==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 10-DEC-11 3V1X . COMPND 2 MOLECULE: 2-METHYLISOBORNEOL SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR M.KOKSAL,D.W.CHRISTIANSON . 311 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14486.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 223 71.7 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 . 8 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 1 0 0 2 1 1 1 0 0 0 0 1 1 1 0 0 0 0 1 0 0 1 1 0 1 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 1 116 A G 0 0 66 0, 0.0 2,-0.2 0, 0.0 300,-0.1 0.000 360.0 360.0 360.0 12.1 -23.0 36.6 21.6 2 117 A R - 0 0 131 1,-0.1 2,-0.0 300,-0.0 307,-0.0 -0.640 360.0-117.7 -94.1 148.3 -25.3 33.8 22.6 3 118 A A - 0 0 22 -2,-0.2 -1,-0.1 1,-0.1 295,-0.0 -0.292 43.1 -85.8 -71.5 158.7 -26.5 30.9 20.3 4 119 A V > - 0 0 2 1,-0.1 3,-1.9 2,-0.1 -1,-0.1 -0.535 56.6-108.2 -58.6 124.7 -30.1 30.4 19.4 5 120 A P T 3 S+ 0 0 41 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.409 102.8 15.8 -59.0 135.7 -31.5 28.3 22.3 6 121 A G T 3 S+ 0 0 55 1,-0.3 2,-0.5 -2,-0.1 254,-0.1 0.354 89.3 135.6 83.2 -6.5 -32.1 24.7 21.1 7 122 A L < - 0 0 7 -3,-1.9 2,-0.5 1,-0.1 -1,-0.3 -0.682 56.1-130.8 -77.8 121.0 -30.0 25.1 17.9 8 123 A Y + 0 0 63 -2,-0.5 2,-0.3 248,-0.3 255,-0.1 -0.609 49.5 139.1 -74.3 119.0 -27.8 22.1 17.5 9 124 A H - 0 0 61 -2,-0.5 285,-0.1 254,-0.0 -6,-0.0 -0.959 48.3-118.2-154.8 170.4 -24.3 23.2 16.8 10 125 A H - 0 0 60 -2,-0.3 288,-0.2 284,-0.0 287,-0.1 -0.951 29.3-126.9-117.8 127.3 -20.6 22.6 17.5 11 126 A P - 0 0 114 0, 0.0 284,-0.1 0, 0.0 283,-0.1 -0.319 25.7-152.2 -71.9 160.2 -18.4 25.2 19.2 12 127 A V - 0 0 38 282,-0.1 40,-0.0 283,-0.1 279,-0.0 -0.965 18.4-100.2-131.4 154.0 -15.2 26.2 17.5 13 128 A P - 0 0 109 0, 0.0 3,-0.0 0, 0.0 -1,-0.0 -0.182 53.9 -84.1 -58.3 155.0 -11.8 27.5 18.7 14 129 A E - 0 0 128 1,-0.1 2,-0.2 0, 0.0 34,-0.0 -0.460 55.0-106.4 -60.2 135.9 -11.0 31.2 18.5 15 130 A P - 0 0 10 0, 0.0 37,-0.1 0, 0.0 -1,-0.1 -0.498 43.7 -89.9 -69.1 136.1 -9.8 32.0 14.9 16 131 A D > - 0 0 73 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 -0.231 36.0-152.9 -46.6 111.9 -6.0 32.6 14.7 17 132 A P H > S+ 0 0 90 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.826 92.7 58.7 -65.5 -32.9 -5.7 36.4 15.2 18 133 A V H > S+ 0 0 112 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.960 111.4 41.3 -60.9 -49.5 -2.5 36.6 13.2 19 134 A R H > S+ 0 0 57 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.879 113.0 54.0 -63.2 -37.7 -4.4 35.1 10.2 20 135 A V H X S+ 0 0 15 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.972 110.9 46.4 -63.9 -44.4 -7.5 37.2 10.7 21 136 A E H X S+ 0 0 66 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.877 112.3 49.3 -68.0 -38.1 -5.5 40.3 10.7 22 137 A E H X S+ 0 0 47 -4,-2.0 4,-2.3 -5,-0.2 5,-0.3 0.950 111.4 48.9 -66.9 -47.8 -3.5 39.4 7.6 23 138 A V H X S+ 0 0 0 -4,-3.0 4,-3.3 1,-0.2 5,-0.3 0.935 108.7 56.0 -51.9 -46.7 -6.6 38.5 5.7 24 139 A S H X S+ 0 0 7 -4,-2.9 4,-2.1 -5,-0.3 -1,-0.2 0.934 109.6 44.1 -57.2 -40.4 -8.2 41.8 6.7 25 140 A R H X S+ 0 0 97 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.926 116.1 44.9 -75.6 -37.7 -5.4 43.8 5.3 26 141 A R H X S+ 0 0 76 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.894 113.2 51.2 -70.5 -37.2 -5.0 42.0 2.0 27 142 A I H X S+ 0 0 0 -4,-3.3 4,-2.7 -5,-0.3 5,-0.2 0.932 109.3 50.9 -70.0 -37.0 -8.8 41.9 1.5 28 143 A K H X S+ 0 0 110 -4,-2.1 4,-1.9 -5,-0.3 5,-0.3 0.918 111.5 48.2 -61.6 -44.2 -9.0 45.7 2.1 29 144 A R H X>S+ 0 0 127 -4,-2.1 4,-3.0 2,-0.2 5,-0.8 0.875 111.5 49.7 -63.4 -42.3 -6.2 46.3 -0.5 30 145 A W H X>S+ 0 0 0 -4,-2.4 5,-2.3 3,-0.2 4,-1.9 0.978 113.2 46.5 -57.6 -52.6 -7.9 44.0 -3.1 31 146 A A H <5S+ 0 0 0 -4,-2.7 6,-3.0 3,-0.2 7,-0.4 0.845 124.3 31.8 -58.2 -40.1 -11.2 45.8 -2.6 32 147 A E H <5S+ 0 0 76 -4,-1.9 -2,-0.2 4,-0.2 -1,-0.2 0.891 130.8 28.2 -89.3 -44.1 -9.7 49.3 -2.8 33 148 A D H <5S+ 0 0 103 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.782 128.5 31.2 -95.9 -26.6 -6.7 48.9 -5.1 34 149 A E T < - 0 0 73 1,-0.1 4,-1.5 -14,-0.0 5,-0.2 -0.910 360.0-153.7 -95.4 133.1 -14.7 45.5 7.9 43 163 A G H > S+ 0 0 6 -2,-0.5 4,-2.5 1,-0.2 5,-0.2 0.823 100.1 62.7 -61.4 -30.4 -11.9 43.4 6.7 44 164 A F H > S+ 0 0 102 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.935 97.1 53.1 -67.5 -42.2 -12.0 42.0 10.2 45 165 A S H > S+ 0 0 30 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.950 115.4 39.6 -52.7 -57.6 -15.6 40.6 9.8 46 166 A V H X S+ 0 0 11 -4,-1.5 4,-3.0 1,-0.2 5,-0.3 0.870 113.4 55.8 -68.5 -32.0 -14.8 38.6 6.7 47 167 A G H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.945 109.6 44.8 -63.5 -46.4 -11.3 37.6 8.0 48 168 A R H X S+ 0 0 70 -4,-2.9 4,-2.4 -5,-0.2 5,-0.2 0.920 114.3 53.8 -60.5 -38.4 -12.8 36.0 11.1 49 169 A Y H X S+ 0 0 9 -4,-2.1 4,-1.9 -5,-0.3 -2,-0.2 0.955 114.7 36.5 -58.5 -55.9 -15.4 34.4 8.9 50 170 A M H X S+ 0 0 2 -4,-3.0 4,-1.3 2,-0.2 -1,-0.2 0.878 117.3 49.9 -75.6 -36.3 -13.0 32.8 6.5 51 171 A V H >< S+ 0 0 10 -4,-2.7 3,-0.5 -5,-0.3 -1,-0.2 0.959 114.0 48.0 -64.2 -46.0 -10.3 31.8 9.1 52 172 A G H 3< S+ 0 0 19 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.863 115.3 44.7 -57.3 -38.6 -13.0 30.3 11.2 53 173 A C H 3< S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.645 118.7 39.8 -84.8 -16.5 -14.5 28.4 8.3 54 174 A H X< + 0 0 0 -4,-1.3 3,-2.0 -3,-0.5 -1,-0.2 -0.484 60.1 157.1-131.0 63.3 -11.3 27.1 6.7 55 175 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.763 75.4 57.9 -63.5 -18.9 -9.0 26.0 9.6 56 176 A D T 3 S+ 0 0 56 -3,-0.1 -5,-0.0 232,-0.1 232,-0.0 0.320 71.4 130.4 -91.5 14.8 -7.1 23.7 7.3 57 177 A A < - 0 0 4 -3,-2.0 132,-0.2 -6,-0.2 131,-0.1 -0.473 51.5-148.3 -68.1 132.5 -6.0 26.5 4.8 58 178 A P S S+ 0 0 69 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.871 73.0 6.3 -71.7 -26.1 -2.2 26.1 4.2 59 179 A T S > S- 0 0 58 129,-0.3 4,-2.0 1,-0.1 3,-0.2 -0.920 72.7-107.4-143.6 168.3 -1.7 29.8 3.6 60 180 A V H > S+ 0 0 19 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.858 119.1 62.6 -65.8 -34.0 -3.3 33.2 3.7 61 181 A D H > S+ 0 0 103 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.910 104.7 46.8 -54.1 -43.4 -3.2 33.0 -0.2 62 182 A H H >> S+ 0 0 53 1,-0.2 4,-1.0 2,-0.2 3,-0.8 0.943 112.3 49.8 -63.2 -49.4 -5.5 29.9 0.0 63 183 A L H 3X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.855 105.0 58.9 -56.0 -37.0 -7.8 31.8 2.5 64 184 A M H 3X S+ 0 0 3 -4,-2.7 4,-2.3 1,-0.2 5,-0.3 0.778 93.2 65.9 -70.7 -24.3 -7.9 34.7 0.1 65 185 A L H + 0 0 40 0, 0.0 3,-1.9 0, 0.0 4,-0.3 0.458 360.0 107.8 -75.6 4.4 -36.2 42.9 -8.8 82 209 A V T 3 S+ 0 0 99 1,-0.3 3,-0.4 2,-0.1 77,-0.0 0.907 84.9 28.3 -56.6 -49.3 -37.7 43.4 -12.3 83 210 A G T >> S+ 0 0 36 -3,-0.3 4,-2.1 1,-0.2 3,-0.8 0.279 87.9 116.5 -94.5 20.0 -34.6 43.3 -14.5 84 211 A L H <> + 0 0 37 -3,-1.9 4,-3.0 1,-0.3 5,-0.3 0.823 68.8 57.1 -53.9 -43.4 -32.7 40.9 -12.1 85 212 A G H 3> S+ 0 0 36 -3,-0.4 4,-1.9 -4,-0.3 -1,-0.3 0.880 109.6 46.1 -63.6 -34.9 -32.4 38.0 -14.5 86 213 A G H <> S+ 0 0 47 -3,-0.8 4,-2.0 2,-0.2 5,-0.2 0.945 114.0 48.1 -71.7 -46.0 -30.7 40.2 -17.1 87 214 A R H X S+ 0 0 133 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.921 114.0 46.2 -56.4 -44.7 -28.3 41.7 -14.5 88 215 A L H X S+ 0 0 10 -4,-3.0 4,-2.9 1,-0.2 -1,-0.2 0.906 108.2 55.5 -74.9 -37.3 -27.4 38.4 -13.0 89 216 A L H X S+ 0 0 109 -4,-1.9 4,-1.4 -5,-0.3 -1,-0.2 0.955 109.9 46.5 -57.1 -47.1 -26.8 36.7 -16.3 90 217 A L H < S+ 0 0 88 -4,-2.0 3,-0.3 1,-0.2 4,-0.3 0.909 112.8 49.0 -66.4 -38.4 -24.3 39.4 -17.4 91 218 A A H >< S+ 0 0 6 -4,-2.1 3,-2.3 1,-0.2 4,-0.4 0.899 103.7 61.8 -64.8 -35.6 -22.6 39.1 -14.0 92 219 A H H >X S+ 0 0 31 -4,-2.9 4,-3.1 1,-0.3 3,-2.2 0.841 91.3 67.4 -58.0 -29.9 -22.5 35.3 -14.5 93 220 A T T 3< S+ 0 0 20 -4,-1.4 5,-0.4 -3,-0.3 -1,-0.3 0.715 89.2 63.7 -67.5 -15.5 -20.3 35.8 -17.6 94 221 A A T <4 S+ 0 0 0 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.644 114.5 34.1 -75.6 -14.0 -17.6 37.1 -15.2 95 222 A I T <4 S+ 0 0 1 -3,-2.2 2,-0.5 -4,-0.4 -2,-0.2 0.779 130.8 30.0-106.9 -42.9 -17.6 33.5 -13.8 96 223 A D S < S- 0 0 84 -4,-3.1 -1,-0.3 45,-0.1 -2,-0.0 -0.950 100.6-124.1-125.2 100.9 -18.4 31.4 -16.9 97 224 A H - 0 0 86 -2,-0.5 2,-0.2 -3,-0.2 -3,-0.1 -0.086 9.9-118.2 -62.7 144.6 -17.0 33.3 -19.8 98 225 A F - 0 0 82 -5,-0.4 2,-0.4 7,-0.1 -1,-0.1 -0.571 24.0-158.9 -67.5 138.2 -18.7 34.5 -22.9 99 226 A H + 0 0 165 -2,-0.2 2,-0.2 0, 0.0 -1,-0.0 -0.991 33.8 126.0-122.7 126.2 -17.4 33.0 -26.2 100 227 A S - 0 0 59 -2,-0.4 2,-0.0 1,-0.1 -2,-0.0 -0.738 52.7 -45.4-156.5-164.4 -18.1 35.0 -29.3 101 228 A T > - 0 0 75 -2,-0.2 4,-2.2 1,-0.1 -1,-0.1 -0.226 53.6-105.1 -78.9 169.9 -16.8 36.8 -32.5 102 229 A A T 4 S+ 0 0 94 1,-0.2 -1,-0.1 2,-0.2 -2,-0.0 0.847 121.9 52.1 -66.4 -28.3 -13.8 39.0 -32.8 103 230 A E T > S+ 0 0 129 1,-0.1 4,-0.5 2,-0.1 -1,-0.2 0.939 117.4 31.9 -71.6 -46.5 -16.3 41.9 -33.0 104 231 A Y H > S+ 0 0 125 1,-0.2 4,-1.8 2,-0.1 5,-0.2 0.722 103.1 73.0 -91.0 -21.6 -18.4 41.2 -29.9 105 232 A T H X S+ 0 0 43 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.916 95.2 51.7 -58.4 -49.4 -15.9 39.7 -27.6 106 233 A P H > S+ 0 0 78 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.877 107.2 53.7 -60.7 -34.7 -14.0 43.0 -26.8 107 234 A T H X S+ 0 0 99 -4,-0.5 4,-1.3 2,-0.2 -2,-0.2 0.906 111.4 44.7 -65.5 -43.6 -17.3 44.7 -25.9 108 235 A W H X S+ 0 0 30 -4,-1.8 4,-1.0 2,-0.2 3,-0.2 0.906 109.2 58.3 -56.9 -47.3 -18.1 42.0 -23.4 109 236 A Q H >< S+ 0 0 102 -4,-2.8 3,-1.1 1,-0.2 4,-0.4 0.945 105.4 49.1 -53.6 -44.9 -14.6 42.2 -22.2 110 237 A A H >< S+ 0 0 67 -4,-2.5 3,-1.8 1,-0.3 4,-0.4 0.851 101.2 63.3 -61.4 -34.3 -15.1 45.9 -21.4 111 238 A S H >< S+ 0 0 30 -4,-1.3 3,-1.2 1,-0.3 4,-0.5 0.751 88.7 70.6 -65.1 -24.0 -18.3 45.2 -19.5 112 239 A L T << S+ 0 0 2 -3,-1.1 -1,-0.3 -4,-1.0 10,-0.2 0.729 102.3 44.0 -66.7 -19.5 -16.3 43.2 -17.0 113 240 A A T < S+ 0 0 64 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 0.524 91.6 94.5 -94.0 -3.5 -14.7 46.5 -15.7 114 241 A A S < S+ 0 0 64 -3,-1.2 2,-0.3 -4,-0.4 -2,-0.1 0.793 89.5 7.0 -69.8 -34.1 -18.1 48.3 -15.7 115 242 A D S > S- 0 0 56 -4,-0.5 4,-2.4 -3,-0.1 5,-0.2 -0.910 75.7 -99.8-143.9 174.7 -19.2 47.9 -12.2 116 243 A A H > S+ 0 0 14 -2,-0.3 4,-3.3 1,-0.2 5,-0.2 0.927 116.0 52.2 -62.4 -46.5 -18.1 46.7 -8.7 117 244 A P H > S+ 0 0 9 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.933 114.2 41.4 -60.6 -45.4 -19.9 43.3 -8.9 118 245 A R H > S+ 0 0 42 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.869 115.9 49.7 -71.6 -35.0 -18.4 42.4 -12.2 119 246 A R H X S+ 0 0 61 -4,-2.4 4,-2.1 2,-0.2 5,-0.3 0.909 111.9 50.2 -59.4 -44.1 -14.9 43.7 -11.3 120 247 A A H X S+ 0 0 0 -4,-3.3 4,-3.1 -5,-0.2 5,-0.2 0.958 115.7 40.9 -60.3 -53.8 -15.1 41.8 -8.1 121 248 A Y H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.2 5,-0.4 0.881 112.7 52.2 -59.8 -47.1 -16.1 38.5 -9.8 122 249 A D H X S+ 0 0 52 -4,-2.5 4,-1.9 -10,-0.2 -1,-0.2 0.952 117.9 39.0 -59.7 -44.7 -13.8 38.8 -12.7 123 250 A S H X S+ 0 0 26 -4,-2.1 4,-2.2 -5,-0.2 5,-0.2 0.974 117.9 46.7 -70.1 -51.5 -10.8 39.4 -10.4 124 251 A A H X S+ 0 0 0 -4,-3.1 4,-1.6 -5,-0.3 -55,-0.2 0.875 116.7 44.4 -60.4 -39.2 -11.8 36.9 -7.6 125 252 A M H X S+ 0 0 4 -4,-2.5 4,-3.3 -5,-0.2 -1,-0.3 0.853 106.4 62.7 -71.5 -39.7 -12.6 34.1 -10.2 126 253 A G H X S+ 0 0 19 -4,-1.9 4,-1.6 -5,-0.4 -2,-0.2 0.934 107.8 42.2 -47.7 -53.8 -9.3 35.0 -12.0 127 254 A Y H X S+ 0 0 66 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.899 113.6 52.8 -63.7 -39.5 -7.4 34.0 -8.9 128 255 A F H X S+ 0 0 0 -4,-1.6 4,-3.0 -5,-0.2 -2,-0.2 0.929 107.5 50.4 -61.0 -45.5 -9.5 31.0 -8.3 129 256 A V H < S+ 0 0 62 -4,-3.3 -1,-0.2 1,-0.2 -2,-0.2 0.854 109.1 51.5 -66.3 -33.7 -9.0 29.6 -11.8 130 257 A R H < S+ 0 0 182 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.923 119.5 36.4 -67.3 -39.0 -5.2 30.0 -11.6 131 258 A A H < S+ 0 0 64 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.875 108.5 66.0 -82.7 -40.6 -5.1 28.0 -8.3 132 259 A A S < S- 0 0 10 -4,-3.0 60,-0.1 -5,-0.2 55,-0.0 -0.368 86.2-100.8 -84.3 164.8 -7.8 25.4 -8.7 133 260 A T > - 0 0 40 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 -0.346 38.1-108.5 -72.4 156.2 -8.1 22.4 -11.0 134 261 A P H > S+ 0 0 116 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.888 123.2 53.1 -51.1 -40.0 -10.3 22.8 -14.1 135 262 A S H > S+ 0 0 54 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.898 107.6 49.2 -57.2 -43.6 -12.8 20.4 -12.3 136 263 A Q H > S+ 0 0 10 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.876 112.6 49.5 -67.5 -36.6 -12.8 22.5 -9.1 137 264 A S H X S+ 0 0 3 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.911 111.8 46.3 -64.9 -46.8 -13.5 25.6 -11.4 138 265 A D H X S+ 0 0 108 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.885 110.5 54.5 -62.3 -40.7 -16.3 24.0 -13.3 139 266 A R H X S+ 0 0 18 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.914 108.1 49.2 -62.1 -38.5 -17.8 22.8 -10.0 140 267 A Y H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.919 107.7 53.7 -65.7 -42.9 -17.8 26.4 -8.6 141 268 A R H X S+ 0 0 54 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.905 108.5 50.2 -59.1 -42.1 -19.5 27.7 -11.7 142 269 A H H X S+ 0 0 106 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.938 110.9 48.9 -59.8 -45.0 -22.3 25.1 -11.3 143 270 A D H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.878 112.3 49.3 -67.3 -29.3 -22.7 26.1 -7.6 144 271 A M H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.862 107.1 53.2 -75.1 -34.7 -22.8 29.8 -8.7 145 272 A A H X S+ 0 0 38 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.928 109.9 50.5 -63.5 -43.9 -25.4 29.0 -11.4 146 273 A R H X S+ 0 0 41 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.921 109.0 51.3 -49.6 -53.2 -27.5 27.4 -8.6 147 274 A L H X S+ 0 0 7 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.937 108.8 49.7 -55.1 -45.3 -27.1 30.5 -6.5 148 275 A H H X S+ 0 0 9 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.899 109.7 51.9 -65.9 -34.0 -28.3 32.8 -9.2 149 276 A L H X S+ 0 0 107 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.904 107.8 51.9 -65.4 -42.0 -31.3 30.6 -9.8 150 277 A G H X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.928 109.4 50.0 -55.3 -49.4 -32.1 30.8 -6.2 151 278 A Y H X S+ 0 0 25 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.870 109.7 51.4 -54.9 -44.3 -31.9 34.6 -6.2 152 279 A L H X S+ 0 0 54 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.804 108.6 49.9 -72.2 -32.5 -34.2 34.8 -9.3 153 280 A A H X S+ 0 0 34 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.953 113.2 47.1 -63.0 -54.9 -36.9 32.6 -7.7 154 281 A E H X S+ 0 0 45 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.920 114.0 46.8 -51.7 -45.6 -36.8 34.8 -4.6 155 282 A G H X S+ 0 0 5 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.879 109.3 54.5 -65.4 -42.5 -36.9 38.0 -6.7 156 283 A A H X S+ 0 0 50 -4,-2.2 4,-0.7 2,-0.2 6,-0.2 0.942 111.2 45.8 -56.1 -46.1 -39.8 36.5 -8.9 157 284 A W H >X>S+ 0 0 53 -4,-2.5 5,-2.3 1,-0.2 3,-1.2 0.931 109.6 55.0 -64.2 -40.3 -41.9 35.9 -5.6 158 285 A A H 3<5S+ 0 0 64 -4,-2.4 3,-0.4 1,-0.3 -1,-0.2 0.836 95.9 65.7 -62.5 -32.6 -41.0 39.3 -4.3 159 286 A Q H 3<5S+ 0 0 96 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.768 117.9 25.7 -64.5 -26.4 -42.4 41.0 -7.4 160 287 A T H <<5S- 0 0 115 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.367 106.8-115.4-113.8 4.7 -45.9 39.8 -6.5 161 288 A G T <5 + 0 0 49 -4,-0.9 -3,-0.2 -3,-0.4 2,-0.1 0.774 54.1 174.6 67.7 20.5 -45.5 39.4 -2.8 162 289 A H < - 0 0 82 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.429 23.4-154.0 -63.4 131.5 -46.1 35.7 -3.3 163 290 A V - 0 0 15 -2,-0.1 3,-0.1 -3,-0.1 -1,-0.1 -0.945 18.1-148.2-104.8 107.9 -45.7 33.6 -0.1 164 291 A P - 0 0 0 0, 0.0 79,-0.1 0, 0.0 5,-0.1 -0.287 26.8 -89.3 -64.5 163.8 -44.6 30.0 -1.2 165 292 A E > - 0 0 82 1,-0.1 4,-2.5 78,-0.1 5,-0.2 -0.260 48.1-103.8 -60.7 156.6 -45.6 26.8 0.6 166 293 A V H > S+ 0 0 18 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.927 122.5 48.4 -52.9 -49.4 -42.9 26.0 3.2 167 294 A W H > S+ 0 0 168 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.877 111.4 52.9 -62.7 -34.2 -41.3 23.2 1.1 168 295 A E H > S+ 0 0 64 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 108.8 47.2 -65.9 -45.0 -41.2 25.6 -1.8 169 296 A Y H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.941 112.2 51.7 -56.7 -48.5 -39.5 28.2 0.3 170 297 A L H X S+ 0 0 51 -4,-2.8 4,-0.6 2,-0.2 -2,-0.2 0.851 108.3 52.4 -56.7 -40.2 -37.1 25.4 1.4 171 298 A A H >X S+ 0 0 39 -4,-2.4 3,-1.2 2,-0.2 4,-0.7 0.959 110.9 45.8 -63.3 -53.5 -36.4 24.5 -2.3 172 299 A M H >X S+ 0 0 9 -4,-2.4 4,-3.2 1,-0.2 3,-1.3 0.906 111.7 52.4 -48.3 -48.1 -35.6 28.1 -3.2 173 300 A R H 3< S+ 0 0 31 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.548 97.6 66.3 -73.6 -10.5 -33.3 28.3 -0.1 174 301 A Q H << S+ 0 0 70 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.742 115.8 28.9 -69.9 -30.4 -31.6 25.1 -1.2 175 302 A F H << S+ 0 0 70 -3,-1.3 2,-1.6 -4,-0.7 -2,-0.2 0.852 113.0 60.6 -99.3 -44.5 -30.3 27.1 -4.2 176 303 A N S < S+ 0 0 10 -4,-3.2 2,-0.3 -26,-0.2 -1,-0.2 -0.656 96.9 120.3 -84.5 88.7 -30.2 30.6 -2.7 177 304 A N S S- 0 0 9 -2,-1.6 35,-0.1 -3,-0.1 -3,-0.1 -0.928 83.8-104.2-163.4 150.0 -27.7 29.2 -0.3 178 305 A F S > S+ 0 0 39 33,-0.4 3,-3.5 -2,-0.3 34,-0.1 0.680 80.9 114.9 -63.6 -14.8 -24.2 29.3 1.2 179 306 A R T 3> + 0 0 14 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.655 63.0 61.9 -33.3 -40.9 -23.3 26.1 -0.8 180 307 A P T 34 S+ 0 0 4 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.739 103.2 55.8 -63.0 -15.0 -20.6 27.7 -3.1 181 308 A C T X4 S+ 0 0 12 -3,-3.5 3,-1.0 2,-0.2 -2,-0.2 0.950 110.8 36.2 -84.8 -56.3 -18.5 28.5 0.1 182 309 A P G >4 S+ 0 0 2 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.820 108.7 66.1 -66.8 -25.8 -18.2 25.1 1.7 183 310 A T G 3< S+ 0 0 1 -4,-1.9 3,-0.4 1,-0.3 4,-0.2 0.658 95.3 58.0 -75.3 -13.4 -17.8 23.3 -1.6 184 311 A I G <> S+ 0 0 7 -3,-1.0 4,-2.6 -4,-0.3 -1,-0.3 0.296 72.7 109.0 -88.4 13.6 -14.5 25.1 -2.2 185 312 A T H <> S+ 0 0 1 -3,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.851 76.9 50.9 -54.6 -39.5 -13.1 23.6 1.0 186 313 A D H >>S+ 0 0 0 -3,-0.4 5,-2.5 2,-0.2 4,-0.7 0.912 110.4 48.0 -64.6 -43.8 -10.7 21.3 -1.0 187 314 A T H >45S+ 0 0 8 1,-0.2 3,-0.8 -4,-0.2 -2,-0.2 0.928 115.6 44.2 -61.5 -46.2 -9.4 24.1 -3.1 188 315 A V H 3<5S+ 0 0 0 -4,-2.6 -129,-0.3 1,-0.2 -1,-0.2 0.784 112.1 54.1 -69.8 -31.4 -8.8 26.2 -0.1 189 316 A G H 3<5S- 0 0 2 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.478 114.7-114.7 -80.0 -6.8 -7.3 23.1 1.8 190 317 A G T <<5S+ 0 0 49 -3,-0.8 2,-0.3 -4,-0.7 -3,-0.2 0.753 83.5 84.7 81.2 23.7 -4.7 22.5 -1.0 191 318 A Y S > - 0 0 49 0, 0.0 4,-2.4 0, 0.0 3,-0.9 -0.217 17.5-124.2 -59.0 144.0 -11.8 14.0 -7.5 195 322 A A H 3> S+ 0 0 40 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.854 109.2 55.4 -58.1 -38.8 -14.7 15.1 -9.8 196 323 A D H 34 S+ 0 0 140 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.834 111.9 44.4 -68.4 -26.7 -16.0 11.5 -10.2 197 324 A L H X4 S+ 0 0 33 -3,-0.9 3,-0.8 2,-0.2 6,-0.3 0.845 109.4 53.9 -82.3 -39.4 -16.3 11.3 -6.4 198 325 A H H 3< S+ 0 0 22 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.924 106.4 56.9 -52.3 -43.6 -17.9 14.8 -6.0 199 326 A A T 3< S+ 0 0 60 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.585 76.3 118.4 -71.6 -14.0 -20.5 13.7 -8.5 200 327 A R S <> S- 0 0 80 -3,-0.8 4,-2.4 -4,-0.3 5,-0.2 -0.258 72.5-125.3 -52.1 142.7 -21.7 10.6 -6.6 201 328 A P H > S+ 0 0 112 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.899 110.6 53.5 -59.9 -36.5 -25.4 10.9 -5.6 202 329 A D H > S+ 0 0 59 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.959 109.2 46.5 -65.2 -44.8 -24.5 10.3 -2.0 203 330 A M H > S+ 0 0 1 -6,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.902 110.4 54.2 -59.7 -40.6 -21.9 13.1 -1.9 204 331 A Q H X S+ 0 0 44 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.911 109.8 47.5 -59.0 -43.4 -24.4 15.4 -3.7 205 332 A R H X S+ 0 0 157 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.917 110.0 52.2 -64.4 -41.7 -27.0 14.7 -0.9 206 333 A V H X S+ 0 0 1 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.950 112.5 45.8 -56.6 -48.9 -24.4 15.3 1.8 207 334 A I H X S+ 0 0 4 -4,-2.8 4,-2.9 1,-0.2 5,-0.3 0.932 111.2 50.8 -63.2 -47.8 -23.5 18.7 0.3 208 335 A A H X S+ 0 0 14 -4,-2.3 4,-2.8 -5,-0.2 -1,-0.2 0.925 111.9 48.0 -55.9 -45.1 -27.1 19.8 -0.2 209 336 A L H X S+ 0 0 15 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.921 111.4 50.3 -64.1 -45.8 -28.0 19.0 3.4 210 337 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 5,-0.3 0.946 114.1 43.0 -55.2 -52.9 -25.0 20.8 4.7 211 338 A G H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -33,-0.4 0.922 113.4 53.8 -62.3 -37.9 -25.8 23.9 2.7 212 339 A N H X S+ 0 0 22 -4,-2.8 4,-2.0 -5,-0.3 -2,-0.2 0.956 113.0 42.5 -65.1 -44.0 -29.5 23.6 3.6 213 340 A A H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.960 115.3 47.4 -64.7 -44.8 -28.7 23.5 7.4 214 341 A T H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.792 111.5 52.3 -77.2 -18.7 -26.1 26.2 7.4 215 342 A T H X S+ 0 0 1 -4,-2.0 4,-1.8 -5,-0.3 3,-0.3 0.908 103.7 54.7 -81.5 -35.7 -28.3 28.4 5.4 216 343 A I H X S+ 0 0 2 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.852 98.5 67.2 -64.2 -28.6 -31.3 28.1 7.7 217 344 A V H X S+ 0 0 3 -4,-1.7 4,-2.7 1,-0.2 5,-0.3 0.954 100.2 48.9 -50.9 -44.1 -28.8 29.2 10.4 218 345 A N H X S+ 0 0 16 -4,-0.9 4,-2.7 -3,-0.3 -2,-0.2 0.929 106.0 54.7 -68.2 -42.7 -28.8 32.5 8.7 219 346 A D H X S+ 0 0 0 -4,-1.8 4,-0.7 2,-0.2 -1,-0.2 0.934 112.1 46.4 -46.8 -48.1 -32.6 32.6 8.6 220 347 A L H < S+ 0 0 0 -4,-2.6 3,-0.5 1,-0.2 4,-0.3 0.937 117.7 39.3 -68.6 -45.7 -32.6 32.1 12.4 221 348 A Y H < S+ 0 0 4 -4,-2.7 87,-0.8 1,-0.2 4,-0.2 0.796 121.0 43.8 -72.7 -29.6 -29.9 34.7 13.2 222 349 A S H X S+ 0 0 1 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.398 83.6 102.1 -96.5 2.1 -31.1 37.3 10.7 223 350 A Y H X S+ 0 0 8 -4,-0.7 4,-1.2 -3,-0.5 -1,-0.2 0.923 82.7 45.1 -49.9 -50.9 -34.8 36.9 11.4 224 351 A T H 4 S+ 0 0 24 84,-0.6 3,-0.4 -4,-0.3 4,-0.4 0.904 112.6 50.6 -67.1 -37.2 -35.1 40.1 13.5 225 352 A K H >4 S+ 0 0 79 83,-0.3 3,-1.7 -4,-0.2 4,-0.4 0.912 106.4 56.8 -64.3 -37.1 -33.1 42.2 11.1 226 353 A E H >< S+ 0 0 21 -4,-2.5 3,-0.9 1,-0.3 7,-0.5 0.757 85.9 76.9 -74.0 -21.4 -35.3 41.0 8.2 227 354 A L T 3< S+ 0 0 96 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.779 100.7 46.1 -53.4 -22.5 -38.5 42.2 9.9 228 355 A N T < S+ 0 0 140 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.599 85.4 113.5 -99.9 -12.4 -37.3 45.7 8.7 229 356 A S S < S- 0 0 28 -3,-0.9 4,-0.4 -4,-0.4 -3,-0.0 -0.252 86.9 -79.9 -50.9 145.4 -36.3 44.8 5.1 230 357 A P S S- 0 0 127 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.261 99.7 -14.1 -46.4 127.5 -38.5 46.4 2.4 231 358 A G S S- 0 0 76 1,-0.1 2,-0.8 -3,-0.1 -73,-0.0 -0.372 120.1 -33.6 80.7-152.7 -41.7 44.5 2.1 232 359 A R - 0 0 144 -74,-0.1 2,-0.3 -2,-0.1 -1,-0.1 -0.815 66.1-155.7-105.8 88.0 -42.2 41.1 3.6 233 360 A H - 0 0 61 -2,-0.8 2,-0.2 -7,-0.5 5,-0.1 -0.497 19.2-123.7 -65.8 123.8 -38.7 39.5 3.3 234 361 A L + 0 0 19 -2,-0.3 2,-0.3 -80,-0.1 -1,-0.1 -0.485 43.4 148.0 -75.8 137.2 -39.1 35.7 3.3 235 362 A N > - 0 0 0 -2,-0.2 4,-2.7 1,-0.1 5,-0.3 -0.922 59.7 -91.0-151.2 170.1 -37.2 33.4 5.8 236 363 A L H > S+ 0 0 0 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.927 122.5 47.0 -60.5 -44.0 -38.3 30.1 7.3 237 364 A P H > S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.929 113.8 49.0 -60.1 -48.0 -40.0 31.3 10.4 238 365 A V H > S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.895 114.2 45.8 -53.1 -46.5 -42.0 34.0 8.4 239 366 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 5,-0.4 0.908 112.8 49.1 -67.2 -42.0 -43.1 31.4 5.8 240 367 A I H X S+ 0 0 1 -4,-2.7 4,-2.6 -5,-0.3 6,-0.2 0.959 112.9 48.9 -61.4 -50.5 -44.1 28.8 8.4 241 368 A A H <>S+ 0 0 8 -4,-2.8 5,-1.3 -5,-0.2 4,-0.3 0.910 115.6 43.4 -52.9 -51.9 -46.1 31.4 10.3 242 369 A E H <5S+ 0 0 50 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.874 124.4 31.1 -67.4 -41.2 -47.9 32.6 7.1 243 370 A R H <5S+ 0 0 108 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.922 126.2 39.5 -83.0 -49.4 -48.7 29.2 5.6 244 371 A E T <5S- 0 0 83 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.2 0.253 105.5-130.3 -82.2 14.4 -49.1 27.0 8.6 245 372 A Q T 5 + 0 0 149 -4,-0.3 2,-0.2 -5,-0.2 -3,-0.2 0.902 54.1 149.8 18.2 76.0 -50.9 30.0 10.3 246 373 A L < - 0 0 70 -5,-1.3 -1,-0.1 -6,-0.2 2,-0.1 -0.771 54.4 -93.2-114.8 162.5 -48.8 29.8 13.5 247 374 A C > - 0 0 67 -2,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.506 43.0-107.7 -73.1 154.8 -47.8 32.7 15.9 248 375 A E H > S+ 0 0 78 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.872 117.5 53.1 -49.5 -40.4 -44.4 34.1 15.0 249 376 A R H > S+ 0 0 106 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.924 110.5 42.4 -66.8 -47.9 -42.9 32.5 18.1 250 377 A D H > S+ 0 0 72 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.835 112.8 54.8 -70.7 -30.0 -44.0 29.0 17.5 251 378 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.880 109.8 47.2 -66.0 -44.3 -43.1 29.3 13.8 252 379 A Y H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.952 110.8 51.0 -63.9 -47.9 -39.6 30.3 14.8 253 380 A L H X S+ 0 0 42 -4,-2.8 4,-1.9 1,-0.3 -1,-0.2 0.891 109.5 50.8 -59.3 -37.6 -39.2 27.5 17.3 254 381 A K H X S+ 0 0 90 -4,-1.9 4,-2.4 2,-0.2 -1,-0.3 0.897 105.7 56.1 -64.1 -35.2 -40.3 25.1 14.6 255 382 A A H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.870 104.1 54.3 -65.3 -36.8 -37.7 26.5 12.2 256 383 A V H X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.2 -248,-0.3 0.942 108.5 48.4 -59.6 -43.8 -35.1 25.7 14.9 257 384 A E H X S+ 0 0 113 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.881 109.2 52.5 -65.3 -36.9 -36.3 22.1 14.9 258 385 A V H X S+ 0 0 31 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.955 109.5 49.7 -60.4 -51.9 -36.2 22.0 11.0 259 386 A H H X S+ 0 0 3 -4,-2.7 4,-3.2 1,-0.2 5,-0.2 0.935 109.1 53.0 -47.2 -53.1 -32.6 23.2 11.2 260 387 A N H X S+ 0 0 19 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.907 109.5 47.1 -55.6 -43.0 -31.7 20.6 13.8 261 388 A E H X S+ 0 0 140 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.901 112.9 49.2 -65.8 -41.6 -33.1 17.7 11.6 262 389 A L H X S+ 0 0 33 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.951 114.1 46.0 -61.7 -44.2 -31.2 19.1 8.5 263 390 A Q H X S+ 0 0 4 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.958 114.0 47.2 -66.1 -47.9 -28.0 19.3 10.5 264 391 A H H X S+ 0 0 92 -4,-3.0 4,-2.4 -5,-0.2 5,-0.2 0.919 113.1 49.6 -57.7 -43.2 -28.4 15.8 12.1 265 392 A S H X S+ 0 0 36 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.872 107.8 54.0 -65.6 -37.1 -29.2 14.4 8.7 266 393 A F H X S+ 0 0 2 -4,-2.4 4,-2.6 -57,-0.2 5,-0.2 0.964 110.5 47.2 -57.7 -50.6 -26.1 16.1 7.2 267 394 A E H X S+ 0 0 50 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.934 112.6 47.3 -56.9 -47.2 -24.0 14.4 9.8 268 395 A A H X S+ 0 0 54 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.889 113.0 50.1 -62.5 -40.7 -25.5 10.9 9.4 269 396 A A H X S+ 0 0 19 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.901 112.4 46.1 -67.7 -38.4 -25.1 11.2 5.7 270 397 A A H X S+ 0 0 14 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.877 111.2 52.5 -69.8 -36.9 -21.4 12.3 5.9 271 398 A A H X S+ 0 0 57 -4,-2.6 4,-1.5 -5,-0.2 -2,-0.2 0.952 110.3 49.1 -64.6 -46.0 -20.7 9.5 8.5 272 399 A D H X S+ 0 0 110 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.849 112.1 46.6 -56.0 -42.1 -22.2 6.9 6.1 273 400 A L H X S+ 0 0 3 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.834 107.5 57.8 -71.7 -34.3 -20.2 8.2 3.0 274 401 A A H < S+ 0 0 27 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.863 112.4 41.3 -62.9 -31.9 -17.0 8.2 5.1 275 402 A E H < S+ 0 0 165 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.900 116.2 48.4 -80.5 -40.8 -17.6 4.5 5.8 276 403 A A H < S+ 0 0 68 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.778 129.8 19.2 -72.3 -25.6 -18.7 3.6 2.3 277 404 A C < + 0 0 10 -4,-2.0 2,-1.3 -5,-0.1 -1,-0.3 -0.527 68.7 176.2-148.4 70.6 -15.8 5.4 0.6 278 405 A P + 0 0 81 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.077 26.4 143.6 -83.2 42.5 -12.9 6.0 3.0 279 406 A L >> - 0 0 78 -2,-1.3 4,-2.4 1,-0.1 3,-0.6 -0.523 58.9-118.9 -70.6 146.4 -10.5 7.6 0.5 280 407 A P H 3> S+ 0 0 91 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.855 111.1 51.6 -51.2 -47.6 -8.4 10.4 2.0 281 408 A P H 3> S+ 0 0 36 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.819 113.2 48.4 -67.0 -26.5 -9.6 13.2 -0.3 282 409 A V H <> S+ 0 0 2 -3,-0.6 4,-3.0 2,-0.2 5,-0.2 0.931 112.2 46.8 -71.9 -50.7 -13.2 12.2 0.6 283 410 A L H X S+ 0 0 71 -4,-2.4 4,-1.9 1,-0.2 5,-0.2 0.888 114.8 47.3 -63.8 -40.0 -12.6 12.1 4.3 284 411 A R H X S+ 0 0 117 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.900 111.8 49.2 -67.5 -42.4 -10.8 15.5 4.2 285 412 A F H X S+ 0 0 0 -4,-1.5 4,-2.6 -5,-0.2 -2,-0.2 0.941 110.9 51.6 -60.0 -47.0 -13.6 17.1 2.1 286 413 A L H X S+ 0 0 11 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.892 111.8 46.4 -57.9 -41.5 -16.2 15.8 4.5 287 414 A R H X S+ 0 0 198 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.886 110.5 52.0 -67.1 -39.9 -14.4 17.2 7.4 288 415 A G H X S+ 0 0 5 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.872 107.7 52.5 -66.3 -34.6 -13.8 20.5 5.7 289 416 A V H X S+ 0 0 2 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.968 110.6 47.6 -62.9 -48.9 -17.6 20.8 4.9 290 417 A A H X S+ 0 0 32 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.893 112.4 51.0 -55.3 -38.6 -18.4 20.2 8.6 291 418 A A H X S+ 0 0 25 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.888 109.2 48.7 -66.0 -40.0 -15.8 22.8 9.5 292 419 A W H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.947 113.0 49.1 -64.4 -45.1 -17.2 25.4 7.2 293 420 A V H X S+ 0 0 5 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.948 113.6 44.7 -59.0 -50.5 -20.7 24.7 8.6 294 421 A D H X S+ 0 0 30 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.947 114.8 50.1 -60.8 -45.7 -19.5 25.0 12.3 295 422 A G H X S+ 0 0 2 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.845 107.1 53.4 -61.8 -35.5 -17.6 28.1 11.4 296 423 A N H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.919 108.6 49.6 -66.9 -40.5 -20.6 29.6 9.7 297 424 A H H X S+ 0 0 7 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.947 111.3 50.2 -61.2 -42.9 -22.7 29.1 12.8 298 425 A D H X S+ 0 0 14 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.920 108.7 51.1 -63.4 -42.4 -20.0 30.7 14.9 299 426 A W H X S+ 0 0 23 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.957 112.8 46.1 -60.5 -42.8 -19.7 33.7 12.6 300 427 A H H < S+ 0 0 1 -4,-2.3 3,-0.4 1,-0.2 -2,-0.2 0.955 112.8 50.7 -63.1 -45.6 -23.5 34.2 12.8 301 428 A R H < S+ 0 0 71 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.861 115.7 40.3 -57.1 -41.8 -23.5 33.8 16.6 302 429 A T H < S+ 0 0 41 -4,-2.3 2,-1.6 -5,-0.2 -1,-0.2 0.664 90.7 91.8 -88.7 -15.0 -20.7 36.3 17.3 303 430 A N X + 0 0 18 -4,-1.5 4,-1.9 -3,-0.4 3,-0.2 -0.586 39.5 157.3 -87.6 85.6 -21.7 39.0 14.7 304 431 A T T 4 + 0 0 97 -2,-1.6 -1,-0.2 1,-0.2 -2,-0.1 0.509 66.1 71.0 -91.1 -6.0 -24.0 41.2 16.9 305 432 A Y T 4 S+ 0 0 202 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.891 115.1 21.4 -64.4 -50.4 -23.4 44.1 14.5 306 433 A R T 4 S+ 0 0 109 -3,-0.2 2,-0.3 -6,-0.1 -2,-0.2 0.862 126.9 42.6 -85.9 -42.3 -25.5 42.5 11.8 307 434 A Y < + 0 0 12 -4,-1.9 2,-0.3 -7,-0.2 -85,-0.2 -0.727 50.4 169.1-116.4 156.1 -27.7 40.1 13.8 308 435 A S - 0 0 70 -87,-0.8 -84,-0.6 -2,-0.3 -83,-0.3 -0.959 31.6-105.7-154.6 164.9 -29.7 39.9 17.0 309 436 A L - 0 0 36 -2,-0.3 2,-0.1 -85,-0.1 -88,-0.1 -0.675 22.9-118.5-101.7 149.1 -32.2 37.4 18.6 310 437 A P - 0 0 9 0, 0.0 2,-1.6 0, 0.0 3,-0.2 -0.423 32.3-112.7 -70.2 157.2 -35.9 37.5 19.1 311 438 A D S S+ 0 0 140 1,-0.2 -62,-0.1 -2,-0.1 -2,-0.0 -0.533 72.2 128.0 -90.6 72.5 -37.3 37.3 22.6 312 439 A F 0 0 27 -2,-1.6 -1,-0.2 1,-0.1 -59,-0.0 0.252 360.0 360.0-111.6 7.1 -38.8 33.9 22.3 313 440 A W 0 0 119 -3,-0.2 -1,-0.1 0, 0.0 -2,-0.1 0.388 360.0 360.0-128.1 360.0 -37.3 32.3 25.3