==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 21-SEP-07 2RD3 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR N.BARISON,L.CENDRON,A.TRENTO,A.ANGELINI,G.ZANOTTI . 439 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20339.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 80.6 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 . 0 0.0 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 . 0 0.0 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 . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 295 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.6 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 0 0 4 5 3 0 0 0 0 0 2 0 4 2 1 0 0 0 0 0 0 0 2 0 2 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -3 A D 0 0 151 0, 0.0 4,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 167.9 120.5 36.7 61.8 2 -2 A P + 0 0 130 0, 0.0 4,-0.1 0, 0.0 0, 0.0 -0.706 360.0 53.8 -94.0 29.9 119.6 39.3 63.1 3 -1 A F S S+ 0 0 190 2,-0.1 2,-0.4 0, 0.0 0, 0.0 0.046 98.5 92.4-100.8 20.8 122.6 40.2 65.4 4 0 A T S S- 0 0 57 1,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.950 89.2 -98.7-127.6 134.3 124.6 39.9 62.3 5 1 A M - 0 0 124 -2,-0.4 2,-0.5 1,-0.1 -2,-0.1 -0.195 32.4-145.6 -54.3 131.0 125.6 42.6 59.8 6 2 A Q > - 0 0 102 1,-0.1 4,-2.1 -4,-0.1 3,-0.4 -0.897 2.8-148.5-100.4 131.5 123.5 42.7 56.6 7 3 A V H > S+ 0 0 8 -2,-0.5 4,-3.0 1,-0.2 5,-0.2 0.893 95.2 54.2 -71.0 -34.2 125.3 43.7 53.5 8 4 A S H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.848 110.3 47.8 -64.3 -32.4 122.4 45.5 51.9 9 5 A Q H > S+ 0 0 85 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.906 112.4 49.0 -76.4 -42.0 122.0 47.6 54.9 10 6 A Y H X S+ 0 0 63 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.885 111.5 49.4 -63.0 -40.4 125.6 48.4 55.0 11 7 A L H X S+ 0 0 0 -4,-3.0 4,-0.8 -5,-0.2 3,-0.5 0.988 110.4 50.7 -62.4 -52.0 125.7 49.3 51.4 12 8 A Y H >X S+ 0 0 65 -4,-2.5 3,-1.3 1,-0.3 4,-0.9 0.885 105.0 57.8 -51.3 -47.9 122.6 51.5 51.8 13 9 A Q H >< S+ 0 0 114 -4,-2.7 3,-1.0 1,-0.2 4,-0.3 0.919 106.3 48.4 -44.0 -54.3 124.3 53.3 54.7 14 10 A N H 3< S+ 0 0 69 -4,-1.7 -1,-0.2 -3,-0.5 4,-0.2 0.567 110.0 51.4 -73.0 -7.2 127.3 54.3 52.5 15 11 A A H S+ 0 0 83 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.930 113.6 49.8 -57.2 -45.2 124.7 61.1 51.2 18 14 A I H > S+ 0 0 32 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.911 109.6 49.2 -62.9 -43.7 124.8 60.5 47.5 19 15 A W H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -1,-0.3 0.827 107.2 58.4 -68.3 -25.9 121.1 59.6 47.3 20 16 A G H X S+ 0 0 29 -4,-1.8 4,-2.1 -5,-0.3 -2,-0.2 0.983 104.5 49.3 -60.7 -58.2 120.5 62.8 49.3 21 17 A D H < S+ 0 0 76 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.801 111.0 53.2 -50.2 -28.7 122.2 64.9 46.6 22 18 A C H >< S+ 0 0 1 -4,-1.4 3,-2.0 -5,-0.2 6,-0.3 0.971 105.6 49.2 -75.0 -50.4 120.0 63.1 44.2 23 19 A I H 3< S+ 0 0 29 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.849 116.1 44.7 -55.0 -37.2 116.6 63.8 45.8 24 20 A S T 3< S+ 0 0 72 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.008 85.5 127.4 -99.3 28.1 117.5 67.5 46.1 25 21 A H S <> S- 0 0 6 -3,-2.0 4,-3.9 1,-0.1 5,-0.4 -0.681 70.8-119.3 -85.3 144.0 118.8 67.8 42.6 26 22 A P H > S+ 0 0 66 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.899 115.6 47.9 -40.0 -52.6 117.4 70.6 40.4 27 23 A F H > S+ 0 0 0 2,-0.2 4,-0.8 1,-0.2 9,-0.1 0.900 116.2 40.2 -62.2 -47.2 116.2 67.9 37.9 28 24 A V H >> S+ 0 0 0 -6,-0.3 4,-2.2 2,-0.2 3,-1.0 0.941 117.0 48.4 -71.3 -47.6 114.6 65.6 40.5 29 25 A Q H 3X S+ 0 0 39 -4,-3.9 4,-1.7 1,-0.3 6,-0.3 0.964 107.0 59.8 -50.4 -49.9 113.1 68.5 42.6 30 26 A G H 3< S+ 0 0 2 -4,-3.5 6,-1.9 -5,-0.4 -1,-0.3 0.762 105.8 47.4 -50.5 -29.4 111.8 69.8 39.2 31 27 A I H X< S+ 0 0 1 -3,-1.0 3,-1.2 -4,-0.8 -1,-0.3 0.944 107.5 55.6 -78.7 -45.3 109.9 66.6 38.8 32 28 A G H 3< S+ 0 0 1 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.713 119.0 30.2 -60.0 -26.7 108.4 66.7 42.3 33 29 A R T 3< S- 0 0 129 -4,-1.7 2,-1.1 120,-0.0 -1,-0.3 -0.350 106.3-111.3-132.4 53.0 106.9 70.2 41.9 34 30 A G S < S+ 0 0 23 -3,-1.2 -3,-0.1 1,-0.2 -4,-0.1 0.392 84.7 116.5 39.8 0.7 106.0 70.5 38.2 35 31 A T + 0 0 95 -2,-1.1 2,-0.3 -6,-0.3 -1,-0.2 0.630 42.0 101.7 -76.0 -12.6 108.8 73.1 37.6 36 32 A L S S- 0 0 3 -6,-1.9 2,-0.2 -7,-0.1 -9,-0.0 -0.568 75.0-120.3 -80.1 131.7 111.0 71.1 35.2 37 33 A E >> - 0 0 85 -2,-0.3 4,-1.4 1,-0.1 3,-1.3 -0.492 14.9-124.8 -77.0 135.2 110.6 72.1 31.5 38 34 A R H 3> S+ 0 0 109 1,-0.3 4,-2.9 -2,-0.2 5,-0.2 0.780 106.4 66.7 -44.6 -38.4 109.5 69.3 29.1 39 35 A D H 3> S+ 0 0 126 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.937 105.1 43.0 -49.3 -52.0 112.6 69.9 26.8 40 36 A K H <> S+ 0 0 40 -3,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.916 114.8 48.6 -63.2 -43.2 114.8 68.7 29.6 41 37 A F H X S+ 0 0 0 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.815 109.1 54.4 -68.8 -31.3 112.6 65.7 30.5 42 38 A R H X S+ 0 0 70 -4,-2.9 4,-2.0 2,-0.2 5,-0.3 0.986 108.2 48.0 -62.0 -59.8 112.3 64.7 26.8 43 39 A F H X S+ 0 0 64 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.883 112.4 54.1 -45.0 -44.0 116.0 64.6 26.5 44 40 A Y H X S+ 0 0 1 -4,-2.1 4,-3.2 1,-0.2 5,-0.3 0.957 106.5 45.3 -59.8 -55.8 116.0 62.5 29.7 45 41 A I H X S+ 0 0 4 -4,-2.7 4,-1.2 1,-0.3 -1,-0.2 0.780 111.3 55.0 -73.1 -16.5 113.6 59.8 28.7 46 42 A I H X S+ 0 0 16 -4,-2.0 4,-1.7 2,-0.2 -1,-0.3 0.916 114.0 41.2 -69.8 -47.0 115.4 59.4 25.4 47 43 A Q H X S+ 0 0 5 -4,-2.2 4,-2.8 -5,-0.3 -2,-0.2 0.880 112.9 53.5 -65.4 -37.9 118.6 58.9 27.2 48 44 A D H X S+ 0 0 5 -4,-3.2 4,-2.8 1,-0.2 -1,-0.2 0.851 105.2 56.5 -71.0 -27.6 117.0 56.7 29.8 49 45 A Y H X S+ 0 0 51 -4,-1.2 4,-1.4 -5,-0.3 -1,-0.2 0.941 108.9 44.1 -67.4 -47.8 115.6 54.6 27.0 50 46 A L H >X S+ 0 0 23 -4,-1.7 4,-1.6 1,-0.2 3,-0.5 0.945 113.5 53.0 -57.9 -44.7 119.1 54.0 25.7 51 47 A F H 3X S+ 0 0 4 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.903 104.3 54.8 -60.0 -43.9 120.2 53.3 29.2 52 48 A L H 3X S+ 0 0 22 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.801 102.2 58.0 -63.2 -31.8 117.5 50.8 29.9 53 49 A L H X S+ 0 0 16 -4,-1.9 4,-1.5 1,-0.2 3,-0.7 0.905 99.8 56.4 -70.5 -38.6 120.7 47.7 31.7 56 52 A A H 3X S+ 0 0 10 -4,-2.0 4,-2.7 1,-0.3 -1,-0.2 0.913 100.1 60.9 -54.8 -42.4 118.8 44.7 30.4 57 53 A K H 3X S+ 0 0 93 -4,-1.3 4,-2.0 1,-0.3 -1,-0.3 0.859 100.0 53.1 -57.7 -34.9 122.1 43.3 29.2 58 54 A V H S- 0 0 85 -2,-0.8 4,-2.9 1,-0.0 5,-0.3 -0.505 77.2-132.8 164.8 117.5 120.2 28.1 40.3 69 65 A E H > S+ 0 0 128 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.814 101.5 57.6 -60.5 -35.1 117.1 28.0 38.3 70 66 A A H > S+ 0 0 51 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.959 114.9 36.1 -61.9 -48.1 115.0 30.1 40.5 71 67 A V H > S+ 0 0 18 -3,-0.3 4,-2.8 2,-0.2 5,-0.3 0.926 114.4 56.6 -74.0 -38.4 117.3 33.1 40.4 72 68 A M H X S+ 0 0 67 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.893 111.9 44.9 -56.5 -35.4 118.2 32.4 36.8 73 69 A R H X S+ 0 0 145 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.881 107.9 55.6 -79.0 -38.0 114.4 32.7 36.1 74 70 A E H X S+ 0 0 74 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.930 107.8 50.8 -60.3 -42.7 113.9 35.8 38.2 75 71 A F H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.903 106.2 54.9 -58.1 -42.1 116.5 37.6 36.2 76 72 A S H X S+ 0 0 58 -4,-1.4 4,-1.8 -5,-0.3 -1,-0.2 0.931 108.1 48.4 -60.4 -44.3 114.8 36.5 33.0 77 73 A N H X S+ 0 0 84 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.907 105.9 58.2 -58.8 -42.0 111.6 38.1 34.1 78 74 A A H X S+ 0 0 9 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.925 105.5 50.1 -54.9 -43.6 113.5 41.2 35.1 79 75 A I H X S+ 0 0 34 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.887 110.6 49.1 -61.4 -39.5 114.6 41.5 31.4 80 76 A Q H X S+ 0 0 102 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.904 111.3 50.5 -65.3 -40.9 111.1 41.1 30.2 81 77 A D H X>S+ 0 0 66 -4,-3.0 4,-2.3 1,-0.2 5,-0.6 0.954 108.0 51.5 -61.6 -49.8 109.9 43.8 32.7 82 78 A I H <5S+ 0 0 21 -4,-2.9 4,-0.4 1,-0.2 -1,-0.2 0.857 115.5 43.6 -59.4 -32.4 112.6 46.2 31.5 83 79 A L H <5S+ 0 0 69 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.896 127.8 25.1 -79.6 -38.2 111.5 45.6 28.0 84 80 A N H <5S+ 0 0 88 -4,-2.7 -2,-0.2 2,-0.1 -3,-0.2 0.211 113.1 62.6-118.1 14.6 107.6 45.7 28.5 85 81 A N T >X5S+ 0 0 77 -4,-2.3 4,-2.0 -5,-0.1 3,-0.8 0.574 94.9 59.5-102.7 -29.9 107.1 47.9 31.7 86 82 A E T 34XS+ 0 0 15 -5,-0.6 5,-4.5 -4,-0.4 6,-0.5 0.742 89.1 79.5 -58.3 -26.7 108.7 51.0 30.1 87 83 A M T 345S+ 0 0 103 -6,-0.3 -1,-0.3 3,-0.2 -2,-0.1 0.070 104.3 31.7 -63.7 15.7 105.6 49.9 28.1 88 84 A S T <>5S+ 0 0 65 -3,-0.8 4,-2.0 0, 0.0 -2,-0.3 0.180 135.7 22.0-124.0 -71.9 104.1 51.8 31.0 89 85 A I H X5S+ 0 0 20 -4,-2.0 4,-1.7 1,-0.2 -3,-0.2 0.967 129.7 33.1 -70.1 -63.2 106.6 54.4 31.9 90 86 A H H >5S+ 0 0 5 1,-0.2 4,-1.4 2,-0.2 -3,-0.2 0.854 121.4 48.3 -64.4 -34.8 108.8 55.1 28.9 91 87 A N H >S+ 0 0 27 -4,-1.4 5,-3.5 -3,-0.4 -1,-0.2 0.855 118.8 29.4 -73.1 -34.2 107.3 58.9 24.1 95 91 A R H <5S+ 0 0 155 -4,-2.0 -2,-0.2 -3,-0.3 -1,-0.2 0.763 118.3 57.5 -90.1 -31.5 103.7 59.3 22.8 96 92 A E H <5S+ 0 0 107 -4,-2.4 -3,-0.2 -5,-0.5 -2,-0.2 0.981 123.9 25.8 -60.2 -57.3 102.8 61.8 25.6 97 93 A L T <5S- 0 0 24 -4,-2.6 2,-0.3 -5,-0.1 -3,-0.0 -0.086 113.7-106.7 -70.8-163.8 105.7 63.8 24.3 98 94 A Q T 5 + 0 0 163 -2,-0.1 2,-0.8 2,-0.0 -3,-0.2 -0.618 43.4 173.1-134.8 85.3 106.1 63.0 20.7 99 95 A I < - 0 0 17 -5,-3.5 2,-0.1 -2,-0.3 -5,-0.0 -0.785 30.8-132.2 -89.7 112.4 109.2 60.9 20.1 100 96 A T > - 0 0 74 -2,-0.8 4,-2.0 1,-0.1 -2,-0.0 -0.400 17.2-122.2 -64.0 138.5 109.2 59.7 16.5 101 97 A Q H > S+ 0 0 125 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.821 115.4 45.8 -48.0 -35.1 109.9 56.0 16.2 102 98 A K H > S+ 0 0 146 2,-0.2 4,-0.8 1,-0.2 5,-0.2 0.977 103.6 59.8 -72.7 -59.6 112.9 57.0 14.0 103 99 A E H >> S+ 0 0 55 2,-0.2 3,-0.7 1,-0.2 4,-0.6 0.803 101.3 61.1 -34.4 -45.4 114.2 59.8 16.3 104 100 A L H >< S+ 0 0 4 -4,-2.0 3,-3.4 1,-0.2 -1,-0.2 0.971 108.2 35.7 -46.1 -86.0 114.6 57.1 19.0 105 101 A Q H 3< S+ 0 0 118 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.420 111.7 67.2 -58.9 6.4 117.1 54.7 17.5 106 102 A N H << S+ 0 0 96 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.592 82.2 101.0 -92.3 -15.7 118.7 57.8 16.0 107 103 A A << - 0 0 34 -3,-3.4 -3,-0.0 -4,-0.6 -4,-0.0 -0.359 63.6-140.0 -76.4 149.2 119.8 59.1 19.4 108 104 A C - 0 0 100 -2,-0.1 2,-0.1 -58,-0.0 -58,-0.1 -0.861 17.8-123.4-102.1 140.9 123.3 58.8 20.8 109 105 A P - 0 0 46 0, 0.0 2,-0.2 0, 0.0 -62,-0.0 -0.480 32.3-118.9 -74.0 156.3 124.0 58.0 24.4 110 106 A T > - 0 0 39 -2,-0.1 4,-2.5 1,-0.1 5,-0.3 -0.554 26.3-101.6 -93.5 165.8 126.1 60.5 26.2 111 107 A L H > S+ 0 0 45 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.859 126.3 51.1 -51.6 -37.0 129.5 59.8 27.8 112 108 A A H > S+ 0 0 15 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.940 110.2 48.8 -69.2 -41.6 127.8 59.7 31.1 113 109 A N H > S+ 0 0 2 -3,-0.2 4,-1.9 1,-0.2 3,-0.3 0.965 115.9 42.5 -57.4 -55.0 125.2 57.3 29.9 114 110 A K H X S+ 0 0 35 -4,-2.5 4,-3.5 1,-0.2 5,-0.3 0.906 110.5 56.3 -58.4 -51.2 127.8 55.0 28.3 115 111 A S H X S+ 0 0 5 -4,-2.8 4,-1.9 -5,-0.3 -1,-0.2 0.881 108.4 47.7 -50.8 -42.1 130.2 55.2 31.2 116 112 A Y H X S+ 0 0 1 -4,-1.7 4,-1.8 -3,-0.3 -1,-0.2 0.953 116.0 40.9 -69.8 -51.4 127.5 54.0 33.7 117 113 A T H X S+ 0 0 8 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.896 112.6 56.2 -66.9 -40.8 126.3 51.0 31.6 118 114 A S H X S+ 0 0 5 -4,-3.5 4,-3.1 -5,-0.2 5,-0.2 0.926 107.7 50.5 -52.7 -43.1 129.8 50.1 30.6 119 115 A Y H X S+ 0 0 5 -4,-1.9 4,-2.1 -5,-0.3 5,-0.2 0.892 109.8 46.6 -66.5 -41.0 130.8 49.9 34.3 120 116 A M H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.974 116.0 47.9 -67.7 -50.2 127.9 47.7 35.3 121 117 A L H X S+ 0 0 4 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.933 113.7 45.4 -47.1 -57.5 128.6 45.4 32.4 122 118 A A H X S+ 0 0 0 -4,-3.1 4,-1.9 -5,-0.2 -1,-0.2 0.859 113.8 48.5 -64.6 -33.1 132.3 45.2 33.0 123 119 A E H X S+ 0 0 23 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.903 113.4 47.1 -78.3 -34.0 132.0 44.6 36.7 124 120 A G H >< S+ 0 0 0 -4,-2.4 3,-0.6 -5,-0.2 8,-0.2 0.954 113.4 48.5 -64.5 -49.0 129.4 41.9 36.1 125 121 A F H 3< S+ 0 0 52 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.837 113.1 47.5 -63.0 -32.1 131.5 40.2 33.5 126 122 A K H 3< S+ 0 0 73 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.730 117.6 40.3 -80.8 -21.6 134.7 40.3 35.6 127 123 A G S << S- 0 0 18 -4,-1.1 2,-0.1 -3,-0.6 -3,-0.0 -0.254 87.7 -88.3-114.8-162.6 133.0 39.0 38.7 128 124 A S > - 0 0 48 -2,-0.1 4,-1.2 1,-0.0 3,-0.2 -0.151 58.5 -77.3 -98.7-164.8 130.5 36.4 39.9 129 125 A I H > S+ 0 0 18 -64,-0.3 4,-1.9 1,-0.2 5,-0.1 0.668 126.1 67.4 -74.4 -11.4 126.8 36.7 40.2 130 126 A K H > S+ 0 0 56 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.924 98.9 51.2 -69.1 -45.4 127.3 38.7 43.5 131 127 A E H > S+ 0 0 11 -3,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.878 109.6 49.3 -55.8 -41.6 128.8 41.5 41.5 132 128 A V H X S+ 0 0 0 -4,-1.2 4,-1.7 -8,-0.2 -1,-0.2 0.930 110.0 50.4 -70.9 -36.5 125.9 41.6 39.1 133 129 A A H < S+ 0 0 0 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.896 116.4 43.0 -62.6 -37.7 123.4 41.6 42.0 134 130 A A H >X S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 4,-0.7 0.881 110.2 56.1 -74.0 -41.0 125.3 44.5 43.5 135 131 A A H 3< S+ 0 0 0 -4,-3.0 4,-0.3 1,-0.2 -2,-0.2 0.799 110.5 42.4 -66.3 -29.4 125.8 46.4 40.3 136 132 A V T 3X S+ 0 0 0 -4,-1.7 4,-1.0 -5,-0.2 -1,-0.2 0.496 97.7 78.7 -97.5 -0.7 122.2 46.7 39.4 137 133 A L H <> S+ 0 0 0 -3,-0.8 4,-2.7 -4,-0.3 5,-0.4 0.935 81.4 58.8 -77.2 -49.5 120.9 47.5 42.8 138 134 A S H X S+ 0 0 0 -4,-0.7 4,-3.0 1,-0.2 5,-0.4 0.939 104.6 54.0 -40.6 -57.0 121.7 51.3 43.2 139 135 A C H > S+ 0 0 12 -4,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.913 115.3 36.2 -51.3 -52.3 119.6 52.1 40.2 140 136 A G H X S+ 0 0 11 -4,-1.0 4,-1.7 2,-0.2 -1,-0.2 0.972 119.7 47.7 -66.1 -52.7 116.4 50.4 41.4 141 137 A W H X S+ 0 0 31 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.914 111.2 49.4 -56.6 -49.8 116.8 51.2 45.1 142 138 A S H X S+ 0 0 0 -4,-3.0 4,-2.8 -5,-0.4 5,-0.2 0.930 109.4 50.3 -63.4 -43.8 117.6 54.9 44.6 143 139 A Y H X S+ 0 0 10 -4,-1.7 4,-2.5 -5,-0.4 -1,-0.2 0.872 108.0 57.6 -59.9 -32.1 114.6 55.6 42.3 144 140 A L H X S+ 0 0 13 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.987 110.5 39.9 -61.9 -54.1 112.5 53.9 44.9 145 141 A V H X S+ 0 0 23 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.934 113.8 54.1 -64.7 -43.9 113.5 56.3 47.6 146 142 A I H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.945 111.1 45.0 -53.5 -48.2 113.4 59.3 45.3 147 143 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 -5,-0.2 -1,-0.2 0.869 111.8 53.6 -65.8 -32.8 109.8 58.5 44.3 148 144 A Q H < S+ 0 0 97 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.924 112.5 44.3 -64.9 -43.3 108.9 57.9 47.9 149 145 A N H >< S+ 0 0 72 -4,-2.9 3,-1.8 1,-0.2 -2,-0.2 0.977 111.3 50.0 -66.6 -56.4 110.2 61.2 48.9 150 146 A L H 3< S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.715 89.3 89.6 -53.0 -20.5 108.7 63.2 45.9 151 147 A S T 3< S+ 0 0 30 -4,-1.0 2,-0.5 -5,-0.3 -1,-0.3 0.591 81.9 61.3 -55.8 -15.0 105.4 61.4 46.9 152 148 A Q < + 0 0 138 -3,-1.8 -1,-0.2 1,-0.1 -120,-0.0 -0.924 66.5 84.3-117.4 109.4 104.7 64.3 49.3 153 149 A I S S- 0 0 87 -2,-0.5 2,-0.1 -120,-0.0 -1,-0.1 0.580 91.8-125.8-126.9 -38.0 104.3 67.8 48.1 154 150 A P S S+ 0 0 75 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 0.589 91.9 45.9 -91.1-136.7 101.5 67.1 47.6 155 151 A N S > S+ 0 0 110 -4,-0.1 4,-2.1 -2,-0.1 8,-0.1 0.473 83.9 111.8 64.2 -1.7 99.8 67.5 44.2 156 152 A A T 4 S+ 0 0 4 2,-0.2 10,-0.2 1,-0.2 -122,-0.1 0.967 84.7 34.2 -59.1 -53.7 103.1 66.0 43.2 157 153 A L T 4 S+ 0 0 63 -6,-0.2 -1,-0.2 1,-0.2 10,-0.1 0.767 114.5 60.0 -69.9 -31.1 101.1 62.9 42.3 158 154 A E T 4 S+ 0 0 134 5,-0.1 -1,-0.2 4,-0.0 -2,-0.2 0.871 74.8 119.7 -65.3 -37.8 98.2 65.0 41.1 159 155 A H X - 0 0 54 -4,-2.1 4,-1.1 1,-0.2 5,-0.2 0.079 66.9-135.3 -39.0 126.0 100.3 66.8 38.5 160 156 A A T 4 S+ 0 0 106 2,-0.1 -1,-0.2 3,-0.1 4,-0.1 0.744 95.0 20.8 -60.4 -25.5 98.7 66.1 35.1 161 157 A F T >4 S+ 0 0 21 2,-0.1 3,-0.7 3,-0.0 4,-0.4 0.835 129.1 35.2-110.6 -64.4 102.1 65.4 33.5 162 158 A Y T 3> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.1 5,-0.2 0.542 98.9 85.5 -71.7 -5.4 104.9 64.4 35.9 163 159 A G H 3X S+ 0 0 4 -4,-1.1 4,-2.4 1,-0.2 -1,-0.2 0.905 82.3 54.9 -66.7 -41.2 102.4 62.6 38.1 164 160 A H H <> S+ 0 0 63 -3,-0.7 4,-3.1 -5,-0.2 -1,-0.2 0.880 103.8 54.9 -62.4 -42.0 102.6 59.3 36.3 165 161 A W H > S+ 0 0 3 -4,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.953 112.2 42.9 -53.7 -54.5 106.4 58.9 36.6 166 162 A I H < S+ 0 0 0 -4,-1.4 4,-0.5 1,-0.2 -1,-0.2 0.905 112.0 54.2 -61.5 -41.3 106.2 59.3 40.4 167 163 A K H >X S+ 0 0 132 -4,-2.4 3,-1.1 1,-0.2 4,-0.8 0.941 108.4 52.8 -54.7 -50.7 103.3 57.0 40.6 168 164 A G H >< S+ 0 0 15 -4,-3.1 3,-1.5 1,-0.2 6,-0.4 0.951 108.7 44.0 -49.4 -63.9 105.3 54.4 38.7 169 165 A Y T 3< S+ 0 0 23 -4,-2.0 -1,-0.2 1,-0.3 -22,-0.2 0.379 115.3 49.4 -76.9 8.6 108.4 54.3 40.8 170 166 A S T <4 S+ 0 0 26 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.453 84.9 117.3-119.5 -3.8 106.5 54.2 44.1 171 167 A S S S+ 0 0 153 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.774 114.9 58.1 -75.5 -24.0 104.0 48.1 45.0 173 169 A E H > S+ 0 0 130 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.969 107.9 43.2 -66.7 -54.9 105.3 46.3 41.9 174 170 A F H > S+ 0 0 44 -6,-0.4 4,-2.5 1,-0.2 5,-0.2 0.880 113.9 55.2 -58.0 -35.8 108.5 48.4 41.6 175 171 A Q H X S+ 0 0 73 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.940 107.9 46.0 -60.9 -49.9 108.8 48.0 45.3 176 172 A A H X S+ 0 0 57 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.864 110.2 55.9 -63.5 -35.2 108.6 44.2 45.2 177 173 A C H X S+ 0 0 58 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.948 107.9 46.2 -65.3 -46.5 111.1 44.3 42.4 178 174 A V H X S+ 0 0 5 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.860 111.4 54.0 -60.2 -36.8 113.7 46.3 44.5 179 175 A N H X S+ 0 0 82 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.874 103.6 54.6 -68.4 -36.7 113.1 43.9 47.4 180 176 A W H X S+ 0 0 47 -4,-2.2 4,-3.1 1,-0.2 -1,-0.2 0.948 109.8 48.1 -57.8 -46.8 113.8 40.9 45.3 181 177 A N H X S+ 0 0 8 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.900 111.9 49.1 -61.8 -43.3 117.1 42.5 44.5 182 178 A I H X S+ 0 0 17 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.966 114.8 44.3 -61.7 -52.9 117.9 43.3 48.1 183 179 A N H X S+ 0 0 105 -4,-3.2 4,-2.7 1,-0.2 5,-0.2 0.889 110.6 54.4 -61.1 -42.6 117.1 39.8 49.3 184 180 A L H X S+ 0 0 10 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.930 109.4 48.1 -53.8 -48.6 119.0 38.2 46.4 185 181 A L H X S+ 0 0 0 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.871 111.4 49.4 -64.9 -37.2 122.1 40.2 47.4 186 182 A D H >X S+ 0 0 27 -4,-2.1 3,-0.7 1,-0.2 4,-0.7 0.921 111.5 48.4 -70.1 -39.7 121.8 39.3 51.0 187 183 A S H 3< S+ 0 0 71 -4,-2.7 3,-0.5 1,-0.2 -2,-0.2 0.870 110.7 51.9 -67.7 -34.6 121.4 35.5 50.3 188 184 A L H 3< S+ 0 0 48 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.678 114.9 41.6 -71.6 -15.0 124.3 35.5 48.0 189 185 A T H X< + 0 0 4 -3,-0.7 2,-2.6 -4,-0.7 3,-1.9 0.440 69.1 112.7-120.5 6.3 126.6 37.2 50.5 190 186 A L T 3< S+ 0 0 121 -4,-0.7 -1,-0.1 -3,-0.5 -4,-0.1 -0.334 90.3 36.2 -79.6 61.8 126.1 35.7 53.9 191 187 A A T 3 S+ 0 0 103 -2,-2.6 -1,-0.3 2,-0.1 2,-0.1 0.192 86.0 127.1 174.8 -1.9 129.5 34.1 53.9 192 188 A S < - 0 0 22 -3,-1.9 -3,-0.0 1,-0.1 -1,-0.0 -0.417 58.6-111.8 -76.4 150.3 131.7 36.7 52.1 193 189 A S > - 0 0 48 -2,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.198 29.5-103.2 -74.3 169.2 134.9 38.0 53.6 194 190 A K H > S+ 0 0 170 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.949 124.9 52.1 -53.7 -46.7 135.5 41.6 54.9 195 191 A Q H > S+ 0 0 160 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.839 107.5 50.0 -63.4 -34.4 137.4 42.2 51.7 196 192 A E H > S+ 0 0 64 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.874 108.6 52.1 -70.4 -40.3 134.7 40.9 49.4 197 193 A I H X S+ 0 0 11 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.907 106.9 54.9 -62.2 -43.0 132.1 43.1 51.1 198 194 A E H X S+ 0 0 79 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.920 106.9 49.8 -53.6 -50.3 134.4 46.1 50.5 199 195 A K H X S+ 0 0 85 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.893 111.3 48.7 -59.6 -40.0 134.5 45.4 46.9 200 196 A L H X S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.879 110.9 50.8 -67.1 -34.8 130.8 45.1 46.7 201 197 A K H X S+ 0 0 32 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.909 106.9 53.8 -67.7 -44.4 130.4 48.3 48.6 202 198 A E H X S+ 0 0 95 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.822 109.1 49.5 -58.2 -32.5 132.7 50.0 46.2 203 199 A I H X S+ 0 0 2 -4,-1.4 4,-2.4 -5,-0.2 5,-0.2 0.911 111.4 50.1 -73.4 -42.4 130.6 48.8 43.3 204 200 A F H X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.937 112.4 43.4 -64.2 -50.2 127.5 50.1 45.0 205 201 A I H X S+ 0 0 52 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.931 112.1 56.5 -62.2 -39.8 128.7 53.6 45.8 206 202 A T H X S+ 0 0 0 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.940 108.0 45.1 -60.7 -45.3 130.3 53.8 42.2 207 203 A T H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -1,-0.3 0.825 110.5 57.1 -67.5 -24.2 127.0 53.2 40.5 208 204 A S H >X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.2 3,-0.6 0.968 104.3 50.7 -68.3 -49.1 125.5 55.6 42.9 209 205 A E H 3X S+ 0 0 69 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.853 107.6 54.7 -46.9 -39.0 127.9 58.3 41.8 210 206 A Y H 3X S+ 0 0 2 -4,-1.9 4,-1.1 -5,-0.2 -1,-0.2 0.841 103.4 56.0 -71.8 -30.2 126.9 57.5 38.2 211 207 A E H X S+ 0 0 63 -4,-2.9 4,-2.8 -5,-0.3 3,-1.0 0.959 109.3 40.9 -44.6 -62.1 123.3 66.1 36.2 217 213 A M H 3< S+ 0 0 26 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.796 111.1 58.6 -64.9 -24.5 123.7 65.5 32.5 218 214 A A H 3< S+ 0 0 0 -4,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.833 111.3 41.9 -69.6 -31.5 119.9 65.1 32.1 219 215 A Y H << S+ 0 0 82 -4,-2.3 -2,-0.2 -3,-1.0 -1,-0.2 0.905 107.1 56.5 -81.6 -46.0 119.5 68.6 33.5 220 216 A Q < 0 0 145 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.562 360.0 360.0 -49.7 -3.9 122.4 70.0 31.5 221 217 A S 0 0 63 -5,-0.3 -2,-0.1 -3,-0.2 -181,-0.1 0.623 360.0 360.0 -12.3 360.0 120.0 68.5 28.9 222 !* 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 0.0 223 0 D T 0 0 196 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 150.7 139.9 53.0 -1.2 224 1 D M - 0 0 113 0, 0.0 2,-0.3 0, 0.0 3,-0.0 -0.236 360.0-136.6 163.8 115.0 140.3 53.8 2.5 225 2 D Q > - 0 0 107 1,-0.1 4,-2.3 -2,-0.1 3,-0.4 -0.650 21.6-130.9 -74.2 142.9 142.2 51.9 5.2 226 3 D V H > S+ 0 0 12 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.855 104.4 56.4 -67.2 -31.9 140.2 51.7 8.4 227 4 D S H > S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.839 110.4 44.7 -69.9 -30.9 143.1 52.8 10.6 228 5 D Q H > S+ 0 0 79 -3,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.893 112.1 52.4 -75.6 -42.8 143.6 56.0 8.6 229 6 D Y H X S+ 0 0 61 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.874 111.2 46.6 -62.7 -35.6 139.9 56.6 8.6 230 7 D L H < S+ 0 0 0 -4,-2.3 4,-0.5 -5,-0.2 3,-0.2 0.964 111.0 51.5 -72.1 -46.9 139.7 56.3 12.3 231 8 D Y H >X S+ 0 0 62 -4,-1.9 3,-1.9 1,-0.2 4,-1.0 0.920 105.6 58.1 -50.7 -47.8 142.7 58.5 12.8 232 9 D Q H >< S+ 0 0 118 -4,-2.8 3,-0.9 1,-0.3 4,-0.3 0.903 106.8 46.3 -47.1 -52.8 141.1 61.1 10.6 233 10 D N T 3< S+ 0 0 68 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.451 111.7 51.8 -78.9 4.0 138.1 61.3 12.8 234 11 D A T <> S+ 0 0 0 -3,-1.9 4,-2.4 -4,-0.5 5,-0.3 0.501 80.4 98.2-111.1 -8.6 140.1 61.6 15.9 235 12 D Q H S+ 0 0 87 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.938 112.0 47.8 -55.6 -50.5 140.5 67.2 16.5 237 14 D I H > S+ 0 0 29 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.891 110.0 50.1 -63.9 -41.0 140.4 65.4 19.9 238 15 D W H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -1,-0.3 0.869 106.4 60.4 -67.3 -29.8 144.1 64.5 19.9 239 16 D G H X S+ 0 0 30 -4,-2.1 4,-1.8 -5,-0.3 -2,-0.2 0.978 104.1 46.8 -54.2 -58.9 144.6 68.2 19.0 240 17 D D H < S+ 0 0 74 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.808 111.5 54.4 -53.2 -30.3 143.0 69.2 22.2 241 18 D C H >< S+ 0 0 1 -4,-1.6 3,-1.4 1,-0.2 6,-0.3 0.927 104.9 50.1 -72.6 -45.9 145.1 66.6 24.0 242 19 D I H 3< S+ 0 0 26 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.846 116.2 43.3 -60.1 -34.0 148.4 67.8 22.8 243 20 D S T 3< S+ 0 0 75 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.181 84.7 125.4-100.8 18.7 147.6 71.4 23.8 244 21 D H S <> S- 0 0 5 -3,-1.4 4,-3.3 -5,-0.1 5,-0.4 -0.574 71.6-119.9 -78.0 139.3 146.1 70.5 27.2 245 22 D P H > S+ 0 0 71 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.844 113.7 51.7 -46.1 -43.1 147.6 72.4 30.1 246 23 D F H > S+ 0 0 0 2,-0.2 4,-1.1 3,-0.2 9,-0.1 0.926 115.5 39.7 -62.0 -47.8 148.7 69.0 31.7 247 24 D V H >> S+ 0 0 0 -6,-0.3 4,-2.1 2,-0.2 3,-0.6 0.944 116.9 47.0 -71.7 -50.4 150.4 67.8 28.5 248 25 D Q H 3X S+ 0 0 37 -4,-3.3 4,-1.7 1,-0.2 6,-0.3 0.903 108.1 61.4 -52.1 -41.3 151.9 71.1 27.5 249 26 D G H 3<>S+ 0 0 0 -4,-2.3 6,-1.5 -5,-0.4 5,-0.6 0.845 104.1 47.4 -52.3 -37.0 153.0 71.2 31.2 250 27 D I H X<5S+ 0 0 2 -4,-1.1 3,-1.3 -3,-0.6 -2,-0.2 0.955 109.7 52.7 -71.1 -48.5 154.9 68.0 30.6 251 28 D G H 3<5S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.735 119.7 31.4 -57.4 -28.8 156.6 69.4 27.4 252 29 D R T 3<5S- 0 0 137 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.1 -0.187 106.3-112.5-128.0 40.8 157.9 72.6 29.0 253 30 D G T < 5S+ 0 0 25 -3,-1.3 -3,-0.2 1,-0.2 -4,-0.1 0.515 83.2 118.2 50.6 11.9 158.6 71.6 32.6 254 31 D T < + 0 0 95 -5,-0.6 2,-0.2 -6,-0.3 -1,-0.2 0.633 41.2 99.9 -86.1 -14.1 155.8 73.8 33.9 255 32 D L S S- 0 0 5 -6,-1.5 2,-0.3 -9,-0.1 -9,-0.0 -0.525 74.6-120.3 -78.3 136.5 153.6 71.1 35.5 256 33 D E >> - 0 0 87 -2,-0.2 3,-1.7 1,-0.1 4,-1.3 -0.596 14.3-123.2 -85.9 138.3 153.9 70.7 39.2 257 34 D R H 3> S+ 0 0 116 -2,-0.3 4,-3.3 1,-0.3 5,-0.3 0.782 107.3 64.6 -42.2 -43.1 155.0 67.4 40.7 258 35 D D H 3> S+ 0 0 120 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.886 106.4 44.1 -48.6 -45.8 151.9 67.2 42.9 259 36 D K H <> S+ 0 0 39 -3,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.867 114.4 47.4 -69.7 -38.5 149.8 66.9 39.8 260 37 D F H X S+ 0 0 0 -4,-1.3 4,-2.8 2,-0.2 -2,-0.2 0.846 108.6 55.8 -74.4 -34.9 152.0 64.5 38.0 261 38 D R H X S+ 0 0 66 -4,-3.3 4,-1.8 1,-0.2 5,-0.2 0.950 106.9 49.1 -58.6 -52.2 152.2 62.3 41.1 262 39 D F H X S+ 0 0 56 -4,-1.9 4,-1.8 -5,-0.3 -1,-0.2 0.859 111.9 52.9 -56.8 -33.0 148.5 62.0 41.2 263 40 D Y H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 5,-0.3 0.945 105.3 48.7 -70.3 -50.6 148.6 61.1 37.5 264 41 D I H X S+ 0 0 3 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.827 110.7 52.7 -70.0 -23.4 151.1 58.3 37.6 265 42 D I H X S+ 0 0 17 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.926 113.4 43.7 -68.9 -44.4 149.2 56.7 40.5 266 43 D Q H X S+ 0 0 7 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.823 112.3 52.5 -65.3 -31.1 146.0 56.9 38.5 267 44 D D H X S+ 0 0 4 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.814 105.4 56.4 -81.5 -28.5 147.7 55.7 35.4 268 45 D Y H X S+ 0 0 48 -4,-1.5 4,-1.6 -5,-0.3 -1,-0.2 0.943 109.0 44.6 -62.3 -50.4 149.0 52.8 37.3 269 46 D L H X S+ 0 0 23 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.878 113.3 53.5 -58.3 -36.0 145.5 51.8 38.3 270 47 D F H X S+ 0 0 5 -4,-1.8 4,-1.7 1,-0.2 3,-0.2 0.903 104.6 53.2 -69.9 -43.2 144.5 52.4 34.7 271 48 D L H X S+ 0 0 20 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.836 102.5 58.8 -61.8 -35.8 147.2 50.1 33.2 272 49 D L H X S+ 0 0 65 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.911 111.7 40.7 -58.3 -42.2 146.1 47.2 35.5 273 50 D E H X S+ 0 0 47 -4,-1.3 4,-0.8 -3,-0.2 -2,-0.2 0.800 111.2 58.1 -77.5 -25.0 142.6 47.4 33.9 274 51 D Y H >X S+ 0 0 17 -4,-1.7 4,-1.5 1,-0.2 3,-1.1 0.920 99.0 57.8 -71.5 -42.1 144.1 48.0 30.5 275 52 D A H 3X S+ 0 0 9 -4,-2.4 4,-2.5 1,-0.3 -1,-0.2 0.892 100.0 60.8 -55.1 -37.0 146.1 44.7 30.6 276 53 D K H 3X S+ 0 0 88 -4,-0.9 4,-2.1 1,-0.3 -1,-0.3 0.830 98.9 54.1 -61.8 -32.0 142.8 42.9 31.1 277 54 D V H S- 0 0 85 -2,-0.6 4,-2.8 1,-0.1 5,-0.3 -0.593 76.3-132.9 167.9 119.1 145.0 32.5 15.6 288 65 D E H > S+ 0 0 123 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.828 102.9 57.4 -60.1 -36.0 148.1 31.6 17.5 289 66 D A H > S+ 0 0 53 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.957 115.4 35.1 -56.2 -54.1 150.2 34.5 16.1 290 67 D V H > S+ 0 0 17 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.901 114.4 56.2 -72.5 -41.8 147.8 37.2 17.3 291 68 D M H X S+ 0 0 74 -4,-2.8 4,-0.9 1,-0.2 -1,-0.2 0.872 112.1 45.6 -58.0 -33.5 146.8 35.4 20.5 292 69 D R H X S+ 0 0 145 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.861 107.5 56.0 -79.3 -36.6 150.5 35.3 21.3 293 70 D E H X S+ 0 0 72 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.949 107.4 50.5 -58.8 -49.7 151.1 39.0 20.3 294 71 D F H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.829 106.1 55.6 -53.0 -36.4 148.4 40.0 22.8 295 72 D S H X S+ 0 0 60 -4,-0.9 4,-1.6 -5,-0.2 -1,-0.2 0.905 107.6 48.5 -70.3 -38.6 150.1 37.9 25.5 296 73 D N H X S+ 0 0 86 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.886 106.2 58.1 -64.2 -36.9 153.3 39.7 25.0 297 74 D A H X S+ 0 0 7 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.932 104.5 51.0 -55.6 -46.6 151.4 43.0 25.2 298 75 D I H X S+ 0 0 33 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.889 109.9 50.0 -59.7 -39.5 150.2 42.0 28.6 299 76 D Q H X S+ 0 0 105 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.870 110.6 50.3 -67.1 -38.3 153.8 41.3 29.7 300 77 D D H X>S+ 0 0 61 -4,-2.3 4,-2.7 2,-0.2 5,-0.6 0.970 106.9 52.5 -63.3 -56.6 154.9 44.6 28.4 301 78 D I H X5S+ 0 0 23 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.856 115.7 42.7 -47.5 -36.1 152.3 46.6 30.2 302 79 D L H <5S+ 0 0 57 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.844 127.3 27.0 -85.6 -30.0 153.3 44.9 33.4 303 80 D N H <5S+ 0 0 87 -4,-2.1 -2,-0.2 -3,-0.2 -3,-0.2 0.299 113.2 62.1-119.8 7.0 157.2 45.0 33.1 304 81 D N H >X5S+ 0 0 83 -4,-2.7 4,-1.8 -5,-0.1 3,-0.8 0.627 96.1 58.7 -93.0 -34.0 157.6 48.2 30.8 305 82 D E T 35S+ 0 0 67 -3,-0.8 4,-2.1 0, 0.0 -2,-0.3 0.197 134.3 21.3-125.0 -73.8 160.6 51.5 33.1 308 85 D I H X5S+ 0 0 20 -4,-1.8 4,-1.7 1,-0.2 -3,-0.2 0.967 129.9 34.1 -67.5 -64.3 158.2 54.4 33.0 309 86 D H H >5S+ 0 0 4 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.849 120.8 48.2 -63.8 -33.0 155.9 54.0 36.0 310 87 D N H >S+ 0 0 24 -4,-1.3 5,-3.2 -3,-0.3 -1,-0.2 0.831 117.4 31.4 -75.2 -31.2 157.3 55.9 41.8 314 91 D R H <5S+ 0 0 151 -4,-1.9 -2,-0.2 -3,-0.3 -1,-0.2 0.770 117.6 56.7 -92.3 -29.1 160.7 55.8 43.3 315 92 D E H <5S+ 0 0 114 -4,-2.2 -2,-0.2 -5,-0.4 -3,-0.2 0.971 123.0 27.7 -62.9 -54.5 161.7 59.1 41.7 316 93 D L T <5S- 0 0 23 -4,-2.7 2,-0.3 -5,-0.1 -59,-0.0 -0.142 113.6-106.9 -72.2-164.6 158.7 60.6 43.5 317 94 D Q T 5 + 0 0 159 -2,-0.1 2,-0.7 2,-0.0 -3,-0.2 -0.592 44.2 172.3-133.6 84.9 158.2 58.6 46.5 318 95 D I < - 0 0 19 -5,-3.2 2,-0.1 -2,-0.3 -2,-0.0 -0.775 30.3-132.7 -91.6 116.0 155.2 56.4 46.2 319 96 D T > - 0 0 77 -2,-0.7 4,-1.9 1,-0.1 -2,-0.0 -0.451 16.7-121.0 -70.9 141.0 155.0 54.0 49.1 320 97 D Q H > S+ 0 0 131 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.817 115.2 44.8 -48.6 -35.9 154.4 50.4 48.2 321 98 D K H > S+ 0 0 144 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.975 103.4 60.6 -75.4 -57.3 151.3 50.6 50.4 322 99 D E H > S+ 0 0 61 2,-0.2 4,-0.6 1,-0.2 3,-0.5 0.795 100.8 61.6 -36.8 -42.8 150.0 54.0 49.2 323 100 D L H >< S+ 0 0 3 -4,-1.9 3,-3.4 1,-0.2 -1,-0.2 0.978 107.7 35.5 -48.5 -85.3 149.7 52.4 45.7 324 101 D Q H 3< S+ 0 0 129 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.445 112.4 65.7 -62.8 7.5 147.2 49.6 46.3 325 102 D N H 3< S+ 0 0 102 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.596 83.5 101.9 -89.1 -15.0 145.5 51.9 48.7 326 103 D A << - 0 0 33 -3,-3.4 -3,-0.0 -4,-0.6 -4,-0.0 -0.332 64.0-137.8 -76.9 149.8 144.5 54.4 45.9 327 104 D C - 0 0 92 -2,-0.1 2,-0.1 0, 0.0 -58,-0.1 -0.866 15.8-124.8-101.7 138.3 141.1 54.7 44.3 328 105 D P - 0 0 33 0, 0.0 2,-0.1 0, 0.0 -62,-0.0 -0.498 32.8-120.6 -68.1 153.6 140.6 55.1 40.6 329 106 D T > - 0 0 39 -2,-0.1 4,-2.4 1,-0.1 5,-0.3 -0.499 27.5-100.5 -89.3 165.0 138.5 58.2 39.8 330 107 D L H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.852 125.9 53.5 -51.9 -34.5 135.2 58.0 38.0 331 108 D A H > S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.970 109.2 48.1 -67.0 -50.7 137.0 59.1 34.8 332 109 D N H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.949 115.7 43.3 -47.2 -57.6 139.6 56.3 35.2 333 110 D K H X S+ 0 0 26 -4,-2.4 4,-3.0 1,-0.3 5,-0.3 0.852 110.7 55.4 -65.0 -37.7 137.0 53.6 35.8 334 111 D S H X S+ 0 0 5 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.3 0.908 108.5 47.6 -61.4 -41.9 134.7 54.8 33.1 335 112 D Y H X S+ 0 0 1 -4,-1.9 4,-1.9 -3,-0.3 -2,-0.2 0.961 116.2 42.1 -69.2 -51.1 137.3 54.6 30.5 336 113 D T H X S+ 0 0 7 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.918 113.0 53.6 -61.5 -44.1 138.6 51.1 31.4 337 114 D S H X S+ 0 0 3 -4,-3.0 4,-3.0 -5,-0.2 -1,-0.2 0.885 108.1 52.3 -56.6 -37.3 135.0 49.7 31.9 338 115 D Y H X S+ 0 0 4 -4,-1.8 4,-2.0 -5,-0.3 5,-0.3 0.924 110.3 44.8 -69.5 -43.5 134.2 51.0 28.4 339 116 D M H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.982 116.9 47.8 -60.9 -51.9 137.1 49.2 26.7 340 117 D L H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.911 112.7 47.6 -52.4 -50.9 136.3 46.1 28.7 341 118 D A H X S+ 0 0 0 -4,-3.0 4,-1.7 -5,-0.2 -1,-0.2 0.832 112.6 47.9 -67.2 -31.0 132.6 46.1 28.0 342 119 D E H X S+ 0 0 19 -4,-2.0 4,-1.0 -3,-0.2 -1,-0.2 0.874 112.2 49.3 -81.5 -34.9 133.0 46.7 24.3 343 120 D G H >< S+ 0 0 0 -4,-2.6 3,-0.5 -5,-0.3 -2,-0.2 0.934 111.9 49.1 -61.1 -44.5 135.6 44.0 23.9 344 121 D F H 3< S+ 0 0 59 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.877 112.1 47.6 -68.6 -32.9 133.4 41.6 25.8 345 122 D K H 3< S+ 0 0 77 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.662 118.2 35.9 -81.7 -15.9 130.3 42.3 23.7 346 123 D G S << S- 0 0 18 -4,-1.0 2,-0.1 -3,-0.5 -3,-0.0 -0.365 87.5 -82.1-122.4-159.2 132.0 42.1 20.4 347 124 D S > - 0 0 46 -2,-0.1 4,-1.2 1,-0.0 3,-0.5 -0.214 57.8 -78.3-100.3-169.4 134.7 40.2 18.5 348 125 D I H > S+ 0 0 15 -64,-0.4 4,-1.6 1,-0.2 5,-0.1 0.663 124.9 66.3 -69.8 -10.4 138.4 40.5 18.4 349 126 D K H > S+ 0 0 45 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.916 98.5 52.1 -73.2 -43.4 138.0 43.6 16.0 350 127 D E H > S+ 0 0 12 -3,-0.5 4,-3.2 1,-0.2 -2,-0.2 0.880 109.9 48.4 -59.6 -36.9 136.4 45.6 18.8 351 128 D V H X S+ 0 0 0 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.905 110.0 50.4 -76.5 -31.7 139.2 44.9 21.2 352 129 D A H < S+ 0 0 0 -4,-1.6 4,-0.4 1,-0.2 -1,-0.2 0.876 116.3 44.2 -67.8 -32.5 141.8 45.8 18.6 353 130 D A H >X S+ 0 0 0 -4,-2.1 3,-0.8 1,-0.2 4,-0.7 0.897 109.8 54.8 -74.3 -46.4 139.9 49.0 18.0 354 131 D A H 3< S+ 0 0 0 -4,-3.2 4,-0.3 1,-0.2 -2,-0.2 0.740 110.9 43.4 -64.4 -24.4 139.2 49.7 21.7 355 132 D V T 3X S+ 0 0 0 -4,-1.5 4,-1.2 -5,-0.2 -1,-0.2 0.589 95.7 80.3-100.2 -6.4 142.9 49.6 22.7 356 133 D L H <> S+ 0 0 1 -3,-0.8 4,-2.7 -4,-0.4 5,-0.3 0.915 83.3 56.4 -67.0 -49.7 144.3 51.6 19.8 357 134 D S H X S+ 0 0 0 -4,-0.7 4,-3.0 1,-0.2 5,-0.4 0.929 103.6 56.8 -46.9 -55.0 143.5 55.3 20.9 358 135 D C H > S+ 0 0 12 -4,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.927 115.6 32.3 -46.1 -59.3 145.4 54.9 24.0 359 136 D G H X S+ 0 0 12 -4,-1.2 4,-1.6 1,-0.2 -1,-0.2 0.954 120.6 48.7 -68.5 -51.3 148.7 53.8 22.4 360 137 D W H X S+ 0 0 30 -4,-2.7 4,-2.3 1,-0.2 3,-0.4 0.929 110.7 50.4 -54.9 -50.7 148.5 55.8 19.2 361 138 D S H X S+ 0 0 0 -4,-3.0 4,-2.9 -5,-0.3 5,-0.2 0.949 109.0 50.7 -58.0 -49.6 147.5 59.1 20.9 362 139 D Y H X S+ 0 0 8 -4,-1.8 4,-2.3 -5,-0.4 -1,-0.3 0.833 108.2 54.9 -56.6 -30.6 150.4 58.9 23.4 363 140 D L H X S+ 0 0 9 -4,-1.6 4,-2.2 -3,-0.4 -2,-0.2 0.974 111.1 42.0 -69.5 -49.5 152.7 58.3 20.5 364 141 D V H X S+ 0 0 21 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.930 113.9 54.4 -60.0 -44.3 151.6 61.5 18.6 365 142 D I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.940 111.9 42.1 -56.4 -49.4 151.6 63.4 21.9 366 143 D A H X S+ 0 0 0 -4,-2.3 4,-0.6 22,-0.3 -1,-0.2 0.835 111.5 55.7 -71.3 -27.3 155.2 62.5 22.7 367 144 D Q H < S+ 0 0 84 -4,-2.2 3,-0.3 21,-0.2 -1,-0.2 0.935 112.1 45.0 -64.7 -43.8 156.3 63.0 19.1 368 145 D N H >< S+ 0 0 69 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.965 109.6 50.5 -63.2 -58.1 155.0 66.5 19.4 369 146 D L H 3< S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.646 90.3 89.5 -55.0 -11.9 156.4 67.4 22.8 370 147 D S T 3< S+ 0 0 29 -4,-0.6 2,-0.6 -3,-0.3 -1,-0.3 0.638 79.9 61.4 -68.0 -13.7 159.7 66.2 21.3 371 148 D Q < + 0 0 138 -3,-1.8 -1,-0.1 -4,-0.1 -120,-0.0 -0.936 67.4 85.8-112.6 111.7 160.5 69.6 20.0 372 149 D I S S- 0 0 80 -2,-0.6 2,-0.1 -120,-0.0 -1,-0.1 0.565 91.3-123.2-128.6 -42.9 160.8 72.4 22.4 373 150 D P S S+ 0 0 84 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 0.583 91.9 42.0 -94.6-139.9 163.6 71.7 22.8 374 151 D N S > S+ 0 0 107 -2,-0.1 4,-1.6 -4,-0.1 -3,-0.1 0.455 83.8 111.2 60.0 3.0 165.1 70.8 26.1 375 152 D A T 4 S+ 0 0 3 2,-0.2 3,-0.3 1,-0.2 10,-0.2 0.954 84.4 38.1 -63.4 -47.6 161.8 69.0 26.5 376 153 D L T 4 S+ 0 0 69 -6,-0.3 -1,-0.2 1,-0.2 10,-0.1 0.775 113.4 57.8 -68.9 -31.6 163.9 65.9 26.2 377 154 D E T 4 S+ 0 0 135 5,-0.1 -1,-0.2 4,-0.0 -2,-0.2 0.787 75.4 123.0 -69.5 -29.5 166.7 67.4 28.3 378 155 D H X - 0 0 58 -4,-1.6 4,-1.4 -3,-0.3 5,-0.3 -0.042 64.8-135.2 -45.6 124.7 164.5 68.1 31.3 379 156 D A T 4 S+ 0 0 111 2,-0.1 -1,-0.2 1,-0.1 4,-0.1 0.708 95.8 17.9 -55.3 -25.0 165.9 66.4 34.4 380 157 D F T >4 S+ 0 0 18 2,-0.1 3,-0.6 3,-0.0 4,-0.4 0.793 129.7 37.3-115.8 -60.8 162.5 65.1 35.4 381 158 D Y T 3> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.1 5,-0.2 0.517 97.2 84.6 -74.3 -4.5 159.9 65.1 32.7 382 159 D G H 3X S+ 0 0 3 -4,-1.4 4,-2.5 1,-0.2 -1,-0.2 0.919 83.1 56.4 -68.3 -41.6 162.4 64.1 30.1 383 160 D H H <> S+ 0 0 69 -3,-0.6 4,-2.7 -5,-0.3 -1,-0.2 0.861 104.3 52.0 -56.4 -45.0 162.2 60.4 30.7 384 161 D W H > S+ 0 0 2 -4,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.917 112.4 45.5 -60.4 -46.4 158.5 60.2 30.1 385 162 D I H < S+ 0 0 0 -4,-1.4 4,-0.3 1,-0.2 -2,-0.2 0.914 111.5 52.3 -63.7 -43.3 158.7 61.9 26.8 386 163 D K H >X S+ 0 0 139 -4,-2.5 3,-1.2 1,-0.2 4,-0.7 0.937 108.9 53.9 -55.6 -49.2 161.7 59.7 25.9 387 164 D G H >< S+ 0 0 18 -4,-2.7 3,-1.6 1,-0.2 6,-0.3 0.950 108.3 43.5 -49.1 -65.8 159.6 56.7 26.7 388 165 D Y T 3< S+ 0 0 22 -4,-1.9 -22,-0.3 1,-0.3 -1,-0.2 0.295 115.5 49.3 -77.2 14.4 156.6 57.3 24.6 389 166 D S T <4 S+ 0 0 31 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.393 85.9 117.1-126.0 -0.5 158.6 58.3 21.5 390 167 D S S S+ 0 0 155 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.835 116.8 53.9 -70.0 -34.7 161.3 52.8 18.7 392 169 D E H > S+ 0 0 125 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.954 107.9 47.7 -63.9 -52.7 159.8 50.1 20.9 393 170 D F H > S+ 0 0 46 -6,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.908 113.1 49.8 -56.1 -41.8 156.6 52.0 21.7 394 171 D Q H X S+ 0 0 77 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.907 108.9 51.1 -65.9 -39.9 156.3 52.9 18.1 395 172 D A H X S+ 0 0 56 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.950 109.3 52.7 -58.8 -46.2 156.7 49.3 17.0 396 173 D C H X S+ 0 0 55 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.926 109.7 46.2 -55.9 -48.7 154.0 48.4 19.5 397 174 D V H X S+ 0 0 5 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.881 111.7 53.5 -60.6 -40.6 151.6 51.0 18.1 398 175 D N H X S+ 0 0 73 -4,-2.6 4,-3.3 2,-0.2 5,-0.3 0.910 104.3 53.7 -61.6 -44.7 152.4 49.8 14.6 399 176 D W H X S+ 0 0 50 -4,-2.9 4,-3.0 1,-0.2 5,-0.2 0.950 111.1 47.2 -52.4 -49.6 151.6 46.2 15.5 400 177 D N H X S+ 0 0 9 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.903 111.7 50.4 -62.9 -41.8 148.2 47.4 16.8 401 178 D I H X S+ 0 0 17 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.965 115.0 43.0 -57.7 -54.3 147.6 49.5 13.6 402 179 D N H X S+ 0 0 100 -4,-3.3 4,-2.8 1,-0.2 5,-0.3 0.903 110.3 56.0 -62.6 -43.9 148.4 46.6 11.3 403 180 D L H X S+ 0 0 12 -4,-3.0 4,-2.5 -5,-0.3 -1,-0.2 0.923 109.0 47.6 -49.1 -50.7 146.4 44.1 13.4 404 181 D L H < S+ 0 0 0 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.862 111.6 49.1 -65.7 -36.2 143.4 46.2 13.0 405 182 D D H >X S+ 0 0 27 -4,-1.8 3,-1.3 2,-0.2 4,-0.9 0.945 112.1 47.9 -69.0 -44.6 143.7 46.7 9.3 406 183 D S H >< S+ 0 0 70 -4,-2.8 3,-0.5 1,-0.3 -2,-0.2 0.894 110.6 52.8 -64.8 -36.9 144.2 43.0 8.6 407 184 D L T 3< S+ 0 0 45 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.627 115.3 40.1 -70.6 -9.1 141.3 42.2 10.8 408 185 D T T X4 + 0 0 4 -3,-1.3 2,-3.0 -4,-0.5 3,-2.2 0.492 68.4 112.5-125.7 -1.1 138.9 44.5 8.9 409 186 D L T << S+ 0 0 131 -4,-0.9 -1,-0.1 -3,-0.5 -4,-0.1 -0.362 91.2 38.9 -73.9 66.7 139.6 44.4 5.2 410 187 D A T 3 S+ 0 0 99 -2,-3.0 -1,-0.3 1,-0.1 2,-0.2 0.254 84.9 120.4 169.1 -2.9 136.2 42.8 4.7 411 188 D S < - 0 0 23 -3,-2.2 -1,-0.1 1,-0.1 -3,-0.0 -0.532 62.3-109.7 -86.5 154.5 133.8 44.5 7.2 412 189 D S > - 0 0 42 -2,-0.2 4,-2.2 1,-0.1 3,-0.2 -0.186 29.9-101.2 -76.5 172.4 130.8 46.4 6.0 413 190 D K H > S+ 0 0 167 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.935 125.7 52.7 -55.1 -44.7 130.2 50.2 6.0 414 191 D Q H > S+ 0 0 159 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.815 106.7 50.1 -64.6 -33.2 128.1 49.6 9.1 415 192 D E H > S+ 0 0 68 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.890 109.1 51.7 -72.5 -41.8 130.8 47.6 11.0 416 193 D I H X S+ 0 0 11 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.900 106.0 56.1 -62.5 -40.0 133.4 50.3 10.3 417 194 D E H X S+ 0 0 82 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.944 107.2 48.6 -52.8 -50.1 131.0 52.9 11.7 418 195 D K H X S+ 0 0 81 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.893 111.6 49.1 -60.1 -40.3 130.8 51.0 14.9 419 196 D L H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.875 110.1 51.7 -66.2 -37.8 134.6 50.7 15.1 420 197 D K H X S+ 0 0 37 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.927 107.2 53.1 -64.6 -47.4 134.9 54.4 14.4 421 198 D E H X S+ 0 0 98 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.842 109.6 48.4 -54.3 -36.0 132.5 55.1 17.2 422 199 D I H X S+ 0 0 0 -4,-1.6 4,-2.6 -5,-0.2 5,-0.2 0.929 111.1 51.8 -70.8 -41.2 134.6 53.0 19.6 423 200 D F H X S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.917 112.6 41.6 -70.4 -42.4 137.7 54.8 18.5 424 201 D I H X S+ 0 0 48 -4,-2.9 4,-2.9 2,-0.2 5,-0.2 0.940 112.1 57.4 -68.8 -39.3 136.5 58.3 19.0 425 202 D T H X S+ 0 0 2 -4,-1.9 4,-1.6 -5,-0.3 -2,-0.2 0.907 107.7 45.8 -58.0 -41.3 134.8 57.4 22.3 426 203 D T H X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 -1,-0.3 0.835 109.9 57.1 -69.7 -25.0 138.0 56.1 23.7 427 204 D S H X S+ 0 0 0 -4,-1.3 4,-1.6 -5,-0.2 3,-0.4 0.949 104.4 51.0 -69.7 -45.2 139.6 59.3 22.4 428 205 D E H X S+ 0 0 74 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.858 106.5 54.5 -49.7 -43.3 137.1 61.4 24.4 429 206 D Y H X S+ 0 0 2 -4,-1.6 4,-1.3 -5,-0.2 -1,-0.2 0.810 103.4 57.1 -68.8 -28.1 138.0 59.4 27.5 430 207 D E H X S+ 0 0 2 -4,-1.4 4,-2.2 -3,-0.4 -1,-0.2 0.910 107.3 47.0 -65.0 -44.0 141.7 60.2 26.9 431 208 D Y H X S+ 0 0 87 -4,-1.6 4,-2.7 1,-0.2 -2,-0.2 0.949 112.3 50.1 -60.6 -48.2 140.8 63.9 27.0 432 209 D L H X S+ 0 0 61 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.791 108.0 56.0 -59.9 -27.6 138.8 63.4 30.1 433 210 D F H X S+ 0 0 2 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.960 108.1 43.7 -76.9 -51.0 141.6 61.6 31.7 434 211 D W H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.918 113.0 57.3 -54.0 -43.5 144.2 64.4 31.2 435 212 D D H >X S+ 0 0 68 -4,-2.7 4,-2.5 1,-0.2 3,-0.6 0.949 109.7 40.4 -52.8 -56.2 141.5 66.6 32.5 436 213 D M H 3< S+ 0 0 23 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.805 110.7 60.4 -68.5 -24.7 141.0 64.8 35.7 437 214 D A H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.850 110.3 40.7 -65.4 -35.3 144.7 64.4 36.0 438 215 D Y H << S+ 0 0 83 -4,-1.9 -2,-0.2 -3,-0.6 -1,-0.2 0.890 105.7 59.8 -81.9 -44.6 145.1 68.1 36.1 439 216 D Q < 0 0 152 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.606 360.0 360.0 -46.5 -8.2 142.1 68.7 38.3 440 217 D S 0 0 64 -5,-0.2 -2,-0.1 -3,-0.1 -181,-0.1 0.514 360.0 360.0 1.7 360.0 144.5 66.5 40.2