==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 30-JUL-08 3DZU . COMPND 2 MOLECULE: RETINOIC ACID RECEPTOR RXR-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.CHANDRA,P.HUANG,Y.HAMURO,S.RAGHURAM,Y.WANG,T.P.BURRIS,F.RA . 665 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34622.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 470 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 34 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 309 46.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.5 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 4 2 2 3 0 1 2 2 2 1 0 1 1 0 0 0 1 3 1 1 1 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 1 132 A K 0 0 195 0, 0.0 2,-0.2 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0 21.9 2.3 55.0 56.4 2 133 A H E -A 11 0A 69 9,-0.5 9,-0.7 18,-0.1 2,-0.3 -0.484 360.0-127.5-114.7-174.8 2.5 53.0 53.2 3 134 A I E -A 10 0A 89 7,-0.2 7,-0.2 -2,-0.2 2,-0.2 -0.994 38.0 -92.9-136.0 139.8 1.5 49.6 51.7 4 135 A C > - 0 0 5 5,-2.0 4,-0.8 -2,-0.3 16,-0.3 -0.306 27.8-144.0 -54.4 117.3 3.6 47.0 49.9 5 136 A A T 4 S+ 0 0 41 14,-3.0 -1,-0.2 1,-0.2 15,-0.1 0.611 96.9 51.2 -59.4 -10.6 3.2 47.8 46.1 6 137 A I T 4 S- 0 0 1 13,-0.3 -1,-0.2 3,-0.1 42,-0.2 0.897 130.5 -5.6 -94.7 -51.0 3.3 44.0 45.6 7 138 A C T 4 S- 0 0 15 2,-0.1 43,-0.6 43,-0.1 44,-0.2 0.679 88.5-106.3-121.9 -27.9 0.7 42.4 47.9 8 139 A G < + 0 0 32 -4,-0.8 3,-0.1 1,-0.2 -3,-0.1 0.191 67.9 132.9 121.5 -20.9 -0.9 45.0 50.3 9 140 A D S S- 0 0 44 1,-0.2 -5,-2.0 -6,-0.1 2,-0.9 0.118 75.8 -72.4 -53.2 176.6 0.6 44.2 53.7 10 141 A R E -A 3 0A 142 -7,-0.2 12,-0.4 2,-0.0 2,-0.3 -0.676 52.9-139.4 -79.6 109.1 2.0 47.1 55.8 11 142 A S E -A 2 0A 5 -2,-0.9 -9,-0.5 -9,-0.7 10,-0.3 -0.523 3.8-149.0 -70.5 131.8 5.1 48.2 54.0 12 143 A S - 0 0 67 8,-1.2 2,-0.3 -2,-0.3 -1,-0.1 0.066 62.5 -75.4 -88.2 24.5 7.9 49.0 56.5 13 144 A G S S- 0 0 25 7,-0.2 7,-2.0 2,-0.1 2,-0.4 -0.855 83.1 -17.8 121.0-157.2 9.2 51.6 54.0 14 145 A K E -B 19 0B 133 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.758 55.0-179.7 -93.7 135.1 11.2 51.4 50.8 15 146 A H E > -B 18 0B 28 3,-3.1 3,-1.3 -2,-0.4 -2,-0.1 -0.999 68.1 -18.7-136.6 129.4 13.0 48.3 49.9 16 147 A Y T 3 S- 0 0 47 -2,-0.4 54,-1.1 1,-0.3 57,-0.1 0.818 135.1 -38.7 41.8 42.7 15.1 47.7 46.8 17 148 A G T 3 S+ 0 0 23 52,-0.2 2,-0.3 1,-0.1 -1,-0.3 0.600 123.3 65.0 92.2 12.1 13.4 50.6 45.1 18 149 A V E < S-B 15 0B 12 -3,-1.3 -3,-3.1 52,-0.1 2,-0.4 -0.995 83.6 -93.0-162.1 157.4 9.7 50.4 46.2 19 150 A Y E +B 14 0B 92 -2,-0.3 -14,-3.0 -5,-0.2 2,-0.3 -0.604 65.2 139.8 -72.0 127.8 7.3 50.6 49.1 20 151 A S - 0 0 0 -7,-2.0 -8,-1.2 -2,-0.4 -7,-0.2 -0.988 48.1 -93.9-164.2 168.4 6.9 47.0 50.4 21 152 A C > - 0 0 0 -10,-0.3 4,-2.8 -2,-0.3 5,-0.2 -0.425 40.9-105.5 -88.0 162.3 6.5 44.6 53.4 22 153 A E H > S+ 0 0 108 -12,-0.4 4,-2.5 2,-0.2 5,-0.2 0.848 119.8 58.8 -54.8 -32.3 9.2 42.7 55.2 23 154 A G H > S+ 0 0 19 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.994 110.0 34.9 -59.8 -76.0 7.8 39.7 53.3 24 155 A C H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.876 116.8 58.1 -47.3 -42.6 8.2 40.7 49.7 25 156 A K H X S+ 0 0 57 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.981 112.2 38.7 -50.7 -65.1 11.4 42.5 50.7 26 157 A G H X S+ 0 0 15 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.747 114.0 55.0 -58.5 -29.4 13.0 39.3 52.0 27 158 A F H X S+ 0 0 11 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.944 108.8 47.0 -69.8 -47.6 11.5 37.1 49.3 28 159 A F H X S+ 0 0 0 -4,-2.7 4,-1.4 -5,-0.2 -2,-0.2 0.862 110.0 57.5 -59.9 -35.9 13.0 39.2 46.5 29 160 A K H X S+ 0 0 77 -4,-1.9 4,-3.3 -5,-0.3 -1,-0.2 0.917 108.0 41.3 -62.3 -50.7 16.3 39.2 48.4 30 161 A R H X S+ 0 0 137 -4,-1.7 4,-2.6 2,-0.2 6,-0.4 0.875 110.2 58.1 -68.6 -38.4 16.8 35.4 48.5 31 162 A T H X>S+ 0 0 5 -4,-1.9 5,-0.9 2,-0.2 4,-0.6 0.872 115.4 38.6 -57.5 -38.5 15.7 34.9 45.0 32 163 A V H <5S+ 0 0 18 -4,-1.4 3,-0.4 -5,-0.2 -2,-0.2 0.960 116.8 47.6 -78.1 -55.4 18.4 37.2 44.0 33 164 A R H <5S+ 0 0 76 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.948 122.0 35.2 -50.1 -58.2 21.1 36.1 46.4 34 165 A K H <5S- 0 0 143 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.599 102.5-129.9 -74.6 -13.4 20.6 32.4 45.6 35 166 A D T <5 + 0 0 86 -4,-0.6 -3,-0.2 -3,-0.4 -4,-0.1 0.849 40.9 178.4 67.3 34.5 19.8 32.9 42.0 36 167 A L < - 0 0 66 -5,-0.9 2,-0.4 -6,-0.4 -1,-0.1 -0.160 19.7-149.1 -63.4 164.3 16.7 30.8 42.2 37 168 A T - 0 0 119 2,-0.0 2,-0.2 0, 0.0 21,-0.1 -0.917 14.5-166.7-141.7 108.9 14.5 30.3 39.1 38 169 A Y - 0 0 34 -2,-0.4 2,-0.3 19,-0.1 18,-0.0 -0.507 2.9-160.6 -94.0 165.7 10.8 29.8 39.6 39 170 A T - 0 0 118 -2,-0.2 2,-0.5 0, 0.0 19,-0.4 -0.975 19.9-118.5-143.0 150.6 8.2 28.6 37.2 40 171 A C - 0 0 14 -2,-0.3 16,-0.1 1,-0.2 -2,-0.0 -0.827 10.3-162.2 -98.8 129.6 4.4 28.9 37.2 41 172 A R S S+ 0 0 231 -2,-0.5 -1,-0.2 2,-0.1 15,-0.0 0.952 83.5 36.5 -69.1 -52.1 2.3 25.8 37.3 42 173 A D S S- 0 0 95 1,-0.1 2,-1.3 0, 0.0 -2,-0.1 0.012 119.7 -59.4 -84.4-157.6 -0.8 27.7 36.1 43 174 A N - 0 0 135 1,-0.1 -2,-0.1 2,-0.0 -1,-0.1 -0.357 64.8-101.3-101.2 55.0 -0.9 30.5 33.6 44 175 A K S S+ 0 0 131 -2,-1.3 -1,-0.1 1,-0.2 -4,-0.0 0.830 99.6 102.2 33.8 55.2 1.3 33.3 35.0 45 176 A D + 0 0 106 2,-0.1 2,-0.2 0, 0.0 -1,-0.2 0.181 41.6 146.4-145.1 9.9 -1.8 35.2 36.2 46 177 A C - 0 0 27 1,-0.1 2,-0.1 -4,-0.0 10,-0.1 -0.345 48.9-124.5 -59.2 120.4 -1.7 34.3 39.9 47 178 A L - 0 0 121 -2,-0.2 2,-0.8 1,-0.1 8,-0.2 -0.382 15.6-136.6 -67.0 140.1 -3.1 37.2 42.0 48 179 A I + 0 0 10 -42,-0.2 2,-0.2 -2,-0.1 5,-0.2 -0.837 33.6 172.7-106.7 100.2 -0.7 38.4 44.7 49 180 A D > - 0 0 66 -2,-0.8 4,-0.6 1,-0.1 -41,-0.2 -0.608 50.9-115.0-104.0 162.8 -2.6 38.9 47.9 50 181 A K T 4 S+ 0 0 123 -43,-0.6 -42,-0.1 -2,-0.2 -1,-0.1 0.646 124.0 37.2 -67.0 -12.5 -1.6 39.8 51.5 51 182 A R T 4 S+ 0 0 232 -44,-0.2 3,-0.3 1,-0.1 -1,-0.2 0.819 126.2 29.7-105.5 -48.1 -3.1 36.3 52.0 52 183 A Q T >4 S+ 0 0 75 1,-0.2 3,-0.5 -45,-0.1 4,-0.2 -0.208 79.6 114.7-110.6 43.8 -2.1 34.1 49.0 53 184 A R G >< S+ 0 0 47 -4,-0.6 3,-1.0 1,-0.2 -1,-0.2 0.867 77.0 54.3 -77.1 -37.9 1.2 35.8 48.0 54 185 A N G 3 S+ 0 0 116 -3,-0.3 3,-0.3 1,-0.2 -1,-0.2 0.377 83.7 98.8 -77.2 7.9 3.3 32.7 48.9 55 186 A R G < S+ 0 0 179 -3,-0.5 2,-0.3 1,-0.3 -1,-0.2 0.833 96.8 6.8 -61.7 -39.0 0.9 31.0 46.5 56 187 A C <> - 0 0 18 -3,-1.0 4,-1.7 -4,-0.2 -1,-0.3 -0.839 56.6-161.4-154.8 114.4 3.4 31.2 43.6 57 188 A Q H > S+ 0 0 101 -2,-0.3 4,-3.0 -3,-0.3 5,-0.3 0.879 92.5 54.0 -61.0 -44.7 7.0 32.3 43.7 58 189 A Y H > S+ 0 0 25 -19,-0.4 4,-2.5 1,-0.2 5,-0.2 0.985 114.3 39.6 -54.5 -63.1 7.3 32.9 39.9 59 190 A C H > S+ 0 0 12 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.776 116.1 54.5 -59.6 -26.4 4.3 35.2 39.7 60 191 A R H >X S+ 0 0 10 -4,-1.7 4,-1.7 2,-0.2 3,-0.7 0.979 110.8 41.8 -71.4 -55.9 5.3 36.8 43.0 61 192 A Y H 3X S+ 0 0 14 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.866 111.4 59.0 -57.1 -38.5 8.9 37.7 42.0 62 193 A Q H 3X S+ 0 0 40 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.833 103.7 50.0 -61.5 -33.7 7.5 38.8 38.6 63 194 A K H S+ 0 0 0 -4,-1.7 5,-2.4 1,-0.2 -2,-0.2 0.906 106.8 48.8 -56.5 -42.4 8.2 42.6 42.3 65 196 A L H ><5S+ 0 0 10 -4,-1.8 3,-1.1 3,-0.2 -1,-0.2 0.870 109.6 53.3 -64.5 -37.0 9.9 43.3 38.9 66 197 A A H 3<5S+ 0 0 10 -4,-1.5 367,-0.2 1,-0.3 -2,-0.2 0.863 106.4 48.8 -66.9 -40.7 6.8 45.1 37.7 67 198 A M T 3<5S- 0 0 61 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.239 127.9-107.6 -82.8 14.6 6.7 47.4 40.7 68 199 A G T < 5 + 0 0 11 -3,-1.1 2,-1.3 1,-0.2 -3,-0.2 0.905 48.7 179.4 63.3 52.6 10.3 47.9 39.8 69 200 A M < - 0 0 3 -5,-2.4 2,-0.4 -6,-0.1 -52,-0.2 -0.693 28.4-135.2 -87.1 97.1 12.2 46.1 42.5 70 201 A K > - 0 0 54 -2,-1.3 3,-1.4 -54,-1.1 4,-0.3 -0.333 16.3-164.6 -57.6 109.9 15.8 46.7 41.4 71 202 A R G > S+ 0 0 26 -2,-0.4 3,-1.7 1,-0.3 -1,-0.2 0.836 88.5 63.7 -64.7 -32.7 17.7 43.4 41.7 72 203 A E G 3 S+ 0 0 63 350,-0.3 -1,-0.3 1,-0.3 351,-0.2 0.666 90.2 67.6 -67.7 -12.9 21.0 45.3 41.4 73 204 A A G < S+ 0 0 28 -3,-1.4 2,-0.4 349,-0.3 -1,-0.3 0.633 80.2 93.9 -79.7 -16.1 20.1 47.1 44.7 74 205 A V S < S- 0 0 16 -3,-1.7 2,-0.1 -4,-0.3 3,-0.1 -0.667 74.5-139.4 -79.2 126.4 20.6 43.7 46.4 75 206 A Q - 0 0 109 -2,-0.4 3,-0.1 1,-0.1 2,-0.1 -0.469 22.5 -85.6 -91.6 162.2 24.1 43.5 47.8 76 207 A E - 0 0 92 266,-0.2 -1,-0.1 -2,-0.1 269,-0.1 -0.348 61.1 -89.7 -62.0 132.9 26.6 40.6 48.0 77 208 A E - 0 0 106 1,-0.1 2,-1.6 -44,-0.1 -1,-0.1 -0.169 38.9-121.1 -46.6 131.0 26.1 38.5 51.1 78 209 A R S S+ 0 0 137 -3,-0.1 2,-0.2 2,-0.1 -1,-0.1 -0.594 79.4 74.0 -82.0 86.3 28.2 39.8 53.9 79 210 A Q 0 0 122 -2,-1.6 -3,-0.0 268,-0.1 0, 0.0 -0.575 360.0 360.0-155.8-142.7 30.4 36.8 54.7 80 211 A R 0 0 240 -2,-0.2 257,-0.1 257,-0.0 -2,-0.1 0.112 360.0 360.0 27.1 360.0 33.4 34.9 53.3 81 ! 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 82 226 A A 0 0 115 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 173.9 54.5 28.4 39.7 83 227 A N + 0 0 98 1,-0.2 2,-1.1 2,-0.1 3,-0.3 0.622 360.0 81.7 -70.8 -10.9 53.0 29.5 36.3 84 228 A E + 0 0 69 1,-0.2 -1,-0.2 3,-0.1 148,-0.0 -0.529 39.4 119.1 -97.6 66.0 53.3 25.8 35.6 85 229 A D S S+ 0 0 82 -2,-1.1 -1,-0.2 1,-0.3 147,-0.1 0.244 92.3 42.3-100.7 1.7 50.2 24.4 37.2 86 230 A M S S- 0 0 2 -3,-0.3 2,-0.6 145,-0.1 -1,-0.3 -0.717 101.2-137.8-147.3 81.1 49.6 23.5 33.6 87 231 A P > - 0 0 26 0, 0.0 4,-1.6 0, 0.0 3,-0.3 -0.279 7.1-157.0 -51.7 97.8 53.0 22.2 32.4 88 232 A V H > S+ 0 0 8 -2,-0.6 4,-2.2 1,-0.2 5,-0.2 0.822 92.8 63.6 -43.1 -37.8 53.5 23.7 28.9 89 233 A E H > S+ 0 0 88 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.978 99.9 48.2 -51.0 -66.9 55.9 20.7 28.4 90 234 A R H > S+ 0 0 133 -3,-0.3 4,-3.0 1,-0.2 5,-0.3 0.835 109.1 55.8 -42.9 -43.8 53.2 18.1 28.8 91 235 A I H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.957 108.3 45.6 -57.8 -53.3 51.0 20.0 26.3 92 236 A L H < S+ 0 0 42 -4,-2.2 4,-0.3 -3,-0.4 -1,-0.2 0.904 112.4 54.5 -57.1 -41.6 53.6 20.0 23.6 93 237 A E H >X S+ 0 0 99 -4,-2.4 3,-2.7 1,-0.2 4,-1.0 0.969 108.7 44.5 -56.9 -59.4 54.2 16.3 24.3 94 238 A A H 3< S+ 0 0 0 -4,-3.0 3,-0.3 27,-0.3 -1,-0.2 0.868 108.3 62.3 -53.6 -35.6 50.5 15.4 23.9 95 239 A E T 3< S+ 0 0 28 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.544 96.0 60.9 -68.2 -7.0 50.6 17.6 20.8 96 240 A L T <4 0 0 115 -3,-2.7 -1,-0.2 -4,-0.3 -2,-0.2 0.881 360.0 360.0 -87.2 -42.1 53.3 15.3 19.3 97 241 A A < 0 0 70 -4,-1.0 -1,-0.1 -3,-0.3 21,-0.1 -0.171 360.0 360.0 -52.6 360.0 51.2 12.1 19.2 98 ! 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 99 263 A D > 0 0 119 0, 0.0 4,-0.8 0, 0.0 74,-0.1 0.000 360.0 360.0 360.0 100.7 34.7 13.7 -4.7 100 264 A P H > + 0 0 18 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.747 360.0 74.0 -88.6 -27.6 36.7 15.5 -1.9 101 265 A V H > S+ 0 0 9 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.886 103.2 45.4 -54.6 -36.8 34.0 15.9 0.7 102 266 A T H > S+ 0 0 13 2,-0.2 4,-3.2 1,-0.2 5,-0.4 0.970 105.9 58.6 -68.3 -53.7 34.5 12.2 1.4 103 267 A N H X S+ 0 0 48 -4,-0.8 4,-1.1 2,-0.2 -2,-0.2 0.895 110.1 46.4 -37.4 -54.9 38.3 12.5 1.4 104 268 A I H >X S+ 0 0 64 -4,-2.6 3,-2.6 1,-0.2 4,-1.9 0.987 112.5 47.4 -51.6 -70.7 37.8 15.0 4.2 105 269 A C H 3X S+ 0 0 11 -4,-2.1 4,-2.1 1,-0.3 -2,-0.2 0.780 104.9 59.1 -43.4 -41.4 35.4 12.9 6.2 106 270 A Q H 3X S+ 0 0 96 -4,-3.2 4,-1.2 1,-0.2 -1,-0.3 0.834 112.0 43.6 -61.7 -28.3 37.5 9.7 5.9 107 271 A A H X S+ 0 0 114 -4,-1.2 4,-1.1 1,-0.3 3,-0.8 0.939 118.1 40.7 -50.5 -51.6 40.6 8.7 11.6 111 275 A Q H 3X S+ 0 0 46 -4,-2.7 4,-2.5 1,-0.2 -1,-0.3 0.669 101.2 73.0 -72.8 -17.8 41.6 11.8 13.6 112 276 A L H 3X S+ 0 0 4 -4,-1.6 4,-0.8 -3,-0.5 -1,-0.2 0.835 101.9 42.4 -67.1 -31.4 38.4 11.6 15.7 113 277 A F H X S+ 0 0 50 -4,-1.1 3,-1.9 1,-0.2 4,-1.5 0.946 97.5 64.3 -52.5 -56.0 43.3 10.2 17.8 115 279 A L H 3X S+ 0 0 6 -4,-2.5 4,-2.9 1,-0.3 3,-0.4 0.856 94.1 58.4 -34.0 -61.3 41.9 13.3 19.5 116 280 A V H 3X S+ 0 0 2 -4,-0.8 4,-3.0 1,-0.3 -1,-0.3 0.842 105.9 51.0 -41.7 -42.1 40.7 11.4 22.6 117 281 A E H < S+ 0 0 0 -4,-2.9 3,-3.3 1,-0.2 7,-0.3 0.962 108.5 50.4 -61.9 -58.4 42.8 15.0 25.2 120 284 A K H 3< S+ 0 0 73 -4,-3.0 6,-0.4 1,-0.3 -1,-0.2 0.784 108.4 59.1 -52.8 -26.0 43.4 12.3 27.8 121 285 A R T 3< S+ 0 0 107 -4,-1.5 -27,-0.3 -5,-0.2 -1,-0.3 0.335 83.5 98.2 -86.4 4.4 47.1 13.4 27.5 122 286 A I S X> S- 0 0 2 -3,-3.3 3,-0.9 -5,-0.1 4,-0.7 -0.848 88.7-100.7 -96.2 126.5 46.2 17.0 28.5 123 287 A P T 34 S+ 0 0 23 0, 0.0 2,-1.1 0, 0.0 -2,-0.1 -0.071 98.5 1.2 -46.5 138.5 47.0 17.7 32.2 124 288 A H T 3> S+ 0 0 64 1,-0.1 4,-0.7 -4,-0.1 3,-0.4 -0.067 103.9 101.1 73.2 -34.2 44.0 17.7 34.6 125 289 A F T X4 S+ 0 0 0 -2,-1.1 3,-2.2 -3,-0.9 -5,-0.1 0.915 81.9 46.2 -43.0 -62.4 41.5 16.8 31.8 126 290 A S T 3< S+ 0 0 42 -4,-0.7 -1,-0.3 -6,-0.4 7,-0.1 0.835 102.8 65.7 -52.7 -37.1 41.3 13.1 32.6 127 291 A E T 34 S+ 0 0 152 -3,-0.4 -1,-0.3 2,-0.1 -2,-0.2 0.679 85.3 99.3 -61.6 -17.1 40.9 14.0 36.3 128 292 A L S << S- 0 0 13 -3,-2.2 5,-0.1 -4,-0.7 -4,-0.0 -0.396 95.3 -79.6 -74.3 148.1 37.6 15.6 35.4 129 293 A P >> - 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0 0 24 -2,-2.5 3,-1.1 -3,-0.3 13,-0.1 -0.786 20.9-173.0 -92.5 104.3 35.0 25.4 27.3 214 378 A P T 3 S+ 0 0 16 0, 0.0 -1,-0.1 0, 0.0 12,-0.1 0.515 77.5 68.6 -72.2 -8.4 33.1 26.0 30.5 215 379 A D T 3 + 0 0 71 2,-0.1 4,-0.1 10,-0.1 3,-0.1 0.620 67.0 120.2 -88.4 -12.9 30.1 27.2 28.7 216 380 A S S < S- 0 0 14 -3,-1.1 2,-0.3 1,-0.1 3,-0.2 -0.288 73.6-110.4 -53.9 129.4 29.2 23.8 27.3 217 381 A K S S+ 0 0 190 1,-0.2 -1,-0.1 -82,-0.1 -2,-0.1 -0.484 94.6 38.4 -71.5 125.7 25.7 22.9 28.5 218 382 A G S S+ 0 0 56 -2,-0.3 2,-0.5 1,-0.2 -1,-0.2 0.795 70.4 160.9 105.5 46.6 25.6 20.1 31.1 219 383 A L - 0 0 28 -3,-0.2 -1,-0.2 1,-0.1 -87,-0.0 -0.864 39.0-150.4-104.1 126.3 28.6 20.6 33.3 220 384 A S S S+ 0 0 75 -2,-0.5 -1,-0.1 1,-0.3 -89,-0.0 0.686 98.2 3.4 -63.2 -15.4 28.7 18.9 36.7 221 385 A N > - 0 0 56 1,-0.1 4,-1.1 2,-0.0 -1,-0.3 -0.439 60.4-175.6-173.4 92.4 30.9 22.0 37.6 222 386 A P H >> S+ 0 0 67 0, 0.0 4,-2.8 0, 0.0 3,-1.0 0.937 85.9 63.5 -54.3 -52.2 31.6 24.8 35.2 223 387 A A H 3> S+ 0 0 62 1,-0.3 4,-4.2 2,-0.2 5,-0.2 0.871 96.8 56.0 -38.8 -57.2 34.0 26.5 37.6 224 388 A E H 3> S+ 0 0 78 1,-0.2 4,-2.7 -3,-0.2 -1,-0.3 0.891 114.2 41.5 -46.4 -45.2 36.4 23.6 37.6 225 389 A V H X S+ 0 0 18 -4,-2.7 4,-1.6 1,-0.2 3,-0.6 0.899 112.9 47.8 -50.6 -49.7 41.4 24.8 34.1 229 393 A R H 3X S+ 0 0 9 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.917 106.4 57.6 -59.8 -44.4 41.2 27.0 31.0 230 394 A E H 3X S+ 0 0 37 -4,-2.9 4,-1.2 -5,-0.3 -1,-0.2 0.786 102.0 57.0 -57.6 -28.1 42.3 30.1 33.0 231 395 A K H XX S+ 0 0 68 -4,-1.5 3,-2.2 -3,-0.6 4,-1.6 0.992 102.4 52.3 -64.3 -59.9 45.5 28.1 33.9 232 396 A V H 3X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.3 -1,-0.2 0.745 102.7 61.6 -47.4 -25.1 46.4 27.6 30.3 233 397 A Y H 3X S+ 0 0 2 -4,-1.1 4,-1.6 -5,-0.2 -1,-0.3 0.911 111.1 39.3 -68.1 -39.6 45.9 31.4 30.0 234 398 A A H XX S+ 0 0 29 -3,-2.2 4,-3.3 -4,-1.2 3,-0.6 0.995 115.4 46.8 -70.1 -69.0 48.8 31.6 32.5 235 399 A S H 3X S+ 0 0 1 -4,-1.6 4,-2.9 1,-0.3 -3,-0.2 0.857 119.0 45.2 -41.3 -44.5 51.1 28.9 31.3 236 400 A L H 3X S+ 0 0 0 -4,-1.8 4,-1.3 -5,-0.3 -1,-0.3 0.843 111.4 50.8 -70.9 -37.3 50.6 30.2 27.8 237 401 A E H < + 0 0 52 -4,-2.1 3,-1.3 -5,-0.2 -1,-0.3 -0.344 62.5 155.7-146.0 65.9 59.1 35.8 22.5 245 409 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.676 77.3 57.7 -62.9 -23.0 60.3 38.9 24.5 246 410 A E T 3 S+ 0 0 186 1,-0.2 -2,-0.0 2,-0.0 0, 0.0 0.640 94.2 72.4 -84.3 -13.9 60.5 41.0 21.4 247 411 A Q X - 0 0 74 -3,-1.3 3,-1.1 1,-0.2 4,-0.3 -0.785 62.4-177.8-103.5 90.2 56.8 40.4 20.5 248 412 A P T > S+ 0 0 95 0, 0.0 2,-1.7 0, 0.0 3,-0.6 0.962 79.8 31.7 -48.1 -78.0 54.8 42.4 23.1 249 413 A G T 3> S+ 0 0 25 1,-0.2 4,-1.7 2,-0.1 5,-0.1 -0.309 80.6 116.0 -82.4 55.8 51.3 41.5 22.1 250 414 A R H <> S+ 0 0 5 -2,-1.7 4,-1.2 -3,-1.1 -1,-0.2 0.857 76.5 53.1 -85.9 -39.2 51.9 37.9 20.8 251 415 A F H <> S+ 0 0 12 -3,-0.6 4,-1.7 -4,-0.3 3,-0.2 0.940 113.5 46.1 -57.7 -46.2 49.8 36.4 23.5 252 416 A A H >> S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 3,-1.1 0.986 113.1 44.9 -59.6 -64.4 47.0 38.7 22.4 253 417 A K H 3< S+ 0 0 50 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.644 112.1 57.3 -57.2 -12.6 47.3 38.2 18.6 254 418 A L H >< S+ 0 0 0 -4,-1.2 3,-0.8 -3,-0.2 -1,-0.3 0.837 107.9 43.9 -86.5 -36.1 47.5 34.5 19.4 255 419 A L H X< S+ 0 0 7 -4,-1.7 3,-2.2 -3,-1.1 -2,-0.2 0.841 99.8 71.0 -75.2 -33.5 44.2 34.5 21.2 256 420 A L T 3< S+ 0 0 11 -4,-2.4 4,-0.5 1,-0.3 -1,-0.2 0.405 83.7 73.7 -65.9 8.2 42.6 36.6 18.5 257 421 A R T <> S+ 0 0 15 -3,-0.8 4,-1.4 -5,-0.2 -1,-0.3 0.788 81.1 73.6 -86.7 -31.7 42.9 33.5 16.4 258 422 A L H <> S+ 0 0 11 -3,-2.2 4,-2.4 -4,-0.2 5,-0.2 0.826 87.5 55.4 -52.5 -45.7 40.0 31.9 18.3 259 423 A P H > S+ 0 0 4 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.971 107.3 49.7 -54.8 -55.3 37.1 33.9 16.9 260 424 A A H > S+ 0 0 0 -4,-0.5 4,-2.3 1,-0.2 5,-0.2 0.855 110.8 52.9 -50.4 -38.7 37.9 33.0 13.3 261 425 A L H X S+ 0 0 10 -4,-1.4 4,-3.1 2,-0.2 -1,-0.2 0.938 111.2 43.1 -65.5 -48.8 38.1 29.4 14.4 262 426 A R H X S+ 0 0 32 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.967 112.7 53.4 -63.0 -51.2 34.7 29.4 16.1 263 427 A S H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.949 115.7 39.2 -46.8 -58.7 33.1 31.3 13.2 264 428 A I H X S+ 0 0 0 -4,-2.3 4,-0.8 -5,-0.2 -1,-0.2 0.919 110.8 58.7 -58.9 -46.4 34.4 28.7 10.7 265 429 A G H >X S+ 0 0 2 -4,-3.1 4,-1.7 -5,-0.2 3,-0.9 0.916 108.1 47.3 -50.1 -45.8 33.8 25.8 12.9 266 430 A L H 3X S+ 0 0 35 -4,-2.8 4,-1.2 1,-0.3 3,-0.4 0.962 109.7 50.2 -61.4 -53.9 30.1 26.7 13.0 267 431 A K H 3X S+ 0 0 49 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.3 0.559 108.9 58.7 -63.6 -3.4 29.8 27.2 9.3 268 432 A C H < S+ 0 0 73 -4,-2.6 3,-2.7 -5,-0.3 -2,-0.2 0.991 110.7 35.3 -66.3 -79.8 24.7 13.8 6.1 277 441 A L H 3< S+ 0 0 160 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.1 0.860 114.0 58.8 -42.8 -49.2 20.9 13.9 5.7 278 442 A I H 3< S- 0 0 101 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.842 109.7-129.4 -51.3 -29.9 21.3 14.3 2.0 279 443 A G << + 0 0 52 -3,-2.7 -3,-0.2 -4,-0.6 -2,-0.2 0.444 46.2 173.3 88.7 2.3 23.1 11.0 2.3 280 444 A D - 0 0 55 -5,-0.4 -1,-0.3 -6,-0.4 -2,-0.1 -0.227 52.6 -26.4 -49.3 115.5 25.7 12.8 0.3 281 445 A T S S- 0 0 30 -3,-0.1 2,-0.2 2,-0.0 -2,-0.1 0.405 96.5 -60.1 55.2 161.2 28.7 10.5 0.1 282 446 A P - 0 0 89 0, 0.0 2,-0.3 0, 0.0 -176,-0.1 -0.486 51.3-168.5 -76.8 143.2 29.6 7.9 2.7 283 447 A I - 0 0 47 -2,-0.2 2,-0.2 -7,-0.1 -177,-0.1 -0.841 17.2-117.2-124.8 163.2 30.2 8.9 6.3 284 448 A D > - 0 0 64 -2,-0.3 4,-2.3 -179,-0.1 5,-0.2 -0.643 22.3-108.7-105.6 163.3 31.6 6.8 9.2 285 449 A T H > S+ 0 0 103 -2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.836 113.3 49.9 -55.0 -44.8 30.3 5.6 12.6 286 450 A F H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.947 111.8 49.8 -64.0 -45.9 32.3 7.9 14.9 287 451 A L H > S+ 0 0 9 1,-0.2 4,-2.0 2,-0.2 3,-0.4 0.947 108.2 52.8 -55.1 -51.5 31.3 11.0 12.9 288 452 A M H < S+ 0 0 83 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.857 105.3 57.1 -53.1 -36.3 27.7 10.0 13.0 289 453 A E H < S+ 0 0 45 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.919 104.9 49.7 -63.4 -42.7 28.0 9.7 16.8 290 454 A M H < 0 0 13 -4,-1.7 -1,-0.2 -3,-0.4 -2,-0.2 0.883 360.0 360.0 -62.4 -39.5 29.2 13.3 17.1 291 455 A L < 0 0 41 -4,-2.0 -22,-0.0 -5,-0.2 -19,-0.0 -0.281 360.0 360.0 -82.1 360.0 26.3 14.5 15.0 292 !* 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 0.0 293 108 D A 0 0 113 0, 0.0 2,-0.4 0, 0.0 9,-0.0 0.000 360.0 360.0 360.0 -59.8 39.4 62.1 42.0 294 109 D I - 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