==== 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 TRANSFERASE 16-SEP-09 2WTJ . COMPND 2 MOLECULE: CHECKPOINT KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.HILTON,S.NAUD,J.J.CALDWELL,K.BOXALL,S.BURNS,V.E.ANDERSON, . 287 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16169.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 69.7 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 . 39 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 21 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 33.8 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 1 1 3 2 0 0 1 0 0 1 0 1 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 2 2 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 1 209 A M 0 0 160 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-105.1 3.4 -67.2 -4.5 2 210 A S - 0 0 95 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.950 360.0-102.8-174.1 172.5 7.2 -67.3 -4.7 3 211 A V - 0 0 119 -2,-0.3 3,-0.1 1,-0.0 0, 0.0 -0.814 29.7-105.0-115.5 155.0 10.3 -67.7 -2.4 4 212 A Y - 0 0 63 -2,-0.3 -1,-0.0 1,-0.1 5,-0.0 -0.413 53.1 -88.5 -65.4 148.5 12.9 -65.4 -0.9 5 213 A P > - 0 0 24 0, 0.0 4,-2.5 0, 0.0 3,-0.3 -0.279 33.0-123.0 -58.7 147.1 16.4 -65.6 -2.5 6 214 A K H > S+ 0 0 170 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.873 111.5 55.4 -62.6 -41.7 18.7 -68.2 -1.0 7 215 A A H > S+ 0 0 59 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.846 110.4 47.1 -61.8 -32.3 21.3 -65.7 -0.1 8 216 A L H >> S+ 0 0 0 -3,-0.3 4,-2.2 2,-0.2 3,-1.4 0.955 111.7 48.5 -71.1 -51.2 18.7 -63.7 1.8 9 217 A R H 3< S+ 0 0 138 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.861 102.4 66.4 -55.0 -35.8 17.4 -66.8 3.6 10 218 A D H 3< S+ 0 0 121 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.802 117.0 22.0 -56.5 -30.5 21.0 -67.7 4.4 11 219 A E H << S+ 0 0 73 -3,-1.4 18,-2.8 -4,-0.6 19,-0.4 0.625 123.2 43.7-113.3 -21.7 21.3 -64.7 6.7 12 220 A Y E < -A 28 0A 5 -4,-2.2 2,-0.6 16,-0.2 16,-0.2 -0.955 58.2-142.4-133.4 147.3 17.8 -63.7 7.7 13 221 A I E -A 27 0A 84 14,-2.3 14,-2.4 -2,-0.3 2,-0.1 -0.961 34.5-136.9-102.2 118.7 14.5 -65.2 8.8 14 222 A M E +A 26 0A 31 -2,-0.6 12,-0.2 12,-0.2 2,-0.1 -0.425 30.4 168.3 -79.2 151.2 11.8 -63.2 7.2 15 223 A S E - 0 0 48 10,-2.5 -1,-0.1 1,-0.3 11,-0.1 -0.422 34.4 -13.1-139.8-149.3 8.7 -62.2 9.1 16 224 A K E - 0 0 134 -2,-0.1 9,-3.2 8,-0.1 -1,-0.3 -0.101 63.0-105.6 -66.9 151.7 5.6 -60.0 9.1 17 225 A T E -A 24 0A 62 7,-0.2 7,-0.3 1,-0.1 -1,-0.1 -0.531 29.7-176.7 -69.7 139.9 4.8 -57.1 6.7 18 226 A L E - 0 0 77 5,-3.7 2,-0.3 1,-0.5 6,-0.2 0.652 66.0 -16.6-109.1 -28.0 5.2 -53.7 8.3 19 227 A G E A 23 0A 20 4,-1.5 4,-3.5 0, 0.0 -1,-0.5 -0.964 360.0 360.0-169.9 159.5 4.1 -51.6 5.3 20 228 A S 0 0 142 2,-0.3 4,-0.0 -2,-0.3 -3,-0.0 -0.929 360.0 360.0-156.0 360.0 3.5 -51.7 1.5 21 ! 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 22 233 A E 0 0 90 0, 0.0 17,-3.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 142.1 6.9 -53.3 0.7 23 234 A V E -AB 19 38A 43 -4,-3.5 -5,-3.7 15,-0.2 -4,-1.5 -0.968 360.0-169.6-119.0 127.0 8.7 -53.4 4.0 24 235 A K E -AB 17 37A 30 13,-2.8 13,-3.2 -2,-0.5 2,-0.2 -0.893 23.7-121.4-118.0 145.3 9.1 -56.6 6.1 25 236 A L E + B 0 36A 13 -9,-3.2 -10,-2.5 -2,-0.4 2,-0.3 -0.595 40.6 174.9 -72.3 139.9 10.3 -57.4 9.6 26 237 A A E -AB 14 35A 0 9,-2.4 9,-2.7 -2,-0.2 2,-0.5 -0.969 27.5-131.6-143.9 162.7 13.2 -59.8 9.6 27 238 A F E -AB 13 34A 76 -14,-2.4 -14,-2.3 -2,-0.3 2,-0.5 -0.972 19.0-134.1-118.2 124.1 15.6 -61.4 12.1 28 239 A E E >> -AB 12 33A 30 5,-2.8 4,-2.6 -2,-0.5 5,-0.6 -0.652 13.7-149.5 -74.3 122.5 19.4 -61.4 11.4 29 240 A R T 45S+ 0 0 120 -18,-2.8 -1,-0.2 -2,-0.5 -17,-0.1 0.912 91.2 57.3 -60.4 -46.3 20.5 -65.0 12.2 30 241 A K T 45S+ 0 0 190 -19,-0.4 -1,-0.2 1,-0.2 -18,-0.1 0.854 126.1 17.9 -54.4 -39.1 24.0 -64.0 13.3 31 242 A T T 45S- 0 0 65 -3,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.553 90.1-131.6-112.3 -13.0 22.8 -61.6 16.0 32 243 A C T <5 + 0 0 104 -4,-2.6 2,-0.3 1,-0.2 -3,-0.2 0.748 64.3 136.9 58.4 25.1 19.2 -62.7 16.5 33 244 A K E < -B 28 0A 149 -5,-0.6 -5,-2.8 1,-0.1 -1,-0.2 -0.724 57.9-105.3-101.8 154.3 18.3 -59.0 16.3 34 245 A K E +B 27 0A 97 -2,-0.3 47,-0.5 -7,-0.2 2,-0.3 -0.460 39.4 170.8 -78.3 144.2 15.4 -57.4 14.3 35 246 A V E -B 26 0A 2 -9,-2.7 -9,-2.4 45,-0.2 2,-0.4 -0.893 29.4-121.2-137.8 170.3 15.9 -55.6 11.0 36 247 A A E -BC 25 79A 8 43,-2.8 43,-3.9 -2,-0.3 2,-0.5 -0.961 20.1-156.7-115.4 138.5 13.6 -54.2 8.4 37 248 A I E -BC 24 78A 0 -13,-3.2 -13,-2.8 -2,-0.4 2,-0.6 -0.948 3.0-154.2-120.6 116.5 13.8 -55.4 4.8 38 249 A K E -BC 23 77A 32 39,-3.2 39,-3.0 -2,-0.5 2,-0.6 -0.765 10.7-155.1 -89.1 122.7 12.6 -53.2 2.0 39 250 A I E - C 0 76A 22 -17,-3.5 2,-0.6 -2,-0.6 37,-0.2 -0.887 8.5-170.4-104.4 118.2 11.5 -55.2 -1.1 40 251 A I E - C 0 75A 35 35,-2.6 35,-3.2 -2,-0.6 2,-0.2 -0.932 19.8-134.2-109.5 116.4 11.6 -53.4 -4.4 41 252 A S E C 0 74A 89 -2,-0.6 33,-0.1 33,-0.2 32,-0.0 -0.463 360.0 360.0 -69.5 135.7 10.0 -55.2 -7.3 42 253 A K 0 0 115 31,-0.5 3,-0.2 -2,-0.2 -1,-0.1 0.432 360.0 360.0 -75.4 360.0 12.1 -55.2 -10.5 43 ! 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 44 266 A P > 0 0 97 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -54.8 14.0 -49.8 -11.2 45 267 A A H > + 0 0 57 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.841 360.0 53.7 -51.5 -41.7 17.8 -50.4 -11.3 46 268 A L H > S+ 0 0 70 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.965 111.4 41.8 -62.0 -56.8 18.5 -46.7 -11.6 47 269 A N H > S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.841 118.0 48.4 -59.9 -35.0 16.6 -45.5 -8.5 48 270 A V H X S+ 0 0 5 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.914 108.0 53.3 -74.0 -43.7 17.9 -48.5 -6.5 49 271 A E H X S+ 0 0 43 -4,-2.9 4,-1.8 -5,-0.2 -2,-0.2 0.874 114.5 41.8 -57.2 -40.7 21.5 -48.1 -7.5 50 272 A T H X S+ 0 0 54 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.923 110.8 55.2 -76.4 -44.4 21.5 -44.4 -6.4 51 273 A E H X S+ 0 0 6 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.950 112.7 43.9 -49.7 -53.1 19.5 -45.1 -3.2 52 274 A I H X S+ 0 0 17 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.907 112.6 49.8 -60.0 -47.4 22.1 -47.7 -2.1 53 275 A E H X S+ 0 0 58 -4,-1.8 4,-1.1 -5,-0.2 -1,-0.2 0.836 114.0 47.7 -65.2 -32.6 25.2 -45.6 -3.1 54 276 A I H X S+ 0 0 8 -4,-2.6 4,-1.6 2,-0.2 3,-0.3 0.939 111.7 47.3 -70.9 -50.8 23.8 -42.7 -1.1 55 277 A L H < S+ 0 0 5 -4,-2.7 11,-0.3 -5,-0.3 -2,-0.2 0.898 109.9 54.8 -60.8 -39.0 22.9 -44.6 2.0 56 278 A K H < S+ 0 0 142 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.871 112.5 42.0 -61.0 -36.9 26.3 -46.3 2.0 57 279 A K H < S+ 0 0 82 -4,-1.1 2,-0.2 -3,-0.3 -1,-0.2 0.702 98.1 87.2 -88.6 -19.3 28.2 -43.0 2.0 58 280 A L < - 0 0 15 -4,-1.6 2,-0.3 -3,-0.2 58,-0.0 -0.569 49.3-177.3 -86.2 144.5 26.0 -41.0 4.4 59 281 A N + 0 0 119 -2,-0.2 5,-0.1 6,-0.1 6,-0.1 -0.742 28.1 125.9-143.4 92.6 26.6 -41.1 8.2 60 282 A H > - 0 0 32 3,-0.4 3,-1.7 -2,-0.3 -2,-0.0 -0.995 59.1-126.0-150.4 142.2 24.2 -39.2 10.4 61 283 A P T 3 S+ 0 0 42 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.731 111.2 49.9 -63.5 -24.1 22.0 -40.2 13.4 62 284 A C T 3 S+ 0 0 0 81,-0.1 82,-2.3 46,-0.1 2,-0.4 0.141 99.1 78.4-104.1 19.3 18.8 -38.9 11.7 63 285 A I B < S-e 144 0B 2 -3,-1.7 -3,-0.4 80,-0.3 82,-0.2 -0.994 86.3-113.3-127.5 128.1 19.4 -40.7 8.4 64 286 A I - 0 0 1 80,-2.3 2,-0.3 -2,-0.4 -6,-0.1 -0.157 29.8-137.3 -56.6 144.3 18.6 -44.4 8.1 65 287 A K - 0 0 63 -4,-0.1 15,-1.2 -6,-0.1 2,-0.4 -0.811 8.4-126.1-106.1 148.7 21.6 -46.8 7.5 66 288 A I E +D 79 0A 32 -2,-0.3 13,-0.2 -11,-0.3 3,-0.1 -0.758 22.9 179.0 -90.0 137.7 21.8 -49.7 5.1 67 289 A K E - 0 0 104 11,-3.6 2,-0.3 1,-0.4 12,-0.2 0.716 63.8 -13.4-107.3 -30.8 22.8 -53.0 6.5 68 290 A N E -D 78 0A 42 10,-1.2 10,-2.5 2,-0.0 -1,-0.4 -0.982 53.8-145.0-166.7 164.0 22.8 -55.3 3.5 69 291 A F E -D 77 0A 62 -2,-0.3 2,-0.5 8,-0.2 8,-0.2 -0.993 6.1-170.0-145.7 133.7 21.7 -55.5 -0.1 70 292 A F E -D 76 0A 23 6,-2.6 6,-2.8 -2,-0.3 2,-0.8 -0.972 4.5-165.9-127.9 119.9 20.4 -58.4 -2.3 71 293 A D E +D 75 0A 93 -2,-0.5 4,-0.2 4,-0.2 2,-0.1 -0.873 43.1 115.5-103.4 101.5 19.9 -58.1 -6.0 72 294 A A S S- 0 0 30 2,-2.5 -30,-0.0 -2,-0.8 -2,-0.0 -0.256 86.4 -30.3-135.9-142.0 17.8 -61.0 -7.2 73 295 A E S S+ 0 0 111 -2,-0.1 -31,-0.5 -32,-0.0 2,-0.3 0.888 140.0 9.7 -51.9 -39.0 14.4 -61.6 -8.7 74 296 A D E S-C 41 0A 49 -33,-0.1 -2,-2.5 -32,-0.1 2,-0.4 -0.811 95.1 -96.7-128.8 172.8 13.6 -58.5 -6.8 75 297 A Y E -CD 40 71A 24 -35,-3.2 -35,-2.6 -2,-0.3 2,-0.5 -0.778 32.6-163.1 -91.9 138.2 15.8 -56.0 -4.9 76 298 A Y E -CD 39 70A 15 -6,-2.8 -6,-2.6 -2,-0.4 2,-0.6 -0.976 4.6-171.2-123.4 121.2 16.1 -56.4 -1.1 77 299 A I E -CD 38 69A 0 -39,-3.0 -39,-3.2 -2,-0.5 2,-0.6 -0.940 11.5-152.1-112.8 116.7 17.4 -53.5 1.1 78 300 A V E +CD 37 68A 0 -10,-2.5 -11,-3.6 -2,-0.6 -10,-1.2 -0.766 25.8 171.0 -90.5 121.2 18.2 -54.4 4.7 79 301 A L E -CD 36 66A 13 -43,-3.9 -43,-2.8 -2,-0.6 -13,-0.2 -0.787 40.6 -79.5-123.8 165.4 17.8 -51.5 7.0 80 302 A E - 0 0 41 -15,-1.2 2,-0.5 -2,-0.3 -45,-0.2 -0.334 51.3-116.5 -50.8 139.8 17.7 -50.6 10.7 81 303 A L - 0 0 38 -47,-0.5 2,-0.8 -55,-0.0 3,-0.1 -0.767 21.4-155.4 -85.0 126.3 14.3 -51.4 12.2 82 304 A M > - 0 0 19 -2,-0.5 3,-1.8 1,-0.2 51,-0.2 -0.882 4.5-164.2-104.1 103.8 12.6 -48.2 13.5 83 305 A E T 3 S+ 0 0 116 -2,-0.8 52,-0.2 51,-0.7 51,-0.2 0.768 82.3 61.7 -64.7 -28.8 10.3 -49.5 16.1 84 306 A G T 3 S- 0 0 12 49,-1.6 -1,-0.3 1,-0.2 50,-0.2 0.619 95.4-151.5 -71.9 -13.8 8.2 -46.4 16.3 85 307 A G E < -F 133 0B 26 -3,-1.8 48,-3.1 48,-0.7 2,-0.2 -0.281 40.9 -13.2 73.3-161.2 7.1 -46.8 12.7 86 308 A E E > -F 132 0B 59 46,-0.2 3,-1.0 1,-0.1 4,-0.4 -0.506 47.3-134.2 -84.9 143.0 6.2 -44.0 10.3 87 309 A L T >> S+ 0 0 0 44,-2.9 3,-2.2 41,-0.8 4,-0.6 0.850 102.9 74.3 -56.9 -34.2 5.4 -40.4 11.2 88 310 A F H >> S+ 0 0 78 40,-1.3 3,-1.7 43,-0.3 4,-1.3 0.871 87.5 57.9 -43.8 -48.5 2.4 -40.7 8.9 89 311 A D H <4 S+ 0 0 88 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.686 102.6 56.2 -63.1 -16.8 0.6 -42.9 11.5 90 312 A K H <4 S+ 0 0 80 -3,-2.2 -1,-0.3 -4,-0.4 -2,-0.2 0.635 115.7 33.4 -87.6 -14.9 0.8 -40.0 14.0 91 313 A V H X< S+ 0 0 12 -3,-1.7 3,-0.6 -4,-0.6 -2,-0.2 0.417 89.0 109.7-123.9 -4.0 -0.9 -37.4 11.8 92 314 A V G >< S+ 0 0 60 -4,-1.3 3,-1.6 1,-0.2 110,-0.0 -0.339 76.4 28.5 -72.1 157.1 -3.4 -39.4 9.8 93 315 A G G 3 S- 0 0 65 1,-0.3 -1,-0.2 -2,-0.0 3,-0.1 0.843 135.9 -64.2 60.3 36.0 -7.1 -38.9 10.6 94 316 A N G < S+ 0 0 123 -3,-0.6 -1,-0.3 107,-0.3 -2,-0.2 0.655 90.6 157.0 60.2 16.1 -6.5 -35.3 11.8 95 317 A K < - 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0 0 40 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.125 23.0-126.0 -56.2 153.8 2.3 -20.7 19.0 235 457 A E H > S+ 0 0 85 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.787 110.3 60.1 -72.3 -27.8 2.9 -17.7 16.6 236 458 A K H > S+ 0 0 120 2,-0.2 4,-1.8 1,-0.2 27,-0.3 0.914 104.1 48.4 -63.9 -45.7 6.6 -18.7 16.4 237 459 A A H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 3,-0.3 0.953 113.5 46.7 -59.0 -51.5 5.7 -22.1 15.0 238 460 A L H X S+ 0 0 24 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.868 107.1 58.2 -60.9 -38.4 3.4 -20.6 12.4 239 461 A D H X S+ 0 0 54 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.905 105.6 49.6 -59.2 -41.7 5.9 -18.0 11.5 240 462 A L H X S+ 0 0 0 -4,-1.8 4,-1.2 -3,-0.3 3,-0.3 0.918 107.7 53.5 -65.2 -42.7 8.4 -20.7 10.6 241 463 A V H >X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 3,-1.1 0.946 106.7 53.5 -53.1 -48.3 5.9 -22.5 8.4 242 464 A K H 3< S+ 0 0 99 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.839 107.0 51.0 -58.8 -34.2 5.3 -19.3 6.5 243 465 A K H 3< S+ 0 0 74 -4,-1.4 10,-2.3 -3,-0.3 3,-0.3 0.696 113.4 45.4 -78.4 -17.4 9.0 -18.9 5.8 244 466 A L H << S+ 0 0 0 -4,-1.2 2,-0.8 -3,-1.1 -52,-0.2 0.773 104.0 61.0 -93.0 -33.4 9.2 -22.4 4.4 245 467 A L S < S+ 0 0 9 -4,-2.5 2,-0.5 -5,-0.2 -1,-0.2 -0.285 74.9 139.9 -89.3 48.5 6.0 -22.3 2.3 246 468 A V - 0 0 43 -2,-0.8 6,-0.2 -3,-0.3 -25,-0.1 -0.831 48.8-146.8 -95.9 130.6 7.5 -19.5 0.3 247 469 A V S S+ 0 0 69 -2,-0.5 -1,-0.1 -27,-0.2 -26,-0.1 0.851 81.5 74.9 -68.4 -39.3 6.8 -19.8 -3.5 248 470 A D S >> S- 0 0 84 1,-0.2 4,-1.8 2,-0.0 3,-0.8 -0.689 72.9-152.4 -78.0 114.6 10.0 -18.3 -4.7 249 471 A P T 34 S+ 0 0 52 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.772 93.4 55.0 -62.6 -28.2 12.7 -20.9 -4.2 250 472 A K T 34 S+ 0 0 101 1,-0.2 -2,-0.0 -3,-0.0 -3,-0.0 0.794 113.7 40.3 -75.9 -29.3 15.5 -18.3 -3.8 251 473 A A T <4 S+ 0 0 61 -3,-0.8 -1,-0.2 2,-0.1 3,-0.1 0.681 91.8 110.1 -87.3 -21.8 13.6 -16.5 -1.0 252 474 A R S < S- 0 0 23 -4,-1.8 -8,-0.2 -6,-0.2 -9,-0.1 -0.221 82.9 -94.7 -55.1 141.4 12.5 -19.7 0.7 253 475 A F - 0 0 34 -10,-2.3 -1,-0.1 -13,-0.1 2,-0.1 -0.329 37.5-140.4 -53.0 133.6 14.1 -20.5 4.0 254 476 A T > - 0 0 50 -3,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.369 31.0-100.3 -81.7 174.0 17.1 -22.8 3.8 255 477 A T H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.895 125.5 53.6 -62.2 -37.5 17.7 -25.4 6.5 256 478 A E H > S+ 0 0 67 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.926 109.2 47.1 -63.8 -45.1 20.3 -23.1 8.1 257 479 A E H > S+ 0 0 66 1,-0.2 4,-0.7 2,-0.2 3,-0.4 0.920 111.8 51.3 -61.2 -43.1 17.8 -20.3 8.3 258 480 A A H >< S+ 0 0 0 -4,-2.3 3,-0.8 1,-0.2 6,-0.2 0.889 108.2 51.9 -60.2 -38.9 15.2 -22.7 9.7 259 481 A L H 3< S+ 0 0 24 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.766 109.6 49.8 -72.2 -23.3 17.6 -23.8 12.4 260 482 A R H 3< S+ 0 0 175 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.527 86.1 118.3 -88.5 -7.5 18.3 -20.2 13.4 261 483 A H S XX S- 0 0 6 -3,-0.8 3,-2.5 -4,-0.7 4,-0.7 -0.299 76.8-118.3 -65.0 142.0 14.6 -19.4 13.7 262 484 A P G >4 S+ 0 0 69 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.802 111.2 65.9 -49.1 -33.2 13.3 -18.4 17.1 263 485 A W G 34 S+ 0 0 3 -27,-0.3 -26,-0.1 1,-0.3 -4,-0.1 0.761 105.0 44.5 -63.7 -22.3 11.0 -21.4 17.2 264 486 A L G <4 S+ 0 0 0 -3,-2.5 2,-2.1 -6,-0.2 -1,-0.3 0.515 81.8 98.2-102.3 -6.8 14.0 -23.7 17.3 265 487 A Q << + 0 0 98 -3,-1.0 2,-0.3 -4,-0.7 -1,-0.1 -0.591 52.2 131.4 -76.7 80.3 16.0 -21.7 19.9 266 488 A D > - 0 0 43 -2,-2.1 4,-2.5 1,-0.1 3,-0.2 -0.781 38.7-172.8-143.1 88.4 14.8 -24.1 22.6 267 489 A E H > S+ 0 0 136 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.765 86.3 56.6 -63.8 -26.5 17.6 -25.5 24.8 268 490 A D H > S+ 0 0 135 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.962 107.8 46.3 -65.0 -53.5 15.2 -27.9 26.5 269 491 A M H > S+ 0 0 12 1,-0.2 4,-2.2 -3,-0.2 -2,-0.2 0.943 113.6 50.9 -52.9 -47.6 14.2 -29.5 23.2 270 492 A K H X S+ 0 0 36 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.903 107.7 51.6 -60.5 -41.5 17.9 -29.7 22.3 271 493 A R H X S+ 0 0 62 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.924 108.2 52.6 -59.9 -45.0 18.8 -31.3 25.6 272 494 A K H X S+ 0 0 49 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.908 111.1 46.8 -56.7 -44.1 16.2 -34.0 25.1 273 495 A F H X S+ 0 0 7 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.967 112.7 48.5 -63.1 -52.5 17.6 -34.7 21.6 274 496 A Q H X S+ 0 0 102 -4,-3.0 4,-2.0 1,-0.2 -2,-0.2 0.863 111.6 51.5 -55.4 -37.3 21.1 -34.9 22.9 275 497 A D H X S+ 0 0 97 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.936 110.2 47.7 -64.5 -47.5 19.9 -37.1 25.7 276 498 A L H X S+ 0 0 26 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.883 109.2 55.4 -61.9 -39.6 18.2 -39.5 23.2 277 499 A L H X S+ 0 0 22 -4,-2.8 4,-1.4 2,-0.2 -1,-0.2 0.957 108.8 45.3 -55.7 -54.1 21.3 -39.5 21.1 278 500 A S H X S+ 0 0 65 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.889 111.5 53.7 -62.2 -40.1 23.6 -40.7 23.9 279 501 A E H >< S+ 0 0 123 -4,-2.2 3,-0.6 1,-0.2 4,-0.4 0.942 107.2 50.3 -58.4 -49.0 21.1 -43.3 25.0 280 502 A E H 3< S+ 0 0 75 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.811 114.7 47.2 -56.6 -29.8 20.9 -44.8 21.5 281 503 A N H >X S+ 0 0 72 -4,-1.4 3,-2.2 -3,-0.2 4,-1.2 0.665 82.6 89.6 -92.9 -18.6 24.7 -44.9 21.5 282 504 A E T << S+ 0 0 145 -4,-1.4 3,-0.4 -3,-0.6 -1,-0.2 0.820 84.9 57.4 -49.0 -38.3 25.5 -46.5 24.8 283 505 A S T 34 S+ 0 0 124 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.625 116.4 33.1 -74.0 -12.5 25.4 -50.0 23.4 284 506 A T T <4 S+ 0 0 103 -3,-2.2 2,-0.5 -4,-0.1 -1,-0.2 0.422 86.2 118.2-121.0 -2.4 28.1 -49.3 20.8 285 507 A A < - 0 0 71 -4,-1.2 3,-0.1 -3,-0.4 -3,-0.0 -0.559 49.1-156.4 -72.7 117.2 30.3 -46.8 22.6 286 508 A L - 0 0 138 -2,-0.5 -2,-0.1 1,-0.1 -1,-0.0 -0.495 27.9 -96.3 -82.2 160.5 33.8 -48.2 23.1 287 509 A P - 0 0 130 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.303 49.1-169.8 -66.5 164.4 36.1 -46.9 25.8 288 510 A Q - 0 0 177 -3,-0.1 2,-0.2 -2,-0.0 -3,-0.0 -0.956 31.8 -60.4-153.4 171.7 38.6 -44.2 24.7 289 511 A V 0 0 146 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.351 360.0 360.0 -62.2 122.3 41.6 -42.2 25.8 290 512 A L 0 0 143 -2,-0.2 -1,-0.1 0, 0.0 0, 0.0 -0.412 360.0 360.0 -58.8 360.0 40.9 -40.2 28.9