==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 17-NOV-97 3BDP . COMPND 2 MOLECULE: DNA (5'-D(*GP*CP*AP*TP*GP*AP*TP*GP*CP*2DT)-3'); . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.R.KIEFER,C.MAO,L.S.BEESE . 580 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26913.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 412 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 32 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 239 41.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 3.4 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 3 1 2 3 3 1 0 0 0 3 1 0 1 0 1 0 0 0 0 0 0 1 0 1 0 1 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 297 A A 0 0 138 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 97.1 9.8 5.4 2.6 2 298 A A - 0 0 86 1,-0.1 2,-0.4 0, 0.0 147,-0.0 0.106 360.0-118.2 -42.3 152.8 11.0 8.6 0.8 3 299 A M - 0 0 28 1,-0.0 2,-0.2 146,-0.0 -1,-0.1 -0.816 25.5-115.1-102.2 139.2 8.4 11.3 0.2 4 300 A A + 0 0 71 -2,-0.4 2,-0.3 148,-0.0 -1,-0.0 -0.480 48.1 141.8 -76.0 140.3 7.5 12.4 -3.3 5 301 A F - 0 0 55 -2,-0.2 2,-0.5 41,-0.1 43,-0.2 -0.956 49.5-105.5-169.1 155.0 8.4 15.9 -4.6 6 302 A T E -a 48 0A 80 41,-3.3 43,-2.4 -2,-0.3 2,-1.5 -0.771 20.9-147.3 -88.9 126.8 9.5 17.8 -7.7 7 303 A L E -a 49 0A 59 -2,-0.5 43,-0.1 41,-0.2 41,-0.1 -0.701 31.9-149.8 -92.2 83.8 13.2 18.9 -7.5 8 304 A A E -a 50 0A 7 -2,-1.5 43,-0.5 41,-1.3 3,-0.1 -0.187 30.1-172.2 -60.7 142.4 12.5 22.1 -9.6 9 305 A D S S+ 0 0 113 1,-0.3 2,-0.3 41,-0.1 -1,-0.1 0.531 82.6 22.1-104.2 -17.3 15.1 23.7 -11.9 10 306 A R S S- 0 0 179 45,-0.0 -1,-0.3 48,-0.0 2,-0.2 -0.991 88.9-101.2-150.7 148.3 12.8 26.6 -12.5 11 307 A V - 0 0 19 -2,-0.3 2,-0.3 43,-0.1 49,-0.1 -0.475 39.3-163.7 -70.9 137.3 9.9 28.3 -10.7 12 308 A T > - 0 0 60 -2,-0.2 3,-1.8 1,-0.1 4,-0.3 -0.848 34.9-111.5-123.1 160.3 6.4 27.5 -12.1 13 309 A E G > S+ 0 0 161 -2,-0.3 3,-2.1 1,-0.3 -1,-0.1 0.841 116.1 66.6 -54.2 -34.0 3.0 29.0 -11.7 14 310 A E G > S+ 0 0 96 1,-0.3 3,-0.5 2,-0.1 31,-0.3 0.786 96.7 54.6 -57.3 -32.4 2.1 25.9 -9.8 15 311 A M G < S+ 0 0 4 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.460 97.4 67.4 -82.9 -2.5 4.5 26.9 -7.0 16 312 A L G < S+ 0 0 24 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.1 -0.139 72.1 149.8-112.8 40.1 2.9 30.3 -6.6 17 313 A A < - 0 0 10 -3,-0.5 3,-0.1 2,-0.1 -3,-0.0 -0.158 61.4-101.9 -72.3 164.2 -0.5 29.3 -5.2 18 314 A D S S+ 0 0 106 1,-0.2 53,-1.9 52,-0.1 2,-0.3 0.579 105.8 22.8 -55.6 -23.5 -2.8 31.2 -2.8 19 315 A K E S+b 71 0A 74 51,-0.2 25,-0.5 2,-0.0 2,-0.3 -0.953 71.7 151.9-153.7 133.4 -1.7 29.1 0.2 20 316 A A E -b 72 0A 0 51,-1.9 53,-2.2 -2,-0.3 2,-0.5 -0.989 45.8-113.9-158.0 159.9 1.3 27.0 0.9 21 317 A A E -bC 73 42A 0 21,-3.2 21,-2.1 -2,-0.3 2,-0.4 -0.877 45.1-160.9 -93.9 129.0 3.6 25.6 3.5 22 318 A L E - C 0 41A 1 51,-2.9 2,-0.5 -2,-0.5 53,-0.3 -0.962 17.6-170.2-122.6 135.2 7.0 27.4 2.9 23 319 A V E + C 0 40A 9 17,-2.6 17,-2.2 -2,-0.4 2,-0.5 -0.987 6.8 177.0-123.3 119.7 10.5 26.5 4.0 24 320 A V E - C 0 39A 11 -2,-0.5 2,-0.4 15,-0.2 15,-0.2 -0.844 29.0-145.0-120.2 89.2 13.3 29.1 3.5 25 321 A E E + C 0 38A 18 13,-1.6 12,-3.2 -2,-0.5 2,-0.6 -0.411 29.2 169.9 -72.5 117.1 16.2 27.3 5.1 26 322 A V - 0 0 6 -2,-0.4 10,-0.1 10,-0.2 5,-0.1 -0.970 7.4-177.7-121.0 108.0 18.9 29.2 7.0 27 323 A V + 0 0 13 -2,-0.6 -1,-0.1 8,-0.4 2,-0.1 0.777 52.5 94.6 -82.1 -30.1 21.1 26.7 8.7 28 324 A E S S- 0 0 104 7,-0.3 6,-0.1 1,-0.1 -2,-0.0 -0.429 77.0-133.0 -62.5 136.3 23.5 29.0 10.6 29 325 A E S S+ 0 0 130 1,-0.2 2,-1.0 -2,-0.1 -1,-0.1 0.936 101.9 57.0 -58.3 -47.3 22.2 29.6 14.1 30 326 A N S S- 0 0 33 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.784 74.2-171.7 -86.1 107.9 22.8 33.3 13.7 31 327 A Y > + 0 0 2 -2,-1.0 3,-1.6 3,-0.1 2,-0.4 0.403 40.1 125.9 -81.7 2.2 20.7 34.1 10.6 32 328 A H T 3 S- 0 0 6 1,-0.3 51,-0.1 275,-0.1 -2,-0.1 -0.522 95.3 -17.1 -69.5 117.5 22.0 37.7 10.1 33 329 A D T 3 S+ 0 0 96 -2,-0.4 -1,-0.3 49,-0.3 50,-0.1 0.805 107.6 149.4 57.0 33.1 23.3 38.0 6.5 34 330 A A < - 0 0 7 -3,-1.6 -1,-0.2 1,-0.1 -3,-0.1 -0.632 51.6 -89.6 -99.4 157.5 23.4 34.2 6.4 35 331 A P - 0 0 69 0, 0.0 2,-0.7 0, 0.0 -8,-0.4 -0.241 24.8-137.9 -64.0 142.7 23.0 31.8 3.5 36 332 A I - 0 0 12 -10,-0.1 -10,-0.2 1,-0.1 3,-0.1 -0.945 20.4-164.3-101.1 116.0 19.6 30.5 2.5 37 333 A V - 0 0 32 -12,-3.2 2,-0.3 -2,-0.7 -11,-0.1 0.632 54.8 -31.3 -79.0 -21.1 20.5 26.8 1.8 38 334 A G E -C 25 0A 0 -13,-0.5 -13,-1.6 13,-0.1 2,-0.3 -0.918 55.7-125.0 173.6 166.5 17.4 25.7 -0.2 39 335 A I E -CD 24 50A 0 11,-2.1 11,-2.4 -2,-0.3 2,-0.4 -0.961 15.1-169.7-134.4 148.2 13.7 26.2 -0.5 40 336 A A E -CD 23 49A 0 -17,-2.2 -17,-2.6 -2,-0.3 2,-0.4 -1.000 1.1-173.5-140.0 138.9 10.6 24.0 -0.3 41 337 A V E -CD 22 48A 0 7,-2.5 7,-3.2 -2,-0.4 2,-0.4 -1.000 1.9-177.5-133.0 132.3 7.0 24.7 -1.1 42 338 A V E +CD 21 47A 5 -21,-2.1 -21,-3.2 -2,-0.4 2,-0.2 -1.000 22.6 142.3-130.1 125.8 4.0 22.3 -0.5 43 339 A N E > - D 0 46A 5 3,-2.2 3,-2.2 -2,-0.4 -23,-0.1 -0.820 69.1 -69.5-146.9-174.2 0.6 23.4 -1.6 44 340 A E T 3 S+ 0 0 149 -25,-0.5 3,-0.1 1,-0.3 -24,-0.1 0.792 129.2 56.9 -57.0 -26.8 -2.5 21.8 -3.1 45 341 A H T 3 S- 0 0 84 -31,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.439 118.0 -93.1 -85.1 -0.6 -0.6 21.2 -6.4 46 342 A G E < - D 0 43A 27 -3,-2.2 -3,-2.2 -32,-0.1 2,-0.4 -0.863 49.0 -45.0 133.3-164.7 2.2 19.2 -4.8 47 343 A R E - D 0 42A 89 -2,-0.3 -41,-3.3 -5,-0.2 2,-0.3 -0.961 48.2-179.9-119.9 131.3 5.7 19.4 -3.2 48 344 A F E -aD 6 41A 3 -7,-3.2 -7,-2.5 -2,-0.4 2,-0.4 -0.963 18.3-159.8-134.4 147.3 8.6 21.3 -4.6 49 345 A F E -aD 7 40A 3 -43,-2.4 -41,-1.3 -2,-0.3 2,-0.4 -0.976 16.6-170.6-120.9 137.1 12.2 22.0 -3.8 50 346 A L E -aD 8 39A 0 -11,-2.4 -11,-2.1 -2,-0.4 -41,-0.1 -0.987 25.8-122.3-129.9 138.3 13.9 25.0 -5.3 51 347 A R >> - 0 0 56 -43,-0.5 4,-2.1 -2,-0.4 3,-0.6 -0.620 26.4-131.9 -75.0 139.3 17.6 25.9 -5.3 52 348 A P H 3> S+ 0 0 10 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.851 100.1 62.9 -62.2 -38.8 17.8 29.4 -3.7 53 349 A E H 34 S+ 0 0 127 1,-0.2 4,-0.1 2,-0.2 -15,-0.0 0.848 113.5 35.8 -57.9 -32.6 20.1 30.9 -6.3 54 350 A T H X4 S+ 0 0 32 -3,-0.6 3,-0.6 2,-0.1 4,-0.4 0.900 118.4 45.7 -91.2 -41.6 17.4 30.4 -8.9 55 351 A A H >< S+ 0 0 0 -4,-2.1 3,-1.2 1,-0.2 7,-0.3 0.918 112.5 50.3 -68.4 -40.3 14.2 31.1 -7.0 56 352 A L T 3< S+ 0 0 31 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.1 0.588 111.1 51.0 -75.1 -5.5 15.4 34.2 -5.3 57 353 A A T < S+ 0 0 77 -3,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.428 90.1 96.7-104.8 -4.8 16.5 35.5 -8.7 58 354 A D <> - 0 0 28 -3,-1.2 4,-2.5 -4,-0.4 3,-0.4 -0.774 66.7-150.5 -89.6 117.5 13.1 34.8 -10.2 59 355 A P H > S+ 0 0 92 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.839 95.2 52.7 -56.5 -35.4 10.9 37.9 -10.2 60 356 A Q H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.852 111.0 46.1 -69.1 -37.9 7.6 35.9 -9.9 61 357 A F H > S+ 0 0 0 -3,-0.4 4,-2.5 -6,-0.2 -1,-0.2 0.908 113.9 47.5 -70.6 -44.3 8.9 34.0 -6.8 62 358 A V H X S+ 0 0 44 -4,-2.5 4,-1.8 -7,-0.3 -2,-0.2 0.900 114.6 48.3 -63.2 -37.0 10.2 37.2 -5.1 63 359 A A H X S+ 0 0 63 -4,-2.2 4,-0.7 -5,-0.3 -2,-0.2 0.896 110.5 49.9 -69.4 -39.9 6.8 38.8 -6.0 64 360 A W H >< S+ 0 0 7 -4,-2.1 3,-0.8 1,-0.2 6,-0.2 0.908 109.0 53.9 -63.6 -41.4 4.9 35.9 -4.6 65 361 A L H 3< S+ 0 0 0 -4,-2.5 27,-2.9 1,-0.2 -2,-0.2 0.891 113.1 42.5 -59.1 -41.5 7.0 36.0 -1.4 66 362 A G H 3< S+ 0 0 26 -4,-1.8 2,-0.9 25,-0.2 -1,-0.2 0.496 86.9 107.8 -87.3 -2.5 6.1 39.7 -0.9 67 363 A D X< - 0 0 56 -3,-0.8 3,-2.0 -4,-0.7 25,-0.1 -0.674 55.0-160.4 -83.1 109.9 2.5 39.3 -1.8 68 364 A E T 3 S+ 0 0 108 -2,-0.9 -1,-0.2 1,-0.3 -4,-0.0 0.726 89.6 59.3 -58.2 -25.3 0.5 39.7 1.5 69 365 A T T 3 S+ 0 0 83 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.520 86.4 82.7 -85.8 -2.8 -2.5 38.0 -0.1 70 366 A K S < S- 0 0 46 -3,-2.0 2,-0.3 -6,-0.2 -51,-0.2 -0.888 82.6-143.0-100.9 102.4 -0.5 34.8 -0.8 71 367 A K E -b 19 0A 67 -53,-1.9 -51,-1.9 -2,-0.9 2,-0.4 -0.518 18.2-169.7 -77.5 129.3 -0.6 33.0 2.5 72 368 A K E -be 20 94A 0 21,-2.8 23,-1.7 -2,-0.3 24,-1.2 -0.918 12.0-155.9-119.7 141.4 2.3 31.1 3.8 73 369 A S E +be 21 96A 0 -53,-2.2 -51,-2.9 -2,-0.4 2,-0.2 -0.955 31.6 157.9-112.1 132.5 2.6 28.7 6.8 74 370 A M E - e 0 97A 4 22,-3.0 24,-3.3 -2,-0.5 2,-0.4 -0.793 43.5-117.0-142.3-175.6 6.0 28.4 8.2 75 371 A F S S- 0 0 36 -53,-0.3 39,-0.1 22,-0.3 22,-0.1 -0.963 99.2 -6.0-131.5 112.3 8.2 27.4 11.2 76 372 A D S >> S+ 0 0 32 -2,-0.4 4,-1.0 3,-0.1 3,-0.7 0.971 72.7 175.7 65.1 57.0 10.3 30.3 12.6 77 373 A S H 3> S+ 0 0 11 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.770 71.6 69.0 -64.7 -24.3 9.4 32.8 9.8 78 374 A K H 3> S+ 0 0 10 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.916 96.5 53.6 -61.1 -40.5 11.3 35.5 11.6 79 375 A R H <> S+ 0 0 57 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.918 114.7 40.4 -57.7 -46.1 14.5 33.6 10.8 80 376 A A H X S+ 0 0 3 -4,-1.0 4,-2.4 2,-0.2 5,-0.2 0.912 113.2 54.7 -68.9 -47.7 13.6 33.5 7.0 81 377 A A H X S+ 0 0 19 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.918 113.0 41.6 -53.8 -47.2 12.2 37.1 7.0 82 378 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -49,-0.3 0.912 111.9 53.2 -70.6 -42.6 15.5 38.5 8.4 83 379 A A H < S+ 0 0 1 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.855 115.1 44.4 -59.4 -34.1 17.7 36.3 6.2 84 380 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 3,-1.6 0.855 105.6 58.8 -77.8 -38.3 15.7 37.7 3.3 85 381 A K H ><5S+ 0 0 48 -4,-2.4 3,-1.8 1,-0.3 -2,-0.2 0.903 102.3 56.5 -55.9 -40.4 15.7 41.4 4.5 86 382 A W T 3<5S+ 0 0 53 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.702 107.8 48.6 -65.3 -15.4 19.5 41.0 4.3 87 383 A K T < 5S- 0 0 100 -3,-1.6 -1,-0.3 2,-0.2 -2,-0.2 0.244 120.6-108.2-104.3 8.6 19.0 40.1 0.6 88 384 A G T < 5S+ 0 0 75 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.732 79.8 128.3 72.1 19.9 16.7 43.0 -0.1 89 385 A I < - 0 0 21 -5,-2.6 2,-0.4 -8,-0.1 -1,-0.2 -0.935 50.5-142.1-113.3 134.0 13.6 40.7 -0.3 90 386 A E - 0 0 132 -2,-0.4 2,-0.5 -28,-0.1 -23,-0.1 -0.787 7.6-153.5 -96.0 130.4 10.4 41.3 1.7 91 387 A L + 0 0 26 -2,-0.4 2,-0.3 -10,-0.1 -25,-0.2 -0.898 26.3 162.0-103.9 125.7 8.5 38.3 3.1 92 388 A C + 0 0 26 -27,-2.9 -25,-0.2 -2,-0.5 3,-0.1 -0.874 42.1 47.9-135.5 170.2 4.7 38.9 3.6 93 389 A G + 0 0 4 -2,-0.3 -21,-2.8 1,-0.2 2,-1.1 0.666 56.2 157.0 76.1 16.0 1.5 36.9 4.1 94 390 A V E +e 72 0A 40 -23,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.643 7.6 168.7 -76.1 103.8 2.8 34.5 6.8 95 391 A S E + 0 0 44 -23,-1.7 2,-0.3 -2,-1.1 -22,-0.2 0.570 61.6 31.2 -95.6 -7.5 -0.5 33.6 8.4 96 392 A F E -e 73 0A 0 -24,-1.2 -22,-3.0 -3,-0.1 2,-0.6 -0.930 55.1-170.6-155.3 124.9 0.7 30.7 10.6 97 393 A D E > -e 74 0A 2 -2,-0.3 4,-2.1 -24,-0.2 3,-0.3 -0.956 9.6-161.0-118.5 109.0 4.0 30.1 12.4 98 394 A L H > S+ 0 0 0 -24,-3.3 4,-2.5 -2,-0.6 5,-0.2 0.783 89.1 57.5 -59.5 -34.0 4.3 26.6 13.8 99 395 A L H > S+ 0 0 23 -25,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.922 111.1 42.4 -63.9 -44.6 7.1 27.4 16.2 100 396 A L H > S+ 0 0 3 -3,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.866 113.4 52.2 -70.6 -37.7 5.0 30.2 17.8 101 397 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.928 112.3 46.2 -63.8 -44.4 1.9 28.0 17.8 102 398 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.919 110.7 53.7 -63.8 -43.4 3.8 25.2 19.6 103 399 A Y H < S+ 0 0 9 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.908 110.3 46.0 -58.6 -43.1 5.3 27.7 22.1 104 400 A L H < S+ 0 0 2 -4,-2.1 370,-0.4 1,-0.2 -1,-0.2 0.881 109.5 54.5 -68.8 -38.3 1.9 29.0 23.1 105 401 A L H < S- 0 0 2 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.886 137.3 -14.6 -64.0 -39.6 0.4 25.6 23.4 106 402 A D >< - 0 0 27 -4,-2.1 3,-1.4 -5,-0.1 5,-0.4 -0.519 55.0-172.3-170.2 95.0 3.2 24.5 25.8 107 403 A P G > S+ 0 0 12 0, 0.0 3,-0.7 0, 0.0 -3,-0.1 0.680 85.4 67.4 -61.4 -22.1 6.5 26.4 26.3 108 404 A A G 3 S+ 0 0 61 1,-0.2 -5,-0.1 208,-0.1 208,-0.1 0.727 81.7 75.7 -74.4 -21.2 7.9 23.7 28.5 109 405 A Q G < S- 0 0 112 -3,-1.4 -1,-0.2 -7,-0.2 3,-0.1 0.819 93.6-139.9 -59.5 -30.2 8.1 21.3 25.6 110 406 A G < - 0 0 50 -3,-0.7 2,-0.4 -4,-0.3 -2,-0.1 0.855 24.7-170.0 72.5 34.0 11.1 23.2 24.3 111 407 A V + 0 0 14 -5,-0.4 -1,-0.2 1,-0.2 3,-0.1 -0.435 24.3 152.2 -62.7 114.5 10.0 22.9 20.7 112 408 A D + 0 0 120 -2,-0.4 2,-0.3 1,-0.1 -1,-0.2 0.215 59.3 33.0-130.0 10.4 12.9 24.1 18.6 113 409 A D S > S- 0 0 12 1,-0.1 4,-1.9 -14,-0.1 5,-0.2 -0.972 85.1-102.0-157.4 166.5 12.4 22.3 15.3 114 410 A V H > S+ 0 0 3 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.881 118.4 56.8 -60.8 -38.6 9.6 21.0 13.2 115 411 A R H > S+ 0 0 76 12,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.910 105.7 50.4 -60.2 -43.9 10.1 17.4 14.4 116 412 A A H > S+ 0 0 12 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.917 114.5 44.0 -60.8 -44.4 9.6 18.5 18.0 117 413 A A H < S+ 0 0 0 -4,-1.9 3,-0.5 1,-0.2 4,-0.3 0.907 113.5 51.0 -67.3 -40.7 6.3 20.3 17.2 118 414 A A H ><>S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.2 5,-1.7 0.884 101.9 60.5 -64.3 -39.0 5.1 17.5 15.0 119 415 A K H ><5S+ 0 0 86 -4,-2.5 3,-2.1 1,-0.3 -1,-0.2 0.833 90.0 71.5 -59.7 -30.3 5.7 14.9 17.7 120 416 A M T 3<5S+ 0 0 54 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.763 107.1 36.6 -55.7 -25.1 3.2 16.8 19.8 121 417 A K T < 5S- 0 0 60 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 -0.019 122.9 -98.9-120.4 31.5 0.5 15.5 17.5 122 418 A Q T < 5S+ 0 0 161 -3,-2.1 2,-0.6 1,-0.2 -3,-0.2 0.829 80.1 134.9 58.3 37.5 1.9 12.0 16.8 123 419 A Y < + 0 0 46 -5,-1.7 -1,-0.2 -8,-0.2 -2,-0.2 -0.976 14.9 156.6-116.9 116.1 3.5 13.0 13.5 124 420 A E + 0 0 121 -2,-0.6 2,-0.6 -3,-0.1 -1,-0.1 0.174 33.8 114.0-128.6 21.3 7.0 11.6 13.1 125 421 A A S S+ 0 0 44 28,-0.1 2,-0.3 -7,-0.1 32,-0.1 -0.104 71.1 68.1 -85.8 39.7 7.5 11.6 9.3 126 422 A V S S- 0 0 10 -2,-0.6 24,-0.1 -11,-0.1 -3,-0.0 -0.977 80.2-122.5-155.6 141.1 10.1 14.3 9.6 127 423 A R - 0 0 134 -2,-0.3 -12,-0.4 23,-0.1 2,-0.2 -0.533 29.6-103.1 -90.5 154.3 13.6 14.2 11.1 128 424 A P >> - 0 0 48 0, 0.0 4,-1.3 0, 0.0 3,-0.7 -0.523 33.1-122.1 -68.5 143.1 15.0 16.5 13.9 129 425 A D H 3> S+ 0 0 30 1,-0.3 4,-3.2 2,-0.2 5,-0.5 0.861 111.8 58.3 -56.7 -38.3 17.2 19.1 12.4 130 426 A E H 3> S+ 0 0 118 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.844 100.8 57.9 -61.4 -34.5 20.2 18.0 14.5 131 427 A A H <4 S+ 0 0 50 -3,-0.7 -1,-0.2 2,-0.2 -2,-0.2 0.897 116.2 32.4 -64.4 -41.2 19.8 14.6 13.0 132 428 A V H < S+ 0 0 17 -4,-1.3 -2,-0.2 -3,-0.1 -1,-0.2 0.885 128.9 34.7 -88.8 -31.8 20.3 15.9 9.5 133 429 A Y H < S- 0 0 6 -4,-3.2 7,-2.1 1,-0.2 -3,-0.2 0.712 99.5-140.9 -91.0 -23.7 22.7 18.8 10.0 134 430 A G < - 0 0 14 -4,-1.9 2,-0.4 -5,-0.5 -1,-0.2 -0.333 25.9 -67.7 89.5-175.8 24.7 17.4 12.9 135 431 A K S > S- 0 0 113 4,-0.1 3,-0.7 -2,-0.1 4,-0.3 -0.934 72.9 -49.4-122.7 140.0 26.0 19.2 15.9 136 432 A G G > S+ 0 0 50 -2,-0.4 3,-2.5 1,-0.2 0, 0.0 -0.041 125.1 13.2 43.7-125.2 28.6 21.9 16.4 137 433 A A G 3 S+ 0 0 110 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.938 133.6 47.4 -44.2 -61.5 31.9 21.2 14.7 138 434 A K G < S+ 0 0 135 -3,-0.7 -1,-0.3 2,-0.0 -2,-0.2 0.443 85.3 124.7 -64.4 1.6 30.5 18.3 12.6 139 435 A R < + 0 0 84 -3,-2.5 2,-0.3 -4,-0.3 -5,-0.2 -0.306 33.6 148.8 -59.6 147.9 27.5 20.5 11.7 140 436 A A - 0 0 59 -7,-2.1 -2,-0.0 -6,-0.1 -3,-0.0 -0.887 52.0-104.1-179.4 147.3 27.1 20.7 7.9 141 437 A V - 0 0 67 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.652 45.9-133.5 -78.1 133.0 24.6 21.1 5.1 142 438 A P - 0 0 29 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 -0.259 34.3 -69.3 -82.5 177.2 24.1 17.7 3.5 143 439 A D >> - 0 0 132 1,-0.1 4,-2.7 4,-0.1 3,-1.0 -0.271 55.7 -98.4 -65.8 151.7 24.0 16.9 -0.2 144 440 A E H 3> S+ 0 0 69 1,-0.3 4,-3.2 2,-0.2 5,-0.3 0.744 120.0 53.3 -40.3 -42.3 21.1 18.1 -2.2 145 441 A P H 3> S+ 0 0 87 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.930 116.5 39.1 -65.3 -40.9 19.1 14.9 -2.3 146 442 A V H <> S+ 0 0 73 -3,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.924 119.8 46.8 -70.5 -46.3 19.3 14.6 1.5 147 443 A L H X S+ 0 0 9 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.932 111.9 50.3 -60.5 -50.8 18.8 18.4 2.0 148 444 A A H X S+ 0 0 0 -4,-3.2 4,-2.0 -5,-0.2 -1,-0.2 0.864 110.4 49.2 -60.0 -39.5 15.9 18.5 -0.4 149 445 A E H X S+ 0 0 54 -4,-1.5 4,-2.5 -5,-0.3 -1,-0.2 0.921 110.2 51.2 -68.1 -41.8 14.1 15.6 1.2 150 446 A H H X S+ 0 0 9 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.931 111.8 46.3 -60.0 -46.1 14.5 17.1 4.7 151 447 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.895 113.5 48.6 -64.8 -40.1 13.1 20.5 3.6 152 448 A V H X S+ 0 0 0 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.909 110.6 50.9 -66.8 -40.9 10.1 19.0 1.8 153 449 A R H X S+ 0 0 41 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.884 110.9 49.3 -65.2 -35.5 9.3 16.8 4.8 154 450 A K H X S+ 0 0 11 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.946 112.2 48.0 -67.2 -44.8 9.4 19.8 7.1 155 451 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.889 110.1 51.9 -61.6 -39.7 7.1 21.7 4.7 156 452 A A H X S+ 0 0 5 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.871 108.4 51.9 -65.9 -36.5 4.7 18.7 4.5 157 453 A A H X S+ 0 0 0 -4,-1.8 4,-4.0 2,-0.2 5,-0.3 0.959 111.5 45.9 -63.4 -51.2 4.6 18.6 8.3 158 454 A I H X S+ 0 0 1 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.935 112.0 52.2 -56.4 -46.5 3.7 22.3 8.6 159 455 A W H < S+ 0 0 71 -4,-2.6 4,-0.4 -5,-0.2 -1,-0.2 0.933 118.5 37.1 -55.9 -44.9 1.1 21.8 5.8 160 456 A E H < S+ 0 0 109 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.889 117.6 48.4 -75.5 -41.4 -0.4 18.9 7.7 161 457 A L H X S+ 0 0 5 -4,-4.0 4,-2.0 1,-0.2 5,-0.2 0.617 86.3 85.9 -78.7 -15.0 -0.1 20.2 11.3 162 458 A E H X S+ 0 0 24 -4,-1.8 4,-2.2 -5,-0.3 5,-0.2 0.899 90.6 47.2 -54.2 -45.4 -1.5 23.7 10.8 163 459 A R H > S+ 0 0 166 -3,-0.4 4,-2.3 -4,-0.4 -1,-0.2 0.943 112.5 45.5 -64.9 -53.1 -5.1 22.7 11.3 164 460 A P H > S+ 0 0 24 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.883 114.6 49.9 -60.0 -36.1 -4.8 20.6 14.4 165 461 A F H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.942 111.9 46.0 -66.7 -46.4 -2.6 23.2 16.1 166 462 A L H X S+ 0 0 53 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.870 111.4 55.4 -62.0 -37.5 -5.0 26.1 15.3 167 463 A D H X S+ 0 0 70 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.908 110.8 42.6 -62.0 -46.3 -7.8 23.8 16.6 168 464 A E H X S+ 0 0 42 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.933 111.5 54.9 -68.4 -44.2 -6.1 23.3 19.9 169 465 A L H <>S+ 0 0 0 -4,-2.9 5,-3.8 1,-0.2 6,-0.6 0.901 108.5 50.3 -54.4 -40.1 -5.1 27.0 20.2 170 466 A R H ><5S+ 0 0 174 -4,-2.2 3,-1.3 4,-0.2 -1,-0.2 0.899 108.0 51.0 -65.1 -41.1 -8.8 27.8 19.7 171 467 A R H 3<5S+ 0 0 164 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.882 111.4 49.1 -61.9 -38.7 -9.9 25.4 22.4 172 468 A N T 3<5S- 0 0 19 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.405 115.6-119.2 -78.8 -0.0 -7.3 27.1 24.7 173 469 A E T < 5S+ 0 0 126 -3,-1.3 -3,-0.2 -5,-0.2 4,-0.1 0.885 84.3 118.4 60.4 35.7 -8.7 30.5 23.7 174 470 A Q >< + 0 0 0 -5,-3.8 4,-1.7 -6,-0.2 -4,-0.2 0.231 31.7 100.7-115.6 8.5 -5.2 31.2 22.4 175 471 A D H > S+ 0 0 39 -6,-0.6 4,-2.9 1,-0.2 5,-0.2 0.927 89.1 41.1 -62.7 -44.1 -6.0 31.7 18.7 176 472 A R H >>S+ 0 0 154 2,-0.2 4,-3.1 1,-0.2 5,-0.9 0.840 107.5 62.5 -73.5 -30.7 -5.9 35.6 18.9 177 473 A L H 4>S+ 0 0 9 3,-0.2 5,-2.3 1,-0.2 4,-0.5 0.899 113.5 37.0 -59.3 -37.7 -2.9 35.4 21.1 178 474 A L H <>S+ 0 0 0 -4,-1.7 5,-2.1 3,-0.2 -2,-0.2 0.948 125.3 36.4 -78.4 -49.3 -1.2 33.8 18.2 179 475 A V H <5S+ 0 0 73 -4,-2.9 -3,-0.2 1,-0.2 -2,-0.2 0.845 128.1 30.0 -76.0 -34.7 -2.7 35.7 15.3 180 476 A E T <5S+ 0 0 90 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.614 132.0 23.8-102.3 -13.9 -3.0 39.2 16.8 181 477 A L T > S+ 0 0 42 0, 0.0 4,-1.4 0, 0.0 3,-0.2 0.906 114.0 53.8 -60.7 -33.1 2.5 40.5 14.3 185 481 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.861 98.6 62.8 -66.3 -34.8 5.2 40.8 17.0 186 482 A S H X S+ 0 0 5 -4,-1.7 4,-1.9 -3,-0.3 -1,-0.2 0.913 103.7 47.7 -55.1 -46.3 7.5 38.5 15.1 187 483 A S H X S+ 0 0 74 -4,-1.3 4,-1.7 -3,-0.2 -1,-0.2 0.840 110.5 51.8 -64.1 -36.1 7.6 40.9 12.2 188 484 A I H X S+ 0 0 15 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.933 109.8 49.4 -68.3 -42.3 8.4 43.8 14.5 189 485 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.871 107.0 56.0 -63.7 -35.3 11.3 41.9 16.1 190 486 A A H X S+ 0 0 2 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.916 107.6 48.6 -62.2 -42.6 12.6 41.1 12.6 191 487 A E H X S+ 0 0 96 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.935 112.1 49.3 -62.9 -44.1 12.7 44.8 11.9 192 488 A M H X S+ 0 0 5 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.933 113.4 44.3 -60.2 -49.7 14.5 45.5 15.2 193 489 A E H < S+ 0 0 0 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.912 114.8 49.4 -62.1 -45.2 17.2 42.8 14.7 194 490 A F H < S+ 0 0 73 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.922 111.3 49.8 -60.4 -46.4 17.8 43.8 11.1 195 491 A A H < S- 0 0 25 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.912 94.7-174.8 -59.8 -44.6 18.1 47.5 12.0 196 492 A G < - 0 0 4 -4,-2.4 2,-0.4 -5,-0.2 111,-0.2 -0.054 27.0 -81.4 73.7 177.4 20.6 46.7 14.8 197 493 A V E -F 306 0B 9 109,-2.1 109,-2.1 -4,-0.1 2,-0.2 -0.994 38.4-122.1-127.2 129.1 22.2 49.1 17.3 198 494 A K E -FG 305 345B 45 147,-0.6 147,-2.0 -2,-0.4 2,-0.4 -0.469 25.7-156.5 -71.5 135.8 25.1 51.4 16.5 199 495 A V E - G 0 344B 0 105,-2.9 2,-1.6 145,-0.2 145,-0.2 -0.958 17.0-140.4-120.1 130.6 28.2 50.9 18.7 200 496 A D > + 0 0 53 143,-3.1 4,-2.2 -2,-0.4 3,-0.3 -0.679 27.0 178.6 -86.2 86.3 31.0 53.5 19.2 201 497 A T H > S+ 0 0 14 -2,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.708 75.0 60.4 -65.9 -22.8 33.8 51.0 19.2 202 498 A K H > S+ 0 0 116 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.921 108.3 45.2 -69.4 -42.3 36.5 53.6 19.7 203 499 A R H > S+ 0 0 53 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.943 113.1 50.4 -63.6 -46.6 34.8 54.4 23.0 204 500 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.897 110.3 50.1 -58.0 -42.5 34.5 50.8 23.8 205 501 A E H X S+ 0 0 103 -4,-2.4 4,-0.9 2,-0.2 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1,-0.3 -1,-0.3 0.808 104.9 52.8 -60.8 -32.5 45.2 40.8 45.5 223 519 A Y H S+ 0 0 30 -4,-1.2 4,-1.7 -3,-0.7 5,-0.8 0.822 109.4 51.3 -73.0 -29.9 48.4 38.9 45.1 224 520 A E H <5S+ 0 0 132 -4,-1.7 3,-0.4 -3,-0.4 -2,-0.2 0.992 110.4 45.4 -67.2 -61.1 49.9 41.1 47.9 225 521 A L H <5S+ 0 0 28 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.721 117.6 46.3 -54.7 -25.4 47.1 40.5 50.4 226 522 A A H <5S- 0 0 3 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.790 103.5-131.1 -88.7 -30.4 47.2 36.8 49.6 227 523 A G T <5S+ 0 0 58 -4,-1.7 2,-0.3 -3,-0.4 -3,-0.2 0.497 80.7 45.4 91.2 3.6 51.0 36.5 49.8 228 524 A Q S - 0 0 71 -2,-0.3 3,-2.5 1,-0.2 7,-0.3 -0.681 35.7-172.9 -86.0 96.2 43.9 32.3 39.5 232 528 A I T 3 S+ 0 0 2 -2,-1.2 -1,-0.2 1,-0.3 6,-0.1 0.708 84.9 60.8 -59.8 -19.3 41.3 34.7 40.9 233 529 A N T 3 S+ 0 0 108 1,-0.1 -1,-0.3 -3,-0.1 3,-0.1 0.485 87.2 83.3 -86.4 -5.0 39.0 33.4 38.2 234 530 A S <> - 0 0 20 -3,-2.5 4,-2.9 1,-0.2 5,-0.2 -0.850 63.1-164.8-100.2 98.9 39.2 29.9 39.5 235 531 A P H > S+ 0 0 75 0, 0.0 4,-2.7 0, 0.0 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H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 5,-0.3 0.928 111.6 51.2 -65.4 -41.2 -0.6 43.8 37.4 366 662 A L H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.5 0.937 107.4 52.2 -59.9 -44.3 -0.7 42.1 40.9 367 663 A A H X>S+ 0 0 0 -4,-2.6 4,-1.1 1,-0.2 5,-0.7 0.894 113.3 47.3 -58.0 -38.3 -3.0 44.8 42.3 368 664 A H H <5S+ 0 0 24 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.941 115.3 40.2 -70.5 -50.0 -5.2 44.2 39.3 369 665 A I H <5S+ 0 0 38 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.861 123.1 39.6 -71.1 -35.5 -5.4 40.4 39.3 370 666 A A H <5S- 0 0 3 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.717 95.3-144.6 -83.5 -20.8 -5.7 40.1 43.1 371 667 A E T <5 - 0 0 90 -4,-1.1 2,-0.7 -5,-0.5 -3,-0.2 0.930 28.3-179.8 54.7 45.9 -8.0 43.1 43.3 372 668 A D >< - 0 0 2 -5,-0.7 4,-3.1 -6,-0.3 5,-0.3 -0.693 23.2-149.3 -79.4 116.1 -6.4 44.1 46.6 373 669 A D H > S+ 0 0 128 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 0.901 95.5 45.8 -51.8 -47.9 -8.1 47.3 47.8 374 670 A N H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.934 115.7 45.5 -63.5 -48.3 -5.0 48.5 49.6 375 671 A L H > S+ 0 0 0 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.903 114.4 48.1 -62.6 -43.8 -2.6 47.7 46.8 376 672 A M H X S+ 0 0 10 -4,-3.1 4,-2.2 -9,-0.2 -1,-0.2 0.898 111.5 50.6 -65.0 -40.5 -5.0 49.3 44.1 377 673 A E H X S+ 0 0 77 -4,-2.3 4,-1.4 -5,-0.3 -1,-0.2 0.893 106.8 55.9 -64.6 -38.5 -5.4 52.4 46.2 378 674 A A H <>S+ 0 0 2 -4,-2.2 5,-2.5 1,-0.2 -1,-0.2 0.905 112.1 40.8 -61.6 -41.5 -1.7 52.7 46.6 379 675 A F H ><5S+ 0 0 4 -4,-1.7 3,-1.1 3,-0.2 -1,-0.2 0.839 108.7 59.8 -76.7 -30.5 -1.2 52.7 42.8 380 676 A R H 3<5S+ 0 0 130 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.790 110.0 44.5 -63.9 -26.1 -4.2 55.0 42.3 381 677 A R T 3<5S- 0 0 155 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.387 110.2-128.5 -94.3 -1.9 -2.3 57.5 44.5 382 678 A D T < 5 + 0 0 78 -3,-1.1 -3,-0.2 -5,-0.1 -2,-0.1 0.891 46.8 177.1 49.8 44.5 0.9 56.8 42.6 383 679 A L < - 0 0 55 -5,-2.5 2,-0.9 -6,-0.2 -1,-0.1 -0.258 45.7 -95.5 -73.8 159.5 2.6 56.2 45.9 384 680 A D > - 0 0 73 1,-0.2 4,-2.7 2,-0.1 5,-0.2 -0.713 42.8-154.1 -73.6 112.0 6.2 55.1 46.4 385 681 A I H > S+ 0 0 5 -2,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.815 87.4 50.6 -65.2 -31.2 5.2 51.4 46.7 386 682 A H H > S+ 0 0 15 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.868 112.7 45.4 -74.7 -35.5 8.2 50.4 48.8 387 683 A T H > S+ 0 0 22 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.917 114.3 50.4 -71.0 -42.1 7.7 53.3 51.3 388 684 A K H X S+ 0 0 25 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.899 110.6 48.2 -62.8 -39.6 4.0 52.4 51.4 389 685 A T H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 5,-0.4 0.919 112.0 50.1 -66.9 -41.7 4.8 48.7 52.0 390 686 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 5,-0.3 0.952 108.9 52.2 -60.0 -50.0 7.2 49.6 54.8 391 687 A M H <>S+ 0 0 46 -4,-3.0 5,-1.5 1,-0.2 4,-0.5 0.923 115.1 43.1 -51.4 -46.2 4.6 51.8 56.4 392 688 A D H <5S+ 0 0 31 -4,-2.2 3,-0.2 3,-0.2 -2,-0.2 0.935 118.6 37.9 -70.5 -49.0 2.2 48.9 56.3 393 689 A I H <5S+ 0 0 6 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.858 124.4 40.5 -76.0 -30.1 4.3 46.0 57.5 394 690 A F T <5S- 0 0 50 -4,-2.6 -1,-0.2 -5,-0.4 -2,-0.2 0.453 104.1-131.6 -95.1 1.4 6.2 48.0 60.0 395 691 A Q T 5 + 0 0 148 -4,-0.5 2,-0.3 -5,-0.3 -3,-0.2 0.933 61.2 120.7 49.3 60.5 3.1 49.9 61.2 396 692 A V < - 0 0 38 -5,-1.5 -1,-0.2 -6,-0.2 2,-0.1 -0.859 63.7 -96.1-140.9 171.9 4.6 53.4 61.1 397 693 A S > - 0 0 49 -2,-0.3 4,-0.6 1,-0.1 3,-0.4 -0.372 41.7-101.3 -86.3 171.2 3.8 56.7 59.3 398 694 A E T >4 S+ 0 0 128 1,-0.2 3,-1.1 2,-0.2 -1,-0.1 0.881 124.9 58.6 -59.7 -34.8 5.5 57.8 56.1 399 695 A D T 34 S+ 0 0 154 1,-0.3 -1,-0.2 -8,-0.0 -8,-0.0 0.850 105.8 46.6 -61.7 -38.3 7.5 60.0 58.4 400 696 A E T 34 S+ 0 0 110 -3,-0.4 2,-0.6 2,-0.1 -1,-0.3 0.412 80.3 109.1 -90.5 4.2 8.8 57.2 60.4 401 697 A V << - 0 0 23 -3,-1.1 -10,-0.1 -4,-0.6 -14,-0.0 -0.708 57.1-156.8 -83.0 123.5 9.9 54.8 57.7 402 698 A T > - 0 0 69 -2,-0.6 4,-2.3 1,-0.1 3,-0.3 -0.436 30.8-100.5 -90.6 166.8 13.7 54.8 57.7 403 699 A P H > S+ 0 0 115 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.895 123.8 52.1 -56.6 -37.7 16.0 53.9 54.8 404 700 A N H > S+ 0 0 86 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.861 108.6 51.1 -68.3 -32.5 16.6 50.4 56.3 405 701 A M H > S+ 0 0 31 -3,-0.3 4,-2.1 2,-0.2 5,-0.2 0.918 111.0 47.1 -68.2 -44.7 12.8 49.9 56.5 406 702 A R H X S+ 0 0 79 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.916 108.5 55.5 -63.7 -42.6 12.2 50.9 52.9 407 703 A R H X S+ 0 0 118 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.865 111.8 44.3 -57.5 -37.1 15.1 48.7 51.7 408 704 A Q H X S+ 0 0 28 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.843 111.5 49.9 -77.8 -35.2 13.5 45.7 53.4 409 705 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.832 110.9 53.1 -69.4 -32.5 9.9 46.4 52.2 410 706 A K H X S+ 0 0 101 -4,-2.4 4,-3.1 -5,-0.2 -2,-0.2 0.892 105.9 53.1 -66.8 -39.8 11.5 46.7 48.8 411 707 A A H X S+ 0 0 16 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.856 108.8 48.8 -63.4 -38.1 13.1 43.3 49.3 412 708 A V H X S+ 0 0 0 -4,-1.7 4,-4.1 2,-0.2 -1,-0.2 0.874 112.9 48.2 -70.7 -36.1 9.7 41.8 50.1 413 709 A N H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.921 111.5 48.9 -70.4 -43.3 8.2 43.4 47.0 414 710 A F H X S+ 0 0 112 -4,-3.1 4,-0.9 2,-0.2 -2,-0.2 0.951 122.0 36.7 -58.8 -45.9 11.1 42.2 44.8 415 711 A G H <>S+ 0 0 11 -4,-2.2 5,-1.7 -5,-0.2 -2,-0.2 0.949 107.1 65.7 -70.6 -48.8 10.5 38.7 46.3 416 712 A I H X5S+ 0 0 2 -4,-4.1 4,-0.5 1,-0.2 3,-0.5 0.879 97.3 58.5 -37.4 -57.1 6.8 39.0 46.5 417 713 A V H <5S+ 0 0 15 -4,-2.0 2,-3.2 1,-0.3 -1,-0.2 0.909 100.6 53.5 -36.2 -77.8 6.7 39.1 42.7 418 714 A Y T <5S- 0 0 97 -4,-0.9 3,-0.4 1,-0.2 -1,-0.3 -0.254 137.9 -72.6 -66.5 62.0 8.4 35.7 42.2 419 715 A G T 45S- 0 0 0 -2,-3.2 -1,-0.2 -3,-0.5 -3,-0.2 0.504 70.1 -97.8 63.6 7.9 6.0 33.7 44.4 420 716 A I << - 0 0 16 -5,-1.7 2,-0.7 -4,-0.5 -1,-0.2 0.946 45.1-161.3 45.4 74.1 7.5 35.2 47.6 421 717 A S > - 0 0 29 -3,-0.4 4,-1.7 -6,-0.2 -1,-0.2 -0.770 5.8-160.9 -85.0 115.1 9.9 32.5 48.7 422 718 A D H > S+ 0 0 35 -2,-0.7 4,-2.2 2,-0.2 -1,-0.1 0.726 90.3 54.9 -69.9 -22.5 10.7 33.0 52.4 423 719 A Y H > S+ 0 0 82 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.933 113.9 41.8 -73.5 -46.7 13.9 30.9 52.3 424 720 A G H > S+ 0 0 31 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.758 113.0 54.1 -69.9 -27.2 15.1 33.1 49.4 425 721 A L H >X S+ 0 0 2 -4,-1.7 4,-3.5 2,-0.2 3,-0.7 0.985 106.1 52.3 -66.4 -59.5 13.8 36.3 51.2 426 722 A A H 3<>S+ 0 0 8 -4,-2.2 5,-2.8 1,-0.3 -2,-0.2 0.787 111.5 46.9 -45.6 -37.9 15.8 35.4 54.4 427 723 A Q H 3<5S+ 0 0 69 -4,-1.4 -1,-0.3 3,-0.2 -2,-0.2 0.858 113.7 47.8 -76.9 -34.2 18.9 35.0 52.3 428 724 A N H <<5S+ 0 0 90 -4,-1.5 -2,-0.2 -3,-0.7 -1,-0.2 0.921 120.2 37.0 -70.1 -44.9 18.3 38.3 50.4 429 725 A L T <5S- 0 0 9 -4,-3.5 -1,-0.2 -5,-0.1 -2,-0.2 0.447 107.4-130.4 -85.1 0.3 17.6 40.1 53.6 430 726 A N T 5 + 0 0 101 -5,-0.4 2,-0.2 1,-0.2 -3,-0.2 0.934 67.3 122.2 47.4 51.3 20.3 38.1 55.3 431 727 A I < - 0 0 39 -5,-2.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.762 69.3 -77.6-130.2 174.7 17.9 37.3 58.2 432 728 A S >> - 0 0 56 -2,-0.2 4,-2.6 1,-0.1 3,-0.5 -0.377 35.9-119.3 -76.4 159.9 16.5 34.1 59.7 433 729 A R H 3> S+ 0 0 128 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.921 115.2 57.5 -61.9 -44.3 13.8 32.2 58.0 434 730 A K H 34 S+ 0 0 127 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.777 111.6 43.5 -58.9 -25.8 11.5 32.7 61.0 435 731 A E H <> S+ 0 0 98 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.852 112.3 50.6 -85.8 -40.7 11.9 36.4 60.5 436 732 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 3,-0.4 0.946 110.8 50.3 -60.8 -46.6 11.5 36.3 56.7 437 733 A A H X S+ 0 0 34 -4,-3.6 4,-2.0 1,-0.3 -1,-0.2 0.815 107.1 56.2 -61.5 -29.1 8.4 34.3 57.3 438 734 A E H > S+ 0 0 94 -4,-0.5 4,-1.6 -5,-0.3 -1,-0.3 0.855 104.3 51.6 -71.2 -35.6 7.3 37.0 59.7 439 735 A F H X S+ 0 0 35 -4,-1.8 4,-1.9 -3,-0.4 -2,-0.2 0.952 109.4 50.9 -63.4 -48.7 7.7 39.7 57.1 440 736 A I H X S+ 0 0 21 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.893 108.0 51.2 -55.8 -46.6 5.5 37.7 54.7 441 737 A E H X S+ 0 0 107 -4,-2.0 4,-1.1 1,-0.2 -1,-0.2 0.855 109.6 49.8 -63.0 -35.3 2.8 37.3 57.3 442 738 A R H X S+ 0 0 50 -4,-1.6 4,-1.7 -3,-0.2 -1,-0.2 0.851 108.9 54.7 -72.1 -31.1 2.7 41.0 58.0 443 739 A Y H X S+ 0 0 1 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.952 107.9 47.7 -64.5 -48.9 2.5 41.6 54.2 444 740 A F H < S+ 0 0 34 -4,-2.4 7,-0.3 1,-0.2 -1,-0.2 0.734 108.0 55.9 -65.6 -22.8 -0.6 39.4 53.9 445 741 A E H < S+ 0 0 100 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.898 115.0 38.6 -74.2 -40.1 -2.2 41.1 56.8 446 742 A S H < S+ 0 0 20 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.771 127.0 36.9 -78.0 -29.2 -1.8 44.5 55.0 447 743 A F X + 0 0 0 -4,-2.5 4,-1.6 -5,-0.1 3,-0.5 -0.578 67.2 160.0-125.7 66.9 -2.6 43.0 51.6 448 744 A P H > S+ 0 0 76 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.783 74.9 57.7 -56.1 -37.8 -5.4 40.4 52.3 449 745 A G H > S+ 0 0 8 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.883 106.1 49.1 -63.7 -41.5 -6.5 40.4 48.6 450 746 A V H > S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.861 110.4 52.0 -65.7 -36.2 -3.0 39.4 47.5 451 747 A K H X S+ 0 0 95 -4,-1.6 4,-1.9 -7,-0.3 -2,-0.2 0.937 110.3 47.7 -65.3 -45.5 -3.0 36.7 50.1 452 748 A R H X S+ 0 0 124 -4,-2.5 4,-3.3 1,-0.2 5,-0.2 0.906 110.4 52.0 -61.7 -43.0 -6.3 35.4 48.8 453 749 A Y H X S+ 0 0 22 -4,-2.3 4,-3.0 1,-0.2 5,-0.3 0.926 107.6 51.5 -60.6 -44.9 -5.1 35.5 45.2 454 750 A M H X S+ 0 0 8 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.915 115.1 43.2 -59.8 -40.6 -2.0 33.5 46.1 455 751 A E H X S+ 0 0 103 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.957 116.3 46.6 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