==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-MAY-11 2YIR . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE CHK2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.T.LOUNTOS,A.G.JOBSON,J.E.TROPEA,C.SELF,G.ZHANG,Y.POMMIER, . 286 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16681.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 16 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 2 1 3 1 0 0 2 0 0 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 2 1 0 1 3 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 . 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 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 1 210 A S 0 0 149 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 168.0 62.1 26.5 4.9 2 211 A V - 0 0 122 1,-0.1 3,-0.1 0, 0.0 0, 0.0 -0.527 360.0 -87.1-105.5 170.0 63.8 24.6 2.1 3 212 A Y - 0 0 60 -2,-0.2 -1,-0.1 1,-0.1 10,-0.0 -0.514 59.2 -90.5 -70.3 148.9 63.2 21.2 0.4 4 213 A P > - 0 0 25 0, 0.0 4,-2.4 0, 0.0 3,-0.4 -0.289 31.2-121.0 -60.2 147.8 65.0 18.3 2.1 5 214 A K H > S+ 0 0 173 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.874 111.2 55.6 -56.5 -44.1 68.5 17.5 0.8 6 215 A A H > S+ 0 0 56 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.857 110.2 46.1 -62.7 -35.3 67.6 13.9 -0.1 7 216 A L H >> S+ 0 0 0 -3,-0.4 4,-2.1 2,-0.2 3,-1.2 0.955 112.0 49.9 -68.3 -51.4 64.7 15.2 -2.3 8 217 A R H 3< S+ 0 0 132 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.817 103.3 63.3 -56.0 -33.8 66.8 17.9 -3.9 9 218 A D H 3< S+ 0 0 126 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.825 117.4 24.7 -59.7 -34.5 69.5 15.3 -4.6 10 219 A E H << S+ 0 0 74 -3,-1.2 21,-2.6 -4,-0.7 22,-0.4 0.601 123.6 41.9-106.1 -20.6 67.1 13.3 -7.0 11 220 A Y E < -A 30 0A 5 -4,-2.1 2,-0.5 19,-0.2 19,-0.2 -0.971 60.6-140.5-136.9 147.1 64.6 15.9 -8.2 12 221 A I E -A 29 0A 83 17,-2.3 17,-2.2 -2,-0.3 2,-0.2 -0.945 32.7-136.7-102.5 123.2 64.5 19.5 -9.4 13 222 A M E +A 28 0A 34 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.594 30.6 165.3 -90.1 144.2 61.4 21.2 -8.0 14 223 A S E - 0 0 45 13,-3.0 -1,-0.1 1,-0.3 14,-0.1 -0.267 35.1 -15.9-132.3-147.3 59.1 23.4 -10.1 15 224 A K E - 0 0 136 11,-0.1 12,-3.1 1,-0.1 2,-0.4 -0.046 64.6 -97.7 -69.0 163.8 55.7 25.1 -10.2 16 225 A T E -A 26 0A 67 10,-0.2 10,-0.2 1,-0.1 -1,-0.1 -0.644 31.8-179.5 -81.4 130.1 52.6 24.4 -8.1 17 226 A L E - 0 0 91 8,-3.0 2,-0.3 -2,-0.4 9,-0.2 0.686 63.7 -21.7 -98.0 -26.5 50.0 22.2 -9.8 18 227 A G E -A 25 0A 24 7,-1.5 7,-2.1 67,-0.1 2,-0.3 -0.975 54.3-124.8-170.8 173.6 47.4 22.2 -7.0 19 228 A S E +A 24 0A 85 -2,-0.3 2,-0.2 5,-0.3 5,-0.2 -0.999 16.2 179.0-140.4 136.7 46.5 22.7 -3.3 20 229 A G - 0 0 38 3,-0.9 5,-0.0 -2,-0.3 -2,-0.0 -0.630 46.8-104.4-113.0-177.9 44.9 20.6 -0.5 21 230 A A S S+ 0 0 119 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 0.876 125.2 50.2 -70.2 -40.5 44.2 21.5 3.1 22 231 A C S S- 0 0 57 1,-0.2 21,-1.7 20,-0.1 2,-0.3 0.850 127.7 -68.6 -62.0 -41.5 47.2 19.2 4.0 23 232 A G - 0 0 18 19,-0.2 -3,-0.9 20,-0.0 -1,-0.2 -0.892 57.9 -55.8 158.8 174.3 49.5 20.8 1.4 24 233 A E E -A 19 0A 71 -2,-0.3 17,-3.0 -5,-0.2 2,-0.5 -0.065 30.4-132.7 -75.6 166.3 50.5 21.5 -2.2 25 234 A V E -AB 18 40A 38 -7,-2.1 -8,-3.0 15,-0.2 -7,-1.5 -0.996 30.9-163.7-113.6 126.4 51.1 19.3 -5.2 26 235 A K E -AB 16 39A 23 13,-3.0 13,-2.8 -2,-0.5 2,-0.3 -0.859 19.9-123.4-112.2 146.0 54.3 20.4 -7.1 27 236 A L E + B 0 38A 12 -12,-3.1 -13,-3.0 -2,-0.3 2,-0.3 -0.640 40.0 172.0 -75.1 139.0 55.7 19.7 -10.5 28 237 A A E -AB 13 37A 0 9,-2.2 9,-2.9 -2,-0.3 2,-0.5 -0.970 28.3-133.4-143.7 161.6 59.2 18.1 -10.4 29 238 A F E -AB 12 36A 64 -17,-2.2 -17,-2.3 -2,-0.3 2,-0.5 -0.982 20.8-130.3-118.1 127.8 61.7 16.6 -12.7 30 239 A E E >> -AB 11 35A 26 5,-2.7 4,-2.5 -2,-0.5 5,-0.5 -0.640 16.1-145.9 -73.1 123.2 63.5 13.4 -11.9 31 240 A R T 45S+ 0 0 123 -21,-2.6 -1,-0.2 -2,-0.5 -20,-0.1 0.893 92.4 55.9 -61.0 -43.2 67.2 14.1 -12.5 32 241 A K T 45S+ 0 0 190 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.847 126.2 18.0 -56.9 -39.8 68.0 10.5 -13.7 33 242 A T T 45S- 0 0 72 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.551 91.2-131.9-111.6 -14.1 65.4 10.5 -16.5 34 243 A C T <5 + 0 0 104 -4,-2.5 2,-0.2 1,-0.2 -3,-0.2 0.694 62.2 137.9 59.3 23.4 64.6 14.2 -16.9 35 244 A K E < -B 30 0A 152 -5,-0.5 -5,-2.7 1,-0.1 -1,-0.2 -0.675 57.5-103.0-103.3 154.9 61.0 13.2 -16.8 36 245 A K E +B 29 0A 101 -2,-0.2 45,-0.5 -7,-0.2 2,-0.3 -0.477 40.2 172.2 -77.8 140.4 58.1 15.0 -15.1 37 246 A V E -B 28 0A 2 -9,-2.9 -9,-2.2 -2,-0.2 2,-0.4 -0.892 28.9-120.2-135.3 166.6 56.7 13.8 -11.8 38 247 A A E -BC 27 79A 7 41,-3.1 41,-3.0 -2,-0.3 2,-0.5 -0.906 19.7-158.1-106.1 142.5 54.2 15.1 -9.3 39 248 A I E -BC 26 78A 0 -13,-2.8 -13,-3.0 -2,-0.4 2,-0.5 -0.966 3.3-156.6-123.2 114.9 55.2 15.7 -5.6 40 249 A K E -BC 25 77A 43 37,-3.0 37,-2.7 -2,-0.5 2,-0.5 -0.788 8.8-155.5 -89.6 124.6 52.5 15.8 -3.0 41 250 A I E - C 0 76A 18 -17,-3.0 2,-0.4 -2,-0.5 35,-0.2 -0.869 11.4-176.7-102.0 128.3 53.5 17.6 0.2 42 251 A I E - C 0 75A 29 33,-2.4 33,-3.0 -2,-0.5 -19,-0.2 -0.984 22.9-134.6-123.2 118.3 51.8 16.8 3.5 43 252 A S E C 0 74A 72 -21,-1.7 31,-0.2 -2,-0.4 30,-0.0 -0.383 360.0 360.0 -73.4 147.0 52.8 18.9 6.4 44 253 A K 0 0 135 29,-0.5 -1,-0.1 -2,-0.1 30,-0.1 0.902 360.0 360.0 -87.8 360.0 53.6 17.4 9.8 45 ! 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 46 268 A L 0 0 195 0, 0.0 104,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -63.2 46.0 7.3 10.5 47 269 A N > - 0 0 84 1,-0.1 4,-1.7 4,-0.0 3,-0.2 -0.310 360.0-119.4 -86.2 162.5 49.7 8.3 9.7 48 270 A V H > S+ 0 0 14 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.890 106.9 58.4 -65.1 -40.7 51.2 8.9 6.3 49 271 A E H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.883 109.3 46.0 -60.2 -39.9 54.0 6.2 6.4 50 272 A T H > S+ 0 0 57 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.853 111.1 52.4 -71.1 -35.2 51.3 3.5 6.9 51 273 A E H X S+ 0 0 19 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.947 110.3 48.9 -59.1 -48.7 49.2 5.1 4.0 52 274 A I H X S+ 0 0 6 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.908 109.0 53.6 -59.3 -41.2 52.3 4.9 1.8 53 275 A E H X S+ 0 0 109 -4,-2.1 4,-1.0 -5,-0.2 -1,-0.2 0.906 108.7 49.0 -59.8 -43.4 52.8 1.3 2.9 54 276 A I H >X S+ 0 0 16 -4,-2.2 4,-1.1 1,-0.2 3,-1.1 0.968 112.8 47.3 -57.4 -52.2 49.2 0.5 1.9 55 277 A L H 3< S+ 0 0 5 -4,-2.6 11,-0.3 1,-0.3 -2,-0.2 0.809 105.0 59.7 -66.6 -29.4 49.7 2.1 -1.5 56 278 A K H 3< S+ 0 0 119 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.796 107.7 46.9 -64.2 -28.3 53.0 0.4 -2.1 57 279 A K H << S+ 0 0 163 -3,-1.1 2,-0.2 -4,-1.0 -1,-0.2 0.702 94.6 89.7 -86.6 -22.6 51.3 -3.0 -1.9 58 280 A L < - 0 0 18 -4,-1.1 2,-0.3 -3,-0.2 58,-0.0 -0.574 51.6-175.3 -82.6 141.4 48.3 -2.1 -4.2 59 281 A N + 0 0 115 -2,-0.2 5,-0.1 6,-0.1 6,-0.1 -0.800 29.6 123.8-142.0 89.0 48.7 -2.8 -7.9 60 282 A H > - 0 0 30 3,-0.4 3,-1.8 -2,-0.3 52,-0.0 -0.985 59.4-128.4-147.5 138.6 45.8 -1.6 -10.1 61 283 A P T 3 S+ 0 0 41 0, 0.0 4,-0.1 0, 0.0 51,-0.0 0.683 109.5 53.3 -67.0 -15.7 45.8 0.7 -13.0 62 284 A C T 3 S+ 0 0 0 46,-0.1 82,-2.5 81,-0.1 2,-0.4 0.118 97.6 78.1-103.4 20.4 43.0 2.9 -11.5 63 285 A I B < S-e 144 0B 2 -3,-1.8 -3,-0.4 80,-0.3 82,-0.2 -0.999 90.0-107.9-129.6 129.5 44.9 3.4 -8.2 64 286 A I - 0 0 5 80,-2.2 2,-0.3 -2,-0.4 -6,-0.1 -0.195 31.1-142.1 -57.1 137.8 47.7 5.8 -7.9 65 287 A K - 0 0 97 -4,-0.1 15,-0.5 -6,-0.1 2,-0.5 -0.808 9.1-128.6-104.4 145.9 51.2 4.4 -7.5 66 288 A I E +D 79 0A 18 -2,-0.3 13,-0.2 -11,-0.3 3,-0.1 -0.831 22.0 179.3 -96.4 127.1 54.0 5.8 -5.3 67 289 A K E - 0 0 86 11,-3.3 2,-0.3 -2,-0.5 12,-0.2 0.813 68.8 -12.5 -91.5 -39.4 57.4 6.4 -7.0 68 290 A N E -D 78 0A 41 10,-1.5 10,-2.8 2,-0.0 -1,-0.4 -0.978 56.7-153.0-158.2 166.0 59.2 7.7 -4.0 69 291 A F E -D 77 0A 51 -2,-0.3 2,-0.4 8,-0.2 8,-0.2 -0.985 3.4-169.4-150.3 131.3 58.7 9.0 -0.4 70 292 A F E -D 76 0A 25 6,-2.8 6,-2.7 -2,-0.3 2,-0.8 -0.980 6.0-163.9-128.9 122.9 60.6 11.4 1.8 71 293 A D E +D 75 0A 75 -2,-0.4 4,-0.2 4,-0.2 2,-0.1 -0.860 44.4 120.6-106.4 94.6 59.8 11.7 5.5 72 294 A A S S- 0 0 33 2,-2.6 -69,-0.0 -2,-0.8 3,-0.0 -0.079 85.4 -32.5-127.8-137.9 61.5 15.0 6.6 73 295 A E S S+ 0 0 150 -2,-0.1 -29,-0.5 -29,-0.1 2,-0.2 0.927 140.2 6.2 -55.3 -44.4 60.2 18.3 8.0 74 296 A D E S-C 43 0A 40 -31,-0.2 -2,-2.6 -30,-0.1 2,-0.4 -0.721 96.3 -93.9-121.1 176.9 57.1 17.5 6.0 75 297 A Y E -CD 42 71A 29 -33,-3.0 -33,-2.4 -2,-0.2 2,-0.5 -0.832 33.0-165.3 -93.8 135.5 56.2 14.4 3.9 76 298 A Y E -CD 41 70A 10 -6,-2.7 -6,-2.8 -2,-0.4 2,-0.5 -0.989 2.9-169.5-121.3 122.9 57.0 14.4 0.3 77 299 A I E -CD 40 69A 10 -37,-2.7 -37,-3.0 -2,-0.5 2,-0.5 -0.963 7.7-154.1-117.6 121.4 55.3 11.8 -1.9 78 300 A V E +CD 39 68A 0 -10,-2.8 -11,-3.3 -2,-0.5 -10,-1.5 -0.798 26.1 154.5 -97.9 128.7 56.5 11.3 -5.5 79 301 A L E -CD 38 66A 14 -41,-3.0 -41,-3.1 -2,-0.5 -13,-0.1 -0.909 47.5 -74.0-142.5 170.8 54.0 9.9 -8.1 80 302 A E - 0 0 103 -15,-0.5 2,-0.2 -2,-0.3 -43,-0.2 -0.310 59.1 -97.5 -64.1 152.5 53.4 10.0 -11.8 81 303 A L - 0 0 30 -45,-0.5 2,-0.6 1,-0.1 -1,-0.1 -0.508 28.0-162.0 -73.2 133.2 52.0 13.1 -13.2 82 304 A M > - 0 0 21 -2,-0.2 3,-2.0 1,-0.1 51,-0.3 -0.819 11.0-176.6-117.1 87.5 48.2 13.1 -13.7 83 305 A E T 3 S+ 0 0 107 51,-1.2 52,-0.2 -2,-0.6 51,-0.2 0.658 72.7 67.1 -68.6 -19.5 47.9 16.0 -16.0 84 306 A G T 3 S- 0 0 14 49,-2.2 -1,-0.3 1,-0.2 50,-0.2 0.674 93.2-153.1 -69.8 -19.4 44.2 16.0 -16.2 85 307 A G E < -F 133 0B 29 -3,-2.0 48,-2.9 48,-0.8 -1,-0.2 -0.349 40.8 -14.6 76.8-158.6 44.0 17.1 -12.6 86 308 A E E > -F 132 0B 58 46,-0.2 3,-0.9 1,-0.1 4,-0.4 -0.533 50.0-131.9 -83.6 145.7 41.1 16.4 -10.2 87 309 A L T >> S+ 0 0 0 44,-2.9 3,-2.1 41,-0.9 4,-0.7 0.844 103.6 75.1 -56.8 -35.1 37.7 15.2 -11.3 88 310 A F H >> S+ 0 0 72 40,-1.4 3,-1.3 43,-0.3 4,-1.2 0.861 88.7 55.5 -42.6 -48.8 36.4 18.0 -9.0 89 311 A D H <4 S+ 0 0 88 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.657 103.9 55.4 -66.7 -17.6 37.4 20.7 -11.5 90 312 A K H <4 S+ 0 0 60 -3,-2.1 -1,-0.3 -4,-0.4 -2,-0.2 0.602 116.1 34.6 -87.2 -15.4 35.3 19.0 -14.2 91 313 A V H << S+ 0 0 10 -3,-1.3 3,-0.5 -4,-0.7 -2,-0.2 0.445 91.1 109.8-118.7 -3.8 32.0 19.0 -12.2 92 314 A V S >< S+ 0 0 59 -4,-1.2 3,-1.2 1,-0.2 110,-0.0 -0.334 74.0 26.6 -76.0 154.5 32.3 22.3 -10.2 93 315 A G T 3 S- 0 0 66 1,-0.2 -1,-0.2 -2,-0.1 3,-0.1 0.875 134.3 -62.5 61.8 38.8 30.0 25.3 -10.9 94 316 A N T 3 S+ 0 0 123 -3,-0.5 -1,-0.2 107,-0.4 -2,-0.2 0.596 94.3 148.4 62.7 14.9 27.2 23.1 -12.3 95 317 A K < - 0 0 110 -3,-1.2 2,-0.4 106,-0.1 -1,-0.2 -0.497 26.9-165.7 -71.6 146.1 29.4 21.8 -15.1 96 318 A R - 0 0 76 -2,-0.2 2,-0.1 -3,-0.1 103,-0.1 -0.999 17.1-128.5-143.0 153.3 28.7 18.3 -16.3 97 319 A L - 0 0 19 101,-0.9 2,-0.1 -2,-0.4 104,-0.0 -0.450 38.9 -96.8 -87.0 154.2 30.2 15.6 -18.3 98 320 A K > - 0 0 124 -2,-0.1 4,-2.3 1,-0.1 3,-0.4 -0.392 39.2-108.6 -68.6 154.9 28.4 13.8 -21.1 99 321 A E H > S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.891 118.6 56.2 -55.0 -42.9 26.9 10.4 -20.0 100 322 A A H > S+ 0 0 64 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.902 108.6 46.3 -55.3 -46.8 29.5 8.5 -22.0 101 323 A T H > S+ 0 0 1 -3,-0.4 4,-2.5 2,-0.2 5,-0.3 0.879 110.5 54.5 -65.0 -39.1 32.4 10.2 -20.2 102 324 A C H X S+ 0 0 1 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.918 108.8 48.9 -56.7 -44.5 30.5 9.6 -16.8 103 325 A K H X S+ 0 0 27 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.901 110.9 48.7 -65.5 -43.0 30.3 5.9 -17.7 104 326 A L H X S+ 0 0 4 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.940 116.7 42.0 -62.4 -49.7 34.0 5.5 -18.6 105 327 A Y H X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.926 116.0 48.9 -62.8 -46.2 35.1 7.3 -15.4 106 328 A F H X S+ 0 0 2 -4,-2.8 4,-2.7 -5,-0.3 -2,-0.2 0.877 105.8 56.6 -66.2 -37.9 32.6 5.5 -13.2 107 329 A Y H X S+ 0 0 30 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.908 109.8 47.1 -55.0 -43.1 33.5 2.1 -14.6 108 330 A Q H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.872 109.4 52.0 -70.8 -39.3 37.1 2.7 -13.6 109 331 A M H X S+ 0 0 1 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.933 111.1 49.5 -59.1 -45.2 36.2 4.0 -10.1 110 332 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.908 110.5 48.7 -59.9 -45.6 34.2 0.7 -9.7 111 333 A L H X S+ 0 0 26 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.912 113.9 48.2 -60.8 -42.5 37.1 -1.5 -10.8 112 334 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.932 114.8 42.8 -62.6 -50.5 39.4 0.4 -8.4 113 335 A V H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.887 111.9 54.9 -69.8 -36.4 37.1 0.2 -5.4 114 336 A Q H X S+ 0 0 38 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.943 108.5 49.6 -57.3 -45.7 36.3 -3.5 -6.2 115 337 A Y H X S+ 0 0 40 -4,-2.2 4,-1.4 -5,-0.2 -2,-0.2 0.920 110.3 50.8 -60.9 -43.2 40.0 -4.2 -6.1 116 338 A L H ><>S+ 0 0 0 -4,-2.1 5,-2.5 1,-0.2 3,-0.6 0.960 112.0 45.4 -58.2 -51.4 40.3 -2.4 -2.8 117 339 A H H ><5S+ 0 0 13 -4,-2.8 3,-1.5 1,-0.3 -2,-0.2 0.886 110.4 53.7 -65.5 -38.2 37.5 -4.4 -1.2 118 340 A E H 3<5S+ 0 0 123 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.796 110.6 49.7 -59.4 -31.0 38.8 -7.7 -2.6 119 341 A N T <<5S- 0 0 81 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.195 122.5-104.7 -97.2 15.5 42.1 -6.8 -1.0 120 342 A G T < 5S+ 0 0 19 -3,-1.5 33,-3.6 1,-0.2 2,-0.4 0.761 79.6 126.0 71.6 25.2 40.6 -5.9 2.5 121 343 A I E < -H 152 0C 10 -5,-2.5 2,-0.4 31,-0.2 -1,-0.2 -0.960 41.0-165.4-117.5 136.5 40.9 -2.1 2.1 122 344 A I E -H 151 0C 3 29,-2.4 29,-2.1 -2,-0.4 62,-0.1 -0.958 7.6-158.4-114.8 133.9 38.1 0.5 2.5 123 345 A H - 0 0 0 -2,-0.4 26,-0.3 27,-0.2 -1,-0.1 0.956 12.1-175.0 -77.4 -52.2 38.9 4.0 1.2 124 346 A R + 0 0 100 60,-0.1 -1,-0.1 26,-0.1 23,-0.1 0.405 68.1 66.8 70.4 4.1 36.4 5.9 3.2 125 347 A D + 0 0 33 21,-0.1 2,-0.4 5,-0.1 5,-0.1 -0.096 60.6 155.5-141.6 38.0 37.1 9.3 1.6 126 348 A L + 0 0 11 3,-0.1 68,-0.1 18,-0.0 20,-0.0 -0.573 18.6 130.1 -73.7 124.2 35.9 8.9 -2.0 127 349 A K S > S- 0 0 79 -2,-0.4 3,-2.0 66,-0.0 -40,-0.1 -0.950 71.2 -89.4-161.8 168.6 35.0 12.2 -3.6 128 350 A P G > S+ 0 0 11 0, 0.0 -40,-1.4 0, 0.0 3,-1.3 0.807 122.0 60.3 -59.9 -27.6 35.8 14.1 -6.9 129 351 A E G 3 S+ 0 0 56 1,-0.2 -3,-0.1 -42,-0.2 -40,-0.0 0.747 103.8 52.6 -69.3 -20.2 38.9 15.8 -5.3 130 352 A N G < S+ 0 0 13 -3,-2.0 15,-2.6 -5,-0.1 2,-0.5 0.175 91.8 84.8-103.9 16.3 40.3 12.3 -4.8 131 353 A V E < - G 0 144B 1 -3,-1.3 -44,-2.9 13,-0.2 -43,-0.3 -0.985 65.4-162.1-114.6 121.3 39.9 11.2 -8.4 132 354 A L E -FG 86 143B 27 11,-2.8 11,-2.3 -2,-0.5 2,-0.4 -0.802 9.7-137.9-107.0 146.8 42.7 12.2 -10.7 133 355 A L E -FG 85 142B 0 -48,-2.9 -49,-2.2 -2,-0.3 -48,-0.8 -0.883 5.3-145.0-109.1 130.6 42.7 12.3 -14.5 134 356 A S S S+ 0 0 27 7,-2.7 -51,-1.2 -2,-0.4 2,-0.3 0.781 77.8 1.6 -62.8 -33.5 45.6 11.1 -16.6 135 357 A S S S- 0 0 35 2,-0.3 5,-0.1 6,-0.3 -53,-0.0 -0.880 72.3-105.0-147.3 174.8 45.3 13.6 -19.3 136 358 A Q S S+ 0 0 150 -2,-0.3 2,-0.2 3,-0.1 4,-0.1 0.478 88.3 105.7 -86.5 -3.2 43.4 16.7 -20.5 137 359 A E S S- 0 0 135 1,-0.1 -2,-0.3 2,-0.1 -3,-0.0 -0.530 78.8-129.1 -70.7 143.1 41.6 14.4 -23.1 138 360 A E S S+ 0 0 74 -2,-0.2 2,-1.1 1,-0.2 -1,-0.1 0.922 101.4 60.6 -62.1 -44.6 38.1 13.6 -22.1 139 361 A D S S+ 0 0 56 -35,-0.0 2,-0.3 -3,-0.0 -1,-0.2 -0.742 81.7 128.0 -85.1 99.9 38.7 9.9 -22.6 140 362 A C - 0 0 2 -2,-1.1 2,-0.2 -4,-0.1 136,-0.1 -0.942 62.5 -92.0-144.9 165.5 41.5 9.1 -20.1 141 363 A L - 0 0 5 -2,-0.3 -7,-2.7 135,-0.1 2,-0.3 -0.557 38.6-151.2 -74.0 145.6 42.4 6.8 -17.3 142 364 A I E - G 0 133B 0 -9,-0.2 2,-0.4 -2,-0.2 -9,-0.2 -0.860 6.4-159.8-114.1 155.8 41.4 7.9 -13.8 143 365 A K E - G 0 132B 19 -11,-2.3 -11,-2.8 -2,-0.3 2,-0.3 -0.996 15.1-130.7-138.8 133.1 43.2 7.0 -10.6 144 366 A I E +eG 63 131B 0 -82,-2.5 -80,-2.2 -2,-0.4 -13,-0.2 -0.611 34.0 175.7 -79.1 139.0 41.9 7.1 -7.1 145 367 A T + 0 0 30 -15,-2.6 -15,-0.1 -2,-0.3 -1,-0.0 -0.698 35.8 64.1-130.9-176.9 44.2 8.9 -4.6 146 368 A D + 0 0 49 -2,-0.2 3,-0.3 1,-0.1 -1,-0.2 0.991 37.4 177.5 59.8 86.3 44.3 10.0 -0.9 147 369 A F > + 0 0 2 1,-0.2 3,-1.6 2,-0.1 -1,-0.1 0.126 43.4 118.8 -99.6 21.9 44.3 7.0 1.4 148 370 A G T 3 S+ 0 0 20 1,-0.3 -1,-0.2 -23,-0.1 -2,-0.1 0.682 82.7 37.8 -65.2 -21.3 44.6 9.0 4.6 149 371 A H T 3 S+ 0 0 102 -3,-0.3 -1,-0.3 -26,-0.3 -2,-0.1 0.334 92.1 124.8-107.1 5.9 41.2 7.8 5.9 150 372 A S < - 0 0 13 -3,-1.6 2,-0.3 -104,-0.1 -27,-0.2 -0.099 42.6-157.8 -68.7 161.6 41.6 4.2 4.6 151 373 A K E -H 122 0C 130 -29,-2.1 -29,-2.4 -105,-0.0 2,-0.5 -0.996 13.4-130.4-143.6 144.2 41.3 1.2 6.8 152 374 A I E -H 121 0C 114 -2,-0.3 -31,-0.2 -31,-0.2 2,-0.1 -0.854 23.2-138.1 -97.9 124.8 42.5 -2.4 6.6 153 375 A L + 0 0 56 -33,-3.6 2,-0.3 -2,-0.5 -1,-0.0 -0.417 42.1 128.3 -75.1 155.7 39.9 -5.1 7.2 154 376 A G - 0 0 53 -2,-0.1 2,-0.2 0, 0.0 -34,-0.0 -0.964 62.2 -21.0 179.3-170.4 40.9 -8.1 9.2 155 377 A E - 0 0 130 -2,-0.3 2,-0.1 1,-0.1 0, 0.0 -0.352 69.7-143.8 -57.4 118.5 39.9 -10.3 12.2 156 378 A T > - 0 0 57 -2,-0.2 4,-1.8 1,-0.1 5,-0.1 -0.354 21.6-116.2 -83.0 162.2 37.6 -8.1 14.3 157 379 A S H > S+ 0 0 83 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.855 118.9 59.8 -58.2 -36.3 37.3 -7.9 18.1 158 380 A L H > S+ 0 0 26 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.932 101.6 50.3 -59.4 -47.5 33.8 -9.2 17.4 159 381 A M H > S+ 0 0 102 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.918 111.2 48.9 -59.6 -43.5 35.0 -12.4 15.7 160 382 A R H >< S+ 0 0 122 -4,-1.8 3,-0.5 1,-0.2 -1,-0.2 0.902 111.3 50.7 -62.7 -40.5 37.3 -13.1 18.7 161 383 A T H 3< S+ 0 0 58 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.931 103.0 59.3 -61.9 -44.2 34.4 -12.4 21.1 162 384 A L H 3< S+ 0 0 82 -4,-2.6 2,-1.2 -5,-0.1 -1,-0.2 0.708 72.7 96.9 -66.8 -20.1 32.1 -14.8 19.3 163 385 A C S << S- 0 0 105 -4,-1.0 -4,-0.0 -3,-0.5 -3,-0.0 -0.658 97.7 -76.6 -62.6 100.8 34.5 -17.7 19.8 164 386 A G S S+ 0 0 58 -2,-1.2 -1,-0.1 2,-0.0 0, 0.0 0.616 90.9 61.4 -47.9-163.0 32.1 -18.3 22.7 165 387 A T > - 0 0 114 -3,-0.1 2,-0.5 4,-0.0 3,-0.5 0.699 31.5-166.3-110.9 147.9 30.6 -18.2 25.3 166 388 A P G > + 0 0 69 0, 0.0 3,-1.5 0, 0.0 8,-0.1 0.071 45.4 129.2 -83.0 30.3 28.8 -14.9 26.0 167 389 A T G 3 S+ 0 0 101 -2,-0.5 -3,-0.0 1,-0.3 0, 0.0 0.847 90.0 22.9 -47.4 -40.8 28.1 -15.6 29.7 168 390 A Y G < S+ 0 0 219 -3,-0.5 2,-0.3 2,-0.1 -1,-0.3 0.227 99.0 121.5-111.6 9.1 29.5 -12.2 30.6 169 391 A L < - 0 0 49 -3,-1.5 -4,-0.0 1,-0.1 5,-0.0 -0.614 63.6-116.4 -91.6 139.2 29.0 -10.5 27.3 170 392 A A >> - 0 0 34 -2,-0.3 4,-1.2 1,-0.1 3,-1.2 -0.365 18.5-125.4 -74.5 143.7 26.9 -7.3 26.9 171 393 A P H 3> S+ 0 0 92 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.833 106.4 62.8 -60.8 -34.0 23.7 -7.5 24.8 172 394 A E H 3> S+ 0 0 133 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.801 100.0 54.6 -62.5 -27.5 24.7 -4.6 22.5 173 395 A V H <> S+ 0 0 42 -3,-1.2 4,-0.6 2,-0.2 -1,-0.2 0.957 109.9 46.6 -70.1 -44.2 27.7 -6.6 21.3 174 396 A L H >< S+ 0 0 80 -4,-1.2 3,-1.2 1,-0.2 4,-0.3 0.911 110.8 52.3 -61.7 -41.3 25.4 -9.5 20.3 175 397 A V H >< S+ 0 0 114 -4,-2.6 3,-1.6 1,-0.2 4,-0.4 0.877 100.2 63.0 -62.6 -38.0 23.0 -7.0 18.6 176 398 A S H >X S+ 0 0 48 -4,-1.9 4,-1.1 1,-0.3 3,-0.6 0.659 84.4 78.5 -62.0 -18.0 25.9 -5.6 16.6 177 399 A V T << S+ 0 0 62 -3,-1.2 -1,-0.3 -4,-0.6 3,-0.2 0.820 82.5 64.9 -58.8 -32.2 26.4 -9.0 14.9 178 400 A G T <4 S+ 0 0 44 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.879 116.1 25.1 -60.4 -37.3 23.4 -8.3 12.6 179 401 A T T X4 S+ 0 0 87 -3,-0.6 3,-0.7 -4,-0.4 -1,-0.2 0.414 91.4 120.9-112.0 -0.4 25.2 -5.4 10.9 180 402 A A T 3< + 0 0 49 -4,-1.1 -3,-0.0 -3,-0.2 0, 0.0 -0.239 65.1 35.1 -65.1 155.1 28.9 -6.2 11.3 181 403 A G T 3 S+ 0 0 50 1,-0.0 -1,-0.2 3,-0.0 3,-0.2 0.580 86.9 98.7 79.6 12.8 31.2 -6.6 8.2 182 404 A Y X + 0 0 98 -3,-0.7 3,-1.5 1,-0.1 4,-0.3 0.079 38.3 114.5-114.2 21.6 29.5 -4.1 6.0 183 405 A N T > + 0 0 106 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.838 69.5 66.8 -58.5 -32.3 31.9 -1.1 6.5 184 406 A R T >> S+ 0 0 107 1,-0.3 3,-1.6 2,-0.2 4,-0.9 0.762 82.3 76.4 -60.4 -25.4 32.9 -1.4 2.9 185 407 A A H <> S+ 0 0 7 -3,-1.5 4,-2.0 1,-0.3 -1,-0.3 0.743 78.8 71.9 -62.8 -21.1 29.4 -0.3 1.9 186 408 A V H <> S+ 0 0 67 -3,-1.6 4,-2.0 -4,-0.3 -1,-0.3 0.843 95.4 52.8 -60.8 -31.9 30.3 3.4 2.8 187 409 A D H <> S+ 0 0 0 -3,-1.6 4,-2.2 -4,-0.3 -1,-0.2 0.891 106.3 52.5 -69.9 -39.1 32.5 3.4 -0.3 188 410 A C H X S+ 0 0 2 -4,-0.9 4,-2.0 2,-0.2 -2,-0.2 0.887 108.3 50.7 -65.9 -37.0 29.5 2.3 -2.5 189 411 A W H X S+ 0 0 37 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.958 110.5 49.3 -61.4 -50.2 27.4 5.2 -1.0 190 412 A S H X S+ 0 0 30 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.863 108.4 53.0 -56.6 -42.1 30.1 7.7 -1.8 191 413 A L H X S+ 0 0 1 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.896 106.2 54.4 -59.3 -43.7 30.4 6.3 -5.4 192 414 A G H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.874 109.4 46.8 -55.3 -44.9 26.6 6.8 -5.7 193 415 A V H X S+ 0 0 32 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.919 112.7 50.2 -64.1 -44.8 27.0 10.5 -4.7 194 416 A I H X S+ 0 0 4 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.942 112.0 47.3 -56.6 -49.0 30.0 10.9 -7.1 195 417 A L H X S+ 0 0 1 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.917 110.3 52.4 -61.2 -46.0 28.0 9.4 -10.0 196 418 A F H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 6,-0.4 0.918 112.1 46.5 -51.2 -49.2 24.9 11.6 -9.2 197 419 A I H X S+ 0 0 27 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.892 111.6 50.5 -64.6 -42.4 27.2 14.6 -9.3 198 420 A C H < S+ 0 0 2 -4,-2.6 -101,-0.9 1,-0.2 -2,-0.2 0.929 115.2 42.0 -62.7 -45.9 28.9 13.6 -12.6 199 421 A L H < S+ 0 0 2 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.784 129.5 25.7 -69.6 -32.0 25.6 12.9 -14.4 200 422 A S H < S- 0 0 4 -4,-1.8 -2,-0.2 -5,-0.2 -3,-0.2 0.613 91.0-128.1-111.9 -22.9 23.7 16.0 -13.1 201 423 A G S < S+ 0 0 4 -4,-2.4 -107,-0.4 -5,-0.3 -4,-0.1 0.521 81.4 79.9 78.1 6.4 26.3 18.7 -12.2 202 424 A Y S S- 0 0 18 -6,-0.4 -2,-0.2 -108,-0.1 -1,-0.2 -0.972 83.9-100.2-142.6 156.6 24.8 19.2 -8.7 203 425 A P - 0 0 56 0, 0.0 21,-0.2 0, 0.0 -9,-0.1 -0.555 18.6-140.7 -82.0 139.5 25.0 17.4 -5.3 204 426 A P S S+ 0 0 1 0, 0.0 20,-2.5 0, 0.0 2,-0.5 0.861 93.2 36.7 -63.5 -36.6 22.1 15.0 -4.2 205 427 A F S S+ 0 0 22 18,-0.2 2,-0.3 19,-0.0 18,-0.1 -0.975 78.9 130.9-122.7 125.2 22.3 16.2 -0.6 206 428 A S - 0 0 29 -2,-0.5 11,-0.0 2,-0.1 18,-0.0 -0.968 60.2-118.1-166.6 158.6 23.0 19.8 0.2 207 429 A E > + 0 0 139 -2,-0.3 3,-0.8 4,-0.1 2,-0.4 0.320 69.2 128.7 -87.7 10.7 21.7 22.7 2.3 208 430 A H T 3 S- 0 0 122 1,-0.3 -2,-0.1 3,-0.0 3,-0.1 -0.520 85.3 -20.5 -75.6 124.3 20.9 24.8 -0.8 209 431 A R T 3 S+ 0 0 230 -2,-0.4 2,-0.3 1,-0.1 -1,-0.3 0.895 111.9 104.9 40.5 57.7 17.4 26.2 -0.9 210 432 A T < - 0 0 62 -3,-0.8 -1,-0.1 1,-0.0 0, 0.0 -0.975 60.6-151.3-153.5 154.7 15.9 23.7 1.6 211 433 A Q S S+ 0 0 204 -2,-0.3 2,-0.5 2,-0.1 -4,-0.1 0.371 72.7 102.2-100.4 -1.2 14.7 23.6 5.2 212 434 A V S S- 0 0 76 1,-0.1 5,-0.0 2,-0.0 -2,-0.0 -0.739 80.8-117.5 -85.1 124.5 15.5 19.9 5.5 213 435 A S > - 0 0 45 -2,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.247 17.4-119.2 -58.0 148.0 18.8 19.5 7.4 214 436 A L H > S+ 0 0 60 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.917 115.7 54.0 -53.2 -44.3 21.6 17.8 5.5 215 437 A K H > S+ 0 0 146 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.923 108.8 46.7 -59.9 -44.9 21.6 15.0 8.0 216 438 A D H > S+ 0 0 82 1,-0.2 4,-1.7 2,-0.2 6,-0.4 0.871 110.0 54.7 -66.6 -35.5 17.9 14.3 7.6 217 439 A Q H X>S+ 0 0 13 -4,-2.4 5,-1.1 2,-0.2 4,-0.6 0.934 113.7 41.4 -59.1 -46.4 18.3 14.4 3.8 218 440 A I H ><5S+ 0 0 64 -4,-2.4 3,-0.8 2,-0.2 -2,-0.2 0.945 114.7 47.6 -70.7 -50.6 21.0 11.7 4.0 219 441 A T H 3<5S+ 0 0 83 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.791 116.1 45.2 -65.6 -28.4 19.5 9.4 6.6 220 442 A S H 3<5S- 0 0 53 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.598 105.1-132.4 -85.8 -14.0 16.1 9.4 4.9 221 443 A G T <<5 + 0 0 14 -3,-0.8 2,-1.4 -4,-0.6 -3,-0.2 0.611 54.8 147.9 71.5 14.2 17.8 8.9 1.5 222 444 A K < - 0 0 155 -5,-1.1 -1,-0.2 -6,-0.4 -2,-0.1 -0.640 27.8-170.2 -89.3 87.8 15.8 11.7 -0.1 223 445 A Y - 0 0 61 -2,-1.4 2,-0.9 22,-0.1 -18,-0.2 -0.367 33.6 -97.4 -72.3 156.6 18.1 13.2 -2.7 224 446 A N - 0 0 65 -20,-2.5 2,-0.7 -21,-0.2 -1,-0.1 -0.669 41.8-165.4 -79.8 105.3 17.2 16.4 -4.5 225 447 A F - 0 0 85 -2,-0.9 -1,-0.0 4,-0.0 -3,-0.0 -0.854 9.2-174.7 -99.7 111.1 15.7 15.3 -7.8 226 448 A I >> - 0 0 52 -2,-0.7 4,-1.7 1,-0.2 3,-0.7 -0.856 11.1-158.6-106.0 100.3 15.5 18.1 -10.4 227 449 A P H 3> S+ 0 0 76 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.824 86.0 54.1 -47.1 -45.1 13.6 16.7 -13.4 228 450 A E H 34 S+ 0 0 143 1,-0.2 4,-0.5 2,-0.2 3,-0.1 0.884 108.8 48.5 -64.3 -40.0 14.8 19.2 -16.0 229 451 A V H <4 S+ 0 0 39 -3,-0.7 3,-0.5 1,-0.2 4,-0.3 0.907 117.2 42.5 -64.4 -37.9 18.5 18.6 -15.2 230 452 A W H >< S+ 0 0 10 -4,-1.7 3,-1.2 1,-0.2 -2,-0.2 0.659 87.9 88.2 -85.8 -16.9 17.9 14.8 -15.4 231 453 A A T 3< S+ 0 0 86 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.827 90.2 51.1 -51.6 -34.7 15.7 14.6 -18.6 232 454 A E T 3 S+ 0 0 139 -3,-0.5 -1,-0.3 -4,-0.5 2,-0.2 0.775 98.1 81.3 -73.8 -30.0 18.8 14.4 -20.7 233 455 A V S < S- 0 0 20 -3,-1.2 -135,-0.0 -4,-0.3 -33,-0.0 -0.519 87.4-104.5 -81.1 146.5 20.3 11.5 -18.7 234 456 A S > - 0 0 42 -2,-0.2 4,-1.7 1,-0.1 5,-0.1 -0.203 16.1-124.2 -68.7 157.2 19.2 7.9 -19.3 235 457 A E H > S+ 0 0 178 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.830 111.7 57.4 -65.6 -36.3 16.9 5.9 -17.0 236 458 A K H > S+ 0 0 125 2,-0.2 4,-1.7 1,-0.2 27,-0.3 0.887 105.6 49.6 -63.9 -40.5 19.6 3.2 -16.7 237 459 A A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.938 114.0 45.0 -61.2 -50.3 22.2 5.7 -15.3 238 460 A L H X S+ 0 0 27 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.864 107.4 59.6 -62.4 -37.9 19.6 7.0 -12.8 239 461 A D H X S+ 0 0 56 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.902 106.9 46.4 -56.9 -43.7 18.6 3.4 -11.9 240 462 A L H >X S+ 0 0 0 -4,-1.7 4,-1.3 1,-0.2 3,-0.6 0.935 109.0 55.0 -66.1 -44.5 22.2 2.6 -10.8 241 463 A V H >X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 3,-0.7 0.914 108.1 50.3 -50.9 -45.1 22.4 5.9 -8.9 242 464 A K H 3< S+ 0 0 92 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.770 107.1 52.3 -69.9 -27.3 19.3 4.8 -7.0 243 465 A K H << S+ 0 0 76 -4,-1.2 10,-2.2 -3,-0.6 3,-0.3 0.667 112.3 46.5 -83.1 -15.4 20.7 1.3 -6.1 244 466 A L H << S+ 0 0 0 -4,-1.3 2,-0.6 -3,-0.7 -2,-0.2 0.763 104.8 59.9 -91.7 -29.7 23.9 2.9 -4.7 245 467 A L S < S+ 0 0 9 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.2 -0.288 73.9 137.2 -95.7 47.6 22.0 5.5 -2.6 246 468 A V - 0 0 41 -2,-0.6 6,-0.2 -3,-0.3 -25,-0.1 -0.851 50.4-146.1 -93.1 129.3 20.2 2.9 -0.6 247 469 A V S S+ 0 0 66 -2,-0.5 -1,-0.1 -27,-0.1 -26,-0.1 0.872 81.6 77.5 -68.2 -41.1 20.1 3.8 3.1 248 470 A D S >> S- 0 0 85 1,-0.2 4,-2.1 -3,-0.1 3,-0.9 -0.620 72.7-153.5 -71.9 112.1 20.3 0.2 4.4 249 471 A P T 34 S+ 0 0 50 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.742 92.5 55.0 -60.3 -26.1 24.0 -0.8 4.0 250 472 A K T 34 S+ 0 0 99 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.776 112.8 41.7 -77.0 -27.5 23.1 -4.5 3.7 251 473 A A T <4 S+ 0 0 59 -3,-0.9 -1,-0.2 2,-0.1 3,-0.1 0.715 92.6 109.0 -88.2 -26.9 20.7 -3.8 0.8 252 474 A R S < S- 0 0 23 -4,-2.1 -8,-0.2 -6,-0.2 2,-0.1 -0.113 81.8 -96.4 -49.0 144.3 23.0 -1.3 -0.9 253 475 A F - 0 0 35 -10,-2.2 2,-0.1 -13,-0.1 -1,-0.1 -0.421 35.4-142.0 -62.4 136.8 24.7 -2.4 -4.2 254 476 A T > - 0 0 52 -2,-0.1 4,-2.2 -3,-0.1 5,-0.2 -0.422 32.9 -98.2 -85.5 173.0 28.2 -3.7 -3.8 255 477 A T H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.864 125.9 54.2 -63.6 -35.8 30.8 -2.9 -6.5 256 478 A E H > S+ 0 0 66 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.909 108.6 47.6 -62.3 -46.2 30.1 -6.3 -8.1 257 479 A E H 4 S+ 0 0 70 1,-0.2 3,-0.2 2,-0.2 -2,-0.2 0.901 112.0 50.4 -61.6 -41.0 26.4 -5.6 -8.4 258 480 A A H >< S+ 0 0 0 -4,-2.2 3,-1.3 1,-0.2 6,-0.3 0.888 107.7 53.0 -64.3 -42.8 27.1 -2.1 -9.9 259 481 A L H 3< S+ 0 0 23 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.768 109.8 49.1 -63.8 -28.1 29.5 -3.6 -12.5 260 482 A R T 3< S+ 0 0 169 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.399 86.3 118.3 -90.4 1.6 26.8 -6.1 -13.6 261 483 A H S X S- 0 0 4 -3,-1.3 3,-1.7 -4,-0.2 4,-0.5 -0.399 78.2-115.4 -69.9 145.9 24.2 -3.3 -13.9 262 484 A P G > S+ 0 0 68 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.825 112.2 64.5 -51.5 -34.4 22.7 -2.8 -17.4 263 485 A W G 3 S+ 0 0 3 -27,-0.3 -26,-0.1 1,-0.3 -4,-0.1 0.809 104.2 45.8 -57.9 -33.9 24.3 0.8 -17.6 264 486 A L G < S+ 0 0 0 -3,-1.7 2,-1.7 -6,-0.3 -1,-0.3 0.391 82.7 98.4 -95.5 3.7 27.8 -0.7 -17.5 265 487 A Q < + 0 0 104 -3,-1.5 2,-0.4 -4,-0.5 -1,-0.1 -0.583 53.6 131.4 -85.9 74.1 27.1 -3.4 -20.1 266 488 A D > - 0 0 44 -2,-1.7 4,-2.4 1,-0.1 5,-0.2 -0.898 41.0-170.9-137.6 97.8 28.6 -1.2 -22.8 267 489 A E H > S+ 0 0 127 -2,-0.4 4,-2.6 1,-0.2 5,-0.1 0.814 88.1 56.0 -65.6 -30.1 31.2 -2.8 -25.1 268 490 A D H > S+ 0 0 107 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.954 109.3 44.9 -62.1 -54.3 32.2 0.5 -26.6 269 491 A M H > S+ 0 0 13 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.938 115.4 49.0 -54.0 -46.9 33.0 2.0 -23.2 270 492 A K H X S+ 0 0 41 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.867 108.8 52.2 -66.7 -36.7 34.9 -1.1 -22.3 271 493 A R H X S+ 0 0 125 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.934 109.4 50.7 -58.7 -48.3 36.8 -1.1 -25.6 272 494 A K H X S+ 0 0 87 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.902 108.8 51.2 -57.8 -44.0 37.9 2.5 -24.9 273 495 A F H X S+ 0 0 6 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.949 111.2 47.0 -60.2 -49.5 39.1 1.6 -21.4 274 496 A Q H X S+ 0 0 101 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.872 111.0 52.3 -60.3 -40.4 41.2 -1.3 -22.8 275 497 A D H X S+ 0 0 88 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.914 109.1 50.7 -56.9 -45.3 42.6 0.9 -25.5 276 498 A L H X S+ 0 0 16 -4,-2.4 4,-1.2 1,-0.2 -2,-0.2 0.885 107.3 53.3 -64.7 -38.0 43.6 3.4 -22.8 277 499 A L H < S+ 0 0 37 -4,-2.1 -1,-0.2 1,-0.2 3,-0.2 0.908 110.0 47.8 -60.8 -44.1 45.3 0.8 -20.7 278 500 A S H >< S+ 0 0 81 -4,-1.8 3,-1.8 1,-0.2 -2,-0.2 0.907 104.4 58.3 -68.1 -45.3 47.5 -0.3 -23.7 279 501 A E H 3< S+ 0 0 150 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.849 90.5 74.1 -47.5 -39.0 48.5 3.2 -24.7 280 502 A E T 3< S+ 0 0 97 -4,-1.2 -1,-0.3 -3,-0.2 2,-0.2 0.453 89.4 121.0 -61.5 2.3 50.0 3.6 -21.2 281 503 A N < + 0 0 88 -3,-1.8 0, 0.0 1,-0.0 0, 0.0 -0.874 39.2 152.1-135.7 164.3 53.0 1.3 -22.2 282 504 A E + 0 0 172 -2,-0.2 -3,-0.1 0, 0.0 -2,-0.0 -0.973 40.9 175.6 96.3 9.1 56.1 0.8 -22.6 283 505 A S - 0 0 85 1,-0.1 2,-0.1 3,-0.0 3,-0.1 -0.312 30.3-109.0 -82.9 167.9 56.2 -3.1 -22.0 284 506 A T - 0 0 118 1,-0.1 -1,-0.1 -2,-0.0 0, 0.0 -0.456 47.0 -80.6 -85.0 164.7 59.2 -5.4 -22.4 285 507 A A - 0 0 103 -2,-0.1 -1,-0.1 1,-0.0 0, 0.0 -0.316 48.4-147.2 -61.7 151.5 59.6 -7.9 -25.3 286 508 A L 0 0 146 -3,-0.1 -1,-0.0 0, 0.0 -3,-0.0 -0.930 360.0 360.0-124.1 147.8 57.6 -11.2 -24.7 287 509 A P 0 0 184 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.393 360.0 360.0 -63.4 360.0 58.4 -14.8 -25.8