==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-DEC-98 2PRI . COMPND 2 MOLECULE: GLYCOGEN PHOSPHORYLASE B; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR N.G.OIKONOMAKOS,S.E.ZOGRAPHOS,L.N.JOHNSON,A.C.PAPAGEORGIOU, . 830 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32061.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 608 73.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 2 0.2 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 . 63 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 312 37.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 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 2 1 2 7 1 2 2 4 2 0 0 1 0 3 0 1 0 1 0 0 1 1 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 2 3 1 3 2 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 PARALLEL BRIDGES PER LADDER . 0 2 2 1 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 13 A I 0 0 155 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -28.5 -1.9 10.7 30.0 2 14 A S - 0 0 33 3,-0.2 2,-0.6 487,-0.1 484,-0.1 -0.861 360.0 -70.2 154.5-180.0 1.4 9.7 28.4 3 15 A V S S+ 0 0 48 -2,-0.3 3,-0.1 1,-0.2 90,-0.1 -0.324 82.6 127.1 -97.7 54.7 4.0 7.0 29.1 4 16 A R S S- 0 0 32 -2,-0.6 90,-2.4 1,-0.4 91,-0.4 -0.025 84.8 -89.5 -91.7 26.2 5.1 8.6 32.4 5 17 A G - 0 0 13 88,-0.2 -1,-0.4 89,-0.1 2,-0.3 -0.304 60.9 -43.5 94.4-178.7 4.3 5.1 33.8 6 18 A L - 0 0 149 85,-0.3 2,-0.7 -3,-0.1 89,-0.5 -0.648 35.4-144.4 -90.1 144.0 1.2 3.5 35.3 7 19 A A - 0 0 42 -2,-0.3 5,-0.1 87,-0.2 -1,-0.1 -0.559 34.4-164.5-103.7 64.6 -1.1 5.3 37.8 8 20 A G > - 0 0 29 -2,-0.7 4,-1.8 1,-0.1 5,-0.2 -0.008 24.6-128.9 -50.8 151.3 -1.8 2.1 39.7 9 21 A V H > S+ 0 0 114 2,-0.2 4,-1.5 1,-0.2 5,-0.2 0.978 107.9 42.1 -65.8 -56.2 -4.7 1.9 42.2 10 22 A E H > S+ 0 0 159 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.850 117.4 47.9 -60.4 -38.0 -2.6 0.6 45.1 11 23 A N H > S+ 0 0 74 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.800 106.4 53.0 -78.9 -29.1 0.3 2.9 44.5 12 24 A V H X S+ 0 0 6 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.872 113.7 46.4 -71.7 -32.8 -1.6 6.2 44.1 13 25 A T H X S+ 0 0 79 -4,-1.5 4,-1.6 -5,-0.2 -2,-0.2 0.910 112.4 49.8 -70.8 -43.9 -3.3 5.4 47.4 14 26 A E H X S+ 0 0 79 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.913 109.3 52.1 -61.3 -43.0 0.1 4.5 49.0 15 27 A L H X S+ 0 0 8 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.944 106.4 53.7 -59.8 -49.0 1.6 7.8 47.7 16 28 A K H X S+ 0 0 51 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.868 108.2 47.1 -56.3 -43.0 -1.1 9.9 49.1 17 29 A K H X S+ 0 0 107 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.856 113.0 49.5 -71.3 -31.0 -0.8 8.7 52.7 18 30 A N H X S+ 0 0 17 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.854 107.0 55.4 -73.7 -31.3 2.9 9.0 52.6 19 31 A F H X S+ 0 0 5 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.919 112.7 43.2 -63.8 -41.2 2.5 12.5 51.3 20 32 A N H X S+ 0 0 61 -4,-1.8 4,-1.7 2,-0.2 5,-0.3 0.850 107.6 59.1 -72.8 -35.9 0.4 13.2 54.4 21 33 A R H >X>S+ 0 0 98 -4,-2.3 4,-3.2 1,-0.2 3,-0.6 0.983 111.4 41.4 -55.1 -57.7 2.7 11.4 56.7 22 34 A H H 3X>S+ 0 0 12 -4,-2.3 5,-3.0 1,-0.2 4,-1.5 0.866 108.9 57.4 -58.2 -43.4 5.6 13.7 55.8 23 35 A L H 3<5S+ 0 0 4 -4,-1.9 6,-1.9 -5,-0.2 -1,-0.2 0.861 121.5 30.6 -56.1 -34.7 3.5 16.9 55.8 24 36 A H H > - 0 0 84 -2,-0.3 3,-3.6 -3,-0.1 4,-0.8 -0.999 36.5-101.7-138.5 132.9 -1.2 20.9 59.0 31 43 A R T 34 S+ 0 0 104 -2,-0.4 -7,-0.0 1,-0.3 -1,-0.0 0.624 116.8 66.2 -21.3 -33.2 -3.1 21.4 55.7 32 44 A N T 34 S+ 0 0 139 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.622 114.4 26.4 -77.0 -11.2 -4.4 24.8 57.0 33 45 A V T <4 S+ 0 0 92 -3,-3.6 -2,-0.2 2,-0.1 -1,-0.2 0.386 90.1 119.2-128.4 -0.1 -1.0 26.4 57.0 34 46 A A < - 0 0 17 -4,-0.8 -11,-0.0 4,-0.1 -5,-0.0 -0.456 45.7-159.7 -69.5 137.4 0.9 24.4 54.4 35 47 A T >> - 0 0 62 -2,-0.2 4,-2.2 1,-0.0 3,-1.2 -0.696 39.1 -92.7-111.3 167.4 2.2 26.5 51.5 36 48 A P H 3> S+ 0 0 66 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.844 128.1 57.5 -50.7 -31.0 3.2 25.3 48.0 37 49 A R H 3> S+ 0 0 67 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.881 105.5 47.2 -67.1 -38.9 6.7 25.1 49.4 38 50 A D H <> S+ 0 0 18 -3,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.895 111.2 52.7 -67.4 -39.6 5.7 22.7 52.1 39 51 A Y H X S+ 0 0 21 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.887 106.2 53.5 -63.1 -39.1 3.7 20.6 49.6 40 52 A Y H X S+ 0 0 8 -4,-2.1 4,-2.6 -5,-0.3 -1,-0.2 0.892 110.5 47.1 -64.1 -38.6 6.8 20.4 47.4 41 53 A F H X S+ 0 0 26 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.840 108.5 53.2 -72.9 -34.3 8.8 19.0 50.4 42 54 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.932 114.2 43.5 -64.2 -44.4 6.2 16.5 51.4 43 55 A L H X S+ 0 0 5 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.936 112.0 53.2 -65.4 -47.2 6.3 15.2 47.8 44 56 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.906 111.1 46.3 -56.1 -42.5 10.0 15.3 47.6 45 57 A H H X S+ 0 0 34 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.838 111.5 52.5 -70.1 -30.6 10.3 13.2 50.8 46 58 A T H X S+ 0 0 2 -4,-1.6 4,-0.7 2,-0.2 -2,-0.2 0.897 112.5 44.2 -70.0 -41.9 7.7 10.8 49.5 47 59 A V H >< S+ 0 0 1 -4,-2.8 3,-0.8 1,-0.2 4,-0.4 0.882 109.9 55.6 -70.5 -38.9 9.6 10.3 46.2 48 60 A R H >X S+ 0 0 54 -4,-2.4 3,-1.3 -5,-0.3 4,-0.8 0.829 97.8 64.7 -63.5 -31.6 13.0 10.0 48.0 49 61 A D H >X S+ 0 0 52 -4,-1.3 4,-0.7 1,-0.3 3,-0.6 0.849 94.4 61.0 -58.8 -36.5 11.5 7.2 50.1 50 62 A H H << S+ 0 0 43 -3,-0.8 4,-0.3 -4,-0.7 -1,-0.3 0.634 107.4 41.7 -70.6 -14.7 11.1 5.0 47.0 51 63 A L H <> S+ 0 0 0 -3,-1.3 4,-2.3 -4,-0.4 -1,-0.2 0.524 92.3 77.6-113.6 1.0 14.8 5.0 46.1 52 64 A V H S+ 0 0 32 -4,-0.3 4,-2.3 2,-0.2 172,-0.4 0.827 112.1 57.9 -72.2 -36.1 17.3 0.5 46.0 55 67 A W H X S+ 0 0 22 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.955 108.3 46.5 -58.9 -50.3 20.2 2.8 47.0 56 68 A I H X S+ 0 0 104 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.904 115.2 44.4 -60.9 -45.8 21.0 0.5 50.0 57 69 A R H X S+ 0 0 54 -4,-1.6 4,-2.3 -5,-0.2 -1,-0.2 0.812 110.2 54.7 -72.6 -29.3 20.9 -2.8 48.0 58 70 A T H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.963 113.9 41.7 -66.0 -49.0 22.8 -1.4 45.0 59 71 A Q H X S+ 0 0 30 -4,-2.2 4,-1.4 -5,-0.2 -2,-0.2 0.911 114.8 49.8 -63.7 -43.7 25.6 -0.4 47.4 60 72 A Q H X S+ 0 0 98 -4,-2.4 4,-1.9 1,-0.2 3,-0.3 0.918 109.2 56.0 -60.9 -40.7 25.5 -3.6 49.4 61 73 A H H X S+ 0 0 67 -4,-2.3 4,-2.8 1,-0.3 5,-0.4 0.930 103.9 49.9 -55.8 -52.9 25.5 -5.4 46.0 62 74 A Y H X S+ 0 0 11 -4,-2.1 4,-1.6 1,-0.2 -1,-0.3 0.809 108.9 55.2 -57.9 -30.1 28.8 -3.8 44.9 63 75 A Y H < S+ 0 0 88 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.896 112.7 41.7 -71.4 -37.6 30.3 -4.8 48.2 64 76 A E H < S+ 0 0 127 -4,-1.9 -2,-0.2 -3,-0.3 -3,-0.1 0.965 123.9 33.9 -72.9 -56.2 29.4 -8.4 47.7 65 77 A K H < S- 0 0 151 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.774 91.1-155.1 -72.0 -28.4 30.3 -8.9 44.1 66 78 A D < + 0 0 13 -4,-1.6 -3,-0.1 -5,-0.4 -4,-0.1 0.935 21.6 177.0 53.9 60.5 33.2 -6.4 44.3 67 79 A P - 0 0 50 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.262 43.7 -68.2 -86.4 177.8 33.5 -5.3 40.7 68 80 A K - 0 0 46 746,-0.1 73,-0.4 253,-0.1 2,-0.4 -0.505 56.2-136.0 -66.6 128.4 35.9 -2.7 39.3 69 81 A R E -a 321 0A 9 251,-3.0 253,-1.6 -2,-0.3 2,-0.6 -0.737 8.4-149.0 -94.2 134.7 34.9 0.8 40.7 70 82 A I E -ab 322 142A 1 71,-2.5 73,-3.0 -2,-0.4 2,-0.6 -0.883 9.6-165.8-103.6 119.5 34.8 3.9 38.5 71 83 A Y E -ab 323 143A 3 251,-3.4 253,-3.0 -2,-0.6 2,-0.9 -0.905 3.0-162.2-108.4 114.3 35.5 7.2 40.3 72 84 A Y E -ab 324 144A 0 71,-2.8 73,-2.3 -2,-0.6 2,-0.5 -0.823 9.5-164.9 -98.6 99.3 34.6 10.4 38.4 73 85 A L E +ab 325 145A 1 251,-1.9 253,-2.1 -2,-0.9 2,-0.3 -0.725 22.6 148.6 -88.1 127.8 36.5 13.3 39.8 74 86 A S - 0 0 0 71,-1.8 73,-0.2 -2,-0.5 253,-0.1 -0.971 47.4-144.4-158.1 139.0 35.2 16.7 38.9 75 87 A L S S+ 0 0 1 251,-0.4 2,-0.4 -2,-0.3 72,-0.2 0.503 91.5 57.7 -82.6 -1.7 35.0 20.1 40.6 76 88 A E + 0 0 8 250,-0.1 2,-0.3 48,-0.1 44,-0.2 -0.989 48.2 168.6-137.0 138.1 31.7 20.6 38.9 77 89 A F E -J 119 0B 4 42,-2.3 2,-1.8 -2,-0.4 42,-0.7 -0.817 16.6-163.1-143.9 94.2 28.4 18.8 38.8 78 90 A Y E +J 118 0B 17 47,-2.2 40,-0.2 -2,-0.3 51,-0.1 -0.547 26.8 158.9 -82.4 77.0 25.7 20.8 37.1 79 91 A M E - 0 0 30 -2,-1.8 -1,-0.2 38,-0.7 39,-0.2 0.824 19.7-169.1 -72.9 -40.0 22.7 18.8 38.4 80 92 A G E -J 117 0B 0 37,-1.6 37,-0.7 2,-0.0 -1,-0.2 -0.447 54.4 -17.1 78.4-159.9 19.7 21.1 38.2 81 93 A R - 0 0 29 35,-0.2 4,-0.2 1,-0.1 35,-0.1 -0.473 56.0-165.7 -77.6 154.7 16.4 20.0 39.9 82 94 A T > + 0 0 30 -2,-0.1 4,-1.2 2,-0.1 5,-0.1 0.467 64.0 84.1-122.9 0.5 16.1 16.4 40.9 83 95 A L H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.1 3,-0.3 0.986 97.8 36.8 -67.1 -58.6 12.4 15.7 41.7 84 96 A Q H > S+ 0 0 32 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.913 114.5 55.6 -60.5 -45.4 11.1 15.1 38.2 85 97 A N H > S+ 0 0 18 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.842 108.2 49.8 -57.5 -34.1 14.1 13.3 37.0 86 98 A T H X S+ 0 0 5 -4,-1.2 4,-1.1 -3,-0.3 -1,-0.2 0.854 109.9 50.0 -73.6 -36.7 13.7 10.9 39.9 87 99 A M H <>S+ 0 0 0 -4,-1.7 5,-3.4 2,-0.2 6,-0.7 0.913 111.4 50.2 -66.0 -43.6 10.1 10.3 39.1 88 100 A V H ><5S+ 0 0 1 -4,-2.8 3,-1.3 1,-0.2 -2,-0.2 0.947 111.9 45.3 -59.8 -51.9 11.0 9.6 35.5 89 101 A N H 3<5S+ 0 0 0 -4,-2.2 133,-2.4 1,-0.3 135,-0.3 0.682 117.7 44.8 -68.3 -18.4 13.8 7.1 36.3 90 102 A L T 3<5S- 0 0 16 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.322 110.7-120.0-105.5 3.8 11.6 5.3 38.8 91 103 A A T < 5S+ 0 0 33 -3,-1.3 -85,-0.3 -4,-0.4 -3,-0.2 0.888 78.3 123.5 57.2 44.3 8.5 5.3 36.6 92 104 A L >< + 0 0 15 -5,-3.4 4,-2.5 -6,-0.1 5,-0.3 0.410 33.0 98.0-112.7 -4.6 6.6 7.4 39.2 93 105 A E H > S+ 0 0 2 -6,-0.7 4,-1.9 2,-0.2 -88,-0.2 0.866 86.4 40.6 -58.3 -44.7 5.6 10.4 37.3 94 106 A N H > S+ 0 0 5 -90,-2.4 4,-3.2 2,-0.2 -1,-0.2 0.932 115.5 51.0 -71.7 -44.6 2.0 9.5 36.4 95 107 A A H > S+ 0 0 3 -89,-0.5 4,-3.0 -91,-0.4 -2,-0.2 0.914 114.2 44.7 -56.8 -45.3 1.2 8.0 39.8 96 108 A C H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.858 112.3 52.1 -66.8 -38.9 2.6 11.1 41.5 97 109 A D H X S+ 0 0 42 -4,-1.9 4,-1.4 -5,-0.3 -2,-0.2 0.929 114.1 43.4 -62.3 -46.7 0.7 13.3 39.1 98 110 A E H >X S+ 0 0 58 -4,-3.2 4,-2.6 2,-0.2 3,-0.6 0.985 114.7 47.9 -62.0 -59.6 -2.5 11.4 39.9 99 111 A A H 3X S+ 0 0 4 -4,-3.0 4,-1.4 1,-0.3 -2,-0.2 0.855 113.5 46.5 -49.9 -46.6 -2.0 11.3 43.6 100 112 A T H 3<>S+ 0 0 2 -4,-2.4 5,-3.1 2,-0.2 -1,-0.3 0.804 111.0 54.6 -68.4 -30.0 -1.2 15.0 43.9 101 113 A Y H X<5S+ 0 0 167 -4,-1.4 3,-2.4 -3,-0.6 -2,-0.2 0.959 107.9 47.5 -66.1 -51.6 -4.2 15.8 41.7 102 114 A Q H 3<5S+ 0 0 97 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.792 108.2 55.9 -59.9 -28.4 -6.5 13.8 44.0 103 115 A L T 3<5S- 0 0 26 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.439 125.1-111.0 -81.5 -0.9 -4.9 15.7 46.9 104 116 A G T < 5S+ 0 0 60 -3,-2.4 2,-0.3 1,-0.2 -3,-0.2 0.851 76.1 120.7 75.1 38.7 -6.0 18.8 45.0 105 117 A L < - 0 0 30 -5,-3.1 2,-0.7 -8,-0.1 -1,-0.2 -0.946 62.6-123.2-133.5 153.9 -2.6 20.1 43.9 106 118 A D > - 0 0 87 -2,-0.3 4,-1.3 1,-0.2 3,-0.3 -0.856 16.7-160.4 -96.5 114.2 -0.8 20.8 40.6 107 119 A M H >> S+ 0 0 2 -2,-0.7 4,-2.3 1,-0.2 3,-0.7 0.926 90.9 56.4 -59.0 -46.4 2.4 18.8 40.5 108 120 A E H 3> S+ 0 0 92 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.842 105.4 52.9 -54.8 -35.6 3.9 21.0 37.8 109 121 A E H 34 S+ 0 0 111 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.2 0.831 110.4 46.7 -70.8 -32.3 3.4 24.0 40.1 110 122 A L H X< S+ 0 0 0 -4,-1.3 3,-1.4 -3,-0.7 4,-0.4 0.811 105.4 59.8 -77.7 -33.5 5.3 22.3 43.0 111 123 A E H >< S+ 0 0 16 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.883 96.1 62.9 -61.8 -37.8 8.1 21.2 40.7 112 124 A E T 3< S+ 0 0 71 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.615 94.1 64.0 -63.8 -12.0 8.8 24.8 39.9 113 125 A I T < S+ 0 0 35 -3,-1.4 2,-0.3 -77,-0.1 -1,-0.3 0.677 76.4 102.9 -86.8 -20.2 9.6 25.4 43.6 114 126 A E S < S- 0 0 10 -3,-1.5 2,-0.2 -4,-0.4 -33,-0.1 -0.482 73.2-126.5 -68.9 129.4 12.7 23.1 43.7 115 127 A E - 0 0 61 -2,-0.3 -1,-0.1 55,-0.2 -2,-0.1 -0.503 25.3-110.8 -76.5 140.3 16.0 25.0 43.6 116 128 A D - 0 0 12 -2,-0.2 2,-1.3 -35,-0.1 -35,-0.2 -0.371 16.8-129.8 -67.6 145.8 18.5 24.1 41.0 117 129 A A E +J 80 0B 11 -37,-0.7 -37,-1.6 1,-0.1 2,-1.2 -0.753 34.2 179.8 -94.2 85.4 21.7 22.4 42.1 118 130 A G E +J 78 0B 3 -2,-1.3 35,-2.6 -39,-0.2 2,-0.7 -0.266 26.2 140.7 -86.8 52.3 23.9 24.8 40.2 119 131 A L E +J 77 0B 3 -2,-1.2 -42,-2.3 -42,-0.7 2,-0.3 -0.097 59.1 62.5 -86.2 41.5 27.3 23.4 41.2 120 132 A G - 0 0 0 -2,-0.7 33,-0.3 -44,-0.2 3,-0.1 -0.969 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3 S+ 0 0 21 -3,-0.5 3,-0.3 1,-0.3 -1,-0.2 0.849 91.5 36.7 -53.7 -42.8 41.1 20.4 38.0 330 342 A P T > S+ 0 0 0 0, 0.0 3,-1.8 0, 0.0 -1,-0.3 0.061 82.2 120.5 -98.0 25.2 41.6 17.1 39.9 331 343 A S T X + 0 0 0 -3,-2.0 3,-1.7 1,-0.3 -2,-0.1 0.705 56.1 75.3 -62.9 -21.7 45.1 16.6 38.5 332 344 A L T 3> S+ 0 0 0 -3,-0.3 4,-2.4 1,-0.3 -1,-0.3 0.591 75.4 83.3 -67.8 -6.9 46.8 16.7 41.9 333 345 A A H <> S+ 0 0 1 -3,-1.8 4,-2.1 2,-0.2 -1,-0.3 0.818 85.0 58.1 -63.1 -31.9 45.3 13.1 42.2 334 346 A I H <> S+ 0 0 0 -3,-1.7 4,-1.6 2,-0.2 3,-0.2 0.993 113.2 33.5 -64.9 -62.9 48.4 11.9 40.3 335 347 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.846 118.6 55.8 -63.6 -28.6 51.1 13.2 42.7 336 348 A E H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.867 105.5 50.5 -68.7 -37.7 48.7 12.6 45.7 337 349 A L H X S+ 0 0 2 -4,-2.1 4,-2.1 -3,-0.2 -1,-0.2 0.860 112.7 47.7 -67.4 -34.8 48.3 8.9 44.7 338 350 A M H X S+ 0 0 0 -4,-1.6 4,-3.3 2,-0.2 5,-0.5 0.921 107.8 55.3 -70.3 -44.3 52.1 8.7 44.5 339 351 A R H X>S+ 0 0 25 -4,-2.5 4,-1.9 1,-0.2 5,-1.0 0.925 111.8 43.6 -54.1 -48.4 52.6 10.4 47.9 340 352 A V H X>S+ 0 0 13 -4,-2.1 5,-2.9 3,-0.2 4,-1.0 0.958 116.8 45.0 -63.9 -51.7 50.3 7.9 49.6 341 353 A L H <5S+ 0 0 0 -4,-2.1 6,-2.5 3,-0.2 -2,-0.2 0.899 126.4 30.2 -59.5 -45.4 51.8 4.8 47.9 342 354 A V H <5S+ 0 0 28 -4,-3.3 4,-0.5 4,-0.3 -3,-0.2 0.963 129.2 33.4 -79.6 -58.7 55.4 5.9 48.4 343 355 A D H <5S+ 0 0 9 -4,-1.9 -3,-0.2 -5,-0.5 -2,-0.1 0.926 134.3 21.9 -66.6 -48.9 55.4 7.9 51.6 344 356 A L T < - 0 0 93 -2,-0.2 4,-2.5 1,-0.1 3,-0.5 -0.434 36.3-108.2 -72.6 152.1 59.2 1.8 45.6 349 361 A W H > S+ 0 0 38 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.915 115.6 48.9 -43.0 -62.3 58.8 4.7 43.1 350 362 A D H > S+ 0 0 101 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.812 112.3 46.8 -51.9 -40.1 58.6 2.6 40.0 351 363 A K H > S+ 0 0 33 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.906 114.2 49.1 -69.6 -41.0 56.0 0.2 41.3 352 364 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.926 110.6 50.1 -62.6 -45.6 53.9 3.1 42.6 353 365 A W H X S+ 0 0 55 -4,-3.1 4,-2.8 -5,-0.2 5,-0.3 0.893 107.8 53.6 -61.1 -41.8 54.2 5.0 39.2 354 366 A E H X S+ 0 0 93 -4,-1.8 4,-1.7 -5,-0.2 -1,-0.2 0.916 111.0 45.9 -59.9 -43.9 53.1 1.9 37.4 355 367 A V H X S+ 0 0 0 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.950 113.8 49.5 -63.7 -48.5 50.0 1.6 39.5 356 368 A T H >X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 3,-1.0 0.938 111.0 46.5 -57.1 -54.5 49.2 5.3 39.2 357 369 A V H 3< S+ 0 0 27 -4,-2.8 81,-0.9 1,-0.3 -1,-0.2 0.887 112.4 53.9 -57.2 -39.0 49.5 5.6 35.4 358 370 A K H 3< S+ 0 0 95 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.698 111.8 41.1 -72.2 -20.9 47.4 2.5 35.1 359 371 A T H << S+ 0 0 3 -4,-1.2 -36,-2.8 -3,-1.0 2,-0.3 0.677 102.8 79.2-101.7 -14.2 44.5 3.7 37.2 360 372 A C E < +g 323 0A 1 -4,-1.7 78,-2.2 76,-0.3 79,-0.5 -0.688 48.5 177.6-100.0 146.4 44.3 7.3 35.9 361 373 A A E -g 324 0A 2 -38,-1.5 -36,-3.4 -2,-0.3 2,-0.4 -0.997 15.3-146.1-144.6 137.1 42.8 8.8 32.8 362 374 A Y E -gh 325 440A 1 77,-2.5 79,-2.1 -2,-0.3 2,-0.5 -0.883 3.8-159.6-114.0 135.4 42.5 12.4 31.7 363 375 A T E -gh 326 441A 0 -38,-2.3 -36,-1.2 -2,-0.4 2,-0.3 -0.948 11.2-153.4-111.9 122.0 39.8 14.2 29.7 364 376 A N - 0 0 3 77,-2.3 79,-0.2 -2,-0.5 3,-0.1 -0.744 12.6-178.6 -93.6 139.7 40.7 17.5 28.0 365 377 A H + 0 0 22 -2,-0.3 296,-0.4 1,-0.2 2,-0.3 0.514 57.8 20.2-116.8 -8.4 37.9 20.0 27.3 366 378 A T - 0 0 6 295,-0.1 -1,-0.2 294,-0.1 294,-0.1 -0.997 41.7-154.8-159.5 160.0 39.5 23.0 25.5 367 379 A V + 0 0 28 292,-0.4 -1,-0.1 -2,-0.3 293,-0.1 0.414 59.4 114.8-115.4 -4.6 42.4 24.3 23.5 368 380 A I > - 0 0 9 291,-0.3 3,-1.5 1,-0.1 4,-0.4 -0.547 64.0-137.4 -72.9 131.8 42.4 28.0 24.3 369 381 A P G > S+ 0 0 69 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.786 98.7 61.2 -55.6 -37.9 45.5 29.0 26.2 370 382 A E G 3 S+ 0 0 51 1,-0.2 -96,-2.9 -98,-0.1 -2,-0.1 0.615 100.9 56.3 -70.1 -11.5 43.8 31.2 28.8 371 383 A A G < S+ 0 0 15 -3,-1.5 2,-0.3 -98,-0.3 -98,-0.2 0.558 85.1 107.7 -93.9 -10.3 41.8 28.1 30.0 372 384 A L S < S- 0 0 16 -3,-1.1 2,-0.8 -4,-0.4 -98,-0.1 -0.511 71.7-125.8 -75.6 129.4 45.0 26.1 30.7 373 385 A E + 0 0 5 -2,-0.3 56,-2.3 -100,-0.0 2,-0.5 -0.643 37.1 163.2 -80.8 108.9 46.0 25.5 34.3 374 386 A R E -N 428 0F 72 -2,-0.8 54,-0.2 54,-0.2 -98,-0.1 -0.876 21.8-159.0-125.5 94.8 49.6 26.7 35.0 375 387 A W E -N 427 0F 0 52,-1.5 52,-2.1 -2,-0.5 5,-0.0 -0.606 22.1-115.0 -80.6 128.3 50.1 27.0 38.7 376 388 A P E >> -N 426 0F 12 0, 0.0 4,-1.4 0, 0.0 3,-0.8 -0.342 20.3-132.7 -59.5 137.2 53.0 29.2 40.0 377 389 A V H 3> S+ 0 0 8 48,-2.5 4,-2.8 1,-0.2 5,-0.2 0.849 102.8 63.5 -62.0 -35.6 55.6 27.1 41.8 378 390 A H H 3> S+ 0 0 107 47,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.836 103.7 50.8 -60.5 -28.4 55.8 29.5 44.8 379 391 A L H <> S+ 0 0 22 -3,-0.8 4,-2.5 2,-0.2 5,-0.3 0.940 113.3 41.5 -73.1 -47.9 52.1 28.6 45.5 380 392 A L H X S+ 0 0 0 -4,-1.4 4,-1.9 1,-0.2 8,-0.3 0.842 111.9 59.3 -65.9 -33.6 52.6 24.8 45.3 381 393 A E H < S+ 0 0 112 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.905 113.4 35.5 -59.8 -46.7 55.8 25.3 47.3 382 394 A T H < S+ 0 0 76 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.914 127.7 33.4 -75.5 -47.9 54.0 27.0 50.2 383 395 A L H < S+ 0 0 0 -4,-2.5 -192,-2.4 1,-0.2 -3,-0.2 0.853 133.5 19.1 -81.3 -41.6 50.7 25.0 50.2 384 396 A L X + 0 0 0 -4,-1.9 4,-1.6 -5,-0.3 3,-0.5 -0.498 67.3 166.3-133.1 67.6 51.7 21.5 49.1 385 397 A P H > S+ 0 0 19 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.836 77.2 47.6 -48.7 -47.1 55.5 21.1 49.6 386 398 A R H > S+ 0 0 25 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.838 108.5 54.2 -69.2 -33.3 55.7 17.4 49.2 387 399 A H H > S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.834 105.2 54.0 -69.5 -31.7 53.6 17.4 46.1 388 400 A L H X S+ 0 0 10 -4,-1.6 4,-2.4 -8,-0.3 5,-0.2 0.939 108.1 50.3 -65.9 -44.8 55.9 19.9 44.4 389 401 A Q H X S+ 0 0 64 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.875 111.2 48.5 -59.1 -40.0 58.9 17.5 45.2 390 402 A I H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.896 109.7 51.5 -68.9 -39.8 57.0 14.6 43.6 391 403 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.888 109.0 50.7 -63.5 -41.7 56.1 16.6 40.5 392 404 A Y H X S+ 0 0 70 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.901 112.3 47.6 -63.1 -40.7 59.7 17.6 40.0 393 405 A E H X S+ 0 0 44 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.840 111.5 49.5 -69.5 -35.6 60.7 13.9 40.4 394 406 A I H X S+ 0 0 4 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.938 112.8 48.4 -66.9 -45.1 58.0 12.9 37.9 395 407 A N H X S+ 0 0 16 -4,-2.9 4,-2.9 1,-0.2 5,-0.3 0.915 108.3 54.5 -58.7 -47.0 59.2 15.6 35.5 396 408 A Q H X S+ 0 0 117 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.925 113.0 41.4 -53.7 -49.8 62.9 14.4 35.9 397 409 A R H X S+ 0 0 95 -4,-1.8 4,-1.1 2,-0.2 -1,-0.2 0.859 115.1 50.4 -69.7 -37.2 62.1 10.8 35.0 398 410 A F H >X S+ 0 0 10 -4,-2.3 4,-2.0 2,-0.2 3,-0.7 0.941 109.0 50.1 -67.0 -48.7 59.7 11.7 32.2 399 411 A L H 3X S+ 0 0 31 -4,-2.9 4,-3.1 1,-0.3 5,-0.2 0.884 106.5 57.1 -59.0 -36.9 62.1 14.1 30.5 400 412 A N H 3X S+ 0 0 108 -4,-1.6 4,-1.8 -5,-0.3 -1,-0.3 0.845 104.7 52.5 -62.3 -31.8 64.8 11.4 30.7 401 413 A R H X S+ 0 0 0 -4,-2.0 4,-3.5 2,-0.2 3,-0.8 0.948 109.7 52.0 -62.6 -51.1 62.0 11.9 26.1 403 415 A A H 3< S+ 0 0 38 -4,-3.1 -1,-0.2 1,-0.3 6,-0.2 0.892 110.6 50.1 -53.0 -42.4 65.8 12.5 25.9 404 416 A A H 3< S+ 0 0 80 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.746 116.0 41.7 -68.7 -26.9 66.3 8.8 25.3 405 417 A A H << S+ 0 0 52 -4,-1.2 -2,-0.2 -3,-0.8 -1,-0.2 0.827 126.6 30.6 -89.3 -37.6 63.6 8.7 22.6 406 418 A F S >< S- 0 0 48 -4,-3.5 3,-1.8 -5,-0.1 -1,-0.2 -0.661 84.5-159.0-123.0 75.0 64.6 12.0 20.8 407 419 A P T 3 S+ 0 0 107 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.318 76.1 6.3 -57.2 123.3 68.4 12.3 21.4 408 420 A G T 3 S+ 0 0 78 1,-0.2 2,-2.2 -5,-0.1 3,-0.2 0.330 86.2 129.6 87.0 -9.7 69.7 15.8 21.0 409 421 A D <> + 0 0 55 -3,-1.8 4,-1.2 1,-0.2 -1,-0.2 -0.505 26.2 165.7 -79.2 76.2 66.2 17.4 20.6 410 422 A V H > + 0 0 112 -2,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.778 68.8 52.8 -65.4 -29.8 66.9 20.0 23.2 411 423 A D H > S+ 0 0 68 1,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.900 104.0 56.8 -74.0 -37.4 63.9 22.2 22.3 412 424 A R H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.859 102.3 58.6 -58.4 -36.4 61.5 19.3 22.6 413 425 A L H X S+ 0 0 49 -4,-1.2 4,-1.1 1,-0.2 -1,-0.2 0.934 109.6 40.1 -60.1 -50.2 62.8 18.9 26.2 414 426 A R H < S+ 0 0 161 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.852 114.5 55.1 -69.4 -32.8 61.8 22.4 27.3 415 427 A R H < S+ 0 0 80 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.839 112.5 41.1 -67.2 -37.3 58.5 22.2 25.3 416 428 A M H < S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.632 86.7 121.2 -87.6 -16.7 57.4 19.0 27.0 417 429 A S < - 0 0 14 -4,-1.1 14,-0.1 -5,-0.2 11,-0.1 -0.032 62.0-141.3 -48.8 147.6 58.5 19.9 30.6 418 430 A L S S+ 0 0 0 -27,-0.1 10,-3.4 13,-0.1 2,-0.5 0.690 91.8 71.0 -81.2 -18.6 55.9 19.9 33.3 419 431 A V E S-O 427 0F 14 8,-0.2 2,-0.5 -27,-0.1 8,-0.2 -0.876 72.9-157.6-102.2 125.0 57.8 23.0 34.6 420 432 A E E -O 426 0F 52 6,-2.5 6,-1.9 -2,-0.5 2,-0.2 -0.902 8.2-150.8-105.6 125.8 57.6 26.2 32.6 421 433 A E + 0 0 133 -2,-0.5 2,-0.3 4,-0.2 3,-0.1 -0.495 46.9 77.1 -90.3 160.5 60.4 28.8 33.0 422 434 A G S S- 0 0 55 1,-0.2 3,-0.1 -2,-0.2 -2,-0.0 -0.984 93.4 -2.1 143.7-153.9 60.0 32.5 32.6 423 435 A A S S- 0 0 114 -2,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.901 139.1 -1.5 -34.1 -70.0 58.7 35.5 34.6 424 436 A V S S- 0 0 55 -3,-0.1 2,-0.2 -47,-0.0 -1,-0.2 -0.946 88.3-109.7-124.2 145.0 57.5 33.1 37.3 425 437 A K - 0 0 79 -2,-0.4 -48,-2.5 -3,-0.1 -47,-0.4 -0.553 42.4-175.4 -73.7 141.8 58.0 29.3 37.2 426 438 A R E -NO 376 420F 86 -6,-1.9 -6,-2.5 -50,-0.3 2,-0.5 -0.875 26.1-123.8-134.0 164.8 54.7 27.5 36.7 427 439 A I E -NO 375 419F 0 -52,-2.1 -52,-1.5 -2,-0.3 2,-1.1 -0.964 21.1-138.6-113.6 120.7 53.6 23.9 36.6 428 440 A N E > -N 374 0F 8 -10,-3.4 4,-1.6 -2,-0.5 3,-0.4 -0.684 15.4-167.1 -80.0 102.4 51.7 22.9 33.5 429 441 A M H > S+ 0 0 0 -56,-2.3 4,-1.9 -2,-1.1 -1,-0.2 0.818 83.6 57.6 -62.5 -32.2 48.9 20.7 34.9 430 442 A A H > S+ 0 0 0 -57,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.886 105.3 50.5 -66.1 -38.1 47.9 19.3 31.5 431 443 A H H > S+ 0 0 18 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.883 108.6 54.0 -66.4 -36.5 51.5 18.0 30.9 432 444 A L H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.902 108.7 48.8 -60.6 -44.8 51.2 16.4 34.4 433 445 A C H < S+ 0 0 0 -4,-1.9 4,-0.4 2,-0.2 -2,-0.2 0.905 109.3 50.5 -65.8 -43.6 48.0 14.6 33.4 434 446 A I H >< S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 -1,-0.2 0.925 113.1 46.9 -61.3 -44.6 49.3 13.2 30.1 435 447 A A H 3< S+ 0 0 5 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.870 117.1 41.2 -66.3 -38.7 52.4 11.8 31.8 436 448 A G T 3< S+ 0 0 0 -4,-2.0 2,-0.3 -5,-0.2 -76,-0.3 0.228 104.9 76.3 -97.7 16.3 50.6 10.2 34.7 437 449 A S < - 0 0 0 -3,-0.8 -76,-0.2 -4,-0.4 -79,-0.1 -0.937 64.6-147.0-125.9 148.1 47.6 8.8 32.8 438 450 A H S S+ 0 0 62 -78,-2.2 2,-0.3 -81,-0.9 -77,-0.2 0.553 88.7 34.8 -89.1 -6.9 47.2 5.8 30.5 439 451 A A - 0 0 0 -79,-0.5 -77,-2.5 -82,-0.1 2,-0.4 -0.982 58.7-173.2-150.6 135.4 44.6 7.5 28.3 440 452 A V E -hi 362 467A 0 26,-2.3 28,-2.9 -2,-0.3 2,-0.4 -0.997 19.4-170.2-126.7 128.2 44.1 11.1 27.2 441 453 A N E -hi 363 468A 1 -79,-2.1 -77,-2.3 -2,-0.4 28,-0.2 -0.947 20.2-143.0-133.0 148.9 40.9 11.9 25.3 442 454 A G E - i 0 469A 0 26,-1.5 28,-1.6 -2,-0.4 -77,-0.1 -0.475 23.2-129.7 -90.5 169.2 39.3 14.7 23.3 443 455 A V S S+ 0 0 2 1,-0.2 29,-2.3 26,-0.2 2,-0.3 0.370 88.2 23.5-105.0 4.3 35.6 15.4 23.6 444 456 A A S > S- 0 0 0 27,-0.2 4,-2.9 1,-0.1 5,-0.2 -0.952 84.9-107.6-162.5 149.2 34.9 15.5 19.8 445 457 A R H > S+ 0 0 89 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.871 117.9 42.9 -51.3 -47.8 36.6 14.0 16.8 446 458 A I H > S+ 0 0 37 236,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.902 115.1 50.3 -67.9 -38.8 38.0 17.3 15.4 447 459 A H H > S+ 0 0 4 214,-0.5 4,-1.8 1,-0.2 -2,-0.2 0.901 109.9 51.7 -62.5 -42.0 39.0 18.4 18.9 448 460 A S H X S+ 0 0 4 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.869 111.0 47.4 -64.1 -37.5 40.8 15.1 19.4 449 461 A E H X S+ 0 0 67 -4,-1.8 4,-2.3 -5,-0.2 5,-0.3 0.910 108.0 54.9 -69.9 -42.2 42.7 15.5 16.2 450 462 A I H X S+ 0 0 30 -4,-2.5 4,-2.9 1,-0.2 5,-0.4 0.855 104.2 55.7 -58.7 -36.8 43.7 19.0 16.9 451 463 A L H <>S+ 0 0 2 -4,-1.8 5,-2.3 1,-0.2 -1,-0.2 0.912 111.9 43.0 -61.9 -43.0 45.2 17.8 20.2 452 464 A K H <5S+ 0 0 41 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.819 120.7 40.0 -72.3 -35.3 47.4 15.4 18.3 453 465 A K H <5S+ 0 0 119 -4,-2.3 -2,-0.2 -5,-0.1 -3,-0.2 0.790 133.3 5.0 -84.9 -31.7 48.3 17.8 15.6 454 466 A T T ><5S+ 0 0 94 -4,-2.9 3,-2.1 -5,-0.3 4,-0.3 0.599 122.5 31.2-116.1 -96.9 48.8 20.8 17.7 455 467 A I T 3 5S+ 0 0 73 -5,-0.4 3,-0.2 1,-0.3 -4,-0.2 0.818 132.9 23.6 -40.1 -51.7 48.7 21.3 21.4 456 468 A F T 3> S+ 0 0 99 -3,-2.1 4,-2.1 1,-0.2 5,-0.2 0.911 74.8 49.1 -51.8 -53.2 51.8 16.9 19.3 458 470 A D H > S+ 0 0 21 -4,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.869 112.5 48.8 -55.8 -40.9 55.1 16.2 21.1 459 471 A F H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.849 109.4 52.4 -69.1 -36.0 53.3 14.0 23.6 460 472 A Y H < S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.868 107.5 51.3 -67.9 -37.5 51.5 12.1 20.9 461 473 A E H < S+ 0 0 73 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.839 112.6 48.4 -67.7 -32.1 54.8 11.4 19.1 462 474 A L H < S+ 0 0 27 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.944 133.7 7.7 -73.4 -52.2 56.1 10.0 22.4 463 475 A E >X + 0 0 16 -4,-2.5 3,-1.4 1,-0.1 4,-0.6 -0.678 65.2 171.9-135.9 81.5 53.2 7.8 23.3 464 476 A P T 34 S+ 0 0 63 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.750 75.0 68.8 -59.7 -26.5 50.7 7.6 20.4 465 477 A H T 34 S+ 0 0 134 1,-0.2 -5,-0.1 -5,-0.0 -2,-0.0 0.736 89.3 63.0 -67.7 -24.5 48.7 4.8 22.3 466 478 A K T <4 S+ 0 0 5 -3,-1.4 -26,-2.3 -27,-0.1 2,-0.3 0.899 84.2 87.9 -68.3 -41.0 47.5 7.2 25.0 467 479 A F E < +i 440 0A 21 -4,-0.6 2,-0.2 -3,-0.3 -26,-0.2 -0.446 50.5 148.5 -73.9 125.9 45.5 9.5 22.8 468 480 A Q E -i 441 0A 47 -28,-2.9 -26,-1.5 -2,-0.3 2,-0.3 -0.720 35.2-124.6-136.1-175.7 41.8 8.7 22.1 469 481 A N E +i 442 0A 43 -28,-0.2 2,-0.3 -2,-0.2 -26,-0.2 -0.991 16.8 179.3-139.0 144.4 38.5 10.4 21.4 470 482 A K - 0 0 0 -28,-1.6 334,-0.1 -2,-0.3 -29,-0.0 -0.758 26.0-140.8-146.9 92.9 35.2 10.1 23.1 471 483 A T - 0 0 4 -2,-0.3 -27,-0.2 1,-0.1 -28,-0.1 -0.333 26.4-116.2 -58.2 132.1 32.6 12.3 21.5 472 484 A N + 0 0 11 -29,-2.3 2,-0.3 191,-0.1 -1,-0.1 0.011 36.5 179.4 -60.2 174.8 30.4 13.9 24.2 473 485 A G - 0 0 1 328,-0.1 2,-0.3 330,-0.0 327,-0.3 -0.940 20.2-122.8-166.2 176.1 26.7 13.2 24.5 474 486 A I B -p 800 0G 5 325,-2.6 327,-2.5 -2,-0.3 328,-0.4 -0.864 33.2 -97.2-130.2 161.5 23.7 14.1 26.6 475 487 A T > - 0 0 1 -2,-0.3 4,-2.2 325,-0.2 5,-0.1 -0.718 21.1-151.8 -85.2 122.3 21.2 12.0 28.6 476 488 A P T 4>S+ 0 0 1 0, 0.0 5,-1.9 0, 0.0 4,-0.4 0.696 90.5 66.0 -64.7 -16.6 17.9 11.3 26.6 477 489 A R I >4>S+ 0 0 0 3,-0.2 5,-2.9 2,-0.2 3,-0.7 0.993 114.2 22.3 -69.7 -64.9 16.1 11.1 29.9 478 490 A R I 34>S+ 0 0 13 1,-0.2 5,-1.0 3,-0.2 -1,-0.1 0.894 127.7 51.3 -70.7 -37.8 16.4 14.7 31.2 479 491 A W I 3<5S+ 0 0 1 -4,-2.2 -1,-0.2 3,-0.1 -2,-0.2 0.322 131.6 4.0 -85.6 11.4 17.0 16.1 27.7 480 492 A L I <>5S+ 0 0 0 -3,-0.7 4,-2.9 -4,-0.4 8,-0.3 0.193 130.7 41.5-149.8 -76.0 14.0 14.5 26.0 481 493 A V I 4 S+ 0 0 38 0, 0.0 4,-2.5 0, 0.0 -482,-0.2 0.840 75.1 62.0 -63.8 -30.4 7.2 14.6 27.1 486 498 A G H > S+ 0 0 25 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.921 108.3 39.9 -61.5 -44.7 5.0 15.6 24.1 487 499 A L H > S+ 0 0 4 -3,-0.2 4,-1.8 1,-0.2 5,-0.2 0.904 114.1 54.5 -72.2 -39.9 7.7 14.7 21.6 488 500 A A H X S+ 0 0 7 -4,-2.2 4,-2.2 -8,-0.3 -2,-0.2 0.887 107.0 52.4 -60.5 -38.3 8.7 11.6 23.5 489 501 A E H X S+ 0 0 53 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.959 108.7 46.7 -64.5 -52.0 5.1 10.4 23.4 490 502 A I H X S+ 0 0 8 -4,-1.7 4,-0.8 1,-0.2 -1,-0.2 0.834 112.9 51.0 -61.4 -32.2 4.5 10.7 19.7 491 503 A I H >X S+ 0 0 1 -4,-1.8 4,-2.8 1,-0.2 3,-0.8 0.936 110.7 48.9 -67.7 -45.3 7.8 8.9 19.0 492 504 A A H 3X S+ 0 0 17 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.795 101.0 64.5 -64.2 -31.1 6.8 6.1 21.4 493 505 A E H 3< S+ 0 0 113 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.825 115.6 30.2 -62.0 -31.3 3.4 5.8 19.6 494 506 A R H << S+ 0 0 58 -3,-0.8 -2,-0.2 -4,-0.8 -1,-0.1 0.886 136.3 18.0 -94.8 -49.5 5.3 4.7 16.5 495 507 A I H < S- 0 0 21 -4,-2.8 3,-0.3 1,-0.3 -3,-0.2 0.405 99.5-119.3-109.8 5.2 8.5 2.9 17.7 496 508 A G < - 0 0 32 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 -0.467 34.1 -71.3 94.8-168.5 8.0 2.0 21.3 497 509 A E S > S+ 0 0 87 -2,-0.1 3,-1.6 1,-0.1 4,-0.3 0.490 100.5 92.3-109.7 -9.3 9.8 2.9 24.5 498 510 A E G > S+ 0 0 106 -3,-0.3 3,-1.1 1,-0.3 4,-0.2 0.710 72.2 74.5 -63.4 -16.9 13.0 1.0 24.2 499 511 A Y G > S+ 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1,-0.2 -1,-0.3 0.624 76.3 81.6 -77.8 -14.5 11.7 7.3 12.6 510 522 A L G X S+ 0 0 64 -3,-2.4 3,-1.3 1,-0.3 -1,-0.2 0.821 83.5 61.2 -59.1 -31.9 13.4 7.9 9.2 511 523 A S G < S+ 0 0 97 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.1 0.397 99.8 54.2 -79.3 6.0 10.6 5.7 7.7 512 524 A Y G X S+ 0 0 61 -3,-1.9 3,-1.4 1,-0.1 7,-0.3 0.257 73.6 107.4-118.0 7.8 7.9 8.2 8.9 513 525 A V T < S+ 0 0 14 -3,-1.3 -2,-0.1 1,-0.3 -1,-0.1 0.653 90.9 34.2 -60.9 -17.3 9.6 11.1 7.2 514 526 A D T 3 S+ 0 0 101 -4,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.304 89.7 121.8-118.3 2.9 6.9 11.1 4.5 515 527 A D <> - 0 0 52 -3,-1.4 4,-2.2 1,-0.2 5,-0.2 -0.572 54.1-151.9 -71.8 120.8 4.1 10.0 7.0 516 528 A E H > S+ 0 0 81 -2,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.847 91.9 48.1 -62.7 -40.2 1.4 12.7 6.9 517 529 A A H > S+ 0 0 40 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 112.4 48.8 -69.4 -44.2 0.2 12.2 10.5 518 530 A F H > S+ 0 0 2 2,-0.2 4,-3.4 1,-0.2 5,-0.4 0.943 109.0 51.6 -61.4 -51.0 3.7 12.2 12.0 519 531 A I H X S+ 0 0 7 -4,-2.2 4,-2.0 -7,-0.3 -1,-0.2 0.911 112.2 48.3 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34.8 33.4 540 552 A E H <5S+ 0 0 88 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.670 142.2 22.1 -85.1 -23.2 7.6 35.1 35.1 541 553 A Y T < - 0 0 30 -2,-0.3 3,-1.6 80,-0.1 83,-0.1 -0.886 17.1-158.7-106.5 113.5 4.7 36.2 19.0 547 559 A P T 3 S+ 0 0 27 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.497 88.8 64.3 -65.7 -5.0 4.5 32.3 18.9 548 560 A N T 3 S+ 0 0 117 2,-0.1 3,-0.1 -18,-0.1 -17,-0.0 0.655 86.4 89.3 -93.3 -16.7 4.1 32.2 15.2 549 561 A S S < S- 0 0 0 -3,-1.6 2,-0.4 1,-0.1 40,-0.3 -0.187 94.3 -88.4 -74.8 169.1 7.5 33.7 14.5 550 562 A L E -q 589 0H 0 38,-2.8 40,-3.1 1,-0.1 2,-1.1 -0.664 38.2-132.5 -79.0 131.5 10.7 31.6 14.1 551 563 A F E -q 590 0H 0 -2,-0.4 99,-2.3 38,-0.2 98,-1.9 -0.767 26.1-173.4 -92.6 98.0 12.3 31.0 17.5 552 564 A D E +qr 591 650H 0 38,-2.4 40,-3.3 -2,-1.1 2,-0.4 -0.798 13.1 177.5 -92.3 103.5 16.0 31.9 17.0 553 565 A V E +qr 592 651H 1 97,-2.3 99,-1.8 -2,-0.8 2,-0.5 -0.927 27.5 177.5-127.7 139.4 17.9 31.0 20.1 554 566 A Q E +q 593 0H 1 38,-2.7 40,-2.2 -2,-0.4 2,-0.5 -0.953 18.0 169.3-126.6 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151.6 22.1 21.2 8.3 697 709 A F E +u 677 0H 10 -21,-2.4 -19,-2.2 -2,-0.3 2,-0.3 -0.708 37.6 173.5-106.5 80.8 22.8 24.9 7.8 698 710 A I E +u 678 0H 22 -2,-0.9 2,-0.3 -5,-0.3 -19,-0.2 -0.700 5.5 152.0 -91.7 138.2 26.6 25.0 7.7 699 711 A F + 0 0 1 -21,-1.8 -19,-0.4 -2,-0.3 69,-0.1 -0.870 27.2 41.6-149.0 179.3 28.5 28.2 6.9 700 712 A G S S- 0 0 2 -2,-0.3 64,-0.1 -21,-0.1 -20,-0.1 0.061 86.5 -23.8 72.3-179.0 31.8 30.0 7.5 701 713 A M - 0 0 20 1,-0.1 -21,-0.5 2,-0.1 -44,-0.3 -0.222 52.2-140.5 -64.5 151.3 35.5 29.1 7.7 702 714 A R > - 0 0 87 -23,-0.1 4,-1.8 -45,-0.1 3,-0.4 -0.553 41.4 -90.5-102.0 175.7 36.7 25.6 8.4 703 715 A V H > S+ 0 0 22 -23,-0.3 4,-2.2 1,-0.2 5,-0.2 0.913 128.4 54.7 -51.5 -47.4 39.7 25.1 10.6 704 716 A E H > S+ 0 0 120 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.852 106.3 51.4 -54.2 -39.8 42.0 25.2 7.5 705 717 A D H > S+ 0 0 53 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.888 107.5 53.1 -72.3 -36.0 40.6 28.6 6.4 706 718 A V H X S+ 0 0 14 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.951 111.0 45.9 -62.2 -48.5 41.2 30.0 9.8 707 719 A D H X S+ 0 0 80 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.852 109.4 54.2 -62.8 -37.1 44.8 29.0 9.8 708 720 A R H X S+ 0 0 164 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.927 109.4 50.2 -62.5 -42.3 45.3 30.3 6.2 709 721 A L H X S+ 0 0 7 -4,-2.2 4,-3.1 1,-0.2 -2,-0.2 0.804 108.5 51.4 -65.6 -32.7 44.0 33.6 7.5 710 722 A D H < S+ 0 0 84 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.867 107.8 51.1 -74.7 -37.4 46.4 33.6 10.4 711 723 A Q H < S+ 0 0 155 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.983 117.3 41.7 -58.4 -54.9 49.4 33.0 8.2 712 724 A R H < S- 0 0 157 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.911 121.4-110.2 -55.4 -50.5 48.2 35.8 6.0 713 725 A G < - 0 0 37 -4,-3.1 2,-0.6 -5,-0.2 -3,-0.2 0.191 24.4-106.3 115.5 121.7 47.3 38.1 9.0 714 726 A Y - 0 0 46 -4,-0.1 2,-0.5 -2,-0.1 43,-0.1 -0.695 35.5-178.9 -84.0 121.3 43.7 38.9 9.9 715 727 A N >> - 0 0 87 -2,-0.6 3,-0.9 1,-0.1 4,-0.7 -0.926 12.1-170.6-121.6 105.5 42.8 42.5 9.0 716 728 A A H 3> S+ 0 0 4 -2,-0.5 4,-1.8 38,-0.4 5,-0.2 0.746 81.0 71.8 -65.0 -26.6 39.2 43.4 10.0 717 729 A Q H 3> S+ 0 0 70 37,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.848 89.4 61.4 -57.7 -37.9 39.4 46.7 8.1 718 730 A E H <> S+ 0 0 56 -3,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.947 107.8 42.9 -53.4 -54.0 39.3 44.8 4.7 719 731 A Y H X S+ 0 0 45 -4,-0.7 4,-1.3 1,-0.2 -1,-0.2 0.843 112.8 52.5 -62.2 -37.0 35.9 43.4 5.6 720 732 A Y H < S+ 0 0 30 -4,-1.8 7,-0.3 1,-0.2 -1,-0.2 0.892 111.6 48.4 -66.2 -37.6 34.7 46.8 6.9 721 733 A D H < S+ 0 0 88 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.871 116.1 40.3 -70.2 -40.8 35.9 48.3 3.6 722 734 A R H < S+ 0 0 176 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.526 106.1 64.1 -90.6 -8.0 34.2 45.8 1.3 723 735 A I X - 0 0 11 -4,-1.3 4,-2.4 -5,-0.2 -1,-0.2 -0.893 55.8-172.8-122.2 103.1 30.8 45.3 3.0 724 736 A P H > S+ 0 0 80 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.869 87.9 53.7 -58.9 -41.4 28.6 48.4 3.2 725 737 A E H > S+ 0 0 55 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.892 111.2 46.9 -61.9 -39.4 26.0 46.7 5.5 726 738 A L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.930 112.1 50.3 -66.1 -45.7 28.8 45.8 7.9 727 739 A R H X S+ 0 0 78 -4,-2.4 4,-2.2 -7,-0.3 5,-0.2 0.928 107.3 54.6 -57.1 -47.6 30.2 49.3 7.7 728 740 A Q H X S+ 0 0 89 -4,-3.0 4,-0.9 1,-0.2 -1,-0.2 0.854 108.8 48.3 -56.1 -39.8 26.7 50.7 8.4 729 741 A I H >X S+ 0 0 1 -4,-1.5 4,-2.1 2,-0.2 3,-0.6 0.947 109.9 50.1 -67.9 -49.7 26.4 48.6 11.6 730 742 A I H 3X S+ 0 0 5 -4,-2.2 4,-2.1 1,-0.3 -2,-0.2 0.854 111.2 49.3 -58.4 -36.5 29.8 49.6 13.0 731 743 A E H 3X S+ 0 0 101 -4,-2.2 4,-1.3 2,-0.2 -1,-0.3 0.744 107.3 55.7 -77.0 -20.5 29.1 53.3 12.4 732 744 A Q H S+ 0 0 22 -4,-0.9 5,-2.0 -3,-0.6 6,-0.6 0.899 110.6 44.6 -73.4 -42.3 25.8 52.9 14.2 733 745 A L H ><5S+ 0 0 4 -4,-2.1 3,-0.6 1,-0.2 13,-0.4 0.895 114.2 50.5 -66.3 -41.9 27.5 51.4 17.2 734 746 A S H 3<5S+ 0 0 68 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.764 111.0 47.4 -68.7 -29.1 30.2 54.1 17.1 735 747 A S H 3<5S- 0 0 86 -4,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.457 115.4-105.7 -96.1 -0.8 27.8 57.0 16.9 736 748 A G T X<5S+ 0 0 7 -3,-0.6 3,-1.0 -4,-0.5 -3,-0.2 0.603 71.4 141.1 90.8 11.2 25.5 56.0 19.7 737 749 A F T 3 S+ 0 0 90 -6,-0.1 3,-1.9 1,-0.1 -1,-0.3 -0.725 71.1 177.9-127.9 81.4 26.1 57.4 26.3 743 755 A P T 3 S+ 0 0 68 0, 0.0 3,-0.3 0, 0.0 -7,-0.3 0.721 81.9 46.0 -54.4 -29.7 27.3 57.6 22.7 744 756 A D T > S+ 0 0 98 1,-0.2 3,-1.8 -9,-0.1 4,-0.3 0.295 78.2 112.6-100.5 12.3 30.7 56.1 23.4 745 757 A L T < S+ 0 0 28 -3,-1.9 3,-0.4 -6,-0.3 -1,-0.2 0.842 80.8 41.9 -50.9 -41.4 29.4 53.3 25.5 746 758 A F T 3> S+ 0 0 2 -13,-0.4 4,-1.8 -3,-0.3 -1,-0.3 -0.019 75.7 114.6-101.4 32.5 30.3 50.6 23.0 747 759 A K H <> S+ 0 0 118 -3,-1.8 4,-2.8 1,-0.2 5,-0.2 0.825 74.6 56.9 -69.1 -31.2 33.8 51.9 22.0 748 760 A D H > S+ 0 0 58 -3,-0.4 4,-2.3 -4,-0.3 -1,-0.2 0.889 107.3 47.5 -66.8 -40.5 35.5 48.9 23.5 749 761 A I H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.946 116.2 43.0 -65.5 -49.7 33.5 46.4 21.4 750 762 A V H X S+ 0 0 15 -4,-1.8 4,-2.4 2,-0.2 5,-0.3 0.936 114.0 51.6 -61.5 -48.7 34.1 48.4 18.1 751 763 A N H X S+ 0 0 73 -4,-2.8 4,-2.4 1,-0.2 5,-0.4 0.927 113.9 44.3 -53.9 -47.9 37.8 48.9 19.0 752 764 A M H X S+ 0 0 10 -4,-2.3 4,-2.3 3,-0.2 -2,-0.2 0.916 111.5 52.3 -63.7 -46.8 38.2 45.2 19.6 753 765 A L H < S+ 0 0 2 -4,-2.8 4,-0.3 1,-0.2 9,-0.2 0.856 117.6 38.4 -58.4 -40.0 36.3 44.1 16.5 754 766 A M H < S+ 0 0 29 -4,-2.4 -38,-0.4 -5,-0.2 -37,-0.3 0.808 133.8 17.4 -83.2 -32.8 38.4 46.3 14.3 755 767 A H H < S+ 0 0 125 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.708 130.5 24.3-117.7 -24.9 41.8 45.8 16.0 756 768 A H < + 0 0 117 -4,-2.3 2,-1.0 -5,-0.4 -3,-0.2 -0.198 64.5 151.1-138.4 50.6 42.0 42.8 18.2 757 769 A D > - 0 0 14 -4,-0.3 3,-0.8 1,-0.2 -4,-0.1 -0.729 17.1-179.0 -84.9 107.2 39.4 40.2 17.2 758 770 A R T 3 S+ 0 0 122 -2,-1.0 -1,-0.2 1,-0.2 -5,-0.0 0.676 83.2 46.9 -76.5 -19.1 40.9 36.9 18.2 759 771 A F T 3 S- 0 0 10 -3,-0.1 -1,-0.2 -199,-0.1 -102,-0.1 0.065 101.6-129.3-115.4 27.7 37.9 35.1 16.8 760 772 A K <> + 0 0 9 -3,-0.8 4,-0.6 1,-0.1 -2,-0.1 0.774 35.7 173.8 23.3 69.4 37.6 36.9 13.4 761 773 A V H >> S+ 0 0 4 1,-0.2 3,-1.6 2,-0.2 4,-0.6 0.947 75.0 53.0 -62.7 -51.5 33.9 37.8 13.6 762 774 A F H >> S+ 0 0 1 1,-0.3 3,-1.2 -9,-0.2 4,-0.6 0.852 98.3 66.5 -53.6 -39.3 33.9 39.9 10.4 763 775 A A H 34 S+ 0 0 20 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.760 108.0 37.4 -57.1 -27.4 35.4 37.0 8.4 764 776 A D H S+ 0 0 95 -4,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.777 112.0 57.7 -65.9 -25.8 28.5 33.7 4.8 768 780 A Y H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.924 110.5 38.0 -71.8 -48.7 26.5 33.9 8.0 769 781 A V H X S+ 0 0 4 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.854 114.8 55.5 -73.2 -31.9 23.7 36.3 6.9 770 782 A K H X S+ 0 0 94 -4,-1.9 4,-1.2 -5,-0.3 3,-0.4 0.949 111.5 45.1 -60.6 -46.7 23.6 34.6 3.5 771 783 A C H X S+ 0 0 2 -4,-1.7 4,-1.2 1,-0.2 -2,-0.2 0.839 107.4 57.6 -65.3 -35.6 23.0 31.3 5.3 772 784 A Q H X S+ 0 0 1 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.783 101.2 57.5 -66.1 -27.6 20.4 32.9 7.6 773 785 A E H X S+ 0 0 87 -4,-1.4 4,-2.0 -3,-0.4 -1,-0.2 0.898 102.5 55.2 -69.2 -38.6 18.5 33.8 4.5 774 786 A R H X S+ 0 0 131 -4,-1.2 4,-1.6 1,-0.2 -2,-0.2 0.823 106.0 49.7 -64.1 -32.5 18.4 30.2 3.5 775 787 A V H X S+ 0 0 0 -4,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.874 109.4 52.0 -75.2 -34.2 16.8 29.1 6.8 776 788 A S H X S+ 0 0 25 -4,-1.5 4,-1.1 1,-0.2 -2,-0.2 0.864 107.5 53.4 -66.2 -36.8 14.2 31.8 6.5 777 789 A A H < S+ 0 0 56 -4,-2.0 3,-0.4 1,-0.2 -1,-0.2 0.922 111.3 45.1 -63.3 -45.2 13.4 30.5 3.0 778 790 A L H >< S+ 0 0 29 -4,-1.6 3,-1.2 1,-0.2 7,-0.4 0.763 104.9 61.0 -71.1 -27.2 12.9 27.0 4.4 779 791 A Y H 3< S+ 0 0 44 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.803 94.1 65.4 -69.6 -27.2 10.8 28.2 7.4 780 792 A K T 3< S+ 0 0 137 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.613 96.5 60.7 -67.8 -14.0 8.3 29.6 4.8 781 793 A N X> - 0 0 75 -3,-1.2 4,-2.3 -4,-0.2 3,-1.0 -0.704 70.0-177.3-117.4 75.9 7.7 25.9 3.8 782 794 A P H 3> S+ 0 0 87 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.811 79.1 53.3 -38.0 -51.6 6.3 24.3 7.1 783 795 A R H 3> S+ 0 0 96 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.860 113.3 41.7 -58.3 -42.3 6.1 20.8 5.6 784 796 A E H <> S+ 0 0 60 -3,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.836 112.5 54.3 -77.2 -33.1 9.7 20.8 4.4 785 797 A W H X S+ 0 0 14 -4,-2.3 4,-1.8 -7,-0.4 -2,-0.2 0.945 111.3 45.8 -62.5 -48.7 11.0 22.4 7.5 786 798 A T H X S+ 0 0 15 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.831 109.6 54.7 -63.3 -35.0 9.3 19.7 9.6 787 799 A R H X S+ 0 0 30 -4,-1.3 4,-1.2 -5,-0.2 -1,-0.2 0.871 109.0 47.4 -68.9 -35.6 10.6 17.0 7.4 788 800 A M H X S+ 0 0 30 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.828 109.2 55.2 -72.6 -32.0 14.1 18.2 7.8 789 801 A V H >X S+ 0 0 7 -4,-1.8 4,-2.6 1,-0.2 3,-0.8 0.953 104.8 52.4 -63.4 -48.8 13.5 18.3 11.6 790 802 A I H 3X S+ 0 0 2 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.831 105.8 55.8 -56.0 -32.8 12.5 14.7 11.4 791 803 A R H 3< S+ 0 0 69 -4,-1.2 4,-0.4 2,-0.2 -1,-0.3 0.837 110.6 44.1 -69.9 -33.6 15.8 13.9 9.7 792 804 A N H X< S+ 0 0 0 -4,-1.4 3,-0.6 -3,-0.8 4,-0.4 0.941 116.2 45.1 -75.1 -51.1 17.7 15.5 12.5 793 805 A I H >< S+ 0 0 5 -4,-2.6 3,-1.3 1,-0.2 4,-0.2 0.933 112.3 51.2 -57.6 -50.1 15.8 13.9 15.4 794 806 A A T 3< S+ 0 0 0 -4,-2.3 -1,-0.2 -5,-0.3 3,-0.2 0.707 115.7 44.7 -62.7 -17.0 15.8 10.5 13.8 795 807 A T T < S+ 0 0 7 -3,-0.6 3,-0.5 -4,-0.4 -1,-0.2 0.357 87.4 86.2-113.0 8.7 19.5 10.8 13.4 796 808 A S X + 0 0 4 -3,-1.3 3,-2.5 -4,-0.4 -1,-0.1 0.479 54.6 105.2 -88.4 -2.2 20.6 12.2 16.8 797 809 A G G > + 0 0 5 1,-0.3 3,-1.3 -294,-0.3 -293,-0.3 0.783 68.3 66.2 -48.0 -35.9 20.9 8.8 18.5 798 810 A K G 3 S+ 0 0 44 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.663 91.5 67.3 -63.6 -13.9 24.7 8.8 18.4 799 811 A F G < + 0 0 4 -3,-2.5 -325,-2.6 -326,-0.1 2,-0.3 0.142 68.6 117.1 -99.1 23.5 24.7 11.7 20.8 800 812 A S B X> -p 474 0G 4 -3,-1.3 4,-1.2 -327,-0.3 3,-1.2 -0.687 68.7-131.4 -87.4 138.6 23.4 10.0 23.8 801 813 A S H 3> S+ 0 0 0 -327,-2.5 4,-2.7 -2,-0.3 5,-0.2 0.630 105.1 71.9 -66.1 -10.8 25.7 9.9 26.8 802 814 A D H 3> S+ 0 0 12 -328,-0.4 4,-2.1 2,-0.2 -1,-0.3 0.889 99.3 46.4 -69.2 -37.5 25.0 6.2 27.1 803 815 A R H <> S+ 0 0 43 -3,-1.2 4,-1.4 -6,-0.2 -2,-0.2 0.908 113.3 48.6 -68.2 -43.4 27.0 5.7 23.9 804 816 A T H X S+ 0 0 0 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.931 113.7 46.0 -61.9 -48.3 29.8 7.9 25.3 805 817 A I H X S+ 0 0 0 -4,-2.7 4,-3.4 1,-0.2 5,-0.2 0.907 107.4 56.7 -64.2 -42.6 29.9 6.1 28.6 806 818 A A H X S+ 0 0 14 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.852 110.1 47.5 -57.5 -33.7 29.9 2.7 26.9 807 819 A Q H X S+ 0 0 55 -4,-1.4 4,-2.9 2,-0.2 5,-0.3 0.882 111.3 47.8 -75.0 -41.5 33.0 3.7 25.0 808 820 A Y H X>S+ 0 0 0 -4,-2.0 5,-2.7 2,-0.2 4,-2.2 0.951 112.9 52.5 -60.5 -49.0 34.8 5.1 28.1 809 821 A A H <>S+ 0 0 0 -4,-3.4 6,-2.1 3,-0.2 5,-1.6 0.939 119.4 31.9 -51.1 -56.5 33.8 1.8 29.8 810 822 A R H <5S+ 0 0 129 -4,-2.2 -2,-0.2 4,-0.2 -1,-0.2 0.930 127.5 35.1 -72.8 -47.2 35.2 -0.4 27.1 811 823 A E H <5S+ 0 0 98 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.544 134.4 13.9 -89.3 -8.2 38.2 1.5 25.8 812 824 A I T <5S+ 0 0 10 -4,-2.2 -3,-0.2 -5,-0.3 -4,-0.1 0.621 128.9 38.0-128.5 -53.0 39.5 3.2 28.9 813 825 A W T