==== 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 SIGNALING PROTEIN/SIGNALING PROTEIN 17-MAR-09 3GNI . COMPND 2 MOLECULE: PROTEIN MO25; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.ZEQIRAJ,S.GOLDIE,D.R.ALESSI,D.M.F.VAN AALTEN . 639 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31348.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 443 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 31 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 264 41.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 6 0 0 3 3 2 3 2 0 0 1 3 5 0 0 0 1 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 2 1 0 0 1 3 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 . 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A P 0 0 178 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 111.4 1.6 12.8 -29.4 2 3 A F - 0 0 158 1,-0.1 2,-1.7 0, 0.0 0, 0.0 -0.441 360.0-129.3 -66.9 121.7 3.2 16.3 -29.6 3 4 A P + 0 0 112 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.496 33.1 179.7 -83.4 77.6 6.7 15.9 -28.1 4 5 A F - 0 0 167 -2,-1.7 2,-0.1 1,-0.1 0, 0.0 -0.235 31.2-100.5 -66.8 160.6 7.2 18.7 -25.5 5 6 A G - 0 0 77 1,-0.0 2,-0.6 0, 0.0 -1,-0.1 -0.430 30.9-118.1 -78.0 157.8 10.4 19.1 -23.5 6 7 A K - 0 0 200 -2,-0.1 2,-0.4 0, 0.0 -1,-0.0 -0.889 20.1-145.9-101.6 122.6 10.8 17.9 -19.9 7 8 A S - 0 0 106 -2,-0.6 2,-0.1 1,-0.1 0, 0.0 -0.752 25.2-113.6 -87.2 131.2 11.4 20.5 -17.2 8 9 A H - 0 0 176 -2,-0.4 2,-0.4 1,-0.0 -1,-0.1 -0.331 34.5-168.2 -64.3 137.9 13.7 19.3 -14.3 9 10 A K - 0 0 110 -2,-0.1 -1,-0.0 39,-0.0 5,-0.0 -0.995 20.0-118.7-134.6 139.2 12.2 19.0 -10.8 10 11 A S > - 0 0 40 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.289 30.6-113.6 -64.4 153.4 13.6 18.6 -7.3 11 12 A P H > S+ 0 0 8 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.880 118.0 56.1 -52.1 -39.6 12.7 15.4 -5.3 12 13 A A H > S+ 0 0 27 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.890 109.1 43.7 -61.7 -45.7 10.9 17.8 -2.9 13 14 A D H > S+ 0 0 79 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.787 112.7 53.3 -71.0 -32.6 8.6 19.2 -5.6 14 15 A I H X S+ 0 0 6 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.910 110.3 46.6 -66.1 -45.2 8.0 15.8 -7.1 15 16 A V H X S+ 0 0 3 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.943 114.9 48.0 -61.4 -46.8 6.9 14.5 -3.7 16 17 A K H X S+ 0 0 115 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.907 110.6 50.6 -56.0 -51.8 4.7 17.6 -3.2 17 18 A N H X S+ 0 0 54 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.897 113.0 46.2 -52.8 -48.1 3.2 17.2 -6.7 18 19 A L H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.901 109.0 54.7 -67.0 -42.9 2.3 13.5 -6.1 19 20 A K H X S+ 0 0 115 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.918 112.7 43.7 -53.9 -48.8 0.9 14.3 -2.7 20 21 A E H X S+ 0 0 131 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.841 114.8 48.5 -67.7 -38.0 -1.5 16.8 -4.2 21 22 A S H X S+ 0 0 6 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.883 108.7 52.7 -72.1 -37.9 -2.4 14.6 -7.2 22 23 A M H X S+ 0 0 1 -4,-3.1 4,-1.5 1,-0.2 -2,-0.2 0.932 105.2 56.8 -59.5 -44.0 -3.1 11.6 -5.0 23 24 A A H X S+ 0 0 49 -4,-1.8 4,-0.6 -5,-0.2 -1,-0.2 0.820 106.2 50.0 -54.6 -37.3 -5.5 13.8 -2.9 24 25 A V H >< S+ 0 0 32 -4,-1.1 3,-1.0 1,-0.2 -1,-0.2 0.932 108.6 51.8 -66.8 -48.5 -7.5 14.6 -6.1 25 26 A L H 3< S+ 0 0 14 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.742 101.6 60.9 -58.4 -30.0 -7.8 10.9 -7.1 26 27 A E H 3< S+ 0 0 37 -4,-1.5 313,-2.4 -5,-0.1 -1,-0.2 0.792 90.6 88.6 -71.5 -26.2 -9.1 9.9 -3.7 27 28 A K << - 0 0 100 -3,-1.0 3,-0.2 -4,-0.6 311,-0.0 -0.495 58.4-164.9 -74.7 135.6 -12.1 12.3 -4.3 28 29 A Q S S+ 0 0 108 -2,-0.2 2,-1.9 1,-0.2 -1,-0.1 0.858 76.4 69.7 -78.6 -41.7 -15.3 10.9 -6.0 29 30 A D S S+ 0 0 162 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.445 73.4 107.2 -92.5 66.9 -16.9 14.2 -6.8 30 31 A I S S- 0 0 34 -2,-1.9 5,-0.0 -3,-0.2 -6,-0.0 -0.972 72.1 -96.3-136.7 151.2 -14.6 15.6 -9.5 31 32 A S > - 0 0 68 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.200 35.9-110.8 -62.4 156.9 -15.1 16.1 -13.3 32 33 A D H > S+ 0 0 144 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.851 119.1 51.4 -57.2 -37.9 -13.7 13.4 -15.7 33 34 A K H > S+ 0 0 145 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.904 108.6 49.8 -68.9 -41.8 -11.1 15.9 -16.9 34 35 A K H > S+ 0 0 118 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.887 114.6 45.4 -61.8 -40.0 -9.9 16.8 -13.4 35 36 A A H X S+ 0 0 29 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.878 113.3 50.2 -67.8 -40.9 -9.6 13.0 -12.6 36 37 A E H X S+ 0 0 102 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.906 109.9 51.0 -62.4 -47.0 -7.8 12.5 -15.9 37 38 A K H X S+ 0 0 123 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.910 112.1 45.8 -57.2 -47.9 -5.4 15.3 -15.2 38 39 A A H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.868 110.2 55.0 -66.6 -36.9 -4.6 13.9 -11.8 39 40 A T H X S+ 0 0 45 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.945 110.0 46.0 -57.7 -50.0 -4.2 10.4 -13.3 40 41 A E H X S+ 0 0 91 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.870 114.0 48.8 -61.3 -40.2 -1.6 11.8 -15.8 41 42 A E H X S+ 0 0 69 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.905 109.5 49.9 -68.9 -45.6 0.3 13.7 -13.1 42 43 A V H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.968 112.6 49.9 -52.3 -54.8 0.5 10.7 -10.7 43 44 A S H X S+ 0 0 22 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.877 112.5 45.5 -49.6 -47.9 1.8 8.6 -13.6 44 45 A K H X S+ 0 0 136 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.845 112.9 49.6 -72.4 -38.0 4.5 11.2 -14.6 45 46 A N H X S+ 0 0 11 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.866 110.1 51.1 -64.7 -42.8 5.7 11.8 -11.0 46 47 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.895 110.0 49.6 -63.2 -43.0 6.0 8.1 -10.4 47 48 A V H X S+ 0 0 53 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.916 111.6 50.4 -58.7 -43.8 8.1 7.7 -13.6 48 49 A A H X S+ 0 0 33 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.875 111.4 47.2 -61.4 -41.0 10.2 10.7 -12.3 49 50 A M H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 3,-0.2 0.921 110.1 52.0 -67.4 -49.1 10.7 9.1 -8.9 50 51 A K H X S+ 0 0 54 -4,-2.5 4,-2.9 1,-0.2 5,-0.5 0.897 108.7 52.2 -49.0 -46.1 11.6 5.7 -10.4 51 52 A E H X S+ 0 0 85 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.810 106.4 52.7 -69.8 -29.5 14.2 7.4 -12.6 52 53 A I H < S+ 0 0 32 -4,-1.3 10,-0.3 -3,-0.2 -1,-0.2 0.855 117.0 39.2 -65.7 -36.5 15.8 9.1 -9.5 53 54 A L H < S+ 0 0 4 -4,-1.6 -2,-0.2 -3,-0.2 -3,-0.1 0.858 132.0 23.0 -87.6 -39.2 16.2 5.8 -7.7 54 55 A Y H < S- 0 0 42 -4,-2.9 -3,-0.2 1,-0.3 2,-0.2 0.632 94.9-149.8 -98.1 -17.1 17.2 3.5 -10.6 55 56 A G < - 0 0 9 -4,-1.1 -1,-0.3 -5,-0.5 5,-0.2 -0.514 26.8 -84.0 73.6-151.3 18.6 6.1 -12.9 56 57 A T - 0 0 50 3,-3.6 0, 0.0 -2,-0.2 0, 0.0 -0.630 41.4 -81.6-134.7-169.0 18.3 5.5 -16.7 57 58 A N S S+ 0 0 140 -2,-0.2 3,-0.1 1,-0.1 -2,-0.0 0.640 132.9 34.1 -71.8 -15.7 20.0 3.6 -19.5 58 59 A E S S+ 0 0 168 1,-0.2 2,-0.4 2,-0.0 -1,-0.1 0.770 120.8 41.7-106.8 -39.4 22.3 6.7 -19.7 59 60 A K - 0 0 157 3,-0.0 -3,-3.6 0, 0.0 -1,-0.2 -0.904 66.2-142.5-117.8 139.9 22.7 7.8 -16.0 60 61 A E - 0 0 163 -2,-0.4 -5,-0.2 -5,-0.2 -6,-0.1 -0.657 44.8 -83.4 -91.1 156.2 23.1 5.9 -12.8 61 62 A P - 0 0 39 0, 0.0 2,-0.5 0, 0.0 -8,-0.1 -0.356 40.2-138.0 -63.3 137.4 21.3 7.1 -9.6 62 63 A Q >> - 0 0 149 -10,-0.3 4,-1.9 1,-0.1 3,-0.5 -0.869 10.2-133.2-102.0 131.0 23.1 9.9 -7.7 63 64 A T H 3> S+ 0 0 119 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.730 100.6 55.4 -57.0 -38.2 23.1 9.6 -3.9 64 65 A E H 3> S+ 0 0 145 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.941 111.1 44.6 -59.2 -52.0 22.1 13.2 -3.0 65 66 A A H <> S+ 0 0 19 -3,-0.5 4,-2.1 1,-0.2 -2,-0.2 0.892 114.9 49.7 -58.7 -42.5 19.0 13.0 -5.1 66 67 A V H X S+ 0 0 20 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.899 111.6 47.6 -64.6 -43.1 18.2 9.5 -3.7 67 68 A A H X S+ 0 0 38 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.829 111.5 49.8 -69.8 -37.8 18.7 10.7 -0.1 68 69 A Q H X S+ 0 0 94 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.913 113.2 48.6 -62.3 -44.8 16.5 13.8 -0.6 69 70 A L H X S+ 0 0 0 -4,-2.1 4,-3.1 -5,-0.2 -2,-0.2 0.947 111.1 46.7 -64.0 -52.3 13.8 11.6 -2.1 70 71 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 5,-0.2 0.934 113.8 49.8 -56.3 -48.0 13.8 9.0 0.6 71 72 A Q H X S+ 0 0 106 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.944 113.0 45.9 -53.1 -53.2 13.7 11.7 3.3 72 73 A E H X S+ 0 0 62 -4,-2.5 4,-1.8 1,-0.2 6,-0.2 0.899 110.5 54.1 -59.0 -44.2 10.8 13.5 1.6 73 74 A L H X>S+ 0 0 0 -4,-3.1 5,-1.0 1,-0.2 4,-0.9 0.884 110.7 45.9 -57.3 -42.1 9.0 10.2 1.1 74 75 A Y H <5S+ 0 0 35 -4,-2.3 3,-0.3 1,-0.2 -2,-0.2 0.876 113.0 49.3 -69.6 -40.9 9.2 9.4 4.9 75 76 A N H <5S+ 0 0 116 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.796 111.8 48.5 -70.4 -28.9 8.1 12.8 6.0 76 77 A S H <5S- 0 0 22 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.642 98.3-130.1 -88.1 -18.5 5.1 13.0 3.7 77 78 A G T >X5 + 0 0 21 -4,-0.9 4,-2.0 -3,-0.3 3,-0.7 0.677 64.5 136.1 74.1 20.2 3.6 9.5 4.5 78 79 A L H 3>< + 0 0 0 -5,-1.0 4,-2.9 1,-0.3 5,-0.3 0.759 60.0 65.0 -74.7 -27.6 3.4 8.8 0.8 79 80 A L H 3> S+ 0 0 4 -6,-0.7 4,-0.7 2,-0.2 -1,-0.3 0.805 110.3 39.5 -59.9 -33.1 4.7 5.3 1.2 80 81 A S H <> S+ 0 0 27 -3,-0.7 4,-2.8 2,-0.2 -2,-0.2 0.890 115.6 51.0 -79.3 -46.2 1.5 4.6 3.2 81 82 A T H X S+ 0 0 41 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.847 108.5 51.5 -61.4 -39.8 -0.7 6.7 0.8 82 83 A L H < S+ 0 0 3 -4,-2.9 4,-0.2 2,-0.2 -1,-0.2 0.843 113.6 43.8 -70.6 -36.6 0.5 5.0 -2.4 83 84 A V H >< S+ 0 0 8 -4,-0.7 3,-0.9 -5,-0.3 4,-0.3 0.926 115.9 48.3 -70.0 -45.9 -0.1 1.5 -0.9 84 85 A A H 3< S+ 0 0 26 -4,-2.8 3,-0.2 1,-0.2 -2,-0.2 0.827 122.0 34.5 -62.7 -31.7 -3.5 2.6 0.5 85 86 A D T >< S+ 0 0 0 -4,-2.0 3,-3.0 -5,-0.2 4,-0.4 0.253 79.5 120.4-109.3 7.8 -4.5 4.2 -2.9 86 87 A L G X + 0 0 1 -3,-0.9 3,-1.5 1,-0.3 -1,-0.2 0.797 69.6 62.0 -43.5 -39.3 -2.8 1.7 -5.1 87 88 A Q G 3 S+ 0 0 46 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.709 97.0 58.7 -61.1 -22.6 -6.2 0.8 -6.7 88 89 A L G < S+ 0 0 26 -3,-3.0 -1,-0.3 2,-0.0 2,-0.2 0.534 90.6 91.2 -87.2 -6.4 -6.6 4.4 -8.0 89 90 A I S < S- 0 0 6 -3,-1.5 -50,-0.1 -4,-0.4 5,-0.0 -0.578 81.8-102.4 -96.7 150.7 -3.4 4.3 -10.0 90 91 A D > - 0 0 52 -51,-0.2 4,-2.2 -2,-0.2 5,-0.2 -0.142 40.8 -96.0 -63.9 163.9 -2.9 3.3 -13.7 91 92 A F H > S+ 0 0 77 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.884 123.6 38.7 -47.2 -51.0 -1.5 -0.1 -14.8 92 93 A E H > S+ 0 0 51 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.792 112.5 56.0 -79.1 -30.2 2.1 1.1 -15.3 93 94 A G H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.829 101.8 58.1 -67.6 -33.9 2.1 3.4 -12.2 94 95 A K H X S+ 0 0 18 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.865 108.3 45.9 -61.8 -39.3 1.1 0.5 -10.0 95 96 A K H X S+ 0 0 5 -4,-0.9 4,-2.1 2,-0.2 -2,-0.2 0.817 110.7 54.2 -70.3 -37.9 4.3 -1.3 -11.2 96 97 A D H X S+ 0 0 9 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.887 104.8 53.5 -60.7 -40.8 6.2 2.0 -10.6 97 98 A V H X S+ 0 0 3 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.966 109.0 49.5 -58.8 -51.1 4.9 2.1 -7.0 98 99 A A H X S+ 0 0 4 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.910 113.0 46.3 -50.8 -48.9 6.2 -1.5 -6.5 99 100 A Q H X S+ 0 0 57 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.916 114.2 46.7 -64.2 -47.2 9.7 -0.6 -7.9 100 101 A I H X S+ 0 0 1 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.910 115.1 47.6 -55.6 -46.9 10.0 2.7 -5.9 101 102 A F H X S+ 0 0 5 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.919 111.4 49.3 -63.3 -49.5 8.9 0.9 -2.7 102 103 A N H X S+ 0 0 22 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.845 111.9 49.1 -59.5 -39.3 11.3 -2.0 -3.2 103 104 A N H < S+ 0 0 37 -4,-1.9 4,-0.3 2,-0.2 -2,-0.2 0.896 112.2 46.3 -71.5 -43.7 14.2 0.3 -3.8 104 105 A I H >< S+ 0 0 0 -4,-2.2 3,-1.7 1,-0.2 11,-0.3 0.920 110.0 56.3 -58.7 -46.4 13.6 2.5 -0.8 105 106 A L H 3< S+ 0 0 1 -4,-2.4 11,-0.3 1,-0.3 10,-0.2 0.806 105.3 50.2 -59.0 -35.0 13.1 -0.7 1.3 106 107 A R T 3< S+ 0 0 56 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.503 83.8 124.6 -79.7 -6.8 16.6 -2.0 0.4 107 108 A R < - 0 0 57 -3,-1.7 8,-0.5 -4,-0.3 2,-0.4 -0.327 41.5-172.4 -64.0 135.5 18.1 1.4 1.3 108 109 A Q - 0 0 139 5,-0.2 2,-0.8 6,-0.1 5,-0.2 -0.948 20.5-169.5-143.6 109.5 20.8 0.9 3.8 109 110 A I B > S-A 112 0A 93 3,-0.8 3,-1.2 -2,-0.4 2,-0.3 -0.891 74.2 -49.5-100.1 102.7 22.7 3.6 5.8 110 111 A G T 3 S- 0 0 60 -2,-0.8 0, 0.0 1,-0.3 0, 0.0 -0.550 119.1 -26.0 69.1-129.2 25.6 1.7 7.4 111 112 A T T 3 S+ 0 0 144 -2,-0.3 -1,-0.3 -3,-0.0 -2,-0.0 0.713 122.4 96.3 -83.1 -24.0 24.3 -1.4 9.2 112 113 A R B < -A 109 0A 143 -3,-1.2 -3,-0.8 -4,-0.1 0, 0.0 -0.211 60.4-155.9 -70.8 154.6 20.9 0.3 9.6 113 114 A T >> - 0 0 33 -5,-0.2 4,-1.4 1,-0.1 3,-0.9 -0.792 10.1-170.4-133.5 88.0 17.9 -0.2 7.3 114 115 A P H 3> S+ 0 0 12 0, 0.0 4,-1.5 0, 0.0 -6,-0.1 0.649 79.1 56.2 -59.9 -25.3 15.7 3.0 7.7 115 116 A T H 3> S+ 0 0 2 -8,-0.5 4,-2.6 -11,-0.3 5,-0.2 0.852 104.9 53.1 -80.0 -34.2 12.6 1.9 5.8 116 117 A V H <> S+ 0 0 7 -3,-0.9 4,-1.6 -11,-0.3 -1,-0.2 0.940 108.8 50.7 -60.0 -49.4 12.2 -1.2 8.0 117 118 A E H X S+ 0 0 83 -4,-1.4 4,-0.7 1,-0.2 -2,-0.2 0.882 111.4 49.1 -51.9 -43.3 12.3 1.2 11.0 118 119 A Y H >X S+ 0 0 33 -4,-1.5 4,-0.8 1,-0.2 3,-0.8 0.891 107.7 51.5 -70.7 -41.0 9.7 3.3 9.3 119 120 A I H 3< S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.2 7,-0.2 0.788 102.2 62.3 -68.2 -24.2 7.3 0.5 8.5 120 121 A C H 3< S+ 0 0 45 -4,-1.6 3,-0.3 1,-0.2 -1,-0.2 0.777 107.5 43.3 -69.7 -26.2 7.6 -0.7 12.2 121 122 A T H << S+ 0 0 103 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.606 122.7 40.9 -87.1 -13.5 6.0 2.7 13.1 122 123 A Q >< + 0 0 82 -4,-0.8 3,-1.3 -5,-0.1 4,-0.3 -0.505 69.3 157.7-134.1 64.0 3.5 2.3 10.2 123 124 A Q T >> + 0 0 83 -3,-0.3 4,-1.0 1,-0.3 3,-0.9 0.667 58.8 76.6 -72.6 -21.7 2.5 -1.4 10.3 124 125 A N H 3> S+ 0 0 98 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.718 81.5 74.0 -62.9 -19.8 -0.9 -1.2 8.5 125 126 A I H <> S+ 0 0 0 -3,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.953 97.7 47.3 -52.2 -51.2 1.2 -0.9 5.3 126 127 A L H <> S+ 0 0 0 -3,-0.9 4,-2.1 -4,-0.3 -2,-0.2 0.875 112.7 47.9 -56.2 -44.0 1.9 -4.6 5.7 127 128 A F H X S+ 0 0 36 -4,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.857 109.8 52.1 -73.2 -32.8 -1.7 -5.4 6.3 128 129 A M H X S+ 0 0 42 -4,-2.8 4,-0.9 2,-0.2 -2,-0.2 0.881 110.3 49.4 -65.5 -40.6 -2.9 -3.4 3.3 129 130 A L H < S+ 0 0 0 -4,-2.2 3,-0.4 -5,-0.2 4,-0.3 0.919 111.9 47.8 -62.1 -46.5 -0.4 -5.3 1.1 130 131 A L H >< S+ 0 0 2 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.928 110.1 51.9 -61.0 -47.7 -1.7 -8.6 2.4 131 132 A K H >< S+ 0 0 102 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.717 92.8 78.4 -59.9 -22.4 -5.3 -7.5 1.9 132 133 A G G >< S+ 0 0 2 -4,-0.9 3,-1.7 -3,-0.4 6,-0.3 0.727 74.9 75.2 -60.3 -22.5 -4.3 -6.7 -1.7 133 134 A Y G < S+ 0 0 2 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.760 87.0 62.0 -60.6 -25.3 -4.5 -10.4 -2.6 134 135 A E G < S+ 0 0 85 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.447 95.1 68.1 -81.4 -2.7 -8.3 -10.1 -2.6 135 136 A S X> - 0 0 53 -3,-1.7 4,-1.5 1,-0.1 3,-1.2 -0.948 69.1-154.6-126.0 109.8 -8.3 -7.6 -5.4 136 137 A P T 34 S+ 0 0 103 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.788 91.4 57.9 -57.3 -31.8 -7.2 -8.8 -8.9 137 138 A E T 34 S+ 0 0 104 1,-0.2 4,-0.2 2,-0.1 -5,-0.0 0.804 122.3 22.4 -69.0 -29.5 -6.1 -5.4 -10.1 138 139 A I T <> S+ 0 0 21 -3,-1.2 4,-2.4 -6,-0.3 5,-0.2 0.447 96.4 96.5-114.0 -6.0 -3.6 -4.8 -7.3 139 140 A A H X S+ 0 0 1 -4,-1.5 4,-2.7 1,-0.2 5,-0.1 0.880 83.9 46.8 -60.9 -46.2 -2.8 -8.3 -6.1 140 141 A L H > S+ 0 0 19 -4,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.931 115.4 45.6 -65.6 -47.5 0.4 -9.0 -8.1 141 142 A N H > S+ 0 0 14 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.857 113.2 50.3 -64.5 -37.0 2.0 -5.7 -7.2 142 143 A C H X S+ 0 0 2 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.930 109.8 51.8 -62.2 -46.1 1.0 -6.0 -3.6 143 144 A G H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.912 108.7 49.7 -55.8 -49.4 2.6 -9.5 -3.6 144 145 A I H X S+ 0 0 31 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.908 114.8 44.8 -56.2 -46.3 5.9 -8.2 -5.1 145 146 A M H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.901 114.3 48.0 -65.9 -44.6 6.0 -5.5 -2.4 146 147 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.869 107.8 55.2 -63.6 -40.3 5.0 -7.8 0.5 147 148 A R H < S+ 0 0 50 -4,-2.6 -1,-0.2 -5,-0.2 4,-0.2 0.811 109.4 47.7 -67.5 -28.5 7.6 -10.4 -0.6 148 149 A E H >< S+ 0 0 42 -4,-1.2 3,-0.6 -5,-0.2 4,-0.2 0.836 110.4 53.2 -78.1 -33.5 10.3 -7.7 -0.4 149 150 A C H >< S+ 0 0 0 -4,-1.7 3,-1.9 1,-0.2 6,-0.3 0.916 103.3 55.5 -60.5 -46.8 9.0 -6.6 3.0 150 151 A I T 3< S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.501 86.1 79.9 -77.3 -2.3 9.2 -10.1 4.5 151 152 A R T < S+ 0 0 64 -3,-0.6 2,-0.5 -4,-0.2 -1,-0.3 0.702 85.2 74.2 -64.7 -24.6 12.9 -10.4 3.6 152 153 A H S X> S- 0 0 29 -3,-1.9 4,-2.1 -4,-0.2 3,-0.9 -0.862 84.5-139.1 -99.8 124.3 13.4 -8.3 6.7 153 154 A E H 3> S+ 0 0 94 -2,-0.5 4,-2.4 1,-0.3 5,-0.2 0.815 97.4 54.9 -54.1 -44.8 12.9 -10.2 10.0 154 155 A P H 3> S+ 0 0 60 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.862 112.7 44.4 -58.4 -34.5 11.0 -7.4 11.9 155 156 A L H <> S+ 0 0 0 -3,-0.9 4,-1.7 -6,-0.3 -2,-0.2 0.884 110.7 53.4 -79.5 -40.6 8.4 -7.2 9.2 156 157 A A H X S+ 0 0 1 -4,-2.1 4,-2.4 -7,-0.3 -1,-0.2 0.892 108.3 52.6 -49.8 -45.3 8.2 -11.0 8.8 157 158 A K H X S+ 0 0 101 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.901 104.2 54.5 -64.6 -44.7 7.5 -11.1 12.6 158 159 A I H < S+ 0 0 31 -4,-1.5 -1,-0.2 1,-0.2 4,-0.2 0.920 113.8 41.6 -53.9 -48.5 4.6 -8.6 12.5 159 160 A I H >< S+ 0 0 0 -4,-1.7 3,-1.3 1,-0.2 6,-0.5 0.922 113.2 52.9 -66.1 -44.4 2.8 -10.6 9.8 160 161 A L H 3< S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.814 111.2 45.9 -62.5 -34.4 3.5 -14.0 11.4 161 162 A W T 3< S+ 0 0 72 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.315 98.4 96.4 -92.9 7.0 2.1 -13.0 14.8 162 163 A S S < S- 0 0 15 -3,-1.3 3,-0.3 -4,-0.2 4,-0.3 -0.506 78.9-124.3 -94.9 160.9 -1.0 -11.3 13.4 163 164 A E S > S+ 0 0 119 1,-0.2 3,-1.3 -2,-0.2 4,-0.2 0.834 109.1 65.6 -60.9 -37.8 -4.6 -12.6 13.0 164 165 A Q G > S+ 0 0 77 1,-0.3 3,-1.9 2,-0.2 4,-0.3 0.730 79.9 77.9 -66.1 -26.8 -4.3 -11.6 9.3 165 166 A F G > S+ 0 0 0 -6,-0.5 3,-1.7 -3,-0.3 -1,-0.3 0.839 85.5 63.4 -46.9 -38.9 -1.6 -14.3 8.6 166 167 A Y G X S+ 0 0 13 -3,-1.3 3,-1.1 -4,-0.3 4,-0.4 0.649 83.2 76.6 -70.4 -13.3 -4.4 -17.0 8.5 167 168 A D G X> S+ 0 0 33 -3,-1.9 4,-2.3 1,-0.2 3,-0.9 0.737 79.0 74.4 -63.1 -24.9 -6.0 -15.3 5.5 168 169 A F H <> S+ 0 0 0 -3,-1.7 4,-2.7 -4,-0.3 -1,-0.2 0.835 84.4 63.8 -55.7 -37.6 -3.1 -16.9 3.5 169 170 A F H <4 S+ 0 0 10 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.2 0.825 109.2 40.5 -62.1 -31.8 -4.9 -20.3 3.9 170 171 A R H X4 S+ 0 0 133 -3,-0.9 3,-1.7 -4,-0.4 -2,-0.2 0.919 114.3 52.9 -70.8 -51.8 -7.8 -18.8 1.8 171 172 A Y H >< S+ 0 0 2 -4,-2.3 3,-1.4 1,-0.3 12,-0.2 0.820 101.4 58.2 -58.3 -38.9 -5.4 -17.0 -0.6 172 173 A V T 3< S+ 0 0 3 -4,-2.7 -1,-0.3 1,-0.3 -3,-0.1 0.570 108.4 47.6 -70.2 -9.0 -3.3 -20.0 -1.6 173 174 A E T < S+ 0 0 68 -3,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.201 79.5 135.7-115.2 9.3 -6.5 -21.8 -2.8 174 175 A M < - 0 0 42 -3,-1.4 6,-0.2 -4,-0.1 7,-0.1 -0.320 61.4-127.3 -58.5 140.6 -7.9 -18.9 -4.9 175 176 A S S S+ 0 0 67 254,-0.1 2,-0.8 5,-0.1 255,-0.3 0.731 94.2 82.4 -72.4 -23.2 -9.1 -20.1 -8.2 176 177 A T S > S- 0 0 42 1,-0.2 4,-2.2 253,-0.1 3,-0.5 -0.772 73.4-159.1 -77.0 108.9 -7.0 -17.6 -10.2 177 178 A F H > S+ 0 0 10 251,-2.4 4,-2.5 -2,-0.8 5,-0.2 0.780 81.8 61.8 -71.7 -32.3 -3.8 -19.6 -10.2 178 179 A D H > S+ 0 0 15 250,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.902 112.2 39.2 -58.5 -40.9 -1.4 -16.7 -10.8 179 180 A I H > S+ 0 0 11 -3,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.930 114.4 52.1 -77.9 -44.2 -2.5 -15.1 -7.6 180 181 A A H X S+ 0 0 5 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.889 111.9 48.4 -53.4 -43.5 -2.7 -18.3 -5.5 181 182 A S H X S+ 0 0 15 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.909 110.6 50.3 -62.0 -48.6 0.9 -19.2 -6.7 182 183 A D H X S+ 0 0 12 -4,-1.7 4,-1.4 -5,-0.2 -2,-0.2 0.901 112.7 47.4 -53.6 -45.8 2.1 -15.7 -5.7 183 184 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.851 109.8 51.1 -69.4 -39.9 0.5 -16.0 -2.2 184 185 A F H X S+ 0 0 10 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.849 106.8 56.3 -66.0 -33.9 1.9 -19.5 -1.6 185 186 A A H X S+ 0 0 45 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.887 110.9 42.9 -61.3 -40.2 5.3 -18.1 -2.5 186 187 A T H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.877 114.0 51.8 -72.1 -39.6 5.0 -15.4 0.2 187 188 A F H X S+ 0 0 0 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.904 111.7 46.1 -63.2 -45.6 3.6 -18.0 2.7 188 189 A K H X S+ 0 0 83 -4,-2.6 4,-1.1 2,-0.2 5,-0.2 0.919 110.7 52.7 -67.2 -45.9 6.4 -20.4 2.1 189 190 A D H >X S+ 0 0 24 -4,-2.0 4,-2.6 1,-0.2 3,-0.8 0.924 107.8 52.5 -53.0 -48.9 9.1 -17.6 2.4 190 191 A L H 3< S+ 0 0 5 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.853 113.8 42.7 -53.0 -41.1 7.5 -16.6 5.7 191 192 A L H 3< S+ 0 0 1 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.587 126.4 30.2 -84.8 -12.5 7.8 -20.1 7.1 192 193 A T H << S+ 0 0 35 -4,-1.1 3,-0.3 -3,-0.8 -2,-0.2 0.568 103.8 65.5-125.7 -16.8 11.3 -20.9 5.7 193 194 A R S < S+ 0 0 112 -4,-2.6 2,-1.1 1,-0.3 -3,-0.1 0.974 106.4 36.0 -79.8 -58.1 13.4 -17.7 5.5 194 195 A H S > S- 0 0 41 -5,-0.4 4,-2.6 -4,-0.3 -1,-0.3 -0.777 76.7-176.7 -98.9 89.3 13.9 -16.7 9.1 195 196 A K H > S+ 0 0 65 -2,-1.1 4,-1.9 -3,-0.3 -1,-0.2 0.747 76.4 49.3 -68.0 -31.9 14.1 -20.1 10.6 196 197 A L H > S+ 0 0 118 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.938 114.3 46.7 -68.9 -47.1 14.4 -19.2 14.2 197 198 A L H > S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.879 114.0 48.4 -58.7 -42.5 11.4 -16.9 13.9 198 199 A S H X S+ 0 0 1 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.884 109.3 52.2 -67.6 -41.1 9.4 -19.5 12.0 199 200 A A H X S+ 0 0 12 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.905 111.7 47.0 -62.3 -43.1 10.3 -22.2 14.6 200 201 A E H X S+ 0 0 89 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.923 111.0 51.8 -63.7 -47.9 9.0 -19.9 17.4 201 202 A F H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.915 111.3 47.7 -52.2 -48.6 5.8 -19.1 15.4 202 203 A L H < S+ 0 0 0 -4,-2.5 4,-0.3 2,-0.2 -1,-0.2 0.868 112.1 48.0 -66.4 -40.7 5.1 -22.8 14.9 203 204 A E H >< S+ 0 0 85 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.923 117.6 42.7 -61.8 -43.9 5.7 -23.7 18.6 204 205 A Q H 3< S+ 0 0 124 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.733 126.9 29.4 -77.9 -25.7 3.5 -20.8 19.8 205 206 A H T 3X S+ 0 0 39 -4,-2.0 4,-2.5 -5,-0.2 5,-0.3 0.060 80.7 131.8-121.4 21.7 0.6 -21.2 17.3 206 207 A Y H <> S+ 0 0 15 -3,-0.6 4,-2.7 -4,-0.3 5,-0.3 0.843 70.3 45.5 -40.5 -57.5 0.9 -25.0 16.7 207 208 A D H > S+ 0 0 121 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.904 116.7 41.3 -65.3 -48.8 -2.7 -25.9 17.1 208 209 A R H > S+ 0 0 100 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.929 116.8 49.8 -64.6 -44.6 -4.3 -23.2 14.9 209 210 A F H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.932 114.6 41.9 -60.0 -50.1 -1.6 -23.4 12.2 210 211 A F H X S+ 0 0 18 -4,-2.7 4,-1.9 -5,-0.3 -1,-0.2 0.732 110.4 57.6 -76.7 -21.6 -1.8 -27.2 11.8 211 212 A S H X S+ 0 0 62 -4,-1.5 4,-0.7 -5,-0.3 -1,-0.2 0.916 114.2 38.9 -67.3 -45.0 -5.6 -27.2 12.0 212 213 A E H >X S+ 0 0 42 -4,-2.2 4,-0.8 2,-0.2 3,-0.6 0.881 115.1 54.0 -67.1 -41.8 -5.6 -24.8 9.0 213 214 A Y H >X S+ 0 0 1 -4,-2.8 4,-1.4 1,-0.2 3,-0.7 0.854 99.6 61.8 -64.1 -36.6 -2.7 -26.7 7.4 214 215 A E H 3< S+ 0 0 75 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.841 99.0 56.9 -55.5 -37.2 -4.6 -30.0 7.7 215 216 A K H << S+ 0 0 130 -4,-0.7 3,-0.4 -3,-0.6 -1,-0.2 0.798 102.2 54.4 -65.1 -32.2 -7.3 -28.4 5.4 216 217 A L H X< S+ 0 0 1 -4,-0.8 3,-1.1 -3,-0.7 -1,-0.2 0.824 102.8 56.6 -69.8 -36.2 -4.7 -27.8 2.6 217 218 A L T 3< S+ 0 0 3 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.618 109.1 47.2 -71.8 -12.6 -3.7 -31.5 2.7 218 219 A H T 3 S+ 0 0 117 -4,-0.4 -1,-0.2 -3,-0.4 -2,-0.2 0.372 86.6 141.2-104.5 3.4 -7.4 -32.3 2.0 219 220 A S < - 0 0 10 -3,-1.1 6,-0.1 1,-0.1 -3,-0.1 -0.050 53.8-145.2 -53.7 141.5 -7.6 -29.7 -0.9 220 221 A E S S+ 0 0 191 4,-0.0 2,-0.6 5,-0.0 -1,-0.1 0.528 82.1 93.4 -79.0 -8.3 -9.6 -30.5 -4.0 221 222 A N S > S- 0 0 27 1,-0.1 4,-2.2 -5,-0.1 5,-0.2 -0.796 70.9-150.4 -89.1 120.1 -6.9 -28.4 -5.8 222 223 A Y H > S+ 0 0 25 -2,-0.6 4,-2.3 1,-0.2 -1,-0.1 0.853 94.3 44.6 -60.5 -41.1 -4.1 -30.7 -7.1 223 224 A V H > S+ 0 0 6 2,-0.2 4,-3.4 1,-0.2 5,-0.4 0.919 109.8 55.0 -73.5 -43.3 -1.3 -28.1 -6.8 224 225 A T H > S+ 0 0 3 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.939 114.0 42.4 -49.0 -51.6 -2.4 -26.9 -3.4 225 226 A K H X S+ 0 0 42 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.928 116.6 46.7 -65.0 -48.7 -2.1 -30.5 -2.1 226 227 A R H X S+ 0 0 14 -4,-2.3 4,-1.6 -5,-0.2 -2,-0.2 0.948 118.3 40.9 -58.6 -52.5 1.1 -31.2 -4.0 227 228 A Q H X S+ 0 0 35 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.899 115.8 49.8 -62.3 -46.1 2.9 -28.0 -2.9 228 229 A S H X S+ 0 0 0 -4,-2.5 4,-2.0 -5,-0.4 -1,-0.2 0.856 109.7 50.6 -66.2 -36.4 1.6 -28.1 0.7 229 230 A L H X S+ 0 0 1 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.874 111.7 49.2 -69.6 -36.7 2.6 -31.7 1.2 230 231 A K H X S+ 0 0 64 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.901 110.1 49.2 -66.4 -46.3 6.1 -30.8 -0.0 231 232 A L H X S+ 0 0 1 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.894 107.5 57.4 -62.4 -40.1 6.5 -27.8 2.2 232 233 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.914 107.0 47.0 -54.6 -49.8 5.3 -30.0 5.2 233 234 A G H X S+ 0 0 1 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.885 112.4 49.9 -59.5 -41.3 8.1 -32.5 4.6 234 235 A E H < S+ 0 0 68 -4,-1.9 4,-0.3 1,-0.2 -2,-0.2 0.825 111.9 49.3 -68.4 -31.6 10.7 -29.6 4.3 235 236 A L H >< S+ 0 0 7 -4,-2.2 3,-0.6 2,-0.2 6,-0.2 0.895 111.5 46.7 -72.0 -44.7 9.4 -28.1 7.5 236 237 A L H 3< S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.782 110.0 53.0 -71.5 -30.2 9.5 -31.3 9.6 237 238 A L T 3< S+ 0 0 83 -4,-1.7 2,-0.4 -5,-0.2 -1,-0.2 0.518 85.9 105.5 -84.3 -4.1 13.0 -32.3 8.5 238 239 A D S X S- 0 0 22 -3,-0.6 3,-1.9 -4,-0.3 7,-0.2 -0.649 70.8-139.3 -79.5 129.7 14.4 -28.9 9.4 239 240 A R G > S+ 0 0 179 -2,-0.4 3,-1.4 1,-0.3 4,-0.2 0.802 101.2 62.5 -58.6 -34.5 16.5 -29.0 12.6 240 241 A H G 3 S+ 0 0 75 1,-0.2 -1,-0.3 2,-0.1 3,-0.3 0.734 105.1 48.9 -59.0 -25.3 15.0 -25.7 13.9 241 242 A N G <> S+ 0 0 6 -3,-1.9 4,-3.0 -6,-0.2 -1,-0.2 0.164 71.9 119.7-104.7 17.6 11.6 -27.4 13.9 242 243 A F H <> S+ 0 0 128 -3,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.838 76.8 48.4 -50.9 -43.3 12.6 -30.5 15.9 243 244 A T H > S+ 0 0 74 -3,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.911 113.6 46.3 -66.7 -44.8 10.2 -29.8 18.7 244 245 A I H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.908 111.6 53.0 -61.8 -46.2 7.2 -29.2 16.4 245 246 A M H X S+ 0 0 20 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.868 106.4 52.0 -58.4 -42.2 8.1 -32.3 14.3 246 247 A T H < S+ 0 0 52 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.834 111.0 48.3 -69.1 -32.4 8.1 -34.5 17.5 247 248 A K H >< S+ 0 0 77 -4,-1.5 3,-1.4 -5,-0.1 4,-0.3 0.957 112.5 49.6 -63.0 -50.3 4.6 -33.2 18.4 248 249 A Y H >< S+ 0 0 7 -4,-2.5 3,-1.1 1,-0.3 6,-0.2 0.864 108.6 49.6 -59.4 -44.9 3.3 -33.8 14.8 249 250 A I T 3< S+ 0 0 1 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.1 0.312 100.9 66.6 -83.8 7.0 4.5 -37.4 14.4 250 251 A S T < S+ 0 0 24 -3,-1.4 -1,-0.2 -5,-0.1 40,-0.2 0.497 79.9 93.6 -99.6 -9.1 3.0 -38.4 17.7 251 252 A K X> - 0 0 84 -3,-1.1 4,-1.2 -4,-0.3 3,-1.0 -0.770 66.2-148.3 -94.7 122.9 -0.6 -37.9 16.6 252 253 A P H 3> S+ 0 0 41 0, 0.0 4,-2.4 0, 0.0 3,-0.3 0.876 95.9 58.0 -50.8 -44.9 -2.5 -40.9 15.2 253 254 A E H 3> S+ 0 0 100 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.714 103.2 52.8 -64.2 -24.7 -4.7 -38.8 12.8 254 255 A N H <> S+ 0 0 16 -3,-1.0 4,-2.0 -6,-0.2 -1,-0.2 0.845 109.7 47.6 -77.1 -39.5 -1.6 -37.4 11.1 255 256 A L H X S+ 0 0 0 -4,-1.2 4,-2.7 -3,-0.3 -2,-0.2 0.894 109.4 55.2 -62.5 -44.7 -0.2 -40.9 10.4 256 257 A K H X S+ 0 0 104 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.958 109.9 45.9 -50.7 -56.6 -3.6 -41.9 9.1 257 258 A L H X S+ 0 0 13 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.882 113.3 47.8 -55.9 -48.1 -3.6 -39.1 6.6 258 259 A M H X S+ 0 0 0 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.896 111.2 51.7 -62.0 -42.6 0.0 -39.7 5.4 259 260 A M H < S+ 0 0 0 -4,-2.7 4,-0.2 2,-0.2 3,-0.2 0.903 112.2 46.6 -60.0 -43.9 -0.7 -43.4 5.0 260 261 A N H >< S+ 0 0 63 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.895 107.2 55.6 -63.6 -45.1 -3.8 -42.6 2.9 261 262 A L H >< S+ 0 0 11 -4,-2.6 3,-1.0 1,-0.3 12,-0.2 0.735 96.4 67.4 -63.3 -20.5 -1.8 -40.0 0.8 262 263 A L T 3< S+ 0 0 1 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.679 102.6 46.8 -67.3 -18.4 0.6 -42.9 0.0 263 264 A R T < S+ 0 0 61 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.215 85.3 128.1-108.9 11.4 -2.3 -44.5 -1.9 264 265 A D < - 0 0 34 -3,-1.0 6,-0.1 2,-0.1 -3,-0.0 -0.201 70.0-118.5 -58.2 156.6 -3.3 -41.3 -3.8 265 266 A K S S+ 0 0 210 4,-0.0 2,-0.5 5,-0.0 -1,-0.1 0.817 92.3 88.0 -70.1 -29.1 -3.7 -41.5 -7.6 266 267 A S > - 0 0 8 1,-0.2 4,-2.4 -5,-0.1 5,-0.2 -0.600 64.9-156.5 -76.0 121.1 -0.9 -39.0 -8.1 267 268 A R H > S+ 0 0 81 -2,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.908 98.1 51.6 -57.0 -44.4 2.6 -40.5 -8.2 268 269 A N H > S+ 0 0 28 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.937 109.6 48.8 -57.0 -52.0 4.0 -37.1 -7.2 269 270 A I H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.913 110.2 50.0 -54.7 -49.7 1.6 -36.8 -4.2 270 271 A Q H X S+ 0 0 37 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.839 110.2 51.8 -64.1 -29.8 2.4 -40.4 -2.9 271 272 A F H X S+ 0 0 54 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.872 110.8 46.3 -71.4 -41.3 6.2 -39.6 -3.1 272 273 A E H X S+ 0 0 18 -4,-2.0 4,-0.6 2,-0.2 -2,-0.2 0.776 109.8 55.2 -71.7 -28.6 5.8 -36.4 -1.1 273 274 A A H >X S+ 0 0 0 -4,-2.1 4,-3.1 -12,-0.2 3,-0.8 0.874 102.9 56.9 -62.8 -43.1 3.7 -38.4 1.4 274 275 A F H 3X S+ 0 0 3 -4,-1.7 4,-3.0 1,-0.2 -2,-0.2 0.901 98.9 60.3 -52.4 -46.4 6.6 -40.8 1.7 275 276 A H H 3< S+ 0 0 63 -4,-1.4 -1,-0.2 1,-0.2 4,-0.2 0.766 115.1 34.1 -54.7 -32.5 8.9 -37.9 2.8 276 277 A V H XX S+ 0 0 0 -3,-0.8 3,-1.3 -4,-0.6 4,-0.9 0.873 115.1 55.6 -90.8 -44.0 6.6 -37.3 5.8 277 278 A F H >X S+ 0 0 0 -4,-3.1 4,-1.2 1,-0.3 3,-0.6 0.881 98.0 63.9 -52.4 -45.2 5.6 -40.9 6.5 278 279 A K H 3X S+ 0 0 21 -4,-3.0 4,-2.0 1,-0.2 -1,-0.3 0.767 98.5 56.2 -53.2 -28.6 9.3 -42.0 6.8 279 280 A V H <> S+ 0 0 15 -3,-1.3 4,-1.2 1,-0.2 -1,-0.2 0.882 100.3 55.8 -77.6 -37.8 9.7 -39.7 9.8 280 281 A F H << S+ 0 0 0 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.825 116.0 39.1 -56.5 -35.8 6.8 -41.3 11.8 281 282 A V H < S+ 0 0 1 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.810 108.9 57.3 -90.9 -35.6 8.5 -44.7 11.5 282 283 A A H < S+ 0 0 37 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.724 83.6 109.6 -65.6 -23.1 12.2 -43.7 11.9 283 284 A N < - 0 0 27 -4,-1.2 3,-0.5 1,-0.1 -3,-0.0 -0.400 56.2-162.4 -59.2 118.2 11.1 -42.2 15.3 284 285 A P S S+ 0 0 110 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.665 84.7 58.1 -75.7 -18.4 12.6 -44.4 18.1 285 286 A N S S+ 0 0 136 2,-0.0 2,-0.2 0, 0.0 -2,-0.1 -0.395 74.6 171.3-111.0 54.5 10.1 -43.0 20.7 286 287 A K - 0 0 28 -3,-0.5 -36,-0.1 -2,-0.2 -5,-0.0 -0.443 29.1-126.8 -70.3 130.5 6.8 -43.9 19.1 287 288 A T > - 0 0 56 -2,-0.2 4,-2.8 1,-0.1 3,-0.4 -0.242 27.9-102.5 -69.3 163.6 3.6 -43.3 21.2 288 289 A Q H > S+ 0 0 106 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.914 119.7 50.3 -58.4 -49.6 1.1 -46.1 21.8 289 290 A P H > S+ 0 0 61 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.806 115.5 45.7 -60.3 -28.4 -1.6 -45.0 19.3 290 291 A I H > S+ 0 0 0 -3,-0.4 4,-1.8 2,-0.2 3,-0.3 0.919 112.7 48.3 -74.9 -48.5 1.2 -44.7 16.7 291 292 A L H X S+ 0 0 40 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.879 108.6 56.6 -59.9 -40.1 2.7 -48.0 17.5 292 293 A D H X S+ 0 0 89 -4,-3.1 4,-1.7 1,-0.2 -1,-0.2 0.853 106.1 49.1 -57.9 -40.7 -0.8 -49.5 17.4 293 294 A I H X S+ 0 0 19 -4,-1.0 4,-1.3 -3,-0.3 -1,-0.2 0.860 112.0 48.0 -70.9 -37.1 -1.4 -48.3 13.8 294 295 A L H < S+ 0 0 0 -4,-1.8 7,-0.2 2,-0.2 -2,-0.2 0.919 113.6 45.8 -72.3 -42.3 2.0 -49.7 12.5 295 296 A L H >< S+ 0 0 35 -4,-2.3 3,-0.9 1,-0.2 4,-0.3 0.846 109.0 57.2 -65.7 -35.1 1.5 -53.1 14.1 296 297 A K H 3< S+ 0 0 113 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.861 119.5 30.1 -61.9 -37.8 -2.1 -53.3 12.8 297 298 A N T 3X S+ 0 0 0 -4,-1.3 4,-3.1 1,-0.1 5,-0.3 0.042 84.6 125.3-109.6 22.2 -0.9 -52.8 9.2 298 299 A Q H <> S+ 0 0 55 -3,-0.9 4,-1.9 1,-0.2 5,-0.2 0.899 78.2 38.4 -52.2 -56.9 2.5 -54.6 9.7 299 300 A A H > S+ 0 0 80 -4,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.862 117.3 51.4 -63.4 -39.3 2.2 -57.1 6.9 300 301 A K H > S+ 0 0 46 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.890 110.0 48.7 -67.0 -41.0 0.5 -54.7 4.5 301 302 A L H X S+ 0 0 0 -4,-3.1 4,-2.9 2,-0.2 5,-0.2 0.919 109.6 51.3 -66.2 -46.0 3.1 -52.0 5.0 302 303 A I H X S+ 0 0 43 -4,-1.9 4,-1.5 -5,-0.3 -1,-0.2 0.921 115.2 43.6 -55.8 -46.0 6.0 -54.4 4.4 303 304 A E H X S+ 0 0 111 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.930 114.7 49.1 -65.2 -47.6 4.3 -55.6 1.1 304 305 A F H >< S+ 0 0 23 -4,-2.8 3,-0.7 1,-0.2 -2,-0.2 0.907 111.2 49.3 -56.9 -48.3 3.4 -52.0 0.0 305 306 A L H >< S+ 0 0 1 -4,-2.9 3,-0.8 1,-0.2 -1,-0.2 0.778 103.9 59.8 -67.4 -30.9 6.9 -50.7 0.6 306 307 A S H 3< S+ 0 0 61 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.749 115.9 33.7 -64.9 -27.4 8.6 -53.5 -1.4 307 308 A K T << S+ 0 0 121 -4,-0.9 2,-0.8 -3,-0.7 3,-0.5 0.125 86.8 130.1-115.7 19.6 6.6 -52.5 -4.5 308 309 A F S < S- 0 0 8 -3,-0.8 4,-0.1 1,-0.2 14,-0.1 -0.682 90.9 -35.1 -89.5 109.7 6.6 -48.8 -3.9 309 310 A Q S > S+ 0 0 11 -2,-0.8 3,-1.7 1,-0.1 -1,-0.2 0.883 74.4 169.5 42.8 54.4 7.7 -46.8 -7.0 310 311 A N T 3 S+ 0 0 81 -3,-0.5 -1,-0.1 1,-0.3 -2,-0.1 0.663 70.5 67.5 -62.2 -21.6 10.3 -49.5 -8.0 311 312 A D T 3 S+ 0 0 109 1,-0.1 2,-1.4 3,-0.0 -1,-0.3 0.538 72.5 95.8 -77.5 -10.1 10.7 -47.7 -11.3 312 313 A R < + 0 0 51 -3,-1.7 3,-0.3 1,-0.2 -1,-0.1 -0.693 61.8 170.5 -78.5 92.7 12.3 -44.8 -9.4 313 314 A T + 0 0 109 -2,-1.4 -1,-0.2 1,-0.2 -2,-0.0 0.829 51.7 32.4 -95.9 -40.2 15.7 -46.3 -10.1 314 315 A E S S+ 0 0 167 -3,-0.2 2,-1.1 1,-0.0 -1,-0.2 0.081 77.6 111.1-115.0 27.9 18.7 -44.1 -9.2 315 316 A D > - 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