==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 02-JAN-03 1NJX . COMPND 2 MOLECULE: DNA PRIMER STRAND; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.JOHNSON,L.S.BEESE . 580 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27546.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 413 71.2 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 . 1 0.2 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 . 29 5.0 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 . 241 41.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 3.6 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 2 1 2 2 4 3 1 0 0 1 2 0 1 2 0 0 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 0 140 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 5.9 9.1 5.2 1.8 2 298 A K - 0 0 78 1,-0.1 2,-0.5 0, 0.0 147,-0.0 -0.009 360.0-109.5 -56.9 164.8 10.5 8.4 0.4 3 299 A M - 0 0 30 146,-0.0 2,-0.1 1,-0.0 -1,-0.1 -0.872 29.0-121.9-104.4 131.7 8.2 11.4 -0.3 4 300 A A + 0 0 73 -2,-0.5 2,-0.3 148,-0.0 43,-0.0 -0.440 45.7 143.1 -72.9 140.3 7.4 12.4 -3.8 5 301 A F - 0 0 59 -2,-0.1 2,-0.6 41,-0.1 43,-0.2 -0.973 48.5-102.7-167.2 164.4 8.3 15.9 -5.0 6 302 A T E -a 48 0A 76 41,-2.6 43,-2.6 -2,-0.3 2,-1.6 -0.877 18.1-150.6-101.7 121.4 9.5 17.9 -8.0 7 303 A L E -a 49 0A 68 -2,-0.6 43,-0.1 41,-0.2 2,-0.1 -0.717 32.7-152.4 -89.0 85.3 13.2 19.0 -8.0 8 304 A A E -a 50 0A 7 -2,-1.6 43,-0.5 41,-1.4 3,-0.1 -0.330 28.7-168.1 -67.9 139.5 12.5 22.0 -10.1 9 305 A D S S+ 0 0 105 1,-0.2 2,-0.3 41,-0.1 -1,-0.1 0.543 81.4 16.5 -97.5 -14.3 15.0 23.6 -12.4 10 306 A R S S- 0 0 178 44,-0.0 2,-0.3 48,-0.0 -1,-0.2 -0.985 88.3 -92.9-155.3 158.7 12.8 26.7 -12.8 11 307 A V - 0 0 22 -2,-0.3 2,-0.3 43,-0.1 49,-0.1 -0.579 40.5-167.5 -79.0 133.6 9.8 28.4 -11.2 12 308 A T > - 0 0 49 -2,-0.3 3,-1.4 1,-0.1 4,-0.3 -0.796 33.3-108.1-119.2 162.7 6.3 27.5 -12.6 13 309 A E G > S+ 0 0 153 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.857 114.7 58.4 -56.1 -42.7 2.9 29.0 -12.1 14 310 A E G > S+ 0 0 90 1,-0.3 3,-0.6 2,-0.1 31,-0.3 0.656 96.3 64.9 -65.9 -13.6 1.5 26.2 -10.0 15 311 A M G < S+ 0 0 3 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.577 95.8 61.2 -82.3 -9.2 4.3 26.9 -7.5 16 312 A L G < S+ 0 0 18 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.1 -0.116 71.7 149.3-110.6 36.6 2.7 30.3 -6.9 17 313 A A < - 0 0 11 -3,-0.6 -3,-0.0 2,-0.1 3,-0.0 -0.164 60.9-107.2 -63.7 163.1 -0.7 29.3 -5.5 18 314 A D S S+ 0 0 102 1,-0.1 53,-2.4 52,-0.1 2,-0.3 0.414 104.6 38.9 -76.3 1.3 -2.5 31.6 -3.0 19 315 A K E S+b 71 0A 71 51,-0.2 25,-0.5 2,-0.1 2,-0.3 -0.934 72.3 142.1-151.0 129.3 -1.9 29.2 -0.1 20 316 A A E -b 72 0A 0 51,-1.7 53,-2.4 -2,-0.3 2,-0.5 -0.993 49.8-113.3-163.1 156.8 1.2 27.1 0.5 21 317 A A E -bC 73 42A 0 21,-3.0 21,-2.3 -2,-0.3 2,-0.4 -0.854 44.0-162.6 -92.1 128.7 3.6 25.7 3.2 22 318 A L E - C 0 41A 1 51,-2.7 2,-0.5 -2,-0.5 53,-0.3 -0.965 17.5-171.1-123.4 136.2 6.9 27.4 2.5 23 319 A V E + C 0 40A 9 17,-2.5 17,-2.3 -2,-0.4 2,-0.5 -0.992 6.7 177.0-125.2 120.8 10.4 26.6 3.7 24 320 A V E - C 0 39A 11 -2,-0.5 2,-0.4 15,-0.2 15,-0.2 -0.906 31.2-143.4-123.0 93.3 13.3 29.0 3.1 25 321 A E E + C 0 38A 17 13,-2.2 12,-2.4 -2,-0.5 13,-0.6 -0.502 28.9 172.4 -75.9 119.0 16.1 27.2 4.8 26 322 A V - 0 0 7 -2,-0.4 10,-0.1 10,-0.2 5,-0.1 -0.965 4.2-179.4-122.5 107.3 18.8 29.0 6.8 27 323 A V + 0 0 11 -2,-0.5 -1,-0.1 8,-0.3 9,-0.1 0.819 53.2 94.6 -79.0 -35.3 21.0 26.5 8.6 28 324 A E S S- 0 0 112 7,-0.3 6,-0.1 1,-0.1 -2,-0.0 -0.380 76.4-134.6 -58.6 133.9 23.4 29.0 10.3 29 325 A E S S+ 0 0 150 1,-0.2 2,-0.9 2,-0.1 -1,-0.1 0.926 100.3 56.2 -57.7 -45.8 22.1 29.6 13.8 30 326 A N S S- 0 0 23 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.800 75.0-170.4 -88.6 108.1 22.7 33.3 13.4 31 327 A Y > + 0 0 2 -2,-0.9 3,-1.8 3,-0.1 2,-0.4 0.474 40.3 124.6 -81.2 -1.6 20.6 34.1 10.3 32 328 A H T 3 S- 0 0 6 1,-0.3 51,-0.1 275,-0.2 -2,-0.1 -0.454 95.9 -15.8 -66.2 119.4 21.8 37.6 9.7 33 329 A D T 3 S+ 0 0 96 -2,-0.4 -1,-0.3 49,-0.3 50,-0.1 0.786 107.2 149.8 56.4 31.3 23.3 38.0 6.2 34 330 A A < - 0 0 9 -3,-1.8 -1,-0.2 1,-0.1 -3,-0.1 -0.537 50.8 -91.8 -94.8 158.8 23.3 34.2 6.2 35 331 A P - 0 0 78 0, 0.0 2,-0.7 0, 0.0 -8,-0.3 -0.325 22.8-140.8 -68.8 146.6 23.0 31.8 3.2 36 332 A I - 0 0 13 -10,-0.1 -10,-0.2 1,-0.1 17,-0.1 -0.961 19.0-171.1-105.5 114.9 19.6 30.4 2.2 37 333 A V - 0 0 34 -12,-2.4 2,-0.3 -2,-0.7 -11,-0.1 0.630 56.9 -15.5 -86.4 -15.2 20.5 26.8 1.3 38 334 A G E -C 25 0A 0 -13,-0.6 -13,-2.2 13,-0.1 2,-0.4 -0.953 52.6-135.0-179.4 161.1 17.2 25.7 -0.3 39 335 A I E -CD 24 50A 1 11,-2.0 11,-3.0 -2,-0.3 2,-0.4 -0.985 14.3-171.8-132.6 139.8 13.5 26.3 -0.8 40 336 A A E -CD 23 49A 0 -17,-2.3 -17,-2.5 -2,-0.4 2,-0.4 -0.993 0.9-170.6-133.0 141.0 10.5 24.0 -0.6 41 337 A V E -CD 22 48A 0 7,-2.5 7,-3.2 -2,-0.4 2,-0.4 -0.999 2.6-176.3-132.5 131.2 6.9 24.7 -1.5 42 338 A V E +CD 21 47A 5 -21,-2.3 -21,-3.0 -2,-0.4 2,-0.2 -0.992 23.0 138.1-129.2 123.3 4.0 22.5 -0.7 43 339 A N E > - D 0 46A 6 3,-2.5 3,-1.4 -2,-0.4 -23,-0.1 -0.784 68.2 -68.2-145.8-169.5 0.5 23.4 -2.0 44 340 A E T 3 S+ 0 0 144 -25,-0.5 3,-0.1 1,-0.3 -24,-0.1 0.729 127.6 54.6 -61.2 -22.8 -2.6 21.9 -3.6 45 341 A H T 3 S- 0 0 92 -31,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.586 119.7 -87.4 -88.5 -11.8 -0.7 21.3 -6.8 46 342 A G E < - D 0 43A 27 -3,-1.4 -3,-2.5 -32,-0.1 2,-0.4 -0.956 50.6 -50.7 143.8-162.4 2.1 19.3 -5.2 47 343 A R E - D 0 42A 91 -2,-0.3 -41,-2.6 -5,-0.2 2,-0.3 -0.967 48.4-177.3-120.5 133.1 5.5 19.4 -3.5 48 344 A F E -aD 6 41A 4 -7,-3.2 -7,-2.5 -2,-0.4 2,-0.4 -0.962 18.5-157.3-135.2 149.8 8.4 21.3 -5.0 49 345 A F E -aD 7 40A 2 -43,-2.6 -41,-1.4 -2,-0.3 2,-0.4 -0.985 17.3-170.9-121.8 133.0 12.1 22.0 -4.2 50 346 A L E -aD 8 39A 0 -11,-3.0 -11,-2.0 -2,-0.4 -41,-0.1 -0.975 24.4-124.0-128.3 139.7 13.8 25.0 -5.6 51 347 A R >> - 0 0 53 -43,-0.5 4,-2.4 -2,-0.4 3,-0.8 -0.636 24.5-132.2 -77.9 134.9 17.5 26.0 -5.6 52 348 A P H 3> S+ 0 0 11 0, 0.0 4,-2.4 0, 0.0 5,-0.3 0.883 101.5 62.4 -54.6 -44.6 17.9 29.5 -4.0 53 349 A E H 34 S+ 0 0 133 1,-0.2 4,-0.1 2,-0.2 -15,-0.0 0.828 115.0 32.7 -53.0 -35.6 20.1 30.9 -6.8 54 350 A T H X> S+ 0 0 48 -3,-0.8 3,-1.0 2,-0.1 4,-0.9 0.918 119.7 46.8 -89.5 -50.3 17.3 30.4 -9.3 55 351 A A H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.3 7,-0.3 0.930 113.0 49.7 -58.3 -48.1 14.1 31.0 -7.2 56 352 A L T 3< S+ 0 0 28 -4,-2.4 -1,-0.3 -5,-0.3 -3,-0.1 0.583 111.7 49.6 -70.2 -8.3 15.4 34.2 -5.6 57 353 A A T <4 S+ 0 0 73 -3,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.538 88.8 100.6-102.4 -12.4 16.4 35.5 -9.0 58 354 A D S+ 0 0 87 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.850 95.8 50.7 -53.6 -40.7 10.8 37.9 -10.7 60 356 A Q H > S+ 0 0 115 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.907 111.2 46.8 -67.7 -42.5 7.6 35.9 -10.4 61 357 A F H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.921 113.1 49.2 -65.9 -43.8 8.8 34.0 -7.3 62 358 A V H X S+ 0 0 46 -4,-2.6 4,-1.9 -7,-0.3 -2,-0.2 0.921 111.2 49.5 -61.4 -43.4 10.0 37.2 -5.6 63 359 A A H X S+ 0 0 64 -4,-2.3 4,-0.6 -5,-0.2 -1,-0.2 0.898 109.8 52.2 -62.1 -39.9 6.7 38.9 -6.4 64 360 A W H >< S+ 0 0 7 -4,-2.2 3,-0.9 1,-0.2 -1,-0.2 0.905 107.2 52.8 -62.2 -42.9 4.9 35.9 -4.9 65 361 A L H 3< S+ 0 0 0 -4,-2.4 27,-3.0 1,-0.2 -1,-0.2 0.894 113.4 43.1 -59.6 -41.8 7.0 36.1 -1.7 66 362 A G H 3< S+ 0 0 24 -4,-1.9 2,-0.8 25,-0.2 -1,-0.2 0.449 87.6 105.6 -87.1 0.5 6.1 39.8 -1.3 67 363 A D X< - 0 0 53 -3,-0.9 3,-1.9 -4,-0.6 25,-0.1 -0.732 55.6-160.0 -86.6 109.8 2.4 39.5 -2.1 68 364 A E T 3 S+ 0 0 112 -2,-0.8 -1,-0.2 1,-0.3 -4,-0.0 0.723 89.8 61.2 -60.1 -23.3 0.4 39.7 1.1 69 365 A T T 3 S+ 0 0 79 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.582 86.8 80.6 -82.2 -9.8 -2.6 38.0 -0.6 70 366 A K S < S- 0 0 50 -3,-1.9 2,-0.3 -6,-0.2 -51,-0.2 -0.872 82.1-146.1 -97.6 105.2 -0.5 34.9 -1.2 71 367 A K E -b 19 0A 65 -53,-2.4 -51,-1.7 -2,-0.9 2,-0.4 -0.546 16.0-169.0 -80.8 135.0 -0.7 33.1 2.2 72 368 A K E -be 20 94A 0 21,-2.6 23,-1.7 -2,-0.3 24,-1.2 -0.952 13.3-153.8-124.5 142.6 2.2 31.1 3.5 73 369 A S E +be 21 96A 0 -53,-2.4 -51,-2.7 -2,-0.4 2,-0.2 -0.960 33.1 156.4-112.1 129.6 2.5 28.7 6.4 74 370 A M E - e 0 97A 3 22,-2.8 24,-3.4 -2,-0.5 2,-0.4 -0.778 43.3-116.6-141.5-177.1 6.0 28.3 7.8 75 371 A F S S- 0 0 33 -53,-0.3 39,-0.1 22,-0.2 22,-0.1 -0.986 98.4 -2.2-130.8 117.7 8.1 27.5 10.9 76 372 A D S > S+ 0 0 33 -2,-0.4 4,-1.1 3,-0.1 3,-0.5 0.986 72.1 179.1 63.6 62.1 10.2 30.3 12.3 77 373 A S H > S+ 0 0 12 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.769 73.3 66.3 -65.4 -26.1 9.1 32.9 9.7 78 374 A K H > S+ 0 0 10 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.918 98.1 53.7 -61.5 -42.5 11.3 35.6 11.3 79 375 A R H > S+ 0 0 53 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.932 113.9 41.2 -56.3 -48.3 14.4 33.6 10.4 80 376 A A H X S+ 0 0 2 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.914 114.0 52.7 -67.3 -44.4 13.4 33.5 6.7 81 377 A A H X S+ 0 0 17 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.915 112.6 44.0 -59.6 -45.2 12.1 37.1 6.7 82 378 A V H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -49,-0.3 0.932 112.1 51.1 -67.8 -45.5 15.4 38.5 8.1 83 379 A A H < S+ 0 0 1 -4,-2.2 4,-0.4 -5,-0.3 -1,-0.2 0.894 114.0 46.5 -58.9 -38.0 17.6 36.3 5.9 84 380 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 3,-1.2 0.864 105.4 59.1 -71.7 -36.2 15.6 37.6 2.9 85 381 A K H ><5S+ 0 0 59 -4,-2.2 3,-1.8 1,-0.3 -2,-0.2 0.896 101.1 55.9 -58.6 -39.7 15.7 41.2 4.1 86 382 A W T 3<5S+ 0 0 55 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.713 108.3 48.9 -66.1 -18.1 19.5 41.0 3.9 87 383 A K T < 5S- 0 0 105 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.289 121.5-108.4-101.9 7.5 19.0 40.0 0.3 88 384 A G T < 5S+ 0 0 74 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.743 78.1 130.3 72.8 24.2 16.7 42.9 -0.4 89 385 A I < - 0 0 19 -5,-2.8 2,-0.4 -8,-0.1 -1,-0.2 -0.941 49.4-141.5-116.6 130.6 13.6 40.6 -0.6 90 386 A E - 0 0 131 -2,-0.5 2,-0.6 -3,-0.1 -23,-0.1 -0.725 7.3-156.4 -92.4 134.7 10.4 41.2 1.2 91 387 A L + 0 0 25 -2,-0.4 2,-0.3 -10,-0.1 -25,-0.2 -0.950 24.9 162.3-111.2 119.1 8.4 38.3 2.7 92 388 A C + 0 0 26 -27,-3.0 -25,-0.2 -2,-0.6 3,-0.1 -0.814 42.7 47.2-129.7 169.8 4.7 38.9 3.2 93 389 A G + 0 0 11 -2,-0.3 -21,-2.6 1,-0.2 2,-1.0 0.683 55.5 159.3 75.1 19.1 1.5 37.0 3.8 94 390 A V E +e 72 0A 39 -23,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.661 6.3 169.1 -76.9 106.4 2.7 34.6 6.5 95 391 A S E + 0 0 43 -23,-1.7 2,-0.3 -2,-1.0 -22,-0.2 0.594 61.7 31.5 -95.4 -12.9 -0.6 33.5 8.0 96 392 A F E -e 73 0A 1 -24,-1.2 -22,-2.8 87,-0.1 2,-0.6 -0.960 55.7-170.6-150.4 127.0 0.6 30.7 10.2 97 393 A D E > -e 74 0A 2 -2,-0.3 4,-2.2 -24,-0.2 -22,-0.2 -0.948 8.3-162.5-119.5 108.5 3.9 30.1 12.0 98 394 A L H > S+ 0 0 0 -24,-3.4 4,-2.4 -2,-0.6 5,-0.2 0.797 88.9 58.1 -60.3 -31.6 4.2 26.6 13.4 99 395 A L H > S+ 0 0 20 -25,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.954 111.1 41.0 -64.2 -48.7 7.0 27.6 15.8 100 396 A L H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.854 113.7 54.2 -68.4 -34.1 4.9 30.2 17.5 101 397 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.947 111.4 43.9 -64.4 -47.6 1.8 28.0 17.4 102 398 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.905 111.5 55.5 -62.8 -42.1 3.7 25.2 19.2 103 399 A Y H < S+ 0 0 12 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.911 109.7 45.2 -57.2 -45.7 5.2 27.7 21.6 104 400 A L H < S+ 0 0 1 -4,-2.3 370,-0.4 1,-0.2 -1,-0.2 0.884 110.0 54.8 -68.5 -37.3 1.8 29.0 22.7 105 401 A L H < S- 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.883 137.2 -12.0 -64.2 -38.4 0.3 25.5 23.0 106 402 A D >< - 0 0 37 -4,-2.2 3,-1.6 -5,-0.1 5,-0.3 -0.531 56.6-174.1-166.6 93.3 3.1 24.5 25.4 107 403 A P G > S+ 0 0 13 0, 0.0 3,-0.8 0, 0.0 -3,-0.1 0.660 83.8 69.3 -63.8 -15.9 6.2 26.6 25.9 108 404 A A G 3 S+ 0 0 54 1,-0.2 -5,-0.1 2,-0.1 208,-0.1 0.667 81.2 73.7 -77.8 -16.4 7.7 23.9 28.2 109 405 A Q G < S- 0 0 113 -3,-1.6 -1,-0.2 -7,-0.2 3,-0.2 0.685 91.4-141.8 -71.7 -16.4 8.2 21.4 25.3 110 406 A G < - 0 0 44 -3,-0.8 2,-0.2 -4,-0.2 -2,-0.1 0.827 23.0-167.8 59.4 33.8 11.1 23.5 24.0 111 407 A V + 0 0 12 -5,-0.3 -1,-0.2 1,-0.2 3,-0.1 -0.367 21.9 159.8 -57.6 116.7 10.1 23.0 20.4 112 408 A D + 0 0 121 -2,-0.2 2,-0.3 -3,-0.2 -1,-0.2 0.288 58.0 30.6-124.1 6.4 13.0 24.1 18.2 113 409 A D S > S- 0 0 10 1,-0.1 4,-1.7 -14,-0.1 3,-0.3 -0.980 84.4-100.9-156.4 164.3 12.4 22.4 14.9 114 410 A V H > S+ 0 0 2 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.903 118.1 57.8 -55.3 -42.8 9.5 21.1 12.7 115 411 A A H > S+ 0 0 14 12,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.897 105.9 49.4 -56.0 -42.3 10.1 17.5 13.9 116 412 A A H > S+ 0 0 32 -3,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.885 113.2 45.5 -66.0 -39.2 9.6 18.5 17.5 117 413 A A H >< S+ 0 0 0 -4,-1.7 3,-1.3 1,-0.2 4,-0.4 0.926 112.0 52.9 -68.5 -43.4 6.3 20.4 16.8 118 414 A A H ><>S+ 0 0 0 -4,-3.1 5,-2.2 1,-0.3 3,-1.6 0.840 99.3 62.1 -60.8 -35.8 5.1 17.6 14.6 119 415 A K H ><5S+ 0 0 130 -4,-1.9 3,-1.4 1,-0.3 -1,-0.3 0.739 89.6 70.9 -65.0 -20.3 5.6 15.0 17.3 120 416 A M T <<5S+ 0 0 53 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.765 106.8 37.3 -65.6 -24.8 3.1 16.9 19.4 121 417 A K T < 5S- 0 0 70 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 -0.039 122.6-101.6-117.0 28.9 0.4 15.6 17.0 122 418 A Q T < 5S+ 0 0 157 -3,-1.4 2,-0.6 1,-0.2 -3,-0.2 0.817 77.5 139.2 55.7 35.4 1.9 12.1 16.5 123 419 A Y < + 0 0 45 -5,-2.2 -1,-0.2 -8,-0.1 -2,-0.2 -0.953 13.6 157.4-109.5 119.2 3.3 13.1 13.1 124 420 A E + 0 0 127 -2,-0.6 2,-0.7 -3,-0.1 -1,-0.1 0.171 34.3 111.7-131.0 20.8 6.8 11.7 12.6 125 421 A A S S+ 0 0 45 28,-0.1 2,-0.3 -7,-0.1 32,-0.1 -0.195 71.6 70.0 -88.7 43.7 7.3 11.6 8.8 126 422 A V S S- 0 0 12 -2,-0.7 24,-0.1 -11,-0.1 -3,-0.0 -0.962 79.7-123.6-157.7 140.3 10.0 14.3 9.1 127 423 A R - 0 0 112 -2,-0.3 -12,-0.4 23,-0.1 -13,-0.1 -0.566 29.9-103.7 -90.4 152.4 13.5 14.2 10.6 128 424 A P >> - 0 0 62 0, 0.0 4,-1.2 0, 0.0 3,-0.6 -0.447 32.1-120.9 -68.5 147.9 14.9 16.5 13.3 129 425 A D H >> S+ 0 0 33 1,-0.2 4,-3.1 2,-0.2 3,-0.6 0.900 112.2 57.3 -57.7 -40.9 17.2 19.2 11.9 130 426 A E H 3> S+ 0 0 110 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.841 102.0 55.6 -60.0 -33.6 20.1 18.0 14.0 131 427 A A H <4 S+ 0 0 59 -3,-0.6 -1,-0.3 2,-0.2 -2,-0.2 0.840 115.8 38.2 -67.7 -32.1 19.8 14.5 12.5 132 428 A V H << S+ 0 0 15 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.899 129.7 26.9 -85.0 -45.4 20.1 16.0 9.0 133 429 A Y H < S- 0 0 6 -4,-3.1 7,-2.0 1,-0.2 -3,-0.2 0.653 97.3-142.2 -94.0 -18.2 22.7 18.7 9.6 134 430 A G < - 0 0 24 -4,-2.0 2,-0.3 -5,-0.5 -1,-0.2 -0.302 24.3 -81.8 82.1-174.0 24.6 17.3 12.5 135 431 A K S > S- 0 0 120 4,-0.1 3,-1.8 -4,-0.1 4,-0.2 -0.918 71.6 -19.2-133.2 159.1 25.9 19.4 15.4 136 432 A G G > S- 0 0 63 -2,-0.3 3,-1.9 1,-0.3 0, 0.0 -0.152 127.1 -4.2 52.2-136.2 28.9 21.6 16.3 137 433 A A G 3 S+ 0 0 111 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.695 135.5 59.1 -61.2 -20.1 32.0 21.1 14.2 138 434 A K G < S+ 0 0 178 -3,-1.8 -1,-0.3 2,-0.0 -2,-0.2 0.535 78.7 120.8 -86.8 -7.6 30.3 18.2 12.4 139 435 A R < + 0 0 85 -3,-1.9 2,-0.3 -4,-0.2 -5,-0.2 -0.283 34.3 143.9 -59.3 138.5 27.5 20.5 11.2 140 436 A A - 0 0 61 -7,-2.0 -2,-0.0 -6,-0.1 -3,-0.0 -0.933 53.1-101.7-174.2 150.2 27.1 20.7 7.5 141 437 A V - 0 0 68 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.687 45.1-132.6 -80.8 124.3 24.6 21.0 4.6 142 438 A P - 0 0 29 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.159 35.9 -70.0 -72.5 169.6 24.1 17.5 3.0 143 439 A D >> - 0 0 130 1,-0.1 4,-2.6 3,-0.1 3,-0.7 -0.159 56.5 -98.9 -55.6 155.2 24.1 16.7 -0.7 144 440 A E H 3> S+ 0 0 69 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.835 120.0 56.1 -46.9 -47.1 21.1 18.1 -2.7 145 441 A P H 3> S+ 0 0 94 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.910 114.7 39.3 -55.6 -43.1 19.1 14.8 -2.7 146 442 A V H <> S+ 0 0 64 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.902 117.9 48.5 -72.9 -43.3 19.2 14.6 1.1 147 443 A L H X S+ 0 0 9 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.932 111.3 50.2 -61.8 -48.5 18.7 18.3 1.6 148 444 A A H X S+ 0 0 0 -4,-3.5 4,-2.2 1,-0.2 5,-0.2 0.893 109.4 49.4 -59.8 -44.8 15.7 18.5 -0.8 149 445 A E H X S+ 0 0 59 -4,-1.6 4,-2.5 -5,-0.3 -1,-0.2 0.907 111.5 50.7 -63.5 -39.0 13.8 15.6 0.7 150 446 A H H X S+ 0 0 4 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.939 111.1 46.3 -64.2 -47.3 14.3 17.1 4.2 151 447 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.879 113.6 49.5 -64.3 -36.8 13.0 20.5 3.2 152 448 A V H X S+ 0 0 1 -4,-2.2 4,-2.8 -5,-0.2 -1,-0.2 0.906 110.0 50.8 -68.7 -40.2 10.0 19.0 1.4 153 449 A R H X S+ 0 0 36 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.867 110.3 49.6 -65.7 -34.1 9.2 16.8 4.4 154 450 A K H X S+ 0 0 11 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.921 112.4 47.4 -70.0 -39.2 9.3 19.9 6.7 155 451 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.917 111.8 50.8 -64.9 -42.5 7.0 21.7 4.3 156 452 A A H X S+ 0 0 8 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.894 109.5 50.6 -62.4 -40.9 4.7 18.7 4.1 157 453 A A H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.935 111.0 48.0 -63.0 -46.1 4.5 18.5 7.9 158 454 A I H X S+ 0 0 2 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.918 110.2 53.2 -59.8 -43.0 3.7 22.2 8.1 159 455 A W H < S+ 0 0 89 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.886 116.0 38.8 -59.2 -41.1 1.0 21.8 5.4 160 456 A E H < S+ 0 0 119 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.850 115.5 50.9 -78.9 -37.4 -0.6 18.9 7.4 161 457 A L H X S+ 0 0 3 -4,-2.9 4,-2.2 -5,-0.2 5,-0.3 0.611 84.8 85.0 -80.3 -15.7 -0.2 20.3 10.9 162 458 A E H X S+ 0 0 22 -4,-1.4 4,-2.7 1,-0.2 5,-0.2 0.943 92.4 46.2 -52.5 -53.9 -1.7 23.8 10.4 163 459 A R H > S+ 0 0 136 -4,-0.4 4,-2.8 -3,-0.3 5,-0.2 0.942 113.0 46.3 -58.0 -54.3 -5.3 22.7 11.0 164 460 A P H > S+ 0 0 37 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.872 115.2 48.3 -60.0 -34.3 -4.8 20.6 14.1 165 461 A F H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.937 112.8 46.8 -70.5 -44.1 -2.6 23.3 15.7 166 462 A L H X S+ 0 0 33 -4,-2.7 4,-2.4 -5,-0.3 -1,-0.2 0.891 110.4 55.0 -63.7 -37.7 -5.1 26.0 14.9 167 463 A D H X S+ 0 0 84 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.912 110.7 43.6 -62.3 -42.4 -7.9 23.8 16.2 168 464 A E H X S+ 0 0 32 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.897 111.4 53.6 -71.3 -39.2 -6.2 23.3 19.6 169 465 A L H <>S+ 0 0 0 -4,-2.4 5,-3.5 1,-0.2 6,-0.6 0.928 110.0 49.1 -58.7 -42.8 -5.3 27.0 19.9 170 466 A R H ><5S+ 0 0 152 -4,-2.4 3,-1.5 4,-0.2 -1,-0.2 0.912 108.4 52.3 -61.9 -43.3 -8.9 27.9 19.3 171 467 A R H 3<5S+ 0 0 188 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.858 111.6 47.5 -60.7 -35.0 -10.0 25.4 21.9 172 468 A N T 3<5S- 0 0 12 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.427 115.6-117.9 -84.3 -1.4 -7.5 27.1 24.3 173 469 A E T < 5S+ 0 0 118 -3,-1.5 -3,-0.2 -4,-0.3 4,-0.1 0.879 85.3 117.0 62.6 38.5 -8.9 30.5 23.3 174 470 A Q >< + 0 0 0 -5,-3.5 4,-1.8 -6,-0.2 -4,-0.2 0.242 33.2 101.3-117.1 7.7 -5.4 31.3 22.0 175 471 A D H > S+ 0 0 33 -6,-0.6 4,-2.4 1,-0.2 5,-0.2 0.920 87.7 43.1 -62.0 -42.6 -6.2 31.8 18.3 176 472 A R H >>S+ 0 0 129 1,-0.2 4,-3.0 2,-0.2 5,-0.8 0.848 106.7 62.4 -70.9 -33.5 -6.1 35.6 18.6 177 473 A L H >>S+ 0 0 8 3,-0.2 5,-2.6 2,-0.2 4,-0.7 0.915 112.2 38.0 -57.1 -41.4 -3.0 35.4 20.7 178 474 A L H <>S+ 0 0 0 -4,-1.8 5,-2.8 3,-0.2 -2,-0.2 0.977 125.7 34.4 -72.5 -57.1 -1.2 33.8 17.7 179 475 A V H <5S+ 0 0 74 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.798 128.1 33.3 -71.8 -32.7 -2.8 35.7 14.9 180 476 A E H <5S+ 0 0 125 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.631 132.9 16.9-101.6 -15.5 -3.2 39.2 16.5 181 477 A L T X S+ 0 0 42 0, 0.0 4,-1.4 0, 0.0 3,-0.2 0.905 112.8 53.1 -66.7 -34.9 2.5 40.4 14.0 185 481 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.875 99.9 62.6 -64.5 -36.3 5.1 40.9 16.6 186 482 A S H X S+ 0 0 2 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.903 103.4 48.4 -55.5 -42.5 7.4 38.5 14.8 187 483 A S H X S+ 0 0 72 -4,-1.3 4,-1.7 -3,-0.2 -1,-0.2 0.863 111.1 50.4 -66.3 -35.9 7.4 40.8 11.8 188 484 A I H X S+ 0 0 14 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.904 109.8 50.0 -69.2 -40.1 8.2 43.8 14.0 189 485 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.890 106.6 56.5 -65.1 -37.5 11.1 41.9 15.7 190 486 A A H X S+ 0 0 2 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.925 108.3 47.1 -59.1 -44.6 12.4 41.0 12.2 191 487 A E H X S+ 0 0 94 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.924 112.4 49.4 -62.9 -44.5 12.6 44.7 11.4 192 488 A M H X S+ 0 0 4 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.927 113.0 46.0 -60.5 -48.1 14.3 45.6 14.7 193 489 A E H < S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.920 114.3 47.8 -61.2 -47.5 16.9 42.9 14.3 194 490 A F H < S+ 0 0 74 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.887 110.1 52.4 -62.9 -40.5 17.6 43.8 10.7 195 491 A A H < S- 0 0 23 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.945 94.0-175.4 -60.8 -47.5 17.9 47.5 11.6 196 492 A G < - 0 0 4 -4,-2.3 2,-0.4 -5,-0.2 111,-0.2 -0.033 27.8 -82.6 75.1 176.3 20.4 46.7 14.3 197 493 A V E -F 306 0B 8 109,-2.3 109,-2.3 -4,-0.1 2,-0.2 -0.986 37.9-123.5-123.6 128.6 22.0 49.1 16.8 198 494 A K E -FG 305 345B 55 147,-0.6 147,-2.2 -2,-0.4 2,-0.4 -0.470 26.4-154.8 -71.4 137.4 25.0 51.3 15.8 199 495 A V E - G 0 344B 4 105,-3.1 2,-1.5 145,-0.2 145,-0.2 -0.943 18.9-135.4-119.8 136.7 28.0 51.0 18.1 200 496 A D > + 0 0 57 143,-3.2 4,-1.9 -2,-0.4 3,-0.2 -0.704 29.7 178.5 -86.0 86.9 30.8 53.5 18.8 201 497 A T H > S+ 0 0 12 -2,-1.5 4,-2.8 1,-0.2 5,-0.2 0.843 75.3 57.9 -62.2 -35.9 33.6 50.9 18.4 202 498 A K H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.914 106.6 49.9 -61.3 -40.8 36.3 53.5 19.0 203 499 A R H > S+ 0 0 69 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.946 111.2 48.1 -62.2 -48.7 34.7 54.3 22.4 204 500 A L H X S+ 0 0 0 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.917 111.2 50.2 -57.9 -45.5 34.6 50.6 23.3 205 501 A E H X S+ 0 0 93 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.847 109.3 52.7 -62.9 -33.8 38.2 50.1 22.3 206 502 A Q H X S+ 0 0 93 -4,-2.0 4,-2.0 2,-0.2 3,-0.2 0.956 111.6 44.5 -64.8 -51.5 39.2 53.1 24.4 207 503 A M H X S+ 0 0 31 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.906 110.0 57.5 -59.0 -42.4 37.4 51.8 27.5 208 504 A G H X S+ 0 0 9 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.874 106.3 48.1 -56.7 -40.5 39.0 48.4 26.7 209 505 A K H X S+ 0 0 149 -4,-1.8 4,-1.8 -3,-0.2 -1,-0.2 0.915 111.6 49.1 -67.8 -43.0 42.5 49.8 26.9 210 506 A E H X S+ 0 0 106 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.859 111.6 50.3 -64.0 -36.3 41.8 51.6 30.2 211 507 A L H X S+ 0 0 16 -4,-2.5 4,-3.3 2,-0.2 5,-0.2 0.913 106.3 54.5 -67.6 -43.8 40.4 48.4 31.6 212 508 A A H X S+ 0 0 51 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.884 109.7 48.2 -57.2 -40.4 43.4 46.4 30.6 213 509 A E H X S+ 0 0 136 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.940 114.2 45.3 -66.0 -47.6 45.6 48.9 32.4 214 510 A Q H X S+ 0 0 79 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.873 112.1 52.3 -64.2 -38.0 43.5 48.8 35.5 215 511 A L H X S+ 0 0 27 -4,-3.3 4,-3.0 2,-0.2 5,-0.2 0.927 108.0 51.1 -64.3 -44.8 43.3 45.0 35.4 216 512 A G H X S+ 0 0 27 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.912 111.5 48.1 -58.6 -43.4 47.0 44.6 35.2 217 513 A T H X S+ 0 0 106 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.936 116.2 41.2 -63.7 -49.3 47.5 46.9 38.2 218 514 A V H X S+ 0 0 7 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.870 111.9 57.4 -67.7 -36.2 44.9 45.1 40.4 219 515 A E H X S+ 0 0 56 -4,-3.0 4,-1.8 -5,-0.2 -1,-0.2 0.912 108.6 45.8 -60.1 -43.9 46.1 41.7 39.1 220 516 A Q H X S+ 0 0 107 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.877 109.8 53.9 -67.5 -38.6 49.7 42.4 40.3 221 517 A R H X S+ 0 0 74 -4,-1.8 4,-2.7 1,-0.2 5,-0.2 0.892 107.2 52.9 -62.3 -39.4 48.4 43.8 43.7 222 518 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.918 110.2 45.4 -62.6 -45.5 46.5 40.5 44.2 223 519 A Y H X>S+ 0 0 25 -4,-1.8 4,-1.8 2,-0.2 5,-1.7 0.867 112.8 53.1 -66.3 -34.9 49.6 38.4 43.5 224 520 A E H <5S+ 0 0 128 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.934 113.7 40.9 -63.8 -47.9 51.6 40.7 45.8 225 521 A L H <5S+ 0 0 32 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.769 117.2 49.5 -71.9 -27.1 49.1 40.3 48.6 226 522 A A H <5S- 0 0 0 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 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32.3 359 655 A S S S- 0 0 25 208,-3.2 208,-0.4 1,-0.2 5,-0.1 -0.830 80.0 -27.5 -92.2 114.6 7.1 52.0 36.0 360 656 A Q S > S+ 0 0 60 -2,-0.7 4,-1.9 1,-0.1 -1,-0.2 0.864 78.8 164.1 49.5 48.5 6.4 49.0 38.2 361 657 A I H > + 0 0 2 -3,-0.3 4,-2.5 1,-0.2 5,-0.2 0.897 69.7 55.8 -63.7 -36.6 4.3 47.2 35.6 362 658 A E H > S+ 0 0 13 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.939 110.2 43.0 -62.0 -47.7 4.5 43.9 37.4 363 659 A L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.843 113.4 52.9 -67.6 -31.3 3.2 45.2 40.7 364 660 A R H X S+ 0 0 5 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.896 109.2 49.6 -68.6 -38.8 0.5 47.1 38.9 365 661 A V H X S+ 0 0 2 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.912 110.2 51.1 -64.2 -41.5 -0.6 43.9 37.1 366 662 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.916 107.4 52.5 -62.5 -42.1 -0.6 42.1 40.4 367 663 A A H X>S+ 0 0 0 -4,-2.2 4,-1.2 1,-0.2 5,-0.9 0.919 113.6 45.6 -58.9 -42.8 -2.9 44.9 41.9 368 664 A H H <5S+ 0 0 27 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.955 116.3 41.7 -65.1 -54.6 -5.2 44.4 38.9 369 665 A I H <5S+ 0 0 52 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.894 122.2 39.9 -63.4 -41.6 -5.3 40.6 39.0 370 666 A A H <5S- 0 0 5 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.654 94.4-142.7 -82.4 -16.2 -5.6 40.3 42.7 371 667 A E T <5 + 0 0 96 -4,-1.2 2,-0.6 -5,-0.3 -3,-0.2 0.913 31.1 179.0 51.5 45.2 -7.9 43.2 43.1 372 668 A D >< - 0 0 2 -5,-0.9 4,-2.9 -6,-0.3 5,-0.3 -0.696 23.2-150.6 -80.5 118.3 -6.1 44.1 46.3 373 669 A D H > S+ 0 0 132 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.903 93.6 46.3 -56.4 -46.3 -7.7 47.3 47.6 374 670 A N H > S+ 0 0 44 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.922 116.0 44.6 -65.2 -45.0 -4.6 48.6 49.4 375 671 A L H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.904 113.5 50.0 -68.3 -40.4 -2.3 47.9 46.4 376 672 A M H X S+ 0 0 12 -4,-2.9 4,-2.3 -9,-0.2 -2,-0.2 0.927 111.5 48.8 -64.0 -42.8 -4.8 49.4 43.9 377 673 A E H X S+ 0 0 76 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.909 107.0 56.8 -63.1 -40.5 -5.2 52.5 45.9 378 674 A A H <>S+ 0 0 2 -4,-2.1 5,-2.5 1,-0.2 -1,-0.2 0.921 112.2 41.1 -57.2 -44.4 -1.4 52.9 46.2 379 675 A F H ><5S+ 0 0 4 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.841 108.6 58.9 -75.4 -29.9 -1.1 52.9 42.5 380 676 A R H 3<5S+ 0 0 134 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.802 110.5 44.4 -67.3 -24.2 -4.1 55.1 42.0 381 677 A R T 3<5S- 0 0 158 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.390 111.3-128.3 -94.7 0.4 -2.3 57.7 44.2 382 678 A D T < 5 + 0 0 77 -3,-1.2 -3,-0.2 -5,-0.2 -2,-0.1 0.885 45.3 177.6 50.4 44.6 1.0 57.0 42.2 383 679 A L < - 0 0 57 -5,-2.5 2,-0.9 -6,-0.2 -1,-0.1 -0.304 45.1 -96.5 -72.8 157.7 2.8 56.4 45.5 384 680 A D > - 0 0 78 1,-0.2 4,-2.4 2,-0.1 5,-0.2 -0.705 42.8-152.7 -73.1 110.0 6.4 55.3 45.7 385 681 A I H > S+ 0 0 5 -2,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.798 86.9 51.4 -63.0 -31.0 5.5 51.6 46.1 386 682 A H H > S+ 0 0 14 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.908 112.4 45.7 -72.9 -40.2 8.6 50.6 48.0 387 683 A T H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.915 114.4 49.6 -66.2 -41.4 8.2 53.4 50.6 388 684 A K H X S+ 0 0 30 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.920 110.0 49.9 -62.7 -44.5 4.5 52.5 50.8 389 685 A T H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.911 110.6 51.0 -62.0 -40.0 5.2 48.8 51.3 390 686 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.905 107.3 53.1 -63.3 -43.2 7.7 49.7 54.0 391 687 A M H <>S+ 0 0 44 -4,-2.3 5,-1.8 1,-0.2 4,-0.4 0.911 114.9 41.5 -58.6 -44.0 5.1 51.9 55.8 392 688 A D H <5S+ 0 0 34 -4,-2.1 3,-0.4 3,-0.2 -2,-0.2 0.943 117.7 41.8 -72.3 -50.2 2.6 49.0 55.9 393 689 A I H <5S+ 0 0 5 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.795 125.0 36.3 -71.8 -26.0 4.9 46.1 56.8 394 690 A F T <5S- 0 0 54 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.397 105.9-128.2-104.4 1.4 6.9 48.0 59.4 395 691 A Q T 5 + 0 0 146 -4,-0.4 2,-0.3 -3,-0.4 -3,-0.2 0.945 61.1 124.0 51.9 63.9 3.9 50.0 60.6 396 692 A V < - 0 0 39 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.937 61.6 -98.2-144.5 164.7 5.3 53.5 60.4 397 693 A S > - 0 0 47 -2,-0.3 3,-1.3 1,-0.1 4,-0.4 -0.314 43.5-101.0 -78.8 168.3 4.5 56.9 58.8 398 694 A E G > S+ 0 0 137 1,-0.3 3,-1.6 2,-0.2 -1,-0.1 0.916 123.2 50.7 -57.4 -46.0 6.1 58.0 55.5 399 695 A D G 3 S+ 0 0 141 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.594 105.7 59.4 -70.7 -6.7 8.6 60.3 57.3 400 696 A E G < S+ 0 0 110 -3,-1.3 2,-0.6 2,-0.1 -1,-0.3 0.488 77.2 107.8 -96.7 -6.6 9.5 57.4 59.6 401 697 A V < - 0 0 27 -3,-1.6 -10,-0.1 -4,-0.4 -14,-0.0 -0.637 58.7-155.8 -76.6 117.4 10.6 55.1 56.7 402 698 A T > - 0 0 68 -2,-0.6 4,-2.3 1,-0.1 5,-0.2 -0.430 29.1-104.6 -87.6 165.5 14.4 54.9 56.9 403 699 A P H > S+ 0 0 114 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.906 122.3 50.2 -57.4 -41.5 16.7 54.1 53.9 404 700 A N H > S+ 0 0 83 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.877 108.5 53.4 -66.5 -34.6 17.3 50.5 55.2 405 701 A M H > S+ 0 0 32 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.936 109.8 46.4 -64.7 -45.7 13.5 50.0 55.7 406 702 A R H X S+ 0 0 76 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.901 110.1 55.2 -63.7 -39.0 12.8 51.0 52.1 407 703 A R H X S+ 0 0 121 -4,-2.2 4,-1.6 -5,-0.2 -1,-0.2 0.914 110.4 44.2 -60.5 -43.9 15.6 48.8 50.8 408 704 A Q H X S+ 0 0 28 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.876 112.8 51.0 -71.5 -34.0 14.2 45.7 52.6 409 705 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.891 108.4 53.4 -67.7 -36.8 10.6 46.5 51.4 410 706 A K H X S+ 0 0 106 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.878 107.2 51.7 -63.7 -36.9 11.9 46.8 47.9 411 707 A A H X S+ 0 0 17 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.860 107.3 52.1 -67.9 -36.8 13.5 43.4 48.2 412 708 A V H X S+ 0 0 2 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.934 112.5 45.6 -64.6 -43.8 10.2 42.0 49.4 413 709 A N H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.856 109.0 55.8 -66.4 -34.9 8.6 43.5 46.3 414 710 A F H X S+ 0 0 100 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.893 105.8 53.0 -62.7 -38.9 11.4 42.2 44.1 415 711 A G H X>S+ 0 0 10 -4,-2.1 5,-1.7 1,-0.2 4,-0.7 0.829 109.4 47.7 -65.2 -33.9 10.6 38.8 45.5 416 712 A I H <5S+ 0 0 23 -4,-1.3 -2,-0.2 3,-0.2 -1,-0.2 0.872 110.2 52.0 -74.8 -38.7 7.0 39.1 44.4 417 713 A V H <5S+ 0 0 10 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.864 122.6 29.6 -66.6 -36.5 7.9 40.4 40.9 418 714 A Y H <5S- 0 0 111 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.395 104.9-122.4-106.1 3.9 10.2 37.4 40.2 419 715 A G T <5 + 0 0 12 -4,-0.7 -3,-0.2 -5,-0.1 -4,-0.1 0.871 46.4 172.0 59.9 42.7 8.5 34.8 42.4 420 716 A I < - 0 0 49 -5,-1.7 -1,-0.1 -6,-0.2 2,-0.1 -0.427 30.7-109.9 -81.1 158.7 11.5 34.0 44.6 421 717 A S > - 0 0 30 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.306 28.8-103.4 -83.0 169.4 11.2 31.7 47.6 422 718 A D H > S+ 0 0 55 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.806 126.9 53.5 -61.8 -29.0 11.5 32.7 51.3 423 719 A Y H > S+ 0 0 140 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.878 107.3 51.4 -71.1 -38.4 15.0 31.2 51.2 424 720 A G H > S+ 0 0 20 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.890 111.1 46.8 -64.6 -40.0 15.7 33.4 48.2 425 721 A L H X S+ 0 0 4 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.928 111.1 52.0 -67.0 -44.9 14.5 36.4 50.1 426 722 A A H X>S+ 0 0 8 -4,-2.5 5,-2.3 1,-0.2 4,-0.7 0.910 112.9 45.2 -56.6 -44.5 16.5 35.4 53.1 427 723 A Q H <5S+ 0 0 85 -4,-2.5 3,-0.4 3,-0.2 -1,-0.2 0.911 112.6 50.7 -67.2 -42.4 19.6 35.1 50.9 428 724 A N H <5S+ 0 0 88 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.868 120.1 35.2 -64.0 -36.8 18.9 38.4 49.2 429 725 A L H <5S- 0 0 10 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.424 105.8-126.5 -96.7 0.1 18.5 40.3 52.5 430 726 A N T <5 + 0 0 103 -4,-0.7 2,-0.2 -3,-0.4 -3,-0.2 0.936 69.9 119.3 53.1 50.1 21.1 38.3 54.3 431 727 A I S - 0 0 51 -2,-0.2 4,-2.5 1,-0.1 3,-0.3 -0.451 35.6-123.0 -75.7 148.8 17.3 34.2 58.5 433 729 A R H > S+ 0 0 114 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.875 115.8 57.2 -55.5 -36.1 14.7 32.3 56.5 434 730 A K H > S+ 0 0 139 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.902 107.7 44.1 -61.8 -45.1 12.5 32.7 59.6 435 731 A E H > S+ 0 0 92 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.859 111.9 53.9 -69.0 -35.8 12.8 36.5 59.6 436 732 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.869 106.5 52.7 -65.7 -35.8 12.2 36.5 55.8 437 733 A A H X S+ 0 0 35 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.876 106.0 53.5 -66.5 -37.8 9.0 34.5 56.4 438 734 A E H X S+ 0 0 76 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.852 106.0 53.0 -65.2 -35.7 7.9 37.1 59.0 439 735 A F H X S+ 0 0 41 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.934 110.5 47.6 -63.8 -45.4 8.4 39.8 56.4 440 736 A I H X S+ 0 0 48 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.916 111.1 50.2 -60.5 -46.8 6.2 37.9 54.0 441 737 A E H X S+ 0 0 103 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.901 110.7 50.3 -59.7 -40.8 3.5 37.3 56.6 442 738 A R H X S+ 0 0 74 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.889 109.2 52.0 -65.2 -38.7 3.6 41.0 57.4 443 739 A Y H X S+ 0 0 1 -4,-2.2 4,-2.0 1,-0.2 3,-0.3 0.930 108.2 50.0 -63.8 -45.4 3.2 41.8 53.7 444 740 A F H < S+ 0 0 50 -4,-2.6 7,-0.3 1,-0.2 -1,-0.2 0.777 106.6 56.0 -65.7 -25.4 0.1 39.5 53.4 445 741 A E H < S+ 0 0 112 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.856 113.3 41.2 -73.1 -33.2 -1.4 41.2 56.4 446 742 A S H < S+ 0 0 26 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.740 126.2 34.3 -83.4 -26.0 -1.1 44.5 54.7 447 743 A F >X + 0 0 0 -4,-2.0 4,-1.7 -5,-0.1 3,-0.9 -0.553 66.2 163.0-129.9 66.3 -2.2 43.2 51.2 448 744 A P H 3> S+ 0 0 77 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.755 74.7 61.5 -55.9 -28.8 -4.8 40.5 52.0 449 745 A G H 3> S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.888 104.1 48.0 -66.5 -39.8 -6.0 40.6 48.4 450 746 A V H <> S+ 0 0 0 -3,-0.9 4,-2.6 2,-0.2 -1,-0.2 0.891 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