==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-SEP-07 2R7Q . COMPND 2 MOLECULE: RNA-DEPENDENT RNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SIMIAN ROTAVIRUS; . AUTHOR X.LU,S.C.HARRISON,Y.J.TAO,J.T.PATTON,M.L.NIBERT . 1072 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44121.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 768 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 89 8.3 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 . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.7 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 . 60 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 118 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 458 42.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.0 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 3 3 4 0 5 3 3 3 3 2 3 1 1 1 4 2 1 2 1 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 5 1 3 1 3 3 1 1 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 4 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A G > 0 0 58 0, 0.0 4,-0.6 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -18.6 19.2 37.4 71.3 2 3 A K H > + 0 0 163 1,-0.2 4,-2.5 753,-0.2 5,-0.2 0.697 360.0 74.1 -71.9 -20.3 18.2 36.5 74.9 3 4 A Y H > S+ 0 0 5 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.907 92.4 51.0 -62.9 -43.9 18.3 40.1 76.0 4 5 A N H > S+ 0 0 30 -3,-0.4 4,-1.1 1,-0.2 -1,-0.2 0.862 114.1 45.3 -62.7 -36.3 15.1 41.2 74.3 5 6 A L H X S+ 0 0 99 -4,-0.6 4,-1.7 2,-0.2 3,-0.4 0.925 111.1 51.0 -71.0 -45.0 13.2 38.2 75.9 6 7 A I H X S+ 0 0 22 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.872 105.0 60.0 -60.0 -37.4 14.7 38.7 79.4 7 8 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.894 103.9 49.4 -59.4 -40.7 13.6 42.4 79.2 8 9 A S H X S+ 0 0 47 -4,-1.1 4,-2.7 -3,-0.4 5,-0.3 0.906 108.6 51.2 -66.5 -41.9 10.0 41.3 78.8 9 10 A E H X S+ 0 0 73 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.889 111.6 50.3 -61.9 -38.6 10.1 38.9 81.7 10 11 A Y H X S+ 0 0 13 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.936 112.0 44.7 -66.5 -46.2 11.5 41.8 83.8 11 12 A L H X S+ 0 0 1 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.896 114.2 49.1 -65.9 -40.2 8.8 44.3 82.7 12 13 A S H < S+ 0 0 53 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.894 113.1 50.0 -64.2 -38.1 6.0 41.8 83.3 13 14 A F H < S+ 0 0 22 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.891 113.6 43.7 -66.0 -43.8 7.6 41.1 86.7 14 15 A I H < S+ 0 0 10 -4,-2.6 2,-0.4 1,-0.1 -2,-0.2 0.934 117.7 42.0 -69.6 -46.5 7.9 44.8 87.7 15 16 A Y < + 0 0 28 -4,-2.6 -1,-0.1 -5,-0.2 59,-0.0 -0.875 49.5 163.7-110.0 132.5 4.4 45.9 86.5 16 17 A N 0 0 134 -2,-0.4 -1,-0.1 1,-0.1 -4,-0.1 0.248 360.0 360.0-127.3 10.2 1.2 43.9 87.0 17 18 A S 0 0 117 2,-0.0 -1,-0.1 0, 0.0 58,-0.0 0.590 360.0 360.0 -45.9 360.0 -1.4 46.6 86.4 18 ! 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 19 22 A V 0 0 81 0, 0.0 55,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 138.5 0.9 46.8 79.3 20 23 A Q E -A 73 0A 42 53,-0.2 53,-0.2 2,-0.0 -12,-0.0 -0.952 360.0-168.0-118.7 132.6 3.8 46.3 76.8 21 24 A I E -A 72 0A 6 51,-2.0 51,-1.8 -2,-0.4 2,-0.2 -0.829 16.5-145.9-121.2 92.2 3.9 47.5 73.2 22 25 A P E -A 71 0A 19 0, 0.0 2,-0.6 0, 0.0 49,-0.2 -0.356 13.5-152.5 -58.6 121.3 6.7 46.0 71.1 23 26 A I E -A 70 0A 8 47,-2.6 46,-3.2 -2,-0.2 47,-1.5 -0.872 18.7-179.9-101.3 118.5 8.0 48.6 68.6 24 27 A Y E -A 68 0A 36 -2,-0.6 2,-0.3 44,-0.3 44,-0.2 -0.566 9.2-177.6-110.2 176.5 9.5 47.2 65.4 25 28 A Y E -A 67 0A 3 42,-1.3 42,-3.3 -2,-0.2 2,-0.3 -0.963 5.4-161.0-165.0 159.2 11.1 48.6 62.3 26 29 A S - 0 0 4 -2,-0.3 6,-0.1 2,-0.2 40,-0.1 -0.996 30.6-134.8-152.7 146.2 12.5 47.4 59.0 27 30 A S S S+ 0 0 46 -2,-0.3 2,-0.1 4,-0.1 -1,-0.1 0.789 90.5 91.2 -66.8 -25.3 14.8 48.6 56.2 28 31 A N S > S- 0 0 70 1,-0.1 4,-1.2 -3,-0.1 -2,-0.2 -0.432 75.3-144.4 -69.0 143.1 12.1 47.1 53.9 29 32 A S H > S+ 0 0 88 2,-0.2 4,-1.8 3,-0.1 5,-0.2 0.953 94.9 43.7 -77.5 -50.8 9.4 49.7 53.0 30 33 A E H > S+ 0 0 142 1,-0.2 4,-1.5 2,-0.2 3,-0.2 0.926 114.9 50.4 -61.2 -43.1 6.3 47.6 52.9 31 34 A L H > S+ 0 0 18 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.887 106.9 55.3 -62.4 -39.4 7.3 45.8 56.2 32 35 A E H X S+ 0 0 24 -4,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.870 105.2 52.0 -61.8 -39.2 7.9 49.2 57.9 33 36 A N H X S+ 0 0 90 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.846 109.6 50.3 -63.9 -36.0 4.4 50.3 57.0 34 37 A R H X S+ 0 0 73 -4,-1.5 4,-3.0 2,-0.2 -2,-0.2 0.908 108.7 52.1 -66.5 -42.0 3.2 47.1 58.5 35 38 A C H X S+ 0 0 5 -4,-2.6 4,-1.7 1,-0.2 -11,-0.3 0.886 110.2 48.6 -62.3 -38.6 5.3 48.0 61.6 36 39 A I H X S+ 0 0 47 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.895 112.4 48.3 -67.9 -39.1 3.6 51.4 61.7 37 40 A E H X S+ 0 0 90 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.932 110.4 51.1 -65.8 -44.7 0.2 49.8 61.4 38 41 A F H X S+ 0 0 1 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.873 108.3 51.4 -61.3 -41.2 0.9 47.2 64.1 39 42 A H H X S+ 0 0 22 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.920 110.7 49.6 -63.3 -43.1 2.1 49.8 66.6 40 43 A S H X S+ 0 0 63 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.945 111.6 46.0 -62.9 -49.0 -1.0 51.9 66.0 41 44 A K H X S+ 0 0 74 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.850 110.9 55.1 -63.1 -35.7 -3.4 49.0 66.5 42 45 A C H X S+ 0 0 0 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.900 109.5 45.4 -64.3 -42.8 -1.5 48.0 69.6 43 46 A L H X S+ 0 0 73 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.932 114.1 50.0 -66.2 -43.9 -1.8 51.4 71.3 44 47 A E H < S+ 0 0 100 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.903 112.0 46.3 -62.9 -43.7 -5.5 51.5 70.3 45 48 A N H ><>S+ 0 0 37 -4,-2.6 5,-2.5 1,-0.2 3,-1.2 0.909 113.0 49.9 -66.4 -41.7 -6.3 48.1 71.8 46 49 A S H ><5S+ 0 0 33 -4,-2.2 3,-1.9 1,-0.3 2,-0.3 0.923 104.5 57.4 -62.9 -43.5 -4.4 48.8 74.9 47 50 A K T 3<5S+ 0 0 131 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.1 0.064 113.5 43.0 -76.6 30.1 -6.2 52.1 75.4 48 51 A N T < 5S- 0 0 96 -3,-1.2 -1,-0.3 -2,-0.3 -2,-0.2 0.240 113.0-112.3-153.0 3.8 -9.4 50.0 75.4 49 52 A G T < 5 + 0 0 73 -3,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.886 69.0 143.7 59.4 40.9 -8.4 47.1 77.5 50 53 A L < - 0 0 100 -5,-2.5 -1,-0.2 -6,-0.1 -2,-0.2 -0.819 53.9 -99.4-111.2 152.8 -8.5 44.7 74.6 51 54 A S - 0 0 89 -2,-0.3 4,-0.2 1,-0.1 3,-0.1 -0.349 16.3-158.1 -71.7 147.3 -6.2 41.8 73.9 52 55 A L > + 0 0 29 1,-0.1 4,-1.7 2,-0.1 5,-0.2 0.279 69.7 99.1-105.4 7.9 -3.3 42.0 71.6 53 56 A R H > S+ 0 0 165 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.901 84.6 43.8 -62.8 -44.4 -3.1 38.3 71.0 54 57 A K H > S+ 0 0 148 1,-0.2 4,-2.8 2,-0.2 3,-0.3 0.893 110.7 57.0 -67.5 -38.9 -4.9 38.3 67.7 55 58 A L H > S+ 0 0 13 1,-0.2 4,-1.0 -4,-0.2 -1,-0.2 0.847 102.3 54.3 -61.4 -37.6 -2.9 41.3 66.5 56 59 A F H < S+ 0 0 68 -4,-1.7 -1,-0.2 2,-0.2 7,-0.2 0.819 111.6 45.2 -66.0 -34.9 0.4 39.5 67.1 57 60 A V H >< S+ 0 0 100 -4,-1.0 3,-1.5 -3,-0.3 -2,-0.2 0.909 110.5 54.4 -71.3 -43.1 -0.9 36.7 64.8 58 61 A E H 3< S+ 0 0 91 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.686 118.8 35.2 -63.2 -20.5 -2.2 39.2 62.3 59 62 A Y T 3X S+ 0 0 1 -4,-1.0 4,-1.9 -5,-0.2 3,-0.4 -0.196 72.5 131.8-128.9 40.8 1.3 40.7 62.2 60 63 A N H <> S+ 0 0 76 -3,-1.5 4,-3.4 1,-0.2 5,-0.3 0.861 71.6 63.0 -59.8 -34.7 3.4 37.6 62.6 61 64 A D H >>S+ 0 0 41 1,-0.2 4,-2.8 -4,-0.2 5,-0.6 0.918 103.8 45.3 -58.7 -45.1 5.4 38.9 59.6 62 65 A V H >5S+ 0 0 0 -3,-0.4 4,-1.1 3,-0.2 -1,-0.2 0.889 115.2 48.2 -66.6 -38.6 6.5 42.0 61.6 63 66 A I H <5S+ 0 0 49 -4,-1.9 -2,-0.2 -7,-0.2 -1,-0.2 0.928 119.0 38.8 -66.5 -46.1 7.3 39.9 64.6 64 67 A E H <5S+ 0 0 139 -4,-3.4 -2,-0.2 -5,-0.1 -3,-0.2 0.853 132.2 18.9 -72.4 -39.3 9.3 37.3 62.6 65 68 A N H <5S+ 0 0 102 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.749 102.5 81.2-109.4 -29.3 11.1 39.5 60.1 66 69 A A S < S+ 0 0 89 1,-0.1 3,-0.9 -65,-0.1 4,-0.1 0.608 81.4 123.8 65.9 10.7 6.9 52.0 91.9 80 83 A N T >> + 0 0 58 1,-0.2 3,-1.2 2,-0.1 4,-1.1 0.326 37.1 106.2 -81.0 7.0 6.5 51.5 95.7 81 84 A A H 3> + 0 0 7 1,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.745 65.0 68.4 -58.2 -25.3 6.2 47.8 94.7 82 85 A V H <> S+ 0 0 2 -3,-0.9 4,-1.8 2,-0.2 -1,-0.3 0.881 96.2 52.9 -62.9 -38.7 9.8 47.4 96.1 83 86 A E H <> S+ 0 0 79 -3,-1.2 4,-0.8 1,-0.2 -1,-0.2 0.953 115.1 41.0 -62.0 -47.2 8.4 47.9 99.6 84 87 A R H >< S+ 0 0 149 -4,-1.1 3,-0.7 1,-0.2 4,-0.5 0.926 113.8 50.2 -67.8 -46.4 5.8 45.2 99.0 85 88 A K H >< S+ 0 0 24 -4,-3.1 3,-0.8 1,-0.2 4,-0.3 0.828 103.8 60.9 -62.0 -37.4 8.0 42.7 97.2 86 89 A L H >X S+ 0 0 2 -4,-1.8 3,-1.5 -5,-0.2 4,-0.6 0.782 86.9 71.7 -62.7 -33.4 10.7 42.8 99.8 87 90 A V G X< S+ 0 0 69 -4,-0.8 3,-0.9 -3,-0.7 -1,-0.2 0.818 85.2 67.2 -56.9 -33.5 8.7 41.6 102.8 88 91 A K G <4 S+ 0 0 129 -3,-0.8 -1,-0.3 -4,-0.5 3,-0.3 0.814 111.5 35.2 -56.8 -32.7 8.5 38.0 101.4 89 92 A Y G <4 S+ 0 0 36 -3,-1.5 83,-0.3 -4,-0.3 -1,-0.3 0.429 94.1 86.2-101.3 -3.1 12.3 37.8 102.1 90 93 A A << + 0 0 16 -3,-0.9 2,-1.1 -4,-0.6 -1,-0.2 0.319 53.7 114.6 -80.8 11.1 12.4 39.9 105.2 91 94 A K + 0 0 164 -3,-0.3 2,-0.2 -4,-0.2 -1,-0.2 0.018 59.8 89.1 -71.4 32.0 11.6 36.8 107.2 92 95 A G S S- 0 0 29 -2,-1.1 77,-0.0 76,-0.3 -3,-0.0 -0.768 89.0 -88.2-126.2 173.1 15.1 36.9 108.8 93 96 A K - 0 0 188 -2,-0.2 80,-0.2 1,-0.1 79,-0.1 -0.721 48.4-119.5 -84.9 114.7 16.8 38.5 111.8 94 97 A P - 0 0 49 0, 0.0 2,-0.2 0, 0.0 79,-0.1 -0.101 31.8-105.4 -49.9 147.0 18.0 42.0 111.0 95 98 A L - 0 0 31 74,-0.3 2,-0.6 75,-0.1 133,-0.0 -0.514 27.6-139.6 -76.2 145.6 21.7 42.5 111.4 96 99 A E - 0 0 132 -2,-0.2 2,-0.3 -3,-0.1 136,-0.1 -0.917 15.9-129.8-113.2 111.5 22.9 44.5 114.5 97 100 A A - 0 0 14 -2,-0.6 2,-1.4 12,-0.2 135,-0.1 -0.386 11.5-142.6 -61.9 119.2 25.7 46.9 113.8 98 101 A D > - 0 0 83 -2,-0.3 2,-2.5 1,-0.1 3,-1.6 -0.692 11.2-161.2 -84.0 92.9 28.5 46.4 116.4 99 102 A L T 3 S+ 0 0 79 -2,-1.4 -1,-0.1 1,-0.2 9,-0.1 -0.083 76.8 71.1 -70.9 45.7 29.5 50.1 116.8 100 103 A T T 3 S+ 0 0 116 -2,-2.5 -1,-0.2 132,-0.0 133,-0.0 0.456 71.4 81.2-133.4 -13.1 32.8 49.0 118.3 101 104 A V S < S+ 0 0 55 -3,-1.6 2,-0.3 131,-0.1 -2,-0.1 0.776 81.0 69.9 -71.6 -28.7 34.8 47.7 115.4 102 105 A N - 0 0 11 130,-0.2 6,-0.1 1,-0.1 131,-0.0 -0.741 65.4-147.3-100.0 141.1 36.0 51.0 113.9 103 106 A E S S+ 0 0 183 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.999 89.3 59.1 -61.6 -69.3 38.6 53.4 115.3 104 107 A L S > S- 0 0 44 1,-0.2 3,-2.7 2,-0.1 4,-0.3 -0.508 87.6-134.7 -67.1 119.5 37.0 56.6 114.0 105 108 A D G > S+ 0 0 86 -2,-0.4 3,-1.6 1,-0.3 5,-0.3 0.788 101.7 57.6 -43.1 -42.4 33.5 56.8 115.4 106 109 A Y G 3 S+ 0 0 6 1,-0.3 -1,-0.3 3,-0.1 4,-0.1 0.645 93.7 67.4 -70.6 -12.6 31.9 57.8 112.1 107 110 A E G < S+ 0 0 3 -3,-2.7 2,-0.3 2,-0.1 127,-0.3 0.514 83.9 92.9 -82.4 -4.4 33.2 54.7 110.4 108 111 A N S < S- 0 0 5 -3,-1.6 2,-3.7 -4,-0.3 90,-0.1 -0.716 93.7-111.9 -90.9 140.4 30.9 52.7 112.7 109 112 A N + 0 0 3 123,-0.4 -12,-0.2 -2,-0.3 -10,-0.1 -0.141 62.7 155.3 -67.3 52.8 27.4 51.9 111.2 110 113 A K - 0 0 61 -2,-3.7 88,-1.7 -5,-0.3 2,-0.4 0.043 55.8 -73.2 -67.7-176.0 25.8 54.2 113.8 111 114 A M B >> -D 197 0B 57 86,-0.2 3,-1.1 1,-0.1 4,-0.9 -0.687 42.6-122.0 -82.8 135.9 22.4 55.8 113.2 112 115 A T H >> S+ 0 0 0 84,-2.2 4,-2.1 81,-0.5 3,-1.2 0.860 113.7 51.8 -44.2 -44.5 22.6 58.6 110.7 113 116 A S H 34 S+ 0 0 27 81,-1.4 -1,-0.3 1,-0.3 82,-0.1 0.840 100.7 61.6 -62.7 -36.3 21.2 61.1 113.2 114 117 A E H <4 S+ 0 0 144 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.664 114.5 35.7 -64.7 -17.6 23.8 60.0 115.8 115 118 A L H << S+ 0 0 28 -3,-1.2 -2,-0.2 -4,-0.9 -1,-0.2 0.680 135.1 24.7-104.6 -29.2 26.5 61.2 113.4 116 119 A F < + 0 0 16 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 -0.703 64.3 179.7-139.3 81.3 24.5 64.2 112.1 117 120 A P S S+ 0 0 94 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.570 72.6 47.5 -59.3 -10.0 21.8 65.3 114.7 118 121 A T S >> S- 0 0 65 -5,-0.1 3,-1.6 1,-0.1 4,-1.1 -0.985 80.3-126.5-138.4 149.3 20.8 68.0 112.2 119 122 A A T 34 S+ 0 0 51 -2,-0.3 71,-0.1 1,-0.3 72,-0.1 0.607 110.9 60.8 -64.8 -12.1 19.9 68.3 108.5 120 123 A E T 34 S+ 0 0 135 1,-0.1 -1,-0.3 70,-0.0 -4,-0.0 0.620 107.4 41.8 -91.4 -14.4 22.5 71.0 108.3 121 124 A E T <4 S+ 0 0 84 -3,-1.6 -2,-0.2 -5,-0.1 -1,-0.1 0.564 90.8 112.7-105.3 -12.2 25.4 68.8 109.4 122 125 A Y < + 0 0 36 -4,-1.1 2,-0.2 -6,-0.1 68,-0.1 -0.162 37.2 168.2 -59.5 153.7 24.3 65.8 107.3 123 126 A T > - 0 0 51 66,-0.1 3,-0.6 67,-0.0 66,-0.1 -0.810 36.4-154.0-170.8 125.1 26.5 64.7 104.4 124 127 A D G >> + 0 0 21 -2,-0.2 4,-3.1 1,-0.2 3,-2.5 0.415 68.1 115.0 -82.2 4.5 26.5 61.6 102.2 125 128 A S G 34 S+ 0 0 54 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.607 78.1 45.0 -49.0 -12.2 30.2 62.3 101.6 126 129 A L G <4 S+ 0 0 8 -3,-0.6 207,-0.4 209,-0.0 -1,-0.3 0.444 128.7 18.4-115.5 0.6 31.0 59.1 103.5 127 130 A M T <4 S+ 0 0 3 -3,-2.5 -2,-0.2 205,-0.1 -3,-0.1 0.392 78.1 140.8-145.9 -6.6 28.6 56.6 102.0 128 131 A D < - 0 0 14 -4,-3.1 557,-0.1 1,-0.2 59,-0.1 -0.179 42.6-152.3 -47.3 117.2 27.4 58.2 98.7 129 132 A P - 0 0 3 0, 0.0 556,-3.3 0, 0.0 -1,-0.2 0.759 18.8-155.6 -65.6 -22.6 27.2 55.3 96.2 130 133 A A + 0 0 2 1,-0.2 2,-0.4 56,-0.2 559,-0.3 0.739 48.5 124.0 53.6 27.8 27.9 58.1 93.6 131 134 A I - 0 0 6 55,-0.3 2,-1.0 2,-0.2 -1,-0.2 -0.921 69.9-126.5-122.0 145.9 26.2 56.0 90.9 132 135 A L S S+ 0 0 31 -2,-0.4 2,-0.3 560,-0.1 54,-0.1 -0.143 86.4 78.5 -82.0 42.6 23.3 56.8 88.6 133 136 A T S S- 0 0 5 -2,-1.0 2,-0.2 53,-0.2 -2,-0.2 -0.978 77.5-116.9-143.7 151.4 21.3 53.7 89.6 134 137 A S > - 0 0 3 -2,-0.3 4,-2.1 1,-0.1 3,-0.2 -0.643 10.8-133.1-101.7 153.7 19.2 53.2 92.7 135 138 A L H > S+ 0 0 0 1,-0.3 4,-1.9 -2,-0.2 5,-0.2 0.811 114.0 59.4 -61.9 -32.7 19.3 50.7 95.7 136 139 A S H > S+ 0 0 22 44,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.906 105.1 48.6 -62.4 -41.0 15.6 50.3 95.0 137 140 A S H > S+ 0 0 27 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.912 108.0 53.5 -65.3 -43.2 16.5 49.1 91.5 138 141 A N H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.879 109.2 49.0 -60.6 -39.8 19.2 46.7 92.7 139 142 A L H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.959 111.2 49.4 -66.1 -46.0 16.6 45.1 95.1 140 143 A N H X S+ 0 0 17 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.912 111.0 50.6 -58.8 -42.3 14.1 44.8 92.2 141 144 A A H X S+ 0 0 1 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.912 110.8 48.3 -62.5 -43.4 16.8 43.2 90.0 142 145 A V H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.889 112.4 47.0 -65.7 -42.0 17.7 40.7 92.7 143 146 A M H X S+ 0 0 4 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.868 108.3 57.0 -67.4 -36.0 14.2 39.6 93.4 144 147 A F H X S+ 0 0 0 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.902 109.5 45.1 -60.9 -43.2 13.5 39.3 89.7 145 148 A W H X S+ 0 0 4 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.881 109.4 55.9 -68.3 -38.1 16.3 36.9 89.4 146 149 A L H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.906 108.5 47.7 -61.1 -41.6 15.2 35.0 92.5 147 150 A E H >< S+ 0 0 78 -4,-2.3 3,-1.4 1,-0.2 4,-0.4 0.921 111.4 50.6 -65.4 -44.1 11.8 34.4 91.0 148 151 A K H 3< S+ 0 0 65 -4,-1.9 3,-0.3 1,-0.3 -2,-0.2 0.884 115.2 41.3 -63.4 -39.9 13.2 33.3 87.7 149 152 A H T 3< S+ 0 0 15 -4,-2.5 3,-0.3 1,-0.2 -1,-0.3 0.036 85.8 105.1 -99.1 29.7 15.5 30.8 89.2 150 153 A E S < S+ 0 0 104 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.1 0.936 85.0 37.0 -71.7 -50.7 13.0 29.6 91.7 151 154 A N S S+ 0 0 145 -4,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.266 88.3 132.2 -87.7 12.1 12.1 26.2 90.1 152 155 A D - 0 0 34 -3,-0.3 2,-0.2 4,-0.1 -3,-0.0 -0.122 43.9-145.4 -57.9 164.7 15.7 25.6 88.9 153 156 A V >> - 0 0 101 4,-0.0 4,-1.2 5,-0.0 3,-1.1 -0.785 45.4 -2.3-130.2 174.3 17.1 22.2 89.6 154 157 A A H 3> S- 0 0 73 1,-0.3 4,-1.4 -2,-0.2 3,-0.5 -0.097 127.1 -8.0 47.1-134.9 20.3 20.4 90.6 155 158 A E H 3> S+ 0 0 95 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.823 134.3 60.6 -61.1 -33.9 23.4 22.6 90.8 156 159 A K H <> S+ 0 0 116 -3,-1.1 4,-1.9 1,-0.2 -1,-0.2 0.910 103.5 52.5 -61.3 -39.4 21.5 25.6 89.5 157 160 A L H X S+ 0 0 50 -4,-1.2 4,-3.0 -3,-0.5 -1,-0.2 0.892 104.3 54.5 -63.6 -40.2 19.1 25.3 92.4 158 161 A K H X S+ 0 0 111 -4,-1.4 4,-3.0 2,-0.2 -1,-0.2 0.875 106.6 52.1 -61.7 -37.2 22.0 25.2 95.0 159 162 A V H X S+ 0 0 16 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.914 112.1 46.2 -63.8 -41.9 23.2 28.5 93.4 160 163 A Y H X S+ 0 0 15 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.898 112.2 51.8 -64.9 -41.3 19.7 29.8 93.9 161 164 A K H X S+ 0 0 115 -4,-3.0 4,-1.9 2,-0.2 -2,-0.2 0.917 109.5 47.6 -62.6 -45.9 19.7 28.4 97.5 162 165 A R H X S+ 0 0 34 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.885 116.4 45.7 -64.3 -38.8 22.9 30.1 98.5 163 166 A R H X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 -2,-0.2 0.868 107.9 55.2 -70.9 -39.1 21.7 33.4 97.0 164 167 A L H X S+ 0 0 45 -4,-2.9 4,-1.2 2,-0.2 -2,-0.2 0.885 108.4 50.1 -61.8 -39.9 18.3 33.2 98.6 165 168 A D H >X S+ 0 0 68 -4,-1.9 3,-1.0 -5,-0.2 4,-0.9 0.990 113.1 44.8 -60.7 -60.3 19.8 32.8 102.0 166 169 A L H >X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.3 3,-1.0 0.875 108.4 55.5 -52.6 -46.6 22.1 35.8 101.5 167 170 A F H 3X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.3 -1,-0.3 0.826 98.9 64.5 -60.3 -27.8 19.5 38.1 100.1 168 171 A T H X S+ 0 0 0 -4,-2.6 4,-1.8 -5,-0.2 3,-0.9 0.892 108.2 56.1 -68.5 -39.7 16.7 46.7 105.1 175 178 A N H 3< S+ 0 0 67 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.854 94.0 68.6 -62.2 -36.1 13.1 45.9 106.0 176 179 A K H 3< S+ 0 0 94 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.836 119.5 19.8 -51.1 -36.4 13.7 46.9 109.6 177 180 A Y H << S- 0 0 41 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.500 115.7-115.2-111.3 -10.6 14.1 50.5 108.6 178 181 A G < - 0 0 22 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.1 -0.303 45.2 -55.0 97.0 174.1 12.4 50.4 105.2 179 182 A V - 0 0 10 -2,-0.1 2,-0.1 -4,-0.1 -96,-0.1 -0.829 58.1-117.6 -96.1 115.4 13.9 51.0 101.8 180 183 A P - 0 0 1 0, 0.0 2,-0.4 0, 0.0 -44,-0.2 -0.248 27.5-136.4 -50.7 114.1 15.8 54.3 101.5 181 184 A R - 0 0 172 -2,-0.1 8,-0.4 -46,-0.1 2,-0.2 -0.629 18.4-148.3 -81.3 129.9 14.0 56.4 98.8 182 185 A H - 0 0 44 -2,-0.4 6,-0.2 6,-0.1 2,-0.1 -0.585 7.6-127.9 -94.3 156.3 16.4 58.2 96.5 183 186 A N > - 0 0 38 4,-1.7 3,-2.0 -2,-0.2 -1,-0.1 -0.286 40.3 -83.7 -93.4-175.9 15.9 61.5 94.8 184 187 A A T 3 S+ 0 0 93 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.858 129.8 54.0 -55.4 -40.2 16.3 62.4 91.1 185 188 A K T 3 S- 0 0 143 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.292 116.2-115.7 -80.2 13.1 20.0 62.8 91.4 186 189 A Y S < S+ 0 0 43 -3,-2.0 2,-0.4 1,-0.2 -55,-0.3 0.784 73.2 139.2 57.1 26.6 20.2 59.3 92.8 187 190 A R - 0 0 86 -57,-0.1 -4,-1.7 -58,-0.1 2,-0.6 -0.847 52.6-132.3-103.2 139.2 21.4 61.0 96.0 188 191 A Y - 0 0 2 -2,-0.4 -6,-0.1 -6,-0.2 -64,-0.1 -0.813 26.9-153.4 -94.9 122.1 20.2 59.9 99.4 189 192 A E > - 0 0 89 -2,-0.6 4,-2.2 -8,-0.4 5,-0.2 -0.272 26.0-102.6 -90.0 175.1 19.1 62.8 101.7 190 193 A Y H > S+ 0 0 21 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.826 112.9 59.1 -66.6 -35.4 18.9 63.3 105.4 191 194 A D H > S+ 0 0 99 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.946 114.7 35.0 -62.8 -47.2 15.2 62.8 105.8 192 195 A V H 4 S+ 0 0 21 -11,-0.2 3,-0.4 1,-0.2 -2,-0.2 0.925 125.9 42.2 -70.4 -44.9 15.3 59.3 104.4 193 196 A M H >< S+ 0 0 0 -4,-2.2 3,-2.4 1,-0.2 -81,-0.5 0.808 95.0 76.7 -70.9 -34.2 18.7 58.5 105.9 194 197 A K H 3< S+ 0 0 88 -4,-3.3 -81,-1.4 1,-0.3 -80,-0.2 0.779 97.9 45.0 -52.4 -37.9 18.3 60.0 109.5 195 198 A D T 3< S+ 0 0 88 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.1 0.311 112.5 64.7 -90.8 9.8 16.1 57.2 110.9 196 199 A K S < S- 0 0 15 -3,-2.4 -84,-2.2 2,-0.0 -83,-0.2 -0.882 99.5 -78.0-131.5 161.0 18.4 54.5 109.3 197 200 A P B > -D 111 0B 1 0, 0.0 3,-2.3 0, 0.0 4,-0.4 -0.356 43.2-130.2 -58.0 129.8 22.0 53.3 109.7 198 201 A Y T 3 S+ 0 0 0 -88,-1.7 3,-0.5 1,-0.3 4,-0.3 0.912 105.8 42.3 -45.8 -56.2 24.2 55.7 107.8 199 202 A Y T 3> S+ 0 0 9 -89,-0.3 4,-1.8 1,-0.2 -1,-0.3 0.176 85.3 107.6 -80.8 19.5 26.1 53.0 105.8 200 203 A L H <> S+ 0 0 0 -3,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.971 79.0 41.8 -62.4 -55.1 22.9 51.1 105.1 201 204 A V H > S+ 0 0 0 -3,-0.5 4,-2.1 -4,-0.4 -1,-0.2 0.931 116.2 46.2 -60.2 -49.8 22.5 51.9 101.5 202 205 A T H > S+ 0 0 9 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.890 113.2 51.7 -62.7 -38.3 26.2 51.5 100.4 203 206 A W H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.871 106.4 53.7 -63.7 -40.5 26.3 48.3 102.4 204 207 A A H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.937 109.1 49.5 -62.5 -42.5 23.3 47.0 100.6 205 208 A N H X S+ 0 0 2 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.948 111.8 46.7 -62.8 -47.0 24.9 47.7 97.2 206 209 A S H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.895 116.5 45.4 -62.3 -40.4 28.1 45.9 98.1 207 210 A S H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.895 113.3 47.9 -68.6 -43.5 26.3 42.9 99.5 208 211 A I H X S+ 0 0 0 -4,-3.0 4,-1.7 -5,-0.2 -2,-0.2 0.902 111.8 52.3 -63.6 -41.1 23.8 42.6 96.6 209 212 A E H < S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.871 112.7 44.5 -62.8 -40.2 26.8 42.9 94.3 210 213 A M H >< S+ 0 0 0 -4,-1.7 3,-1.4 -5,-0.2 -2,-0.2 0.908 111.3 50.9 -72.1 -43.2 28.6 40.1 96.0 211 214 A L H >< S+ 0 0 0 -4,-2.6 3,-1.3 1,-0.3 -2,-0.2 0.796 104.2 57.3 -67.2 -30.0 25.7 37.7 96.4 212 215 A M T 3< S+ 0 0 0 -4,-1.7 503,-2.8 1,-0.3 -1,-0.3 0.312 105.6 54.5 -82.4 10.8 24.8 38.0 92.7 213 216 A S T < S+ 0 0 3 -3,-1.4 2,-0.5 501,-0.3 500,-0.3 0.170 85.3 111.0-122.3 9.0 28.3 36.8 92.0 214 217 A V < + 0 0 0 -3,-1.3 -51,-0.1 1,-0.2 3,-0.1 -0.758 23.2 137.0 -93.9 130.7 28.0 33.7 94.2 215 218 A F + 0 0 55 -2,-0.5 -53,-0.2 1,-0.3 -1,-0.2 0.489 56.1 50.8-129.3 -73.1 28.0 30.3 92.5 216 219 A S S > S- 0 0 41 1,-0.1 4,-1.8 -54,-0.0 -1,-0.3 -0.097 89.5-104.4 -68.4 169.3 30.0 27.7 94.3 217 220 A H H > S+ 0 0 102 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.870 122.5 57.1 -62.9 -36.9 29.7 26.9 98.0 218 221 A D H > S+ 0 0 59 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.858 103.0 53.4 -63.0 -36.6 33.0 28.7 98.5 219 222 A D H > S+ 0 0 9 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.943 109.0 49.9 -63.5 -43.5 31.5 31.8 97.0 220 223 A Y H X S+ 0 0 34 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.877 110.2 49.3 -61.6 -42.2 28.6 31.6 99.4 221 224 A L H X S+ 0 0 31 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.930 115.9 42.8 -63.9 -45.3 30.9 31.2 102.4 222 225 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.917 115.3 48.1 -68.1 -44.5 33.0 34.2 101.4 223 226 A A H X S+ 0 0 0 -4,-3.3 4,-3.0 -5,-0.2 5,-0.2 0.887 111.4 51.8 -64.4 -38.6 30.1 36.3 100.5 224 227 A K H X S+ 0 0 65 -4,-2.3 4,-2.0 -5,-0.3 5,-0.2 0.934 112.3 43.7 -64.3 -46.9 28.3 35.5 103.7 225 228 A E H X S+ 0 0 19 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.950 118.5 44.5 -65.2 -45.2 31.2 36.4 106.0 226 229 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.907 112.6 50.8 -65.6 -44.7 31.9 39.6 104.0 227 230 A I H X S+ 0 0 0 -4,-3.0 4,-0.5 -5,-0.2 -1,-0.2 0.872 116.8 41.4 -61.7 -40.9 28.3 40.7 103.8 228 231 A V H < S+ 0 0 49 -4,-2.0 3,-0.4 -5,-0.2 4,-0.3 0.910 118.3 42.1 -74.6 -45.3 27.8 40.2 107.5 229 232 A L H >X S+ 0 0 33 -4,-2.8 4,-3.0 -5,-0.2 3,-1.9 0.889 107.0 62.3 -68.8 -37.9 31.1 41.7 108.8 230 233 A S H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.746 88.4 72.7 -58.5 -28.8 31.0 44.6 106.4 231 234 A Y T 3< S+ 0 0 2 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.2 0.779 118.1 16.1 -58.6 -30.3 27.8 45.8 108.0 232 235 A S T <4 S+ 0 0 13 -3,-1.9 2,-0.7 -4,-0.3 -123,-0.4 0.663 118.0 68.7-114.0 -30.9 29.9 46.9 111.1 233 236 A N < + 0 0 7 -4,-3.0 -1,-0.2 1,-0.1 -125,-0.1 -0.846 47.2 158.1 -95.9 114.6 33.5 46.9 109.8 234 237 A R S S+ 0 0 29 -2,-0.7 99,-0.1 -127,-0.3 -1,-0.1 0.003 70.8 37.9-122.3 27.5 34.0 49.8 107.4 235 238 A S S S+ 0 0 9 97,-0.1 4,-0.1 -134,-0.0 97,-0.1 0.515 118.2 23.9-153.4 -13.2 37.7 50.2 107.6 236 239 A T S > S+ 0 0 48 3,-0.1 4,-3.0 2,-0.1 5,-0.2 0.477 86.8 93.4-139.0 -1.9 39.8 47.1 108.0 237 240 A L H > S+ 0 0 4 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.967 93.8 42.1 -59.9 -51.5 37.9 44.2 106.6 238 241 A A H > S+ 0 0 5 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.894 116.3 48.5 -63.4 -42.2 39.5 44.4 103.1 239 242 A K H > S+ 0 0 120 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.935 113.2 48.4 -63.6 -42.8 42.9 45.0 104.5 240 243 A L H < S+ 0 0 30 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.883 113.7 45.5 -64.1 -42.6 42.6 42.1 106.9 241 244 A V H < S+ 0 0 5 -4,-2.5 4,-0.3 -5,-0.2 -1,-0.2 0.822 117.9 43.8 -69.1 -35.6 41.3 39.7 104.3 242 245 A S H >X S+ 0 0 14 -4,-2.1 3,-0.8 -5,-0.3 4,-0.6 0.730 91.1 81.5 -86.2 -21.9 44.0 40.7 101.7 243 246 A S H >X S+ 0 0 35 -4,-1.9 3,-0.9 1,-0.2 4,-0.5 0.825 84.2 60.6 -54.7 -36.6 47.1 40.8 103.9 244 247 A P H >> S+ 0 0 1 0, 0.0 4,-2.3 0, 0.0 3,-1.5 0.872 90.5 69.3 -60.8 -36.1 47.8 37.1 103.8 245 248 A M H <> S+ 0 0 3 -3,-0.8 4,-1.6 -4,-0.3 5,-0.2 0.802 87.7 64.7 -55.0 -33.2 48.2 37.0 100.1 246 249 A S H << S+ 0 0 6 -3,-0.9 4,-0.4 -4,-0.6 -1,-0.3 0.876 112.5 35.1 -60.0 -38.6 51.5 38.9 100.3 247 250 A I H XX S+ 0 0 1 -3,-1.5 3,-1.2 -4,-0.5 4,-0.7 0.876 108.6 64.7 -79.9 -38.4 53.0 36.0 102.1 248 251 A L H >X S+ 0 0 3 -4,-2.3 4,-1.3 1,-0.3 3,-1.1 0.813 92.8 62.5 -55.8 -34.5 51.2 33.1 100.4 249 252 A V H 3< S+ 0 0 0 -4,-1.6 422,-0.5 1,-0.3 -1,-0.3 0.886 99.0 56.2 -60.7 -36.9 52.8 33.9 97.0 250 253 A A H <4 S+ 0 0 4 -3,-1.2 409,-0.3 -4,-0.4 -1,-0.3 0.717 104.3 57.5 -64.1 -25.9 56.2 33.1 98.6 251 254 A L H << S+ 0 0 1 -3,-1.1 24,-0.2 -4,-0.7 -2,-0.2 0.934 80.1 88.0 -74.7 -51.5 54.9 29.7 99.6 252 255 A V S < S- 0 0 2 -4,-1.3 419,-0.6 60,-0.1 420,-0.2 -0.307 74.7-125.8 -59.7 127.3 53.8 27.9 96.4 253 256 A D - 0 0 45 58,-0.5 2,-0.6 418,-0.1 21,-0.2 -0.291 20.5-118.0 -68.4 153.1 56.5 25.9 94.5 254 257 A I E +E 273 0C 0 19,-2.5 19,-1.8 418,-0.1 2,-0.5 -0.856 32.9 173.1 -99.1 116.4 57.2 26.6 90.8 255 258 A N E S-E 272 0C 112 -2,-0.6 17,-0.2 1,-0.4 16,-0.1 -0.725 70.5 -24.7-120.9 79.3 56.6 23.7 88.5 256 259 A G E S- 0 0 4 15,-2.8 -1,-0.4 -2,-0.5 2,-0.3 0.577 74.9-179.7 85.4 121.7 57.0 25.1 85.0 257 260 A T E -E 269 0C 0 12,-2.6 12,-2.4 -3,-0.1 2,-0.4 -0.943 28.9-103.1-148.2 166.8 56.5 28.7 84.3 258 261 A F E +E 268 0C 12 414,-0.6 10,-0.2 -2,-0.3 2,-0.2 -0.761 39.2 179.5 -96.4 141.3 56.6 31.2 81.4 259 262 A I E -E 267 0C 14 8,-2.5 8,-1.9 -2,-0.4 2,-0.4 -0.673 30.5 -97.6-127.9-175.9 59.5 33.6 81.1 260 263 A T E -E 266 0C 9 231,-1.0 6,-0.2 -2,-0.2 2,-0.1 -0.915 35.1-161.2-110.1 132.6 60.8 36.4 78.8 261 264 A N > - 0 0 25 4,-1.4 3,-2.5 -2,-0.4 4,-0.2 -0.437 43.9 -80.6-102.5-179.6 63.3 35.6 76.0 262 265 A E T 3 S+ 0 0 182 1,-0.3 -2,-0.0 -2,-0.1 -1,-0.0 0.658 130.8 57.2 -56.5 -16.9 65.6 37.9 74.0 263 266 A E T 3 S- 0 0 135 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.157 114.6-118.3 -98.7 14.9 62.6 38.9 71.9 264 267 A L S < S+ 0 0 49 -3,-2.5 2,-0.3 1,-0.2 -2,-0.1 0.888 73.4 126.7 46.8 49.2 60.7 40.0 74.9 265 268 A E - 0 0 103 -4,-0.2 -4,-1.4 639,-0.1 -1,-0.2 -0.964 67.9 -93.8-132.6 150.1 58.0 37.4 74.4 266 269 A L E +E 260 0C 27 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.355 44.4 177.0 -65.4 141.1 56.6 34.8 76.7 267 270 A E E -E 259 0C 89 -8,-1.9 -8,-2.5 -2,-0.1 -10,-0.1 -0.960 29.8-114.6-149.5 125.8 58.2 31.4 76.4 268 271 A F E -E 258 0C 76 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.304 28.6-173.3 -62.5 140.0 57.4 28.2 78.4 269 272 A S E -E 257 0C 25 -12,-2.4 -12,-2.6 2,-0.1 -2,-0.0 -0.994 21.6-150.6-136.6 124.4 60.2 26.9 80.7 270 273 A N E + 0 0 136 -2,-0.4 -14,-0.1 -14,-0.2 -12,-0.1 0.396 50.7 142.2 -77.4 5.7 59.8 23.6 82.5 271 274 A K E - 0 0 39 -14,-0.2 -15,-2.8 -16,-0.1 2,-0.4 0.055 41.8-145.2 -46.1 154.8 62.1 24.9 85.3 272 275 A Y E -E 255 0C 105 -17,-0.2 2,-0.5 -16,-0.1 -17,-0.2 -0.994 12.0-169.4-127.6 128.7 61.3 24.0 88.9 273 276 A V E -E 254 0C 0 -19,-1.8 -19,-2.5 -2,-0.4 2,-0.6 -0.985 18.8-135.1-124.7 126.0 62.0 26.4 91.8 274 277 A R - 0 0 136 -2,-0.5 2,-0.4 -21,-0.2 -22,-0.1 -0.676 18.8-133.8 -79.4 117.3 61.8 25.3 95.4 275 278 A A - 0 0 10 -2,-0.6 2,-0.5 -24,-0.2 -22,-0.1 -0.601 24.0-164.8 -71.6 126.9 59.9 27.9 97.5 276 279 A I - 0 0 24 -2,-0.4 384,-0.1 -26,-0.1 355,-0.0 -0.960 8.6-178.8-120.0 113.8 62.0 28.4 100.6 277 280 A V - 0 0 10 -2,-0.5 355,-0.1 -26,-0.1 5,-0.1 -0.935 22.2-132.3-121.0 117.8 60.3 30.1 103.5 278 281 A P >> - 0 0 3 0, 0.0 3,-1.8 0, 0.0 4,-0.9 -0.315 27.8-114.2 -64.2 144.7 62.0 30.9 106.9 279 282 A D H 3> S+ 0 0 109 1,-0.3 4,-1.2 2,-0.2 3,-0.4 0.794 114.0 63.5 -46.8 -36.4 60.1 30.0 110.0 280 283 A Q H 3> S+ 0 0 42 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.834 95.6 58.6 -60.6 -35.9 59.6 33.6 111.0 281 284 A T H <> S+ 0 0 11 -3,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.886 101.4 55.6 -62.0 -39.5 57.5 34.2 107.8 282 285 A F H X S+ 0 0 63 -4,-0.9 4,-2.2 -3,-0.4 -1,-0.2 0.874 105.9 51.1 -61.9 -36.9 55.1 31.6 109.0 283 286 A D H X S+ 0 0 91 -4,-1.2 4,-2.5 2,-0.2 -1,-0.2 0.937 108.8 50.7 -64.9 -43.4 54.7 33.5 112.3 284 287 A E H X S+ 0 0 34 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.883 111.4 49.1 -60.7 -40.2 54.0 36.7 110.4 285 288 A L H X S+ 0 0 1 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.871 109.9 51.1 -67.6 -38.6 51.4 34.8 108.3 286 289 A N H X S+ 0 0 53 -4,-2.2 4,-3.5 2,-0.2 -2,-0.2 0.906 105.7 55.0 -66.1 -39.0 49.8 33.4 111.5 287 290 A Q H X S+ 0 0 100 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.903 107.3 50.7 -60.7 -40.7 49.5 36.8 113.0 288 291 A M H X S+ 0 0 42 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.910 113.1 46.2 -63.3 -40.1 47.6 38.0 110.0 289 292 A L H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.911 111.3 51.0 -67.3 -42.2 45.4 35.0 110.4 290 293 A D H X S+ 0 0 61 -4,-3.5 4,-2.8 1,-0.2 -2,-0.2 0.903 109.8 50.2 -61.9 -42.6 44.9 35.6 114.1 291 294 A N H X S+ 0 0 86 -4,-2.8 4,-1.4 1,-0.2 -1,-0.2 0.902 108.9 52.5 -62.7 -40.2 44.0 39.2 113.5 292 295 A M H <>S+ 0 0 0 -4,-1.9 5,-1.8 -5,-0.2 3,-0.3 0.920 111.7 46.6 -61.5 -42.4 41.5 38.0 110.9 293 296 A R H ><5S+ 0 0 90 -4,-2.4 3,-1.8 1,-0.2 -2,-0.2 0.901 107.9 54.9 -66.2 -42.8 40.0 35.7 113.6 294 297 A K H 3<5S+ 0 0 157 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.751 102.4 60.3 -61.7 -25.4 39.9 38.4 116.2 295 298 A A T 3<5S- 0 0 28 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.285 127.6 -94.9 -88.4 11.0 37.9 40.5 113.8 296 299 A G T < 5S+ 0 0 41 -3,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.336 80.4 137.9 97.1 -8.3 35.1 37.9 113.6 297 300 A L < + 0 0 1 -5,-1.8 -1,-0.3 -6,-0.2 -2,-0.1 -0.546 10.5 149.6 -75.8 133.7 36.3 36.1 110.5 298 301 A V > + 0 0 94 -2,-0.3 4,-2.2 -3,-0.1 -1,-0.2 0.650 65.4 43.2-125.6 -60.1 36.0 32.3 110.7 299 302 A D H > S+ 0 0 53 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.913 114.3 49.8 -60.9 -46.6 35.4 30.7 107.3 300 303 A I H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.919 112.0 48.0 -62.4 -44.9 37.9 32.7 105.4 301 304 A P H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.916 110.6 52.6 -63.6 -37.8 40.6 32.1 107.9 302 305 A K H X S+ 0 0 115 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.933 105.9 53.8 -62.6 -42.9 39.9 28.4 107.9 303 306 A M H X S+ 0 0 12 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.903 110.4 45.6 -59.8 -43.2 40.1 28.2 104.1 304 307 A I H X S+ 0 0 5 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.908 112.1 53.3 -65.6 -38.6 43.6 29.8 104.1 305 308 A Q H < S+ 0 0 64 -4,-2.2 4,-0.3 2,-0.2 -2,-0.2 0.911 108.4 48.6 -62.5 -42.3 44.5 27.5 106.9 306 309 A D H >X S+ 0 0 79 -4,-2.8 3,-1.8 1,-0.2 4,-0.5 0.940 109.6 52.6 -63.2 -44.7 43.4 24.4 105.0 307 310 A W H >X S+ 0 0 8 -4,-2.2 4,-2.4 1,-0.3 3,-0.5 0.830 99.2 66.9 -59.6 -33.9 45.4 25.6 102.0 308 311 A L H 3< S+ 0 0 23 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.575 82.9 73.5 -67.0 -11.1 48.4 25.9 104.1 309 312 A V H <4 S+ 0 0 111 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.958 124.2 0.9 -68.0 -48.7 48.8 22.2 104.8 310 313 A D H << S- 0 0 76 -3,-0.5 -2,-0.2 -4,-0.5 -3,-0.1 0.759 81.1-148.9-107.9 -36.4 50.1 21.5 101.2 311 314 A R < + 0 0 88 -4,-2.4 -58,-0.5 -5,-0.2 2,-0.3 0.955 29.9 178.0 63.2 52.8 50.2 24.9 99.5 312 315 A S > - 0 0 21 -5,-0.3 3,-1.0 1,-0.1 -1,-0.2 -0.698 38.1-140.4 -91.9 140.0 49.5 23.5 96.1 313 316 A I G > S+ 0 0 27 -2,-0.3 3,-0.7 1,-0.2 -1,-0.1 0.737 103.1 66.6 -67.2 -19.8 49.1 25.8 93.1 314 317 A E G 3 S+ 0 0 146 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.808 108.7 35.0 -70.3 -30.5 46.3 23.5 92.0 315 318 A K G X S+ 0 0 93 -3,-1.0 3,-0.7 1,-0.1 4,-0.4 0.166 92.0 98.3-108.0 16.1 44.1 24.6 95.0 316 319 A F T X> + 0 0 0 -3,-0.7 4,-1.8 1,-0.2 3,-0.9 0.757 57.3 84.4 -74.0 -28.6 45.4 28.2 94.9 317 320 A P H 3> S+ 0 0 68 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.828 87.7 57.0 -44.2 -33.8 42.4 29.5 93.0 318 321 A L H <> S+ 0 0 37 -3,-0.7 4,-2.1 2,-0.2 5,-0.2 0.917 103.8 50.1 -66.7 -42.8 40.6 29.8 96.3 319 322 A M H <> S+ 0 0 4 -3,-0.9 4,-1.8 -4,-0.4 -1,-0.2 0.880 114.2 46.0 -62.0 -39.1 43.3 32.0 97.9 320 323 A A H X S+ 0 0 4 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.848 108.8 56.2 -69.2 -37.6 43.1 34.3 94.8 321 324 A K H X S+ 0 0 56 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.876 109.1 45.9 -62.9 -40.3 39.2 34.2 94.9 322 325 A I H X S+ 0 0 4 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.917 109.4 55.3 -68.4 -43.0 39.3 35.5 98.5 323 326 A Y H < S+ 0 0 7 -4,-1.8 4,-0.5 1,-0.2 -2,-0.2 0.863 112.6 42.2 -58.5 -42.5 41.9 38.2 97.6 324 327 A S H >< S+ 0 0 4 -4,-2.0 3,-0.7 1,-0.2 4,-0.4 0.859 111.5 56.0 -72.6 -38.6 39.6 39.6 94.8 325 328 A W H >< S+ 0 0 6 -4,-1.8 3,-1.7 1,-0.2 -2,-0.2 0.870 90.4 72.1 -63.6 -36.2 36.5 39.3 96.9 326 329 A S G >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.811 92.2 58.2 -53.5 -34.7 37.7 41.4 99.7 327 330 A F G X S+ 0 0 36 -3,-0.7 3,-1.7 -4,-0.5 -1,-0.3 0.785 86.3 76.5 -66.3 -28.3 37.5 44.6 97.7 328 331 A H G < S+ 0 0 0 -3,-1.7 -1,-0.2 -4,-0.4 -118,-0.2 0.289 71.3 85.8 -69.7 12.0 33.8 44.2 96.9 329 332 A V G < S- 0 0 15 -3,-0.9 -1,-0.3 1,-0.3 2,-0.2 0.769 103.4-104.8 -79.6 -29.0 33.0 45.4 100.4 330 333 A G < - 0 0 5 -3,-1.7 113,-0.5 -4,-0.1 -1,-0.3 -0.683 41.5 -52.8 129.4 176.8 33.2 49.0 99.2 331 334 A F - 0 0 42 -2,-0.2 2,-0.9 111,-0.2 109,-0.0 -0.522 45.4-120.4 -87.3 158.1 35.4 52.0 99.3 332 335 A R - 0 0 37 109,-1.6 2,-0.8 112,-0.3 109,-0.3 -0.839 33.1-177.0 -98.9 102.1 36.8 53.5 102.5 333 336 A K + 0 0 25 -2,-0.9 107,-0.1 -207,-0.4 3,-0.1 -0.767 10.7 168.7-105.2 90.2 35.5 57.1 102.5 334 337 A Q - 0 0 2 -2,-0.8 2,-0.4 1,-0.1 3,-0.0 -0.031 43.0 -75.9 -83.7-170.3 36.9 59.0 105.5 335 338 A K >> - 0 0 89 1,-0.1 4,-2.1 111,-0.1 3,-1.0 -0.756 39.9-117.0 -92.9 137.7 36.8 62.7 106.3 336 339 A M H 3> S+ 0 0 23 -2,-0.4 4,-2.3 1,-0.3 5,-0.2 0.821 114.2 52.4 -39.1 -42.8 39.3 64.9 104.5 337 340 A L H 3> S+ 0 0 38 226,-0.5 4,-2.5 1,-0.2 -1,-0.3 0.877 107.7 48.3 -65.2 -42.3 41.0 65.8 107.8 338 341 A D H <> S+ 0 0 35 -3,-1.0 4,-0.9 2,-0.2 -1,-0.2 0.886 113.0 49.2 -65.8 -39.3 41.6 62.2 108.9 339 342 A A H < S+ 0 0 3 -4,-2.1 3,-0.5 1,-0.2 4,-0.3 0.934 117.2 40.9 -65.0 -46.0 43.0 61.3 105.6 340 343 A A H >< S+ 0 0 0 -4,-2.3 3,-1.1 -5,-0.3 -2,-0.2 0.811 105.1 69.2 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-501,-0.3 -10,-0.2 5,-0.1 -0.839 47.0 -90.5 -97.3 135.8 28.7 38.6 88.5 715 728 A D >> - 0 0 18 -503,-2.8 4,-1.7 -2,-0.4 3,-0.9 -0.226 31.4-140.9 -47.6 122.5 25.7 36.8 86.9 716 729 A R H 3> S+ 0 0 56 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.795 100.4 61.8 -58.7 -33.6 25.2 38.3 83.4 717 730 A E H 3> S+ 0 0 49 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.898 105.1 48.5 -61.3 -38.0 21.5 38.2 83.8 718 731 A F H <> S+ 0 0 3 -3,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.949 111.6 48.1 -66.4 -45.0 21.9 40.6 86.7 719 732 A I H X S+ 0 0 1 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.885 111.3 52.2 -60.8 -40.1 24.2 42.9 84.7 720 733 A L H X S+ 0 0 12 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.935 108.2 50.3 -62.9 -43.9 21.7 42.7 81.9 721 734 A T H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.874 108.6 51.8 -63.4 -38.6 18.8 43.8 84.2 722 735 A K H X S+ 0 0 0 -4,-2.2 4,-3.2 1,-0.2 5,-0.2 0.916 109.1 50.5 -63.6 -42.3 20.8 46.7 85.5 723 736 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.865 107.8 54.7 -62.3 -36.1 21.5 47.8 81.9 724 737 A M H < S+ 0 0 0 -4,-2.0 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L H < S+ 0 0 0 -4,-2.5 8,-3.3 1,-0.2 9,-1.3 0.775 122.5 34.6 -72.8 -34.9 22.1 48.6 72.6 745 758 A T H < S+ 0 0 14 -4,-3.1 16,-0.2 6,-0.2 -3,-0.2 0.706 88.1 104.8 -98.6 -20.5 24.6 46.2 71.1 746 759 A T S < S- 0 0 4 -4,-1.8 2,-1.7 -5,-0.4 4,-0.2 -0.265 86.6-101.5 -60.2 147.1 24.9 47.3 67.5 747 760 A N S S+ 0 0 16 14,-0.1 2,-0.2 4,-0.1 -1,-0.1 -0.536 80.5 113.4 -75.0 89.4 28.2 49.2 66.8 748 761 A S S > S- 0 0 0 -2,-1.7 3,-1.1 -5,-0.1 24,-0.1 -0.696 86.5 -77.1-140.3-170.1 26.8 52.7 66.8 749 762 A T T 3 S+ 0 0 12 23,-0.3 -2,-0.1 1,-0.2 23,-0.0 0.487 129.5 46.8 -76.0 -3.5 27.2 55.9 68.9 750 763 A F T 3 S+ 0 0 22 315,-0.2 -1,-0.2 -7,-0.2 315,-0.1 0.203 76.1 140.4-122.2 12.1 24.9 54.4 71.5 751 764 A K < + 0 0 2 -3,-1.1 316,-2.2 1,-0.2 317,-0.2 -0.368 18.7 171.5 -60.4 131.4 26.4 50.9 71.9 752 765 A V - 0 0 0 -8,-3.3 2,-0.3 1,-0.4 -7,-0.2 0.714 58.3 -11.5-111.8 -35.5 26.5 49.8 75.5 753 766 A F - 0 0 0 -9,-1.3 2,-0.5 -7,-0.1 -1,-0.4 -0.977 69.4 -90.7-160.0 170.2 27.6 46.2 75.4 754 767 A D - 0 0 7 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105,-0.0 2,-0.3 101,-0.0 -1,-0.2 0.099 57.6 63.4-110.7 19.6 26.0 42.2 58.8 765 778 A T S > S- 0 0 55 1,-0.1 4,-2.2 0, 0.0 5,-0.2 -0.957 84.2-118.2-139.6 157.8 22.4 42.8 57.8 766 779 A V H > S+ 0 0 89 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.906 112.9 53.6 -64.3 -42.1 20.5 45.6 56.1 767 780 A D H > S+ 0 0 26 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.945 110.1 48.7 -59.9 -43.8 18.3 46.4 59.0 768 781 A E H > S+ 0 0 21 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.920 112.4 47.2 -61.8 -43.9 21.4 46.8 61.2 769 782 A V H X S+ 0 0 12 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.919 111.5 52.5 -63.2 -40.4 23.1 49.1 58.7 770 783 A Y H X S+ 0 0 44 -4,-3.1 4,-1.5 1,-0.2 -2,-0.2 0.943 114.5 41.2 -60.6 -47.1 19.8 51.0 58.4 771 784 A I H X S+ 0 0 3 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.881 110.8 57.8 -68.9 -38.3 19.7 51.5 62.1 772 785 A Q H X S+ 0 0 5 -4,-3.2 4,-1.5 1,-0.2 -23,-0.3 0.905 106.9 47.9 -59.9 -43.4 23.4 52.2 62.4 773 786 A R H X S+ 0 0 105 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.871 109.1 55.1 -65.6 -38.1 23.3 55.1 60.0 774 787 A A H X S+ 0 0 1 -4,-1.5 4,-1.0 -5,-0.2 3,-0.3 0.948 106.4 48.3 -63.1 -47.8 20.3 56.6 61.8 775 788 A F H < S+ 0 0 1 -4,-2.2 3,-0.4 1,-0.2 -1,-0.2 0.878 108.1 56.5 -61.4 -37.0 22.0 56.7 65.2 776 789 A M H >< S+ 0 0 27 -4,-1.5 3,-2.1 1,-0.2 4,-0.4 0.884 94.5 66.7 -62.3 -39.2 25.0 58.4 63.7 777 790 A S H 3< S+ 0 0 58 -4,-1.6 3,-0.3 -3,-0.3 -1,-0.2 0.891 109.2 37.6 -48.9 -45.8 22.9 61.2 62.2 778 791 A L T 3< S+ 0 0 12 -4,-1.0 -1,-0.3 -3,-0.4 3,-0.2 -0.240 85.2 114.5-101.2 43.5 22.2 62.4 65.8 779 792 A S S < S+ 0 0 52 -3,-2.1 2,-0.6 1,-0.3 -1,-0.2 0.939 79.8 31.7 -76.3 -51.0 25.7 61.6 67.1 780 793 A S S S- 0 0 96 -4,-0.4 -1,-0.3 -3,-0.3 2,-0.2 -0.943 78.6-167.8-114.3 116.8 26.7 65.2 67.8 781 794 A Q - 0 0 50 -2,-0.6 55,-0.1 -3,-0.2 59,-0.1 -0.599 25.3 -93.7-101.2 163.8 24.0 67.6 68.9 782 795 A K - 0 0 185 -2,-0.2 2,-0.2 53,-0.1 57,-0.2 -0.141 25.7-164.7 -70.9 166.5 24.1 71.4 69.2 783 796 A S > - 0 0 4 1,-0.1 4,-1.3 56,-0.0 5,-0.2 -0.670 7.3-163.1-156.4 91.1 24.8 73.4 72.3 784 797 A G H >> S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 3,-1.0 0.880 94.4 49.2 -41.6 -52.6 23.9 77.1 72.2 785 798 A I H 3> S+ 0 0 47 1,-0.3 4,-1.7 2,-0.2 5,-0.3 0.938 105.6 56.6 -55.0 -51.0 26.1 77.9 75.2 786 799 A A H 3> S+ 0 0 11 1,-0.3 4,-0.8 2,-0.2 -1,-0.3 0.734 110.1 47.4 -54.1 -24.5 29.1 76.1 73.7 787 800 A D H X - 0 0 5 -4,-0.9 4,-2.3 -5,-0.3 3,-0.6 -0.235 68.5-136.0 -53.0 135.4 33.4 84.9 72.5 793 806 A S H 3> S+ 0 0 66 1,-0.2 4,-3.0 2,-0.2 5,-0.4 0.937 103.6 58.8 -60.2 -49.9 36.4 87.1 71.9 794 807 A T H 3> S+ 0 0 15 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.773 112.2 43.7 -51.3 -28.3 38.4 85.9 74.9 795 808 A F H <> S+ 0 0 3 -3,-0.6 4,-2.2 -6,-0.3 -1,-0.2 0.883 111.9 49.7 -83.9 -45.0 38.0 82.4 73.3 796 809 A K H X S+ 0 0 109 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.911 110.1 51.0 -61.8 -43.2 38.9 83.4 69.7 797 810 A N H X S+ 0 0 93 -4,-3.0 4,-3.5 1,-0.2 -1,-0.2 0.871 107.9 55.4 -61.7 -37.1 42.0 85.3 70.8 798 811 A Y H X S+ 0 0 3 -4,-0.6 4,-2.0 -5,-0.4 -2,-0.2 0.939 110.1 43.6 -62.4 -46.7 43.0 82.1 72.7 799 812 A V H X S+ 0 0 17 -4,-2.2 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-4,-0.9 -1,-0.3 -5,-0.3 -2,-0.2 0.243 91.5 100.1 -83.6 12.4 46.0 60.7 52.4 940 953 A L S < S- 0 0 34 -3,-1.9 2,-0.2 1,-0.1 -3,-0.1 -0.443 86.9 -76.1 -93.6 172.7 46.4 64.2 50.9 941 954 A H >> - 0 0 133 -2,-0.1 4,-1.7 1,-0.1 3,-1.6 -0.450 42.7-115.4 -70.0 136.3 48.1 65.3 47.7 942 955 A E H 3> S+ 0 0 103 1,-0.3 4,-1.2 2,-0.2 -1,-0.1 0.769 115.8 55.5 -39.5 -37.6 51.9 65.4 47.9 943 956 A N H 3> S+ 0 0 93 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.892 106.6 49.0 -67.1 -39.9 51.8 69.2 47.4 944 957 A E H <> S+ 0 0 62 -3,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.893 105.8 56.9 -66.6 -40.4 49.5 69.7 50.4 945 958 A I H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.838 103.1 55.9 -60.4 -35.4 51.7 67.6 52.7 946 959 A Q H X S+ 0 0 65 -4,-1.2 4,-2.0 -5,-0.3 -1,-0.2 0.899 110.4 43.6 -64.0 -42.1 54.6 69.8 51.9 947 960 A L H X S+ 0 0 106 -4,-1.2 4,-3.8 -3,-0.2 -2,-0.2 0.911 112.1 52.8 -68.5 -44.0 52.8 73.0 53.0 948 961 A Y H X S+ 0 0 10 -4,-2.5 4,-0.5 2,-0.2 -2,-0.2 0.922 111.5 46.4 -59.7 -45.8 51.4 71.3 56.1 949 962 A L H ><>S+ 0 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0 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.901 114.3 42.6 -62.3 -43.9 59.7 68.6 54.0 960 973 A D H X S+ 0 0 69 -4,-2.7 4,-0.6 2,-0.2 5,-0.2 0.858 110.2 57.2 -70.8 -36.8 60.6 68.0 50.4 961 974 A T H >X S+ 0 0 91 -4,-2.0 4,-1.9 -5,-0.3 3,-0.5 0.920 111.9 41.5 -62.1 -43.4 62.8 65.1 51.2 962 975 A Y H 3< S+ 0 0 9 -4,-2.2 6,-0.5 1,-0.2 -2,-0.2 0.957 100.9 66.8 -70.0 -49.2 60.1 63.2 53.0 963 976 A V H 3< S+ 0 0 4 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.630 116.9 28.9 -50.7 -14.6 57.1 63.9 50.6 964 977 A G H << S+ 0 0 53 -4,-0.6 5,-0.2 -3,-0.5 -1,-0.2 0.783 95.8 105.8-109.8 -51.3 58.9 61.8 48.0 965 978 A S S X S- 0 0 35 -4,-1.9 4,-1.0 -5,-0.2 3,-0.4 0.381 81.8-109.2 -28.8 159.3 61.0 59.3 49.9 966 979 A K H > S+ 0 0 180 1,-0.2 4,-2.5 2,-0.2 3,-0.3 0.846 117.5 64.8 -63.4 -34.6 60.1 55.6 50.2 967 980 A I H > S+ 0 0 78 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.875 93.4 58.9 -59.4 -38.8 59.3 56.3 53.9 968 981 A Y H > S+ 0 0 18 -6,-0.5 4,-1.7 -3,-0.4 -1,-0.2 0.917 110.2 42.0 -59.0 -43.8 56.4 58.6 53.0 969 982 A S H X S+ 0 0 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26 1,-0.2 4,-0.1 2,-0.2 -4,-0.0 0.045 120.2 -24.0 40.1-131.5 39.0 43.8 76.1 990 1003 A C T >> S+ 0 0 6 1,-0.2 3,-1.9 2,-0.1 4,-0.6 0.871 130.4 63.1 -78.7 -43.5 39.7 40.2 75.2 991 1004 A Y G >4 S+ 0 0 9 1,-0.3 3,-1.0 -6,-0.2 -2,-0.2 0.850 85.1 73.9 -55.2 -40.7 41.7 40.7 72.0 992 1005 A Q G 3< S+ 0 0 65 -4,-2.3 -1,-0.3 -7,-0.3 -88,-0.2 0.710 98.4 51.9 -48.9 -18.2 44.5 42.7 73.8 993 1006 A L G <4 S+ 0 0 22 -3,-1.9 -89,-1.6 -5,-0.2 -1,-0.3 0.840 93.1 87.2 -86.4 -37.3 45.5 39.2 75.2 994 1007 A F B << S-W 903 0N 0 -3,-1.0 2,-1.1 -4,-0.6 -91,-0.3 -0.308 77.2-125.2 -68.4 144.1 45.7 37.3 71.9 995 1008 A D > - 0 0 31 -93,-1.0 3,-1.8 1,-0.1 6,-0.2 -0.755 22.7-171.6 -92.2 94.0 48.7 37.0 69.6 996 1009 A F T 3 S+ 0 0 4 -2,-1.1 -1,-0.1 1,-0.3 29,-0.1 0.509 84.7 53.8 -65.1 -4.7 47.3 38.2 66.2 997 1010 A N T 3 S+ 0 0 84 -96,-0.1 -1,-0.3 4,-0.0 -2,-0.0 0.022 77.4 146.2-115.9 24.9 50.6 37.2 64.5 998 1011 A S <> - 0 0 0 -3,-1.8 4,-2.6 1,-0.2 5,-0.1 -0.370 51.0-140.4 -61.4 134.8 50.4 33.6 65.9 999 1012 A P H > S+ 0 0 91 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.888 106.4 54.5 -63.8 -35.8 51.9 31.2 63.4 1000 1013 A D H > S+ 0 0 16 -99,-0.2 4,-0.9 2,-0.2 3,-0.3 0.911 111.3 41.9 -62.7 -45.6 49.1 28.9 64.5 1001 1014 A L H 4 S+ 0 0 0 -6,-0.2 4,-0.4 1,-0.2 3,-0.3 0.877 108.1 62.2 -68.2 -38.6 46.4 31.5 63.7 1002 1015 A E H >< S+ 0 0 70 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.793 96.8 59.0 -58.4 -33.9 48.2 32.5 60.4 1003 1016 A K H 3< S+ 0 0 136 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.946 97.5 58.6 -63.0 -46.4 47.7 29.0 59.1 1004 1017 A L T 3< S+ 0 0 9 -4,-0.9 37,-3.0 -3,-0.3 2,-0.7 0.601 93.6 80.2 -60.4 -10.1 43.9 29.2 59.4 1005 1018 A I E < -v 1041 0M 12 -3,-1.0 2,-0.9 -4,-0.4 37,-0.2 -0.875 59.6-175.3-105.3 109.3 44.0 32.3 57.1 1006 1019 A R E +v 1042 0M 114 35,-3.3 37,-2.1 -2,-0.7 -3,-0.1 -0.756 15.6 163.9-104.8 85.9 44.3 31.3 53.4 1007 1020 A I - 0 0 13 -2,-0.9 2,-0.3 35,-0.2 37,-0.1 -0.846 24.3-155.7-113.1 102.3 44.7 34.6 51.5 1008 1021 A P - 0 0 51 0, 0.0 2,-1.7 0, 0.0 3,-0.2 -0.570 21.6-129.3 -72.3 128.8 46.0 34.5 47.9 1009 1022 A F + 0 0 144 -2,-0.3 3,-0.2 1,-0.2 -2,-0.0 -0.572 41.0 161.6 -83.5 78.8 47.7 37.8 47.0 1010 1023 A K S S+ 0 0 55 -2,-1.7 2,-0.3 1,-0.2 -1,-0.2 0.699 77.0 26.7 -68.8 -20.9 45.9 38.5 43.7 1011 1024 A G S S- 0 0 18 -3,-0.2 2,-2.0 2,-0.1 -1,-0.2 -0.958 74.4-139.3-147.0 124.3 47.0 42.1 44.2 1012 1025 A K + 0 0 200 -2,-0.3 3,-0.1 -3,-0.2 -3,-0.0 -0.329 53.0 140.2 -81.5 58.0 50.0 43.4 46.1 1013 1026 A I >> - 0 0 44 -2,-2.0 4,-2.3 1,-0.1 3,-0.6 -0.810 43.7-154.3-105.2 91.8 48.1 46.3 47.6 1014 1027 A P H 3> S+ 0 0 73 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.672 90.7 53.0 -35.1 -33.1 49.4 46.6 51.3 1015 1028 A A H 3> S+ 0 0 5 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.975 112.9 38.7 -73.6 -55.8 46.1 48.3 52.3 1016 1029 A V H <> S+ 0 0 0 -3,-0.6 4,-2.1 1,-0.2 5,-0.2 0.904 115.0 53.7 -63.1 -41.8 43.6 45.7 51.0 1017 1030 A T H X S+ 0 0 23 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.880 108.6 52.8 -61.3 -35.9 45.8 42.8 52.0 1018 1031 A F H X S+ 0 0 14 -4,-1.1 4,-2.2 -5,-0.4 5,-0.2 0.945 109.8 43.3 -66.0 -50.0 45.9 44.1 55.5 1019 1032 A I H X S+ 0 0 1 -4,-1.9 4,-2.9 1,-0.2 5,-0.2 0.874 113.0 53.4 -66.6 -36.1 42.2 44.5 56.2 1020 1033 A L H X S+ 0 0 2 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.876 111.2 46.1 -65.5 -39.9 41.4 41.2 54.6 1021 1034 A H H X S+ 0 0 36 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.907 115.7 45.3 -68.3 -43.5 43.9 39.4 56.8 1022 1035 A L H X S+ 0 0 4 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.919 112.0 50.7 -67.4 -44.4 42.7 41.2 60.0 1023 1036 A Y H X S+ 0 0 13 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.888 111.8 50.2 -61.0 -37.5 39.1 40.6 59.2 1024 1037 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 -5,-0.2 -2,-0.2 0.928 110.1 48.5 -66.4 -44.6 40.0 37.0 58.7 1025 1038 A K H X S+ 0 0 16 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.929 112.5 48.1 -63.0 -44.1 41.8 36.7 62.0 1026 1039 A L H X S+ 0 0 10 -4,-2.8 4,-3.2 1,-0.2 5,-0.3 0.943 111.7 50.2 -62.4 -44.3 38.9 38.3 63.9 1027 1040 A E H X S+ 0 0 57 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.879 113.6 45.3 -60.9 -41.5 36.3 36.1 62.3 1028 1041 A V H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.920 115.8 46.0 -68.6 -44.8 38.3 33.0 63.1 1029 1042 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.919 110.1 52.5 -66.1 -44.0 39.0 34.0 66.6 1030 1043 A N H X S+ 0 0 16 -4,-3.2 4,-1.8 -5,-0.2 -1,-0.2 0.890 108.5 53.1 -60.8 -36.1 35.4 35.1 67.3 1031 1044 A Y H X S+ 0 0 80 -4,-1.5 4,-1.9 -5,-0.3 6,-0.4 0.901 109.0 47.8 -64.8 -41.2 34.3 31.7 66.1 1032 1045 A A H X S+ 0 0 1 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.887 109.8 53.5 -65.2 -40.2 36.7 29.9 68.5 1033 1046 A I H < S+ 0 0 6 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.865 118.7 35.1 -63.0 -37.0 35.5 32.1 71.4 1034 1047 A K H < S+ 0 0 96 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.641 130.9 26.8 -95.0 -12.8 31.9 31.2 70.6 1035 1048 A N H < S- 0 0 82 -4,-1.9 -3,-0.2 2,-0.3 -2,-0.2 0.549 86.4-128.2-127.4 -9.5 32.3 27.5 69.5 1036 1049 A G S < S+ 0 0 43 -4,-2.2 2,-0.2 -5,-0.3 -4,-0.2 0.475 83.7 78.6 75.6 -1.4 35.3 26.0 71.1 1037 1050 A S S S- 0 0 57 -6,-0.4 -2,-0.3 -159,-0.1 -1,-0.2 -0.779 75.0-114.8-130.0 176.0 36.5 24.8 67.7 1038 1051 A W E -U 877 0M 3 -161,-0.8 -161,-2.1 -2,-0.2 2,-0.3 -0.693 15.1-159.6-116.4 167.1 38.3 26.4 64.7 1039 1052 A I E -U 876 0M 6 -163,-0.3 2,-0.4 -2,-0.2 -163,-0.3 -0.959 16.5-130.4-139.6 155.2 37.6 27.3 61.1 1040 1053 A S E -U 875 0M 16 -165,-3.9 -165,-1.1 -2,-0.3 2,-0.5 -0.919 19.9-149.1-110.5 133.7 39.8 28.0 58.1 1041 1054 A L E -Uv 8741005M 2 -37,-3.0 -35,-3.3 -2,-0.4 2,-0.5 -0.900 8.3-166.8-110.9 127.0 39.1 31.1 56.0 1042 1055 A F E -Uv 8731006M 64 -169,-1.4 -169,-2.3 -2,-0.5 2,-0.5 -0.926 12.4-146.4-110.4 126.9 39.8 31.4 52.2 1043 1056 A C E +U 872 0M 0 -37,-2.1 -171,-0.2 -2,-0.5 -172,-0.0 -0.834 26.0 166.2 -99.7 125.0 39.8 34.8 50.5 1044 1057 A N + 0 0 67 -173,-2.4 -172,-0.1 -2,-0.5 -1,-0.1 -0.350 21.4 165.3-126.1 46.3 38.6 35.0 46.9 1045 1058 A Y - 0 0 3 -174,-0.1 -35,-0.1 1,-0.1 5,-0.1 -0.468 43.3-104.7 -69.3 132.4 38.2 38.8 46.8 1046 1059 A P > - 0 0 37 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 -0.218 16.2-141.6 -57.1 144.7 37.9 40.3 43.3 1047 1060 A K H > S+ 0 0 143 2,-0.2 4,-0.7 1,-0.2 -2,-0.0 0.872 104.4 48.6 -76.1 -38.9 40.9 42.1 41.9 1048 1061 A S H >> S+ 0 0 78 1,-0.2 4,-0.8 2,-0.2 3,-0.8 0.901 110.0 53.5 -66.1 -40.9 38.8 44.8 40.3 1049 1062 A E H 3> S+ 0 0 62 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.805 93.4 71.8 -63.5 -31.6 36.9 45.2 43.5 1050 1063 A M H 3X S+ 0 0 10 -4,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.830 94.3 53.4 -56.6 -36.3 40.1 45.8 45.5 1051 1064 A I H < S+ 0 0 115 -4,-1.5 3,-0.9 1,-0.2 -1,-0.2 0.912 108.3 51.5 -67.1 -41.0 39.4 54.0 48.1 1056 1069 A K H >< S+ 0 0 61 -4,-1.6 3,-2.1 1,-0.2 -2,-0.2 0.878 98.5 67.6 -62.1 -37.5 36.8 53.3 50.8 1057 1070 A M H >< S+ 0 0 0 -4,-2.2 3,-0.5 1,-0.3 -1,-0.2 0.770 96.6 53.4 -55.3 -33.1 39.6 52.5 53.3 1058 1071 A W T << S+ 0 0 18 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.179 103.5 57.0 -91.6 18.1 40.7 56.2 53.3 1059 1072 A N T < S+ 0 0 84 -3,-2.1 -200,-0.7 2,-0.0 2,-0.4 -0.175 70.3 143.0-138.3 42.2 37.3 57.6 54.1 1060 1073 A I B < -t 859 0L 8 -3,-0.5 2,-0.5 -202,-0.1 -200,-0.3 -0.731 38.2-147.9 -91.7 129.7 36.4 55.9 57.4 1061 1074 A T - 0 0 40 -202,-4.6 -200,-0.5 -2,-0.4 2,-0.2 -0.825 18.7-125.1 -97.1 131.1 34.6 57.9 60.0 1062 1075 A S - 0 0 31 -2,-0.5 2,-0.4 -202,-0.1 -202,-0.0 -0.488 21.3-132.7 -75.2 143.4 35.3 57.0 63.7 1063 1076 A L - 0 0 23 -2,-0.2 2,-0.4 -80,-0.1 -315,-0.1 -0.821 13.3-158.4-101.8 136.1 32.4 56.0 65.9 1064 1077 A R + 0 0 144 -2,-0.4 -313,-0.1 4,-0.0 3,-0.1 -0.913 27.9 141.4-111.6 136.0 31.9 57.5 69.4 1065 1078 A S > - 0 0 6 -2,-0.4 4,-3.1 -315,-0.1 5,-0.3 -0.985 63.3 -97.0-165.0 166.2 29.8 55.7 72.0 1066 1079 A P H > S+ 0 0 9 0, 0.0 4,-3.0 0, 0.0 -314,-0.2 0.882 125.4 52.4 -56.8 -38.7 29.4 54.7 75.7 1067 1080 A Y H > S+ 0 0 28 -316,-2.2 4,-1.7 2,-0.2 5,-0.1 0.932 112.3 44.7 -62.1 -45.5 31.0 51.4 74.9 1068 1081 A T H > S+ 0 0 39 -317,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.882 115.8 46.2 -65.2 -43.8 33.9 53.2 73.2 1069 1082 A N H X S+ 0 0 52 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.870 107.2 60.5 -67.6 -36.8 34.2 55.6 76.0 1070 1083 A A H X S+ 0 0 2 -4,-3.0 4,-1.1 -5,-0.3 -2,-0.2 0.886 104.6 47.2 -60.2 -41.2 33.9 52.7 78.5 1071 1084 A N H < S+ 0 0 24 -4,-1.7 3,-0.4 1,-0.2 -1,-0.2 0.904 114.7 46.2 -65.9 -42.2 37.1 51.0 77.1 1072 1085 A F H < S+ 0 0 149 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.800 103.8 64.6 -67.0 -32.8 39.0 54.4 77.2 1073 1086 A F H < 0 0 115 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.853 360.0 360.0 -59.1 -36.2 37.6 54.9 80.7 1074 1087 A Q < 0 0 102 -4,-1.1 -371,-0.0 -3,-0.4 -3,-0.0 -0.086 360.0 360.0 -61.4 360.0 39.6 51.8 81.8