==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 01-MAR-02 1L3U . COMPND 2 MOLECULE: 5'-D(*GP*CP*GP*AP*TP*CP*AP*CP*GP*TP*A)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.JOHNSON,J.S.TAYLOR,L.S.BEESE . 580 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27541.0 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 . 49 8.4 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 . 29 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 243 41.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 3.3 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 3 1 4 3 1 0 0 1 2 0 0 2 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 . 1 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 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 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 17.7 9.6 5.2 2.6 2 298 A K - 0 0 84 1,-0.1 2,-0.5 0, 0.0 147,-0.0 -0.025 360.0-115.9 -48.5 151.7 11.0 8.3 0.8 3 299 A M - 0 0 28 146,-0.0 -1,-0.1 1,-0.0 2,-0.1 -0.838 26.6-120.4 -98.9 129.5 8.7 11.2 0.3 4 300 A A + 0 0 72 -2,-0.5 2,-0.3 148,-0.0 43,-0.1 -0.391 48.1 142.3 -68.0 139.1 7.8 12.1 -3.3 5 301 A F - 0 0 57 -2,-0.1 2,-0.5 41,-0.1 43,-0.2 -0.962 48.9-103.9-169.7 160.1 8.6 15.6 -4.5 6 302 A T E -a 48 0A 78 41,-2.9 43,-2.6 -2,-0.3 2,-1.5 -0.828 16.8-150.6 -97.6 124.8 9.9 17.5 -7.5 7 303 A L E -a 49 0A 58 -2,-0.5 43,-0.1 41,-0.2 41,-0.1 -0.724 32.7-155.5 -92.0 84.1 13.5 18.7 -7.4 8 304 A A E -a 50 0A 8 -2,-1.5 43,-0.5 41,-1.1 3,-0.1 -0.310 26.9-165.2 -67.1 142.7 12.7 21.7 -9.6 9 305 A D S S+ 0 0 111 1,-0.3 2,-0.3 41,-0.1 -1,-0.1 0.416 80.7 19.6-103.3 -3.9 15.3 23.5 -11.8 10 306 A R S S- 0 0 177 44,-0.0 -1,-0.3 48,-0.0 2,-0.2 -0.974 88.9 -94.9-162.7 150.9 13.1 26.5 -12.2 11 307 A V - 0 0 14 -2,-0.3 2,-0.3 -3,-0.1 49,-0.1 -0.505 41.5-166.5 -72.7 134.9 10.1 28.1 -10.6 12 308 A T > - 0 0 40 -2,-0.2 3,-1.6 1,-0.1 4,-0.3 -0.817 33.2-106.3-121.1 162.4 6.7 27.2 -12.1 13 309 A E G > S+ 0 0 158 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.860 116.0 57.1 -53.0 -45.1 3.2 28.7 -11.7 14 310 A E G > S+ 0 0 91 1,-0.3 3,-0.6 2,-0.1 31,-0.3 0.638 96.3 65.8 -66.6 -11.8 1.8 25.9 -9.5 15 311 A M G < S+ 0 0 3 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.579 95.8 60.3 -82.8 -9.4 4.6 26.6 -7.1 16 312 A L G < S+ 0 0 22 -3,-2.0 -1,-0.2 -4,-0.3 -2,-0.1 -0.159 71.5 149.5-111.7 38.5 3.0 30.0 -6.4 17 313 A A < - 0 0 11 -3,-0.6 3,-0.0 2,-0.1 -3,-0.0 -0.184 61.3-107.5 -64.1 163.8 -0.4 28.9 -5.2 18 314 A D S S+ 0 0 95 1,-0.1 53,-2.1 52,-0.1 2,-0.3 0.362 104.1 39.9 -79.4 7.0 -2.2 31.3 -2.7 19 315 A K E S+b 71 0A 70 51,-0.2 25,-0.5 2,-0.1 2,-0.3 -0.916 71.6 140.7-154.6 128.2 -1.5 28.9 0.2 20 316 A A E -b 72 0A 0 51,-1.7 53,-2.4 -2,-0.3 2,-0.5 -0.994 50.5-112.2-164.1 158.5 1.5 26.8 1.0 21 317 A A E -bC 73 42A 0 21,-3.0 21,-2.2 -2,-0.3 2,-0.4 -0.864 44.0-162.9 -94.0 126.8 3.9 25.4 3.6 22 318 A L E - C 0 41A 1 51,-2.7 2,-0.5 -2,-0.5 53,-0.4 -0.959 16.6-171.0-121.5 134.4 7.2 27.2 3.0 23 319 A V E + C 0 40A 9 17,-2.6 17,-2.2 -2,-0.4 2,-0.6 -0.988 6.8 177.2-124.2 119.8 10.7 26.3 4.2 24 320 A V E - C 0 39A 10 -2,-0.5 2,-0.3 15,-0.2 15,-0.2 -0.888 30.2-145.8-121.5 91.0 13.5 28.8 3.6 25 321 A E E + C 0 38A 17 13,-2.0 12,-1.8 -2,-0.6 13,-0.7 -0.455 28.1 172.9 -72.8 125.8 16.3 27.0 5.3 26 322 A V - 0 0 6 -2,-0.3 10,-0.1 10,-0.2 5,-0.1 -0.958 5.0-177.7-129.0 105.6 19.0 28.8 7.2 27 323 A V + 0 0 10 -2,-0.5 -1,-0.1 8,-0.3 2,-0.1 0.831 55.0 95.8 -76.2 -34.4 21.2 26.3 9.0 28 324 A E S S- 0 0 106 7,-0.3 6,-0.1 1,-0.2 -2,-0.0 -0.384 76.2-136.3 -58.3 128.4 23.6 28.7 10.7 29 325 A E S S+ 0 0 144 1,-0.2 2,-0.9 -2,-0.1 -1,-0.2 0.908 99.2 56.3 -55.2 -44.8 22.2 29.3 14.2 30 326 A N S S- 0 0 25 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.818 75.0-170.4 -90.2 106.4 22.8 33.1 13.9 31 327 A Y > + 0 0 2 -2,-0.9 3,-1.7 3,-0.1 2,-0.4 0.415 40.4 125.3 -80.3 1.4 20.8 33.8 10.7 32 328 A H T 3 S- 0 0 6 1,-0.3 51,-0.1 275,-0.1 -2,-0.1 -0.489 96.4 -16.1 -67.6 120.2 22.0 37.4 10.3 33 329 A D T 3 S+ 0 0 94 -2,-0.4 -1,-0.3 49,-0.3 50,-0.1 0.802 108.0 149.4 54.8 30.9 23.4 37.8 6.8 34 330 A A < - 0 0 9 -3,-1.7 -1,-0.2 1,-0.1 -3,-0.1 -0.541 50.4 -94.1 -93.8 159.6 23.5 34.0 6.7 35 331 A P - 0 0 64 0, 0.0 2,-0.7 0, 0.0 -7,-0.3 -0.376 20.8-139.0 -73.1 148.6 23.1 31.6 3.7 36 332 A I - 0 0 10 -10,-0.1 -10,-0.2 1,-0.1 3,-0.1 -0.949 19.2-169.7-105.2 110.4 19.7 30.1 2.7 37 333 A V - 0 0 34 -12,-1.8 2,-0.3 -2,-0.7 -11,-0.1 0.572 58.1 -18.4 -81.8 -10.6 20.7 26.5 1.8 38 334 A G E -C 25 0A 0 -13,-0.7 -13,-2.0 13,-0.1 2,-0.4 -0.923 53.4-132.3 175.2 160.6 17.5 25.4 0.2 39 335 A I E -CD 24 50A 1 11,-2.0 11,-2.8 -2,-0.3 2,-0.4 -0.982 13.9-171.2-132.6 140.1 13.8 26.1 -0.3 40 336 A A E -CD 23 49A 0 -17,-2.2 -17,-2.6 -2,-0.4 2,-0.4 -0.990 1.2-172.0-131.6 140.6 10.8 23.7 -0.1 41 337 A V E -CD 22 48A 1 7,-2.5 7,-3.2 -2,-0.4 2,-0.4 -0.999 2.2-176.8-133.6 128.5 7.2 24.5 -1.0 42 338 A V E +CD 21 47A 5 -21,-2.2 -21,-3.0 -2,-0.4 2,-0.2 -0.997 22.8 138.0-127.7 126.0 4.3 22.2 -0.4 43 339 A N E > - D 0 46A 6 3,-2.4 3,-1.5 -2,-0.4 -23,-0.1 -0.786 68.9 -63.3-147.4-168.5 0.8 23.2 -1.6 44 340 A E T 3 S+ 0 0 132 -25,-0.5 3,-0.1 1,-0.3 -24,-0.1 0.741 129.0 52.6 -58.1 -24.2 -2.3 21.7 -3.2 45 341 A H T 3 S- 0 0 90 -31,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.566 118.8 -86.4 -91.2 -10.7 -0.3 20.9 -6.4 46 342 A G E < - D 0 43A 26 -3,-1.5 -3,-2.4 -32,-0.1 2,-0.4 -0.931 51.1 -49.4 142.4-166.8 2.5 19.0 -4.7 47 343 A R E - D 0 42A 92 -2,-0.3 -41,-2.9 -5,-0.2 2,-0.4 -0.940 49.3-176.6-114.8 132.1 5.9 19.1 -3.0 48 344 A F E -aD 6 41A 4 -7,-3.2 -7,-2.5 -2,-0.4 2,-0.5 -0.964 18.7-159.0-133.5 147.8 8.8 21.1 -4.5 49 345 A F E -aD 7 40A 3 -43,-2.6 -41,-1.1 -2,-0.4 2,-0.4 -0.992 16.6-172.4-122.6 126.2 12.4 21.7 -3.7 50 346 A L E -aD 8 39A 1 -11,-2.8 -11,-2.0 -2,-0.5 -41,-0.1 -0.953 25.6-122.7-121.4 139.0 14.1 24.8 -5.2 51 347 A R > - 0 0 56 -43,-0.5 4,-2.2 -2,-0.4 3,-0.4 -0.603 26.4-127.3 -75.3 137.2 17.7 25.8 -5.1 52 348 A P H > S+ 0 0 14 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.866 106.2 58.1 -54.4 -41.2 18.1 29.2 -3.5 53 349 A E H 4 S+ 0 0 127 2,-0.2 4,-0.4 1,-0.2 5,-0.0 0.919 114.1 39.9 -55.5 -44.7 20.1 30.7 -6.3 54 350 A T H >> S+ 0 0 43 -3,-0.4 3,-1.4 2,-0.2 4,-0.9 0.991 119.1 41.9 -67.2 -65.3 17.3 29.9 -8.7 55 351 A A H >< S+ 0 0 0 -4,-2.2 3,-1.1 1,-0.3 7,-0.3 0.902 114.7 49.4 -50.9 -52.3 14.2 30.7 -6.6 56 352 A L T 3< S+ 0 0 29 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.560 112.2 49.5 -70.2 -6.9 15.6 34.0 -5.1 57 353 A A T <4 S+ 0 0 75 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.514 88.7 98.4-104.8 -10.8 16.6 35.2 -8.6 58 354 A D S+ 0 0 95 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.872 95.5 51.6 -55.6 -41.2 11.1 37.6 -10.2 60 356 A Q H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.884 111.2 47.2 -65.7 -39.4 7.8 35.7 -9.9 61 357 A F H > S+ 0 0 0 2,-0.2 4,-2.9 -6,-0.2 -1,-0.2 0.942 112.4 48.0 -67.4 -48.5 9.0 33.8 -6.8 62 358 A V H X S+ 0 0 43 -4,-2.5 4,-1.9 -7,-0.3 -2,-0.2 0.879 113.1 49.6 -59.8 -37.4 10.3 36.9 -5.1 63 359 A A H X S+ 0 0 63 -4,-2.1 4,-0.8 -5,-0.3 -1,-0.2 0.898 109.7 51.2 -67.9 -39.6 7.0 38.6 -5.9 64 360 A W H >< S+ 0 0 6 -4,-2.1 3,-0.9 1,-0.2 6,-0.2 0.927 108.0 53.1 -61.8 -45.4 5.1 35.6 -4.5 65 361 A L H 3< S+ 0 0 1 -4,-2.9 27,-2.7 1,-0.2 -1,-0.2 0.896 113.6 42.4 -56.4 -43.3 7.2 35.8 -1.3 66 362 A G H 3< S+ 0 0 24 -4,-1.9 2,-0.8 25,-0.2 -1,-0.2 0.503 87.7 106.0 -85.1 -3.8 6.3 39.5 -0.8 67 363 A D X< - 0 0 57 -3,-0.9 3,-2.0 -4,-0.8 25,-0.1 -0.679 55.8-160.0 -82.0 109.3 2.7 39.1 -1.7 68 364 A E T 3 S+ 0 0 112 -2,-0.8 -1,-0.2 1,-0.3 -4,-0.0 0.694 90.2 61.5 -60.6 -19.7 0.7 39.4 1.5 69 365 A T T 3 S+ 0 0 80 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.599 86.5 80.5 -83.7 -12.2 -2.3 37.7 -0.2 70 366 A K S < S- 0 0 58 -3,-2.0 2,-0.3 -6,-0.2 -51,-0.2 -0.857 82.5-145.6 -96.4 103.6 -0.2 34.5 -0.8 71 367 A K E -b 19 0A 66 -53,-2.1 -51,-1.7 -2,-0.9 2,-0.4 -0.520 15.6-167.3 -78.7 134.0 -0.4 32.8 2.5 72 368 A K E -be 20 94A 0 21,-2.6 23,-1.7 -2,-0.3 24,-1.3 -0.953 12.3-155.6-123.3 140.9 2.5 30.8 3.9 73 369 A S E +be 21 96A 0 -53,-2.4 -51,-2.7 -2,-0.4 2,-0.2 -0.950 33.3 157.4-110.9 131.0 2.7 28.4 6.8 74 370 A M E - e 0 97A 4 22,-2.9 24,-3.3 -2,-0.5 2,-0.5 -0.828 44.2-116.1-144.4-179.5 6.2 28.1 8.3 75 371 A F S S- 0 0 32 -53,-0.4 39,-0.1 -2,-0.2 22,-0.1 -0.988 99.5 -5.1-126.0 116.6 8.3 27.2 11.3 76 372 A D S > S- 0 0 30 -2,-0.5 4,-1.1 3,-0.1 3,-0.4 0.995 71.9-180.0 62.5 63.4 10.3 30.1 12.7 77 373 A S H > S+ 0 0 11 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.819 74.3 66.5 -65.6 -28.6 9.3 32.6 10.0 78 374 A K H > S+ 0 0 10 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.901 97.4 53.7 -59.5 -41.3 11.4 35.3 11.7 79 375 A R H > S+ 0 0 55 -3,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.932 114.7 40.5 -57.7 -46.7 14.6 33.4 10.9 80 376 A A H X S+ 0 0 2 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.910 113.7 54.1 -68.9 -43.5 13.6 33.3 7.2 81 377 A A H X S+ 0 0 16 -4,-3.4 4,-2.3 1,-0.2 -2,-0.2 0.918 112.5 42.7 -58.2 -46.2 12.3 36.8 7.2 82 378 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -49,-0.3 0.926 112.1 52.5 -68.6 -44.2 15.6 38.2 8.6 83 379 A A H < S+ 0 0 1 -4,-2.2 4,-0.4 -5,-0.3 -1,-0.2 0.887 113.8 46.0 -57.9 -38.0 17.8 36.1 6.3 84 380 A L H ><>S+ 0 0 0 -4,-2.4 5,-2.6 1,-0.2 3,-1.3 0.882 105.3 58.8 -73.0 -38.8 15.7 37.4 3.4 85 381 A K H ><5S+ 0 0 57 -4,-2.3 3,-2.1 1,-0.3 -2,-0.2 0.908 101.5 56.4 -55.9 -41.6 15.9 41.0 4.6 86 382 A W T 3<5S+ 0 0 52 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.729 108.2 47.9 -63.4 -20.2 19.7 40.8 4.4 87 383 A K T < 5S- 0 0 104 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.252 122.1-109.0-101.0 8.8 19.3 39.8 0.8 88 384 A G T < 5S+ 0 0 71 -3,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.784 77.2 131.5 69.2 29.7 16.9 42.7 0.2 89 385 A I < - 0 0 18 -5,-2.6 2,-0.4 -8,-0.1 -1,-0.2 -0.959 49.4-139.8-119.6 129.1 13.8 40.4 -0.1 90 386 A E - 0 0 131 -2,-0.4 2,-0.5 -28,-0.1 -23,-0.1 -0.715 8.3-157.3 -91.4 130.6 10.5 41.0 1.7 91 387 A L + 0 0 26 -2,-0.4 2,-0.3 -10,-0.1 -25,-0.2 -0.923 25.2 160.9-105.7 124.0 8.6 38.0 3.2 92 388 A C + 0 0 21 -27,-2.7 -25,-0.2 -2,-0.5 3,-0.1 -0.852 42.4 48.4-134.5 171.3 4.9 38.7 3.7 93 389 A G + 0 0 10 -2,-0.3 -21,-2.6 1,-0.2 2,-1.0 0.661 55.7 158.4 73.6 17.1 1.7 36.7 4.2 94 390 A V E +e 72 0A 38 -23,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.659 6.7 168.5 -75.8 107.3 3.0 34.3 6.9 95 391 A S E + 0 0 44 -23,-1.7 2,-0.3 -2,-1.0 -22,-0.2 0.577 61.4 31.4 -96.7 -13.1 -0.4 33.3 8.4 96 392 A F E -e 73 0A 1 -24,-1.3 -22,-2.9 -3,-0.1 2,-0.5 -0.963 55.3-171.1-150.5 129.0 0.9 30.4 10.6 97 393 A D E > -e 74 0A 1 -2,-0.3 4,-2.4 -24,-0.2 -22,-0.2 -0.941 8.2-163.0-123.1 106.3 4.2 29.8 12.4 98 394 A L H > S+ 0 0 0 -24,-3.3 4,-2.9 -2,-0.5 5,-0.2 0.823 89.3 58.0 -57.1 -36.5 4.4 26.2 13.8 99 395 A L H > S+ 0 0 18 -25,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.954 111.6 40.4 -59.8 -50.2 7.2 27.2 16.1 100 396 A L H > S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.863 114.2 54.3 -67.0 -36.1 5.1 29.9 17.8 101 397 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.943 111.1 44.6 -62.4 -48.1 2.1 27.7 17.8 102 398 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.930 111.0 54.8 -61.5 -45.7 4.0 24.9 19.6 103 399 A Y H < S+ 0 0 8 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.888 109.9 45.7 -55.1 -45.5 5.5 27.4 22.0 104 400 A L H < S+ 0 0 0 -4,-2.2 370,-0.4 1,-0.2 -1,-0.2 0.871 110.7 53.7 -68.7 -37.0 2.0 28.7 23.0 105 401 A L H < S- 0 0 2 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.893 136.8 -11.5 -65.3 -39.6 0.6 25.2 23.3 106 402 A D >< - 0 0 26 -4,-2.4 3,-1.5 -5,-0.1 5,-0.4 -0.562 53.9-172.7-165.7 96.6 3.4 24.2 25.7 107 403 A P G > S+ 0 0 5 0, 0.0 3,-1.2 0, 0.0 -3,-0.1 0.787 86.0 68.4 -59.6 -28.7 6.5 26.2 26.4 108 404 A A G 3 S+ 0 0 62 1,-0.2 -5,-0.1 208,-0.1 208,-0.1 0.711 81.0 74.0 -66.8 -21.7 7.9 23.3 28.4 109 405 A Q G < S- 0 0 110 -3,-1.5 -1,-0.2 -7,-0.2 3,-0.2 0.781 91.5-141.8 -64.0 -24.2 8.3 21.0 25.4 110 406 A G < - 0 0 49 -3,-1.2 2,-0.3 -4,-0.3 -2,-0.1 0.832 24.5-169.7 66.2 31.6 11.3 23.1 24.3 111 407 A V + 0 0 12 -5,-0.4 -1,-0.2 1,-0.2 -8,-0.1 -0.385 24.4 154.1 -58.7 113.3 10.2 22.8 20.7 112 408 A D + 0 0 127 -2,-0.3 2,-0.3 -3,-0.2 -1,-0.2 0.229 59.8 35.2-126.4 10.8 13.1 24.1 18.6 113 409 A D S > S- 0 0 12 1,-0.1 4,-1.6 -14,-0.1 3,-0.4 -0.981 85.1-103.6-156.5 161.6 12.6 22.2 15.3 114 410 A V H > S+ 0 0 1 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.889 116.7 58.7 -53.9 -43.1 9.8 20.9 13.1 115 411 A A H > S+ 0 0 14 12,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.893 105.2 49.5 -55.6 -42.6 10.3 17.3 14.3 116 412 A A H > S+ 0 0 34 -3,-0.4 4,-0.7 2,-0.2 -1,-0.2 0.884 112.6 46.5 -66.5 -38.5 9.7 18.3 18.0 117 413 A A H >< S+ 0 0 0 -4,-1.6 3,-1.0 1,-0.2 4,-0.5 0.934 112.5 50.8 -68.0 -45.1 6.5 20.2 17.1 118 414 A A H ><>S+ 0 0 0 -4,-2.9 5,-2.3 1,-0.3 3,-1.6 0.852 100.7 62.4 -60.5 -36.9 5.3 17.3 15.0 119 415 A K H ><5S+ 0 0 130 -4,-2.1 3,-1.6 1,-0.3 -1,-0.3 0.788 90.5 69.1 -62.2 -24.8 5.9 14.8 17.7 120 416 A M T <<5S+ 0 0 48 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.801 106.9 38.4 -61.8 -29.0 3.3 16.6 19.8 121 417 A K T < 5S- 0 0 62 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 -0.059 123.0-101.5-111.8 29.4 0.7 15.3 17.4 122 418 A Q T < 5S+ 0 0 158 -3,-1.6 2,-0.6 1,-0.2 -3,-0.2 0.814 78.0 139.5 56.2 34.0 2.1 11.9 16.9 123 419 A Y < + 0 0 46 -5,-2.3 -1,-0.2 -8,-0.1 -2,-0.2 -0.950 13.4 157.2-108.9 118.0 3.6 12.9 13.5 124 420 A E + 0 0 133 -2,-0.6 2,-0.7 -3,-0.1 -1,-0.1 0.166 34.4 112.5-128.2 18.6 7.1 11.4 13.1 125 421 A A S S+ 0 0 44 28,-0.1 2,-0.3 -7,-0.1 32,-0.1 -0.148 71.8 68.2 -85.6 41.0 7.6 11.4 9.3 126 422 A V S S- 0 0 11 -2,-0.7 24,-0.1 -11,-0.1 -3,-0.0 -0.969 80.0-123.5-156.3 142.3 10.3 14.0 9.6 127 423 A R - 0 0 110 -2,-0.3 -12,-0.4 23,-0.1 -13,-0.1 -0.594 31.2-102.3 -92.1 151.9 13.8 14.0 11.1 128 424 A P >> - 0 0 62 0, 0.0 4,-1.4 0, 0.0 3,-0.9 -0.451 32.0-122.0 -67.3 144.4 15.1 16.3 13.9 129 425 A D H 3> S+ 0 0 31 1,-0.3 4,-3.3 2,-0.2 5,-0.4 0.891 112.7 57.7 -55.0 -41.1 17.4 19.0 12.4 130 426 A E H 3> S+ 0 0 114 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.833 102.6 54.8 -60.3 -31.6 20.2 17.8 14.6 131 427 A A H <4 S+ 0 0 58 -3,-0.9 -1,-0.2 2,-0.2 -2,-0.2 0.871 116.5 36.8 -69.1 -36.2 20.0 14.3 13.1 132 428 A V H < S+ 0 0 15 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.899 130.9 27.4 -82.7 -44.2 20.3 15.8 9.6 133 429 A Y H < S- 0 0 5 -4,-3.3 7,-2.0 1,-0.2 -3,-0.2 0.597 95.4-144.8 -96.2 -13.7 22.8 18.6 10.2 134 430 A G < - 0 0 21 -4,-1.8 2,-0.3 -5,-0.4 -1,-0.2 -0.148 21.9 -94.8 72.9-177.7 24.7 17.2 13.2 135 431 A K S > S- 0 0 135 4,-0.1 3,-1.1 -4,-0.1 4,-0.4 -0.901 71.3 -4.8-136.2 165.4 25.9 19.6 15.9 136 432 A G G > S- 0 0 68 -2,-0.3 3,-0.6 1,-0.3 0, 0.0 -0.298 128.8 -8.5 58.6-129.7 29.1 21.4 16.9 137 433 A A G 3 S+ 0 0 101 1,-0.2 -1,-0.3 -2,-0.1 -3,-0.0 0.866 136.7 57.7 -68.2 -38.3 32.1 20.7 14.7 138 434 A K G < S+ 0 0 175 -3,-1.1 -1,-0.2 2,-0.0 -2,-0.2 0.635 80.3 119.8 -68.0 -13.9 30.3 17.9 12.9 139 435 A R < + 0 0 77 -3,-0.6 2,-0.3 -4,-0.4 -5,-0.2 -0.267 35.9 137.8 -56.2 135.1 27.6 20.4 11.9 140 436 A A - 0 0 60 -7,-2.0 -2,-0.0 -6,-0.1 -3,-0.0 -0.942 57.3 -97.2-174.8 153.8 27.3 20.6 8.1 141 437 A V - 0 0 68 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.701 44.9-134.4 -81.8 123.5 24.8 20.8 5.2 142 438 A P - 0 0 29 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.186 36.9 -70.8 -72.3 170.0 24.3 17.4 3.7 143 439 A D >> - 0 0 135 1,-0.1 4,-2.8 4,-0.1 3,-0.7 -0.154 54.1 -98.6 -58.5 156.8 24.3 16.7 -0.1 144 440 A E H 3> S+ 0 0 65 1,-0.2 4,-3.5 2,-0.2 5,-0.4 0.845 120.2 57.1 -45.9 -47.8 21.3 17.9 -2.1 145 441 A P H 3> S+ 0 0 92 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.924 115.8 36.8 -53.2 -46.3 19.5 14.6 -2.1 146 442 A V H <> S+ 0 0 62 -3,-0.7 4,-2.1 2,-0.2 -2,-0.2 0.889 119.0 49.2 -73.4 -41.1 19.4 14.4 1.7 147 443 A L H X S+ 0 0 9 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.954 111.6 48.4 -62.8 -51.0 18.9 18.2 2.1 148 444 A A H X S+ 0 0 0 -4,-3.5 4,-2.1 1,-0.2 -1,-0.2 0.875 110.8 51.8 -56.9 -42.2 16.0 18.3 -0.3 149 445 A E H X S+ 0 0 40 -4,-1.5 4,-2.3 -5,-0.4 -1,-0.2 0.932 111.5 46.8 -60.7 -48.6 14.4 15.3 1.3 150 446 A H H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.935 112.0 48.4 -61.5 -49.8 14.6 16.9 4.8 151 447 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.886 112.4 49.8 -60.8 -38.7 13.3 20.3 3.7 152 448 A V H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.912 109.1 51.2 -66.5 -42.6 10.3 18.7 1.9 153 449 A R H X S+ 0 0 36 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.860 110.7 49.9 -63.2 -34.3 9.4 16.5 4.9 154 450 A K H X S+ 0 0 9 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.922 112.0 46.3 -70.3 -42.3 9.5 19.6 7.1 155 451 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.896 113.1 51.0 -64.8 -38.9 7.2 21.6 4.7 156 452 A A H X S+ 0 0 8 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.915 109.7 49.7 -64.1 -43.1 5.0 18.5 4.5 157 453 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 -2,-0.2 0.931 111.9 47.9 -61.3 -46.9 4.8 18.3 8.3 158 454 A I H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.926 110.6 52.4 -59.3 -45.3 3.9 22.0 8.5 159 455 A W H < S+ 0 0 80 -4,-2.7 4,-0.4 1,-0.2 -1,-0.2 0.900 117.0 38.6 -57.6 -43.3 1.3 21.5 5.8 160 456 A E H < S+ 0 0 100 -4,-2.3 3,-0.3 1,-0.2 -2,-0.2 0.849 116.8 49.7 -76.7 -37.4 -0.3 18.6 7.7 161 457 A L H X S+ 0 0 3 -4,-3.1 4,-2.5 -5,-0.2 5,-0.3 0.665 86.1 83.3 -80.4 -19.5 0.1 20.0 11.3 162 458 A E H X S+ 0 0 24 -4,-1.8 4,-2.7 -5,-0.2 5,-0.2 0.919 92.7 46.8 -50.7 -53.1 -1.4 23.5 10.8 163 459 A R H > S+ 0 0 154 -4,-0.4 4,-2.6 -3,-0.3 5,-0.2 0.955 113.8 45.7 -57.8 -56.1 -5.0 22.5 11.2 164 460 A P H > S+ 0 0 33 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.902 114.9 48.4 -57.8 -39.8 -4.5 20.3 14.3 165 461 A F H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.943 113.0 46.6 -65.1 -46.2 -2.3 23.0 16.0 166 462 A L H X S+ 0 0 53 -4,-2.7 4,-2.4 -5,-0.3 -1,-0.2 0.874 110.2 55.2 -61.7 -38.5 -4.8 25.8 15.2 167 463 A D H X S+ 0 0 84 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.901 110.9 43.5 -62.6 -42.4 -7.7 23.6 16.5 168 464 A E H X S+ 0 0 42 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.883 111.3 53.8 -72.0 -37.4 -6.0 23.1 19.9 169 465 A L H <>S+ 0 0 0 -4,-2.4 5,-3.5 1,-0.2 6,-0.6 0.921 109.0 50.7 -60.1 -42.2 -5.0 26.7 20.2 170 466 A R H ><5S+ 0 0 153 -4,-2.4 3,-1.4 4,-0.2 -1,-0.2 0.909 108.9 49.6 -61.7 -44.5 -8.6 27.6 19.6 171 467 A R H 3<5S+ 0 0 162 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.859 111.7 50.3 -62.5 -35.3 -9.8 25.1 22.3 172 468 A N T 3<5S- 0 0 19 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.459 114.5-119.8 -80.2 -2.8 -7.2 26.7 24.6 173 469 A E T < 5S+ 0 0 126 -3,-1.4 -3,-0.2 -4,-0.3 4,-0.1 0.873 85.3 115.7 62.7 36.9 -8.5 30.2 23.7 174 470 A Q >< + 0 0 0 -5,-3.5 4,-1.7 -6,-0.2 -4,-0.2 0.200 33.7 101.8-118.3 10.4 -5.1 31.0 22.4 175 471 A D H > S+ 0 0 34 -6,-0.6 4,-2.4 1,-0.2 5,-0.2 0.923 88.2 41.7 -64.2 -43.4 -6.0 31.5 18.7 176 472 A R H >>S+ 0 0 150 1,-0.2 4,-3.3 2,-0.2 5,-0.9 0.850 107.8 63.3 -70.4 -33.1 -5.9 35.3 18.9 177 473 A L H >>S+ 0 0 7 3,-0.2 5,-2.6 2,-0.2 4,-0.5 0.894 112.5 35.5 -57.6 -40.8 -2.7 35.0 21.1 178 474 A L H <>S+ 0 0 0 -4,-1.7 5,-2.9 3,-0.2 -2,-0.2 0.959 126.7 36.6 -75.8 -54.1 -0.9 33.4 18.1 179 475 A V H <5S+ 0 0 71 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.830 128.7 29.4 -71.0 -37.3 -2.6 35.4 15.3 180 476 A E H <5S+ 0 0 105 -4,-3.3 -3,-0.2 -5,-0.2 -1,-0.2 0.608 133.5 21.3-102.1 -13.3 -2.9 38.8 16.8 181 477 A L T X S+ 0 0 44 0, 0.0 4,-1.4 0, 0.0 3,-0.4 0.912 113.1 53.2 -64.6 -37.1 2.7 40.1 14.3 185 481 A L H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.863 99.7 63.5 -62.1 -36.3 5.3 40.6 17.0 186 482 A S H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.884 102.9 47.8 -55.1 -42.0 7.6 38.1 15.2 187 483 A S H X S+ 0 0 72 -4,-1.2 4,-1.8 -3,-0.4 -1,-0.2 0.850 111.7 50.5 -68.4 -35.7 7.7 40.5 12.2 188 484 A I H X S+ 0 0 14 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.911 109.7 49.5 -68.8 -42.4 8.4 43.4 14.5 189 485 A L H X S+ 0 0 0 -4,-3.1 4,-2.9 1,-0.2 5,-0.2 0.888 108.1 55.3 -63.5 -37.7 11.3 41.5 16.2 190 486 A A H X S+ 0 0 1 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.914 108.7 47.0 -61.0 -43.7 12.6 40.7 12.7 191 487 A E H X S+ 0 0 98 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.927 113.4 49.4 -63.4 -43.9 12.7 44.4 11.9 192 488 A M H X S+ 0 0 5 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.920 112.9 45.5 -60.8 -48.1 14.4 45.2 15.2 193 489 A E H < S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.910 114.4 48.5 -62.8 -44.9 17.1 42.5 14.8 194 490 A F H < S+ 0 0 75 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.887 110.4 51.3 -64.1 -40.4 17.8 43.5 11.2 195 491 A A H < S- 0 0 21 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.903 94.0-176.0 -64.1 -41.5 18.0 47.2 12.1 196 492 A G < - 0 0 3 -4,-2.1 2,-0.4 -5,-0.2 111,-0.2 0.065 28.5 -82.3 68.5 176.5 20.5 46.4 14.9 197 493 A V E -F 306 0B 7 109,-2.2 109,-2.5 -4,-0.1 2,-0.2 -0.984 37.8-123.6-123.2 129.1 22.0 48.8 17.4 198 494 A K E -FG 305 345B 55 147,-0.7 147,-1.9 -2,-0.4 2,-0.4 -0.484 25.8-154.0 -71.4 137.5 25.0 51.0 16.5 199 495 A V E - G 0 344B 4 105,-3.2 2,-1.5 145,-0.2 145,-0.2 -0.946 16.9-136.1-118.5 135.9 28.0 50.5 18.8 200 496 A D > + 0 0 60 143,-3.5 4,-2.0 -2,-0.4 3,-0.4 -0.705 27.9 179.3 -87.1 86.1 30.7 53.1 19.5 201 497 A T H > S+ 0 0 8 -2,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.823 76.2 58.4 -60.9 -32.7 33.6 50.7 19.3 202 498 A K H > S+ 0 0 154 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.897 106.9 48.0 -64.9 -38.6 36.2 53.4 20.0 203 499 A R H > S+ 0 0 67 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.919 111.9 49.7 -67.3 -43.0 34.5 54.2 23.3 204 500 A L H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.927 110.2 49.8 -60.8 -45.8 34.4 50.5 24.2 205 501 A E H X S+ 0 0 92 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.838 110.9 50.7 -62.5 -33.2 38.1 50.0 23.4 206 502 A Q H X S+ 0 0 89 -4,-1.6 4,-1.9 2,-0.2 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32.9 359 655 A S S S- 0 0 24 208,-3.1 208,-0.4 -2,-0.2 5,-0.1 -0.841 80.1 -25.5 -93.9 117.4 6.9 51.6 36.5 360 656 A Q S > S+ 0 0 77 -2,-0.7 4,-1.9 1,-0.1 -1,-0.2 0.862 77.8 165.6 49.2 48.8 6.3 48.6 38.7 361 657 A I H > S+ 0 0 6 -3,-0.3 4,-2.7 1,-0.2 5,-0.2 0.901 70.3 55.0 -62.4 -38.2 4.3 46.7 36.1 362 658 A E H > S+ 0 0 36 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.924 110.9 43.1 -61.4 -45.5 4.5 43.4 38.0 363 659 A L H > S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.841 114.5 50.8 -70.5 -31.1 3.1 44.8 41.2 364 660 A R H X S+ 0 0 5 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.882 110.9 49.4 -71.1 -38.4 0.4 46.7 39.3 365 661 A V H X S+ 0 0 2 -4,-2.7 4,-3.0 -5,-0.2 5,-0.2 0.918 110.7 50.4 -64.9 -41.7 -0.4 43.4 37.5 366 662 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.4 0.921 108.3 52.2 -60.8 -44.8 -0.6 41.7 40.8 367 663 A A H X>S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 5,-0.9 0.917 113.3 45.8 -56.8 -45.0 -2.9 44.4 42.2 368 664 A H H <5S+ 0 0 24 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.950 116.6 41.5 -62.7 -54.9 -5.2 43.8 39.2 369 665 A I H <5S+ 0 0 49 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.891 121.6 40.4 -63.7 -43.0 -5.2 40.0 39.2 370 666 A A H <5S- 0 0 6 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.693 94.8-143.1 -79.8 -19.3 -5.6 39.7 43.0 371 667 A E T <5 + 0 0 100 -4,-1.3 2,-0.7 -5,-0.4 -3,-0.2 0.926 30.5 178.4 54.3 45.7 -8.0 42.6 43.2 372 668 A D >< - 0 0 1 -5,-0.9 4,-2.7 -6,-0.2 5,-0.3 -0.728 22.9-151.2 -82.2 117.6 -6.4 43.6 46.5 373 669 A D H > S+ 0 0 132 -2,-0.7 4,-2.2 1,-0.2 5,-0.2 0.915 93.4 46.4 -54.6 -49.5 -8.2 46.7 47.7 374 670 A N H > S+ 0 0 41 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.924 115.3 45.5 -62.1 -46.2 -5.2 48.1 49.5 375 671 A L H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.887 113.0 49.9 -67.0 -39.3 -2.7 47.5 46.7 376 672 A M H X S+ 0 0 9 -4,-2.7 4,-2.2 -9,-0.2 -1,-0.2 0.888 110.8 49.8 -66.9 -38.3 -5.0 48.9 44.0 377 673 A E H X S+ 0 0 74 -4,-2.2 4,-1.8 -5,-0.3 -2,-0.2 0.903 106.0 57.4 -65.9 -40.8 -5.6 52.0 46.0 378 674 A A H <>S+ 0 0 2 -4,-2.1 5,-2.6 1,-0.2 -2,-0.2 0.928 112.1 40.4 -56.1 -46.7 -1.9 52.4 46.5 379 675 A F H ><5S+ 0 0 4 -4,-1.8 3,-1.3 3,-0.2 -1,-0.2 0.850 108.7 59.5 -73.1 -32.0 -1.3 52.5 42.8 380 676 A R H 3<5S+ 0 0 131 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.817 111.0 43.3 -63.8 -27.3 -4.4 54.6 42.1 381 677 A R T 3<5S- 0 0 154 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.396 111.1-129.8 -93.8 0.4 -2.6 57.2 44.4 382 678 A D T < 5 + 0 0 77 -3,-1.3 -3,-0.2 -5,-0.2 -2,-0.1 0.894 45.9 175.3 49.6 45.3 0.6 56.4 42.6 383 679 A L < - 0 0 63 -5,-2.6 2,-1.1 -6,-0.1 -1,-0.1 -0.314 47.1 -93.6 -77.3 162.4 2.3 55.9 45.9 384 680 A D > - 0 0 73 1,-0.2 4,-2.6 2,-0.1 3,-0.2 -0.698 43.2-153.7 -74.2 105.6 5.9 54.8 46.5 385 681 A I H > S+ 0 0 4 -2,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.796 87.3 51.4 -58.3 -32.3 4.9 51.2 46.8 386 682 A H H > S+ 0 0 10 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.898 111.8 46.0 -74.8 -37.1 7.9 50.2 48.9 387 683 A T H > S+ 0 0 18 -3,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.912 113.6 50.9 -68.3 -41.3 7.3 53.0 51.4 388 684 A K H X S+ 0 0 27 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.918 110.1 48.5 -61.6 -44.7 3.6 52.1 51.5 389 685 A T H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.913 111.7 49.8 -62.9 -42.2 4.4 48.4 52.1 390 686 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-0.3 0.927 108.1 53.4 -61.8 -45.5 6.8 49.3 54.9 391 687 A M H <>S+ 0 0 50 -4,-2.7 5,-1.8 1,-0.2 4,-0.4 0.911 115.6 41.0 -54.9 -43.7 4.1 51.6 56.5 392 688 A D H <5S+ 0 0 29 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.912 118.1 42.6 -73.3 -46.6 1.7 48.7 56.4 393 689 A I H <5S+ 0 0 4 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.729 125.4 35.3 -76.3 -20.6 4.0 45.8 57.5 394 690 A F T <5S- 0 0 47 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.380 105.2-130.0-109.3 0.3 5.7 47.9 60.3 395 691 A Q T 5 + 0 0 147 -4,-0.4 2,-0.3 -5,-0.3 -3,-0.2 0.955 60.0 124.1 48.6 69.1 2.5 49.8 61.1 396 692 A V < - 0 0 35 -5,-1.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.943 62.2 -96.6-147.7 166.6 3.9 53.4 61.0 397 693 A S > - 0 0 50 -2,-0.3 3,-0.8 1,-0.1 4,-0.4 -0.284 45.6 -99.8 -78.3 171.1 3.3 56.7 59.3 398 694 A E G > S+ 0 0 131 1,-0.2 3,-1.7 2,-0.2 -1,-0.1 0.917 123.0 55.1 -59.3 -44.0 5.2 57.8 56.2 399 695 A D G 3 S+ 0 0 158 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.708 103.7 56.2 -63.1 -21.0 7.5 60.0 58.2 400 696 A E G < S+ 0 0 113 -3,-0.8 2,-0.7 2,-0.1 -1,-0.3 0.475 77.8 109.6 -91.0 -3.0 8.4 57.0 60.5 401 697 A V < - 0 0 26 -3,-1.7 -10,-0.1 -4,-0.4 -14,-0.0 -0.648 57.4-157.7 -76.5 115.3 9.6 54.8 57.6 402 698 A T > - 0 0 68 -2,-0.7 4,-2.0 1,-0.1 3,-0.4 -0.495 30.0-105.6 -88.6 161.8 13.4 54.6 57.9 403 699 A P H > S+ 0 0 117 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.867 122.5 51.1 -54.8 -37.8 15.6 53.7 55.0 404 700 A N H > S+ 0 0 82 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.851 107.1 53.9 -69.7 -33.3 16.2 50.2 56.4 405 701 A M H > S+ 0 0 29 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.881 110.8 45.6 -66.9 -39.1 12.4 49.7 56.7 406 702 A R H X S+ 0 0 77 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.901 109.7 55.7 -70.5 -40.1 11.9 50.6 53.1 407 703 A R H X S+ 0 0 119 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.896 112.1 42.4 -58.2 -42.7 14.8 48.3 52.1 408 704 A Q H X S+ 0 0 27 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.880 112.6 51.7 -74.3 -37.0 13.2 45.4 53.8 409 705 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.881 109.5 53.0 -64.9 -35.7 9.6 46.2 52.6 410 706 A K H X S+ 0 0 89 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.922 108.0 49.1 -62.9 -45.3 11.2 46.3 49.1 411 707 A A H X S+ 0 0 11 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.843 109.4 53.2 -63.6 -33.9 12.7 42.9 49.6 412 708 A V H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.924 105.3 53.7 -67.5 -43.2 9.3 41.6 50.7 413 709 A N H X S+ 0 0 3 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.877 109.1 49.5 -59.1 -38.0 7.7 42.9 47.6 414 710 A F H X S+ 0 0 96 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.938 111.2 48.6 -66.0 -46.6 10.2 41.0 45.4 415 711 A G H X S+ 0 0 18 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.912 106.5 56.9 -59.6 -43.8 9.6 37.8 47.4 416 712 A I H X S+ 0 0 0 -4,-2.8 4,-0.5 1,-0.2 3,-0.3 0.932 110.7 43.8 -53.4 -48.4 5.9 38.2 47.0 417 713 A V H < S+ 0 0 3 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.850 115.4 48.2 -66.4 -36.1 6.2 38.3 43.2 418 714 A Y H < S- 0 0 137 -4,-2.1 79,-0.3 -5,-0.1 -1,-0.2 0.673 134.7 -78.9 -78.5 -18.7 8.7 35.4 43.1 419 715 A G H < - 0 0 6 -4,-1.9 -3,-0.2 -3,-0.3 -2,-0.2 0.641 56.5-114.8 112.7 77.3 6.6 33.2 45.4 420 716 A I < + 0 0 27 -4,-0.5 2,-0.3 -7,-0.1 -4,-0.1 0.077 39.2 172.4 -42.1 145.0 7.2 34.3 49.0 421 717 A S > - 0 0 42 1,-0.1 4,-3.5 15,-0.0 5,-0.4 -0.904 36.5-137.2-160.1 127.0 8.9 31.9 51.4 422 718 A D H > S+ 0 0 60 -2,-0.3 4,-1.8 1,-0.2 14,-0.2 0.870 111.5 47.3 -54.5 -37.3 10.1 32.6 55.0 423 719 A Y H > S+ 0 0 117 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.929 113.6 47.5 -69.3 -45.2 13.3 30.7 54.2 424 720 A G H > S+ 0 0 37 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.914 114.6 45.2 -61.8 -44.4 13.8 32.6 51.0 425 721 A L H X S+ 0 0 6 -4,-3.5 4,-2.6 2,-0.2 -1,-0.2 0.835 111.4 55.0 -68.7 -32.5 13.1 36.0 52.6 426 722 A A H X>S+ 0 0 2 -4,-1.8 5,-1.7 -5,-0.4 4,-1.1 0.960 109.2 45.1 -64.3 -52.1 15.4 35.0 55.5 427 723 A Q H <5S+ 0 0 106 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.853 116.4 48.0 -60.1 -36.8 18.3 34.2 53.2 428 724 A N H <5S+ 0 0 106 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.894 122.0 31.9 -73.3 -42.0 17.7 37.4 51.3 429 725 A L H <5S- 0 0 7 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.380 108.0-123.5 -95.4 3.0 17.4 39.8 54.3 430 726 A N T <5 + 0 0 105 -4,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.965 69.2 118.1 52.4 61.1 19.8 37.7 56.3 431 727 A I < - 0 0 41 -5,-1.7 -1,-0.2 -6,-0.1 2,-0.1 -0.840 67.8 -75.7-142.2 177.9 17.5 37.0 59.2 432 728 A S > - 0 0 56 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.402 38.1-115.5 -80.0 158.4 15.8 34.1 60.9 433 729 A R H > S+ 0 0 145 1,-0.2 4,-3.8 2,-0.2 5,-0.2 0.922 116.3 55.3 -56.5 -47.0 12.9 32.2 59.5 434 730 A K H > S+ 0 0 166 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.886 110.7 45.5 -54.0 -42.3 10.7 33.3 62.4 435 731 A E H > S+ 0 0 89 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.930 115.0 46.4 -67.5 -46.9 11.5 36.9 61.6 436 732 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.919 110.8 53.6 -61.1 -44.7 10.9 36.4 57.9 437 733 A A H X S+ 0 0 34 -4,-3.8 4,-2.7 1,-0.2 -1,-0.2 0.889 106.6 52.3 -57.7 -42.4 7.7 34.5 58.5 438 734 A E H X S+ 0 0 117 -4,-1.8 4,-2.7 -5,-0.2 -1,-0.2 0.882 108.1 50.7 -63.3 -39.6 6.4 37.4 60.7 439 735 A F H X S+ 0 0 37 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.957 112.6 46.4 -61.6 -50.4 7.1 39.9 57.9 440 736 A I H X S+ 0 0 16 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.904 112.4 50.6 -57.9 -44.2 5.3 37.8 55.4 441 737 A E H X S+ 0 0 123 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.924 110.9 48.6 -61.0 -44.8 2.4 37.3 57.8 442 738 A R H X S+ 0 0 44 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.895 109.2 54.5 -62.4 -39.3 2.2 41.1 58.4 443 739 A Y H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 3,-0.5 0.952 108.9 46.6 -59.3 -51.0 2.3 41.6 54.6 444 740 A F H < S+ 0 0 31 -4,-2.5 7,-0.3 1,-0.2 -1,-0.2 0.778 106.3 59.0 -64.4 -26.2 -0.7 39.3 54.1 445 741 A E H < S+ 0 0 114 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.872 113.6 38.7 -68.9 -34.9 -2.6 41.0 56.9 446 742 A S H < S+ 0 0 23 -4,-1.6 -2,-0.2 -3,-0.5 -1,-0.2 0.736 125.9 37.2 -85.2 -26.1 -2.3 44.3 55.0 447 743 A F >X + 0 0 0 -4,-2.0 4,-1.8 -5,-0.2 3,-0.6 -0.558 65.0 159.3-126.2 66.4 -2.9 42.7 51.6 448 744 A P H 3> S+ 0 0 71 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.785 74.8 60.1 -58.4 -29.6 -5.5 40.0 52.1 449 745 A G H 3> S+ 0 0 2 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.894 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