==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE RECEPTOR 20-MAY-11 3AZ3 . COMPND 2 MOLECULE: VITAMIN D3 RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.ITOH,S.IIJIMA . 250 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12550.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 73.2 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 . 6 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 7 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 53.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 1 0 2 0 0 0 0 1 0 0 0 1 1 0 0 2 0 1 0 0 0 0 1 0 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 2 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 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 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 1 120 A L 0 0 201 0, 0.0 197,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.7 33.4 17.7 66.5 2 121 A R - 0 0 166 197,-0.0 193,-0.0 196,-0.0 0, 0.0 -0.644 360.0-167.5-120.4 71.9 33.1 15.4 63.4 3 122 A P - 0 0 66 0, 0.0 2,-0.1 0, 0.0 196,-0.1 -0.217 26.3-109.0 -59.0 151.8 30.9 12.4 64.6 4 123 A K - 0 0 188 1,-0.1 2,-0.2 195,-0.0 192,-0.1 -0.451 36.6 -94.1 -78.9 153.8 30.8 9.4 62.2 5 124 A L - 0 0 10 -2,-0.1 -1,-0.1 190,-0.1 187,-0.0 -0.546 45.2-127.4 -65.3 130.8 27.7 8.5 60.2 6 125 A S > - 0 0 51 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.255 24.3-105.4 -70.0 168.3 25.7 6.0 62.2 7 126 A E H > S+ 0 0 139 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.888 125.4 54.1 -65.1 -33.1 24.7 2.7 60.5 8 127 A E H > S+ 0 0 108 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.921 108.5 47.2 -63.3 -45.6 21.1 4.2 60.3 9 128 A Q H > S+ 0 0 28 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.830 112.2 50.3 -65.3 -35.0 22.5 7.4 58.5 10 129 A Q H X S+ 0 0 84 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.884 110.2 50.6 -66.6 -41.7 24.5 5.1 56.1 11 130 A R H X S+ 0 0 153 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.898 110.0 50.4 -61.1 -44.3 21.3 3.1 55.5 12 131 A I H X S+ 0 0 3 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.899 110.9 48.2 -62.0 -44.7 19.4 6.4 54.8 13 132 A I H X S+ 0 0 13 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.944 112.9 48.1 -63.5 -45.3 22.1 7.6 52.3 14 133 A A H X S+ 0 0 57 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.901 112.6 49.0 -61.8 -42.2 22.0 4.1 50.5 15 134 A I H X S+ 0 0 45 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.910 113.5 45.9 -63.6 -48.3 18.2 4.2 50.3 16 135 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.867 112.9 49.1 -64.9 -40.8 18.1 7.7 48.9 17 136 A L H X S+ 0 0 29 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.942 113.9 47.0 -62.3 -46.4 20.8 7.1 46.4 18 137 A D H X S+ 0 0 71 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.884 111.3 52.6 -60.4 -40.5 19.0 3.9 45.3 19 138 A A H X S+ 0 0 0 -4,-2.5 4,-0.7 2,-0.2 3,-0.2 0.928 111.2 45.6 -62.2 -44.9 15.7 5.9 45.1 20 139 A H H >X S+ 0 0 1 -4,-2.4 4,-1.6 1,-0.2 3,-1.1 0.927 110.8 53.2 -65.6 -43.4 17.3 8.5 42.8 21 140 A H H 3< S+ 0 0 108 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.778 112.1 46.0 -61.2 -29.7 18.9 5.8 40.6 22 141 A K H 3< S+ 0 0 139 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.544 121.4 36.7 -86.3 -14.8 15.5 4.2 40.2 23 142 A T H << S+ 0 0 13 -3,-1.1 2,-0.5 -4,-0.7 -2,-0.2 0.392 104.4 68.5-121.1 -2.5 13.7 7.5 39.5 24 143 A Y < - 0 0 29 -4,-1.6 -1,-0.1 -5,-0.1 43,-0.0 -0.981 58.9-161.4-125.4 120.2 16.1 9.6 37.4 25 144 A D > - 0 0 42 -2,-0.5 3,-1.6 1,-0.1 5,-0.1 -0.856 0.8-168.3-100.1 103.8 17.0 8.6 33.9 26 145 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.472 85.5 61.2 -72.8 1.6 20.3 10.4 33.0 27 146 A T T 3 S- 0 0 92 91,-0.0 -2,-0.0 92,-0.0 91,-0.0 0.544 95.9-138.9-100.2 -14.4 19.8 9.4 29.3 28 147 A Y X + 0 0 35 -3,-1.6 3,-1.2 1,-0.1 4,-0.3 0.818 44.7 157.9 59.7 36.0 16.5 11.3 28.9 29 148 A S T 3 + 0 0 68 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.620 62.1 55.5 -72.3 -14.2 15.3 8.3 26.9 30 149 A D T > S+ 0 0 46 1,-0.2 3,-2.3 -5,-0.1 4,-0.3 0.573 79.6 93.2 -92.3 -10.2 11.5 9.0 27.4 31 150 A F G X S+ 0 0 9 -3,-1.2 3,-1.3 1,-0.3 -1,-0.2 0.763 74.5 64.8 -55.9 -32.7 11.6 12.6 26.0 32 151 A C G 3 S+ 0 0 93 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.662 95.2 62.8 -65.3 -13.5 10.7 11.4 22.5 33 152 A Q G < S+ 0 0 147 -3,-2.3 -1,-0.2 2,-0.1 -2,-0.2 0.658 86.6 89.9 -85.5 -18.3 7.3 10.3 24.0 34 153 A F S < S- 0 0 24 -3,-1.3 25,-0.1 -4,-0.3 26,-0.1 -0.338 98.9 -81.3 -74.3 163.9 6.3 13.9 25.0 35 154 A R - 0 0 78 23,-0.4 -1,-0.1 1,-0.1 27,-0.1 -0.357 67.8 -93.8 -60.1 136.0 4.3 16.3 22.8 36 155 A P - 0 0 96 0, 0.0 23,-0.4 0, 0.0 -1,-0.1 -0.245 34.6-109.9 -62.7 146.1 7.0 17.8 20.5 37 156 A P - 0 0 23 0, 0.0 2,-0.4 0, 0.0 19,-0.2 -0.461 30.1-160.4 -67.3 145.3 8.7 21.0 21.2 38 157 A V - 0 0 70 17,-0.3 2,-0.6 -2,-0.1 21,-0.1 -0.995 6.7-170.6-130.3 119.7 7.7 23.9 18.9 39 158 A R - 0 0 90 -2,-0.4 2,-0.1 16,-0.1 3,-0.1 -0.920 15.9-176.9-119.2 97.3 10.1 26.9 18.6 40 159 A V - 0 0 41 -2,-0.6 2,-0.3 1,-0.1 -2,-0.0 -0.397 41.8 -72.4 -86.4 168.6 8.4 29.6 16.6 41 160 A N S S+ 0 0 160 1,-0.1 -1,-0.1 -2,-0.1 0, 0.0 -0.502 73.0 132.8 -67.2 118.0 9.6 33.0 15.5 42 161 A D > + 0 0 22 -2,-0.3 3,-1.6 -3,-0.1 -1,-0.1 -0.126 9.5 152.9-164.0 46.5 9.7 35.2 18.7 43 162 A G T 3 S+ 0 0 93 1,-0.3 -2,-0.0 2,-0.1 85,-0.0 0.779 80.8 46.3 -53.5 -32.1 13.1 36.9 18.6 44 163 A G T 3 S- 0 0 81 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.520 106.7-126.1 -89.5 -10.8 11.7 39.7 20.7 45 164 A G < - 0 0 27 -3,-1.6 2,-0.2 1,-0.2 -2,-0.1 0.860 33.4-161.5 64.6 39.6 10.0 37.5 23.2 46 216 A S > - 0 0 55 1,-0.1 4,-2.9 2,-0.0 -1,-0.2 -0.357 14.6-149.6 -57.1 121.0 6.6 39.3 22.6 47 217 A V H > S+ 0 0 99 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.893 98.0 51.2 -60.5 -42.7 4.2 38.6 25.6 48 218 A T H > S+ 0 0 118 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.913 113.6 43.4 -61.5 -47.4 1.2 38.8 23.2 49 219 A L H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.943 112.6 53.0 -65.4 -45.6 2.6 36.4 20.7 50 220 A E H X S+ 0 0 14 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.890 112.3 45.0 -56.6 -44.4 3.8 34.0 23.5 51 221 A L H < S+ 0 0 34 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.843 111.6 52.7 -69.2 -33.8 0.3 33.9 25.0 52 222 A S H < S+ 0 0 80 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.835 127.0 20.9 -70.2 -30.9 -1.4 33.4 21.6 53 223 A Q H < - 0 0 79 -4,-2.1 -2,-0.2 -5,-0.1 -3,-0.2 0.837 67.7-169.8-104.9 -44.4 0.8 30.5 20.7 54 224 A L >< + 0 0 2 -4,-2.9 3,-1.5 -5,-0.3 -3,-0.1 0.883 23.3 173.9 47.5 43.2 2.2 28.9 23.9 55 225 A S T 3 + 0 0 13 1,-0.3 4,-0.3 -5,-0.2 -17,-0.3 0.771 69.5 39.3 -52.5 -39.8 4.4 26.9 21.4 56 226 A M T 3> S+ 0 0 0 76,-1.3 4,-2.8 73,-0.2 -1,-0.3 0.457 93.0 90.2 -91.4 -5.7 6.6 25.2 24.1 57 227 A L H <> S+ 0 0 10 -3,-1.5 4,-3.2 75,-0.6 5,-0.3 0.921 82.2 50.9 -63.4 -48.4 3.8 24.6 26.6 58 228 A P H > S+ 0 0 28 0, 0.0 4,-1.9 0, 0.0 -23,-0.4 0.930 117.7 41.6 -55.1 -44.2 2.6 21.1 25.5 59 229 A H H > S+ 0 0 0 -23,-0.4 4,-2.3 -4,-0.3 -2,-0.2 0.939 117.9 45.1 -65.2 -51.0 6.3 19.8 25.6 60 230 A L H X S+ 0 0 23 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.839 112.5 51.7 -65.1 -33.7 7.2 21.6 28.8 61 231 A A H X S+ 0 0 5 -4,-3.2 4,-2.9 180,-0.3 -1,-0.2 0.896 111.0 47.9 -67.7 -39.8 4.0 20.5 30.6 62 232 A D H X S+ 0 0 27 -4,-1.9 4,-2.5 -5,-0.3 -2,-0.2 0.901 113.4 48.9 -65.7 -37.9 4.7 16.9 29.5 63 233 A L H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.933 114.9 43.2 -66.4 -45.3 8.3 17.3 30.8 64 234 A V H X S+ 0 0 33 -4,-2.8 4,-2.9 2,-0.2 -2,-0.2 0.918 114.3 50.5 -66.2 -43.1 7.1 18.8 34.1 65 235 A S H X S+ 0 0 11 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.927 112.0 47.6 -61.3 -42.9 4.3 16.2 34.5 66 236 A Y H X S+ 0 0 37 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.918 112.1 50.4 -61.9 -47.1 6.9 13.3 33.8 67 237 A S H X S+ 0 0 18 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.912 108.1 52.9 -59.5 -41.7 9.3 15.0 36.4 68 238 A I H X S+ 0 0 5 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.902 106.3 53.2 -61.7 -42.2 6.4 15.1 39.0 69 239 A Q H X S+ 0 0 118 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.903 110.3 47.3 -57.2 -44.9 5.7 11.4 38.5 70 240 A K H X S+ 0 0 66 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.887 110.7 52.0 -64.9 -35.4 9.4 10.7 39.2 71 241 A V H X S+ 0 0 2 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.925 108.2 51.0 -66.2 -44.1 9.3 13.0 42.3 72 242 A I H X S+ 0 0 59 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.941 112.1 48.2 -57.1 -47.2 6.2 11.0 43.6 73 243 A G H X S+ 0 0 26 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.878 113.2 46.6 -58.2 -45.0 8.2 7.8 43.1 74 244 A F H >< S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 4,-0.4 0.937 109.7 53.7 -63.7 -48.2 11.3 9.2 44.9 75 245 A A H >< S+ 0 0 0 -4,-3.0 3,-1.7 1,-0.3 6,-0.2 0.872 100.2 61.1 -56.9 -40.0 9.2 10.6 47.8 76 246 A K H 3< S+ 0 0 89 -4,-2.1 -1,-0.3 1,-0.3 6,-0.2 0.755 105.7 49.2 -59.5 -23.2 7.6 7.1 48.4 77 247 A M T << S+ 0 0 45 -3,-1.5 -1,-0.3 -4,-0.6 -2,-0.2 0.445 80.0 112.4 -97.5 -3.3 11.2 5.8 49.1 78 248 A I S X S- 0 0 3 -3,-1.7 3,-2.1 -4,-0.4 4,-0.5 -0.582 84.3-103.9 -69.4 126.3 12.3 8.5 51.6 79 249 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 110,-0.1 -0.351 106.1 12.5 -56.8 122.3 12.6 6.8 55.0 80 250 A G T >> S+ 0 0 12 -4,-0.1 3,-1.0 -2,-0.1 4,-0.7 0.077 94.5 106.8 98.2 -20.0 9.5 7.7 57.0 81 251 A F G X4 S+ 0 0 0 -3,-2.1 3,-0.6 1,-0.2 -5,-0.1 0.831 79.6 52.7 -57.9 -37.1 7.5 9.3 54.2 82 252 A R G 34 S+ 0 0 155 -4,-0.5 -1,-0.2 -6,-0.2 7,-0.1 0.685 98.6 65.5 -72.8 -19.3 5.1 6.3 54.1 83 253 A D G <4 S+ 0 0 126 -3,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.749 87.5 88.3 -72.7 -26.0 4.4 6.6 57.9 84 254 A L S << S- 0 0 6 -4,-0.7 -4,-0.0 -3,-0.6 2,-0.0 -0.333 94.8 -93.7 -69.8 154.9 2.8 10.0 57.2 85 255 A T > - 0 0 81 1,-0.1 4,-2.9 4,-0.0 5,-0.2 -0.336 31.5-117.7 -65.6 151.9 -1.0 10.2 56.5 86 256 A S H > S+ 0 0 90 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.765 117.9 56.8 -63.8 -24.1 -1.9 10.1 52.7 87 257 A E H > S+ 0 0 121 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.923 111.5 41.6 -70.5 -42.9 -3.4 13.6 53.2 88 258 A D H > S+ 0 0 1 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.894 111.7 55.5 -70.4 -41.3 -0.0 14.9 54.5 89 259 A Q H X S+ 0 0 26 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.914 112.0 44.2 -55.5 -44.9 1.9 12.9 51.8 90 260 A I H X S+ 0 0 74 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.868 111.3 52.1 -68.6 -42.0 -0.3 14.8 49.1 91 261 A V H X S+ 0 0 34 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.959 113.4 45.7 -59.6 -49.4 0.1 18.2 50.8 92 262 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.895 114.4 47.5 -60.4 -45.1 3.9 17.8 50.9 93 263 A L H X S+ 0 0 19 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.929 114.9 44.6 -65.4 -45.4 4.1 16.5 47.2 94 264 A K H < S+ 0 0 76 -4,-2.7 4,-0.4 1,-0.2 -2,-0.2 0.920 115.5 46.8 -64.0 -46.0 1.9 19.3 45.8 95 265 A S H < S+ 0 0 27 -4,-2.5 4,-0.2 -5,-0.2 -1,-0.2 0.809 120.8 36.6 -67.1 -33.5 3.6 22.1 47.7 96 266 A S H >X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 3,-0.5 0.577 87.3 100.5 -94.5 -15.9 7.2 21.0 46.9 97 267 A A H 3X S+ 0 0 1 -4,-1.5 4,-2.2 1,-0.2 5,-0.1 0.848 86.8 40.6 -38.4 -58.8 6.7 19.8 43.3 98 268 A I H 3> S+ 0 0 12 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.850 115.7 52.2 -65.3 -32.3 8.0 22.8 41.5 99 269 A E H <> S+ 0 0 1 -3,-0.5 4,-2.4 -4,-0.2 -2,-0.2 0.938 110.7 46.0 -67.9 -46.0 10.9 23.2 44.0 100 270 A V H X S+ 0 0 0 -4,-2.8 4,-3.5 2,-0.2 5,-0.2 0.869 110.7 54.8 -64.7 -37.1 12.1 19.6 43.6 101 271 A I H X S+ 0 0 18 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.925 108.3 48.4 -60.7 -43.7 11.8 20.0 39.8 102 272 A M H X S+ 0 0 11 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.923 115.1 46.1 -64.4 -39.9 14.1 23.0 40.0 103 273 A L H >< S+ 0 0 1 -4,-2.4 3,-1.3 1,-0.2 4,-0.3 0.950 115.6 43.8 -65.4 -52.7 16.5 21.0 42.2 104 274 A R H >< S+ 0 0 8 -4,-3.5 3,-1.4 1,-0.3 4,-0.3 0.821 103.8 64.5 -66.4 -30.0 16.5 17.8 40.0 105 275 A S H >X S+ 0 0 27 -4,-2.6 3,-1.1 1,-0.2 4,-0.9 0.684 85.2 78.5 -63.5 -18.9 16.8 19.8 36.8 106 276 A N T << S+ 0 0 13 -3,-1.3 3,-0.5 -4,-0.5 -1,-0.2 0.821 80.0 66.9 -60.8 -30.1 20.2 20.9 38.0 107 277 A E T <4 S+ 0 0 71 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.840 109.3 35.8 -60.8 -32.4 21.7 17.5 37.0 108 278 A S T <4 S+ 0 0 12 -3,-1.1 9,-2.3 -4,-0.3 -1,-0.2 0.538 95.8 108.4 -96.4 -9.1 21.1 18.4 33.3 109 279 A F E < -A 116 0A 2 -4,-0.9 2,-0.4 -3,-0.5 7,-0.3 -0.449 52.8-162.9 -69.9 140.8 21.9 22.0 33.7 110 280 A T E >>> -A 115 0A 30 5,-3.0 4,-1.3 -2,-0.1 5,-1.2 -0.984 25.3-158.2-131.8 129.9 25.2 23.2 32.2 111 281 A M T 345S+ 0 0 72 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.590 84.1 86.5 -75.9 -9.8 27.2 26.3 32.9 112 282 A D T 345S- 0 0 155 1,-0.2 -1,-0.2 3,-0.1 0, 0.0 0.908 123.2 -9.3 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0.679 92.8 68.7 -64.6 -19.9 28.7 25.9 41.8 153 323 A L T << S- 0 0 24 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.718 91.3-149.5 -68.8 -21.5 28.2 24.1 45.1 154 324 A N < - 0 0 127 -3,-1.6 -3,-0.1 -4,-0.4 -2,-0.1 0.937 21.0-156.6 49.4 54.7 29.4 20.9 43.3 155 325 A L - 0 0 35 -5,-0.4 -1,-0.1 -4,-0.1 2,-0.1 -0.330 13.0-121.4 -63.1 141.9 27.2 18.7 45.5 156 326 A H >> - 0 0 55 1,-0.1 4,-2.2 -2,-0.0 3,-0.6 -0.507 31.8-109.7 -72.2 154.4 28.0 15.0 45.9 157 327 A E H 3> S+ 0 0 71 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.893 121.8 58.2 -54.7 -37.5 25.2 12.8 44.8 158 328 A E H 3> S+ 0 0 53 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.877 108.7 44.3 -57.9 -41.4 24.6 12.0 48.5 159 329 A E H <> S+ 0 0 0 -3,-0.6 4,-2.7 2,-0.2 -1,-0.2 0.884 111.5 53.9 -72.2 -36.5 24.1 15.7 49.3 160 330 A H H X S+ 0 0 17 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.931 112.0 43.2 -65.5 -45.9 21.8 16.2 46.2 161 331 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.881 114.4 50.7 -69.1 -39.3 19.4 13.3 47.2 162 332 A L H X S+ 0 0 0 -4,-1.8 4,-2.8 -5,-0.3 -2,-0.2 0.934 109.3 51.6 -64.4 -42.3 19.4 14.5 50.8 163 333 A L H X S+ 0 0 2 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.910 110.4 47.5 -61.7 -41.7 18.6 18.1 49.7 164 334 A M H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.917 113.3 49.1 -65.7 -40.9 15.6 16.9 47.6 165 335 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.929 111.2 48.4 -64.6 -43.9 14.3 14.7 50.5 166 336 A I H < S+ 0 0 3 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.904 110.1 54.1 -61.6 -41.7 14.6 17.6 53.0 167 337 A C H < S+ 0 0 0 -4,-2.3 3,-0.3 -5,-0.2 -1,-0.2 0.930 112.1 43.3 -56.8 -50.0 12.8 19.9 50.5 168 338 A I H < S+ 0 0 0 -4,-2.1 2,-1.6 1,-0.2 -2,-0.2 0.913 109.4 55.9 -62.3 -50.7 9.8 17.4 50.2 169 339 A V S < S+ 0 0 0 -4,-2.4 -1,-0.2 -5,-0.1 17,-0.1 -0.582 75.4 148.5 -88.9 68.4 9.5 16.6 53.9 170 340 A S - 0 0 4 -2,-1.6 3,-0.3 -3,-0.3 13,-0.1 -0.942 38.3-159.1-108.0 121.4 9.0 20.2 55.1 171 341 A P S S+ 0 0 18 0, 0.0 2,-0.8 0, 0.0 5,-0.1 0.700 84.1 72.4 -73.8 -15.1 6.8 20.8 58.2 172 342 A D + 0 0 101 7,-0.1 7,-0.0 3,-0.1 -2,-0.0 -0.464 67.9 119.0 -98.2 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15.7 59.4 183 353 A E H X S+ 0 0 101 -4,-3.2 4,-3.3 1,-0.2 -1,-0.2 0.873 109.4 52.2 -59.7 -41.3 9.8 17.7 61.4 184 354 A A H X S+ 0 0 56 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.876 111.7 47.0 -63.3 -37.5 11.1 14.5 63.0 185 355 A I H X S+ 0 0 5 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.946 115.6 45.1 -68.9 -46.3 11.4 12.9 59.5 186 356 A Q H X S+ 0 0 32 -4,-2.8 4,-3.4 1,-0.2 -2,-0.2 0.898 110.1 54.1 -63.8 -42.6 13.2 16.1 58.2 187 357 A D H X S+ 0 0 67 -4,-3.3 4,-2.7 2,-0.2 -1,-0.2 0.888 106.7 52.1 -59.5 -39.5 15.5 16.4 61.3 188 358 A R H X S+ 0 0 80 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.905 115.1 42.8 -61.2 -42.1 16.6 12.8 60.7 189 359 A L H X S+ 0 0 1 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.915 114.5 49.6 -68.5 -47.3 17.4 13.7 57.1 190 360 A S H X S+ 0 0 9 -4,-3.4 4,-2.7 1,-0.2 -2,-0.2 0.877 110.1 50.6 -62.2 -41.1 19.0 17.1 58.1 191 361 A N H X S+ 0 0 90 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.900 109.4 51.8 -64.3 -39.6 21.3 15.5 60.7 192 362 A T H X S+ 0 0 0 -4,-1.5 4,-3.0 -5,-0.2 -2,-0.2 0.939 112.3 46.5 -61.0 -49.9 22.4 12.9 58.1 193 363 A L H X S+ 0 0 1 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.920 113.5 46.4 -58.4 -51.4 23.3 15.7 55.7 194 364 A Q H X S+ 0 0 76 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.925 115.9 46.2 -59.5 -44.5 25.2 17.9 58.3 195 365 A T H X S+ 0 0 10 -4,-2.5 4,-1.8 1,-0.2 5,-0.2 0.913 112.9 51.5 -62.2 -46.3 27.1 14.7 59.5 196 366 A Y H X>S+ 0 0 12 -4,-3.0 4,-2.9 -5,-0.2 5,-0.6 0.913 110.5 47.3 -58.0 -49.0 27.8 13.7 55.9 197 367 A I H X5S+ 0 0 21 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.957 112.1 49.7 -58.9 -51.0 29.2 17.2 55.0 198 368 A R H <5S+ 0 0 93 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.798 124.5 28.0 -59.0 -34.7 31.5 17.4 58.1 199 369 A C H <5S+ 0 0 32 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.696 132.4 27.3-104.5 -18.4 33.0 13.9 57.6 200 370 A R H <5S+ 0 0 130 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.634 94.9 85.1-117.9 -21.2 32.9 13.3 53.7 201 371 A H S < 0 0 161 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -4.5 29.6 26.7 55.3 207 379 A L H > + 0 0 21 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.902 360.0 50.5 -60.3 -45.0 28.2 24.2 52.8 208 380 A Y H > S+ 0 0 53 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.939 111.7 48.2 -59.2 -46.2 25.2 23.2 55.0 209 381 A A H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.865 111.4 50.9 -60.4 -37.3 24.3 26.9 55.5 210 382 A K H X S+ 0 0 96 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.869 110.3 49.1 -68.2 -37.1 24.6 27.4 51.6 211 383 A M H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.880 110.4 51.1 -68.4 -37.8 22.3 24.4 51.0 212 384 A I H X S+ 0 0 69 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.871 107.9 52.6 -64.7 -41.3 19.7 25.8 53.6 213 385 A Q H X S+ 0 0 104 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.900 104.6 56.4 -62.6 -38.0 19.8 29.2 51.7 214 386 A K H X S+ 0 0 29 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.902 104.6 52.2 -60.4 -39.1 19.1 27.3 48.5 215 387 A L H X S+ 0 0 23 -4,-1.5 4,-1.2 2,-0.2 -1,-0.2 0.893 110.5 47.5 -62.2 -40.1 15.9 25.9 50.2 216 388 A A H X S+ 0 0 46 -4,-1.7 4,-1.4 1,-0.2 3,-0.5 0.927 109.8 53.0 -66.9 -41.1 14.9 29.5 51.1 217 389 A D H X S+ 0 0 47 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.861 104.8 57.3 -58.6 -37.3 15.6 30.6 47.5 218 490 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.835 100.5 56.4 -63.7 -36.5 13.3 27.7 46.4 219 491 A R H X S+ 0 0 65 -4,-1.2 4,-2.1 -3,-0.5 -1,-0.2 0.913 108.3 47.1 -60.9 -45.0 10.4 29.2 48.4 220 492 A S H X S+ 0 0 84 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.912 112.9 48.4 -62.4 -45.3 10.7 32.5 46.6 221 493 A L H X S+ 0 0 7 -4,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.877 109.3 53.9 -62.3 -37.3 10.8 30.8 43.2 222 494 A N H X S+ 0 0 29 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.940 109.6 47.3 -61.6 -47.2 7.8 28.7 44.2 223 495 A E H X S+ 0 0 128 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.894 114.1 47.2 -61.7 -42.7 5.8 31.9 45.0 224 496 A E H X S+ 0 0 48 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.935 112.3 49.6 -67.0 -43.9 6.8 33.5 41.7 225 497 A H H X S+ 0 0 17 -4,-3.1 4,-2.9 1,-0.2 -2,-0.2 0.906 108.7 52.7 -60.1 -43.5 6.0 30.3 39.7 226 498 A S H X S+ 0 0 44 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.895 109.2 49.7 -59.0 -42.9 2.5 30.1 41.4 227 499 A K H X S+ 0 0 127 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.916 114.2 45.5 -62.3 -43.6 1.8 33.8 40.4 228 400 A Q H X S+ 0 0 14 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.883 108.9 54.5 -69.9 -36.9 2.8 33.1 36.8 229 401 A Y H X S+ 0 0 17 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.899 105.9 54.9 -60.7 -44.0 0.9 29.8 36.6 230 402 A R H X S+ 0 0 120 -4,-2.0 4,-0.8 2,-0.2 -2,-0.2 0.940 109.6 45.3 -53.2 -52.4 -2.2 31.9 37.7 231 403 A C H >< S+ 0 0 64 -4,-1.7 3,-1.1 1,-0.2 4,-0.4 0.921 113.8 49.9 -58.8 -46.6 -1.7 34.3 34.7 232 404 A L H >< S+ 0 0 4 -4,-2.5 3,-1.9 1,-0.2 -1,-0.2 0.889 103.2 60.0 -59.8 -38.6 -1.2 31.4 32.3 233 405 A S H 3< S+ 0 0 57 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.686 96.8 62.4 -64.5 -20.7 -4.3 29.6 33.6 234 406 A F T << S+ 0 0 153 -3,-1.1 -1,-0.3 -4,-0.8 -2,-0.2 0.617 78.0 104.7 -78.4 -14.8 -6.4 32.7 32.4 235 407 A Q S X S- 0 0 59 -3,-1.9 3,-2.0 -4,-0.4 4,-0.3 -0.538 86.0-108.2 -71.5 119.2 -5.3 32.0 28.8 236 408 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.256 99.4 6.6 -51.9 136.5 -8.3 30.5 26.9 237 409 A E T > S+ 0 0 135 -4,-0.1 3,-0.7 1,-0.1 4,-0.4 0.537 88.0 129.4 67.2 14.2 -7.8 26.7 26.1 238 410 A C G X + 0 0 3 -3,-2.0 3,-1.7 1,-0.2 4,-0.4 0.875 60.9 67.3 -62.8 -36.7 -4.5 26.6 28.2 239 411 A S G > S+ 0 0 72 -4,-0.3 3,-1.2 1,-0.3 -1,-0.2 0.808 92.5 60.1 -56.4 -29.8 -5.8 23.5 30.1 240 412 A M G < S+ 0 0 131 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.754 103.0 52.5 -66.9 -26.8 -5.6 21.4 26.8 241 413 A K G < S+ 0 0 54 -3,-1.7 -180,-0.3 -4,-0.4 -1,-0.3 0.446 108.7 60.0 -88.6 -7.2 -1.8 22.2 26.7 242 414 A L S < S- 0 0 11 -3,-1.2 -180,-0.1 -4,-0.4 3,-0.1 0.012 84.8-113.9 -98.2-154.3 -1.3 21.0 30.3 243 415 A T > - 0 0 17 1,-0.1 4,-2.7 -182,-0.1 5,-0.2 -0.967 25.9-108.0-139.8 158.9 -1.9 17.5 31.9 244 416 A P H > S+ 0 0 115 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.912 122.0 50.6 -54.1 -41.8 -4.3 16.3 34.6 245 417 A L H > S+ 0 0 39 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.928 111.0 46.6 -62.6 -46.2 -1.4 16.0 37.0 246 418 A V H > S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 5,-0.5 0.920 111.6 53.4 -59.9 -45.7 -0.1 19.6 36.3 247 419 A L H X S+ 0 0 65 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.860 113.0 42.6 -59.4 -37.5 -3.7 20.8 36.7 248 420 A E H < S+ 0 0 99 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.960 116.4 46.6 -72.7 -48.9 -4.1 19.2 40.1 249 421 A V H < S+ 0 0 21 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.889 129.5 21.1 -60.3 -43.6 -0.6 20.2 41.4 250 422 A F H < 0 0 36 -4,-2.6 -1,-0.2 -5,-0.2 -3,-0.2 0.671 360.0 360.0-101.4 -24.3 -0.7 23.9 40.3 251 423 A G < 0 0 105 -4,-1.3 -21,-0.0 -5,-0.5 -22,-0.0 -0.146 360.0 360.0 -94.0 360.0 -4.4 24.6 39.9