==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 15-AUG-11 3TFF . COMPND 2 MOLECULE: ALR2278 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: NOSTOC SP.; . AUTHOR M.B.WINTER,M.A.HERZIK JR.,J.KURIYAN,M.A.MARLETTA . 364 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17466.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 280 76.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 14.3 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 17 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 44.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 3.0 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 0 0 2 0 0 0 1 0 0 0 2 3 0 0 4 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 0 0 0 4 2 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 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 M 0 0 23 0, 0.0 42,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 162.7 42.3 41.3 66.0 2 2 A Y B >> -A 42 0A 22 40,-0.2 3,-1.9 1,-0.1 4,-0.8 -0.266 360.0-110.3 -62.0 149.4 45.7 41.7 64.5 3 3 A G H 3> S+ 0 0 0 38,-2.6 4,-2.5 35,-0.6 36,-0.3 0.768 111.4 73.9 -53.6 -33.0 48.6 41.1 66.8 4 4 A L H 3> S+ 0 0 20 35,-2.1 4,-2.0 1,-0.2 -1,-0.3 0.848 94.4 52.8 -48.6 -42.0 49.5 44.8 66.8 5 5 A V H <> S+ 0 0 18 -3,-1.9 4,-2.2 34,-0.2 -1,-0.2 0.931 110.1 46.4 -62.5 -44.3 46.5 45.6 69.0 6 6 A N H X S+ 0 0 0 -4,-0.8 4,-2.6 -3,-0.2 -2,-0.2 0.876 110.9 52.4 -69.0 -34.7 47.5 43.0 71.6 7 7 A K H X S+ 0 0 77 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.875 107.8 52.9 -64.1 -39.5 51.1 44.3 71.5 8 8 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 -2,-0.2 0.906 109.7 47.4 -64.5 -41.8 49.7 47.8 72.1 9 9 A I H X S+ 0 0 3 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.958 113.0 48.3 -63.4 -48.3 47.8 46.6 75.2 10 10 A Q H X S+ 0 0 46 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.905 113.0 49.9 -54.9 -43.1 50.8 44.8 76.5 11 11 A D H X S+ 0 0 61 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.929 110.4 47.9 -63.0 -49.9 52.9 47.9 75.9 12 12 A M H X S+ 0 0 10 -4,-2.7 4,-1.9 1,-0.2 5,-0.2 0.946 115.0 45.5 -57.2 -50.0 50.5 50.3 77.7 13 13 A I H X S+ 0 0 4 -4,-2.7 4,-1.9 1,-0.2 5,-0.5 0.895 114.3 48.1 -64.7 -40.2 50.2 48.0 80.7 14 14 A S H X S+ 0 0 27 -4,-2.5 4,-1.8 -5,-0.3 -1,-0.2 0.924 113.6 46.9 -64.6 -45.8 53.9 47.4 80.9 15 15 A K H < S+ 0 0 146 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.782 121.3 37.5 -67.2 -28.4 54.7 51.1 80.6 16 16 A H H < S+ 0 0 109 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.673 135.2 13.5 -98.5 -18.7 52.1 52.1 83.2 17 17 A H H X S- 0 0 77 -4,-1.9 4,-0.5 -5,-0.2 -3,-0.2 0.470 105.7-102.5-139.3 -10.1 52.3 49.2 85.8 18 18 A G H X - 0 0 30 -4,-1.8 4,-2.5 -5,-0.5 5,-0.1 0.049 34.3 -81.2 97.1 154.8 55.5 47.2 85.1 19 19 A E H > S+ 0 0 92 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.762 125.4 59.3 -63.2 -27.0 56.4 43.9 83.5 20 20 A D H > S+ 0 0 142 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.974 108.2 42.0 -66.2 -55.9 55.4 42.1 86.7 21 21 A T H X S+ 0 0 40 -4,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.904 114.5 53.8 -56.0 -43.2 51.8 43.4 86.7 22 22 A W H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.957 108.0 48.7 -56.8 -50.3 51.8 42.7 82.9 23 23 A E H X S+ 0 0 82 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.861 109.6 53.8 -57.9 -37.0 52.8 39.1 83.4 24 24 A A H X S+ 0 0 42 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.937 111.7 43.8 -61.1 -48.3 50.1 38.8 86.1 25 25 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.943 112.4 52.0 -63.1 -47.6 47.5 40.0 83.6 26 26 A K H <>S+ 0 0 14 -4,-3.0 5,-2.6 2,-0.2 4,-0.3 0.901 112.0 47.6 -54.6 -45.3 48.8 37.8 80.8 27 27 A Q H ><5S+ 0 0 47 -4,-2.4 3,-2.0 -5,-0.2 5,-0.3 0.968 112.8 46.9 -60.6 -56.0 48.7 34.8 83.1 28 28 A K H 3<5S+ 0 0 113 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.856 106.0 59.3 -55.1 -38.3 45.1 35.5 84.3 29 29 A A T 3<5S- 0 0 14 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.563 118.0-114.6 -68.6 -7.8 44.0 36.1 80.7 30 30 A G T < 5S+ 0 0 52 -3,-2.0 3,-0.2 -4,-0.3 -3,-0.2 0.725 84.4 118.0 81.6 25.2 45.1 32.6 80.0 31 31 A L < + 0 0 17 -5,-2.6 -4,-0.2 -6,-0.2 3,-0.1 0.018 23.5 117.8-115.3 26.7 47.9 33.6 77.6 32 32 A E S S+ 0 0 142 -5,-0.3 -1,-0.2 1,-0.2 -5,-0.1 0.813 72.0 61.3 -65.0 -30.5 51.0 32.3 79.4 33 33 A D S S+ 0 0 133 -3,-0.2 2,-0.3 -6,-0.1 -1,-0.2 0.951 83.5 87.9 -59.4 -51.4 51.8 30.0 76.4 34 34 A I - 0 0 42 1,-0.2 3,-0.1 -3,-0.1 -3,-0.0 -0.318 59.5-167.1 -55.3 111.0 52.1 32.9 74.0 35 35 A D S S- 0 0 137 -2,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.885 70.1 -16.1 -67.1 -41.0 55.8 34.1 74.1 36 36 A F S S- 0 0 139 2,-0.0 2,-0.4 0, 0.0 -1,-0.3 -0.976 70.4-104.4-159.6 153.9 55.0 37.2 72.2 37 37 A F - 0 0 10 -2,-0.3 2,-0.7 -3,-0.1 6,-0.0 -0.711 28.4-136.0 -84.2 136.4 52.3 38.7 69.9 38 38 A V > - 0 0 53 -2,-0.4 3,-1.8 1,-0.1 -35,-0.6 -0.843 13.3-148.5 -94.5 115.7 53.1 38.8 66.2 39 39 A G T 3 S+ 0 0 18 -2,-0.7 -35,-2.1 -36,-0.3 -34,-0.2 0.825 92.0 39.9 -58.7 -41.8 52.0 42.3 65.0 40 40 A M T 3 S+ 0 0 155 -37,-0.2 2,-0.4 -38,-0.1 -1,-0.3 0.237 97.6 100.6 -95.1 14.3 51.0 41.4 61.4 41 41 A E S < S- 0 0 98 -3,-1.8 -38,-2.6 -40,-0.0 2,-0.3 -0.826 73.5-122.4-103.9 137.5 49.3 38.1 62.5 42 42 A A B -A 2 0A 37 -2,-0.4 2,-0.3 -40,-0.2 -40,-0.2 -0.587 32.1-175.2 -78.1 133.0 45.6 37.7 62.9 43 43 A Y - 0 0 40 -42,-1.4 2,-0.2 -2,-0.3 -6,-0.0 -0.816 35.8 -87.8-118.4 164.0 44.4 36.5 66.4 44 44 A S >> - 0 0 65 -2,-0.3 3,-1.9 1,-0.1 4,-0.7 -0.518 34.3-126.2 -64.5 136.3 41.0 35.6 67.8 45 45 A D H 3> S+ 0 0 25 1,-0.3 4,-2.4 -2,-0.2 3,-0.3 0.798 106.6 76.9 -52.7 -28.0 39.2 38.6 69.2 46 46 A D H 3> S+ 0 0 93 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.836 85.5 59.5 -51.2 -39.5 39.0 36.5 72.3 47 47 A V H <> S+ 0 0 16 -3,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.952 108.2 43.7 -56.4 -50.5 42.6 37.2 73.1 48 48 A T H X S+ 0 0 0 -4,-0.7 4,-2.5 -3,-0.3 -2,-0.2 0.942 114.6 47.7 -63.8 -49.4 42.0 41.0 73.2 49 49 A Y H X S+ 0 0 69 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.907 112.6 50.0 -61.1 -40.3 38.8 40.8 75.3 50 50 A H H X S+ 0 0 99 -4,-2.7 4,-2.7 -5,-0.2 5,-0.3 0.892 108.1 53.3 -63.9 -41.5 40.4 38.4 77.7 51 51 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.944 111.4 46.2 -58.2 -46.4 43.4 40.7 78.1 52 52 A V H X S+ 0 0 8 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.928 113.8 47.2 -65.3 -44.5 41.1 43.6 79.0 53 53 A G H X S+ 0 0 32 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.963 113.1 48.1 -58.4 -53.3 39.0 41.6 81.4 54 54 A A H X S+ 0 0 6 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.895 111.6 51.5 -55.0 -41.2 42.0 40.1 83.2 55 55 A A H X S+ 0 0 1 -4,-2.3 4,-2.6 -5,-0.3 6,-0.3 0.890 105.5 55.2 -64.6 -39.1 43.5 43.6 83.4 56 56 A S H X>S+ 0 0 29 -4,-2.3 4,-1.4 2,-0.2 5,-1.2 0.918 113.0 43.8 -58.6 -44.5 40.2 44.9 84.9 57 57 A E H ><5S+ 0 0 128 -4,-2.3 3,-0.8 2,-0.2 -2,-0.2 0.999 116.4 42.7 -63.3 -67.1 40.6 42.3 87.6 58 58 A V H 3<5S+ 0 0 55 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.863 122.4 40.5 -47.4 -44.5 44.3 42.7 88.4 59 59 A L H 3<5S- 0 0 36 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.688 102.0-130.1 -83.0 -20.3 44.1 46.5 88.3 60 60 A G T <<5 + 0 0 65 -4,-1.4 -3,-0.2 -3,-0.8 -4,-0.1 0.829 65.5 124.5 71.4 32.3 40.8 46.9 90.1 61 61 A K S > - 0 0 47 0, 0.0 4,-1.0 0, 0.0 3,-0.8 -0.397 34.4-120.1 -61.3 147.7 36.2 48.8 85.4 63 63 A A H >> S+ 0 0 26 1,-0.2 4,-2.4 2,-0.2 3,-0.5 0.839 111.2 65.4 -58.4 -34.2 37.0 47.3 81.9 64 64 A E H 3> S+ 0 0 83 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.883 98.5 52.2 -57.0 -40.4 35.5 50.5 80.3 65 65 A E H <> S+ 0 0 33 -3,-0.8 4,-2.3 1,-0.2 -1,-0.3 0.819 109.2 51.2 -65.1 -30.3 38.3 52.6 81.8 66 66 A L H X S+ 0 0 40 -4,-2.4 4,-0.9 1,-0.2 3,-0.8 0.942 113.0 51.7 -62.6 -45.6 43.9 57.0 74.0 73 73 A Y H >X S+ 0 0 24 -4,-2.7 4,-2.9 1,-0.2 3,-0.6 0.872 99.6 64.5 -57.2 -42.2 47.1 55.0 74.0 74 74 A W H 3X S+ 0 0 46 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.827 94.2 59.3 -53.5 -38.6 46.5 53.7 70.4 75 75 A V H S+ 0 0 12 -4,-2.7 5,-2.1 1,-0.2 -1,-0.2 0.903 111.1 53.6 -60.2 -39.4 50.4 53.8 66.0 79 79 A S H <5S+ 0 0 38 -4,-1.0 5,-0.5 -5,-0.3 3,-0.3 0.825 116.7 38.3 -65.7 -29.1 52.2 57.1 65.4 80 80 A E H <5S+ 0 0 129 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.647 111.4 56.3 -97.1 -15.2 55.3 55.7 67.0 81 81 A E T <5S- 0 0 98 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.1 -0.061 130.4 -59.8-115.0 32.6 55.4 52.1 65.7 82 82 A G T 5S+ 0 0 67 -3,-0.3 4,-0.2 -4,-0.1 -3,-0.2 0.447 117.3 81.9 116.5 3.7 55.2 52.5 62.0 83 83 A Y >< + 0 0 52 -5,-2.1 4,-2.4 -6,-0.2 -4,-0.2 0.185 50.8 110.1-125.5 18.6 52.0 54.4 61.2 84 84 A G H > S+ 0 0 26 -5,-0.5 4,-2.5 -6,-0.2 5,-0.2 0.901 82.7 46.3 -59.8 -44.6 53.0 58.1 61.8 85 85 A E H > S+ 0 0 178 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.925 111.3 52.2 -68.6 -41.7 52.9 59.1 58.1 86 86 A L H > S+ 0 0 37 2,-0.2 4,-1.0 1,-0.2 -2,-0.2 0.939 110.8 48.6 -53.9 -48.8 49.6 57.3 57.6 87 87 A L H >< S+ 0 0 14 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.936 111.4 49.4 -57.8 -47.5 48.2 59.2 60.5 88 88 A A H >< S+ 0 0 57 -4,-2.5 3,-2.0 1,-0.3 -1,-0.2 0.887 104.5 58.8 -59.9 -39.2 49.5 62.5 59.2 89 89 A S H 3< S+ 0 0 78 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.703 93.9 67.7 -66.7 -19.3 48.0 61.8 55.8 90 90 A A T << S- 0 0 3 -3,-1.1 10,-0.3 -4,-1.0 -1,-0.3 0.511 113.9 -99.3 -81.0 -2.5 44.6 61.6 57.4 91 91 A G < - 0 0 9 -3,-2.0 -1,-0.2 -4,-0.2 3,-0.0 -0.484 18.8 -89.6 120.8 179.4 44.7 65.3 58.2 92 92 A D S S+ 0 0 132 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.104 94.2 57.5-122.6 20.5 45.4 68.0 60.8 93 93 A S S > S- 0 0 39 -3,-0.2 4,-2.9 1,-0.1 5,-0.2 -0.991 79.6-117.3-147.9 152.9 42.0 68.5 62.4 94 94 A L H > S+ 0 0 1 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.928 111.9 46.8 -55.3 -52.6 39.6 66.3 64.3 95 95 A P H > S+ 0 0 22 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.909 115.7 45.4 -62.5 -38.8 36.7 66.7 61.8 96 96 A E H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.939 113.0 50.9 -68.0 -44.9 38.8 66.1 58.7 97 97 A F H X S+ 0 0 8 -4,-2.9 4,-0.9 1,-0.2 -1,-0.2 0.920 110.3 48.7 -56.6 -46.3 40.6 63.1 60.4 98 98 A M H >< S+ 0 0 3 -4,-2.7 3,-0.6 1,-0.2 4,-0.4 0.895 110.1 52.1 -65.9 -35.9 37.2 61.6 61.3 99 99 A E H 3< S+ 0 0 98 -4,-2.1 3,-0.3 -5,-0.2 4,-0.3 0.858 113.7 44.8 -62.4 -34.9 36.0 62.1 57.7 100 100 A N H 3X S+ 0 0 43 -4,-2.0 4,-2.3 -10,-0.3 3,-0.2 0.548 86.2 96.0 -85.7 -8.6 39.1 60.3 56.5 101 101 A L H S+ 0 0 69 -4,-0.4 4,-2.0 -3,-0.3 -1,-0.2 0.925 114.0 47.7 -60.0 -40.7 37.3 54.9 56.7 103 103 A N H > S+ 0 0 89 -4,-0.3 4,-2.1 -3,-0.2 -2,-0.2 0.860 109.1 53.4 -67.9 -31.6 39.8 55.7 54.0 104 104 A L H X S+ 0 0 17 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.933 110.7 46.5 -67.4 -45.0 42.7 55.4 56.5 105 105 A H H X S+ 0 0 37 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.827 107.2 56.9 -67.9 -31.1 41.4 51.9 57.5 106 106 A A H X S+ 0 0 51 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.933 108.9 48.1 -61.7 -41.2 41.0 51.0 53.8 107 107 A R H X S+ 0 0 138 -4,-2.1 4,-0.7 2,-0.2 3,-0.4 0.913 111.0 48.9 -65.1 -43.0 44.8 51.9 53.5 108 108 A V H >X S+ 0 0 22 -4,-2.3 4,-2.2 1,-0.2 3,-1.4 0.922 108.0 57.1 -56.1 -42.7 45.5 49.8 56.6 109 109 A G H 3< S+ 0 0 23 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.741 91.8 67.3 -66.7 -27.2 43.5 47.0 54.9 110 110 A L H 3< S+ 0 0 149 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.845 115.1 30.8 -56.4 -31.8 45.7 47.1 51.8 111 111 A S H << S+ 0 0 94 -3,-1.4 -2,-0.2 -4,-0.7 -1,-0.2 0.731 121.0 50.0 -99.4 -30.6 48.4 45.7 54.2 112 112 A F S >< S- 0 0 13 -4,-2.2 3,-2.2 1,-0.1 -1,-0.2 -0.804 70.2-175.4-109.3 86.6 46.3 43.7 56.7 113 113 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.728 80.3 51.3 -60.4 -26.2 44.1 41.7 54.2 114 114 A Q T 3 S+ 0 0 140 -3,-0.1 -5,-0.1 2,-0.0 -112,-0.0 0.258 81.5 142.6 -93.1 12.7 42.0 40.1 57.0 115 115 A L < - 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0 0 22 -2,-0.4 39,-0.0 -18,-0.2 -2,-0.0 -0.993 45.7-138.3-149.3 150.3 31.3 47.6 64.0 137 137 A T S S+ 0 0 86 -2,-0.3 2,-0.3 -20,-0.2 -1,-0.1 0.504 91.1 74.6 -79.8 -5.3 31.2 43.9 63.6 138 138 A R S S- 0 0 32 -93,-0.0 2,-0.3 0, 0.0 3,-0.3 -0.735 75.5-126.6-114.5 158.0 32.2 43.8 67.3 139 139 A C S S+ 0 0 84 -2,-0.3 -2,-0.1 1,-0.2 0, 0.0 -0.725 78.0 15.3 -98.3 147.8 30.6 44.4 70.7 140 140 A G S S+ 0 0 41 -2,-0.3 4,-0.2 1,-0.1 -1,-0.2 0.498 77.9 116.7 83.1 8.8 31.7 46.6 73.5 141 141 A L > + 0 0 11 -3,-0.3 4,-2.0 1,-0.2 3,-0.3 0.422 40.8 100.9 -97.1 3.9 34.2 48.9 71.9 142 142 A A H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 82.1 53.9 -47.3 -45.6 32.4 52.2 72.3 143 143 A P H > S+ 0 0 22 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.894 105.1 54.1 -61.8 -35.7 34.6 53.1 75.3 144 144 A M H > S+ 0 0 28 -3,-0.3 4,-2.7 -4,-0.2 -2,-0.2 0.926 106.3 52.7 -61.3 -42.3 37.6 52.5 73.2 145 145 A V H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.908 106.6 52.6 -59.6 -42.0 36.2 55.1 70.7 146 146 A L H X S+ 0 0 5 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.943 111.3 46.7 -59.2 -46.1 35.8 57.6 73.5 147 147 A G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.906 110.8 52.1 -60.3 -42.3 39.4 57.1 74.4 148 148 A L H X S+ 0 0 32 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.897 107.1 52.8 -62.4 -40.5 40.5 57.4 70.8 149 149 A L H X S+ 0 0 2 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.904 109.5 48.8 -64.5 -39.4 38.6 60.7 70.4 150 150 A H H X S+ 0 0 9 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.909 109.7 52.8 -64.8 -39.3 40.4 62.1 73.4 151 151 A G H X S+ 0 0 5 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.904 110.0 47.0 -58.8 -44.7 43.7 60.9 71.9 152 152 A L H X S+ 0 0 8 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.869 107.1 58.4 -65.8 -36.1 42.9 62.7 68.7 153 153 A G H <>S+ 0 0 4 -4,-2.2 5,-2.8 1,-0.2 4,-0.2 0.923 110.0 43.2 -58.2 -44.1 41.9 65.8 70.7 154 154 A K H ><5S+ 0 0 117 -4,-2.2 3,-1.3 3,-0.2 -2,-0.2 0.929 111.3 54.8 -66.0 -43.2 45.4 65.8 72.2 155 155 A R H 3<5S+ 0 0 91 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.882 117.4 35.9 -56.6 -39.3 47.0 65.1 68.8 156 156 A F T 3<5S- 0 0 28 -4,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.291 107.0-122.6-100.5 9.1 45.3 68.1 67.3 157 157 A Q T < 5 + 0 0 183 -3,-1.3 2,-0.4 -4,-0.2 -3,-0.2 0.928 68.2 136.8 44.8 53.6 45.5 70.3 70.4 158 158 A T < - 0 0 34 -5,-2.8 2,-0.5 -6,-0.2 -1,-0.2 -0.971 60.7-118.8-129.8 139.1 41.7 70.6 70.4 159 159 A K - 0 0 83 23,-2.2 23,-1.4 -2,-0.4 2,-0.5 -0.693 33.1-164.9 -76.8 126.5 39.2 70.4 73.2 160 160 A V E -D 181 0B 9 -2,-0.5 2,-0.6 21,-0.2 21,-0.2 -0.958 11.3-170.5-121.2 117.6 36.9 67.5 72.5 161 161 A E E -D 180 0B 2 19,-3.3 19,-2.5 -2,-0.5 2,-0.4 -0.934 16.0-179.1-105.5 118.1 33.5 67.1 74.3 162 162 A V E +D 179 0B 9 -2,-0.6 2,-0.4 183,-0.4 185,-0.3 -0.964 13.4 174.5-127.8 128.9 31.9 63.7 73.6 163 163 A T E -D 178 0B 6 15,-2.6 15,-3.1 -2,-0.4 2,-0.5 -0.997 29.6-128.4-131.0 133.7 28.7 62.2 74.8 164 164 A Q E +D 177 0B 13 -2,-0.4 13,-0.3 13,-0.2 3,-0.1 -0.711 28.0 173.8 -83.2 128.7 27.3 58.8 73.6 165 165 A T E + 0 0 13 11,-3.1 2,-0.3 -2,-0.5 12,-0.2 0.576 63.4 34.7-113.7 -17.3 23.7 59.2 72.5 166 166 A A E -D 176 0B 6 10,-2.0 10,-1.8 6,-0.0 2,-0.5 -0.998 69.0-145.5-141.2 150.5 23.0 55.8 71.1 167 167 A F > - 0 0 3 -2,-0.3 5,-1.5 8,-0.2 8,-0.1 -0.942 12.5-158.1-126.8 118.7 24.1 52.3 72.1 168 168 A R T 5S+ 0 0 81 -2,-0.5 3,-0.4 1,-0.2 -1,-0.1 0.832 97.5 51.3 -50.6 -37.7 24.8 49.2 69.9 169 169 A E T 5S+ 0 0 133 1,-0.3 2,-2.4 2,-0.1 -1,-0.2 0.932 97.2 61.5 -78.8 -47.8 24.3 47.0 73.0 170 170 A T T 5S- 0 0 66 1,-0.1 -1,-0.3 0, 0.0 -3,-0.2 -0.338 125.8 -89.3 -78.2 56.4 20.9 48.2 74.2 171 171 A G T 5S+ 0 0 76 -2,-2.4 2,-0.3 -3,-0.4 -3,-0.2 0.637 85.4 132.2 47.6 30.1 19.3 47.1 70.9 172 172 A E S > -E 225 0C 20 40,-0.2 3,-1.6 1,-0.1 4,-0.8 -0.259 360.0-108.8 -62.8 154.5 12.7 76.5 88.3 186 3 B G H 3> S+ 0 0 0 38,-2.7 4,-2.9 35,-0.7 36,-0.3 0.762 111.3 74.2 -58.1 -30.2 12.3 79.3 85.8 187 4 B L H 3> S+ 0 0 19 35,-1.9 4,-2.1 1,-0.2 -1,-0.3 0.853 94.5 52.5 -49.8 -41.5 15.9 80.3 86.0 188 5 B V H <> S+ 0 0 19 -3,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.935 111.5 44.7 -63.1 -46.2 16.8 77.2 84.0 189 6 B N H X S+ 0 0 0 -4,-0.8 4,-2.7 1,-0.2 -2,-0.2 0.876 111.2 54.1 -67.1 -38.0 14.4 78.1 81.2 190 7 B K H X S+ 0 0 72 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.888 108.3 50.2 -58.9 -42.6 15.5 81.7 81.3 191 8 B A H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.883 110.0 49.3 -67.8 -38.9 19.1 80.5 80.8 192 9 B I H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.952 113.0 47.7 -61.4 -48.4 18.1 78.3 77.8 193 10 B Q H X S+ 0 0 50 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.911 112.9 49.2 -55.1 -45.6 16.2 81.3 76.3 194 11 B D H X S+ 0 0 57 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.931 111.1 48.5 -63.4 -47.4 19.1 83.6 76.9 195 12 B M H X S+ 0 0 14 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.964 116.7 42.0 -56.6 -53.9 21.6 81.2 75.3 196 13 B I H X S+ 0 0 5 -4,-2.7 4,-2.1 1,-0.2 5,-0.3 0.886 116.0 48.7 -63.1 -41.1 19.5 80.6 72.2 197 14 B S H X S+ 0 0 16 -4,-2.7 4,-1.6 -5,-0.3 -1,-0.2 0.879 114.2 45.7 -67.2 -40.1 18.5 84.2 71.9 198 15 B K H < S+ 0 0 123 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.897 121.1 37.0 -71.3 -40.6 22.1 85.4 72.2 199 16 B H H < S+ 0 0 112 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.722 135.6 18.3 -86.0 -22.3 23.6 82.9 69.8 200 17 B H H < S- 0 0 76 -4,-2.1 4,-0.5 -5,-0.2 -3,-0.2 0.432 105.7-113.5-131.7 -5.9 20.8 82.7 67.3 201 18 B G X - 0 0 31 -4,-1.6 4,-1.8 -5,-0.3 3,-0.1 0.057 35.9 -70.9 88.6 164.3 18.7 85.9 67.7 202 19 B E H > S+ 0 0 115 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.826 123.3 57.3 -64.2 -38.2 15.2 86.6 68.9 203 20 B D H > S+ 0 0 142 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.931 108.6 46.2 -62.4 -46.6 13.3 85.2 65.8 204 21 B T H > S+ 0 0 41 -4,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.900 111.6 53.2 -60.9 -41.8 14.9 81.8 66.2 205 22 B W H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.947 109.9 47.4 -57.2 -47.9 14.1 81.9 69.9 206 23 B E H X S+ 0 0 87 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.881 109.8 52.6 -62.7 -39.4 10.4 82.6 69.1 207 24 B A H X S+ 0 0 47 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.925 112.5 46.1 -60.2 -43.8 10.2 79.9 66.6 208 25 B I H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.930 112.0 50.1 -64.0 -47.1 11.6 77.5 69.2 209 26 B K H <>S+ 0 0 13 -4,-2.8 5,-2.3 2,-0.2 4,-0.3 0.922 112.5 47.6 -56.7 -48.9 9.2 78.7 71.9 210 27 B Q H ><5S+ 0 0 97 -4,-2.8 3,-1.7 1,-0.2 5,-0.4 0.938 111.6 50.0 -58.6 -49.7 6.3 78.3 69.5 211 28 B K H 3<5S+ 0 0 107 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.813 105.2 57.7 -60.2 -31.5 7.3 74.8 68.5 212 29 B A T 3<5S- 0 0 11 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.539 118.0-113.3 -77.5 -5.8 7.7 73.8 72.1 213 30 B G T < 5S+ 0 0 58 -3,-1.7 3,-0.3 -4,-0.3 -3,-0.2 0.673 89.0 112.8 82.4 20.7 4.1 74.8 72.7 214 31 B L > < + 0 0 17 -5,-2.3 3,-1.3 -6,-0.2 -4,-0.2 0.121 24.8 122.0-112.0 19.5 5.0 77.7 74.9 215 32 B E T 3 S+ 0 0 105 -5,-0.4 -1,-0.2 -6,-0.3 -5,-0.1 0.810 73.7 57.9 -53.0 -31.6 3.8 80.6 72.7 216 33 B D T 3 S+ 0 0 132 -3,-0.3 2,-0.8 -6,-0.1 -1,-0.3 0.799 81.6 92.6 -72.5 -30.5 1.5 81.7 75.5 217 34 B I < - 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