==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 24-APR-09 3H75 . COMPND 2 MOLECULE: PERIPLASMIC SUGAR-BINDING DOMAIN PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS FLUORESCENS PF-5; . AUTHOR D.KUMARAN,A.MAHMOOD,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RE . 328 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14925.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 235 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 53 16.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 22 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 0 0 0 2 1 0 0 3 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 2 1 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 0 PARALLEL BRIDGES PER LADDER . 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 1 0 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 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 -1 A L 0 0 162 0, 0.0 32,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 148.6 -25.9 -14.0 0.3 2 52 A T - 0 0 39 30,-0.4 32,-3.2 1,-0.1 2,-0.4 -0.388 360.0-145.6 -57.9 131.5 -22.7 -14.9 2.1 3 53 A S E -a 34 0A 16 30,-0.2 60,-2.0 57,-0.1 59,-0.6 -0.863 20.6-179.3-111.7 141.4 -23.7 -17.4 4.8 4 54 A V E -ab 35 63A 1 30,-3.0 32,-2.2 -2,-0.4 2,-0.5 -0.996 11.2-161.9-137.0 137.6 -22.3 -18.0 8.3 5 55 A V E -ab 36 64A 6 58,-2.0 60,-3.5 -2,-0.4 2,-0.5 -0.987 11.5-162.0-118.8 126.9 -23.3 -20.5 11.0 6 56 A F E -ab 37 65A 0 30,-2.8 32,-2.6 -2,-0.5 2,-1.0 -0.952 11.7-147.2-113.7 128.0 -22.1 -19.7 14.5 7 57 A L E -ab 38 66A 2 58,-2.6 60,-0.7 -2,-0.5 32,-0.2 -0.812 19.0-160.2 -94.4 98.3 -22.0 -22.4 17.2 8 58 A N E -a 39 0A 0 30,-1.9 32,-2.4 -2,-1.0 33,-0.3 -0.679 7.5-156.4 -80.6 124.3 -22.8 -20.4 20.4 9 59 A P + 0 0 29 0, 0.0 33,-1.2 0, 0.0 -1,-0.1 0.693 64.3 79.1 -77.0 -17.5 -21.6 -22.3 23.6 10 60 A G S S- 0 0 0 31,-0.2 31,-1.9 1,-0.1 32,-0.4 -0.014 89.1 -82.7 -84.3-172.8 -24.0 -20.7 26.0 11 61 A N > - 0 0 55 30,-0.3 3,-1.7 29,-0.2 -1,-0.1 -0.596 36.4-119.0 -85.8 153.0 -27.7 -21.0 26.9 12 62 A S T 3 S+ 0 0 57 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.506 118.9 43.3 -71.2 -1.1 -30.3 -19.2 24.8 13 63 A T T 3 S+ 0 0 120 5,-0.0 2,-0.7 4,-0.0 -1,-0.3 0.230 83.6 119.6-122.5 6.3 -31.2 -17.3 27.9 14 64 A E <> - 0 0 31 -3,-1.7 4,-2.5 1,-0.1 5,-0.3 -0.669 61.6-140.7 -80.0 114.2 -27.6 -16.6 29.1 15 65 A T H > S+ 0 0 51 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.836 94.7 44.1 -42.1 -55.2 -27.2 -12.9 29.2 16 66 A F H > S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.945 116.9 44.3 -60.2 -50.6 -23.6 -12.6 27.9 17 67 A W H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.796 112.5 52.2 -68.1 -26.7 -24.1 -15.1 25.1 18 68 A V H X S+ 0 0 29 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.902 110.1 49.2 -73.5 -39.7 -27.4 -13.6 24.1 19 69 A S H X S+ 0 0 10 -4,-2.3 4,-2.1 -5,-0.3 -2,-0.2 0.880 109.4 52.3 -64.4 -36.2 -25.8 -10.2 23.9 20 70 A Y H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.933 112.6 45.8 -63.5 -46.1 -23.0 -11.6 21.8 21 71 A S H X S+ 0 0 1 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.914 110.5 51.8 -63.3 -45.8 -25.6 -13.1 19.4 22 72 A Q H X S+ 0 0 65 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.875 108.8 50.7 -61.9 -37.8 -27.7 -9.9 19.3 23 73 A F H X S+ 0 0 3 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.916 111.6 48.7 -66.2 -41.4 -24.6 -7.8 18.4 24 74 A X H X S+ 0 0 0 -4,-1.8 4,-3.0 1,-0.2 -2,-0.2 0.903 108.4 53.2 -63.7 -42.4 -23.8 -10.3 15.6 25 75 A Q H X S+ 0 0 68 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.879 107.0 52.0 -62.3 -36.7 -27.3 -10.2 14.3 26 76 A A H X S+ 0 0 7 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.926 112.6 46.2 -64.1 -42.3 -27.2 -6.5 14.0 27 77 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.900 110.3 53.2 -66.0 -41.3 -23.9 -6.9 12.1 28 78 A A H X>S+ 0 0 6 -4,-3.0 5,-2.5 1,-0.2 4,-0.9 0.900 109.9 47.9 -61.3 -42.5 -25.4 -9.6 9.8 29 79 A R H <5S+ 0 0 163 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.924 115.3 44.1 -64.8 -44.6 -28.4 -7.4 8.9 30 80 A D H <5S+ 0 0 55 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.834 117.3 45.6 -70.0 -32.8 -26.2 -4.4 8.1 31 81 A L H <5S- 0 0 4 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.503 108.7-120.0 -89.3 -6.4 -23.6 -6.4 6.2 32 82 A G T <5 + 0 0 32 -4,-0.9 -30,-0.4 -3,-0.4 2,-0.3 0.883 60.8 150.2 69.3 38.1 -26.2 -8.4 4.2 33 83 A L < - 0 0 14 -5,-2.5 2,-0.9 -6,-0.2 -1,-0.2 -0.779 50.8-127.5-105.1 148.9 -25.0 -11.7 5.6 34 84 A D E -a 3 0A 77 -32,-3.2 -30,-3.0 -2,-0.3 2,-0.4 -0.843 38.8-176.5 -95.2 103.9 -27.1 -14.9 6.1 35 85 A L E -a 4 0A 32 -2,-0.9 2,-0.4 -32,-0.2 -30,-0.2 -0.880 16.9-177.4-111.8 136.4 -26.4 -15.8 9.7 36 86 A R E -a 5 0A 128 -32,-2.2 -30,-2.8 -2,-0.4 2,-0.5 -0.997 9.9-159.9-129.0 129.0 -27.6 -18.8 11.7 37 87 A I E -a 6 0A 31 -2,-0.4 2,-0.6 -32,-0.2 -30,-0.2 -0.950 2.5-165.7-114.7 123.1 -26.8 -19.2 15.4 38 88 A L E -a 7 0A 39 -32,-2.6 -30,-1.9 -2,-0.5 2,-0.3 -0.936 12.6-145.7-109.7 119.7 -27.0 -22.6 17.1 39 89 A Y E -a 8 0A 48 -2,-0.6 -28,-0.1 -32,-0.2 -27,-0.1 -0.656 9.5-158.8 -85.5 138.0 -26.9 -22.6 20.9 40 90 A A > - 0 0 0 -32,-2.4 3,-0.7 -30,-0.4 6,-0.2 0.647 30.3-135.4 -85.2 -15.4 -25.3 -25.5 22.7 41 91 A E T 3 - 0 0 88 -31,-1.9 -30,-0.3 -33,-0.3 -31,-0.2 0.917 68.6 -58.0 56.2 44.2 -27.3 -24.8 25.9 42 92 A R T 3 S+ 0 0 74 -33,-1.2 -1,-0.2 -32,-0.4 -32,-0.1 0.702 113.6 112.0 60.2 28.8 -24.0 -25.2 27.8 43 93 A D X> - 0 0 71 -3,-0.7 3,-2.2 -33,-0.2 4,-0.8 -0.926 52.5-159.1-127.8 103.4 -23.2 -28.8 26.7 44 94 A P H 3> S+ 0 0 52 0, 0.0 4,-1.8 0, 0.0 3,-0.4 0.777 89.0 68.6 -53.1 -28.7 -20.1 -28.8 24.5 45 95 A Q H 3> S+ 0 0 107 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.808 94.1 57.5 -63.1 -26.2 -21.1 -32.1 23.0 46 96 A N H <> S+ 0 0 69 -3,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.860 102.9 53.1 -71.2 -33.9 -24.0 -30.4 21.4 47 97 A T H X S+ 0 0 15 -4,-0.8 4,-2.1 -3,-0.4 -2,-0.2 0.925 109.9 48.4 -64.7 -43.4 -21.6 -28.1 19.6 48 98 A L H X S+ 0 0 3 -4,-1.8 4,-3.0 1,-0.2 -2,-0.2 0.927 112.9 47.1 -62.7 -44.9 -19.7 -31.1 18.3 49 99 A Q H X S+ 0 0 78 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.875 109.7 53.8 -65.7 -37.4 -22.9 -32.8 17.1 50 100 A Q H X S+ 0 0 47 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.905 113.9 42.1 -63.3 -41.3 -24.1 -29.6 15.4 51 101 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.936 111.9 54.4 -70.3 -47.0 -20.9 -29.3 13.5 52 102 A R H X S+ 0 0 88 -4,-3.0 4,-1.2 1,-0.2 -2,-0.2 0.922 112.9 42.7 -52.7 -48.0 -20.7 -33.0 12.7 53 103 A E H X S+ 0 0 114 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.789 109.2 58.3 -72.2 -26.4 -24.2 -33.0 11.2 54 104 A L H < S+ 0 0 37 -4,-1.3 3,-0.3 -5,-0.2 -1,-0.2 0.909 106.2 49.0 -67.8 -41.6 -23.5 -29.7 9.3 55 105 A F H < S+ 0 0 23 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.809 113.2 47.3 -67.4 -30.2 -20.6 -31.3 7.5 56 106 A Q H < S+ 0 0 152 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.626 103.8 78.5 -86.7 -14.6 -22.7 -34.3 6.5 57 107 A G S < S- 0 0 28 -4,-1.0 3,-0.2 -3,-0.3 2,-0.1 -0.314 79.3-109.0 -91.5 175.6 -25.6 -32.3 5.3 58 108 A R S S+ 0 0 207 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 -0.368 91.6 43.5 -93.1 176.9 -26.4 -30.3 2.2 59 109 A D S S- 0 0 148 1,-0.1 -1,-0.2 -2,-0.1 -2,-0.0 0.952 79.5-168.0 49.5 56.6 -26.6 -26.5 1.7 60 110 A K - 0 0 82 -3,-0.2 -1,-0.1 1,-0.1 -57,-0.1 -0.428 20.8-109.8 -73.5 149.9 -23.5 -26.0 3.8 61 111 A P - 0 0 11 0, 0.0 25,-0.1 0, 0.0 -57,-0.1 -0.334 18.0-121.8 -75.9 163.3 -22.7 -22.4 4.9 62 112 A D S S+ 0 0 79 -59,-0.6 24,-2.5 1,-0.2 2,-0.3 0.904 97.5 26.0 -70.1 -39.5 -19.8 -20.5 3.5 63 113 A Y E -bc 4 86A 3 -60,-2.0 -58,-2.0 22,-0.2 2,-0.5 -0.948 61.7-159.4-128.4 147.1 -18.4 -20.1 7.0 64 114 A L E -bc 5 87A 0 22,-2.5 24,-2.3 -2,-0.3 2,-0.4 -0.993 17.0-165.2-123.6 117.4 -18.6 -22.0 10.3 65 115 A X E +bc 6 88A 0 -60,-3.5 -58,-2.6 -2,-0.5 2,-0.3 -0.887 15.1 164.0-107.5 136.8 -17.7 -19.9 13.3 66 116 A L E -bc 7 89A 1 22,-2.2 24,-2.7 -2,-0.4 2,-0.3 -0.989 37.8-108.4-149.8 157.0 -17.0 -21.5 16.7 67 117 A V E - c 0 90A 33 -60,-0.7 24,-0.2 -2,-0.3 2,-0.2 -0.646 43.2-110.8 -85.5 141.3 -15.4 -20.7 20.0 68 118 A N + 0 0 6 22,-2.0 2,-0.3 -2,-0.3 -1,-0.1 -0.477 44.5 158.9 -77.4 143.8 -12.1 -22.4 20.8 69 119 A E - 0 0 42 -2,-0.2 4,-0.3 75,-0.1 75,-0.1 -0.950 46.6-115.6-154.4 157.6 -11.8 -25.1 23.4 70 120 A Q S S+ 0 0 91 73,-0.5 74,-0.1 -2,-0.3 -2,-0.0 0.565 106.4 30.1 -79.3 -8.4 -9.2 -27.9 24.0 71 121 A Y S > S+ 0 0 135 3,-0.1 4,-0.7 2,-0.0 -1,-0.1 0.780 124.4 31.8-117.1 -45.6 -11.5 -30.8 23.4 72 122 A V H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.1 5,-0.2 0.889 110.9 60.3 -83.9 -41.5 -14.3 -30.1 20.9 73 123 A A H > S+ 0 0 1 -4,-0.3 4,-2.2 1,-0.2 5,-0.2 0.903 103.3 51.7 -54.2 -46.4 -12.6 -27.5 18.6 74 124 A P H > S+ 0 0 29 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.910 109.9 49.7 -59.2 -41.0 -9.9 -30.0 17.6 75 125 A Q H X S+ 0 0 63 -4,-0.7 4,-2.1 1,-0.2 -2,-0.2 0.890 110.4 50.0 -65.2 -39.1 -12.5 -32.6 16.7 76 126 A I H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.872 107.8 54.4 -67.3 -35.5 -14.5 -30.1 14.6 77 127 A L H X S+ 0 0 25 -4,-2.2 4,-0.6 -5,-0.2 -2,-0.2 0.924 111.1 44.8 -63.1 -43.9 -11.3 -29.1 12.8 78 128 A R H >< S+ 0 0 143 -4,-2.0 3,-0.5 1,-0.2 -2,-0.2 0.857 113.3 50.5 -68.5 -35.7 -10.6 -32.7 11.8 79 129 A L H 3< S+ 0 0 61 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.785 102.4 61.5 -73.0 -27.1 -14.2 -33.3 10.8 80 130 A S H >< S+ 0 0 12 -4,-1.8 3,-2.7 -5,-0.1 4,-0.4 0.686 74.1 121.5 -72.5 -19.6 -14.3 -30.1 8.6 81 131 A Q T << S+ 0 0 152 -4,-0.6 -3,-0.0 -3,-0.5 -4,-0.0 -0.232 86.5 3.7 -51.3 119.2 -11.5 -31.5 6.4 82 132 A G T 3 S+ 0 0 90 3,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.550 96.9 114.7 81.5 8.8 -12.8 -31.6 2.8 83 133 A S S < S- 0 0 20 -3,-2.7 -2,-0.1 2,-0.2 3,-0.1 0.690 75.5-132.5 -82.9 -20.5 -16.1 -30.0 3.7 84 134 A G + 0 0 76 -4,-0.4 2,-0.4 1,-0.3 -3,-0.1 0.432 65.8 127.7 82.2 -2.6 -15.5 -26.9 1.6 85 135 A I - 0 0 13 -5,-0.4 2,-0.3 -22,-0.0 -1,-0.3 -0.739 58.9-131.6 -91.2 134.4 -16.6 -24.8 4.6 86 136 A K E -c 63 0A 72 -24,-2.5 -22,-2.5 -2,-0.4 2,-0.3 -0.680 23.8-143.5 -84.1 135.8 -14.3 -22.1 5.8 87 137 A L E -cd 64 102A 2 14,-2.1 16,-2.1 -2,-0.3 2,-0.4 -0.794 15.1-169.3-105.5 146.5 -13.7 -22.1 9.5 88 138 A F E -cd 65 103A 0 -24,-2.3 -22,-2.2 -2,-0.3 2,-0.5 -0.970 8.4-158.4-135.6 116.8 -13.3 -19.1 11.9 89 139 A I E -cd 66 104A 0 14,-2.6 16,-1.9 -2,-0.4 2,-0.3 -0.831 19.6-169.1 -97.2 126.3 -12.2 -19.8 15.5 90 140 A V E +cd 67 105A 0 -24,-2.7 -22,-2.0 -2,-0.5 2,-1.0 -0.742 45.9 17.9-122.7 167.3 -13.0 -17.1 18.0 91 141 A N E S+ d 0 106A 23 14,-1.9 16,-0.7 -2,-0.3 18,-0.3 -0.156 112.4 43.5 76.5 -36.9 -12.4 -15.8 21.5 92 142 A S S S- 0 0 5 -2,-1.0 13,-0.2 13,-0.2 -24,-0.2 -0.989 90.5 -90.8-140.0 151.3 -9.2 -17.7 22.3 93 143 A P - 0 0 73 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.088 37.2-110.3 -57.9 147.8 -5.9 -18.5 20.3 94 144 A L - 0 0 29 -5,-0.1 2,-0.1 1,-0.1 10,-0.0 -0.598 40.0-125.2 -77.0 141.5 -5.3 -21.6 18.2 95 145 A T > - 0 0 70 -2,-0.2 4,-2.1 1,-0.1 -1,-0.1 -0.379 19.8-106.2 -87.1 167.7 -2.8 -23.9 19.8 96 146 A L T 4 S+ 0 0 169 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.881 122.4 54.8 -57.6 -38.3 0.4 -25.3 18.4 97 147 A D T 4 S+ 0 0 158 1,-0.2 -1,-0.2 0, 0.0 -3,-0.0 0.916 107.4 47.3 -62.0 -45.8 -1.4 -28.6 18.0 98 148 A Q T 4 0 0 40 -21,-0.0 -1,-0.2 -3,-0.0 -2,-0.2 0.854 360.0 360.0 -64.8 -33.6 -4.3 -27.1 16.0 99 149 A R < 0 0 164 -4,-2.1 -3,-0.1 0, 0.0 -4,-0.1 0.122 360.0 360.0 -85.8 360.0 -1.7 -25.3 13.8 100 ! 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 0.0 101 150 A W 0 0 104 0, 0.0 -14,-2.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 135.3 -9.2 -21.5 4.9 102 151 A I E +d 87 0A 70 -16,-0.2 2,-0.2 -14,-0.0 -14,-0.2 -0.976 360.0 167.8-139.6 122.3 -9.1 -21.1 8.7 103 152 A G E -d 88 0A 0 -16,-2.1 -14,-2.6 -2,-0.4 2,-0.3 -0.696 13.0-156.0-123.9 177.5 -8.9 -17.8 10.5 104 153 A S E -de 89 276A 6 171,-2.8 173,-2.4 -16,-0.2 2,-0.3 -0.976 8.5-161.9-152.3 163.7 -9.3 -16.6 14.1 105 154 A X E +de 90 277A 0 -16,-1.9 -14,-1.9 -2,-0.3 2,-0.3 -0.934 16.3 176.8-152.4 125.2 -10.1 -13.6 16.2 106 155 A V E -de 91 278A 13 171,-2.2 173,-3.1 -2,-0.3 -14,-0.1 -0.904 16.1-147.7-131.9 159.4 -9.4 -13.1 19.9 107 156 A G - 0 0 18 -16,-0.7 2,-0.2 -2,-0.3 3,-0.2 -0.029 40.3 -86.8-101.7-152.3 -9.7 -10.5 22.6 108 157 A D > + 0 0 27 1,-0.1 4,-1.7 2,-0.1 3,-0.1 -0.482 54.4 152.8-125.5 64.8 -7.6 -9.8 25.6 109 158 A D H > S+ 0 0 12 -18,-0.3 4,-2.2 1,-0.2 5,-0.2 0.859 73.9 56.1 -58.5 -41.3 -8.9 -12.0 28.5 110 159 A E H > S+ 0 0 64 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.934 106.5 50.2 -60.3 -44.6 -5.5 -12.2 30.3 111 160 A E H > S+ 0 0 68 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.904 108.7 53.6 -59.8 -40.6 -5.3 -8.4 30.5 112 161 A A H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.914 109.8 46.4 -61.1 -43.6 -8.9 -8.3 31.9 113 162 A G H X S+ 0 0 0 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.895 116.1 45.7 -65.6 -40.4 -7.9 -10.8 34.7 114 163 A Y H X S+ 0 0 20 -4,-2.4 4,-2.0 -5,-0.2 3,-0.4 0.959 112.9 49.0 -66.2 -52.3 -4.8 -8.8 35.5 115 164 A R H X S+ 0 0 94 -4,-3.4 4,-3.0 1,-0.2 5,-0.3 0.829 102.4 63.2 -60.7 -33.5 -6.4 -5.4 35.4 116 165 A X H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.935 107.6 41.2 -59.8 -45.0 -9.3 -6.5 37.7 117 166 A L H X S+ 0 0 0 -4,-1.2 4,-2.7 -3,-0.4 5,-0.2 0.930 115.0 50.9 -69.0 -42.7 -6.9 -7.3 40.6 118 167 A K H X S+ 0 0 59 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.911 113.2 46.6 -59.4 -41.7 -4.9 -4.1 40.0 119 168 A E H X S+ 0 0 61 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.902 111.6 50.2 -66.5 -43.1 -8.0 -2.0 39.9 120 169 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.925 111.5 49.0 -61.3 -44.3 -9.4 -3.6 43.0 121 170 A L H X S+ 0 0 26 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.891 110.0 52.3 -62.7 -39.5 -6.2 -3.0 44.8 122 171 A H H < S+ 0 0 146 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.928 112.0 44.6 -63.1 -45.1 -6.2 0.6 43.7 123 172 A K H < S+ 0 0 105 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.834 108.0 57.2 -69.9 -33.1 -9.7 1.2 45.0 124 173 A L H < S- 0 0 36 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.891 92.9-174.5 -64.3 -37.6 -9.1 -0.5 48.3 125 174 A G < - 0 0 27 -4,-1.7 -1,-0.1 -5,-0.2 -2,-0.1 -0.134 32.7 -7.6 72.6-172.3 -6.2 1.8 49.0 126 175 A P + 0 0 128 0, 0.0 -4,-0.0 0, 0.0 0, 0.0 0.030 63.7 121.9 -53.8 160.9 -3.7 1.8 51.9 127 176 A V + 0 0 61 4,-0.1 4,-0.2 6,-0.0 -2,-0.0 0.086 45.8 125.5 165.1 -19.7 -3.9 -0.5 54.9 128 177 A P + 0 0 55 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.535 12.3 103.5 -43.0-165.0 -0.4 -2.3 54.7 129 178 A A S S- 0 0 87 2,-0.2 3,-0.1 1,-0.1 0, 0.0 0.962 112.2 -17.4 80.7 74.3 2.4 -2.7 57.2 130 179 A G S S+ 0 0 92 1,-0.2 2,-0.4 0, 0.0 -1,-0.1 0.191 115.0 105.7 89.2 -17.9 2.1 -6.2 58.6 131 180 A H - 0 0 114 -4,-0.2 -1,-0.2 2,-0.0 -2,-0.2 -0.804 59.9-145.3 -99.4 136.1 -1.5 -6.6 57.5 132 181 A G - 0 0 27 -2,-0.4 2,-0.6 -4,-0.1 32,-0.2 -0.457 13.4-126.8 -91.0 169.3 -2.3 -8.9 54.5 133 182 A I E -f 164 0B 6 30,-2.5 32,-2.6 -2,-0.1 2,-0.3 -0.931 27.9-145.6-117.6 102.4 -5.1 -8.2 52.0 134 183 A E E -fg 165 193B 23 -2,-0.6 60,-2.7 58,-0.5 61,-1.7 -0.523 18.7-170.3 -77.7 135.3 -7.2 -11.4 51.9 135 184 A L E -fg 166 195B 0 30,-2.5 32,-2.5 -2,-0.3 33,-0.9 -0.942 16.8-161.3-128.1 144.2 -8.7 -12.3 48.6 136 185 A L E -fg 168 196B 0 59,-2.1 61,-2.4 -2,-0.3 2,-0.4 -0.947 15.3-158.1-119.3 142.3 -11.2 -14.8 47.3 137 186 A A E -fg 169 197B 0 31,-2.4 33,-2.6 -2,-0.4 2,-0.6 -0.986 9.3-165.6-128.1 134.4 -11.4 -15.7 43.6 138 187 A F E -fg 170 198B 1 59,-2.7 61,-2.9 -2,-0.4 62,-0.3 -0.961 16.2-175.8-117.4 112.8 -14.3 -17.1 41.6 139 188 A S E -f 171 0B 0 31,-3.2 33,-2.6 -2,-0.6 35,-0.5 -0.491 19.5-120.7-101.7 175.4 -13.3 -18.5 38.2 140 189 A G S S- 0 0 0 1,-0.3 33,-1.2 33,-0.2 2,-0.7 0.416 70.3 -20.5 -88.9-135.6 -15.4 -19.9 35.4 141 190 A L > - 0 0 52 32,-0.2 3,-2.1 31,-0.2 6,-0.4 -0.695 64.0-141.0 -76.7 117.0 -15.4 -23.4 33.8 142 191 A K T 3 S+ 0 0 132 -2,-0.7 -1,-0.2 1,-0.3 6,-0.1 0.828 96.0 53.8 -48.5 -41.5 -11.9 -24.6 34.6 143 192 A V T 3 S+ 0 0 64 4,-0.1 -73,-0.5 -3,-0.0 -1,-0.3 0.527 90.1 96.8 -76.3 -4.6 -11.3 -26.2 31.2 144 193 A T S <> S- 0 0 18 -3,-2.1 4,-2.6 1,-0.1 3,-0.2 -0.615 73.3-134.2 -90.9 145.3 -12.1 -23.1 29.2 145 194 A P H > S+ 0 0 22 0, 0.0 4,-3.4 0, 0.0 5,-0.3 0.844 105.5 60.3 -62.5 -33.5 -9.6 -20.7 27.8 146 195 A A H > S+ 0 0 24 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.930 111.2 40.5 -60.2 -43.6 -11.6 -17.7 29.0 147 196 A A H > S+ 0 0 1 -6,-0.4 4,-2.5 -3,-0.2 5,-0.2 0.940 117.0 48.7 -69.1 -47.7 -11.2 -19.0 32.6 148 197 A Q H X S+ 0 0 91 -4,-2.6 4,-2.2 -7,-0.2 -2,-0.2 0.918 114.0 45.5 -58.7 -47.2 -7.6 -20.0 32.1 149 198 A L H X S+ 0 0 47 -4,-3.4 4,-1.9 2,-0.2 -1,-0.2 0.899 113.2 48.4 -66.1 -42.5 -6.5 -16.7 30.5 150 199 A R H X S+ 0 0 10 -4,-1.9 4,-2.1 -5,-0.3 -1,-0.2 0.911 112.7 49.6 -66.0 -37.6 -8.3 -14.6 33.1 151 200 A E H X S+ 0 0 32 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.882 105.9 56.3 -66.9 -37.5 -6.7 -16.6 35.9 152 201 A R H X S+ 0 0 141 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.922 107.8 48.9 -59.7 -41.7 -3.3 -16.3 34.3 153 202 A G H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.913 110.7 50.4 -62.7 -43.2 -3.8 -12.5 34.5 154 203 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.929 109.1 51.4 -59.2 -46.8 -4.8 -12.8 38.1 155 204 A R H X S+ 0 0 105 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.861 107.5 53.1 -60.3 -37.3 -1.8 -14.9 38.9 156 205 A R H X S+ 0 0 69 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.921 110.4 47.0 -65.1 -41.8 0.5 -12.3 37.3 157 206 A A H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 3,-0.5 0.890 110.2 53.2 -66.8 -38.9 -1.0 -9.6 39.5 158 207 A L H >< S+ 0 0 26 -4,-2.5 3,-0.7 1,-0.2 -1,-0.2 0.863 104.0 56.1 -64.5 -34.8 -0.7 -11.7 42.6 159 208 A A H 3< S+ 0 0 84 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.791 107.9 49.1 -67.6 -25.5 3.0 -12.3 41.9 160 209 A E H 3< S+ 0 0 96 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.581 113.8 47.8 -88.2 -11.3 3.5 -8.5 41.8 161 210 A H X< + 0 0 63 -4,-0.7 3,-2.2 -3,-0.7 -1,-0.2 -0.632 57.0 171.7-133.3 75.9 1.7 -8.0 45.1 162 211 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.688 76.3 71.2 -57.7 -18.2 2.8 -10.4 47.8 163 212 A Q T 3 S+ 0 0 60 -31,-0.1 -30,-2.5 2,-0.1 2,-0.5 0.758 82.3 85.1 -70.5 -22.9 0.7 -8.5 50.4 164 213 A V E < -f 133 0B 10 -3,-2.2 2,-0.7 -32,-0.2 -30,-0.2 -0.681 68.5-159.7 -81.9 126.7 -2.4 -10.0 48.7 165 214 A H E -f 134 0B 87 -32,-2.6 -30,-2.5 -2,-0.5 2,-0.9 -0.895 7.8-151.1-114.1 104.7 -3.2 -13.4 50.1 166 215 A L E -f 135 0B 44 -2,-0.7 -30,-0.2 -32,-0.2 3,-0.2 -0.626 14.7-176.9 -72.2 106.7 -5.4 -15.5 47.9 167 216 A R E - 0 0 84 -32,-2.5 2,-0.3 -2,-0.9 -1,-0.2 0.848 65.3 -11.4 -75.9 -33.3 -7.2 -17.7 50.5 168 217 A Q E -f 136 0B 85 -33,-0.9 -31,-2.4 -3,-0.1 2,-0.5 -0.928 49.6-157.7-168.3 140.2 -9.1 -19.7 47.9 169 218 A L E -f 137 0B 29 -2,-0.3 2,-0.3 -33,-0.2 -31,-0.2 -0.994 24.5-177.6-120.7 122.5 -9.9 -19.8 44.2 170 219 A V E -f 138 0B 26 -33,-2.6 -31,-3.2 -2,-0.5 2,-0.8 -0.811 29.5-117.3-118.8 162.7 -13.0 -21.8 43.3 171 220 A Y E +f 139 0B 56 -2,-0.3 -31,-0.2 -33,-0.2 -30,-0.1 -0.870 27.7 175.9-103.9 104.9 -14.6 -22.7 40.0 172 221 A G > - 0 0 0 -33,-2.6 3,-2.2 -2,-0.8 7,-0.3 0.423 38.6-132.1 -85.7 -1.4 -18.1 -21.2 39.9 173 222 A E T 3 - 0 0 93 -33,-1.2 -33,-0.2 -34,-0.5 -32,-0.2 0.771 60.6 -68.6 55.0 33.1 -18.6 -22.3 36.3 174 223 A W T 3 S+ 0 0 25 -35,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.467 103.7 136.8 67.5 3.2 -19.9 -18.9 35.2 175 224 A N <> - 0 0 64 -3,-2.2 4,-2.2 1,-0.1 -1,-0.2 -0.718 48.1-156.8 -93.7 125.9 -22.9 -19.7 37.4 176 225 A R H > S+ 0 0 66 -2,-0.5 4,-2.3 1,-0.2 -1,-0.1 0.922 93.4 44.3 -62.8 -51.8 -24.5 -17.1 39.7 177 226 A E H > S+ 0 0 144 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.865 113.5 52.3 -65.9 -33.1 -26.3 -19.4 42.2 178 227 A R H > S+ 0 0 96 2,-0.2 4,-2.5 -6,-0.2 -2,-0.2 0.945 112.0 44.6 -66.5 -47.0 -23.2 -21.7 42.4 179 228 A A H X S+ 0 0 0 -4,-2.2 4,-3.0 -7,-0.3 -2,-0.2 0.883 111.2 56.3 -62.6 -37.3 -20.9 -18.8 43.2 180 229 A Y H X S+ 0 0 32 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.931 109.4 44.6 -58.9 -47.5 -23.6 -17.6 45.7 181 230 A R H X S+ 0 0 145 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.906 114.6 48.2 -64.8 -42.9 -23.5 -20.9 47.5 182 231 A Q H X S+ 0 0 27 -4,-2.5 4,-2.8 1,-0.2 3,-0.2 0.899 110.7 52.2 -64.5 -40.2 -19.7 -21.0 47.5 183 232 A A H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.851 99.8 62.0 -65.3 -36.9 -19.5 -17.4 48.7 184 233 A Q H < S+ 0 0 57 -4,-1.9 4,-0.5 -5,-0.2 -1,-0.2 0.909 114.4 35.4 -55.5 -41.6 -21.8 -18.1 51.6 185 234 A Q H >X S+ 0 0 143 -4,-1.2 4,-2.3 -3,-0.2 3,-0.6 0.947 119.1 48.0 -77.0 -52.1 -19.3 -20.6 52.9 186 235 A L H 3X S+ 0 0 15 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.867 109.2 51.4 -59.2 -43.1 -16.1 -18.8 51.9 187 236 A L H 3< S+ 0 0 6 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.1 0.748 112.9 47.2 -69.2 -22.0 -17.0 -15.4 53.3 188 237 A K H <4 S+ 0 0 161 -3,-0.6 -2,-0.2 -4,-0.5 -1,-0.2 0.866 114.7 45.7 -83.0 -40.4 -17.8 -17.0 56.6 189 238 A R H < S+ 0 0 151 -4,-2.3 -2,-0.2 1,-0.3 -3,-0.2 0.834 123.0 35.6 -69.6 -35.5 -14.6 -19.0 56.7 190 239 A Y >< + 0 0 24 -4,-2.6 3,-1.8 -5,-0.2 -1,-0.3 -0.638 65.7 163.1-121.8 72.3 -12.5 -16.0 55.6 191 240 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.679 71.4 67.3 -63.9 -18.1 -14.0 -12.9 57.3 192 241 A K T 3 S+ 0 0 148 -3,-0.1 -58,-0.5 -57,-0.0 -5,-0.1 0.584 72.0 125.9 -79.1 -7.8 -10.8 -10.9 56.7 193 242 A T E < +g 134 0B 0 -3,-1.8 -58,-0.2 1,-0.2 3,-0.1 -0.249 26.8 166.5 -52.7 129.8 -11.5 -11.1 53.0 194 243 A Q E + 0 0 48 -60,-2.7 29,-2.7 1,-0.2 2,-0.4 0.515 60.3 50.9-120.0 -17.5 -11.5 -7.5 51.5 195 244 A L E -gh 135 223B 0 -61,-1.7 -59,-2.1 27,-0.2 2,-0.5 -0.979 54.9-171.0-129.1 139.1 -11.3 -8.4 47.8 196 245 A V E -gh 136 224B 1 27,-2.9 29,-1.9 -2,-0.4 2,-0.5 -0.949 7.9-166.0-130.6 110.0 -13.4 -10.7 45.6 197 246 A W E -g 137 0B 0 -61,-2.4 -59,-2.7 -2,-0.5 2,-0.4 -0.827 10.0-173.3 -94.2 128.6 -12.1 -11.2 42.1 198 247 A S E -g 138 0B 0 -2,-0.5 -59,-0.2 27,-0.4 -2,-0.0 -0.991 27.9-142.3-127.9 135.4 -14.7 -12.9 39.7 199 248 A A S S+ 0 0 0 -61,-2.9 2,-0.3 -2,-0.4 -60,-0.1 0.579 88.6 16.2 -70.6 -10.8 -14.1 -14.1 36.2 200 249 A N S > S- 0 0 3 -62,-0.3 4,-1.3 25,-0.2 28,-0.2 -0.974 77.5-112.4-153.9 168.1 -17.6 -12.9 35.2 201 250 A D H > S+ 0 0 2 26,-2.5 4,-2.7 -2,-0.3 5,-0.2 0.839 108.0 62.7 -73.4 -34.4 -20.4 -10.7 36.4 202 251 A E H > S+ 0 0 41 25,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.938 108.2 43.5 -55.0 -50.2 -22.9 -13.4 37.2 203 252 A X H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.887 111.0 54.5 -65.5 -38.6 -20.7 -14.9 39.8 204 253 A A H X S+ 0 0 0 -4,-1.3 4,-2.4 1,-0.2 -2,-0.2 0.939 108.2 49.6 -60.5 -45.4 -19.8 -11.5 41.2 205 254 A L H X S+ 0 0 6 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.858 111.3 50.1 -61.7 -35.5 -23.5 -10.7 41.7 206 255 A G H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.2 -2,-0.2 0.935 111.7 46.4 -68.4 -46.0 -24.0 -14.1 43.4 207 256 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.851 108.5 57.9 -64.7 -33.8 -21.0 -13.5 45.8 208 257 A X H X S+ 0 0 5 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.867 104.4 50.5 -64.8 -36.7 -22.3 -10.0 46.5 209 258 A Q H X S+ 0 0 67 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.930 109.9 49.5 -67.1 -44.2 -25.7 -11.4 47.7 210 259 A A H X S+ 0 0 1 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.902 110.8 52.7 -59.7 -39.4 -23.9 -13.8 50.0 211 260 A A H ><>S+ 0 0 0 -4,-2.2 5,-2.1 1,-0.2 3,-0.9 0.920 106.7 50.1 -62.5 -46.6 -21.8 -10.9 51.3 212 261 A R H ><5S+ 0 0 125 -4,-2.3 3,-1.4 1,-0.3 -1,-0.2 0.889 106.3 57.2 -60.0 -39.5 -24.9 -8.7 52.1 213 262 A E H 3<5S+ 0 0 98 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.716 106.0 50.3 -64.3 -22.3 -26.4 -11.6 54.0 214 263 A L T <<5S- 0 0 79 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.440 124.3-101.3 -95.7 -1.7 -23.4 -11.7 56.2 215 264 A G T < 5S+ 0 0 57 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.400 77.7 136.4 98.0 -2.3 -23.4 -8.0 57.0 216 265 A R < - 0 0 49 -5,-2.1 -1,-0.3 -6,-0.2 -2,-0.1 -0.342 50.0-134.3 -75.2 161.3 -20.7 -7.0 54.6 217 266 A K >>> - 0 0 108 -3,-0.1 3,-2.6 -2,-0.0 4,-1.5 -0.833 13.7-140.2-123.1 93.7 -21.1 -4.0 52.3 218 267 A P B 345S+i 222 0C 6 0, 0.0 5,-0.2 0, 0.0 24,-0.1 -0.243 90.6 19.1 -51.9 128.9 -20.1 -4.5 48.7 219 268 A G T 345S+ 0 0 23 3,-2.7 4,-0.2 1,-0.1 23,-0.1 0.197 128.1 51.4 95.5 -17.2 -18.3 -1.4 47.4 220 269 A T T <45S+ 0 0 107 -3,-2.6 3,-0.1 2,-0.4 -1,-0.1 0.746 127.8 2.4-114.6 -65.6 -17.4 -0.1 50.9 221 270 A D T <5S+ 0 0 59 -4,-1.5 2,-0.4 1,-0.3 -5,-0.0 0.483 134.6 41.1-105.1 -5.4 -15.8 -2.8 53.1 222 271 A L B - 0 0 6 1,-0.1 4,-2.6 4,-0.0 5,-0.3 -0.291 51.0-111.9 -62.2 151.2 -25.4 -7.6 32.2 231 280 A P H > S+ 0 0 78 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.902 118.3 49.0 -51.2 -45.4 -28.0 -4.9 33.1 232 281 A E H > S+ 0 0 94 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.872 111.2 49.2 -64.6 -38.5 -27.7 -5.7 36.8 233 282 A A H > S+ 0 0 0 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.900 110.2 50.9 -67.9 -40.5 -23.9 -5.6 36.8 234 283 A L H X S+ 0 0 3 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.918 111.3 48.2 -63.1 -42.6 -23.9 -2.2 35.0 235 284 A Q H X S+ 0 0 64 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.2 0.903 110.1 52.1 -64.6 -40.0 -26.4 -0.8 37.5 236 285 A A H X>S+ 0 0 10 -4,-2.1 6,-1.8 2,-0.2 5,-1.6 0.864 109.1 49.9 -64.8 -35.7 -24.2 -2.2 40.4 237 286 A L H ><5S+ 0 0 13 -4,-2.1 3,-0.9 2,-0.2 -1,-0.2 0.935 111.5 48.4 -67.0 -44.9 -21.1 -0.5 38.9 238 287 A I H 3<5S+ 0 0 41 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.889 112.0 49.6 -61.0 -39.8 -23.1 2.8 38.6 239 288 A D H 3<5S- 0 0 94 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.562 112.6-121.1 -76.4 -9.9 -24.3 2.4 42.2 240 289 A G T <<5S+ 0 0 38 -3,-0.9 -3,-0.2 -4,-0.6 -4,-0.1 0.499 86.0 111.6 82.3 3.5 -20.7 1.7 43.4 241 290 A K S + 0 0 1 -2,-0.3 3,-1.5 34,-0.2 4,-0.2 0.032 62.0 96.6 133.9 -28.0 -16.3 -5.1 25.6 249 298 A H G > + 0 0 14 1,-0.3 3,-1.5 2,-0.2 4,-0.3 0.632 67.2 79.4 -70.6 -10.8 -15.7 -8.7 24.4 250 299 A F G 3 S+ 0 0 8 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.664 87.9 61.8 -69.0 -11.9 -19.4 -9.2 23.7 251 300 A T G X> S+ 0 0 0 -3,-1.5 4,-1.7 1,-0.2 3,-0.8 0.588 75.3 93.5 -87.6 -11.4 -18.7 -7.3 20.5 252 301 A L H <> S+ 0 0 2 -3,-1.5 4,-2.3 1,-0.3 -1,-0.2 0.851 79.6 56.2 -52.1 -42.4 -16.2 -9.8 19.1 253 302 A G H 3> S+ 0 0 0 -3,-0.3 4,-1.7 -4,-0.3 -1,-0.3 0.876 106.5 50.9 -58.8 -39.1 -18.8 -11.7 17.1 254 303 A G H <> S+ 0 0 0 -3,-0.8 4,-1.4 -4,-0.2 -1,-0.2 0.918 110.6 47.4 -65.2 -44.1 -19.8 -8.6 15.2 255 304 A W H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.876 107.9 58.1 -64.1 -36.9 -16.3 -7.7 14.3 256 305 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.892 103.9 51.2 -60.3 -40.0 -15.8 -11.3 13.2 257 306 A L H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.842 106.4 54.0 -68.6 -31.4 -18.6 -10.9 10.7 258 307 A V H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.940 111.4 46.5 -65.2 -44.6 -17.1 -7.7 9.3 259 308 A A H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.905 114.8 45.3 -63.2 -43.1 -13.9 -9.7 8.8 260 309 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.884 109.4 56.1 -68.9 -37.8 -15.7 -12.7 7.2 261 310 A H H X S+ 0 0 16 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.929 112.0 43.5 -57.3 -44.9 -17.8 -10.3 5.1 262 311 A D H <>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 3,-0.4 0.863 108.5 57.3 -70.7 -35.9 -14.5 -8.9 3.7 263 312 A D H ><5S+ 0 0 12 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.912 104.1 53.3 -60.8 -41.2 -12.9 -12.3 3.3 264 313 A A H 3<5S+ 0 0 42 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.780 107.0 53.0 -64.0 -26.6 -15.8 -13.3 1.0 265 314 A L T 3<5S- 0 0 86 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.469 120.7-109.9 -87.2 -2.1 -15.1 -10.2 -1.0 266 315 A G T < 5S+ 0 0 49 -3,-1.6 2,-1.7 -4,-0.4 -3,-0.2 0.487 80.4 131.5 86.5 2.9 -11.5 -11.2 -1.4 267 316 A L < + 0 0 61 -5,-2.3 44,-0.2 -6,-0.2 -1,-0.1 -0.519 44.0 102.6 -87.5 68.3 -10.4 -8.3 0.8 268 317 A D + 0 0 76 -2,-1.7 4,-0.3 -5,-0.2 5,-0.1 -0.001 30.2 86.4-119.3-137.0 -8.2 -10.5 3.0 269 318 A A S >S- 0 0 44 2,-0.1 5,-0.7 3,-0.1 4,-0.0 -0.250 85.8 -32.8 70.0-154.9 -4.4 -11.1 3.4 270 319 A R T 5S+ 0 0 158 3,-0.1 2,-4.4 1,-0.1 4,-0.4 0.371 111.2 54.5 -75.7-146.8 -2.1 -9.0 5.6 271 320 A R T 5S+ 0 0 140 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 -0.122 102.7 63.1 49.1 -56.7 -2.4 -5.3 6.3 272 321 A L T 5S- 0 0 25 -2,-4.4 48,-0.4 -4,-0.3 -1,-0.3 0.562 120.3-107.7 -71.8 -5.3 -6.0 -5.6 7.5 273 322 A G T 5 + 0 0 40 1,-0.2 3,-0.2 -5,-0.1 5,-0.2 0.375 63.7 174.7 99.3 -4.7 -4.6 -7.9 10.3 274 323 A G < + 0 0 7 -5,-0.7 -1,-0.2 -4,-0.4 -169,-0.1 -0.166 34.1 26.9 -83.1 179.8 -5.8 -11.3 9.3 275 324 A P S S+ 0 0 35 0, 0.0 -171,-2.8 0, 0.0 2,-0.7 -0.992 127.0 30.6 -86.4 -3.9 -6.2 -14.2 9.2 276 325 A D E S-e 104 0A 43 -173,-0.2 -171,-0.2 -3,-0.2 2,-0.2 -0.804 78.7-163.0-115.5 89.6 -5.6 -14.3 13.0 277 326 A W E -e 105 0A 24 -173,-2.4 -171,-2.2 -2,-0.7 2,-0.5 -0.482 7.1-163.1 -75.0 137.1 -6.8 -11.1 14.5 278 327 A Q E -e 106 0A 174 -2,-0.2 2,-0.3 -173,-0.2 -171,-0.2 -0.974 18.5-176.4-121.3 112.5 -5.6 -10.1 18.0 279 328 A L - 0 0 26 -173,-3.1 2,-0.7 -2,-0.5 44,-0.1 -0.806 29.8-142.9-115.6 153.8 -7.8 -7.4 19.6 280 329 A S + 0 0 100 -2,-0.3 -173,-0.1 42,-0.2 -2,-0.0 -0.933 41.5 147.4-110.5 101.2 -7.8 -5.4 22.8 281 330 A L + 0 0 1 -2,-0.7 43,-0.3 42,-0.1 -1,-0.1 0.708 33.6 99.6-108.5 -28.2 -11.5 -5.1 23.5 282 331 A F + 0 0 17 -34,-0.1 2,-0.3 -36,-0.1 -34,-0.2 -0.358 41.8 172.8 -69.4 140.1 -11.7 -5.0 27.3 283 332 A Q E -K 247 0D 67 -36,-1.7 -36,-2.5 -2,-0.1 2,-1.2 -0.992 39.0-120.1-143.7 139.8 -12.1 -1.8 29.2 284 333 A A E -K 246 0D 38 -2,-0.3 -38,-0.2 -38,-0.2 -57,-0.0 -0.734 48.4-126.0 -81.3 101.1 -12.8 -1.2 32.9 285 334 A L - 0 0 12 -40,-2.3 -40,-0.3 -2,-1.2 -1,-0.0 -0.116 14.3-141.4 -54.4 141.3 -16.1 0.7 32.5 286 335 A T > - 0 0 63 1,-0.1 4,-2.5 -42,-0.1 5,-0.2 -0.595 31.3-107.5 -94.0 161.8 -16.6 4.1 34.0 287 336 A P H > S+ 0 0 77 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.895 121.5 54.9 -58.5 -37.3 -20.1 4.8 35.5 288 337 A A H > S+ 0 0 67 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.912 110.1 44.4 -61.2 -45.0 -20.8 7.1 32.5 289 338 A Q H > S+ 0 0 27 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.887 111.6 53.6 -66.9 -39.7 -20.0 4.3 30.0 290 339 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.871 105.0 55.2 -62.7 -37.2 -22.0 1.8 32.0 291 340 A R H X S+ 0 0 126 -4,-2.1 4,-2.4 -5,-0.2 -1,-0.2 0.907 108.0 49.0 -61.9 -43.5 -25.0 4.1 31.9 292 341 A Q H X S+ 0 0 65 -4,-1.5 4,-2.0 1,-0.2 5,-0.2 0.937 113.7 44.8 -61.9 -49.0 -24.9 4.2 28.1 293 342 A L H X S+ 0 0 8 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.838 112.2 53.3 -65.3 -33.3 -24.7 0.4 27.8 294 343 A L H < S+ 0 0 36 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.939 109.0 47.8 -67.3 -47.4 -27.4 -0.0 30.4 295 344 A R H < S+ 0 0 171 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.907 119.4 39.0 -60.1 -43.9 -29.8 2.3 28.5 296 345 A L H >< S+ 0 0 25 -4,-2.0 3,-1.9 -5,-0.2 -2,-0.2 0.849 80.8 168.6 -78.6 -36.5 -29.2 0.6 25.2 297 346 A G G >< S- 0 0 28 -4,-2.5 3,-1.7 1,-0.3 4,-0.1 -0.266 73.2 -12.9 57.6-142.2 -29.0 -3.0 26.2 298 347 A D G 3 S+ 0 0 66 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.323 128.7 73.8 -76.2 11.7 -29.0 -5.4 23.3 299 348 A Q G X + 0 0 127 -3,-1.9 3,-1.5 1,-0.2 4,-0.3 0.455 69.0 95.5 -97.4 -3.8 -30.1 -2.6 21.0 300 349 A V G X S+ 0 0 5 -3,-1.7 3,-1.6 1,-0.3 -1,-0.2 0.831 72.3 63.8 -57.1 -34.1 -26.6 -1.2 21.2 301 350 A G G > S+ 0 0 3 1,-0.3 3,-1.8 -3,-0.2 -1,-0.3 0.785 88.3 70.1 -62.4 -26.2 -25.6 -3.0 17.9 302 351 A T G < S+ 0 0 85 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.693 93.0 57.9 -64.9 -18.6 -28.1 -0.9 16.0 303 352 A R G < S+ 0 0 145 -3,-1.6 2,-0.5 -4,-0.3 -1,-0.3 0.348 88.4 94.7 -93.6 6.1 -26.0 2.2 16.5 304 353 A V < - 0 0 13 -3,-1.8 2,-1.4 -4,-0.1 3,-0.2 -0.854 68.2-144.1-103.5 130.9 -22.9 0.6 14.9 305 354 A D > + 0 0 105 -2,-0.5 4,-0.5 1,-0.2 3,-0.1 -0.667 29.3 167.9 -92.3 82.0 -22.2 1.2 11.2 306 355 A F H >> S+ 0 0 1 -2,-1.4 3,-2.0 1,-0.2 4,-0.8 0.920 73.7 55.1 -61.6 -48.2 -20.8 -2.2 10.3 307 356 A R H >4 S+ 0 0 116 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.867 104.5 58.1 -55.3 -33.2 -20.9 -1.8 6.6 308 357 A G H 34 S+ 0 0 20 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.2 0.708 99.3 57.7 -69.2 -19.5 -18.8 1.3 7.2 309 358 A L H << S+ 0 0 13 -3,-2.0 -1,-0.2 -4,-0.5 -2,-0.2 0.655 82.7 109.2 -83.8 -17.1 -16.2 -0.8 8.9 310 359 A S S << S- 0 0 2 -3,-0.9 -51,-0.1 -4,-0.8 -52,-0.0 -0.290 72.5-135.6 -60.0 143.5 -15.7 -2.9 5.8 311 360 A A > + 0 0 11 -53,-0.2 3,-2.2 -44,-0.2 2,-0.2 0.485 66.2 126.7 -79.0 -1.8 -12.4 -2.4 4.0 312 361 A Q T 3 S- 0 0 105 1,-0.3 -2,-0.0 -5,-0.2 -50,-0.0 -0.382 85.6 -1.7 -61.0 124.3 -14.4 -2.3 0.8 313 362 A G T 3 S+ 0 0 86 1,-0.2 -1,-0.3 -2,-0.2 -2,-0.1 0.652 102.6 143.1 68.7 15.1 -13.6 0.8 -1.2 314 363 A K < - 0 0 78 -3,-2.2 -1,-0.2 1,-0.1 4,-0.1 -0.667 53.1-120.7 -90.7 140.7 -11.3 1.9 1.7 315 364 A P > - 0 0 101 0, 0.0 3,-0.6 0, 0.0 2,-0.1 -0.203 45.0 -88.3 -67.9 171.2 -8.0 3.7 1.1 316 365 A D T 3 S+ 0 0 104 1,-0.2 3,-0.1 3,-0.0 -45,-0.0 -0.453 109.6 51.8 -83.8 162.5 -4.9 1.9 2.4 317 366 A S T 3 S+ 0 0 97 1,-0.4 2,-0.6 -2,-0.1 -1,-0.2 0.430 78.8 138.9 89.7 5.6 -3.6 2.3 5.9 318 367 A Y < + 0 0 41 -3,-0.6 -1,-0.4 -4,-0.1 2,-0.4 -0.738 29.0 178.9 -83.0 122.5 -7.1 1.5 6.9 319 368 A R - 0 0 160 -2,-0.6 -47,-0.1 -3,-0.1 -46,-0.1 -0.949 41.0 -94.0-122.7 143.8 -7.1 -0.8 9.9 320 369 A Y - 0 0 28 -48,-0.4 -10,-0.1 -2,-0.4 -11,-0.1 -0.392 28.0-150.6 -59.6 127.0 -10.3 -2.0 11.5 321 370 A P + 0 0 58 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 -0.081 31.7 169.3 -90.9 35.6 -11.1 0.3 14.4 322 371 A F + 0 0 20 -13,-0.1 2,-0.3 3,-0.1 -42,-0.2 -0.227 21.0 110.0 -52.0 125.7 -12.8 -2.5 16.3 323 372 A G S > S- 0 0 13 1,-0.1 3,-1.2 -44,-0.1 4,-0.3 -0.954 79.4 -91.4 175.3 166.6 -13.6 -1.4 19.9 324 373 A L T >> S+ 0 0 0 -43,-0.3 3,-1.9 -2,-0.3 4,-1.1 0.789 113.2 72.9 -65.1 -26.5 -16.2 -0.5 22.5 325 374 A Q H 3> S+ 0 0 95 1,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.813 84.8 65.4 -59.8 -28.8 -15.7 3.2 21.5 326 375 A L H <4 S+ 0 0 18 -3,-1.2 -1,-0.3 1,-0.2 -21,-0.2 0.744 106.8 43.6 -64.6 -21.2 -17.6 2.5 18.2 327 376 A L H <4 S+ 0 0 4 -3,-1.9 -1,-0.2 -4,-0.3 -2,-0.2 0.682 115.2 46.6 -94.9 -22.4 -20.6 1.8 20.4 328 377 A L H < 0 0 10 -4,-1.1 -2,-0.2 -3,-0.2 -3,-0.1 0.498 360.0 360.0-100.5 -5.3 -20.2 4.8 22.8 329 378 A R < 0 0 202 -4,-1.3 -1,-0.2 -5,-0.2 -3,-0.1 0.847 360.0 360.0 -51.9 360.0 -19.6 7.6 20.3