==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GENE REGULATION 08-MAY-01 1ILG . COMPND 2 MOLECULE: ORPHAN NUCLEAR RECEPTOR PXR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.E.WATKINS,M.R.REDINBO . 270 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 20 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 125 46.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 0 0 0 1 1 0 0 0 0 1 0 0 1 1 1 0 0 0 0 0 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 1 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 142 A G 0 0 90 0, 0.0 2,-0.4 0, 0.0 215,-0.1 0.000 360.0 360.0 360.0 177.1 -5.3 43.9 13.3 2 143 A L - 0 0 35 214,-0.1 210,-0.0 213,-0.1 2,-0.0 -0.699 360.0-134.7 -89.7 136.5 -7.1 47.1 12.3 3 144 A T > - 0 0 65 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.231 27.2-105.2 -78.9 173.3 -10.5 47.9 13.8 4 145 A E H > S+ 0 0 113 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.909 122.6 53.7 -66.2 -40.8 -13.5 49.1 11.8 5 146 A E H > S+ 0 0 88 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.840 111.5 45.2 -61.6 -36.0 -13.0 52.6 13.2 6 147 A Q H > S+ 0 0 16 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.914 113.5 48.9 -74.4 -44.5 -9.3 52.6 12.1 7 148 A R H X S+ 0 0 132 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.899 112.3 48.5 -61.5 -42.5 -10.2 51.2 8.6 8 149 A M H X S+ 0 0 117 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.913 110.5 53.5 -63.1 -40.7 -12.9 53.8 8.2 9 150 A M H X S+ 0 0 0 -4,-1.6 4,-1.5 -5,-0.2 -2,-0.2 0.906 109.8 45.4 -59.8 -47.7 -10.4 56.5 9.3 10 151 A I H X S+ 0 0 16 -4,-2.5 4,-3.3 1,-0.2 5,-0.2 0.903 110.5 56.0 -65.7 -39.8 -7.8 55.5 6.7 11 152 A R H X S+ 0 0 176 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.879 107.9 45.4 -62.7 -39.5 -10.4 55.3 4.0 12 153 A E H X S+ 0 0 40 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.815 114.7 50.8 -73.0 -27.8 -11.7 58.9 4.5 13 154 A L H X S+ 0 0 0 -4,-1.5 4,-2.0 -5,-0.2 -2,-0.2 0.944 113.8 42.8 -70.1 -50.5 -8.0 60.0 4.6 14 155 A M H X S+ 0 0 46 -4,-3.3 4,-2.7 2,-0.2 5,-0.2 0.910 113.8 52.4 -62.3 -43.3 -7.2 58.1 1.4 15 156 A D H X S+ 0 0 43 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.925 110.0 47.4 -59.1 -47.8 -10.4 59.3 -0.2 16 157 A A H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.865 111.7 53.4 -61.9 -36.5 -9.6 63.0 0.7 17 158 A Q H >X S+ 0 0 8 -4,-2.0 4,-2.0 2,-0.2 3,-0.5 0.944 109.8 44.3 -66.1 -50.4 -6.1 62.5 -0.7 18 159 A M H 3< S+ 0 0 128 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.856 113.6 52.2 -65.7 -31.8 -7.1 61.1 -4.1 19 160 A K H 3< S+ 0 0 123 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.724 123.2 26.4 -75.2 -22.2 -9.8 63.8 -4.5 20 161 A T H << S+ 0 0 25 -4,-1.1 2,-0.8 -3,-0.5 -2,-0.2 0.475 99.0 84.3-122.0 -4.1 -7.5 66.7 -3.7 21 162 A F < - 0 0 23 -4,-2.0 2,-1.7 -5,-0.1 -1,-0.1 -0.876 57.7-161.2-106.2 104.8 -3.9 65.7 -4.7 22 163 A D > - 0 0 41 -2,-0.8 3,-2.4 1,-0.2 6,-0.1 -0.643 9.5-173.8 -84.6 82.4 -3.4 66.3 -8.4 23 164 A T T 3 S+ 0 0 86 -2,-1.7 119,-0.3 1,-0.3 -1,-0.2 0.672 81.4 46.8 -53.6 -23.5 -0.3 64.0 -8.7 24 165 A T T 3 S- 0 0 69 117,-0.1 119,-0.4 -3,-0.1 -1,-0.3 0.412 100.2-133.0-100.2 -0.1 0.3 65.0 -12.3 25 166 A F X + 0 0 11 -3,-2.4 3,-1.9 117,-0.1 -2,-0.1 0.763 52.7 151.8 55.2 25.6 -0.0 68.8 -11.6 26 167 A S T 3 + 0 0 72 1,-0.3 -1,-0.1 116,-0.0 -3,-0.0 0.841 67.7 50.4 -53.2 -38.9 -2.3 68.9 -14.7 27 168 A H T 3 S+ 0 0 141 -5,-0.1 2,-0.7 2,-0.0 -1,-0.3 0.226 85.1 101.1 -89.3 13.6 -4.2 71.9 -13.3 28 169 A F < + 0 0 21 -3,-1.9 2,-0.3 -6,-0.1 58,-0.0 -0.890 51.6 119.4-101.6 111.5 -1.1 74.0 -12.5 29 170 A K + 0 0 141 -2,-0.7 3,-0.1 1,-0.1 -2,-0.0 -0.960 37.2 58.3-160.1 173.9 -0.6 76.6 -15.1 30 171 A N S S+ 0 0 159 -2,-0.3 2,-0.1 1,-0.2 -1,-0.1 0.621 74.7 150.2 72.0 11.9 -0.4 80.3 -15.9 31 172 A F - 0 0 40 1,-0.1 -1,-0.2 54,-0.0 51,-0.1 -0.397 49.4-103.9 -77.0 154.9 2.5 80.5 -13.4 32 173 A R - 0 0 107 49,-0.3 -1,-0.1 -3,-0.1 53,-0.1 -0.329 31.9-158.6 -75.0 157.1 5.3 82.9 -13.6 33 174 A L - 0 0 78 -2,-0.1 2,-0.3 49,-0.1 3,-0.1 -0.928 34.4 -82.8-132.8 158.3 8.8 82.0 -14.8 34 175 A P - 0 0 13 0, 0.0 45,-0.1 0, 0.0 44,-0.1 -0.480 66.2 -85.8 -66.8 123.4 12.2 83.5 -14.2 35 176 A G 0 0 71 -2,-0.3 43,-0.0 43,-0.2 -3,-0.0 0.211 360.0 360.0 -27.4 135.6 12.8 86.4 -16.7 36 177 A V 0 0 156 -3,-0.1 -1,-0.1 0, 0.0 -3,-0.0 -0.334 360.0 360.0 -80.2 360.0 14.1 85.4 -20.1 37 ! 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 38 198 A K > 0 0 125 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 162.2 23.2 94.9 5.6 39 199 A W G >> + 0 0 85 1,-0.3 4,-1.7 2,-0.2 3,-0.5 0.747 360.0 80.9 -63.4 -23.1 20.4 92.4 6.5 40 200 A S G 34 S+ 0 0 47 1,-0.2 -1,-0.3 2,-0.2 217,-0.0 0.721 76.2 77.5 -56.0 -20.2 20.7 91.1 3.0 41 201 A Q G X4 S+ 0 0 75 -3,-1.8 3,-1.2 1,-0.2 -1,-0.2 0.980 104.5 28.5 -53.8 -65.5 23.7 89.1 4.3 42 202 A V T <4 S+ 0 0 76 -3,-0.5 -1,-0.2 -4,-0.3 -2,-0.2 0.790 107.0 78.4 -67.2 -25.8 21.7 86.4 6.1 43 203 A R T >< + 0 0 7 -4,-1.7 3,-0.6 1,-0.3 -1,-0.3 0.398 67.5 93.9 -64.2 6.5 19.0 87.0 3.5 44 204 A K G X + 0 0 55 -3,-1.2 3,-0.8 1,-0.2 -1,-0.3 -0.169 45.2 116.2 -91.8 38.6 21.3 84.9 1.3 45 205 A D G > + 0 0 31 1,-0.2 3,-2.0 -3,-0.2 4,-0.3 0.666 54.0 79.8 -78.7 -20.2 19.2 81.9 2.3 46 206 A L G <> S+ 0 0 22 -3,-0.6 4,-0.8 1,-0.3 3,-0.4 0.510 78.3 73.3 -66.3 -2.9 18.1 81.4 -1.4 47 207 A C G <4 S+ 0 0 60 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.1 0.627 84.2 63.9 -85.1 -15.8 21.5 79.8 -1.9 48 208 A S T <4 S+ 0 0 47 -3,-2.0 -1,-0.2 -4,-0.1 -2,-0.2 0.595 102.4 55.1 -81.0 -12.7 20.4 76.7 -0.0 49 209 A L T 4 + 0 0 75 -3,-0.4 100,-0.3 -4,-0.3 -2,-0.2 0.920 63.0 154.3 -80.7 -88.0 17.9 76.2 -2.8 50 210 A K < + 0 0 65 -4,-0.8 99,-1.6 1,-0.2 2,-0.4 0.971 19.8 160.3 52.9 87.3 19.6 76.1 -6.2 51 211 A V E -A 148 0A 5 97,-0.2 2,-0.3 98,-0.1 97,-0.2 -0.999 34.6-136.8-138.8 139.6 17.4 74.0 -8.5 52 212 A S E -A 147 0A 16 95,-2.6 95,-1.7 -2,-0.4 2,-0.4 -0.697 23.3-141.1 -92.2 149.6 17.2 73.8 -12.2 53 213 A L E -AB 146 65A 2 12,-1.3 12,-3.3 -2,-0.3 2,-0.4 -0.885 13.1-166.4-115.6 143.1 13.7 73.8 -13.7 54 214 A Q E -AB 145 64A 60 91,-1.9 91,-1.9 -2,-0.4 2,-0.5 -0.997 3.1-167.5-130.7 133.6 12.4 71.7 -16.7 55 215 A L E -AB 144 63A 38 8,-3.1 8,-2.7 -2,-0.4 2,-0.7 -0.949 7.0-160.3-123.5 109.0 9.2 72.3 -18.6 56 216 A R E - B 0 62A 69 87,-3.1 6,-0.2 -2,-0.5 5,-0.1 -0.796 17.7-138.6 -92.5 112.4 8.1 69.5 -20.9 57 217 A G > - 0 0 27 4,-3.2 3,-1.6 -2,-0.7 -1,-0.0 -0.282 17.7-120.5 -68.7 154.5 5.6 70.7 -23.5 58 218 A E T 3 S+ 0 0 84 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.565 114.4 59.1 -69.2 -7.2 2.6 68.6 -24.5 59 219 A D T 3 S- 0 0 131 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.435 126.8 -94.8-100.7 -3.1 4.1 68.8 -28.0 60 220 A G S < S+ 0 0 66 -3,-1.6 -2,-0.1 1,-0.4 2,-0.1 0.335 83.6 131.3 105.7 -6.3 7.4 67.2 -27.2 61 221 A S - 0 0 49 -5,-0.1 -4,-3.2 1,-0.0 2,-0.4 -0.426 42.1-151.3 -79.8 156.8 9.3 70.4 -26.6 62 222 A V E -B 56 0A 82 -6,-0.2 2,-0.4 -2,-0.1 -6,-0.2 -0.989 8.7-166.9-135.5 126.8 11.5 71.0 -23.6 63 223 A W E -B 55 0A 196 -8,-2.7 -8,-3.1 -2,-0.4 2,-0.4 -0.919 12.9-168.6-109.2 135.5 12.4 74.3 -21.8 64 224 A N E -B 54 0A 95 -2,-0.4 2,-0.4 -10,-0.2 -10,-0.2 -0.985 6.4-159.0-130.3 135.4 15.2 74.2 -19.3 65 225 A Y E -B 53 0A 50 -12,-3.3 -12,-1.3 -2,-0.4 -2,-0.0 -0.939 3.6-168.3-117.1 135.7 16.2 76.8 -16.7 66 226 A K - 0 0 145 -2,-0.4 -14,-0.1 -14,-0.2 -2,-0.0 -0.985 26.2-128.5-120.9 117.1 19.6 77.1 -15.1 67 227 A P - 0 0 7 0, 0.0 9,-0.1 0, 0.0 -15,-0.0 -0.222 22.9-110.5 -64.8 154.1 19.7 79.5 -12.1 68 228 A P - 0 0 48 0, 0.0 2,-0.4 0, 0.0 7,-0.0 0.017 31.5-102.5 -73.1-177.2 22.3 82.3 -11.8 69 229 A A - 0 0 77 2,-0.0 2,-0.3 1,-0.0 -22,-0.0 -0.898 40.2 -94.3-113.8 143.2 25.2 82.6 -9.3 70 230 A D + 0 0 76 -2,-0.4 2,-0.3 2,-0.1 4,-0.1 -0.368 69.4 139.2 -56.4 115.2 25.2 84.8 -6.2 71 231 A S - 0 0 76 -2,-0.3 2,-2.0 2,-0.2 5,-0.1 -0.954 61.8 -14.4-161.5 141.5 26.9 88.0 -7.3 72 232 A G S S- 0 0 98 -2,-0.3 -2,-0.1 1,-0.1 3,-0.1 -0.420 103.0 -82.3 65.9 -84.3 26.3 91.7 -6.7 73 233 A G S > S+ 0 0 43 -2,-2.0 2,-0.9 1,-0.1 3,-0.8 -0.138 98.2 56.5-172.2 -86.5 22.8 91.5 -5.3 74 234 A K T 3 S+ 0 0 90 1,-0.2 -1,-0.1 2,-0.1 -4,-0.0 -0.653 80.0 76.3 -84.2 105.6 19.4 91.2 -7.0 75 235 A E T > S+ 0 0 45 -2,-0.9 3,-0.7 -3,-0.1 -1,-0.2 0.143 74.9 77.9-177.5 -13.5 19.2 88.2 -9.3 76 236 A I T < S+ 0 0 44 -3,-0.8 3,-0.3 1,-0.2 -2,-0.1 0.414 86.5 65.3 -88.1 -1.1 18.8 85.5 -6.7 77 237 A F T > S+ 0 0 31 1,-0.2 3,-0.8 2,-0.1 -1,-0.2 0.285 71.9 101.1-100.3 4.3 15.1 86.5 -6.5 78 238 A S T < S+ 0 0 36 -3,-0.7 4,-0.3 1,-0.2 -43,-0.2 0.775 84.2 41.9 -61.9 -28.6 14.6 85.4 -10.0 79 239 A L T 3> S+ 0 0 14 -3,-0.3 4,-2.4 1,-0.1 -1,-0.2 0.511 90.0 89.3-100.6 -3.1 12.9 82.2 -9.0 80 240 A L H <> S+ 0 0 19 -3,-0.8 4,-2.4 2,-0.2 5,-0.2 0.915 84.1 52.1 -60.9 -47.3 10.7 83.5 -6.1 81 241 A P H > S+ 0 0 37 0, 0.0 4,-2.1 0, 0.0 -49,-0.3 0.955 113.6 44.9 -55.9 -48.3 7.7 84.4 -8.2 82 242 A H H > S+ 0 0 0 -4,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.941 113.4 48.5 -58.5 -51.6 7.6 80.9 -9.7 83 243 A M H X S+ 0 0 43 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.830 109.6 54.7 -60.4 -31.0 8.2 79.2 -6.4 84 244 A A H X S+ 0 0 1 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.896 106.7 50.6 -70.0 -38.4 5.4 81.3 -4.9 85 245 A D H X S+ 0 0 32 -4,-2.1 4,-1.8 -5,-0.2 -2,-0.2 0.829 111.5 47.9 -68.9 -30.3 3.0 80.2 -7.6 86 246 A M H X S+ 0 0 5 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.930 110.5 51.6 -73.7 -44.5 3.8 76.5 -6.9 87 247 A S H X S+ 0 0 38 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.889 110.7 47.9 -57.1 -43.3 3.4 77.0 -3.2 88 248 A T H X S+ 0 0 15 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.936 110.6 51.1 -65.2 -46.9 0.0 78.5 -3.6 89 249 A Y H X S+ 0 0 47 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.938 115.1 43.3 -55.3 -48.2 -1.1 75.8 -6.0 90 250 A M H X S+ 0 0 8 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.925 110.5 55.1 -62.7 -47.0 0.1 73.2 -3.4 91 251 A F H X S+ 0 0 6 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.881 105.2 53.3 -55.0 -41.0 -1.5 75.1 -0.5 92 252 A K H X S+ 0 0 112 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.898 107.9 51.1 -61.6 -40.5 -4.8 75.1 -2.3 93 253 A G H X S+ 0 0 13 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.911 111.5 47.7 -62.1 -43.0 -4.6 71.3 -2.6 94 254 A I H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.866 110.4 50.6 -67.0 -38.7 -3.8 71.0 1.1 95 255 A I H X S+ 0 0 33 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.931 111.2 48.7 -66.0 -43.1 -6.7 73.3 2.1 96 256 A S H X S+ 0 0 61 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.878 108.1 57.0 -61.7 -38.6 -9.1 71.2 0.0 97 257 A F H >< S+ 0 0 0 -4,-2.0 3,-0.6 -5,-0.2 -2,-0.2 0.947 110.1 42.2 -56.1 -53.6 -7.6 68.1 1.7 98 258 A A H >< S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 6,-0.3 0.912 109.8 55.7 -62.7 -46.4 -8.5 69.3 5.2 99 259 A K H 3< S+ 0 0 97 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.703 104.2 55.6 -62.3 -19.6 -12.0 70.7 4.4 100 260 A V T << S+ 0 0 41 -4,-1.1 2,-0.6 -3,-0.6 -1,-0.3 0.406 88.0 93.9 -94.2 2.7 -13.0 67.3 2.9 101 261 A I X> - 0 0 0 -3,-1.8 4,-2.4 1,-0.2 3,-1.4 -0.861 68.6-147.0-100.0 118.5 -12.1 65.4 6.2 102 262 A S H 3> S+ 0 0 30 -2,-0.6 4,-2.5 1,-0.3 5,-0.2 0.906 98.7 54.9 -47.0 -53.8 -15.0 65.0 8.6 103 263 A Y H 34 S+ 0 0 48 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.791 113.2 44.8 -54.3 -28.1 -12.8 65.2 11.7 104 264 A F H X4 S+ 0 0 0 -3,-1.4 3,-0.8 -6,-0.3 -1,-0.2 0.874 110.3 51.9 -83.8 -40.7 -11.6 68.6 10.4 105 265 A R H 3< S+ 0 0 125 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.881 103.5 59.0 -62.8 -38.7 -15.0 70.0 9.3 106 266 A D T 3< S+ 0 0 130 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.719 88.4 93.2 -64.8 -21.1 -16.5 69.3 12.8 107 267 A L S < S- 0 0 10 -3,-0.8 2,-0.1 -4,-0.3 5,-0.1 -0.335 94.9 -88.4 -70.9 156.2 -13.9 71.5 14.4 108 268 A P >> - 0 0 47 0, 0.0 4,-1.6 0, 0.0 3,-1.3 -0.431 37.5-115.6 -67.1 139.1 -14.8 75.1 15.0 109 269 A I H 3> S+ 0 0 95 1,-0.3 4,-1.6 2,-0.2 5,-0.2 0.784 114.1 55.0 -43.8 -40.8 -13.9 77.4 12.1 110 270 A E H 3> S+ 0 0 113 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.897 108.5 49.0 -64.8 -37.8 -11.4 79.4 14.0 111 271 A D H <> S+ 0 0 0 -3,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.797 104.3 58.5 -71.9 -28.7 -9.5 76.2 14.9 112 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26.7 69.4 -10.3 152 312 A A S S- 0 0 114 -3,-0.4 -2,-0.1 3,-0.0 -3,-0.0 0.527 137.6 -15.5-120.2 -42.0 29.5 71.9 -11.0 153 313 A G S S+ 0 0 39 -4,-0.3 -3,-0.1 2,-0.0 -4,-0.0 0.595 107.7 102.0-132.0 -43.8 30.4 72.4 -7.3 154 314 A G - 0 0 40 -5,-0.4 2,-0.4 1,-0.1 -4,-0.0 0.020 59.5-140.4 -45.8 154.4 27.6 70.9 -5.1 155 315 A F > - 0 0 145 1,-0.1 3,-2.4 -4,-0.0 -4,-0.1 -0.968 16.1-131.4-126.8 140.4 28.2 67.5 -3.6 156 316 A Q T 3 S+ 0 0 86 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.597 112.1 53.6 -61.9 -10.9 25.8 64.6 -3.1 157 317 A Q T 3 S+ 0 0 90 1,-0.2 2,-0.8 2,-0.0 -1,-0.3 0.410 78.6 96.0-102.9 -1.3 27.1 64.5 0.5 158 318 A L X + 0 0 93 -3,-2.4 2,-0.6 1,-0.2 3,-0.5 -0.140 40.8 136.1 -82.9 40.7 26.3 68.1 1.2 159 319 A L T 3 + 0 0 51 -2,-0.8 -1,-0.2 1,-0.2 6,-0.2 -0.073 23.5 121.1 -78.7 33.9 23.0 67.2 2.8 160 320 A L T 3 + 0 0 131 -2,-0.6 -1,-0.2 4,-0.1 3,-0.1 0.547 48.3 98.6 -74.2 -6.0 23.7 69.6 5.6 161 321 A E S <> S- 0 0 42 -3,-0.5 4,-2.6 1,-0.2 5,-0.3 -0.760 71.9-148.2 -86.6 110.6 20.4 71.2 4.4 162 322 A P H > S+ 0 0 36 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.865 94.9 54.8 -42.6 -51.7 17.6 70.0 6.7 163 323 A M H > S+ 0 0 28 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.947 113.0 40.6 -49.5 -59.4 15.0 70.2 4.0 164 324 A L H > S+ 0 0 25 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.905 114.6 51.0 -59.2 -46.9 17.0 68.0 1.6 165 325 A K H X S+ 0 0 104 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.910 108.5 54.7 -58.4 -41.3 18.1 65.5 4.3 166 326 A F H X S+ 0 0 3 -4,-2.9 4,-2.6 -5,-0.3 5,-0.3 0.920 108.8 47.4 -58.4 -45.0 14.5 65.3 5.3 167 327 A H H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.878 112.9 47.5 -66.6 -38.7 13.4 64.3 1.8 168 328 A Y H X S+ 0 0 64 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.934 115.4 44.5 -68.4 -45.3 16.1 61.7 1.3 169 329 A M H X S+ 0 0 92 -4,-2.6 4,-0.9 -5,-0.2 -2,-0.2 0.955 114.8 47.4 -64.0 -50.2 15.5 60.1 4.7 170 330 A L H >< S+ 0 0 0 -4,-2.6 3,-1.0 -5,-0.3 5,-0.5 0.916 113.3 48.7 -58.0 -44.7 11.7 60.1 4.4 171 331 A K H >< S+ 0 0 59 -4,-2.0 3,-1.7 -5,-0.3 -1,-0.2 0.853 103.4 63.2 -62.2 -34.3 11.9 58.7 0.9 172 332 A K H 3< 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7,-0.0 -0.183 70.9 117.9 -88.1 41.6 0.1 72.5 20.0 193 353 A R S X S- 0 0 14 -2,-0.6 3,-1.5 -3,-0.6 -78,-0.1 -0.870 74.5 -98.0-106.2 142.2 -0.4 75.0 17.2 194 354 A P T 3 S+ 0 0 112 0, 0.0 -76,-0.1 0, 0.0 -77,-0.1 -0.280 105.1 21.6 -60.3 141.1 -0.9 78.7 18.0 195 355 A G T 3 S+ 0 0 52 1,-0.3 -81,-0.2 2,-0.1 2,-0.1 0.407 83.3 145.7 85.4 -2.4 -4.5 79.9 18.2 196 356 A V < - 0 0 24 -3,-1.5 -1,-0.3 -5,-0.2 3,-0.2 -0.452 23.5-179.8 -69.9 139.1 -6.1 76.5 18.8 197 357 A L S S+ 0 0 98 1,-0.2 2,-2.3 -2,-0.1 3,-0.2 0.836 73.9 50.8-101.0 -61.8 -9.1 76.5 21.0 198 358 A Q > + 0 0 98 1,-0.2 4,-2.1 -90,-0.1 5,-0.2 -0.430 63.9 157.6 -79.0 66.4 -10.3 72.9 21.3 199 359 A H H > S+ 0 0 104 -2,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.762 70.0 55.9 -63.2 -26.2 -6.9 71.6 22.2 200 360 A R H > S+ 0 0 190 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.905 108.6 44.4 -73.3 -44.7 -8.5 68.5 23.9 201 361 A V H > S+ 0 0 60 2,-0.2 4,-2.6 1,-0.2 3,-0.4 0.975 114.6 48.0 -63.3 -55.9 -10.4 67.4 20.8 202 362 A V H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.869 110.8 53.3 -54.2 -38.8 -7.5 67.9 18.4 203 363 A D H X S+ 0 0 72 -4,-1.4 4,-2.1 -5,-0.2 -1,-0.2 0.874 109.9 45.7 -67.4 -37.3 -5.2 66.1 20.8 204 364 A Q H X S+ 0 0 120 -4,-1.8 4,-2.3 -3,-0.4 -2,-0.2 0.895 113.2 51.0 -71.5 -39.3 -7.5 63.0 21.0 205 365 A L H X S+ 0 0 18 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.950 110.3 48.9 -60.6 -49.7 -7.9 63.0 17.2 206 366 A Q H X S+ 0 0 44 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.920 109.8 51.3 -57.5 -46.5 -4.1 63.2 16.7 207 367 A E H X S+ 0 0 111 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.910 109.4 51.6 -58.8 -40.0 -3.6 60.3 19.1 208 368 A Q H X S+ 0 0 63 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.884 109.0 49.4 -64.5 -37.9 -6.2 58.3 17.2 209 369 A F H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.910 113.0 47.5 -67.0 -40.0 -4.4 59.0 13.9 210 370 A A H X S+ 0 0 13 -4,-2.5 4,-3.1 2,-0.2 -2,-0.2 0.928 110.8 50.5 -65.2 -46.1 -1.1 57.9 15.4 211 371 A I H X S+ 0 0 75 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.887 111.0 50.1 -60.2 -38.0 -2.5 54.8 16.9 212 372 A T H X S+ 0 0 1 -4,-2.0 4,-2.9 2,-0.2 -1,-0.2 0.911 111.0 48.8 -67.1 -41.3 -4.0 53.9 13.6 213 373 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.940 112.3 48.4 -63.4 -46.4 -0.7 54.5 11.9 214 374 A K H X S+ 0 0 103 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.915 114.9 44.7 -59.9 -44.5 1.1 52.3 14.5 215 375 A S H X S+ 0 0 19 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.898 110.5 54.2 -67.6 -40.6 -1.5 49.5 14.1 216 376 A Y H X S+ 0 0 20 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.874 110.9 48.5 -59.9 -36.9 -1.4 49.8 10.3 217 377 A I H X S+ 0 0 12 -4,-2.1 4,-1.6 1,-0.2 3,-0.5 0.928 110.0 47.7 -70.5 -47.8 2.3 49.3 10.5 218 378 A E H < S+ 0 0 133 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.676 115.2 48.4 -70.1 -13.5 2.4 46.3 12.8 219 379 A C H < S+ 0 0 51 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.660 122.6 27.7 -99.2 -17.8 -0.3 44.6 10.7 220 380 A N H < S+ 0 0 80 -4,-1.0 -2,-0.2 -3,-0.5 -3,-0.1 0.425 114.2 55.4-124.8 2.6 1.2 45.1 7.2 221 381 A R < + 0 0 19 -4,-1.6 -1,-0.2 1,-0.1 8,-0.1 -0.651 47.8 152.6-140.4 82.6 5.0 45.3 7.7 222 382 A P + 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.587 38.8 113.9 -83.2 -15.6 6.6 42.3 9.5 223 383 A Q S > S- 0 0 86 1,-0.1 3,-3.0 3,-0.1 4,-0.0 -0.318 76.4-120.8 -65.5 140.1 10.0 42.5 7.9 224 384 A P G > S+ 0 0 113 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.700 111.9 66.9 -49.6 -23.7 13.1 43.3 10.1 225 385 A A G 3 S+ 0 0 77 1,-0.2 -2,-0.1 3,-0.0 -4,-0.0 0.742 98.0 52.3 -72.5 -22.6 13.7 46.3 7.9 226 386 A H G X S+ 0 0 44 -3,-3.0 3,-1.2 2,-0.0 4,-0.3 0.087 78.2 128.2-103.4 23.4 10.4 47.9 9.1 227 387 A R T < S+ 0 0 155 -3,-1.0 -4,-0.0 1,-0.3 -9,-0.0 -0.588 80.8 9.9 -79.7 140.9 11.2 47.6 12.8 228 388 A F T 3> S+ 0 0 130 -2,-0.3 4,-2.4 1,-0.1 -1,-0.3 0.626 88.0 137.7 65.5 13.9 10.8 50.8 14.7 229 389 A L H <> + 0 0 6 -3,-1.2 4,-2.7 1,-0.2 5,-0.2 0.927 67.6 51.9 -54.4 -48.5 9.2 52.2 11.5 230 390 A F H > S+ 0 0 39 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.871 111.4 46.4 -57.1 -41.6 6.4 54.0 13.5 231 391 A L H > S+ 0 0 108 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.858 110.7 52.7 -71.6 -34.2 9.0 55.6 15.8 232 392 A K H X S+ 0 0 97 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.928 110.1 48.5 -65.9 -43.9 11.1 56.7 12.8 233 393 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.948 111.3 49.7 -60.5 -48.2 8.1 58.3 11.2 234 394 A M H X S+ 0 0 57 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.887 109.9 51.2 -59.3 -38.1 7.2 60.1 14.4 235 395 A A H X S+ 0 0 62 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.866 107.5 54.3 -66.6 -34.3 10.7 61.3 14.7 236 396 A M H X S+ 0 0 20 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.937 105.1 52.4 -63.5 -46.4 10.5 62.6 11.1 237 397 A L H X S+ 0 0 13 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.849 107.1 53.0 -59.1 -34.5 7.4 64.6 11.8 238 398 A T H X S+ 0 0 98 -4,-1.5 4,-1.4 2,-0.2 -1,-0.2 0.876 110.6 47.5 -68.2 -35.4 9.2 66.2 14.7 239 399 A E H X S+ 0 0 82 -4,-1.6 4,-2.7 1,-0.2 5,-0.3 0.909 107.8 55.3 -69.0 -42.8 12.0 67.2 12.3 240 400 A L H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.812 104.9 54.8 -60.5 -30.5 9.5 68.5 9.9 241 401 A R H X S+ 0 0 79 -4,-1.4 4,-1.9 -5,-0.2 -1,-0.2 0.901 109.8 44.8 -69.1 -43.9 8.2 70.8 12.6 242 402 A S H X S+ 0 0 61 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.958 114.3 48.5 -64.0 -52.7 11.6 72.3 13.3 243 403 A I H X S+ 0 0 4 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.902 107.7 57.8 -52.6 -43.8 12.3 72.7 9.6 244 404 A N H X S+ 0 0 19 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.919 108.8 43.7 -54.0 -49.2 8.8 74.3 9.3 245 405 A A H X S+ 0 0 45 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.884 112.8 52.7 -66.5 -37.5 9.7 77.0 11.8 246 406 A Q H X S+ 0 0 88 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.914 111.3 47.0 -64.5 -40.2 13.1 77.5 10.3 247 407 A H H X S+ 0 0 62 -4,-2.9 4,-3.2 2,-0.2 -2,-0.2 0.886 107.1 56.0 -68.8 -40.0 11.5 78.0 6.9 248 408 A T H X S+ 0 0 40 -4,-2.2 4,-2.9 -5,-0.2 -1,-0.2 0.940 111.2 44.6 -56.9 -48.4 8.8 80.4 8.1 249 409 A Q H X S+ 0 0 117 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.852 112.8 51.1 -63.6 -37.2 11.5 82.7 9.5 250 410 A R H X S+ 0 0 44 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.929 112.4 47.8 -66.0 -42.9 13.6 82.3 6.4 251 411 A L H X S+ 0 0 12 -4,-3.2 4,-2.8 1,-0.2 -2,-0.2 0.937 109.0 52.2 -62.9 -49.0 10.5 83.3 4.4 252 412 A L H X S+ 0 0 77 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.859 108.4 51.4 -57.7 -38.2 9.6 86.3 6.6 253 413 A R H X S+ 0 0 92 -4,-1.8 4,-1.4 2,-0.2 3,-0.2 0.950 112.7 44.2 -65.4 -48.4 13.1 87.7 6.2 254 414 A I H X S+ 0 0 13 -4,-2.0 4,-3.6 1,-0.2 3,-0.4 0.919 113.4 51.8 -59.9 -44.1 13.1 87.5 2.4 255 415 A Q H < S+ 0 0 30 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.773 104.3 59.0 -63.2 -28.2 9.5 88.9 2.4 256 416 A D H < S+ 0 0 144 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.871 120.0 24.9 -70.9 -37.1 10.7 91.8 4.5 257 417 A I H < S+ 0 0 85 -4,-1.4 -2,-0.2 -3,-0.4 -3,-0.1 0.811 137.3 24.5 -97.1 -36.6 13.3 92.9 2.0 258 418 A H S < S- 0 0 65 -4,-3.6 -1,-0.2 -5,-0.2 -2,-0.2 -0.731 80.5-144.3-134.6 87.3 11.9 91.6 -1.3 259 419 A P + 0 0 92 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.166 43.4 136.7 -51.0 135.8 8.1 91.0 -1.2 260 420 A F + 0 0 31 2,-0.1 -5,-0.1 -180,-0.1 -176,-0.0 0.385 26.7 121.3-154.4 -22.6 6.9 88.0 -3.2 261 421 A A - 0 0 10 -10,-0.1 -176,-0.0 4,-0.1 -177,-0.0 -0.248 56.6-130.4 -57.5 137.3 4.3 86.1 -1.1 262 422 A T > - 0 0 16 -178,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.232 30.6 -96.5 -78.8 173.3 0.9 85.7 -2.8 263 423 A P H > S+ 0 0 101 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.933 127.2 49.3 -58.4 -45.7 -2.4 86.7 -1.0 264 424 A L H > S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.893 111.9 49.0 -61.2 -39.8 -2.9 83.0 0.0 265 425 A M H > S+ 0 0 4 2,-0.2 4,-2.2 1,-0.2 6,-0.3 0.877 109.4 51.8 -67.6 -37.2 0.6 82.9 1.3 266 426 A Q H <>S+ 0 0 69 -4,-2.5 5,-2.2 2,-0.2 4,-0.3 0.906 108.9 51.8 -65.4 -39.7 0.1 86.2 3.2 267 427 A E H ><5S+ 0 0 134 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.969 111.5 46.0 -59.1 -53.5 -3.0 84.7 4.8 268 428 A L H 3<5S+ 0 0 18 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.841 117.0 43.4 -59.7 -38.0 -1.2 81.6 6.0 269 429 A F T 3<5S- 0 0 40 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.272 116.4-110.2 -94.2 12.8 1.8 83.5 7.4 270 430 A G T < 5 0 0 54 -3,-1.5 -3,-0.2 -4,-0.3 -4,-0.1 0.580 360.0 360.0 74.0 9.5 -0.4 86.1 9.0 271 431 A I < 0 0 94 -5,-2.2 -4,-0.2 -6,-0.3 -5,-0.1 0.967 360.0 360.0 -82.9 360.0 0.7 88.9 6.6