0.913 120.1 43.5 -53.0 -56.0 13.8 40.4 187.0 1166 1254 A Q H > S+ 0 0 126 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.810 112.9 54.3 -63.2 -32.1 12.7 41.1 190.6 1167 1255 A Q H > S+ 0 0 108 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.934 112.3 40.9 -67.4 -49.5 15.6 43.5 191.2 1168 1256 A L H < S+ 0 0 6 -4,-2.4 -2,-0.2 2,-0.2 8,-0.2 0.818 112.1 57.5 -65.5 -34.0 14.9 45.7 188.2 1169 1257 A L H < S+ 0 0 70 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.851 104.8 50.6 -64.1 -35.7 11.2 45.4 189.1 1170 1258 A A H < S+ 0 0 89 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.841 110.0 64.3 -66.5 -34.8 12.2 46.8 192.4 1171 1259 A Q S < S- 0 0 116 -4,-1.4 2,-0.3 -5,-0.1 -3,-0.0 -0.202 83.2-139.1 -74.9 176.7 14.0 49.5 190.4 1172 1260 A K + 0 0 129 3,-0.0 2,-0.3 4,-0.0 -3,-0.1 -0.998 48.3 73.7-147.1 146.0 12.0 51.9 188.2 1173 1261 A 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