==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 15-DEC-09 2X0L . COMPND 2 MOLECULE: LYSINE-SPECIFIC HISTONE DEMETHYLASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.ZIBETTI,A.ADAMO,C.BINDA,F.FORNERIS,C.VERPELLI,E.GINELLI, . 819 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39113.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 588 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 8.1 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 . 4 0.5 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 . 49 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 106 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 311 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 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 5 2 2 2 1 0 1 1 1 0 1 1 0 1 1 1 0 0 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 2 1 2 1 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 PARALLEL BRIDGES PER LADDER . 5 4 2 2 0 1 1 1 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 . 2 2 1 1 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 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 1 171 A P 0 0 124 0, 0.0 2,-0.3 0, 0.0 9,-0.1 0.000 360.0 360.0 360.0 166.6 -16.5 39.6 98.9 2 172 A S > + 0 0 111 4,-0.1 3,-0.5 7,-0.0 2,-0.4 -0.957 360.0 60.1-156.0-176.2 -19.6 40.6 101.1 3 173 A G T 3> S- 0 0 39 -2,-0.3 4,-0.7 1,-0.2 0, 0.0 -0.885 119.8 -35.3 93.9-136.7 -21.1 40.9 104.5 4 174 A V H 3> S+ 0 0 28 -2,-0.4 4,-1.2 2,-0.2 -1,-0.2 0.616 146.0 59.4 -90.3 -16.4 -19.1 43.2 106.8 5 175 A E H <> S+ 0 0 97 -3,-0.5 4,-1.1 2,-0.2 10,-0.2 0.630 96.7 60.9 -85.2 -14.8 -15.9 42.0 105.1 6 176 A G H > S+ 0 0 6 2,-0.2 4,-3.5 1,-0.1 5,-0.3 0.941 102.7 53.2 -68.9 -50.1 -17.3 43.2 101.7 7 177 A A H X S+ 0 0 7 -4,-0.7 4,-0.8 1,-0.2 -2,-0.2 0.889 106.0 50.8 -44.7 -53.3 -17.3 46.7 103.2 8 178 A A H <>S+ 0 0 0 -4,-1.2 5,-3.6 1,-0.2 -1,-0.2 0.875 114.7 45.3 -59.1 -36.5 -13.7 46.5 104.3 9 179 A F H ><5S+ 0 0 72 -4,-1.1 3,-2.4 1,-0.2 -2,-0.2 0.960 108.7 52.8 -72.5 -51.9 -12.8 45.4 100.9 10 180 A Q H 3<5S+ 0 0 41 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.585 110.5 52.2 -64.3 -6.0 -14.9 48.0 99.1 11 181 A S T 3<5S- 0 0 5 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 -0.035 119.4-111.4-114.7 28.5 -13.1 50.6 101.3 12 182 A R T < 5S+ 0 0 63 -3,-2.4 -3,-0.2 1,-0.2 -2,-0.1 0.761 77.0 125.5 47.8 35.8 -9.6 49.3 100.3 13 183 A L < - 0 0 24 -5,-3.6 2,-0.3 -6,-0.2 -2,-0.2 -0.954 69.7-108.8-123.9 146.2 -8.9 47.9 103.8 14 184 A P > - 0 0 35 0, 0.0 3,-1.0 0, 0.0 5,-0.1 -0.555 28.5-145.4 -65.8 122.8 -7.9 44.5 105.2 15 185 A H T 3 S+ 0 0 63 -2,-0.3 30,-0.1 1,-0.2 -7,-0.1 0.619 92.6 34.4 -69.7 -14.7 -11.1 43.2 106.9 16 186 A D T 3 S+ 0 0 98 -11,-0.1 2,-0.3 -8,-0.0 -1,-0.2 0.134 109.9 60.6-132.0 19.5 -9.1 41.5 109.7 17 187 A R S < S- 0 0 152 -3,-1.0 2,-0.4 24,-0.1 -1,-0.0 -0.985 77.5-116.7-140.8 151.1 -6.0 43.6 110.3 18 188 A M - 0 0 13 -2,-0.3 2,-0.1 12,-0.1 -3,-0.1 -0.745 32.6-132.1 -84.2 135.3 -5.6 47.1 111.5 19 189 A T > - 0 0 29 -2,-0.4 4,-2.3 -5,-0.1 5,-0.2 -0.352 25.5-102.8 -79.5 163.5 -3.9 49.5 109.0 20 190 A S H > S+ 0 0 109 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.870 123.0 54.0 -53.1 -41.3 -1.0 51.8 109.9 21 191 A Q H > S+ 0 0 87 2,-0.2 4,-1.8 1,-0.2 3,-0.3 0.932 109.0 48.8 -61.7 -40.8 -3.3 54.8 109.9 22 192 A E H > S+ 0 0 0 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.924 105.7 56.7 -63.4 -45.2 -5.6 53.0 112.5 23 193 A A H < S+ 0 0 26 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.805 105.5 54.8 -54.6 -29.2 -2.6 52.1 114.7 24 194 A A H < S+ 0 0 70 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.939 113.8 36.7 -77.3 -44.8 -1.9 55.8 114.7 25 195 A C H < S+ 0 0 8 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.513 128.8 35.3 -79.5 -3.4 -5.3 56.9 116.0 26 196 A F X + 0 0 0 -4,-1.1 4,-1.8 -5,-0.2 5,-0.3 -0.212 58.4 144.4-147.2 50.7 -5.7 53.9 118.3 27 197 A P H > S+ 0 0 67 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.851 75.6 64.4 -64.8 -27.6 -2.4 52.8 119.8 28 198 A D H > S+ 0 0 71 2,-0.2 4,-0.5 1,-0.1 -2,-0.1 0.964 110.5 36.7 -53.5 -53.2 -4.3 51.9 122.9 29 199 A I H >4 S+ 0 0 9 -3,-0.2 3,-1.6 1,-0.2 8,-0.2 0.975 116.3 47.2 -63.6 -62.7 -6.2 49.2 121.0 30 200 A I H 3< S+ 0 0 62 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.744 115.5 45.9 -59.7 -27.5 -3.6 47.8 118.6 31 201 A S H 3< S+ 0 0 97 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.617 109.0 76.0 -88.0 -11.4 -0.9 47.4 121.3 32 202 A G S << S- 0 0 24 -3,-1.6 -3,-0.1 -4,-0.5 5,-0.1 -0.071 98.2 -43.5 -87.8-171.8 -3.5 45.9 123.6 33 203 A P >> - 0 0 93 0, 0.0 4,-1.3 0, 0.0 3,-1.0 -0.208 48.5-119.3 -66.4 145.0 -5.1 42.4 123.7 34 204 A Q H 3> S+ 0 0 131 1,-0.3 4,-1.5 2,-0.2 5,-0.1 0.712 107.0 65.4 -50.5 -29.9 -6.3 40.5 120.5 35 205 A Q H 3> S+ 0 0 123 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.945 101.4 46.6 -66.7 -46.2 -9.9 40.4 121.7 36 206 A T H <> S+ 0 0 58 -3,-1.0 4,-3.3 1,-0.2 3,-0.4 0.887 104.1 62.4 -64.8 -41.7 -10.5 44.1 121.6 37 207 A Q H X S+ 0 0 25 -4,-1.3 4,-4.3 1,-0.3 -1,-0.2 0.916 103.7 49.1 -46.2 -50.6 -8.9 44.4 118.1 38 208 A K H X S+ 0 0 131 -4,-1.5 4,-2.7 2,-0.2 -1,-0.3 0.824 110.2 51.2 -62.2 -32.2 -11.6 42.2 116.7 39 209 A V H X S+ 0 0 22 -4,-1.2 4,-2.7 -3,-0.4 -2,-0.2 0.951 114.8 43.5 -66.6 -48.2 -14.2 44.4 118.5 40 210 A F H X S+ 0 0 1 -4,-3.3 4,-3.2 2,-0.2 5,-0.2 0.976 114.5 48.5 -56.1 -59.7 -12.5 47.4 116.8 41 211 A L H X S+ 0 0 13 -4,-4.3 4,-3.2 1,-0.3 -1,-0.2 0.884 113.7 48.0 -52.9 -43.2 -12.2 45.7 113.5 42 212 A F H X S+ 0 0 60 -4,-2.7 4,-3.1 -5,-0.2 -1,-0.3 0.902 112.2 47.8 -65.5 -41.9 -15.9 44.6 113.7 43 213 A I H X S+ 0 0 1 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.982 114.6 46.8 -63.2 -53.7 -17.1 48.0 114.7 44 214 A R H X S+ 0 0 0 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.935 115.4 46.1 -45.5 -58.4 -15.0 49.6 111.9 45 215 A N H X S+ 0 0 6 -4,-3.2 4,-2.4 -5,-0.2 -1,-0.2 0.875 112.0 50.0 -59.3 -40.4 -16.3 47.0 109.4 46 216 A R H X S+ 0 0 57 -4,-3.1 4,-2.9 1,-0.2 -1,-0.2 0.923 110.4 49.5 -68.3 -43.0 -19.9 47.3 110.4 47 217 A T H X S+ 0 0 1 -4,-2.9 4,-2.9 -5,-0.2 5,-0.2 0.920 109.7 52.3 -60.4 -44.8 -19.9 51.1 110.2 48 218 A L H X S+ 0 0 0 -4,-2.4 4,-3.6 -5,-0.3 -2,-0.2 0.971 110.9 47.1 -51.2 -57.0 -18.4 50.9 106.7 49 219 A Q H X S+ 0 0 33 -4,-2.4 4,-3.4 1,-0.2 5,-0.2 0.916 110.5 53.3 -51.3 -50.8 -21.1 48.5 105.6 50 220 A L H < S+ 0 0 19 -4,-2.9 4,-0.4 1,-0.2 -1,-0.2 0.919 113.3 41.9 -52.3 -50.9 -23.7 50.8 107.1 51 221 A W H >< S+ 0 0 1 -4,-2.9 3,-1.6 1,-0.2 -1,-0.2 0.946 116.2 50.2 -60.4 -48.4 -22.4 53.8 105.2 52 222 A L H 3< S+ 0 0 19 -4,-3.6 -2,-0.2 1,-0.3 -1,-0.2 0.903 99.8 61.8 -61.9 -44.5 -21.9 51.8 102.0 53 223 A D T 3< S+ 0 0 112 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.2 0.630 126.0 15.4 -54.3 -14.5 -25.4 50.2 102.0 54 224 A N X + 0 0 66 -3,-1.6 3,-0.8 -4,-0.4 -1,-0.3 -0.516 63.5 164.4-164.5 86.0 -26.7 53.7 101.7 55 225 A P T 3 + 0 0 8 0, 0.0 41,-0.1 0, 0.0 39,-0.1 0.260 65.5 80.7-100.7 16.7 -24.4 56.5 100.7 56 226 A K T 3 S+ 0 0 120 41,-0.1 42,-2.0 -5,-0.1 2,-0.4 0.452 92.4 52.1 -92.7 -4.3 -27.1 59.1 99.8 57 227 A I B < S-a 98 0A 84 -3,-0.8 42,-0.2 40,-0.2 36,-0.2 -0.995 93.2-103.0-133.9 140.1 -27.7 60.0 103.5 58 228 A Q - 0 0 14 40,-2.9 2,-0.7 -2,-0.4 -2,-0.1 -0.298 29.7-138.8 -58.1 139.9 -25.2 61.1 106.2 59 229 A L - 0 0 19 -4,-0.1 2,-0.1 24,-0.1 -1,-0.1 -0.911 24.3-164.8-107.6 110.8 -24.3 58.4 108.7 60 230 A T > - 0 0 9 -2,-0.7 4,-2.0 1,-0.1 5,-0.1 -0.377 33.0-110.5 -92.9 165.8 -24.2 59.8 112.2 61 231 A F H > S+ 0 0 29 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.893 119.8 48.1 -61.3 -43.0 -22.8 58.4 115.4 62 232 A E H > S+ 0 0 109 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.977 110.4 50.4 -59.4 -57.0 -26.3 58.0 116.9 63 233 A A H > S+ 0 0 33 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.825 113.1 49.1 -50.8 -36.5 -27.6 56.3 113.7 64 234 A T H >< S+ 0 0 0 -4,-2.0 3,-1.1 2,-0.2 4,-0.2 0.979 111.2 46.0 -65.4 -59.4 -24.5 54.0 113.9 65 235 A L H >< S+ 0 0 37 -4,-2.6 3,-2.4 1,-0.3 -2,-0.2 0.892 104.3 63.4 -54.3 -48.4 -24.9 53.0 117.6 66 236 A Q H 3< S+ 0 0 153 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.850 104.9 48.2 -39.5 -46.2 -28.6 52.4 117.1 67 237 A Q T << S+ 0 0 90 -3,-1.1 -1,-0.3 -4,-1.0 2,-0.3 0.326 93.8 92.4 -86.6 6.3 -27.7 49.5 114.7 68 238 A L < - 0 0 7 -3,-2.4 2,-0.2 -4,-0.2 -25,-0.0 -0.692 57.2-154.0 -98.6 155.9 -25.1 47.7 116.7 69 239 A E >> - 0 0 151 -2,-0.3 4,-2.5 1,-0.1 3,-1.3 -0.739 35.8 -45.6-117.0 169.8 -25.6 44.8 119.2 70 240 A A T 34 S+ 0 0 74 1,-0.3 -1,-0.1 2,-0.3 0, 0.0 -0.368 118.1 25.5 -67.9 155.0 -23.7 43.5 122.2 71 241 A P T 3> S+ 0 0 80 0, 0.0 4,-0.6 0, 0.0 3,-0.4 -0.946 131.3 46.6 -76.7 7.4 -20.9 43.0 122.9 72 242 A Y T <4 S+ 0 0 65 -3,-1.3 -2,-0.3 1,-0.2 7,-0.2 0.960 112.2 44.5 -82.3 -51.3 -20.2 45.7 120.2 73 243 A N T < S+ 0 0 59 -4,-2.5 -1,-0.2 1,-0.2 -3,-0.2 0.339 96.5 87.1 -72.6 8.5 -22.7 48.4 121.1 74 244 A S T 4 S+ 0 0 82 -3,-0.4 2,-0.5 -5,-0.3 -1,-0.2 0.994 82.1 49.9 -70.4 -71.3 -21.6 47.9 124.7 75 245 A D X - 0 0 69 -4,-0.6 4,-1.3 -3,-0.2 -1,-0.2 -0.541 66.1-180.0 -69.7 116.2 -18.5 50.3 124.9 76 246 A T H > S+ 0 0 68 -2,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.743 72.9 64.1 -99.5 -21.6 -19.7 53.6 123.4 77 247 A V H > S+ 0 0 105 2,-0.2 4,-3.0 3,-0.2 5,-0.2 0.986 107.5 47.7 -55.3 -55.6 -16.5 55.7 123.7 78 248 A L H > S+ 0 0 17 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.964 109.2 50.6 -45.0 -67.6 -15.0 53.2 121.2 79 249 A V H X S+ 0 0 1 -4,-1.3 4,-2.5 1,-0.2 -1,-0.2 0.865 113.8 48.3 -43.2 -39.7 -18.0 53.4 118.8 80 250 A H H X S+ 0 0 87 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.946 111.7 47.0 -68.1 -47.8 -17.6 57.2 119.0 81 251 A R H X S+ 0 0 30 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.932 115.5 46.9 -55.5 -48.9 -13.8 57.2 118.3 82 252 A V H X S+ 0 0 1 -4,-2.9 4,-2.6 1,-0.2 5,-0.3 0.965 112.1 48.4 -60.4 -53.7 -14.3 54.8 115.4 83 253 A H H X S+ 0 0 5 -4,-2.5 4,-1.8 -5,-0.3 -1,-0.2 0.885 113.7 48.7 -55.3 -37.7 -17.2 56.7 113.8 84 254 A S H X S+ 0 0 21 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.930 109.5 50.5 -70.8 -49.0 -15.2 59.9 114.2 85 255 A Y H X S+ 0 0 3 -4,-2.7 4,-1.8 1,-0.2 6,-0.2 0.910 112.2 48.2 -47.6 -52.7 -12.0 58.5 112.6 86 256 A L H <>S+ 0 0 0 -4,-2.6 5,-1.8 1,-0.2 6,-1.4 0.882 113.7 46.5 -60.7 -38.3 -13.9 57.1 109.7 87 257 A E H ><5S+ 0 0 53 -4,-1.8 3,-1.2 -5,-0.3 -1,-0.2 0.879 109.3 54.6 -72.5 -35.3 -15.7 60.4 109.2 88 258 A R H 3<5S+ 0 0 37 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.854 111.1 44.4 -71.8 -34.4 -12.6 62.5 109.5 89 259 A H T 3<5S- 0 0 23 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.133 113.3-111.4-101.7 20.6 -10.8 60.5 106.8 90 260 A G T < 5S+ 0 0 1 -3,-1.2 -3,-0.2 2,-0.2 4,-0.1 0.673 82.6 123.2 65.8 18.9 -13.6 60.4 104.3 91 261 A L S S- 0 0 18 26,-0.2 4,-2.6 27,-0.2 5,-0.2 -0.103 79.1 -89.7 -58.0 175.5 -9.8 69.6 89.9 118 288 A V H > S+ 0 0 8 26,-0.4 4,-3.2 2,-0.2 5,-0.3 0.924 132.5 56.6 -58.9 -39.4 -11.5 66.6 91.4 119 289 A S H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.978 110.0 43.6 -60.2 -56.5 -8.7 66.5 94.0 120 290 A G H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.928 115.9 47.2 -41.4 -61.1 -9.5 70.1 95.0 121 291 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.922 109.2 53.2 -56.7 -46.6 -13.3 69.7 95.1 122 292 A A H X S+ 0 0 4 -4,-3.2 4,-1.5 -5,-0.2 -1,-0.2 0.932 113.5 44.1 -57.4 -46.7 -13.1 66.5 97.1 123 293 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.3 3,-0.4 0.971 110.9 54.6 -56.8 -57.1 -11.0 68.2 99.7 124 294 A A H X S+ 0 0 0 -4,-3.0 4,-3.2 1,-0.3 5,-0.3 0.910 107.5 48.5 -45.8 -59.2 -13.2 71.4 99.7 125 295 A R H X S+ 0 0 24 -4,-2.5 4,-2.8 1,-0.2 -1,-0.3 0.855 112.3 49.5 -51.2 -44.5 -16.4 69.5 100.4 126 296 A Q H X S+ 0 0 1 -4,-1.5 4,-1.0 -3,-0.4 -1,-0.2 0.988 113.8 44.4 -56.0 -61.6 -14.8 67.6 103.2 127 297 A L H ><>S+ 0 0 0 -4,-2.6 3,-1.3 2,-0.2 5,-1.0 0.913 114.3 48.9 -49.9 -54.3 -13.4 70.7 104.9 128 298 A Q H ><5S+ 0 0 45 -4,-3.2 3,-2.6 1,-0.3 4,-0.3 0.955 110.7 50.8 -52.7 -52.1 -16.7 72.6 104.4 129 299 A S H 3<5S+ 0 0 18 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.662 104.4 58.6 -62.6 -14.4 -18.6 69.7 105.9 130 300 A F T <<5S- 0 0 34 -3,-1.3 -1,-0.3 -4,-1.0 -2,-0.2 0.295 127.5-102.5 -91.0 10.6 -16.1 69.8 108.8 131 301 A G T < 5S+ 0 0 12 -3,-2.6 -23,-2.3 1,-0.2 2,-0.3 0.933 75.5 137.2 65.5 50.7 -17.2 73.4 109.4 132 302 A M < - 0 0 1 -5,-1.0 2,-0.8 -4,-0.3 -1,-0.2 -0.826 60.5-109.6-116.0 165.8 -14.3 75.3 107.9 133 303 A D E -b 110 0B 63 -24,-2.2 -22,-2.9 -25,-0.5 2,-0.5 -0.846 44.9-174.4 -95.6 113.2 -14.2 78.3 105.7 134 304 A V E +b 111 0B 6 -2,-0.8 283,-0.5 -24,-0.2 2,-0.4 -0.917 16.1 178.4-119.2 128.7 -13.2 77.1 102.2 135 305 A T E -b 112 0B 5 -24,-2.5 -22,-3.4 -2,-0.5 2,-0.5 -0.989 12.7-155.5-127.6 129.6 -12.4 79.0 99.0 136 306 A L E -bd 113 418B 0 281,-2.9 283,-3.1 -2,-0.4 2,-0.6 -0.870 4.0-154.9 -98.6 131.8 -11.2 77.4 95.7 137 307 A L E -bd 114 419B 2 -24,-2.2 -22,-3.4 -2,-0.5 2,-0.5 -0.930 15.8-176.1-104.0 119.9 -9.3 79.4 93.2 138 308 A E - 0 0 12 281,-2.1 284,-2.4 -2,-0.6 285,-0.1 -0.963 21.8-161.0-123.2 120.0 -9.7 78.1 89.6 139 309 A A S S+ 0 0 14 -2,-0.5 302,-0.2 282,-0.3 -1,-0.1 0.907 75.0 70.4 -59.7 -46.1 -7.8 79.5 86.6 140 310 A R S S- 0 0 31 2,-0.2 281,-1.5 281,-0.1 282,-0.3 -0.236 90.0-116.3 -72.0 163.7 -10.2 78.0 84.0 141 311 A D S S+ 0 0 119 279,-0.2 2,-0.3 280,-0.1 -1,-0.1 0.130 97.6 43.1 -84.1 18.6 -13.8 79.1 83.4 142 312 A R S S- 0 0 74 0, 0.0 3,-0.3 0, 0.0 -26,-0.2 -0.973 80.8-116.5-150.6 164.3 -15.1 75.7 84.6 143 313 A V S S+ 0 0 21 -2,-0.3 -26,-0.2 1,-0.1 267,-0.1 -0.307 81.4 63.3 -83.9 176.0 -14.5 73.2 87.3 144 314 A G > - 0 0 2 -28,-2.8 3,-2.7 265,-0.1 -26,-0.4 0.121 68.0-161.1 97.1 -22.0 -13.2 69.6 86.8 145 315 A G T 3 S+ 0 0 9 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800 A G S > S- 0 0 2 14,-0.4 3,-3.5 -2,-0.3 4,-0.5 -0.291 80.7 -69.9 122.2 153.1 -3.6 65.6 93.4 635 801 A E G > S+ 0 0 10 1,-0.3 3,-0.9 2,-0.2 8,-0.4 0.785 127.4 58.3 -44.4 -39.6 -3.0 62.6 91.2 636 802 A H G 3 S+ 0 0 0 1,-0.2 -1,-0.3 -3,-0.1 -26,-0.1 0.359 103.8 56.0 -72.6 6.8 0.7 63.2 91.4 637 803 A T G < S+ 0 0 1 -3,-3.5 2,-0.7 1,-0.1 -1,-0.2 0.484 85.4 77.7-119.9 -9.0 0.5 62.8 95.3 638 804 A I X - 0 0 20 -3,-0.9 3,-2.4 -4,-0.5 -1,-0.1 -0.776 54.5-172.5-111.2 87.0 -1.2 59.4 95.8 639 805 A R T 3 S+ 0 0 75 -2,-0.7 -1,-0.2 1,-0.3 -34,-0.1 0.842 86.9 49.5 -41.1 -49.8 1.5 56.6 95.3 640 806 A N T 3 S+ 0 0 59 1,-0.2 -1,-0.3 7,-0.1 -248,-0.1 0.547 124.3 28.9 -71.2 -8.3 -1.0 53.8 95.6 641 807 A Y S X S+ 0 0 26 -3,-2.4 3,-1.0 -6,-0.1 -1,-0.2 -0.020 82.5 169.3-145.3 45.7 -3.4 55.4 93.1 642 808 A P T 3 + 0 0 4 0, 0.0 -6,-0.1 0, 0.0 5,-0.1 0.085 59.4 12.1 -57.3 163.5 -1.4 57.5 90.6 643 809 A A T 3 S+ 0 0 7 -8,-0.4 2,-0.3 1,-0.1 -7,-0.1 0.498 101.2 106.7 49.8 14.7 -2.7 59.1 87.4 644 810 A T S <> S- 0 0 11 -3,-1.0 4,-2.2 -9,-0.2 5,-0.1 -0.829 72.8-125.5-127.5 163.0 -6.5 58.5 88.1 645 811 A V H > S+ 0 0 19 -2,-0.3 4,-2.8 2,-0.2 5,-0.3 0.977 116.8 46.8 -58.8 -54.2 -9.7 60.3 89.0 646 812 A H H > S+ 0 0 14 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.869 111.2 54.1 -60.7 -31.3 -10.3 58.0 91.9 647 813 A G H > S+ 0 0 0 2,-0.2 4,-1.9 -5,-0.1 -1,-0.3 0.925 111.6 44.5 -64.1 -41.5 -6.7 58.5 92.9 648 814 A A H >X S+ 0 0 11 -4,-2.2 4,-2.5 -3,-0.2 3,-0.5 0.983 110.8 52.3 -67.2 -60.2 -7.2 62.3 92.9 649 815 A L H 3X S+ 0 0 4 -4,-2.8 4,-2.2 1,-0.3 -1,-0.2 0.883 110.8 51.2 -33.4 -53.4 -10.5 62.1 94.8 650 816 A L H 3X S+ 0 0 23 -4,-2.3 4,-2.9 -5,-0.3 -1,-0.3 0.909 106.4 50.7 -59.0 -44.0 -8.7 60.0 97.3 651 817 A S H S+ 0 0 0 -4,-2.0 4,-2.6 -5,-0.3 5,-0.6 0.894 108.2 52.2 -56.6 -38.9 -8.8 69.2 109.9 661 827 A D H X5S+ 0 0 45 -4,-2.1 4,-0.7 1,-0.2 5,-0.2 0.942 113.7 45.1 -63.1 -42.9 -6.6 67.3 112.4 662 828 A Q H <5S+ 0 0 79 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.867 126.7 25.7 -64.4 -41.5 -4.2 70.1 112.4 663 829 A F H <5S+ 0 0 45 -4,-2.4 -3,-0.2 2,-0.1 -2,-0.2 0.682 132.3 32.1-107.6 -20.5 -6.6 73.0 112.6 664 830 A L H <5S- 0 0 49 -4,-2.6 -3,-0.2 -5,-0.3 3,-0.2 0.419 108.2-121.9-109.4 -5.3 -9.7 71.6 114.3 665 831 A G << - 0 0 33 -4,-0.7 2,-1.0 -5,-0.6 -3,-0.2 0.330 22.1 -87.5 74.6 151.9 -7.9 69.1 116.5 666 832 A A > + 0 0 32 -5,-0.2 3,-1.4 1,-0.2 -1,-0.1 -0.693 39.3 175.7-101.6 81.7 -8.3 65.3 116.7 667 833 A M G > S+ 0 0 165 -2,-1.0 3,-0.7 1,-0.2 2,-0.2 0.936 75.3 60.1 -38.5 -64.1 -11.0 64.4 119.2 668 834 A Y G 3 S+ 0 0 11 1,-0.2 -1,-0.2 -587,-0.1 -583,-0.1 0.303 78.7 87.3 -51.5 -4.2 -10.8 60.6 118.4 669 835 A T G < 0 0 54 -3,-1.4 -1,-0.2 -2,-0.2 -2,-0.1 0.436 360.0 360.0 -92.3 5.0 -7.1 59.9 119.4 670 836 A L < 0 0 166 -3,-0.7 -1,-0.2 -644,-0.1 -2,-0.1 0.546 360.0 360.0-104.6 360.0 -7.4 59.1 123.1 671 !* 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 0.0 672 308 B R 0 0 217 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -59.4 11.8 33.2 90.2 673 309 B K - 0 0 175 1,-0.2 3,-0.1 -444,-0.0 -448,-0.0 -0.899 360.0 -85.0-126.0 160.5 13.1 31.9 86.8 674 310 B P - 0 0 38 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.124 58.5 -80.5 -53.0 173.6 12.7 33.4 83.4 675 311 B P S > S- 0 0 16 0, 0.0 3,-1.5 0, 0.0 2,-0.3 -0.338 74.7 -61.1 -67.4 168.9 9.6 32.8 81.3 676 312 B K T 3 S- 0 0 186 1,-0.3 3,-0.1 -3,-0.1 -458,-0.0 -0.330 116.6 -17.1 -63.1 111.5 9.6 29.4 79.4 677 313 B G T 3 S+ 0 0 44 -2,-0.3 2,-0.4 1,-0.3 -1,-0.3 0.617 93.6 137.3 65.9 11.0 12.5 29.2 77.0 678 314 B M < - 0 0 7 -3,-1.5 2,-0.7 -460,-0.1 -1,-0.3 -0.723 53.4-135.0 -71.1 139.0 13.0 33.0 77.1 679 315 B F + 0 0 94 -2,-0.4 -423,-0.2 -430,-0.1 2,-0.2 -0.888 44.1 146.8-115.3 112.0 16.8 33.1 77.2 680 316 B L + 0 0 8 -2,-0.7 2,-0.3 -427,-0.0 -2,-0.1 -0.611 15.1 174.2-143.3 73.5 18.4 35.5 79.7 681 317 B S > - 0 0 50 -2,-0.2 4,-2.1 1,-0.1 3,-0.5 -0.676 40.1-123.3 -84.5 139.4 21.7 34.3 81.2 682 318 B Q H > S+ 0 0 84 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.885 112.6 53.9 -38.2 -51.8 23.6 36.7 83.4 683 319 B E H > S+ 0 0 143 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.880 107.8 46.8 -53.5 -50.1 26.6 36.3 81.1 684 320 B D H > S+ 0 0 33 -3,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.838 108.9 56.8 -66.5 -36.0 24.7 37.2 77.8 685 321 B V H < S+ 0 0 2 -4,-2.1 3,-0.4 1,-0.2 4,-0.2 0.963 106.2 48.4 -59.6 -53.5 23.1 40.2 79.5 686 322 B E H X S+ 0 0 116 -4,-2.1 4,-1.5 1,-0.2 3,-0.5 0.778 112.8 49.5 -58.9 -30.6 26.5 41.8 80.5 687 323 B A H < S+ 0 0 50 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.809 106.6 51.3 -83.5 -31.4 27.9 41.3 77.0 688 324 B V T < S+ 0 0 7 -4,-1.8 -1,-0.2 -3,-0.4 -2,-0.2 0.293 120.4 38.2 -89.5 12.6 25.0 42.8 75.0 689 325 B S T 4 S+ 0 0 16 -3,-0.5 -2,-0.2 -4,-0.2 -1,-0.2 0.581 78.9 101.2-128.1 -28.1 25.2 45.9 77.2 690 326 B A S < S- 0 0 79 -4,-1.5 2,-0.3 -5,-0.2 -2,-0.1 0.614 100.1 -0.4 -44.1 -19.8 29.0 46.5 77.8 691 327 B N S S- 0 0 85 -4,-0.2 4,-0.2 1,-0.1 0, 0.0 -0.955 84.7 -87.2-155.9-175.6 28.7 49.2 75.1 692 328 B A S S+ 0 0 99 -2,-0.3 4,-0.2 1,-0.2 3,-0.2 0.872 125.1 19.1 -61.7 -44.7 26.4 51.1 72.6 693 329 B T S > S+ 0 0 76 2,-0.2 4,-3.4 1,-0.1 5,-0.2 0.364 88.6 106.2-113.5 2.7 26.9 48.6 69.7 694 330 B A H > S+ 0 0 8 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.645 83.9 60.5 -50.5 -15.1 28.1 45.6 71.7 695 331 B A H > S+ 0 0 8 -4,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.969 110.3 31.9 -72.1 -68.8 24.6 44.6 70.8 696 332 B T H 4 S+ 0 0 72 -4,-0.2 -2,-0.2 1,-0.2 5,-0.1 0.745 115.4 61.6 -67.5 -26.0 24.8 44.7 67.0 697 333 B T H >X S+ 0 0 66 -4,-3.4 3,-2.4 2,-0.2 4,-1.8 0.988 105.7 45.4 -55.7 -61.6 28.5 43.6 67.1 698 334 B V H 3X S+ 0 0 38 -4,-0.9 4,-1.7 1,-0.3 -2,-0.2 0.878 109.6 54.9 -53.0 -44.3 27.6 40.3 68.8 699 335 B L H 3< S+ 0 0 24 -4,-1.7 4,-0.4 1,-0.2 -1,-0.3 0.330 109.1 50.7 -74.9 8.0 24.7 39.7 66.3 700 336 B R H <> S+ 0 0 181 -3,-2.4 4,-1.4 2,-0.2 5,-0.2 0.696 101.5 55.5-110.9 -37.1 27.2 40.1 63.5 701 337 B Q H X S+ 0 0 122 -4,-1.8 4,-3.2 2,-0.2 -2,-0.2 0.927 117.2 42.5 -49.3 -45.0 29.9 37.7 64.6 702 338 B L H X S+ 0 0 26 -4,-1.7 4,-2.0 2,-0.2 5,-0.2 0.928 107.7 56.0 -71.3 -48.6 26.9 35.3 64.7 703 339 B D H > S+ 0 0 80 -4,-0.4 4,-0.7 2,-0.2 -1,-0.2 0.749 118.3 38.3 -56.3 -22.8 25.3 36.4 61.4 704 340 B M H >X S+ 0 0 127 -4,-1.4 4,-3.0 2,-0.2 3,-0.8 0.909 107.4 58.6 -90.8 -60.2 28.7 35.6 59.9 705 341 B E H 3< S+ 0 0 87 -4,-3.2 -2,-0.2 1,-0.3 -3,-0.2 0.785 110.3 51.2 -32.0 -35.3 29.7 32.5 61.8 706 342 B L H >X S+ 0 0 23 -4,-2.0 4,-1.7 2,-0.2 3,-0.9 0.889 110.5 42.8 -78.3 -44.0 26.4 31.2 60.3 707 343 B V H S+ 0 0 4 -3,-0.9 4,-2.1 -5,-0.3 -2,-0.2 0.606 106.0 58.5-117.5 -28.9 29.2 27.5 58.1 710 346 B K H X S+ 0 0 88 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.802 109.8 46.6 -68.6 -29.3 26.5 27.3 55.5 711 347 B R H X S+ 0 0 166 -4,-1.4 4,-2.1 2,-0.2 5,-0.2 0.904 106.3 56.5 -79.7 -44.8 29.2 27.5 52.9 712 348 B Q H > S+ 0 0 87 -4,-0.2 4,-1.8 1,-0.2 3,-0.2 0.948 108.6 52.2 -41.9 -52.9 31.3 24.9 54.7 713 349 B I H X S+ 0 0 9 -4,-2.1 4,-3.0 1,-0.2 3,-0.4 0.935 107.9 46.5 -51.5 -57.6 28.2 22.7 54.3 714 350 B Q H X S+ 0 0 120 -4,-1.6 4,-2.1 1,-0.3 -1,-0.2 0.792 108.8 57.5 -63.7 -29.2 27.7 23.1 50.5 715 351 B N H X S+ 0 0 109 -4,-2.1 4,-1.8 -3,-0.2 -1,-0.3 0.902 112.1 39.1 -65.1 -46.7 31.3 22.5 49.9 716 352 B I H X S+ 0 0 11 -4,-1.8 4,-2.9 -3,-0.4 5,-0.4 0.871 111.6 58.2 -72.4 -38.1 31.2 19.1 51.6 717 353 B K H X S+ 0 0 79 -4,-3.0 4,-1.6 -5,-0.2 -2,-0.2 0.926 111.0 44.3 -51.9 -43.3 27.8 18.4 50.1 718 354 B Q H X S+ 0 0 141 -4,-2.1 4,-1.0 -5,-0.2 -2,-0.2 0.822 114.1 48.6 -74.3 -35.8 29.6 18.9 46.7 719 355 B T H >X S+ 0 0 51 -4,-1.8 4,-1.9 2,-0.2 3,-1.6 0.992 113.1 46.0 -62.8 -63.6 32.6 16.8 47.7 720 356 B N H 3X S+ 0 0 6 -4,-2.9 4,-2.0 1,-0.3 -2,-0.2 0.810 107.0 60.1 -50.3 -34.7 30.5 13.9 49.0 721 357 B S H 3X S+ 0 0 73 -4,-1.6 4,-0.8 -5,-0.4 -1,-0.3 0.866 108.0 44.8 -62.1 -35.2 28.3 14.1 45.9 722 358 B A H < S+ 0 0 150 -4,-0.8 3,-0.5 1,-0.2 -1,-0.2 0.753 104.2 51.2 -75.6 -22.1 29.6 9.1 41.9 726 362 B K H 3< S+ 0 0 147 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.864 105.5 55.4 -76.7 -38.1 32.8 7.0 42.0 727 363 B L T >< S+ 0 0 12 -4,-1.6 3,-1.7 -5,-0.1 2,-0.4 0.366 84.5 133.6 -67.9 7.0 31.1 4.5 44.2 728 364 B D T < + 0 0 121 -3,-0.5 -3,-0.1 1,-0.2 -4,-0.0 -0.484 62.7 27.8 -72.7 121.9 28.5 4.3 41.4 729 365 B G T > S- 0 0 46 -2,-0.4 3,-1.1 3,-0.0 -1,-0.2 0.211 100.7-126.4 116.3 -7.6 27.6 0.7 40.4 730 366 B G T < - 0 0 21 -3,-1.7 0, 0.0 1,-0.2 0, 0.0 -0.235 46.8 -64.1 64.7-160.7 28.3 -0.8 43.9 731 367 B I T > S+ 0 0 0 1,-0.1 3,-1.5 -406,-0.1 -1,-0.2 -0.087 97.6 125.8-101.4 30.5 30.7 -3.7 44.1 732 368 B E G X + 0 0 112 -3,-1.1 3,-1.8 1,-0.3 -1,-0.1 0.935 64.5 50.1 -61.3 -52.7 28.2 -5.7 42.0 733 369 B P G 3 S+ 0 0 93 0, 0.0 -1,-0.3 0, 0.0 -3,-0.1 0.195 111.2 54.1 -73.4 22.8 30.3 -6.9 39.1 734 370 B Y G < S+ 0 0 38 -3,-1.5 2,-0.3 -2,-0.1 -2,-0.2 0.255 77.9 118.0-135.3 5.8 32.9 -8.2 41.7 735 371 B R < - 0 0 87 -3,-1.8 -413,-0.1 -4,-0.2 -3,-0.0 -0.613 58.2-135.4 -85.7 137.0 30.7 -10.4 43.8 736 372 B L - 0 0 33 -2,-0.3 3,-0.2 -418,-0.1 -1,-0.0 -0.835 28.6-108.0-102.9 110.3 31.5 -14.1 44.0 737 373 B P - 0 0 105 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.261 44.8 -86.1 -31.5 147.1 28.5 -16.5 43.7 738 374 B E - 0 0 154 1,-0.1 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