==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-NOV-11 4A9U . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE CHK2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.MATIJSSEN,M.C.SILVA-SANTISTEBAN,I.M.WESTWOOD,S.SIDDIQUE,V. . 287 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 69.3 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 . 20 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 33.1 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 2 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 1.6 56.6 -36.9 20.9 2 210 A S - 0 0 108 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.962 360.0-118.9-168.5 178.9 54.5 -40.1 20.5 3 211 A V - 0 0 120 -2,-0.3 3,-0.1 0, 0.0 0, 0.0 -0.878 29.5-100.0-130.4 164.6 53.3 -42.8 18.1 4 212 A Y - 0 0 66 -2,-0.3 2,-0.0 1,-0.1 10,-0.0 -0.492 52.4 -88.4 -78.9 154.2 50.1 -44.1 16.7 5 213 A P > - 0 0 25 0, 0.0 4,-2.5 0, 0.0 3,-0.4 -0.333 31.2-123.7 -64.1 144.5 48.5 -47.2 18.2 6 214 A K H > S+ 0 0 172 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.893 110.8 56.7 -54.5 -43.9 49.6 -50.5 16.6 7 215 A A H > S+ 0 0 55 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.880 110.3 44.4 -58.3 -41.1 46.0 -51.5 15.8 8 216 A L H >> S+ 0 0 0 -3,-0.4 4,-2.5 1,-0.2 3,-1.4 0.965 112.5 50.3 -65.7 -54.3 45.6 -48.3 13.8 9 217 A R H 3< S+ 0 0 131 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.804 101.9 65.3 -54.1 -32.3 48.9 -48.6 12.0 10 218 A D H 3< S+ 0 0 123 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.835 117.2 23.2 -61.5 -33.9 48.0 -52.2 11.1 11 219 A E H << S+ 0 0 73 -3,-1.4 18,-2.7 -4,-0.7 19,-0.4 0.663 124.0 42.8-106.0 -24.0 45.1 -51.1 8.9 12 220 A Y E < -A 28 0A 5 -4,-2.5 2,-0.6 16,-0.2 16,-0.2 -0.937 59.5-141.5-132.3 149.2 46.0 -47.5 8.0 13 221 A I E -A 27 0A 86 14,-2.3 14,-2.1 -2,-0.3 2,-0.1 -0.956 32.7-137.4-104.5 117.3 48.9 -45.4 6.8 14 222 A M E +A 26 0A 32 -2,-0.6 12,-0.2 12,-0.2 2,-0.1 -0.459 29.9 169.4 -78.0 147.4 48.6 -42.0 8.5 15 223 A S E - 0 0 46 10,-2.8 -1,-0.1 1,-0.3 11,-0.1 -0.386 34.4 -18.8-135.2-149.8 49.3 -38.8 6.5 16 224 A K E - 0 0 67 -2,-0.1 9,-2.9 8,-0.1 2,-0.3 -0.046 65.9 -97.9 -65.1 160.9 49.1 -35.0 6.6 17 225 A T E -A 24 0A 68 7,-0.2 7,-0.3 1,-0.2 -1,-0.1 -0.628 33.7-179.7 -76.4 133.3 46.9 -32.9 8.9 18 226 A L E S+ 0 0 90 5,-3.1 2,-0.3 1,-0.4 6,-0.2 0.824 70.8 8.1 -98.1 -47.3 43.7 -31.8 7.3 19 227 A G E A 23 0A 14 4,-1.6 4,-2.7 67,-0.0 -1,-0.4 -0.975 360.0 360.0-135.5 150.8 42.2 -29.8 10.2 20 228 A S 0 0 145 -2,-0.3 4,-0.0 2,-0.2 -2,-0.0 -0.320 360.0 360.0-140.2 360.0 43.6 -28.7 13.5 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 85 0, 0.0 17,-3.6 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 105.4 42.5 -32.9 15.0 23 234 A V E -AB 19 38A 35 -4,-2.7 -5,-3.1 15,-0.2 -4,-1.6 -0.965 360.0-172.2-119.5 127.1 41.7 -34.4 11.7 24 235 A K E -AB 17 37A 29 13,-2.4 13,-3.0 -2,-0.5 2,-0.3 -0.896 23.9-121.2-120.1 146.6 44.3 -36.4 9.7 25 236 A L E + B 0 36A 25 -9,-2.9 -10,-2.8 -2,-0.3 2,-0.3 -0.634 39.8 171.8 -77.5 139.1 44.4 -37.9 6.2 26 237 A A E -AB 14 35A 0 9,-2.2 9,-2.8 -2,-0.3 2,-0.4 -0.958 27.3-132.0-144.6 163.3 45.0 -41.6 6.1 27 238 A F E -AB 13 34A 69 -14,-2.1 -14,-2.3 -2,-0.3 2,-0.6 -0.976 18.7-131.2-119.8 130.2 45.0 -44.5 3.6 28 239 A E E >>> -AB 12 33A 39 5,-2.7 4,-3.4 -2,-0.4 5,-0.6 -0.698 16.7-148.7 -76.6 119.0 43.3 -47.8 4.2 29 240 A R T 345S+ 0 0 125 -18,-2.7 -1,-0.2 -2,-0.6 -17,-0.1 0.879 92.5 56.3 -57.1 -42.1 45.9 -50.4 3.4 30 241 A K T 345S+ 0 0 137 -19,-0.4 -1,-0.2 1,-0.2 -18,-0.1 0.826 127.2 16.4 -61.9 -34.2 43.4 -53.0 2.1 31 242 A T T <45S- 0 0 64 -3,-0.6 -2,-0.2 2,-0.2 -1,-0.2 0.573 89.4-130.9-115.2 -16.8 41.9 -50.6 -0.5 32 243 A C T <5 + 0 0 100 -4,-3.4 2,-0.3 1,-0.3 -3,-0.2 0.792 61.0 145.6 61.1 27.1 44.5 -47.9 -0.8 33 244 A K E < -B 28 0A 139 -5,-0.6 -5,-2.7 1,-0.0 -1,-0.3 -0.717 53.1-110.3 -95.7 148.1 41.5 -45.5 -0.4 34 245 A K E +B 27 0A 62 -2,-0.3 48,-0.5 -7,-0.2 2,-0.3 -0.511 39.1 175.7 -75.9 141.0 41.7 -42.2 1.4 35 246 A V E -B 26 0A 1 -9,-2.8 -9,-2.2 -2,-0.2 2,-0.5 -0.922 27.9-123.6-136.5 164.9 39.9 -41.8 4.7 36 247 A A E -BC 25 80A 9 44,-2.7 44,-3.8 -2,-0.3 2,-0.6 -0.957 21.3-162.1-111.8 129.0 39.7 -39.0 7.4 37 248 A I E -BC 24 79A 0 -13,-3.0 -13,-2.4 -2,-0.5 2,-0.4 -0.918 4.2-155.3-116.5 109.7 40.7 -39.9 10.9 38 249 A K E -BC 23 78A 23 40,-2.8 40,-3.1 -2,-0.6 2,-0.5 -0.683 9.8-154.8 -83.1 132.0 39.5 -37.6 13.7 39 250 A I E - C 0 77A 22 -17,-3.6 2,-0.5 -2,-0.4 38,-0.2 -0.936 12.6-178.1-113.8 121.0 41.7 -37.7 16.8 40 251 A I E - C 0 76A 41 36,-2.6 36,-2.9 -2,-0.5 -2,-0.0 -0.949 22.1-135.8-122.1 111.3 40.3 -36.8 20.2 41 252 A S E C 0 75A 87 -2,-0.5 34,-0.2 34,-0.2 33,-0.0 -0.211 360.0 360.0 -66.9 154.1 42.7 -36.8 23.1 42 253 A K 0 0 116 32,-0.6 33,-0.1 2,-0.1 -1,-0.1 0.867 360.0 360.0-102.0 360.0 41.8 -38.4 26.5 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 44 265 A D > 0 0 132 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 104.5 36.2 -37.3 30.9 45 266 A P T 3> + 0 0 44 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.693 360.0 91.1 -76.8 -21.1 35.8 -37.1 27.1 46 267 A A H 3> S+ 0 0 45 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.808 81.5 56.2 -43.5 -40.9 34.6 -40.8 27.1 47 268 A L H <> S+ 0 0 61 -3,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.951 110.2 41.6 -61.4 -53.3 31.0 -39.6 27.4 48 269 A N H > S+ 0 0 77 -3,-0.5 4,-2.4 -4,-0.4 -1,-0.2 0.881 117.5 47.8 -62.7 -40.3 31.0 -37.3 24.3 49 270 A V H X S+ 0 0 3 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.933 110.8 49.7 -69.2 -46.3 32.9 -39.9 22.2 50 271 A E H X S+ 0 0 42 -4,-2.9 4,-2.7 -5,-0.3 5,-0.2 0.939 113.5 48.2 -55.6 -47.4 30.7 -42.8 23.2 51 272 A T H X S+ 0 0 47 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.927 112.6 47.2 -58.8 -48.4 27.7 -40.7 22.3 52 273 A E H X S+ 0 0 4 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.922 112.9 49.0 -62.6 -45.1 29.2 -39.6 18.9 53 274 A I H X S+ 0 0 5 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.936 111.4 49.3 -58.1 -48.7 30.2 -43.2 18.0 54 275 A E H X S+ 0 0 53 -4,-2.7 4,-1.3 -5,-0.2 -1,-0.2 0.891 113.3 47.2 -59.8 -41.2 26.8 -44.6 18.9 55 276 A I H X S+ 0 0 2 -4,-2.3 4,-1.7 -5,-0.2 3,-0.4 0.960 110.5 50.2 -66.4 -51.8 25.0 -41.9 16.8 56 277 A L H < S+ 0 0 5 -4,-2.8 11,-0.3 1,-0.2 -2,-0.2 0.882 108.1 55.2 -53.9 -42.4 27.3 -42.3 13.7 57 278 A K H < S+ 0 0 145 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.884 112.5 39.7 -59.8 -42.0 26.7 -46.1 13.7 58 279 A K H < S+ 0 0 91 -4,-1.3 -1,-0.2 -3,-0.4 2,-0.2 0.697 97.9 89.5 -87.7 -19.6 22.9 -45.9 13.6 59 280 A L < + 0 0 13 -4,-1.7 2,-0.2 -5,-0.1 58,-0.0 -0.523 47.4 179.0 -80.8 145.6 22.5 -43.0 11.2 60 281 A N + 0 0 117 -2,-0.2 5,-0.1 6,-0.1 6,-0.1 -0.726 25.0 128.7-148.6 93.8 22.3 -43.6 7.5 61 282 A H > - 0 0 31 3,-0.4 3,-2.0 -2,-0.2 -2,-0.0 -0.992 58.3-126.2-151.2 140.5 21.8 -40.6 5.3 62 283 A P T 3 S+ 0 0 47 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.735 112.3 47.9 -58.3 -27.2 23.6 -39.2 2.2 63 284 A C T 3 S+ 0 0 0 81,-0.1 82,-2.6 46,-0.1 2,-0.4 0.135 100.0 77.7-105.2 18.7 24.1 -35.8 3.9 64 285 A I B < S-e 145 0B 3 -3,-2.0 -3,-0.4 80,-0.3 82,-0.2 -0.996 86.1-115.1-127.1 128.8 25.5 -37.2 7.1 65 286 A I - 0 0 5 80,-2.3 2,-0.4 -2,-0.4 -6,-0.1 -0.226 29.4-135.4 -62.2 147.8 29.1 -38.4 7.4 66 287 A K - 0 0 67 -4,-0.1 15,-1.4 -6,-0.1 2,-0.3 -0.839 7.0-127.3-110.7 143.3 29.6 -42.1 8.1 67 288 A I E +D 80 0A 29 -2,-0.4 13,-0.3 -11,-0.3 3,-0.1 -0.686 22.1 178.7 -86.2 138.1 32.0 -43.9 10.5 68 289 A K E - 0 0 107 11,-4.2 2,-0.3 1,-0.4 12,-0.2 0.704 64.2 -10.5-108.3 -31.0 34.3 -46.5 9.1 69 290 A N E -D 79 0A 43 10,-1.4 10,-3.2 2,-0.0 -1,-0.4 -0.985 55.0-147.5-164.8 162.0 36.3 -47.6 12.1 70 291 A F E -D 78 0A 28 -2,-0.3 2,-0.4 8,-0.2 8,-0.2 -0.998 5.6-169.3-144.5 137.3 37.1 -46.7 15.7 71 292 A F E -D 77 0A 23 6,-2.9 6,-3.1 -2,-0.4 2,-0.7 -0.988 5.8-166.4-130.4 126.3 40.1 -47.0 18.0 72 293 A D E +D 76 0A 76 -2,-0.4 4,-0.2 4,-0.2 2,-0.1 -0.800 43.6 119.5-111.1 86.8 40.2 -46.5 21.7 73 294 A A S S- 0 0 36 2,-2.2 -69,-0.0 -2,-0.7 -2,-0.0 -0.002 86.7 -34.0-118.2-138.2 43.8 -46.3 22.7 74 295 A E S S+ 0 0 102 -2,-0.1 -32,-0.6 -32,-0.1 2,-0.3 0.868 138.8 12.9 -56.0 -35.1 46.0 -43.6 24.4 75 296 A D E S-C 41 0A 48 -34,-0.2 -2,-2.2 -33,-0.1 2,-0.5 -0.837 95.8 -94.1-130.6 171.3 43.7 -41.3 22.4 76 297 A Y E -CD 40 72A 14 -36,-2.9 -36,-2.6 -2,-0.3 2,-0.5 -0.772 34.5-166.9 -88.9 130.9 40.4 -41.7 20.6 77 298 A Y E -CD 39 71A 12 -6,-3.1 -6,-2.9 -2,-0.5 2,-0.6 -0.968 2.5-171.2-120.0 117.6 40.6 -42.4 16.8 78 299 A I E -CD 38 70A 0 -40,-3.1 -40,-2.8 -2,-0.5 2,-0.6 -0.931 11.8-150.1-111.5 117.0 37.5 -42.1 14.7 79 300 A V E +CD 37 69A 0 -10,-3.2 -11,-4.2 -2,-0.6 -10,-1.4 -0.754 27.6 167.1 -90.6 120.7 37.8 -43.2 11.1 80 301 A L E -CD 36 67A 8 -44,-3.8 -44,-2.7 -2,-0.6 -13,-0.2 -0.779 41.3 -80.2-128.0 166.7 35.4 -41.4 8.8 81 302 A E - 0 0 40 -15,-1.4 2,-0.6 -2,-0.2 -46,-0.2 -0.339 49.4-116.9 -58.8 148.7 34.7 -40.8 5.1 82 303 A L - 0 0 41 -48,-0.5 2,-0.8 -47,-0.1 -1,-0.1 -0.848 19.8-158.0 -93.1 122.1 37.0 -38.3 3.5 83 304 A M > - 0 0 17 -2,-0.6 3,-1.6 1,-0.1 51,-0.2 -0.877 3.9-162.7 -97.1 105.0 35.3 -35.2 2.2 84 305 A E T 3 S+ 0 0 124 -2,-0.8 51,-0.2 51,-0.7 52,-0.2 0.683 83.0 64.1 -66.5 -18.6 37.7 -33.8 -0.4 85 306 A G T 3 S- 0 0 16 49,-2.3 -1,-0.3 1,-0.2 50,-0.2 0.695 94.1-152.2 -77.8 -19.6 36.1 -30.4 -0.5 86 307 A G E < -F 134 0B 26 -3,-1.6 48,-3.0 48,-0.8 2,-0.3 -0.383 41.2 -13.6 79.5-158.8 36.9 -29.7 3.1 87 308 A E E > -F 133 0B 60 46,-0.2 3,-1.3 1,-0.1 4,-0.4 -0.578 48.2-134.8 -89.1 138.7 35.0 -27.5 5.5 88 309 A L T >> S+ 0 0 0 44,-3.0 3,-1.9 41,-0.8 4,-0.6 0.801 101.8 75.5 -53.7 -30.8 32.3 -25.0 4.5 89 310 A F H >> S+ 0 0 72 40,-1.0 4,-1.7 43,-0.3 3,-1.6 0.887 87.9 57.1 -49.5 -45.2 34.1 -22.6 6.8 90 311 A D H <4 S+ 0 0 89 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.706 102.2 57.0 -62.2 -20.6 36.9 -22.1 4.3 91 312 A K H <4 S+ 0 0 79 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.642 116.7 31.6 -83.9 -15.3 34.3 -21.0 1.7 92 313 A V H X< S+ 0 0 10 -3,-1.6 3,-0.7 -4,-0.6 -2,-0.2 0.525 87.7 111.7-123.3 -11.9 33.0 -18.1 3.9 93 314 A V G >< S+ 0 0 63 -4,-1.7 3,-1.1 1,-0.2 109,-0.0 -0.293 76.4 27.8 -66.5 151.3 35.9 -16.8 6.0 94 315 A G G 3 S- 0 0 64 1,-0.2 -1,-0.2 2,-0.0 3,-0.1 0.810 134.3 -64.4 67.8 30.8 37.2 -13.4 5.3 95 316 A N G < S+ 0 0 118 -3,-0.7 -1,-0.2 106,-0.3 -2,-0.2 0.551 89.3 152.8 70.8 8.4 33.9 -12.1 3.9 96 317 A K < - 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0 0 42 -2,-0.3 4,-1.3 1,-0.1 -1,-0.1 -0.127 23.7-119.4 -65.5 165.2 16.8 -12.2 -3.4 235 457 A E H > S+ 0 0 85 2,-0.2 4,-1.9 1,-0.2 -1,-0.1 0.750 111.0 56.3 -77.7 -25.6 13.9 -11.4 -1.1 236 458 A K H > S+ 0 0 119 2,-0.2 4,-2.4 1,-0.2 27,-0.2 0.920 104.6 50.4 -72.4 -46.0 12.9 -15.1 -0.7 237 459 A A H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.923 114.1 45.8 -56.4 -46.4 16.4 -16.1 0.7 238 460 A L H X S+ 0 0 30 -4,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.899 109.1 55.9 -64.1 -41.2 16.2 -13.2 3.2 239 461 A D H X S+ 0 0 55 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.913 107.2 48.8 -58.1 -44.9 12.6 -14.1 4.1 240 462 A L H X S+ 0 0 0 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.914 109.0 53.3 -61.8 -44.5 13.6 -17.7 5.0 241 463 A V H >X S+ 0 0 1 -4,-1.9 4,-2.1 1,-0.2 3,-1.1 0.928 106.9 52.5 -54.2 -48.5 16.5 -16.4 7.1 242 464 A K H 3< S+ 0 0 103 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.854 107.3 51.8 -57.6 -37.6 14.1 -14.2 9.1 243 465 A K H 3< S+ 0 0 81 -4,-1.6 10,-2.4 1,-0.2 3,-0.3 0.631 112.0 46.5 -79.5 -12.5 11.8 -17.1 9.8 244 466 A L H << S+ 0 0 0 -3,-1.1 2,-0.7 -4,-0.9 -52,-0.2 0.741 104.0 61.6 -94.0 -31.0 14.7 -19.2 11.2 245 467 A L S < S+ 0 0 9 -4,-2.1 2,-0.5 -5,-0.2 -1,-0.2 -0.277 74.1 138.7 -92.2 48.2 16.2 -16.4 13.3 246 468 A V - 0 0 44 -2,-0.7 6,-0.2 -3,-0.3 -25,-0.1 -0.828 50.2-145.7 -94.5 129.9 13.0 -16.1 15.4 247 469 A V S S+ 0 0 70 -2,-0.5 -1,-0.1 -27,-0.2 -26,-0.1 0.912 82.5 78.0 -60.7 -47.1 13.6 -15.6 19.1 248 470 A D S > S- 0 0 87 1,-0.2 4,-1.9 -3,-0.1 3,-0.4 -0.549 71.5-154.0 -68.6 115.6 10.6 -17.7 20.2 249 471 A P T 4 S+ 0 0 52 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.799 92.3 52.9 -60.9 -33.5 11.5 -21.4 19.8 250 472 A K T 4 S+ 0 0 105 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.797 114.4 40.7 -77.6 -28.5 7.9 -22.5 19.3 251 473 A A T 4 S+ 0 0 59 -3,-0.4 -1,-0.2 2,-0.1 3,-0.1 0.731 91.2 110.3 -87.1 -25.9 7.3 -20.0 16.5 252 474 A R S < S- 0 0 22 -4,-1.9 -8,-0.2 -6,-0.2 -9,-0.1 -0.146 81.9 -96.8 -51.1 141.9 10.7 -20.6 14.9 253 475 A F - 0 0 35 -10,-2.4 2,-0.2 -13,-0.1 -1,-0.1 -0.289 36.9-142.0 -58.6 143.7 10.6 -22.4 11.5 254 476 A T > - 0 0 54 -3,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.512 30.9 -98.9 -95.4 173.9 11.2 -26.1 11.6 255 477 A T H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.916 126.0 53.4 -58.7 -42.4 13.1 -28.0 9.0 256 478 A E H > S+ 0 0 69 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.920 109.8 46.7 -58.1 -46.0 9.8 -29.1 7.4 257 479 A E H 4 S+ 0 0 63 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.841 111.8 51.9 -66.1 -33.5 8.7 -25.4 7.2 258 480 A A H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.2 6,-0.3 0.918 108.4 50.1 -67.2 -43.6 12.1 -24.5 5.8 259 481 A L H 3< S+ 0 0 25 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.699 111.4 50.1 -68.3 -19.9 11.9 -27.2 3.1 260 482 A R T 3< S+ 0 0 168 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.434 85.6 115.6 -96.7 -3.4 8.4 -25.9 2.2 261 483 A H S X> S- 0 0 7 -3,-1.2 3,-2.1 -4,-0.3 4,-0.5 -0.425 78.6-117.3 -69.2 141.6 9.5 -22.3 1.9 262 484 A P G >4 S+ 0 0 70 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.784 111.8 65.3 -48.3 -33.1 9.3 -20.7 -1.6 263 485 A W G 34 S+ 0 0 3 1,-0.3 -26,-0.1 -27,-0.2 -4,-0.1 0.806 103.7 45.7 -64.5 -29.1 13.0 -20.2 -1.7 264 486 A L G <4 S+ 0 0 0 -3,-2.1 2,-2.0 -6,-0.3 -1,-0.3 0.465 84.3 98.0 -92.2 -3.4 13.6 -24.0 -1.7 265 487 A Q << + 0 0 100 -3,-1.2 2,-0.4 -4,-0.5 -1,-0.1 -0.512 52.7 128.1 -83.1 72.1 10.9 -24.6 -4.3 266 488 A D > - 0 0 42 -2,-2.0 4,-1.9 1,-0.1 5,-0.2 -0.884 40.0-172.5-137.4 97.6 13.5 -24.8 -7.1 267 489 A E H > S+ 0 0 116 -2,-0.4 4,-2.3 1,-0.2 5,-0.1 0.768 87.2 57.1 -68.6 -28.2 13.5 -27.8 -9.4 268 490 A D H > S+ 0 0 111 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 108.7 47.7 -63.4 -45.3 16.7 -26.9 -11.1 269 491 A M H > S+ 0 0 13 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.902 113.9 46.7 -61.3 -42.6 18.4 -27.0 -7.7 270 492 A K H X S+ 0 0 39 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.862 108.7 54.8 -71.2 -35.9 16.9 -30.3 -6.8 271 493 A R H X S+ 0 0 122 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.925 107.9 49.9 -60.8 -45.0 17.7 -31.8 -10.1 272 494 A K H X S+ 0 0 34 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.884 111.3 49.3 -62.5 -39.0 21.4 -30.9 -9.6 273 495 A F H X S+ 0 0 7 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.948 111.2 47.8 -64.1 -50.2 21.3 -32.5 -6.1 274 496 A Q H X S+ 0 0 97 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.876 110.2 54.5 -58.0 -38.5 19.7 -35.7 -7.4 275 497 A D H X S+ 0 0 93 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.912 105.4 52.0 -60.0 -44.3 22.3 -35.8 -10.1 276 498 A L H X S+ 0 0 35 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.822 106.1 54.8 -65.2 -32.8 25.1 -35.5 -7.5 277 499 A L H X S+ 0 0 22 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.950 107.6 49.5 -62.3 -50.4 23.6 -38.5 -5.6 278 500 A S H X S+ 0 0 71 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.944 109.3 51.6 -53.5 -53.2 23.7 -40.6 -8.8 279 501 A E H < S+ 0 0 90 -4,-2.3 4,-0.4 1,-0.2 3,-0.3 0.912 114.5 43.4 -49.8 -48.2 27.3 -39.7 -9.5 280 502 A E H >< S+ 0 0 75 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.846 116.0 47.4 -69.1 -34.8 28.3 -40.7 -5.9 281 503 A N H >X S+ 0 0 73 -4,-2.6 3,-1.4 1,-0.2 4,-1.2 0.629 88.3 82.9 -86.0 -14.2 26.3 -43.9 -5.9 282 504 A E T 3< S+ 0 0 92 -4,-1.9 -1,-0.2 -3,-0.3 3,-0.2 0.823 85.6 61.7 -56.3 -31.5 27.4 -45.2 -9.3 283 505 A S T <4 S+ 0 0 92 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.1 0.717 115.4 28.1 -70.9 -22.4 30.5 -46.6 -7.6 284 506 A T T <4 0 0 120 -3,-1.4 -1,-0.2 -4,-0.2 -2,-0.2 0.409 360.0 360.0-120.7 -1.9 28.6 -49.0 -5.2 285 507 A A < 0 0 99 -4,-1.2 5,-0.1 -3,-0.2 -3,-0.0 -0.450 360.0 360.0 -66.4 360.0 25.4 -49.7 -7.2 286 ! 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 0.0 287 508 A L 0 0 107 0, 0.0 -234,-0.1 0, 0.0 -233,-0.1 0.000 360.0 360.0 360.0 360.0 33.8 -48.3 23.0 288 ! 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 0.0 289 509 A P 0 0 167 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 155.9 22.6 -54.8 -10.2 290 510 A Q - 0 0 186 -5,-0.1 2,-0.3 0, 0.0 -5,-0.0 -0.859 360.0 -79.7-136.9 169.8 19.0 -55.4 -9.2 291 511 A V 0 0 142 -2,-0.3 0, 0.0 1,-0.0 0, 0.0 -0.537 360.0 360.0 -73.0 126.8 15.8 -57.3 -10.1 292 512 A L 0 0 144 -2,-0.3 -1,-0.0 0, 0.0 0, 0.0 -0.819 360.0 360.0-101.7 360.0 13.9 -55.7 -13.0