==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE, LYASE/DNA 18-NOV-11 3UPQ . COMPND 2 MOLECULE: DNA POLYMERASE LAMBDA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.A.GOSAVI,A.F.MOON,T.A.KUNKEL,L.C.PEDERSEN,K.BEBENEK . 308 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15851.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 9.7 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 . 2 0.6 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 . 14 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.6 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 2 0 2 2 2 1 0 0 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 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 1 252 A H 0 0 108 0, 0.0 2,-0.8 0, 0.0 38,-0.1 0.000 360.0 360.0 360.0 42.7 30.9 20.3 -29.3 2 253 A N + 0 0 36 36,-0.5 40,-0.3 37,-0.4 2,-0.2 -0.474 360.0 152.5 -62.5 104.2 31.4 24.1 -29.6 3 254 A L + 0 0 42 -2,-0.8 4,-0.3 1,-0.1 -1,-0.1 -0.606 21.0 122.3-146.9 78.6 29.5 25.3 -26.6 4 255 A H S > S+ 0 0 83 -2,-0.2 4,-0.5 2,-0.1 -1,-0.1 0.483 88.4 52.7-104.4 -14.6 30.4 28.6 -24.8 5 256 A I H >> S+ 0 0 17 2,-0.1 4,-1.6 -3,-0.1 3,-0.6 0.884 101.2 58.7 -81.5 -46.0 26.8 29.7 -25.5 6 257 A T H 3> S+ 0 0 12 1,-0.2 4,-2.7 2,-0.2 3,-0.3 0.893 95.3 64.3 -51.5 -46.7 25.2 26.6 -23.9 7 258 A E H 3> S+ 0 0 59 -4,-0.3 4,-0.9 1,-0.3 -1,-0.2 0.901 107.8 40.5 -44.1 -52.5 26.9 27.2 -20.5 8 259 A K H S+ 0 0 40 -4,-2.5 5,-2.1 2,-0.2 4,-0.3 0.901 112.5 53.8 -62.1 -42.9 13.1 28.0 -15.1 17 268 A S H ><5S+ 0 0 65 -4,-2.2 3,-2.0 -5,-0.2 -2,-0.2 0.964 109.5 43.5 -57.3 -57.5 13.2 24.4 -14.1 18 269 A V H 3<5S+ 0 0 15 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.762 111.8 56.0 -66.3 -23.6 13.5 24.9 -10.4 19 270 A Q T 3<5S- 0 0 72 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.421 119.5-109.8 -87.7 1.9 10.8 27.6 -10.5 20 271 A G T < 5S+ 0 0 37 -3,-2.0 2,-2.0 -4,-0.3 3,-0.2 0.489 76.2 133.2 91.4 2.5 8.4 25.2 -12.2 21 272 A D >< + 0 0 51 -5,-2.1 4,-2.3 1,-0.2 5,-0.2 -0.500 26.9 166.3 -81.4 70.0 8.2 26.6 -15.7 22 273 A K H > + 0 0 140 -2,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.800 64.8 53.1 -64.0 -32.7 8.6 23.2 -17.1 23 274 A W H > S+ 0 0 157 2,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.924 111.2 44.5 -74.6 -40.5 7.7 23.9 -20.7 24 275 A R H > S+ 0 0 125 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.910 113.3 52.3 -66.1 -40.9 10.1 26.8 -21.1 25 276 A A H X S+ 0 0 14 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.849 106.9 54.4 -60.0 -34.6 12.8 24.6 -19.5 26 277 A L H X S+ 0 0 28 -4,-1.7 4,-2.1 -5,-0.2 5,-0.3 0.957 106.0 50.8 -64.8 -49.1 11.9 21.9 -22.0 27 278 A G H X S+ 0 0 35 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.914 112.9 46.4 -51.9 -47.2 12.5 24.3 -24.9 28 279 A Y H X S+ 0 0 10 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.897 108.0 56.2 -63.9 -42.1 15.9 25.2 -23.4 29 280 A A H X S+ 0 0 38 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.883 113.0 41.2 -57.2 -40.6 16.8 21.6 -22.8 30 281 A K H X S+ 0 0 118 -4,-2.1 4,-0.7 2,-0.2 -1,-0.2 0.839 112.4 53.7 -79.1 -35.0 16.2 20.7 -26.4 31 282 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 -5,-0.3 -2,-0.2 0.868 114.7 43.5 -63.5 -35.5 17.9 23.9 -27.7 32 283 A I H X S+ 0 0 23 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.912 105.9 57.5 -77.5 -46.5 20.9 23.0 -25.7 33 284 A N H < S+ 0 0 93 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.719 110.1 51.8 -55.8 -19.1 21.0 19.3 -26.5 34 285 A A H >X S+ 0 0 20 -4,-0.7 3,-1.9 1,-0.1 4,-0.9 0.943 103.3 51.4 -80.8 -55.0 21.2 20.6 -30.1 35 286 A L H 3< S+ 0 0 35 -4,-1.6 3,-0.3 1,-0.3 -2,-0.2 0.784 103.9 60.1 -57.1 -29.6 24.2 23.0 -29.7 36 287 A K T 3< S+ 0 0 46 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.1 0.130 111.4 42.8 -83.3 22.3 26.2 20.3 -28.1 37 288 A S T <4 S+ 0 0 75 -3,-1.9 2,-0.3 -35,-0.1 -2,-0.2 0.459 79.2 111.3-141.8 -16.4 25.8 18.4 -31.4 38 289 A F < - 0 0 40 -4,-0.9 -36,-0.5 -3,-0.3 4,-0.1 -0.543 65.8-133.9 -69.9 126.0 26.2 20.8 -34.2 39 290 A H S S+ 0 0 75 -2,-0.3 -37,-0.4 1,-0.1 -1,-0.1 0.926 87.6 28.3 -44.2 -72.4 29.5 20.0 -36.1 40 291 A K S S- 0 0 56 1,-0.1 3,-0.1 -39,-0.1 -1,-0.1 -0.826 101.4 -95.4 -99.6 133.1 30.9 23.5 -36.4 41 292 A P - 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -38,-0.1 -0.020 54.1 -88.7 -42.3 142.1 30.2 26.2 -33.8 42 293 A V + 0 0 57 -40,-0.3 3,-0.1 1,-0.1 6,-0.0 -0.302 49.7 168.8 -65.5 136.3 27.3 28.5 -34.7 43 294 A T + 0 0 125 1,-0.2 2,-0.2 -3,-0.1 -1,-0.1 0.812 52.8 45.0-111.1 -64.1 28.3 31.6 -36.7 44 295 A S S > S- 0 0 53 1,-0.1 4,-1.3 4,-0.0 -1,-0.2 -0.593 72.2-125.3 -94.1 149.1 25.3 33.5 -38.2 45 296 A Y H > S+ 0 0 66 1,-0.3 4,-1.0 -2,-0.2 -1,-0.1 0.642 120.6 50.7 -61.5 -13.4 22.0 34.5 -36.6 46 297 A Q H > S+ 0 0 72 2,-0.2 4,-1.0 1,-0.1 -1,-0.3 0.741 97.3 63.7 -92.1 -32.3 20.6 32.6 -39.6 47 298 A E H 4 S+ 0 0 44 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.1 0.809 104.1 54.6 -57.0 -28.7 22.8 29.6 -39.0 48 299 A A H >< S+ 0 0 17 -4,-1.3 3,-1.4 1,-0.2 6,-0.2 0.998 104.2 45.8 -67.6 -69.5 20.7 29.4 -35.8 49 300 A C H 3< S+ 0 0 73 -4,-1.0 -1,-0.2 1,-0.3 -2,-0.2 0.620 101.8 72.1 -54.6 -12.4 17.2 29.4 -37.0 50 301 A S T 3< S+ 0 0 81 -4,-1.0 -1,-0.3 5,-0.1 -2,-0.1 0.056 86.5 86.1 -90.7 24.7 18.4 26.8 -39.5 51 302 A I S X S- 0 0 44 -3,-1.4 3,-1.6 3,-0.4 2,-0.6 -0.979 86.3-112.2-128.0 138.8 18.6 24.3 -36.7 52 303 A P T 3 S+ 0 0 118 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.586 106.3 25.8 -68.5 114.6 16.0 22.0 -35.2 53 304 A G T 3 S+ 0 0 47 -2,-0.6 2,-0.4 1,-0.2 -19,-0.1 0.268 103.5 91.9 116.2 -7.4 15.3 23.2 -31.7 54 305 A I < + 0 0 14 -3,-1.6 -3,-0.4 -6,-0.2 -1,-0.2 -0.976 46.1 158.6-127.7 128.5 16.3 26.9 -32.1 55 306 A G > - 0 0 33 -2,-0.4 4,-3.1 -3,-0.1 5,-0.3 -0.423 55.6 -57.3-129.7-159.8 14.0 29.8 -33.1 56 307 A K H > S+ 0 0 75 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.885 129.1 41.2 -55.3 -46.0 13.6 33.5 -33.1 57 308 A R H > S+ 0 0 109 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.932 120.2 41.0 -72.1 -47.9 13.9 33.9 -29.3 58 309 A M H > S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.890 114.8 53.7 -67.6 -40.8 16.7 31.4 -28.7 59 310 A A H X S+ 0 0 5 -4,-3.1 4,-2.3 1,-0.2 5,-0.2 0.953 107.9 47.4 -59.1 -53.4 18.6 32.6 -31.8 60 311 A E H X S+ 0 0 118 -4,-2.0 4,-0.7 -5,-0.3 -1,-0.2 0.798 111.0 54.5 -62.1 -27.3 18.6 36.3 -30.8 61 312 A K H X S+ 0 0 32 -4,-1.2 4,-1.5 2,-0.2 3,-0.5 0.897 107.3 48.6 -69.8 -42.2 19.7 35.1 -27.4 62 313 A I H X S+ 0 0 21 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.857 107.3 56.6 -63.6 -35.6 22.6 33.3 -28.9 63 314 A I H X S+ 0 0 39 -4,-2.3 4,-1.5 1,-0.2 5,-0.5 0.736 104.9 52.8 -68.3 -23.5 23.4 36.4 -30.9 64 315 A E H X>S+ 0 0 74 -4,-0.7 5,-1.4 -3,-0.5 4,-0.6 0.828 108.5 49.6 -78.7 -34.8 23.7 38.3 -27.6 65 316 A I H X5S+ 0 0 17 -4,-1.5 4,-0.6 3,-0.2 -2,-0.2 0.958 117.6 38.6 -67.1 -52.2 26.2 35.8 -26.2 66 317 A L H <5S+ 0 0 94 -4,-2.4 -2,-0.2 2,-0.1 -3,-0.2 0.989 127.6 32.9 -62.2 -61.2 28.4 35.9 -29.3 67 318 A E H <5S+ 0 0 89 -4,-1.5 -3,-0.2 -5,-0.2 -2,-0.1 0.992 132.6 27.0 -58.6 -72.2 28.2 39.6 -30.0 68 319 A S H <5S- 0 0 78 -4,-0.6 -3,-0.2 -5,-0.5 -1,-0.1 0.877 96.8-131.6 -63.8 -41.3 27.8 41.1 -26.5 69 320 A G S < - 0 0 13 -2,-0.3 3,-0.7 1,-0.1 4,-0.3 -0.754 15.5-149.3 -92.0 131.2 23.2 37.4 -21.8 72 323 A R G > S+ 0 0 47 -2,-0.4 3,-2.1 1,-0.2 4,-0.3 0.844 89.1 69.4 -69.9 -36.4 21.3 40.1 -19.8 73 324 A K G > S+ 0 0 82 1,-0.3 3,-2.5 2,-0.2 4,-0.3 0.814 86.5 70.5 -52.7 -33.5 18.4 37.9 -18.6 74 325 A L G X S+ 0 0 47 -3,-0.7 3,-1.3 1,-0.3 -1,-0.3 0.831 90.5 60.8 -51.0 -34.6 20.9 36.0 -16.4 75 326 A D G < S+ 0 0 137 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.550 101.7 53.1 -75.0 -7.2 21.1 39.2 -14.2 76 327 A H G < S+ 0 0 166 -3,-2.5 2,-0.3 -4,-0.3 -1,-0.3 0.357 73.7 127.5-109.2 3.4 17.3 38.9 -13.5 77 328 A I S < S- 0 0 42 -3,-1.3 -3,-0.0 -4,-0.3 -65,-0.0 -0.470 72.4-104.1 -59.8 121.1 17.4 35.3 -12.2 78 329 A S > - 0 0 49 -2,-0.3 3,-1.1 1,-0.2 -1,-0.1 -0.067 18.0-128.8 -48.3 146.8 15.7 35.4 -8.8 79 330 A E T 3 S+ 0 0 165 1,-0.2 4,-0.4 2,-0.1 -1,-0.2 0.614 104.3 70.6 -74.6 -11.2 18.0 35.2 -5.9 80 331 A S T 3> S+ 0 0 12 1,-0.2 4,-3.0 2,-0.1 3,-0.3 0.660 74.8 88.9 -77.6 -15.4 15.9 32.4 -4.5 81 332 A V H <> S+ 0 0 15 -3,-1.1 4,-2.8 1,-0.3 5,-0.2 0.877 83.0 49.1 -57.9 -49.7 17.1 30.0 -7.2 82 333 A P H > S+ 0 0 83 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.912 116.1 45.4 -57.0 -39.3 20.1 28.6 -5.5 83 334 A V H > S+ 0 0 26 -4,-0.4 4,-2.6 -3,-0.3 -2,-0.2 0.911 111.4 51.9 -69.9 -42.7 18.0 27.9 -2.4 84 335 A L H X S+ 0 0 4 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.898 109.9 50.1 -57.4 -41.7 15.2 26.4 -4.5 85 336 A E H X S+ 0 0 92 -4,-2.8 4,-1.2 -5,-0.2 -2,-0.2 0.928 109.3 51.5 -63.7 -43.6 17.7 24.1 -6.1 86 337 A L H < S+ 0 0 54 -4,-2.0 3,-0.3 -5,-0.2 -2,-0.2 0.920 114.7 42.5 -57.4 -46.9 19.0 23.0 -2.8 87 338 A F H >< S+ 0 0 0 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.913 110.9 54.0 -69.2 -42.5 15.5 22.2 -1.5 88 339 A S H 3< S+ 0 0 31 -4,-2.7 -1,-0.2 1,-0.3 5,-0.2 0.657 94.6 70.7 -71.6 -12.5 14.4 20.5 -4.7 89 340 A N T 3< S+ 0 0 68 -4,-1.2 2,-0.6 -3,-0.3 -1,-0.3 0.473 75.1 99.9 -79.6 -1.6 17.4 18.2 -4.5 90 341 A I S X S- 0 0 1 -3,-1.8 3,-2.3 3,-0.1 36,-0.1 -0.768 90.3-112.1 -77.3 122.0 15.7 16.6 -1.5 91 342 A W T 3 S+ 0 0 71 -2,-0.6 34,-0.5 1,-0.3 35,-0.2 -0.368 103.1 24.4 -59.6 128.3 14.1 13.4 -2.9 92 343 A G T 3 S+ 0 0 33 1,-0.2 2,-0.5 -4,-0.2 -1,-0.3 0.323 101.8 99.1 97.5 -7.2 10.3 13.8 -2.7 93 344 A A < + 0 0 8 -3,-2.3 -1,-0.2 -5,-0.2 2,-0.1 -0.963 48.5 172.6-113.1 127.9 10.4 17.6 -2.8 94 345 A G > - 0 0 37 -2,-0.5 4,-2.7 -3,-0.1 5,-0.2 -0.366 51.7 -63.7-115.5-161.6 9.7 19.4 -6.0 95 346 A T H > S+ 0 0 33 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.875 128.7 49.8 -55.1 -45.6 9.2 23.0 -7.2 96 347 A K H > S+ 0 0 165 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.903 113.8 44.6 -66.5 -41.8 6.0 23.6 -5.2 97 348 A T H > S+ 0 0 36 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.917 113.2 51.2 -67.2 -43.4 7.4 22.3 -1.9 98 349 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.894 111.0 47.9 -60.7 -42.0 10.7 24.2 -2.4 99 350 A Q H X S+ 0 0 64 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.865 111.9 50.5 -66.2 -36.5 8.8 27.5 -3.1 100 351 A M H X S+ 0 0 79 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.951 111.5 46.4 -67.1 -49.3 6.6 26.9 -0.1 101 352 A W H <>S+ 0 0 0 -4,-2.6 5,-2.1 1,-0.2 -2,-0.2 0.912 113.8 50.7 -55.8 -44.2 9.6 26.3 2.2 102 353 A Y H ><5S+ 0 0 37 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.908 108.7 49.7 -63.9 -43.1 11.2 29.4 0.7 103 354 A Q H 3<5S+ 0 0 164 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.859 104.0 61.3 -64.0 -31.7 8.2 31.6 1.3 104 355 A Q T 3<5S- 0 0 111 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.444 125.5-102.2 -75.4 2.5 8.1 30.3 4.9 105 356 A G T < 5S+ 0 0 41 -3,-1.6 -3,-0.2 1,-0.3 2,-0.2 0.436 72.7 145.2 94.7 -0.6 11.6 31.8 5.4 106 357 A F < + 0 0 14 -5,-2.1 -1,-0.3 -6,-0.2 3,-0.1 -0.506 12.3 162.1 -74.7 141.3 13.6 28.6 5.1 107 358 A R + 0 0 104 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.496 55.1 35.7-134.8 -15.8 17.0 29.0 3.5 108 359 A S S > S- 0 0 43 1,-0.1 4,-1.9 -22,-0.0 -1,-0.2 -0.907 79.8-106.5-140.1 166.9 19.2 26.0 4.4 109 360 A L H > S+ 0 0 42 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.820 121.2 59.8 -65.9 -29.0 18.9 22.3 5.1 110 361 A E H > S+ 0 0 103 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.934 104.1 50.4 -60.8 -44.8 19.4 23.1 8.8 111 362 A D H >>S+ 0 0 40 2,-0.2 4,-2.7 1,-0.2 5,-0.8 0.928 112.8 46.5 -55.2 -48.1 16.2 25.2 8.5 112 363 A I H X5S+ 0 0 0 -4,-1.9 4,-1.5 3,-0.2 -2,-0.2 0.956 113.0 49.0 -59.9 -51.9 14.4 22.3 6.8 113 364 A R H <5S+ 0 0 147 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.926 121.6 33.8 -51.5 -49.0 15.6 19.7 9.4 114 365 A S H <5S+ 0 0 55 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.839 135.7 13.4 -82.6 -33.7 14.6 21.9 12.4 115 366 A Q H <5S+ 0 0 122 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.626 95.2 98.4-123.2 -21.6 11.5 23.7 11.2 116 367 A A << - 0 0 17 -4,-1.5 2,-0.5 -5,-0.8 -15,-0.0 -0.435 66.9-125.5 -82.0 148.6 10.0 22.2 8.1 117 368 A S - 0 0 108 -2,-0.1 2,-0.4 0, 0.0 -1,-0.1 -0.806 37.1-165.5 -84.6 127.9 7.1 19.8 7.9 118 369 A L - 0 0 51 -2,-0.5 2,-0.1 -5,-0.1 -25,-0.0 -0.939 17.0-129.3-120.9 140.0 8.4 16.8 5.9 119 370 A T > - 0 0 65 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.333 38.9-101.4 -70.1 166.0 6.7 13.9 4.3 120 371 A T H > S+ 0 0 116 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.917 125.9 48.2 -52.7 -46.0 7.9 10.4 5.0 121 372 A Q H > S+ 0 0 62 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.899 109.7 51.5 -62.9 -44.5 9.7 10.4 1.6 122 373 A Q H > S+ 0 0 10 -30,-0.2 4,-2.6 1,-0.2 5,-0.2 0.884 105.3 55.2 -64.9 -36.4 11.3 13.8 2.2 123 374 A A H X S+ 0 0 46 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.897 111.2 45.5 -63.0 -38.6 12.7 12.8 5.5 124 375 A I H X S+ 0 0 17 -4,-1.5 4,-1.9 -5,-0.2 -2,-0.2 0.922 111.5 52.5 -66.8 -45.5 14.4 9.9 3.8 125 376 A G H < S+ 0 0 0 -4,-2.6 -2,-0.2 -34,-0.5 7,-0.2 0.883 111.0 47.2 -55.9 -41.0 15.6 12.2 1.0 126 377 A L H >< S+ 0 0 31 -4,-2.6 3,-1.8 1,-0.2 4,-0.3 0.923 108.2 54.3 -70.9 -43.5 17.1 14.6 3.5 127 378 A K H 3< S+ 0 0 131 -4,-2.1 3,-0.2 1,-0.3 -1,-0.2 0.876 119.7 34.6 -53.8 -39.2 18.8 11.8 5.5 128 379 A H T 3X S+ 0 0 9 -4,-1.9 4,-2.6 1,-0.2 -1,-0.3 0.045 81.5 128.4-107.3 26.0 20.5 10.6 2.3 129 380 A Y H <> S+ 0 0 26 -3,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.916 76.2 39.3 -50.1 -55.2 20.9 14.1 0.7 130 381 A S H >> S+ 0 0 85 -4,-0.3 3,-1.1 -3,-0.2 4,-0.5 0.927 115.6 51.2 -61.5 -46.8 24.6 13.7 -0.1 131 382 A D H >4 S+ 0 0 26 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 0.912 106.0 55.3 -59.7 -42.7 24.5 10.1 -1.1 132 383 A F H 3< S+ 0 0 39 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.651 101.6 57.8 -71.8 -13.5 21.6 10.8 -3.5 133 384 A L H << S+ 0 0 93 -3,-1.1 2,-0.4 -4,-0.7 -1,-0.3 0.576 94.3 84.6 -84.7 -11.6 23.6 13.5 -5.3 134 385 A E S << S- 0 0 64 -3,-1.7 2,-0.3 -4,-0.5 40,-0.0 -0.737 71.6-141.6 -93.8 137.9 26.4 11.0 -6.1 135 386 A R - 0 0 114 -2,-0.4 40,-0.2 96,-0.1 -2,-0.1 -0.762 22.9-128.4 -91.5 143.8 26.3 8.7 -9.1 136 387 A M E -A 174 0A 0 38,-2.9 38,-2.3 -2,-0.3 40,-0.1 -0.590 26.1 -96.8 -91.1 155.3 27.7 5.2 -8.5 137 388 A P E >> -A 173 0A 58 0, 0.0 4,-1.5 0, 0.0 3,-1.4 -0.379 35.7-113.5 -63.9 148.4 30.3 3.4 -10.6 138 389 A R H 3> S+ 0 0 63 34,-2.4 4,-1.8 1,-0.3 35,-0.1 0.865 116.2 61.2 -48.7 -39.5 28.9 1.1 -13.2 139 390 A E H 3> S+ 0 0 127 1,-0.2 4,-1.6 33,-0.2 -1,-0.3 0.792 100.8 52.2 -62.1 -30.8 30.4 -1.8 -11.2 140 391 A E H <> S+ 0 0 12 -3,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.888 104.8 55.2 -74.3 -38.9 28.4 -1.1 -8.2 141 392 A A H X S+ 0 0 0 -4,-1.5 4,-2.8 1,-0.2 -2,-0.2 0.911 105.6 54.0 -57.3 -40.4 25.2 -1.1 -10.2 142 393 A T H X S+ 0 0 47 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.946 107.9 49.4 -58.0 -46.6 26.2 -4.6 -11.3 143 394 A E H X S+ 0 0 75 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.836 111.6 48.5 -61.9 -37.7 26.5 -5.7 -7.7 144 395 A I H X S+ 0 0 1 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.936 110.6 49.9 -69.4 -46.6 23.1 -4.3 -6.8 145 396 A E H X S+ 0 0 28 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.930 112.6 48.8 -55.2 -45.8 21.4 -5.9 -9.8 146 397 A Q H X S+ 0 0 58 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.829 106.8 55.3 -66.8 -33.6 23.1 -9.2 -8.8 147 398 A T H X S+ 0 0 30 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.922 113.0 42.4 -61.3 -44.9 21.9 -8.9 -5.2 148 399 A V H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.935 115.7 48.7 -67.0 -46.8 18.3 -8.5 -6.4 149 400 A Q H X S+ 0 0 57 -4,-2.9 4,-3.4 1,-0.2 5,-0.2 0.927 111.4 49.3 -60.5 -48.5 18.7 -11.3 -9.0 150 401 A K H < S+ 0 0 66 -4,-2.9 4,-0.4 1,-0.2 -1,-0.2 0.898 114.2 46.2 -57.9 -42.0 20.2 -13.7 -6.5 151 402 A A H < S+ 0 0 10 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.820 116.9 44.2 -72.0 -31.2 17.4 -12.9 -4.0 152 403 A A H >X S+ 0 0 2 -4,-2.3 3,-2.9 1,-0.2 4,-1.2 0.938 106.7 57.0 -78.0 -48.8 14.7 -13.2 -6.6 153 404 A Q T 3< S+ 0 0 75 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.606 94.3 72.5 -60.1 -8.8 16.0 -16.4 -8.2 154 405 A A T 34 S+ 0 0 82 -4,-0.4 -1,-0.3 -5,-0.2 -2,-0.2 0.664 101.6 40.9 -78.7 -18.5 15.8 -17.9 -4.7 155 406 A F T <4 S- 0 0 104 -3,-2.9 2,-0.2 1,-0.3 -2,-0.2 0.683 142.4 -2.1 -93.9 -26.2 12.0 -17.9 -5.1 156 407 A N >< - 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0 0 169 -4,-0.2 -5,-2.1 -3,-0.0 2,-0.7 -0.875 360.0-124.6-102.1 134.9 -5.9 -2.9 -30.4 284 550 A V E -G 277 0C 107 -2,-0.4 -7,-0.2 -7,-0.2 -9,-0.0 -0.694 27.5-141.4 -76.3 114.5 -2.8 -4.2 -28.6 285 551 A L E -G 276 0C 30 -9,-2.5 -9,-0.5 -2,-0.7 2,-0.4 -0.564 24.2-104.9 -77.0 140.1 -0.2 -4.7 -31.3 286 552 A P + 0 0 98 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.510 44.1 169.5 -71.1 122.1 2.0 -7.8 -30.9 287 553 A T + 0 0 20 -2,-0.4 -43,-0.4 -46,-0.2 -42,-0.2 -0.591 9.2 164.4-135.1 74.5 5.5 -6.9 -29.7 288 554 A P S S+ 0 0 97 0, 0.0 2,-0.3 0, 0.0 -44,-0.2 0.810 74.2 18.2 -57.0 -34.0 7.5 -10.0 -28.6 289 555 A T S >> S- 0 0 69 -3,-0.1 4,-1.0 -46,-0.1 3,-0.5 -0.871 84.3-105.3-136.6 165.8 10.8 -8.0 -28.7 290 556 A E H >> S+ 0 0 12 -2,-0.3 4,-1.7 1,-0.2 3,-0.7 0.891 117.7 61.9 -58.6 -42.3 11.9 -4.4 -28.7 291 557 A K H 3> S+ 0 0 56 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.858 96.8 59.4 -52.5 -38.9 12.7 -4.6 -32.4 292 558 A D H <> S+ 0 0 32 -3,-0.5 4,-2.4 1,-0.2 -1,-0.3 0.892 103.4 51.5 -58.2 -40.6 9.1 -5.3 -33.0 293 559 A V H S+ 0 0 2 -4,-1.7 5,-3.1 2,-0.2 3,-0.5 0.929 113.1 49.9 -59.2 -47.0 10.7 -0.1 -33.6 295 561 A R H ><5S+ 0 0 148 -4,-2.8 3,-1.7 1,-0.3 -2,-0.2 0.921 107.7 52.3 -62.3 -44.7 9.5 -1.9 -36.8 296 562 A L H 3<5S+ 0 0 51 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.760 110.9 49.3 -63.3 -24.5 5.9 -1.2 -36.1 297 563 A L T 3<5S- 0 0 3 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.384 119.7-111.0 -94.4 2.3 6.8 2.5 -35.7 298 564 A G T < 5S+ 0 0 63 -3,-1.7 -3,-0.2 -4,-0.3 -2,-0.1 0.849 73.5 136.4 73.6 34.0 8.8 2.5 -39.0 299 565 A L < - 0 0 58 -5,-3.1 -1,-0.3 -8,-0.1 2,-0.2 -0.897 59.6-117.7-119.4 143.8 12.1 2.9 -37.2 300 566 A P - 0 0 101 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.581 49.7 -98.1 -68.3 137.2 15.5 1.2 -37.5 301 567 A Y - 0 0 82 -2,-0.2 2,-0.4 1,-0.0 -10,-0.1 -0.228 37.4-154.7 -57.5 145.4 16.4 -0.6 -34.3 302 568 A R - 0 0 106 -3,-0.1 5,-0.1 5,-0.0 -8,-0.0 -0.992 13.4-128.1-125.7 127.8 18.6 1.2 -31.9 303 569 A E > - 0 0 120 -2,-0.4 3,-2.1 1,-0.1 4,-0.3 -0.304 38.3-101.6 -60.4 153.3 20.8 -0.5 -29.3 304 570 A P G > S+ 0 0 11 0, 0.0 3,-1.7 0, 0.0 -135,-0.1 0.840 123.8 57.7 -48.1 -37.0 20.4 0.8 -25.8 305 571 A A G > S+ 0 0 70 1,-0.3 3,-0.7 -137,-0.2 -136,-0.1 0.731 100.9 57.3 -68.8 -20.1 23.5 2.9 -26.1 306 572 A E G < S+ 0 0 43 -3,-2.1 -1,-0.3 1,-0.2 -3,-0.1 0.397 98.8 61.5 -87.6 2.9 22.0 4.6 -29.1 307 573 A R G < + 0 0 0 -3,-1.7 2,-2.2 -4,-0.3 -51,-0.3 0.179 65.6 121.2-112.2 11.9 19.0 5.7 -27.0 308 574 A D < 0 0 65 -3,-0.7 -1,-0.1 1,-0.2 -55,-0.1 -0.491 360.0 360.0 -83.0 75.6 21.0 7.8 -24.6 309 575 A W 0 0 108 -2,-2.2 -1,-0.2 0, 0.0 -57,-0.0 0.689 360.0 360.0 -99.7 360.0 19.2 11.1 -25.2