==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 16-MAR-13 4JNZ . COMPND 2 MOLECULE: BIFUNCTIONAL PROTEIN PUTA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.J.TANNER . 493 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23624.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 356 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 17 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 216 43.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.4 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 5 2 0 0 1 2 1 1 4 0 2 2 1 0 0 1 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 4 1 2 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 1 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 87 A P 0 0 182 0, 0.0 3,-0.1 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 127.3 16.2 17.2 57.9 2 88 A Q - 0 0 89 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.300 360.0 -92.7 -72.5 162.3 14.5 20.6 58.3 3 89 A S > - 0 0 57 1,-0.1 4,-2.6 -2,-0.0 5,-0.2 -0.236 44.8 -99.9 -62.3 165.2 12.2 21.4 61.2 4 90 A V H > S+ 0 0 136 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.897 124.4 43.8 -57.9 -40.0 8.5 20.7 60.5 5 91 A S H > S+ 0 0 21 2,-0.2 4,-1.4 1,-0.2 297,-0.2 0.901 113.4 48.8 -75.9 -40.3 7.8 24.4 59.8 6 92 A R H > S+ 0 0 19 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.874 110.4 52.7 -65.0 -36.6 10.9 25.0 57.6 7 93 A A H X S+ 0 0 43 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.844 105.5 54.4 -66.4 -33.3 10.1 21.9 55.6 8 94 A A H X S+ 0 0 37 -4,-1.2 4,-1.2 -5,-0.2 -1,-0.2 0.840 105.6 53.0 -71.3 -34.1 6.6 23.2 55.0 9 95 A I H >< S+ 0 0 0 -4,-1.4 3,-0.6 289,-0.2 4,-0.5 0.955 109.3 49.1 -60.6 -51.2 8.0 26.4 53.6 10 96 A T H >< S+ 0 0 60 -4,-1.9 3,-1.2 1,-0.2 4,-0.2 0.893 108.7 52.9 -56.1 -42.8 10.2 24.5 51.2 11 97 A A H 3< S+ 0 0 75 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.785 108.8 49.8 -67.4 -26.9 7.2 22.3 50.0 12 98 A A T X< S+ 0 0 0 -4,-1.2 3,-1.6 -3,-0.6 -1,-0.2 0.462 76.9 112.6 -89.7 -2.8 5.1 25.4 49.2 13 99 A Y T < S+ 0 0 43 -3,-1.2 281,-0.4 -4,-0.5 282,-0.3 0.827 97.2 5.4 -39.8 -59.0 7.8 27.2 47.1 14 100 A R T 3 S+ 0 0 55 -3,-0.3 -1,-0.3 -4,-0.2 325,-0.1 -0.243 86.0 170.6-126.0 43.3 6.1 27.0 43.7 15 101 A R < - 0 0 48 -3,-1.6 324,-0.2 1,-0.1 -3,-0.1 -0.236 47.9 -92.3 -52.2 135.8 2.7 25.4 44.6 16 102 A P > - 0 0 70 0, 0.0 4,-2.5 0, 0.0 5,-0.2 -0.236 33.4-126.1 -51.2 142.6 0.2 25.5 41.7 17 103 A E H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.862 107.5 57.8 -65.3 -37.3 -1.9 28.6 41.9 18 104 A T H > S+ 0 0 37 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.948 113.3 41.5 -55.3 -47.0 -5.2 26.8 41.8 19 105 A E H > S+ 0 0 91 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.923 115.6 47.4 -66.3 -48.4 -4.1 25.0 45.0 20 106 A A H X S+ 0 0 3 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.910 115.9 43.8 -66.0 -42.4 -2.5 27.9 46.8 21 107 A V H >X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 3,-0.6 0.922 110.5 55.1 -67.8 -45.0 -5.4 30.3 46.2 22 108 A S H 3X S+ 0 0 62 -4,-2.0 4,-0.5 -5,-0.4 3,-0.3 0.885 108.8 49.4 -55.5 -40.4 -8.1 27.7 47.0 23 109 A M H 3< S+ 0 0 89 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.758 111.2 49.0 -71.9 -24.9 -6.4 27.1 50.4 24 110 A L H > - 0 0 71 0, 0.0 4,-3.0 0, 0.0 3,-0.6 -0.342 39.9-101.9 -55.5 143.8 -17.3 37.6 58.1 32 118 A Q H 3> S+ 0 0 82 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.774 120.0 45.5 -39.5 -50.1 -20.3 39.5 56.7 33 119 A P H 3> S+ 0 0 94 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.925 117.3 44.8 -64.8 -42.6 -20.5 42.2 59.4 34 120 A V H <> S+ 0 0 40 -3,-0.6 4,-2.8 1,-0.2 -2,-0.2 0.903 112.6 52.3 -64.4 -42.8 -16.8 42.8 59.3 35 121 A A H X S+ 0 0 29 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.881 109.6 49.2 -60.4 -40.6 -16.8 42.8 55.5 36 122 A E H X S+ 0 0 56 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.889 113.2 45.7 -69.3 -40.2 -19.6 45.4 55.5 37 123 A Q H X S+ 0 0 110 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.879 111.3 53.3 -68.7 -39.1 -17.8 47.7 57.9 38 124 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.904 109.6 49.0 -60.9 -42.3 -14.5 47.2 55.9 39 125 A H H X S+ 0 0 76 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.938 110.7 48.9 -63.3 -47.7 -16.3 48.3 52.7 40 126 A K H X S+ 0 0 49 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.926 116.1 43.2 -60.2 -45.8 -17.9 51.4 54.3 41 127 A L H X S+ 0 0 14 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.931 114.0 50.4 -64.7 -46.1 -14.6 52.5 55.7 42 128 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.910 111.9 48.5 -58.5 -43.6 -12.6 51.7 52.6 43 129 A Y H X S+ 0 0 85 -4,-2.9 4,-2.3 -5,-0.2 -1,-0.2 0.917 111.7 49.2 -61.3 -46.2 -15.2 53.6 50.5 44 130 A Q H X S+ 0 0 114 -4,-2.1 4,-2.3 -5,-0.2 5,-0.2 0.916 112.5 47.2 -62.7 -45.5 -15.0 56.6 52.9 45 131 A L H X S+ 0 0 2 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.932 114.9 45.5 -59.7 -49.0 -11.2 56.7 52.8 46 132 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.839 111.4 53.9 -67.3 -32.3 -11.0 56.4 49.0 47 133 A D H X S+ 0 0 62 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.952 111.6 43.1 -66.5 -49.9 -13.7 59.0 48.6 48 134 A K H < S+ 0 0 49 -4,-2.3 4,-0.3 2,-0.2 -2,-0.2 0.857 116.1 50.8 -63.4 -35.4 -11.9 61.6 50.7 49 135 A L H >< S+ 0 0 41 -4,-2.0 3,-0.8 -5,-0.2 -2,-0.2 0.956 115.5 38.7 -68.0 -52.8 -8.6 60.7 49.0 50 136 A R H 3< S+ 0 0 21 -4,-2.5 5,-0.4 1,-0.2 -2,-0.2 0.860 120.7 46.4 -65.6 -35.4 -9.8 61.0 45.5 51 137 A N T >< S+ 0 0 40 -4,-2.2 3,-1.6 -5,-0.2 2,-0.3 0.112 71.1 123.7-112.2 21.6 -11.9 64.0 46.1 52 138 A Q G X S+ 0 0 64 -3,-0.8 3,-0.7 -4,-0.3 -3,-0.0 -0.637 89.2 20.8 -66.1 138.4 -9.7 66.3 48.1 53 139 A K G 3 S- 0 0 148 -2,-0.3 -1,-0.3 1,-0.2 5,-0.1 0.680 129.3 -87.3 61.3 18.7 -9.7 69.5 46.0 54 140 A N G <> S+ 0 0 90 -3,-1.6 4,-2.8 3,-0.1 5,-0.2 0.788 70.4 162.8 62.6 37.8 -12.9 68.3 44.5 55 141 A A H <> S+ 0 0 39 -3,-0.7 4,-2.6 -5,-0.4 5,-0.2 0.933 74.7 37.8 -56.0 -57.2 -11.4 66.2 41.6 56 142 A S H > S+ 0 0 36 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.903 117.4 52.2 -63.3 -42.3 -14.4 64.1 40.7 57 143 A G H > S+ 0 0 37 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.886 112.9 44.7 -60.1 -40.5 -16.8 67.0 41.2 58 144 A R H X S+ 0 0 170 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.906 111.9 51.5 -70.3 -42.3 -14.7 69.2 39.0 59 145 A A H X S+ 0 0 40 -4,-2.6 4,-1.5 -5,-0.2 -2,-0.2 0.824 108.6 55.2 -62.2 -31.7 -14.4 66.4 36.3 60 146 A G H X S+ 0 0 42 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.933 105.9 47.1 -66.5 -50.5 -18.2 66.1 36.5 61 147 A M H X S+ 0 0 74 -4,-1.8 4,-1.5 1,-0.2 5,-0.2 0.888 110.6 55.0 -57.6 -40.7 -18.9 69.7 35.7 62 148 A V H X S+ 0 0 101 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.864 109.3 46.6 -61.9 -38.5 -16.4 69.5 32.9 63 149 A Q H X S+ 0 0 55 -4,-1.5 4,-1.6 2,-0.2 5,-0.2 0.937 106.7 58.5 -66.7 -47.2 -18.3 66.5 31.4 64 150 A G H X S+ 0 0 44 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.775 112.7 38.4 -57.6 -33.8 -21.7 68.2 31.8 65 151 A L H X S+ 0 0 56 -4,-1.5 4,-0.9 2,-0.2 6,-0.4 0.930 115.4 52.2 -76.7 -53.5 -20.7 71.1 29.6 66 152 A L H < S+ 0 0 34 -4,-2.0 5,-0.3 -5,-0.2 -2,-0.2 0.633 117.3 42.4 -57.7 -15.5 -18.7 69.0 27.2 67 153 A Q H >< S+ 0 0 71 -4,-1.6 3,-1.4 3,-0.2 -1,-0.2 0.866 111.7 52.2 -92.0 -53.6 -21.9 66.8 27.0 68 154 A E H 3< S+ 0 0 82 -4,-2.0 2,-1.2 1,-0.3 -3,-0.1 0.950 113.6 36.7 -48.0 -80.4 -24.6 69.6 26.8 69 155 A F T 3< S- 0 0 88 -4,-0.9 -1,-0.3 1,-0.1 -3,-0.1 0.085 113.6-115.0 -67.4 29.9 -23.4 71.8 23.9 70 156 A S < + 0 0 92 -3,-1.4 2,-0.2 -2,-1.2 -3,-0.2 0.824 62.4 161.1 35.9 51.5 -22.2 68.6 22.2 71 157 A L - 0 0 40 -6,-0.4 -1,-0.1 -5,-0.3 2,-0.1 -0.622 35.3-132.7 -99.3 156.0 -18.6 69.8 22.5 72 158 A S > - 0 0 74 -2,-0.2 4,-1.7 1,-0.1 -1,-0.1 -0.302 34.8 -96.0 -88.6-176.5 -15.4 67.8 22.3 73 159 A S H >> S+ 0 0 82 2,-0.2 4,-1.5 1,-0.2 3,-1.4 0.996 121.3 47.0 -59.8 -78.0 -12.4 68.1 24.6 74 160 A Q H 3> S+ 0 0 75 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.712 111.4 55.6 -40.9 -31.9 -10.2 70.6 22.8 75 161 A E H 3> S+ 0 0 42 2,-0.2 4,-2.8 3,-0.2 -1,-0.3 0.955 104.9 51.8 -62.7 -52.9 -13.3 72.7 22.2 76 162 A G H < S+ 0 0 33 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.832 106.0 56.9 -72.7 -32.2 -13.5 87.4 29.6 87 173 A L H 3< S+ 0 0 122 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.696 96.9 64.6 -73.1 -17.1 -13.2 87.1 33.4 88 174 A R T 3< S+ 0 0 178 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.451 73.7 105.0 -85.4 -3.0 -10.1 89.3 33.3 89 175 A I < - 0 0 32 -3,-1.3 6,-0.1 1,-0.1 -3,-0.0 -0.759 69.4-146.9 -77.6 114.8 -12.1 92.2 32.1 90 176 A P S S+ 0 0 116 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.807 76.9 56.1 -57.2 -42.5 -12.3 94.3 35.2 91 177 A D > - 0 0 106 1,-0.1 4,-2.0 -3,-0.1 5,-0.1 -0.852 69.1-149.9-105.6 127.6 -15.7 95.9 34.7 92 178 A K H > S+ 0 0 122 -2,-0.5 4,-3.1 1,-0.2 5,-0.2 0.812 96.8 55.2 -63.7 -35.8 -18.8 93.6 34.2 93 179 A A H > S+ 0 0 77 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.931 109.2 47.6 -62.3 -47.1 -20.7 96.1 32.0 94 180 A T H > S+ 0 0 85 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.900 114.6 48.2 -58.4 -42.2 -17.7 96.3 29.7 95 181 A R H X S+ 0 0 45 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.928 112.3 46.0 -65.6 -48.8 -17.5 92.5 29.7 96 182 A D H X S+ 0 0 67 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.895 113.5 49.6 -63.1 -41.9 -21.3 91.9 29.1 97 183 A A H X S+ 0 0 48 -4,-2.5 4,-0.7 -5,-0.2 -1,-0.2 0.847 110.1 51.8 -66.0 -36.2 -21.3 94.5 26.3 98 184 A L H >< S+ 0 0 103 -4,-1.8 3,-0.7 -5,-0.2 -2,-0.2 0.931 110.7 47.6 -64.0 -47.9 -18.3 92.9 24.6 99 185 A I H 3< S+ 0 0 102 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.915 115.1 45.0 -56.1 -47.1 -19.9 89.4 24.7 100 186 A R H 3< 0 0 79 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.482 360.0 360.0 -84.9 -4.5 -23.2 90.7 23.3 101 187 A D << 0 0 167 -4,-0.7 -3,-0.0 -3,-0.7 -4,-0.0 -0.458 360.0 360.0-123.7 360.0 -21.7 92.9 20.5 102 ! 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 0.0 103 204 A L 0 0 188 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -33.6 6.1 56.9 24.3 104 205 A F > + 0 0 84 1,-0.2 3,-0.8 2,-0.1 4,-0.2 -0.228 360.0 124.2-110.9 39.6 5.0 60.5 24.6 105 206 A V T > S+ 0 0 126 1,-0.2 3,-0.6 2,-0.1 -1,-0.2 0.990 80.1 34.1 -60.3 -63.8 2.0 59.8 26.8 106 207 A N T 3> S+ 0 0 98 1,-0.2 4,-2.2 -3,-0.2 5,-0.2 0.030 78.2 123.2 -86.0 27.3 2.9 62.1 29.7 107 208 A A H <> S+ 0 0 54 -3,-0.8 4,-0.5 1,-0.2 -1,-0.2 0.801 72.4 58.7 -58.6 -29.9 4.5 64.7 27.5 108 209 A A H X> S+ 0 0 83 -3,-0.6 3,-1.6 2,-0.2 4,-1.1 0.979 106.2 44.5 -59.8 -59.4 2.1 67.2 29.0 109 210 A T H 34 S+ 0 0 99 1,-0.3 3,-0.3 2,-0.2 4,-0.2 0.873 112.3 52.7 -55.2 -41.2 3.3 66.6 32.6 110 211 A W H >< S+ 0 0 91 -4,-2.2 3,-0.5 1,-0.2 4,-0.3 0.661 101.7 65.8 -66.8 -16.4 6.9 66.8 31.4 111 212 A G H X< S+ 0 0 37 -3,-1.6 3,-2.6 -4,-0.5 -2,-0.2 0.920 84.6 65.8 -72.2 -45.9 5.9 70.1 29.8 112 213 A L T 3< S+ 0 0 99 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.603 98.2 60.3 -53.2 -12.5 5.3 72.0 33.1 113 214 A L T < 0 0 105 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.2 0.713 360.0 360.0 -86.5 -26.4 9.0 71.5 33.7 114 215 A F < 0 0 196 -3,-2.6 -1,-0.2 -4,-0.3 -2,-0.2 -0.032 360.0 360.0-101.3 360.0 10.1 73.4 30.6 115 ! 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 0.0 116 226 A A > 0 0 111 0, 0.0 4,-1.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -76.7 4.4 62.7 15.9 117 227 A S H > + 0 0 90 2,-0.2 4,-1.2 1,-0.2 5,-0.0 0.760 360.0 52.0 -68.3 -26.1 6.2 66.0 15.9 118 228 A L H > S+ 0 0 38 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.903 103.0 54.8 -75.3 -46.4 7.8 64.5 19.0 119 229 A S H > S+ 0 0 39 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.939 111.7 43.7 -53.1 -54.2 8.9 61.2 17.4 120 230 A R H X S+ 0 0 63 -4,-1.5 4,-1.5 1,-0.2 -1,-0.2 0.895 111.0 55.9 -58.0 -42.4 10.8 63.0 14.6 121 231 A S H X S+ 0 0 67 -4,-1.2 4,-0.9 1,-0.2 -1,-0.2 0.831 110.1 46.3 -59.9 -33.7 12.2 65.4 17.2 122 232 A L H X S+ 0 0 48 -4,-2.1 4,-1.5 -3,-0.3 -2,-0.2 0.898 104.2 60.9 -73.5 -43.5 13.6 62.4 19.1 123 233 A N H < S+ 0 0 129 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.815 100.9 58.2 -53.8 -34.8 15.0 60.7 16.0 124 234 A R H < S+ 0 0 80 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.991 107.1 38.1 -58.4 -70.7 17.3 63.7 15.4 125 235 A I H < 0 0 70 -4,-0.9 4,-0.2 4,-0.0 -1,-0.2 0.725 360.0 360.0 -65.9 -25.9 19.4 64.0 18.6 126 236 A I < 0 0 89 -4,-1.5 0, 0.0 3,-0.1 0, 0.0 -0.641 360.0 360.0 -73.3 360.0 19.7 60.2 19.0 127 ! 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 0.0 128 242 A P > 0 0 144 0, 0.0 4,-0.7 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 -39.8 25.0 59.1 24.9 129 243 A L H > + 0 0 91 -4,-0.2 4,-1.8 2,-0.2 5,-0.1 0.575 360.0 63.6 -84.7 -15.0 22.4 61.8 25.4 130 244 A I H > S+ 0 0 103 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.915 99.3 49.7 -68.0 -46.6 20.2 58.8 26.2 131 245 A R H > S+ 0 0 69 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.854 114.3 46.1 -60.6 -34.9 22.4 58.0 29.2 132 246 A K H X S+ 0 0 62 -4,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.818 111.4 51.4 -77.8 -33.5 22.1 61.6 30.3 133 247 A G H X S+ 0 0 37 -4,-1.8 4,-2.9 2,-0.2 5,-0.3 0.949 110.1 49.6 -64.3 -49.5 18.4 61.6 29.7 134 248 A V H X S+ 0 0 90 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.883 111.8 47.5 -56.1 -44.9 17.9 58.5 31.8 135 249 A D H X S+ 0 0 64 -4,-1.6 4,-1.8 -5,-0.2 -1,-0.2 0.896 115.0 46.0 -66.6 -40.1 20.0 59.8 34.7 136 250 A M H X S+ 0 0 106 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.911 111.6 49.1 -71.1 -44.0 18.1 63.1 34.7 137 251 A A H X S+ 0 0 27 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.850 109.1 56.5 -63.5 -33.6 14.6 61.7 34.4 138 252 A M H X S+ 0 0 13 -4,-1.7 4,-2.3 -5,-0.3 -2,-0.2 0.933 110.5 42.3 -59.7 -49.6 15.6 59.3 37.3 139 253 A R H X S+ 0 0 103 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.913 114.6 50.4 -65.2 -45.2 16.5 62.3 39.6 140 254 A L H < S+ 0 0 69 -4,-2.6 4,-0.4 1,-0.2 -2,-0.2 0.934 119.9 35.2 -60.3 -48.3 13.5 64.3 38.6 141 255 A M H < S+ 0 0 55 -4,-2.5 3,-0.4 -5,-0.2 -1,-0.2 0.802 117.0 54.1 -75.8 -28.6 11.0 61.5 39.2 142 256 A G H >< S+ 0 0 0 -4,-2.3 3,-1.6 -5,-0.3 4,-0.5 0.700 85.5 82.2 -83.3 -19.6 12.9 60.0 42.2 143 257 A E G >< S+ 0 0 146 -4,-1.5 3,-1.6 1,-0.3 -1,-0.2 0.870 84.5 58.8 -52.8 -42.8 13.0 63.2 44.2 144 258 A Q G 3 S+ 0 0 114 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.1 0.721 105.8 51.4 -63.6 -18.9 9.5 62.8 45.6 145 259 A F G < S+ 0 0 8 -3,-1.6 2,-0.4 -4,-0.2 -1,-0.3 0.502 94.4 84.1 -97.3 -5.5 10.5 59.4 47.1 146 260 A V < - 0 0 28 -3,-1.6 283,-0.2 -4,-0.5 3,-0.1 -0.838 53.4-166.7-105.7 135.6 13.6 60.6 49.0 147 261 A T S S- 0 0 27 281,-2.8 2,-0.3 -2,-0.4 282,-0.2 0.740 70.4 -21.9 -91.3 -25.6 13.5 62.1 52.4 148 262 A G B -a 429 0A 3 280,-0.8 282,-2.3 282,-0.1 -1,-0.3 -0.951 49.0-119.5-174.7 161.1 17.1 63.5 52.5 149 263 A E S S+ 0 0 108 -2,-0.3 2,-0.3 280,-0.2 282,-0.2 0.774 102.6 26.4 -78.7 -29.2 20.5 63.1 51.0 150 264 A T S > S- 0 0 70 280,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.903 83.6-114.7-132.6 160.0 22.1 62.3 54.4 151 265 A I H > S+ 0 0 4 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.875 115.4 56.3 -67.6 -34.3 20.7 60.8 57.6 152 266 A A H > S+ 0 0 67 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.926 109.7 46.5 -60.5 -43.9 21.2 64.0 59.5 153 267 A E H 4 S+ 0 0 88 2,-0.2 4,-0.4 1,-0.2 -2,-0.2 0.930 113.3 47.7 -63.3 -49.0 19.0 65.9 57.0 154 268 A A H >< S+ 0 0 3 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.918 113.5 48.4 -57.9 -44.5 16.3 63.2 57.0 155 269 A L H >< S+ 0 0 29 -4,-2.8 3,-1.7 1,-0.3 4,-0.3 0.845 103.2 60.2 -67.9 -35.0 16.2 63.1 60.8 156 270 A A T 3< S+ 0 0 86 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.535 104.5 52.4 -71.4 -5.3 16.0 66.9 61.1 157 271 A N T < S+ 0 0 101 -3,-1.1 4,-0.4 -4,-0.4 -1,-0.3 0.246 87.3 87.8-107.0 8.8 12.8 66.8 59.1 158 272 A A <> + 0 0 4 -3,-1.7 4,-2.2 1,-0.2 3,-0.5 0.784 67.3 73.6 -83.4 -29.0 11.2 64.2 61.4 159 273 A R H > S+ 0 0 54 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.862 85.2 64.2 -57.0 -44.9 9.5 66.4 64.1 160 274 A K H 4 S+ 0 0 71 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.865 117.0 25.2 -50.2 -49.3 6.6 67.7 61.9 161 275 A L H >4>S+ 0 0 38 -3,-0.5 5,-2.6 -4,-0.4 3,-0.9 0.798 116.4 62.1 -89.5 -30.1 5.0 64.3 61.4 162 276 A E H ><5S+ 0 0 36 -4,-2.2 3,-1.0 1,-0.3 -2,-0.2 0.855 101.9 53.6 -63.1 -32.9 6.3 62.6 64.6 163 277 A E T 3<5S+ 0 0 172 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.674 104.6 56.2 -74.3 -15.6 4.5 65.2 66.6 164 278 A K T < 5S- 0 0 127 -3,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.482 131.7 -94.6 -89.4 -6.2 1.4 64.2 64.7 165 279 A G T < 5S+ 0 0 35 -3,-1.0 258,-0.5 -4,-0.4 -3,-0.2 0.482 81.9 134.8 105.9 5.5 1.9 60.6 65.8 166 280 A F < - 0 0 11 -5,-2.6 -1,-0.3 256,-0.2 2,-0.3 -0.466 37.5-155.3 -80.3 157.5 3.8 59.3 62.8 167 281 A R E -b 424 0A 29 256,-2.5 258,-3.3 -2,-0.1 2,-0.3 -0.784 7.5-137.6-122.6 173.7 6.9 57.1 63.2 168 282 A Y E -b 425 0A 17 256,-0.3 43,-2.1 -2,-0.3 2,-0.4 -0.967 15.5-167.5-135.0 151.5 9.8 56.5 60.8 169 283 A S E -bc 426 211A 4 256,-2.5 258,-3.3 -2,-0.3 2,-0.3 -0.979 26.0-145.4-131.0 121.9 12.0 53.8 59.5 170 284 A Y E -bc 427 212A 2 41,-2.5 43,-2.8 -2,-0.4 2,-0.5 -0.698 10.4-164.4 -95.6 140.8 15.1 55.0 57.6 171 285 A D E -bc 428 213A 2 256,-2.5 258,-3.1 -2,-0.3 2,-1.1 -0.972 15.2-145.9-124.3 115.2 16.7 53.3 54.6 172 286 A M E -b 429 0A 16 41,-0.5 258,-0.2 -2,-0.5 18,-0.1 -0.734 38.2-123.1 -78.2 105.1 20.2 54.2 53.5 173 287 A L + 0 0 9 256,-2.3 258,-0.1 -2,-1.1 262,-0.1 -0.089 67.8 83.2 -54.9 148.2 19.6 53.7 49.8 174 288 A G + 0 0 6 260,-0.2 2,-0.3 261,-0.1 44,-0.1 -0.231 44.5 179.9 126.1 140.8 21.8 51.3 47.8 175 289 A E + 0 0 39 1,-0.2 3,-0.1 -2,-0.1 43,-0.1 -0.938 49.1 46.7-158.5 174.8 21.6 47.5 47.4 176 290 A A - 0 0 52 -2,-0.3 42,-0.2 1,-0.1 -1,-0.2 0.918 69.7-146.8 46.7 61.0 23.3 44.5 45.7 177 291 A A - 0 0 2 40,-2.0 45,-2.7 43,-0.2 46,-0.5 -0.343 12.1-165.4 -54.4 130.9 26.9 45.3 46.7 178 292 A L + 0 0 111 43,-0.2 2,-0.3 44,-0.1 -1,-0.1 0.729 63.9 33.6 -93.9 -28.1 29.1 44.0 43.9 179 293 A T S > S- 0 0 68 1,-0.1 4,-2.1 42,-0.1 5,-0.2 -0.825 81.4-110.4-127.2 165.7 32.5 44.1 45.6 180 294 A A H > S+ 0 0 71 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.892 120.7 53.7 -59.6 -39.3 34.0 43.6 49.1 181 295 A A H > S+ 0 0 71 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 106.3 51.0 -62.7 -42.7 34.7 47.3 49.2 182 296 A D H > S+ 0 0 70 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.921 111.0 48.5 -59.5 -46.2 31.1 48.2 48.4 183 297 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.912 109.8 51.6 -63.7 -43.4 29.8 45.9 51.2 184 298 A Q H X S+ 0 0 82 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.905 109.5 50.8 -59.3 -41.8 32.2 47.4 53.7 185 299 A A H X S+ 0 0 62 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.889 109.0 50.4 -65.5 -39.8 31.0 50.9 52.7 186 300 A Y H X S+ 0 0 55 -4,-2.2 4,-2.7 32,-0.3 -1,-0.2 0.906 108.6 53.8 -61.7 -41.0 27.4 49.9 53.2 187 301 A M H X S+ 0 0 10 -4,-2.4 4,-2.5 31,-0.2 -2,-0.2 0.930 110.3 45.9 -57.2 -46.9 28.3 48.5 56.6 188 302 A V H X S+ 0 0 73 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.903 111.6 51.9 -65.8 -42.3 29.9 51.8 57.7 189 303 A S H X S+ 0 0 32 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.918 111.1 47.7 -59.0 -44.6 26.9 53.8 56.3 190 304 A Y H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.917 112.2 49.0 -62.1 -45.3 24.5 51.6 58.3 191 305 A Q H X S+ 0 0 62 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.945 112.5 47.9 -58.6 -50.3 26.6 51.9 61.5 192 306 A Q H X S+ 0 0 99 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.914 112.7 50.2 -52.4 -47.8 26.7 55.7 61.1 193 307 A A H X S+ 0 0 0 -4,-2.5 4,-3.1 -5,-0.2 5,-0.3 0.896 107.2 52.3 -62.0 -43.3 23.0 55.7 60.5 194 308 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.915 108.9 50.9 -62.5 -40.5 22.2 53.7 63.6 195 309 A H H X S+ 0 0 72 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.923 114.7 43.8 -60.0 -45.8 24.2 56.1 65.8 196 310 A A H X S+ 0 0 27 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.926 117.2 43.0 -66.8 -49.4 22.4 59.1 64.3 197 311 A I H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.882 114.2 53.0 -63.8 -38.8 18.8 57.5 64.5 198 312 A G H X S+ 0 0 2 -4,-2.6 4,-1.8 -5,-0.3 5,-0.4 0.871 109.7 47.1 -65.7 -39.5 19.6 56.2 67.9 199 313 A K H < S+ 0 0 145 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.871 114.1 47.8 -69.2 -38.6 20.7 59.6 69.3 200 314 A A H < S+ 0 0 41 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.906 108.2 55.1 -66.4 -42.1 17.6 61.2 67.7 201 315 A S H >< S- 0 0 0 -4,-2.8 3,-1.4 -5,-0.2 -2,-0.2 0.905 84.7-172.4 -56.7 -45.1 15.4 58.5 69.2 202 316 A N T 3< S- 0 0 138 -4,-1.8 -3,-0.1 1,-0.3 -4,-0.1 0.847 70.3 -42.8 55.3 42.7 16.8 59.3 72.6 203 317 A G T 3 S+ 0 0 62 46,-0.5 -1,-0.3 -5,-0.4 3,-0.1 0.479 98.3 130.1 87.9 1.8 15.2 56.4 74.5 204 318 A R <> - 0 0 101 -3,-1.4 4,-0.6 1,-0.2 5,-0.3 0.737 63.1-138.3 -61.1 -23.2 11.7 56.6 72.9 205 319 A G H > - 0 0 8 44,-0.3 4,-1.4 45,-0.2 47,-0.3 -0.152 26.9 -55.5 93.1 177.2 12.0 52.9 72.2 206 320 A I H 4 S+ 0 0 19 45,-0.2 46,-0.2 1,-0.1 -1,-0.2 0.693 128.0 41.3 -73.0 -19.8 11.2 50.5 69.4 207 321 A Y H 4 S+ 0 0 67 -3,-0.3 -1,-0.1 44,-0.1 -2,-0.1 0.932 126.1 24.3 -92.1 -59.8 7.5 51.4 69.0 208 322 A E H < S+ 0 0 53 -4,-0.6 -3,-0.2 -41,-0.1 -2,-0.1 0.813 114.6 73.4 -77.0 -29.9 7.3 55.2 69.3 209 323 A G S < S- 0 0 0 -4,-1.4 43,-0.2 -5,-0.3 -8,-0.1 -0.359 90.6 -90.9 -89.8 165.3 10.8 55.9 68.2 210 324 A P - 0 0 0 0, 0.0 42,-0.4 0, 0.0 2,-0.2 -0.270 40.6-168.3 -70.4 158.8 12.4 55.7 64.8 211 325 A G E -c 169 0A 4 -43,-2.1 -41,-2.5 40,-0.2 2,-0.3 -0.710 16.7-114.6-131.5-174.5 14.1 52.6 63.4 212 326 A I E -cd 170 253A 1 40,-2.4 42,-2.8 -43,-0.3 2,-0.4 -0.922 12.9-149.4-124.1 150.4 16.3 51.5 60.5 213 327 A S E -cd 171 254A 0 -43,-2.8 -41,-0.5 -2,-0.3 2,-0.3 -0.986 19.8-168.9-117.5 131.1 15.7 49.2 57.6 214 328 A I E - d 0 255A 0 40,-3.2 42,-2.8 -2,-0.4 2,-0.5 -0.837 17.0-137.8-120.5 156.7 18.6 47.2 56.2 215 329 A K >> - 0 0 3 -2,-0.3 3,-1.4 40,-0.2 4,-0.5 -0.964 5.6-151.6-111.7 124.0 19.2 45.1 53.1 216 330 A L G >4 S+ 0 0 3 -2,-0.5 3,-1.3 40,-0.4 4,-0.5 0.852 97.9 64.1 -58.7 -31.9 21.2 41.9 53.4 217 331 A S G 34 S+ 0 0 4 1,-0.3 -40,-2.0 2,-0.2 6,-0.4 0.717 97.4 56.5 -65.9 -19.8 22.3 42.3 49.8 218 332 A A G <4 S+ 0 0 0 -3,-1.4 -32,-0.3 -42,-0.2 -1,-0.3 0.694 104.6 52.6 -80.9 -19.0 24.1 45.5 50.8 219 333 A L S << S+ 0 0 0 -3,-1.3 -2,-0.2 -4,-0.5 -1,-0.2 0.427 107.9 47.0-104.0 0.5 26.2 43.7 53.4 220 334 A H S > S- 0 0 9 -4,-0.5 3,-1.0 -3,-0.3 -43,-0.2 -0.981 85.5-115.6-144.2 129.2 27.6 40.9 51.3 221 335 A P T 3 S+ 0 0 27 0, 0.0 -43,-0.2 0, 0.0 -41,-0.1 -0.403 97.9 1.3 -66.6 136.7 29.2 41.1 47.9 222 336 A R T > S+ 0 0 153 -45,-2.7 3,-1.5 -5,-0.1 4,-0.3 0.886 77.3 168.5 56.1 42.9 27.3 39.3 45.1 223 337 A Y G X + 0 0 5 -3,-1.0 3,-1.4 -46,-0.5 -1,-0.1 0.824 62.7 75.6 -53.4 -35.8 24.7 38.2 47.6 224 338 A S G 3 S+ 0 0 69 1,-0.3 -1,-0.3 -7,-0.1 -2,-0.1 0.778 113.8 19.4 -52.5 -32.9 22.5 37.1 44.7 225 339 A R G < S+ 0 0 214 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.174 92.4 138.0-122.6 16.7 24.6 34.0 44.2 226 340 A A < - 0 0 18 -3,-1.4 2,-0.2 -4,-0.3 -4,-0.1 -0.383 48.9-126.6 -69.7 140.5 26.3 33.7 47.6 227 341 A Q > - 0 0 64 -2,-0.1 4,-2.1 1,-0.1 3,-0.3 -0.507 21.1-110.7 -86.0 155.6 26.6 30.3 49.2 228 342 A Y H > S+ 0 0 127 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.883 112.3 53.3 -49.3 -51.1 25.5 29.5 52.8 229 343 A D H > S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.893 112.3 42.5 -59.1 -45.1 29.0 29.0 54.3 230 344 A R H >>S+ 0 0 33 -3,-0.3 4,-2.3 2,-0.2 5,-0.6 0.874 112.4 54.8 -70.8 -37.2 30.4 32.4 53.1 231 345 A V H X>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 4,-1.2 0.919 111.6 44.3 -61.2 -43.7 27.2 34.2 54.1 232 346 A M H <5S+ 0 0 26 -4,-2.5 -2,-0.2 3,-0.2 -1,-0.2 0.885 116.2 46.7 -67.8 -38.6 27.4 32.8 57.6 233 347 A E H <5S+ 0 0 69 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.835 131.6 14.6 -73.9 -31.4 31.1 33.6 58.0 234 348 A E H X5S+ 0 0 97 -4,-2.3 4,-0.7 -5,-0.1 -3,-0.2 0.818 128.2 40.4-115.5 -46.6 31.0 37.1 56.6 235 349 A L H >X S+ 0 0 65 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.870 112.3 49.7 -61.5 -29.0 28.8 38.8 62.0 238 352 A R H S+ 0 0 0 -4,-2.3 5,-2.1 1,-0.2 4,-0.5 0.910 109.4 52.0 -58.3 -41.7 20.4 49.0 67.4 247 361 A R H ><5S+ 0 0 91 -4,-2.2 3,-0.8 1,-0.2 -2,-0.2 0.878 101.7 58.7 -65.9 -38.0 19.7 47.4 70.8 248 362 A Q H 3<5S+ 0 0 101 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.866 115.4 36.5 -57.7 -35.6 22.1 49.7 72.6 249 363 A Y H 3<5S- 0 0 58 -4,-1.4 -46,-0.5 -3,-0.3 -44,-0.3 0.446 110.2-126.1 -93.5 -2.4 20.0 52.6 71.4 250 364 A D T <<5 + 0 0 64 -3,-0.8 2,-0.3 -4,-0.5 -3,-0.2 0.924 60.6 139.7 52.9 51.4 16.8 50.6 71.7 251 365 A I < - 0 0 0 -5,-2.1 -1,-0.2 -6,-0.1 -40,-0.2 -0.888 57.5-101.0-117.9 154.4 15.6 51.2 68.1 252 366 A G - 0 0 15 -42,-0.4 -40,-2.4 -2,-0.3 2,-0.5 -0.457 29.3-160.6 -71.2 142.8 14.0 48.8 65.8 253 367 A I E -de 212 285A 3 31,-2.6 33,-3.0 -42,-0.2 2,-0.4 -0.964 9.9-163.7-128.1 116.4 16.1 47.2 63.1 254 368 A N E -de 213 286A 10 -42,-2.8 -40,-3.2 -2,-0.5 2,-0.8 -0.842 14.7-144.6-109.1 131.6 14.3 45.7 60.2 255 369 A I E -de 214 287A 3 31,-2.1 33,-2.0 -2,-0.4 -40,-0.2 -0.840 25.6-138.6 -93.9 108.1 15.6 43.2 57.6 256 370 A N - 0 0 22 -42,-2.8 2,-0.4 -2,-0.8 -40,-0.4 -0.264 13.6-122.2 -62.2 152.5 14.0 44.1 54.2 257 371 A A + 0 0 22 -42,-0.1 65,-0.2 1,-0.1 3,-0.1 -0.826 37.7 169.3-100.1 136.1 12.8 41.3 52.0 258 372 A E - 0 0 12 -2,-0.4 65,-0.2 1,-0.4 64,-0.1 0.020 45.6 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53.8 -71.8 -34.9 4.2 29.0 55.8 299 413 A V H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.896 105.6 55.6 -64.8 -36.0 6.8 31.6 56.7 300 414 A I H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.928 104.6 51.1 -63.1 -42.6 4.4 32.9 59.3 301 415 A D H X S+ 0 0 67 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.898 111.7 48.9 -60.2 -40.8 4.0 29.5 60.9 302 416 A Y H X S+ 0 0 0 -4,-1.8 4,-2.5 -297,-0.2 -2,-0.2 0.926 111.1 49.2 -60.9 -46.2 7.8 29.3 61.1 303 417 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.874 107.7 54.1 -64.5 -38.4 8.1 32.9 62.6 304 418 A I H X S+ 0 0 37 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.930 112.0 44.5 -60.8 -45.0 5.4 32.1 65.2 305 419 A D H X S+ 0 0 65 -4,-1.8 4,-2.9 -5,-0.2 -2,-0.2 0.879 112.2 53.1 -66.9 -38.3 7.5 29.0 66.3 306 420 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.913 107.7 50.2 -63.9 -43.8 10.7 31.1 66.2 307 421 A A H X>S+ 0 0 1 -4,-2.8 5,-1.9 2,-0.2 4,-0.6 0.899 113.3 47.7 -59.1 -40.8 9.3 33.8 68.5 308 422 A T H ><5S+ 0 0 81 -4,-1.8 3,-0.8 -5,-0.2 -2,-0.2 0.967 115.3 43.0 -64.6 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23.3-146.2-104.6 143.8 6.2 30.7 39.9 340 454 A P S S+ 0 0 7 0, 0.0 -46,-1.8 0, 0.0 -45,-0.5 0.554 88.8 50.9 -81.6 -5.9 7.2 31.5 43.5 341 455 A V B S-J 293 0B 0 -48,-0.2 -48,-0.2 -47,-0.1 -2,-0.1 -0.845 96.6 -95.4-124.0 161.2 4.7 34.4 43.3 342 456 A Y - 0 0 2 -50,-2.0 3,-0.1 -2,-0.3 -1,-0.0 -0.345 22.8-148.8 -67.7 159.3 1.0 34.8 42.3 343 457 A T S S+ 0 0 2 1,-0.1 2,-0.4 -4,-0.1 -1,-0.1 0.515 79.0 63.4-111.9 -10.8 0.3 35.9 38.8 344 458 A R S >> S- 0 0 30 1,-0.1 4,-1.1 144,-0.1 3,-1.1 -0.969 76.5-139.2-113.1 134.8 -3.0 37.7 39.4 345 459 A K H 3> S+ 0 0 68 -2,-0.4 4,-1.8 1,-0.3 3,-0.3 0.856 100.8 60.7 -61.3 -36.7 -2.9 40.8 41.6 346 460 A V H 3> S+ 0 0 29 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.793 99.3 57.5 -63.8 -27.0 -6.2 39.9 43.4 347 461 A Y H <> S+ 0 0 0 -3,-1.1 4,-2.8 2,-0.2 -1,-0.2 0.895 104.1 51.3 -68.8 -39.4 -4.6 36.7 44.6 348 462 A T H X S+ 0 0 11 -4,-1.1 4,-2.5 -3,-0.3 -2,-0.2 0.898 108.5 52.8 -61.9 -37.9 -1.8 38.7 46.3 349 463 A D H X S+ 0 0 17 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.911 110.0 47.3 -61.6 -44.9 -4.6 40.7 47.9 350 464 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.928 111.2 51.2 -61.8 -46.4 -6.2 37.5 49.2 351 465 A S H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.908 107.6 53.6 -56.6 -43.2 -2.9 36.2 50.5 352 466 A Y H X S+ 0 0 1 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.922 110.1 46.5 -62.0 -43.1 -2.3 39.5 52.3 353 467 A L H X S+ 0 0 2 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.901 112.9 48.4 -67.8 -40.4 -5.6 39.3 54.2 354 468 A A H X S+ 0 0 1 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.914 114.3 47.4 -63.9 -41.0 -5.2 35.6 55.1 355 469 A C H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -2,-0.2 0.859 107.5 55.9 -68.7 -34.3 -1.7 36.4 56.4 356 470 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.907 106.0 51.1 -63.9 -42.0 -2.9 39.5 58.3 357 471 A K H X S+ 0 0 63 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.903 109.1 51.4 -60.9 -43.0 -5.4 37.3 60.2 358 472 A K H < S+ 0 0 47 -4,-1.6 3,-0.4 1,-0.2 4,-0.3 0.908 112.1 45.9 -61.2 -43.8 -2.6 34.9 61.1 359 473 A L H >< S+ 0 0 0 -4,-2.2 3,-1.2 1,-0.2 7,-0.2 0.888 110.0 53.2 -67.9 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563 A N T 3 S+ 0 0 121 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.649 101.6 59.7 -68.4 -12.2 -2.9 49.6 36.0 450 564 A T T 3 S+ 0 0 65 4,-0.1 -1,-0.3 5,-0.0 2,-0.2 0.614 83.5 104.3 -85.8 -14.7 -3.5 46.9 38.7 451 565 A S S X> S- 0 0 22 -3,-1.7 4,-2.8 -6,-0.1 3,-0.7 -0.476 71.2-137.3 -73.8 135.9 -2.1 49.2 41.5 452 566 A F H 3> S+ 0 0 12 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.895 106.3 55.4 -50.7 -46.4 -4.6 50.9 43.9 453 567 A V H 34 S+ 0 0 35 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.770 112.1 43.8 -65.0 -24.2 -2.6 54.1 43.7 454 568 A N H <> S+ 0 0 58 -3,-0.7 4,-0.6 -6,-0.3 3,-0.5 0.893 115.1 47.8 -81.5 -45.9 -3.0 54.0 39.9 455 569 A R H >< S+ 0 0 79 -4,-2.8 3,-0.6 1,-0.2 6,-0.3 0.819 106.5 56.5 -66.1 -33.6 -6.7 53.1 39.9 456 570 A I T 3< S+ 0 0 17 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.1 0.783 100.7 58.8 -71.9 -23.3 -7.6 55.7 42.5 457 571 A A T 34 S+ 0 0 77 -3,-0.5 2,-1.1 -4,-0.4 -1,-0.2 0.723 86.4 88.9 -74.4 -21.7 -6.3 58.5 40.3 458 572 A D X< - 0 0 72 -4,-0.6 3,-2.1 -3,-0.6 -1,-0.1 -0.677 61.4-167.7 -82.3 97.6 -8.7 57.4 37.6 459 573 A T T 3 S+ 0 0 67 -2,-1.1 -1,-0.2 1,-0.3 4,-0.1 0.536 84.0 65.2 -64.9 -4.9 -11.9 59.4 38.2 460 574 A S T 3 S+ 0 0 95 2,-0.1 -1,-0.3 -3,-0.0 -2,-0.1 0.511 80.8 86.9 -95.4 -8.5 -13.7 57.1 35.8 461 575 A L S < S- 0 0 21 -3,-2.1 5,-0.1 -6,-0.3 -3,-0.0 -0.861 87.7-119.6 -94.1 118.4 -13.3 54.0 37.9 462 576 A P >> - 0 0 63 0, 0.0 4,-1.9 0, 0.0 3,-0.8 -0.256 14.9-124.1 -61.2 142.6 -16.2 53.8 40.4 463 577 A L H 3> S+ 0 0 18 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.875 109.8 58.2 -55.0 -42.5 -15.2 53.8 44.0 464 578 A D H 34 S+ 0 0 89 1,-0.2 -1,-0.2 2,-0.2 -421,-0.0 0.835 108.2 46.2 -59.0 -35.3 -17.1 50.5 44.7 465 579 A E H X4 S+ 0 0 105 -3,-0.8 3,-1.4 2,-0.2 -1,-0.2 0.895 109.3 55.6 -69.1 -42.3 -14.9 48.8 42.1 466 580 A L H 3< S+ 0 0 10 -4,-1.9 -2,-0.2 1,-0.3 -90,-0.2 0.879 116.8 34.9 -58.5 -41.1 -11.8 50.3 43.5 467 581 A V T 3< S+ 0 0 1 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.097 86.2 148.4-105.0 23.4 -12.4 49.0 47.0 468 582 A A < - 0 0 52 -3,-1.4 -3,-0.1 1,-0.1 -92,-0.1 -0.238 58.1 -99.7 -60.3 143.4 -14.0 45.7 45.9 469 583 A D > - 0 0 35 1,-0.1 4,-1.8 2,-0.0 -1,-0.1 -0.482 26.3-146.5 -67.2 127.4 -13.5 42.7 48.2 470 584 A P H > S+ 0 0 5 0, 0.0 4,-2.1 0, 0.0 -120,-0.2 0.831 96.3 53.6 -67.5 -36.8 -10.7 40.5 46.9 471 585 A V H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.937 111.3 46.2 -61.7 -45.4 -12.2 37.2 48.1 472 586 A T H > S+ 0 0 84 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.862 110.8 54.0 -63.8 -35.7 -15.5 38.0 46.4 473 587 A A H X S+ 0 0 35 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.877 107.5 50.4 -65.4 -39.2 -13.5 39.0 43.3 474 588 A V H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 11,-0.3 0.878 110.1 49.2 -66.8 -38.1 -11.7 35.6 43.3 475 589 A E H X S+ 0 0 73 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.855 108.3 54.2 -69.7 -32.5 -15.0 33.7 43.5 476 590 A K H X S+ 0 0 108 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.912 109.7 47.6 -66.6 -39.8 -16.4 35.8 40.7 477 591 A L H X S+ 0 0 38 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.923 110.5 52.5 -64.2 -42.0 -13.4 34.8 38.5 478 592 A A H X S+ 0 0 15 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.860 107.8 50.3 -64.8 -36.5 -13.9 31.2 39.5 479 593 A Q H < S+ 0 0 163 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.826 116.5 42.2 -71.8 -31.5 -17.6 31.2 38.5 480 594 A Q H < S+ 0 0 155 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.871 122.2 37.6 -76.9 -38.2 -16.7 32.6 35.1 481 595 A E H < S- 0 0 67 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.729 107.1-111.5 -96.7 -26.4 -13.6 30.5 34.4 482 596 A G S < S+ 0 0 68 -4,-2.2 2,-0.3 -5,-0.3 -4,-0.1 0.268 86.0 37.0 116.6 -13.1 -14.5 27.1 35.8 483 597 A Q S > S- 0 0 107 -6,-0.2 3,-0.6 -5,-0.1 2,-0.3 -0.969 83.3 -94.3-161.8 162.7 -12.2 26.8 38.8 484 598 A T T 3 S+ 0 0 38 -2,-0.3 -462,-0.3 1,-0.2 -463,-0.1 -0.567 95.8 10.3 -83.7 134.6 -10.7 28.8 41.6 485 599 A G T 3 S+ 0 0 2 -11,-0.3 -1,-0.2 -2,-0.3 -464,-0.2 0.772 72.2 172.7 78.1 28.3 -7.2 30.4 41.3 486 600 A L < - 0 0 47 -3,-0.6 -1,-0.2 -469,-0.1 -4,-0.0 -0.431 39.1-102.7 -64.1 144.7 -6.4 29.9 37.7 487 601 A P - 0 0 46 0, 0.0 -1,-0.1 0, 0.0 -145,-0.0 -0.180 50.7 -73.3 -62.5 161.3 -3.2 31.7 36.7 488 602 A H > - 0 0 63 3,-0.2 3,-1.9 1,-0.1 -144,-0.1 -0.332 43.5-128.0 -52.0 132.1 -3.2 35.0 34.7 489 603 A P T 3 S+ 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.721 109.0 48.1 -60.0 -23.1 -4.3 34.2 31.1 490 604 A K T 3 S+ 0 0 125 1,-0.2 -2,-0.1 2,-0.0 0, 0.0 0.312 102.8 66.8-101.2 5.1 -1.3 36.1 29.8 491 605 A I < - 0 0 17 -3,-1.9 -1,-0.2 0, 0.0 -3,-0.2 -0.646 68.7-179.5-127.3 77.8 1.2 34.5 32.2 492 606 A P - 0 0 72 0, 0.0 -4,-0.1 0, 0.0 -2,-0.0 -0.123 43.8 -74.5 -65.7 168.6 1.5 30.7 31.2 493 607 A L > - 0 0 77 1,-0.1 3,-2.5 2,-0.1 -155,-0.1 -0.382 44.5-113.8 -65.1 146.6 3.8 28.4 33.2 494 608 A P T 3 S+ 0 0 20 0, 0.0 -157,-0.1 0, 0.0 -1,-0.1 0.832 117.6 52.7 -50.9 -39.4 7.5 28.8 32.4 495 609 A R T 3 0 0 162 -159,-0.5 -158,-0.1 -158,-0.0 -2,-0.1 0.530 360.0 360.0 -77.0 -3.8 7.7 25.3 30.8 496 610 A D < 0 0 147 -3,-2.5 -161,-0.0 0, 0.0 0, 0.0 -0.338 360.0 360.0-100.4 360.0 4.8 26.2 28.5