==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER REDUCTASE 16-AUG-04 1W68 . COMPND 2 MOLECULE: RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE M2 CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR S.KARLSEN,K.R.STRAND,M.KOLBERG,A.K.ROHR,C.H.GORBITZ, . 281 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12920.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 216 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 . 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 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.8 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 1 0 1 0 1 0 0 0 1 0 0 1 0 0 0 1 1 0 0 0 0 0 1 1 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 68 A V > 0 0 124 0, 0.0 3,-1.0 0, 0.0 6,-0.2 0.000 360.0 360.0 360.0 -26.2 122.3 103.8 75.4 2 69 A E T 3 + 0 0 160 1,-0.2 6,-0.1 6,-0.1 0, 0.0 0.657 360.0 53.7 -75.3 -15.9 122.4 107.0 73.3 3 70 A D T 3 S+ 0 0 103 4,-0.0 -1,-0.2 5,-0.0 3,-0.1 0.383 87.3 100.3 -96.4 2.1 120.8 105.1 70.4 4 71 A E <> - 0 0 10 -3,-1.0 4,-3.1 1,-0.2 3,-0.2 -0.801 59.4-160.5 -93.4 110.2 117.9 104.0 72.7 5 72 A P T 4 S+ 0 0 36 0, 0.0 -1,-0.2 0, 0.0 209,-0.1 0.816 94.9 48.6 -56.1 -30.0 114.8 106.1 72.2 6 73 A L T 4 S+ 0 0 0 207,-0.4 82,-2.8 1,-0.1 83,-0.7 0.845 122.7 28.4 -79.2 -38.2 113.6 104.9 75.6 7 74 A L T 4 S+ 0 0 28 80,-0.2 -1,-0.1 -6,-0.2 3,-0.1 0.627 94.4 103.8-101.8 -17.0 116.8 105.5 77.6 8 75 A R S < S- 0 0 113 -4,-3.1 80,-0.1 1,-0.1 -6,-0.1 -0.289 86.2 -75.7 -69.0 154.3 118.5 108.5 75.8 9 76 A E - 0 0 183 1,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.126 49.0-169.0 -48.6 135.1 118.4 112.0 77.1 10 77 A N > - 0 0 30 1,-0.1 3,-0.8 -3,-0.1 4,-0.2 -0.916 19.6-175.1-137.0 110.7 115.1 113.8 76.7 11 78 A P G > S+ 0 0 116 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.800 91.0 55.3 -71.1 -29.5 114.6 117.6 77.3 12 79 A R G > S+ 0 0 182 1,-0.2 3,-2.3 2,-0.1 -2,-0.0 0.465 77.4 108.5 -81.1 -2.2 110.8 117.3 76.7 13 80 A R G < S+ 0 0 70 -3,-0.8 -1,-0.2 1,-0.3 -4,-0.0 0.799 70.1 57.0 -42.8 -41.4 110.7 114.7 79.4 14 81 A F G < S+ 0 0 163 -3,-0.6 2,-0.4 -4,-0.2 -1,-0.3 0.594 99.1 67.5 -73.5 -10.7 109.0 117.0 81.9 15 82 A V < - 0 0 92 -3,-2.3 75,-0.2 1,-0.1 -3,-0.0 -0.877 64.9-152.9-113.6 143.5 106.0 117.8 79.7 16 83 A V + 0 0 63 -2,-0.4 4,-0.2 74,-0.1 -1,-0.1 0.913 57.9 99.6 -82.8 -43.2 103.2 115.3 78.6 17 84 A F + 0 0 144 1,-0.1 2,-0.1 2,-0.1 3,-0.0 -0.694 62.1 44.1 -95.0 151.2 102.0 116.8 75.3 18 85 A P S S- 0 0 94 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.521 89.2-132.5 -81.4 145.3 102.5 116.3 72.5 19 86 A I - 0 0 30 1,-0.2 3,-0.2 -2,-0.1 -2,-0.1 -0.362 23.3-176.0 -60.6 134.0 102.2 112.5 73.0 20 87 A E S S+ 0 0 101 1,-0.2 2,-0.5 -4,-0.2 -1,-0.2 0.776 74.2 35.5-101.0 -36.1 105.1 110.7 71.3 21 88 A Y > + 0 0 39 1,-0.1 4,-2.2 2,-0.0 -1,-0.2 -0.865 56.8 178.6-125.9 98.1 104.1 107.1 71.9 22 89 A H H > S+ 0 0 112 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.776 84.3 59.4 -68.4 -26.6 100.3 106.4 71.8 23 90 A D H > S+ 0 0 66 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.927 110.2 41.3 -67.3 -42.5 100.9 102.7 72.4 24 91 A I H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.875 113.8 55.4 -70.7 -36.5 102.6 103.5 75.7 25 92 A W H X S+ 0 0 38 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.937 105.4 49.7 -61.9 -48.0 100.0 106.1 76.4 26 93 A Q H X S+ 0 0 99 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.821 106.9 57.1 -62.7 -30.4 97.1 103.7 76.0 27 94 A M H X S+ 0 0 19 -4,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.926 108.4 46.5 -63.4 -46.2 98.9 101.3 78.4 28 95 A Y H X S+ 0 0 36 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.871 110.3 53.2 -63.4 -39.7 99.0 104.0 81.1 29 96 A K H X S+ 0 0 83 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.834 106.1 52.8 -66.4 -34.0 95.3 104.9 80.5 30 97 A K H X S+ 0 0 119 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.921 111.4 47.1 -66.9 -42.1 94.2 101.3 81.0 31 98 A A H >< S+ 0 0 7 -4,-1.7 3,-1.1 2,-0.2 4,-0.3 0.933 110.0 52.6 -63.0 -47.1 96.1 101.2 84.3 32 99 A E H >< S+ 0 0 69 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.927 108.2 51.0 -53.5 -49.0 94.6 104.6 85.3 33 100 A A H 3< S+ 0 0 87 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.659 103.7 60.4 -64.7 -17.7 91.1 103.2 84.6 34 101 A S T << S+ 0 0 13 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.445 75.9 139.1 -91.6 0.1 91.8 100.2 86.7 35 102 A F < + 0 0 106 -3,-1.6 2,-0.3 -4,-0.3 -3,-0.1 -0.095 18.9 153.6 -49.5 137.7 92.4 102.2 89.9 36 103 A W - 0 0 2 159,-0.0 2,-0.3 66,-0.0 69,-0.1 -0.945 31.0-132.9-157.0 165.1 91.0 100.7 93.1 37 104 A T > - 0 0 36 -2,-0.3 3,-1.1 1,-0.1 4,-0.2 -0.875 25.1-116.7-125.0 158.6 91.9 100.9 96.8 38 105 A A G > S+ 0 0 5 -2,-0.3 3,-2.9 1,-0.3 -1,-0.1 0.884 112.0 68.5 -60.4 -38.8 92.2 98.2 99.5 39 106 A E G 3 S+ 0 0 139 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.809 88.6 66.5 -49.5 -32.9 89.3 99.8 101.3 40 107 A E G < S+ 0 0 111 -3,-1.1 2,-0.8 2,-0.1 -1,-0.3 0.583 83.4 85.5 -67.6 -11.5 87.1 98.7 98.5 41 108 A V S < S- 0 0 10 -3,-2.9 2,-0.7 -4,-0.2 147,-0.1 -0.840 76.2-142.9 -97.4 111.2 87.6 95.0 99.4 42 109 A D + 0 0 101 -2,-0.8 3,-0.1 1,-0.1 149,-0.1 -0.628 29.0 166.7 -77.5 113.5 85.2 93.9 102.1 43 110 A L > + 0 0 26 -2,-0.7 3,-0.9 1,-0.1 4,-0.4 0.168 46.8 104.7-109.4 13.2 86.9 91.6 104.5 44 111 A S G > S+ 0 0 75 1,-0.3 2,-0.8 2,-0.1 3,-0.5 0.927 83.3 45.2 -59.7 -47.2 84.2 91.7 107.1 45 112 A K G 3 S+ 0 0 136 1,-0.2 -1,-0.3 -3,-0.1 143,-0.2 -0.390 96.9 79.2 -95.4 54.9 82.9 88.2 106.2 46 113 A D G <> + 0 0 2 -3,-0.9 4,-2.2 -2,-0.8 -1,-0.2 0.558 69.7 70.6-132.4 -21.5 86.3 86.4 106.0 47 114 A I H <> S+ 0 0 77 -3,-0.5 4,-1.4 -4,-0.4 -2,-0.1 0.910 103.2 49.5 -65.7 -39.4 87.6 85.6 109.5 48 115 A Q H > S+ 0 0 119 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.914 109.6 51.0 -63.9 -43.8 84.8 83.0 109.7 49 116 A H H > S+ 0 0 55 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.900 107.6 52.7 -59.7 -42.1 85.8 81.5 106.3 50 117 A W H < S+ 0 0 25 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.843 108.6 53.2 -62.2 -31.9 89.4 81.4 107.5 51 118 A E H < S+ 0 0 137 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.951 105.4 51.0 -67.0 -52.7 88.0 79.4 110.5 52 119 A A H < S+ 0 0 81 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.851 90.5 104.4 -54.6 -39.1 86.2 76.9 108.4 53 120 A L S < S- 0 0 8 -4,-1.9 -3,-0.0 -5,-0.2 132,-0.0 0.118 79.1-107.0 -41.7 158.5 89.3 76.2 106.4 54 121 A K > - 0 0 114 1,-0.1 4,-2.5 193,-0.0 5,-0.3 -0.622 28.4-109.7 -90.4 151.8 91.3 73.0 107.0 55 122 A P H > S+ 0 0 97 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.815 120.9 47.6 -49.3 -35.5 94.7 73.1 108.8 56 123 A D H > S+ 0 0 91 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.903 109.5 52.2 -74.0 -42.1 96.5 72.3 105.6 57 124 A E H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.887 110.8 47.1 -62.1 -40.3 94.6 74.8 103.6 58 125 A R H X S+ 0 0 56 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.881 107.6 57.0 -69.6 -35.9 95.4 77.6 106.0 59 126 A H H X S+ 0 0 77 -4,-1.4 4,-1.3 -5,-0.3 -1,-0.2 0.895 110.9 45.6 -59.1 -40.2 99.1 76.5 106.0 60 127 A F H >X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 3,-1.0 0.999 115.1 42.1 -64.7 -70.0 99.0 77.0 102.2 61 128 A I H 3X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.3 5,-0.2 0.823 111.8 56.1 -48.0 -40.9 97.3 80.3 102.0 62 129 A S H 3X S+ 0 0 3 -4,-2.7 4,-1.6 1,-0.2 -1,-0.3 0.894 111.5 44.5 -61.0 -39.8 99.3 81.8 104.9 63 130 A H H X S+ 0 0 14 -4,-1.5 4,-1.5 1,-0.2 3,-0.9 0.889 113.7 51.3 -71.4 -40.6 105.5 85.8 99.8 68 135 A F H 3X S+ 0 0 4 -4,-1.8 4,-0.9 1,-0.2 -2,-0.2 0.775 93.5 76.7 -67.6 -25.2 103.0 88.3 98.5 69 136 A A H 3< S+ 0 0 12 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.773 114.5 15.4 -57.3 -29.9 103.5 90.5 101.6 70 137 A A H <> S+ 0 0 27 -3,-0.9 4,-2.5 -4,-0.4 -1,-0.2 0.572 104.6 87.9-120.0 -16.4 106.9 91.8 100.3 71 138 A S H X S+ 0 0 17 -4,-1.5 4,-2.0 1,-0.2 -2,-0.1 0.884 92.2 45.2 -52.2 -49.6 106.8 90.9 96.6 72 139 A D H X S+ 0 0 7 -4,-0.9 4,-2.7 1,-0.2 -1,-0.2 0.853 111.3 55.2 -65.6 -34.3 105.1 94.1 95.4 73 140 A G H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.924 106.4 50.1 -63.9 -43.5 107.4 96.1 97.6 74 141 A I H X S+ 0 0 18 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.923 111.2 49.7 -59.8 -44.3 110.4 94.6 96.0 75 142 A V H >X S+ 0 0 6 -4,-2.0 4,-2.3 1,-0.2 3,-0.7 0.949 111.1 47.9 -58.7 -52.6 108.9 95.4 92.5 76 143 A N H 3X S+ 0 0 8 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.866 107.1 57.7 -56.8 -38.4 108.2 99.0 93.5 77 144 A E H 3X S+ 0 0 86 -4,-2.4 4,-1.8 1,-0.2 -1,-0.3 0.816 108.6 45.5 -64.5 -31.0 111.8 99.3 94.9 78 145 A N H S+ 0 0 0 -4,-1.4 4,-2.3 -3,-0.7 5,-1.0 0.864 110.8 53.7 -77.9 -37.4 113.1 98.4 91.5 79 146 A L H <>S+ 0 0 2 -4,-2.3 5,-2.4 3,-0.2 6,-0.5 0.913 114.4 41.2 -61.6 -43.0 110.8 100.7 89.7 80 147 A V H <5S+ 0 0 71 -4,-2.5 -2,-0.2 1,-0.2 5,-0.2 0.972 121.5 38.4 -69.4 -57.5 111.9 103.7 91.9 81 148 A E H <5S+ 0 0 97 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.780 136.5 2.5 -66.8 -28.9 115.7 103.0 91.9 82 149 A R T >X5S+ 0 0 44 -4,-2.3 4,-3.6 -5,-0.2 3,-0.9 0.669 120.1 42.0-122.0 -82.8 115.9 101.8 88.3 83 150 A F H 3>> - 0 0 6 -83,-0.7 4,-2.2 1,-0.1 3,-0.5 -0.642 64.1-142.5 -79.6 122.2 110.1 108.8 77.8 90 157 A T H 3> S+ 0 0 16 -2,-0.5 4,-1.7 1,-0.2 -1,-0.1 0.880 97.9 49.8 -48.4 -51.2 107.3 110.8 79.5 91 158 A E H 3> S+ 0 0 5 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.846 110.5 51.0 -61.2 -35.3 104.5 108.3 78.7 92 159 A A H <> S+ 0 0 0 -3,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.905 108.0 51.9 -69.0 -41.4 106.5 105.4 80.1 93 160 A R H X S+ 0 0 71 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.819 106.7 55.0 -65.5 -29.5 107.2 107.3 83.3 94 161 A C H X S+ 0 0 36 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.937 109.0 46.7 -68.8 -43.5 103.5 107.9 83.7 95 162 A F H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.943 114.2 47.4 -62.3 -44.8 102.8 104.2 83.4 96 163 A Y H X S+ 0 0 4 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.789 107.9 56.9 -66.1 -27.7 105.6 103.5 85.9 97 164 A G H X S+ 0 0 39 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.927 111.3 42.1 -68.9 -43.9 104.3 106.2 88.2 98 165 A F H X S+ 0 0 38 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.874 111.0 55.8 -71.6 -34.4 100.9 104.5 88.3 99 166 A Q H X S+ 0 0 4 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.932 107.1 50.4 -62.6 -43.0 102.4 101.1 88.7 100 167 A I H X S+ 0 0 38 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.950 110.8 49.2 -57.1 -49.9 104.3 102.2 91.7 101 168 A A H X S+ 0 0 44 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.918 114.2 45.3 -56.4 -46.0 101.1 103.6 93.2 102 169 A M H X S+ 0 0 2 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.854 106.7 58.1 -69.3 -34.4 99.2 100.4 92.5 103 170 A E H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.888 105.8 50.8 -62.7 -38.1 102.0 98.1 93.9 104 171 A N H X S+ 0 0 86 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.851 109.4 49.5 -69.0 -31.9 101.7 99.9 97.2 105 172 A I H X S+ 0 0 21 -4,-1.2 4,-3.1 2,-0.2 -2,-0.2 0.927 111.4 50.0 -70.1 -42.1 98.0 99.4 97.3 106 173 A H H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.945 110.5 50.5 -56.4 -48.3 98.7 95.7 96.5 107 174 A S H X S+ 0 0 27 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.901 110.8 48.3 -57.1 -44.9 101.2 95.6 99.3 108 175 A E H X S+ 0 0 80 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.957 108.8 55.0 -60.3 -50.6 98.6 97.2 101.7 109 176 A M H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.885 107.4 48.1 -51.0 -47.8 96.0 94.6 100.6 110 177 A Y H X S+ 0 0 3 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.902 110.2 52.4 -64.1 -39.0 98.1 91.6 101.4 111 178 A S H X S+ 0 0 45 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.886 108.6 51.2 -62.1 -39.5 99.0 93.1 104.8 112 179 A L H X S+ 0 0 58 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.921 108.4 51.6 -61.9 -46.9 95.3 93.5 105.5 113 180 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.949 113.1 44.0 -54.5 -53.7 94.5 89.9 104.6 114 181 A I H X S+ 0 0 1 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.905 114.1 50.7 -59.7 -41.8 97.2 88.6 106.9 115 182 A D H < S+ 0 0 67 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.894 111.8 49.1 -63.1 -38.4 96.1 91.0 109.6 116 183 A T H < S+ 0 0 30 -4,-3.0 -2,-0.2 -5,-0.1 -1,-0.2 0.849 120.1 33.7 -70.1 -37.5 92.5 89.8 109.1 117 184 A Y H < S+ 0 0 6 -4,-2.4 2,-0.8 1,-0.2 -2,-0.2 0.871 111.8 57.6 -89.3 -41.7 93.3 86.1 109.3 118 185 A I < + 0 0 4 -4,-2.7 -1,-0.2 -5,-0.3 -71,-0.0 -0.823 48.0 166.4 -99.9 109.0 96.2 85.8 111.8 119 186 A K + 0 0 115 -2,-0.8 -1,-0.2 -3,-0.1 3,-0.0 0.727 54.2 94.7 -87.9 -25.4 95.5 87.3 115.2 120 187 A D > - 0 0 73 1,-0.2 4,-2.2 4,-0.0 5,-0.1 -0.570 65.8-153.2 -72.3 120.3 98.5 85.7 116.8 121 188 A P H > S+ 0 0 92 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.865 90.9 61.2 -60.1 -41.1 101.4 88.2 116.8 122 189 A K H > S+ 0 0 166 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.955 111.0 38.2 -50.8 -57.6 104.0 85.5 116.8 123 190 A E H > S+ 0 0 79 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.906 112.5 59.1 -62.0 -44.8 102.9 84.1 113.5 124 191 A R H X S+ 0 0 59 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.947 108.8 42.6 -49.0 -58.6 102.1 87.6 112.1 125 192 A E H X S+ 0 0 149 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.904 111.8 57.7 -56.3 -41.7 105.7 88.7 112.5 126 193 A Y H < S+ 0 0 97 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.906 113.2 37.1 -55.0 -47.5 106.9 85.3 111.2 127 194 A L H >< S+ 0 0 1 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 0.830 111.9 59.2 -76.0 -34.1 105.0 85.8 107.9 128 195 A F H 3< S+ 0 0 81 -4,-2.8 3,-0.2 -5,-0.3 -1,-0.2 0.751 113.3 38.8 -66.9 -24.7 105.7 89.5 107.6 129 196 A N T >< S+ 0 0 51 -4,-1.6 3,-2.0 -5,-0.2 -1,-0.3 -0.169 76.1 132.9-117.6 38.6 109.4 88.8 107.6 130 197 A A G X> + 0 0 2 -3,-1.3 4,-2.5 1,-0.3 3,-1.0 0.791 64.1 65.8 -59.1 -32.5 109.2 85.7 105.5 131 198 A I G 34 S+ 0 0 45 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.594 114.8 33.6 -68.1 -6.5 112.1 86.9 103.2 132 199 A E G <4 S+ 0 0 134 -3,-2.0 -1,-0.3 -6,-0.2 -2,-0.2 0.266 133.1 28.2-127.0 4.7 114.2 86.5 106.4 133 200 A T T <4 S+ 0 0 53 -3,-1.0 -3,-0.2 -4,-0.2 -2,-0.2 0.581 108.4 62.8-134.2 -36.4 112.4 83.5 108.0 134 201 A M >X - 0 0 0 -4,-2.5 4,-2.4 -5,-0.2 3,-1.0 -0.840 54.6-168.1-103.3 102.2 110.8 81.4 105.2 135 202 A P H 3> S+ 0 0 98 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.765 87.1 69.9 -56.9 -23.9 113.4 79.9 102.8 136 203 A C H 3> S+ 0 0 36 1,-0.2 4,-0.6 2,-0.2 105,-0.1 0.934 113.4 25.4 -57.7 -48.6 110.5 79.0 100.6 137 204 A V H <> S+ 0 0 0 -3,-1.0 4,-2.5 -7,-0.2 5,-0.2 0.689 110.4 74.7 -89.2 -22.6 109.9 82.7 99.8 138 205 A K H X S+ 0 0 83 -4,-2.4 4,-2.4 -8,-0.3 5,-0.2 0.892 95.0 51.9 -57.1 -43.2 113.6 83.7 100.5 139 206 A K H X S+ 0 0 99 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.941 111.0 45.1 -61.2 -50.6 114.6 82.1 97.2 140 207 A K H X S+ 0 0 2 -4,-0.6 4,-2.1 1,-0.2 -2,-0.2 0.932 115.1 47.2 -60.5 -47.7 112.1 83.9 95.1 141 208 A A H X S+ 0 0 2 -4,-2.5 4,-3.4 1,-0.2 5,-0.2 0.912 110.9 51.6 -61.2 -44.4 112.7 87.3 96.7 142 209 A D H X S+ 0 0 72 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.849 107.1 54.7 -61.8 -34.6 116.5 86.9 96.4 143 210 A W H X S+ 0 0 33 -4,-1.8 4,-1.0 -5,-0.2 -1,-0.2 0.958 113.8 40.6 -63.0 -49.7 116.1 86.1 92.7 144 211 A A H >X S+ 0 0 3 -4,-2.1 3,-0.8 1,-0.2 4,-0.8 0.943 113.1 53.6 -63.0 -50.7 114.1 89.4 92.2 145 212 A L H >X S+ 0 0 67 -4,-3.4 4,-1.7 1,-0.2 3,-0.9 0.842 101.0 61.8 -53.5 -39.5 116.4 91.5 94.5 146 213 A R H 3X S+ 0 0 112 -4,-2.0 4,-2.0 1,-0.3 -1,-0.2 0.871 98.7 54.7 -57.4 -40.6 119.5 90.4 92.6 147 214 A W H << S+ 0 0 2 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.741 105.7 54.5 -67.4 -21.7 118.2 92.0 89.4 148 215 A I H << S+ 0 0 13 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.911 114.5 37.7 -77.0 -44.2 117.9 95.3 91.2 149 216 A G H < S+ 0 0 50 -4,-1.7 2,-0.9 2,-0.0 -2,-0.2 0.693 86.2 112.7 -80.8 -19.6 121.4 95.3 92.4 150 217 A D < - 0 0 30 -4,-2.0 8,-0.1 -5,-0.2 -4,-0.0 -0.374 41.4-179.2 -58.9 98.7 122.9 93.8 89.2 151 218 A K S S+ 0 0 196 -2,-0.9 -1,-0.2 1,-0.2 -4,-0.1 0.224 76.8 51.8 -86.6 15.8 124.9 96.8 87.9 152 219 A E S S+ 0 0 168 2,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.732 83.6 90.4-114.1 -48.6 126.0 94.8 84.8 153 220 A A S S- 0 0 11 1,-0.1 2,-0.0 2,-0.1 0, 0.0 -0.208 78.6-118.4 -53.5 137.9 122.7 93.4 83.3 154 221 A T > - 0 0 69 1,-0.1 4,-3.3 4,-0.0 5,-0.2 -0.285 21.7-107.7 -76.5 164.2 121.1 95.7 80.7 155 222 A Y H > S+ 0 0 8 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.885 121.8 59.0 -57.8 -37.4 117.7 97.2 81.0 156 223 A G H > S+ 0 0 3 60,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.937 110.7 38.9 -56.9 -49.6 116.6 94.8 78.4 157 224 A E H > S+ 0 0 39 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.937 118.3 49.4 -66.7 -47.0 117.6 91.8 80.5 158 225 A R H X S+ 0 0 5 -4,-3.3 4,-2.0 1,-0.2 -2,-0.2 0.865 108.3 51.4 -63.3 -37.4 116.3 93.4 83.7 159 226 A V H X S+ 0 0 1 -4,-3.5 4,-1.1 -5,-0.2 -1,-0.2 0.874 110.9 50.4 -69.0 -32.2 112.9 94.3 82.2 160 227 A V H X S+ 0 0 0 -4,-1.4 4,-1.3 -5,-0.3 -2,-0.2 0.907 108.0 53.3 -68.3 -40.7 112.6 90.7 81.0 161 228 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.895 110.4 45.6 -63.0 -40.6 113.5 89.5 84.5 162 229 A F H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.732 104.9 60.7 -77.4 -16.9 110.8 91.6 86.2 163 230 A A H X S+ 0 0 1 -4,-1.1 4,-0.9 2,-0.2 5,-0.3 0.826 109.5 45.0 -72.5 -30.4 108.3 90.5 83.5 164 231 A A H X>S+ 0 0 0 -4,-1.3 5,-2.2 3,-0.2 4,-0.9 0.874 111.4 52.0 -76.6 -42.3 109.0 87.1 84.9 165 232 A V H <5S+ 0 0 14 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.953 116.7 39.0 -60.1 -49.0 108.8 88.3 88.5 166 233 A E H <5S+ 0 0 9 -4,-2.8 -1,-0.2 3,-0.1 -2,-0.2 0.686 131.0 28.6 -77.3 -16.5 105.4 89.9 87.9 167 234 A G H X5S+ 0 0 9 -4,-0.9 4,-2.3 -5,-0.2 3,-0.4 0.844 127.7 29.5-106.1 -64.2 104.1 87.1 85.6 168 235 A I H X5S+ 0 0 0 -4,-0.9 4,-1.0 -5,-0.3 -3,-0.2 0.905 121.1 50.8 -68.1 -42.1 105.6 83.7 86.4 169 236 A F H 4 S+ 0 0 17 -3,-0.4 4,-2.6 -6,-0.3 -2,-0.2 0.755 99.9 76.4 -97.7 -33.0 102.6 85.5 90.5 171 238 A S H X S+ 0 0 4 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.867 92.4 48.2 -44.5 -58.8 101.1 82.8 88.2 172 239 A G H X S+ 0 0 0 -4,-1.0 4,-2.0 1,-0.2 -1,-0.2 0.924 117.1 40.2 -53.7 -53.0 101.3 79.8 90.6 173 240 A S H > S+ 0 0 0 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.836 113.5 57.2 -66.8 -32.7 99.7 81.6 93.6 174 241 A F H X S+ 0 0 37 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.952 108.1 44.9 -62.3 -50.3 97.2 83.3 91.3 175 242 A A H X S+ 0 0 7 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.898 110.6 54.9 -61.0 -42.8 95.9 80.0 90.0 176 243 A S H X S+ 0 0 0 -4,-2.0 4,-1.4 -5,-0.2 -1,-0.2 0.915 111.0 44.2 -57.7 -46.2 95.7 78.5 93.5 177 244 A I H X S+ 0 0 6 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.849 110.5 54.5 -68.4 -33.9 93.6 81.3 94.7 178 245 A F H X S+ 0 0 101 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.866 104.5 57.3 -65.7 -33.4 91.5 81.2 91.6 179 246 A W H X S+ 0 0 62 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.890 105.1 49.1 -61.9 -42.2 91.0 77.5 92.5 180 247 A L H <>S+ 0 0 3 -4,-1.4 5,-1.1 2,-0.2 -1,-0.2 0.875 106.6 55.7 -65.0 -40.1 89.6 78.5 95.9 181 248 A K H ><5S+ 0 0 84 -4,-1.9 3,-1.3 1,-0.2 -1,-0.2 0.911 107.1 51.2 -58.0 -42.1 87.2 80.9 94.2 182 249 A K H 3<5S+ 0 0 156 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.925 110.0 47.9 -60.5 -45.8 86.1 77.9 92.2 183 250 A R T 3<5S- 0 0 98 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.382 119.6-114.7 -77.0 4.8 85.5 76.0 95.4 184 251 A G T < 5 + 0 0 55 -3,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.987 68.2 131.1 59.5 65.1 83.7 78.9 96.8 185 252 A L < + 0 0 45 -5,-1.1 5,-0.3 1,-0.2 -1,-0.2 -0.975 52.0 14.9-145.5 157.6 86.0 79.9 99.6 186 253 A M > - 0 0 0 -2,-0.3 4,-2.7 1,-0.1 5,-0.3 0.908 58.6-170.4 43.1 64.6 87.7 83.0 101.0 187 254 A P H > S+ 0 0 57 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.751 84.0 50.7 -53.1 -28.6 85.7 85.7 99.2 188 255 A G H > S+ 0 0 1 2,-0.2 4,-2.3 -143,-0.2 5,-0.3 0.954 110.7 46.9 -75.2 -51.0 88.1 88.4 100.4 189 256 A L H > S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.928 117.5 43.4 -54.0 -49.3 91.2 86.6 99.2 190 257 A T H X S+ 0 0 12 -4,-2.7 4,-1.3 -5,-0.3 -1,-0.2 0.793 111.1 53.8 -70.6 -31.1 89.7 85.7 95.8 191 258 A F H X S+ 0 0 89 -4,-1.4 4,-1.5 -5,-0.3 3,-0.2 0.939 112.7 41.4 -71.1 -45.8 88.2 89.2 95.2 192 259 A S H X S+ 0 0 1 -4,-2.3 4,-3.3 1,-0.2 5,-0.3 0.884 109.2 61.4 -67.6 -35.8 91.4 91.1 95.7 193 260 A N H X S+ 0 0 3 -4,-1.9 4,-2.2 -5,-0.3 -1,-0.2 0.862 103.5 51.1 -57.7 -35.9 93.2 88.4 93.8 194 261 A E H X S+ 0 0 63 -4,-1.3 4,-1.4 2,-0.2 -1,-0.2 0.920 112.8 43.8 -68.2 -43.6 91.0 89.3 90.8 195 262 A L H X S+ 0 0 23 -4,-1.5 4,-1.7 2,-0.2 3,-0.4 0.958 114.5 49.4 -65.3 -51.0 91.8 93.0 91.0 196 263 A I H X S+ 0 0 0 -4,-3.3 4,-3.1 1,-0.2 3,-0.2 0.911 108.9 52.8 -54.4 -46.2 95.5 92.5 91.6 197 264 A S H X S+ 0 0 29 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.820 103.2 57.5 -61.8 -33.9 95.8 90.1 88.6 198 265 A R H X S+ 0 0 111 -4,-1.4 4,-1.1 -3,-0.4 -1,-0.2 0.924 111.8 42.0 -63.6 -41.3 94.2 92.7 86.4 199 266 A D H >X S+ 0 0 4 -4,-1.7 4,-2.5 -3,-0.2 3,-0.5 0.949 112.1 55.3 -67.5 -46.7 97.0 95.0 87.3 200 267 A E H 3X S+ 0 0 11 -4,-3.1 4,-2.2 1,-0.3 -2,-0.2 0.874 104.1 53.1 -53.0 -43.8 99.6 92.3 87.1 201 268 A G H 3X S+ 0 0 30 -4,-2.6 4,-2.3 1,-0.2 -1,-0.3 0.871 111.2 48.2 -60.9 -36.0 98.6 91.5 83.5 202 269 A L H < S+ 0 0 1 -4,-2.2 3,-1.8 -5,-0.3 -2,-0.2 0.940 105.8 49.2 -55.1 -48.8 111.1 95.4 75.5 212 279 A K H 3< S+ 0 0 98 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.791 105.9 57.2 -61.9 -30.3 109.8 96.0 72.0 213 280 A H T 3< S+ 0 0 42 -4,-1.5 -207,-0.4 -3,-0.3 2,-0.4 0.413 89.4 97.1 -81.6 2.0 110.8 99.7 72.2 214 281 A L < - 0 0 9 -3,-1.8 3,-0.2 -4,-0.3 -210,-0.1 -0.749 55.7-167.2 -92.6 137.1 114.4 98.5 73.0 215 282 A V S S+ 0 0 80 -2,-0.4 2,-1.0 1,-0.3 -1,-0.2 0.940 80.6 36.2 -87.2 -60.8 116.8 98.4 70.1 216 283 A H S S+ 0 0 135 -215,-0.0 -1,-0.3 0, 0.0 -60,-0.3 -0.807 82.9 149.4 -98.3 100.7 119.7 96.5 71.5 217 284 A K - 0 0 77 -2,-1.0 -62,-0.0 -3,-0.2 -6,-0.0 -0.748 50.6 -68.1-123.9 171.5 118.2 93.8 73.8 218 285 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 -0.170 55.3-102.3 -61.9 156.8 119.2 90.3 74.8 219 286 A A > - 0 0 70 1,-0.1 4,-1.8 4,-0.0 3,-0.3 -0.273 35.2-103.3 -71.4 163.3 119.2 87.4 72.3 220 287 A E H > S+ 0 0 76 1,-0.2 4,-2.8 2,-0.2 3,-0.3 0.926 120.3 55.7 -53.9 -49.7 116.3 84.9 72.3 221 288 A Q H > S+ 0 0 111 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.876 107.1 49.9 -53.3 -40.2 118.4 82.3 74.0 222 289 A R H > S+ 0 0 61 -3,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.871 110.9 49.4 -68.8 -34.9 119.2 84.6 76.9 223 290 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 -3,-0.3 5,-0.2 0.896 108.8 52.7 -70.3 -38.7 115.4 85.5 77.3 224 291 A R H X S+ 0 0 72 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.878 109.5 50.7 -63.0 -36.6 114.5 81.8 77.3 225 292 A E H X S+ 0 0 76 -4,-1.8 4,-2.9 -5,-0.2 5,-0.2 0.946 110.7 46.0 -66.5 -50.3 117.1 81.2 80.1 226 293 A I H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.950 117.9 44.0 -58.0 -49.0 115.8 84.0 82.3 227 294 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.912 114.0 49.4 -62.4 -46.0 112.2 82.9 81.8 228 295 A T H X S+ 0 0 33 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.897 108.2 54.1 -62.7 -39.5 113.0 79.2 82.2 229 296 A N H X S+ 0 0 78 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.938 110.2 46.8 -60.4 -44.6 114.9 79.9 85.4 230 297 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.920 109.9 54.8 -62.7 -42.9 111.9 81.7 86.8 231 298 A V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.925 109.4 45.9 -55.5 -49.7 109.6 78.9 85.7 232 299 A R H X S+ 0 0 113 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.925 111.6 51.3 -61.8 -46.2 111.6 76.2 87.6 233 300 A I H X S+ 0 0 18 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.912 111.9 47.8 -57.4 -44.2 111.8 78.3 90.7 234 301 A E H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.898 112.5 48.5 -65.3 -41.0 108.1 78.8 90.7 235 302 A Q H X S+ 0 0 15 -4,-2.4 4,-0.7 2,-0.2 5,-0.4 0.948 110.6 50.6 -64.7 -46.5 107.4 75.1 90.1 236 303 A E H >X>S+ 0 0 72 -4,-3.1 5,-1.6 1,-0.2 4,-1.6 0.893 109.7 53.7 -57.8 -37.9 109.8 74.2 92.9 237 304 A F H 3<>S+ 0 0 6 -4,-2.0 5,-2.8 -5,-0.2 -1,-0.2 0.945 115.1 36.7 -62.2 -49.1 107.9 76.6 95.1 238 305 A L H 3<5S+ 0 0 0 -4,-2.3 6,-1.6 3,-0.2 -1,-0.2 0.235 124.8 36.5 -93.1 14.6 104.4 75.1 94.4 239 306 A T H <<5S+ 0 0 22 -3,-0.7 -1,-0.2 -4,-0.7 -3,-0.2 0.442 132.1 17.8-135.0 -15.7 105.3 71.4 94.3 240 307 A E T <5S+ 0 0 123 -4,-1.6 -3,-0.2 -5,-0.4 -4,-0.1 0.648 128.5 35.0-120.3 -73.7 108.0 71.1 96.9 241 308 A A T - 0 0 37 0, 0.0 3,-1.7 0, 0.0 -4,-0.2 -0.171 15.7-138.7 -50.9 130.7 102.5 71.7 97.4 244 311 A V G > >S+ 0 0 0 -6,-1.6 3,-1.7 1,-0.3 5,-1.1 0.582 96.2 85.6 -66.7 -7.9 99.2 72.8 95.9 245 312 A K G > 5S+ 0 0 159 1,-0.3 3,-3.2 3,-0.2 -1,-0.3 0.886 71.7 73.5 -59.3 -37.9 98.1 69.4 97.0 246 313 A L G < 5S+ 0 0 44 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.712 105.7 35.5 -49.3 -24.9 97.4 71.0 100.4 247 314 A I G < 5S- 0 0 2 -3,-1.7 -1,-0.3 -4,-0.1 -2,-0.2 0.154 131.3 -88.6-116.8 17.2 94.4 72.7 98.8 248 315 A G T < 5S+ 0 0 51 -3,-3.2 2,-0.4 1,-0.2 -3,-0.2 0.908 79.5 139.0 80.6 45.8 93.4 69.8 96.6 249 316 A M < - 0 0 15 -5,-1.1 2,-0.6 -6,-0.0 -1,-0.2 -0.948 57.2-113.5-126.4 146.3 95.4 70.5 93.4 250 317 A N > - 0 0 90 -2,-0.4 4,-1.8 1,-0.2 3,-0.2 -0.632 19.3-151.9 -75.4 115.2 97.4 68.3 91.0 251 318 A C H > S+ 0 0 35 -2,-0.6 4,-1.6 1,-0.2 -1,-0.2 0.797 95.7 54.3 -58.0 -28.0 101.0 69.3 91.4 252 319 A T H > S+ 0 0 97 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.884 106.2 47.7 -75.8 -39.8 101.5 68.2 87.7 253 320 A L H > S+ 0 0 67 -3,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.819 111.1 54.0 -70.6 -28.4 98.8 70.3 86.2 254 321 A M H X S+ 0 0 1 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.910 104.9 52.8 -69.5 -42.6 100.1 73.3 88.2 255 322 A K H X S+ 0 0 85 -4,-1.6 4,-1.3 1,-0.2 -1,-0.2 0.869 110.2 49.6 -59.5 -37.6 103.6 72.8 86.8 256 323 A Q H X S+ 0 0 51 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.870 105.2 56.4 -69.8 -39.5 102.1 72.8 83.3 257 324 A Y H X S+ 0 0 26 -4,-1.8 4,-2.4 1,-0.2 5,-0.2 0.913 104.3 53.3 -59.4 -43.8 100.1 76.1 84.0 258 325 A I H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.916 109.6 48.1 -57.3 -44.7 103.3 77.9 84.9 259 326 A E H X S+ 0 0 33 -4,-1.3 4,-2.7 1,-0.2 16,-0.3 0.865 108.8 54.9 -65.0 -36.1 104.9 76.8 81.6 260 327 A F H X S+ 0 0 36 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.919 109.8 45.7 -62.6 -43.6 101.8 77.9 79.8 261 328 A V H X S+ 0 0 22 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.893 110.6 54.2 -65.6 -39.8 102.1 81.4 81.4 262 329 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.918 107.9 50.2 -59.1 -45.2 105.8 81.4 80.5 263 330 A D H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.885 106.2 55.2 -62.3 -39.1 104.8 80.7 76.9 264 331 A R H X S+ 0 0 98 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.914 108.0 50.0 -60.7 -42.0 102.3 83.5 76.9 265 332 A L H X S+ 0 0 11 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.946 107.1 53.4 -60.3 -50.4 105.2 85.9 78.0 266 333 A M H X>S+ 0 0 0 -4,-2.2 5,-2.9 1,-0.2 4,-0.6 0.911 110.6 47.2 -51.8 -46.5 107.5 84.7 75.2 267 334 A L H ><5S+ 0 0 75 -4,-2.1 3,-1.7 1,-0.2 -1,-0.2 0.947 110.8 50.8 -61.0 -49.1 104.8 85.4 72.6 268 335 A E H 3<5S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.806 108.8 53.7 -56.0 -32.2 104.1 88.9 74.1 269 336 A L H 3<5S- 0 0 6 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.609 124.7-107.1 -78.8 -15.2 107.9 89.4 73.9 270 337 A G T <<5S+ 0 0 54 -3,-1.7 -3,-0.2 -4,-0.6 2,-0.2 0.554 81.7 110.9 98.7 11.5 107.8 88.5 70.2 271 338 A F S