==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 31-MAR-10 2XAG . COMPND 2 MOLECULE: LYSINE-SPECIFIC HISTONE DEMETHYLASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.BINDA,S.VALENTE,M.ROMANENGHI,S.PILOTTO,R.CIRILLI, . 799 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39188.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 579 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 47 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 307 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.1 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 2 2 4 1 3 2 1 0 1 1 1 0 2 0 0 1 1 0 0 1 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 1 2 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 3 3 2 0 2 0 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 . 3 1 1 0 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 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 0 130 0, 0.0 2,-0.3 0, 0.0 9,-0.1 0.000 360.0 360.0 360.0 160.3 -16.3 37.7 100.8 2 172 A S + 0 0 109 7,-0.0 3,-0.4 4,-0.0 2,-0.4 -0.976 360.0 48.4-152.7 172.5 -19.5 39.0 102.5 3 173 A G S > S- 0 0 33 -2,-0.3 4,-1.2 1,-0.2 0, 0.0 -0.860 119.2 -22.9 98.1-142.1 -21.4 39.8 105.8 4 174 A V H > S+ 0 0 37 -2,-0.4 4,-1.1 1,-0.2 -1,-0.2 0.790 149.2 48.3 -72.8 -28.2 -19.5 41.8 108.4 5 175 A E H > S+ 0 0 89 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.671 100.0 68.5 -81.4 -20.1 -16.2 40.7 106.8 6 176 A G H > S+ 0 0 11 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.940 99.8 49.1 -59.4 -48.1 -17.8 41.7 103.5 7 177 A A H < S+ 0 0 6 -4,-1.2 4,-0.4 2,-0.2 6,-0.2 0.926 105.8 54.2 -55.7 -52.7 -17.6 45.3 104.7 8 178 A A H ><>S+ 0 0 0 -4,-1.1 5,-3.2 1,-0.2 3,-0.6 0.887 113.6 43.3 -55.7 -42.3 -13.9 45.2 105.8 9 179 A F H ><5S+ 0 0 73 -4,-1.7 3,-2.2 1,-0.2 -1,-0.2 0.969 109.8 54.9 -60.4 -57.2 -12.9 43.9 102.4 10 180 A Q T 3<5S+ 0 0 45 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.435 109.0 52.7 -61.8 2.1 -15.2 46.4 100.5 11 181 A S T < 5S- 0 0 5 -3,-0.6 -1,-0.3 -4,-0.4 -2,-0.1 -0.129 120.8-107.9-125.1 30.4 -13.3 49.1 102.6 12 182 A R T < 5S+ 0 0 66 -3,-2.2 -3,-0.2 1,-0.1 -2,-0.1 0.768 80.9 125.5 44.0 36.2 -9.8 47.9 101.6 13 183 A L < - 0 0 22 -5,-3.2 2,-0.3 -6,-0.2 -2,-0.2 -0.946 68.5-113.3-124.6 147.4 -9.2 46.5 105.1 14 184 A P > - 0 0 35 0, 0.0 3,-0.8 0, 0.0 5,-0.1 -0.631 25.5-149.7 -74.1 129.8 -8.2 43.1 106.5 15 185 A H T 3 S+ 0 0 70 -2,-0.3 30,-0.2 1,-0.3 -7,-0.1 0.733 91.0 39.9 -77.6 -23.2 -11.2 41.8 108.4 16 186 A D T 3 S+ 0 0 103 -11,-0.1 2,-0.3 2,-0.0 -1,-0.3 -0.189 111.1 58.1-120.7 36.3 -9.3 39.8 111.0 17 187 A R S < S- 0 0 160 -3,-0.8 2,-0.4 24,-0.1 0, 0.0 -0.977 76.4-116.7-162.4 147.7 -6.4 42.2 111.7 18 188 A M - 0 0 20 -2,-0.3 -3,-0.1 1,-0.1 -2,-0.0 -0.811 35.9-126.1 -92.2 135.8 -5.8 45.7 113.0 19 189 A T > - 0 0 26 -2,-0.4 4,-2.3 -5,-0.1 3,-0.3 -0.110 23.9-103.8 -74.7 171.7 -4.2 48.2 110.5 20 190 A S H > S+ 0 0 111 1,-0.2 4,-0.6 2,-0.2 -1,-0.1 0.863 124.3 51.5 -58.9 -36.9 -1.0 50.3 111.0 21 191 A Q H > S+ 0 0 89 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.731 107.3 50.9 -78.3 -24.0 -3.3 53.3 111.4 22 192 A E H > S+ 0 0 0 -3,-0.3 4,-2.5 2,-0.2 3,-0.2 0.934 102.0 61.3 -76.3 -48.8 -5.5 51.6 114.0 23 193 A A H < S+ 0 0 31 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.760 107.8 46.2 -44.4 -27.6 -2.4 50.6 116.1 24 194 A A H < S+ 0 0 75 -4,-0.6 -1,-0.2 2,-0.2 -2,-0.2 0.869 115.6 42.3 -90.8 -37.9 -1.7 54.3 116.4 25 195 A C H < S+ 0 0 9 -4,-1.3 -2,-0.2 -3,-0.2 -3,-0.1 0.712 130.4 28.3 -71.0 -21.2 -5.3 55.4 117.3 26 196 A F >X + 0 0 0 -4,-2.5 4,-1.8 1,-0.1 3,-0.7 -0.237 66.1 148.0-140.3 45.4 -5.7 52.5 119.7 27 197 A P H 3> S+ 0 0 63 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.771 74.4 62.1 -58.8 -27.1 -2.3 51.5 121.0 28 198 A D H 34 S+ 0 0 75 2,-0.2 4,-0.4 1,-0.1 -2,-0.1 0.923 108.4 41.9 -63.1 -47.5 -4.0 50.4 124.2 29 199 A I H X4 S+ 0 0 8 -3,-0.7 3,-1.8 1,-0.2 8,-0.3 0.974 114.3 46.5 -62.8 -59.4 -6.0 47.8 122.4 30 200 A I H 3< S+ 0 0 59 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.719 113.7 48.6 -67.1 -19.2 -3.4 46.3 120.0 31 201 A S T 3< S+ 0 0 103 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.595 110.3 72.7 -90.3 -10.1 -0.7 46.0 122.7 32 202 A G S < S- 0 0 28 -3,-1.8 2,-0.2 -4,-0.4 -3,-0.1 0.215 97.1 -33.0 -87.1-153.6 -3.4 44.4 124.9 33 203 A P >> - 0 0 75 0, 0.0 4,-1.9 0, 0.0 3,-1.2 -0.472 43.6-127.4 -82.4 135.6 -5.1 41.0 124.9 34 204 A Q H 3> S+ 0 0 147 1,-0.3 4,-1.1 -2,-0.2 -2,-0.0 0.672 110.3 64.7 -43.5 -21.3 -6.0 38.9 121.8 35 205 A Q H 3> S+ 0 0 141 2,-0.2 4,-1.0 1,-0.1 -1,-0.3 0.940 102.3 39.8 -76.1 -50.7 -9.4 38.9 123.3 36 206 A T H X> S+ 0 0 48 -3,-1.2 4,-2.7 1,-0.2 3,-0.7 0.908 106.0 67.6 -66.5 -40.3 -10.2 42.7 123.1 37 207 A Q H 3X S+ 0 0 33 -4,-1.9 4,-3.0 1,-0.3 -1,-0.2 0.911 101.0 48.5 -44.0 -48.2 -8.6 42.9 119.7 38 208 A K H 3X S+ 0 0 148 -4,-1.1 4,-2.6 1,-0.2 -1,-0.3 0.840 108.7 53.2 -64.5 -32.9 -11.4 40.7 118.4 39 209 A V H < S+ 0 0 2 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.925 115.2 51.0 -60.5 -49.6 -22.5 52.4 106.7 52 222 A L H 3< S+ 0 0 17 -4,-3.6 -2,-0.2 1,-0.3 -1,-0.2 0.860 102.9 58.5 -61.8 -38.8 -22.1 50.3 103.6 53 223 A D T 3< S+ 0 0 115 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.566 126.3 15.6 -69.7 -7.2 -25.6 48.9 103.6 54 224 A N X + 0 0 84 -3,-1.4 3,-1.2 -4,-0.3 -1,-0.3 -0.293 67.2 159.1-163.8 58.9 -27.1 52.4 103.5 55 225 A P T 3 + 0 0 6 0, 0.0 41,-0.2 0, 0.0 39,-0.1 0.214 59.9 85.1 -86.3 24.5 -24.6 55.0 102.5 56 226 A K T 3 S+ 0 0 126 1,-0.1 42,-0.9 41,-0.1 2,-0.3 0.490 93.3 42.2 -94.4 -7.1 -27.3 57.5 101.4 57 227 A I B < S-a 98 0A 74 -3,-1.2 42,-0.2 40,-0.3 -1,-0.1 -0.999 96.4 -90.0-142.9 143.3 -27.7 58.9 105.0 58 228 A Q - 0 0 9 40,-3.6 2,-0.6 -2,-0.3 -2,-0.1 -0.031 33.7-138.2 -47.0 143.1 -25.4 59.8 107.8 59 229 A L - 0 0 15 -4,-0.1 2,-0.1 24,-0.1 -1,-0.1 -0.930 23.9-161.8-113.5 114.6 -24.4 57.1 110.3 60 230 A T > - 0 0 8 -2,-0.6 4,-1.8 1,-0.1 5,-0.1 -0.417 33.7-119.5 -95.0 160.9 -24.4 58.2 113.9 61 231 A F H > S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.848 117.8 56.8 -61.0 -36.5 -22.9 56.9 117.1 62 232 A E H > S+ 0 0 105 2,-0.2 4,-2.5 1,-0.2 3,-0.2 0.994 109.6 40.8 -50.1 -72.9 -26.5 56.8 118.3 63 233 A A H > S+ 0 0 31 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.705 114.2 55.9 -55.2 -27.6 -27.7 54.6 115.5 64 234 A T H X S+ 0 0 0 -4,-1.8 4,-0.6 2,-0.2 -1,-0.2 0.965 109.0 42.9 -72.9 -53.4 -24.6 52.4 115.7 65 235 A L H >< S+ 0 0 42 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.974 110.2 61.0 -54.6 -56.3 -24.9 51.6 119.4 66 236 A Q H 3< S+ 0 0 150 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.849 109.5 40.1 -26.3 -60.0 -28.5 51.0 118.7 67 237 A Q H 3< S+ 0 0 85 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.331 95.5 95.0 -93.3 7.6 -27.7 48.2 116.1 68 238 A L << - 0 0 3 -3,-2.1 2,-0.3 -4,-0.6 -25,-0.0 -0.518 65.1-135.4 -85.4 165.0 -24.9 46.4 117.9 69 239 A E >> - 0 0 132 -2,-0.2 4,-1.7 1,-0.0 3,-0.9 -0.859 29.9 -68.3-119.8 153.9 -25.4 43.4 120.2 70 240 A A T 34 S+ 0 0 74 1,-0.3 -1,-0.0 -2,-0.3 0, 0.0 -0.462 113.8 34.9 -63.1 149.5 -24.2 42.2 123.6 71 241 A P T >4 S+ 0 0 88 0, 0.0 3,-1.3 0, 0.0 4,-0.5 -0.992 128.1 44.9 -73.0 -11.9 -21.4 41.4 124.5 72 242 A Y T <4 S+ 0 0 77 -3,-0.9 -2,-0.3 1,-0.3 3,-0.3 0.855 106.6 55.3 -71.7 -40.1 -20.2 44.0 122.1 73 243 A N T 3< S+ 0 0 50 -4,-1.7 -1,-0.3 1,-0.2 -3,-0.2 0.171 89.7 86.3 -80.7 21.7 -22.5 46.9 122.8 74 244 A S S < S+ 0 0 88 -3,-1.3 2,-1.1 -5,-0.3 -1,-0.2 0.960 79.2 54.5 -76.6 -69.4 -21.5 46.7 126.5 75 245 A D > + 0 0 71 -4,-0.5 4,-1.8 -3,-0.3 -1,-0.2 -0.506 62.6 172.7 -69.2 97.8 -18.3 48.9 126.5 76 246 A T H > S+ 0 0 67 -2,-1.1 4,-1.3 1,-0.2 -1,-0.2 0.675 72.7 67.6 -87.5 -14.8 -19.7 52.2 125.0 77 247 A V H > S+ 0 0 107 2,-0.2 4,-2.0 3,-0.1 -1,-0.2 0.919 107.9 42.6 -62.2 -41.8 -16.5 54.1 125.7 78 248 A L H > S+ 0 0 8 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.980 108.6 52.9 -68.5 -60.8 -15.0 51.8 123.0 79 249 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 5,-0.2 0.811 111.2 52.9 -47.7 -29.8 -17.8 51.8 120.4 80 250 A H H X S+ 0 0 87 -4,-1.3 4,-2.6 2,-0.2 -1,-0.2 0.987 106.5 48.8 -70.4 -58.1 -17.5 55.6 120.6 81 251 A R H X S+ 0 0 30 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.880 114.9 47.8 -41.7 -48.2 -13.8 55.6 120.0 82 252 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.973 110.1 47.8 -65.1 -56.4 -14.3 53.3 117.0 83 253 A H H X S+ 0 0 6 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.880 113.9 51.4 -52.7 -39.3 -17.3 55.2 115.3 84 254 A S H X S+ 0 0 25 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.952 108.0 49.4 -62.4 -52.9 -15.2 58.4 115.8 85 255 A Y H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 6,-0.2 0.924 112.7 48.3 -49.9 -49.2 -12.1 57.0 114.1 86 256 A L H <>S+ 0 0 0 -4,-2.6 6,-2.0 1,-0.2 5,-1.0 0.825 112.6 48.2 -66.8 -28.9 -14.1 55.7 111.2 87 257 A E H ><5S+ 0 0 55 -4,-1.5 3,-0.8 -5,-0.3 -1,-0.2 0.908 112.0 48.7 -73.8 -41.8 -15.8 59.1 110.8 88 258 A R H 3<5S+ 0 0 29 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.963 112.7 45.7 -66.1 -54.4 -12.6 61.1 111.0 89 259 A H T 3<5S- 0 0 24 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.266 112.9-114.5 -84.2 13.7 -10.7 59.0 108.5 90 260 A G T < 5S+ 0 0 2 -3,-0.8 -3,-0.2 2,-0.2 -4,-0.1 0.514 81.0 121.3 81.7 6.8 -13.5 58.9 106.0 91 261 A L S S- 0 0 15 26,-0.2 4,-2.3 27,-0.2 28,-0.2 0.156 75.5 -90.5 -49.5-179.7 -10.1 68.1 91.5 118 288 A V H > S+ 0 0 11 26,-0.4 4,-2.4 2,-0.2 5,-0.2 0.903 132.4 51.6 -67.1 -37.6 -11.9 65.0 92.8 119 289 A S H > S+ 0 0 7 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.991 112.0 43.0 -64.6 -57.8 -9.2 65.0 95.5 120 290 A G H > S+ 0 0 0 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.946 115.7 49.3 -44.5 -59.4 -9.8 68.6 96.6 121 291 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.885 111.0 50.1 -48.8 -46.5 -13.6 68.3 96.4 122 292 A A H X S+ 0 0 5 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.938 114.1 44.1 -64.0 -44.6 -13.5 65.1 98.4 123 293 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.2 3,-0.3 0.938 111.2 54.4 -62.4 -47.9 -11.3 66.8 101.1 124 294 A A H X S+ 0 0 0 -4,-3.5 4,-2.6 1,-0.3 5,-0.2 0.928 107.5 49.4 -53.2 -52.2 -13.4 70.0 101.1 125 295 A R H X S+ 0 0 45 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.3 0.837 110.9 51.9 -56.1 -36.5 -16.6 68.1 101.8 126 296 A Q H X S+ 0 0 2 -4,-1.4 4,-1.8 -3,-0.3 3,-0.2 0.988 111.5 42.9 -67.4 -55.9 -15.0 66.3 104.6 127 297 A L H <>S+ 0 0 0 -4,-2.5 5,-2.1 1,-0.2 -2,-0.2 0.885 111.4 55.5 -56.6 -45.8 -13.6 69.3 106.5 128 298 A Q H ><5S+ 0 0 49 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.906 110.4 46.2 -52.5 -45.4 -16.8 71.3 106.0 129 299 A S H 3<5S+ 0 0 18 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.787 105.1 60.3 -69.9 -29.0 -18.7 68.4 107.6 130 300 A F T 3<5S- 0 0 34 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.392 128.3-100.6 -76.2 3.4 -16.1 68.2 110.3 131 301 A G T < 5S+ 0 0 5 -3,-1.4 -23,-2.3 1,-0.3 -3,-0.2 0.686 77.7 132.9 85.9 22.9 -17.1 71.9 111.1 132 302 A M < - 0 0 3 -5,-2.1 2,-0.8 -25,-0.2 -1,-0.3 -0.646 60.4-112.8-103.5 161.8 -14.3 73.9 109.4 133 303 A D E -b 110 0B 54 -24,-2.2 -22,-2.4 -25,-0.4 2,-0.4 -0.836 43.5-176.5 -94.6 111.5 -14.4 76.9 107.1 134 304 A V E +b 111 0B 6 -2,-0.8 279,-0.5 -24,-0.2 2,-0.4 -0.872 16.0 178.1-117.4 143.3 -13.2 75.8 103.6 135 305 A T E -b 112 0B 2 -24,-2.0 -22,-2.8 -2,-0.4 2,-0.4 -0.998 14.0-151.2-139.6 137.4 -12.6 77.6 100.3 136 306 A L E -bd 113 414B 1 277,-3.1 279,-3.4 -2,-0.4 2,-0.5 -0.904 1.9-153.1-112.2 137.0 -11.3 76.1 97.1 137 307 A L E -bd 114 415B 3 -24,-2.6 -22,-3.1 -2,-0.4 2,-0.4 -0.928 16.7-178.4-109.9 120.6 -9.4 77.9 94.4 138 308 A E - 0 0 12 277,-2.7 280,-2.4 -2,-0.5 279,-0.1 -0.972 23.1-157.0-124.5 122.1 -9.7 76.6 90.9 139 309 A A S S+ 0 0 14 -2,-0.4 298,-0.2 278,-0.3 280,-0.2 0.889 75.3 73.3 -62.5 -39.6 -7.9 78.0 87.8 140 310 A R S S- 0 0 27 2,-0.2 277,-2.2 277,-0.1 278,-0.2 -0.143 88.7-117.1 -73.1 165.9 -10.5 76.6 85.4 141 311 A D S S+ 0 0 122 275,-0.2 2,-0.3 276,-0.1 -1,-0.1 0.108 97.7 38.4 -88.4 21.0 -14.1 77.8 84.7 142 312 A R S S- 0 0 74 0, 0.0 3,-0.3 0, 0.0 -2,-0.2 -0.972 81.0-108.4-158.2 170.2 -15.3 74.4 85.9 143 313 A V S S+ 0 0 25 -2,-0.3 -26,-0.2 1,-0.1 263,-0.2 -0.405 80.7 57.4 -96.2 169.9 -14.8 71.7 88.5 144 314 A G > - 0 0 2 -28,-2.2 3,-3.1 -27,-0.2 -26,-0.4 0.205 67.9-157.9 96.3 -16.4 -13.4 68.1 88.3 145 315 A G T 3 S+ 0 0 8 1,-0.3 -28,-0.1 -3,-0.3 442,-0.0 -0.189 83.5 20.3 53.0-110.5 -10.0 68.9 86.8 146 316 A R T 3 S+ 0 0 53 1,-0.2 15,-1.2 14,-0.1 2,-0.8 0.453 112.3 82.3 -76.0 1.1 -8.8 65.8 85.2 147 317 A V < + 0 0 7 -3,-3.1 2,-0.3 13,-0.2 -1,-0.2 -0.804 65.0 160.7-101.5 84.8 -12.4 64.6 85.1 148 318 A A - 0 0 8 -2,-0.8 12,-1.7 -4,-0.1 11,-0.7 -0.852 20.5-170.0-105.7 144.4 -13.6 66.4 82.0 149 319 A T E -G 158 0C 24 -2,-0.3 9,-0.3 9,-0.3 2,-0.3 -0.948 18.8-136.5-139.4 111.1 -16.7 65.5 80.0 150 320 A F E -G 157 0C 41 7,-3.3 7,-2.3 -2,-0.4 2,-0.4 -0.505 27.6-175.9 -64.7 128.1 -17.5 67.0 76.6 151 321 A R E +G 156 0C 116 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.999 17.5 139.2-129.2 137.2 -21.2 67.8 76.4 152 322 A K E > S-G 155 0C 111 3,-2.0 3,-2.1 -2,-0.4 2,-0.4 -0.792 71.8 -31.9-175.6 134.8 -23.1 69.2 73.4 153 323 A G T 3 S- 0 0 77 1,-0.3 0, 0.0 -2,-0.2 0, 0.0 -0.371 125.3 -35.9 47.8-105.7 -26.5 68.4 72.0 154 324 A N T 3 S+ 0 0 145 -2,-0.4 376,-0.4 -3,-0.1 -1,-0.3 0.379 112.3 113.9-122.0 -8.2 -26.8 64.8 73.0 155 325 A Y E < +G 152 0C 44 -3,-2.1 -3,-2.0 374,-0.1 2,-0.3 -0.518 40.4 175.8 -65.5 133.8 -23.2 64.0 72.5 156 326 A V E +G 151 0C 24 -2,-0.2 2,-0.3 -5,-0.2 -5,-0.2 -0.963 7.8 154.9-141.7 116.0 -21.5 63.1 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5,-0.2 0.889 121.4 57.3 -57.4 -37.9 45.4 -35.4 51.0 746 386 B E H >> S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 3,-0.9 0.982 108.0 44.1 -49.0 -63.4 43.7 -32.6 48.9 747 387 B E H 3> S+ 0 0 22 1,-0.3 4,-3.0 2,-0.2 -2,-0.2 0.885 109.9 55.3 -55.3 -44.9 42.1 -31.0 51.9 748 388 B Q H 3X S+ 0 0 33 -4,-2.6 4,-2.6 1,-0.2 -1,-0.3 0.828 108.6 48.1 -59.0 -36.0 45.2 -31.2 54.1 749 389 B L H X S+ 0 0 1 -4,-3.0 4,-2.0 1,-0.2 3,-0.8 0.980 106.3 52.5 -49.2 -66.6 44.5 -26.4 54.9 752 392 B V H 3X S+ 0 0 35 -4,-2.6 4,-1.2 1,-0.3 -1,-0.2 0.730 111.8 47.1 -46.7 -30.1 48.3 -26.1 55.3 753 393 B Q H 3X S+ 0 0 42 -4,-1.4 4,-1.2 -3,-0.4 -1,-0.3 0.883 106.3 56.5 -82.1 -39.6 48.4 -23.2 52.8 754 394 B A H < S- 0 0 21 -4,-2.9 3,-2.0 1,-0.2 2,-0.4 0.410 80.1-160.4-123.4 -2.5 45.4 -16.6 57.2 759 399 B G T 3< S- 0 0 0 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.1 -0.382 73.6 -10.6 60.7-112.2 47.2 -17.5 60.5 760 400 B R T 3 S+ 0 0 131 -2,-0.4 2,-3.0 1,-0.1 -1,-0.3 0.341 92.9 121.8-102.8 5.5 44.7 -18.3 63.2 761 401 B D X> + 0 0 73 -3,-2.0 4,-2.0 1,-0.2 3,-0.8 -0.348 34.3 174.8 -70.9 70.7 41.5 -17.2 61.3 762 402 B F H 3> S+ 0 0 58 -2,-3.0 4,-2.0 1,-0.3 -1,-0.2 0.713 73.9 61.6 -52.3 -24.1 40.0 -20.7 61.7 763 403 B Q H 3> S+ 0 0 93 2,-0.2 4,-2.3 -3,-0.2 -1,-0.3 0.970 107.5 40.4 -66.4 -55.0 36.8 -19.2 60.1 764 404 B A H <> S+ 0 0 0 -3,-0.8 4,-2.9 2,-0.2 5,-0.2 0.967 114.0 52.7 -58.5 -58.5 38.5 -18.3 56.8 765 405 B I H X S+ 0 0 2 -4,-2.0 4,-2.6 1,-0.2 5,-0.3 0.893 109.7 51.7 -42.1 -48.4 40.6 -21.5 56.7 766 406 B S H X S+ 0 0 12 -4,-2.0 4,-2.2 -5,-0.3 6,-0.5 0.963 110.2 46.1 -53.4 -58.2 37.3 -23.4 57.2 767 407 B D H < S+ 0 0 63 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.905 113.3 51.6 -53.7 -46.1 35.5 -21.6 54.3 768 408 B V H < S+ 0 0 6 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.936 110.5 44.6 -59.9 -54.0 38.6 -22.1 52.0 769 409 B I H < S- 0 0 11 -4,-2.6 2,-1.3 -5,-0.2 -1,-0.2 0.798 98.9-156.8 -62.3 -29.0 38.9 -25.9 52.6 770 410 B G S < S+ 0 0 19 -4,-2.2 2,-0.3 -5,-0.3 -1,-0.2 -0.575 72.0 50.9 96.8 -74.9 35.1 -25.9 52.1 771 411 B N S S+ 0 0 29 -2,-1.3 -31,-0.5 -3,-0.1 2,-0.4 -0.284 88.1 97.1 -98.7 45.3 33.9 -29.0 53.9 772 412 B K - 0 0 1 -6,-0.5 -2,-0.2 -2,-0.3 2,-0.1 -0.989 67.9-129.2-134.7 130.2 35.5 -28.6 57.2 773 413 B S > - 0 0 32 -2,-0.4 4,-2.3 -33,-0.2 5,-0.2 -0.432 29.8-108.8 -74.7 148.9 33.9 -27.0 60.4 774 414 B V H > S+ 0 0 58 1,-0.2 4,-0.8 2,-0.2 -1,-0.1 0.594 122.3 49.0 -52.3 -12.9 35.6 -24.2 62.3 775 415 B V H > S+ 0 0 83 2,-0.2 4,-2.5 3,-0.1 3,-0.4 0.901 103.1 54.4 -92.9 -57.6 36.2 -26.9 65.0 776 416 B Q H > S+ 0 0 38 1,-0.3 4,-3.2 2,-0.2 -2,-0.2 0.846 108.3 56.6 -43.4 -39.8 37.7 -29.7 62.8 777 417 B V H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -1,-0.3 0.949 106.3 44.7 -58.0 -55.2 40.1 -27.0 61.7 778 418 B K H X S+ 0 0 113 -4,-0.8 4,-0.5 -3,-0.4 -1,-0.2 0.825 114.3 52.4 -63.5 -30.4 41.3 -26.2 65.3 779 419 B N H >X S+ 0 0 82 -4,-2.5 4,-2.0 2,-0.2 3,-2.0 0.954 105.5 52.6 -66.0 -53.7 41.5 -30.0 65.8 780 420 B F H 3X>S+ 0 0 2 -4,-3.2 4,-2.1 1,-0.3 5,-0.7 0.911 100.0 66.0 -40.1 -51.7 43.6 -30.4 62.7 781 421 B F H 3<5S+ 0 0 23 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.743 109.5 36.0 -46.7 -31.0 45.9 -27.7 64.2 782 422 B V H <<5S+ 0 0 96 -3,-2.0 4,-0.5 -4,-0.5 -1,-0.2 0.878 115.9 48.7 -95.9 -43.3 46.8 -30.0 67.0 783 423 B N H ><5S+ 0 0 83 -4,-2.0 3,-0.5 1,-0.2 4,-0.3 0.943 124.0 29.7 -63.7 -50.2 47.0 -33.5 65.4 784 424 B Y T 3X5S+ 0 0 44 -4,-2.1 4,-2.3 1,-0.2 5,-0.3 0.697 90.5 98.7 -88.0 -19.9 49.1 -32.6 62.4 785 425 B R T 34XS+ 0 0 105 -5,-0.7 5,-1.0 1,-0.2 6,-0.5 0.791 85.5 55.1 -27.1 -44.8 50.9 -29.8 64.3 786 426 B R T X45S+ 0 0 195 -3,-0.5 3,-0.9 -4,-0.5 -1,-0.2 0.989 116.0 29.5 -51.7 -69.3 53.6 -32.5 64.6 787 427 B R T 345S+ 0 0 156 -4,-0.3 -2,-0.2 1,-0.2 -1,-0.1 0.613 120.3 48.9 -81.2 -21.8 54.1 -33.5 61.0 788 428 B F T 3<5S- 0 0 59 -4,-2.3 5,-0.3 4,-0.0 -1,-0.2 0.165 101.0-124.8-102.5 17.4 53.3 -30.2 59.1 789 429 B N T <>5 + 0 0 79 -3,-0.9 4,-2.3 -5,-0.3 3,-0.2 0.885 42.2 174.3 32.7 54.7 55.6 -28.1 61.3 790 430 B I H > S+ 0 0 74 -6,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.982 107.6 43.4 -54.0 -60.0 54.6 -24.0 64.5 792 432 B E H > S+ 0 0 110 -3,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.879 112.4 51.9 -55.4 -46.5 56.9 -23.0 61.7 793 433 B V H X S+ 0 0 28 -4,-2.3 4,-1.5 -5,-0.3 3,-0.3 0.934 111.1 48.1 -60.6 -45.0 54.0 -22.2 59.3 794 434 B L H X S+ 0 0 14 -4,-2.2 4,-2.2 1,-0.2 3,-0.2 0.913 109.8 50.5 -64.1 -42.8 52.4 -20.0 61.9 795 435 B Q H X S+ 0 0 110 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.727 106.8 55.9 -72.2 -18.0 55.5 -18.0 62.7 796 436 B E H < S+ 0 0 115 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.843 109.2 46.8 -73.3 -36.2 56.1 -17.5 59.0 797 437 B W H >< S+ 0 0 92 -4,-1.5 3,-1.2 -3,-0.2 -2,-0.2 0.865 111.0 52.5 -70.5 -38.8 52.7 -15.9 58.8 798 438 B E H 3< S+ 0 0 112 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.843 98.5 64.7 -62.4 -37.2 53.5 -13.9 61.9 799 439 B A T 3< 0 0 84 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.414 360.0 360.0 -71.0 3.4 56.7 -12.6 60.3 800 440 B E < 0 0 171 -3,-1.2 -1,-0.1 -5,-0.0 -4,-0.0 -0.900 360.0 360.0-109.0 360.0 54.5 -10.8 57.6