==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 18-APR-08 3CVP . COMPND 2 MOLECULE: PEROXISOME TARGETING SIGNAL 1 RECEPTOR PEX5; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA BRUCEI; . AUTHOR P.SAMPATHKUMAR,C.ROACH,P.A.M MICHELS,W.G.J.HOL . 285 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13245.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 76.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 13 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.8 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 0 0 2 0 0 0 1 0 0 7 4 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 336 A T 0 0 132 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.8 0.9 6.5 -7.7 2 337 A D + 0 0 97 67,-0.1 67,-0.1 2,-0.1 68,-0.1 0.607 360.0 91.2 -75.0 -15.7 2.5 3.6 -5.8 3 338 A Y S S- 0 0 3 66,-0.1 2,-1.6 1,-0.1 63,-0.0 -0.730 77.3-137.2 -88.5 129.1 -0.8 3.2 -4.0 4 339 A P - 0 0 80 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.569 26.3-158.7 -87.5 79.2 -3.3 0.7 -5.5 5 340 A F - 0 0 43 -2,-1.6 2,-0.1 1,-0.1 30,-0.0 -0.280 24.7-104.7 -58.4 133.9 -6.5 2.7 -5.0 6 341 A E - 0 0 115 1,-0.1 3,-0.3 2,-0.0 2,-0.2 -0.382 34.9-126.0 -55.9 132.4 -9.7 0.7 -5.1 7 342 A A S S+ 0 0 72 1,-0.2 -1,-0.1 -3,-0.1 0, 0.0 -0.564 89.8 28.0 -77.6 151.1 -11.5 1.2 -8.4 8 343 A N S S+ 0 0 160 1,-0.2 -1,-0.2 -2,-0.2 3,-0.1 0.980 75.6 176.7 61.3 58.5 -15.2 2.3 -8.1 9 344 A N > - 0 0 6 -3,-0.3 3,-2.1 1,-0.1 4,-0.3 -0.865 22.3-154.9 -95.8 112.4 -14.8 4.1 -4.8 10 345 A P G > S+ 0 0 64 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.768 90.7 65.9 -62.9 -23.4 -18.2 5.6 -4.0 11 346 A Y G > S+ 0 0 29 1,-0.3 3,-0.7 2,-0.2 9,-0.1 0.638 80.7 79.5 -72.1 -14.7 -16.6 8.3 -1.8 12 347 A M G < S+ 0 0 67 -3,-2.1 -1,-0.3 1,-0.2 24,-0.0 0.739 97.1 45.9 -58.5 -23.3 -14.9 9.7 -4.9 13 348 A Y G < S+ 0 0 199 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.644 95.5 106.1 -92.5 -18.2 -18.3 11.4 -5.5 14 349 A H < - 0 0 78 -3,-0.7 2,-0.5 -4,-0.3 -3,-0.0 -0.260 69.7-125.7 -78.9 146.7 -18.9 12.7 -2.0 15 350 A E S S+ 0 0 175 1,-0.2 5,-0.1 2,-0.1 -1,-0.1 -0.787 96.7 2.2 -80.3 128.8 -18.7 16.1 -0.6 16 351 A N > + 0 0 84 -2,-0.5 4,-1.9 3,-0.1 3,-0.3 0.863 66.3 168.7 60.0 53.0 -16.3 15.9 2.3 17 352 A P H > S+ 0 0 20 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.744 76.1 64.1 -61.8 -23.4 -15.0 12.3 2.4 18 353 A M H > S+ 0 0 8 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.957 105.4 43.6 -64.4 -48.7 -12.3 13.3 4.9 19 354 A E H > S+ 0 0 45 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.916 115.3 49.9 -57.0 -48.0 -15.0 14.2 7.5 20 355 A E H X S+ 0 0 64 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.837 109.2 51.3 -60.2 -40.3 -16.9 11.0 6.6 21 356 A G H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.898 110.1 49.3 -62.0 -44.1 -13.7 8.9 7.0 22 357 A L H X S+ 0 0 88 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.908 111.8 48.5 -62.7 -41.0 -13.1 10.4 10.4 23 358 A S H X S+ 0 0 68 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.914 109.2 53.1 -67.4 -39.0 -16.7 9.7 11.4 24 359 A M H <>S+ 0 0 9 -4,-2.3 5,-2.8 1,-0.2 4,-0.5 0.862 109.0 50.9 -60.0 -37.0 -16.3 6.1 10.1 25 360 A L H ><5S+ 0 0 51 -4,-2.0 3,-0.5 3,-0.2 -2,-0.2 0.892 107.2 51.5 -65.0 -44.0 -13.2 5.8 12.3 26 361 A K H 3<5S+ 0 0 92 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.896 112.5 46.9 -60.6 -40.7 -15.1 7.0 15.4 27 362 A L T 3<5S- 0 0 144 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.621 115.2-124.1 -70.0 -17.0 -17.7 4.3 14.5 28 363 A A T < 5 + 0 0 12 -3,-0.5 2,-1.3 -4,-0.5 -3,-0.2 0.685 62.4 143.6 76.2 23.3 -14.8 1.8 14.1 29 364 A N >< + 0 0 35 -5,-2.8 4,-2.4 1,-0.2 5,-0.2 -0.683 22.9 176.2 -91.2 81.9 -15.8 0.9 10.5 30 365 A L H > S+ 0 0 5 -2,-1.3 4,-2.6 181,-0.3 -1,-0.2 0.886 70.3 50.6 -62.3 -49.8 -12.2 0.5 9.2 31 366 A A H > S+ 0 0 20 211,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.910 114.7 45.3 -53.2 -47.5 -12.8 -0.7 5.7 32 367 A E H > S+ 0 0 89 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.891 112.0 51.2 -65.8 -43.9 -15.3 2.2 5.0 33 368 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.893 107.9 53.6 -57.9 -41.9 -13.0 4.8 6.6 34 369 A A H X S+ 0 0 4 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.919 108.7 48.7 -61.8 -44.8 -10.1 3.5 4.4 35 370 A L H X S+ 0 0 37 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.899 111.8 49.2 -60.7 -44.2 -12.2 4.0 1.2 36 371 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.919 113.7 45.8 -59.8 -46.9 -13.2 7.5 2.3 37 372 A F H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.882 108.5 57.1 -66.0 -37.5 -9.5 8.4 3.1 38 373 A E H X S+ 0 0 5 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.912 103.5 53.9 -54.6 -47.0 -8.5 6.8 -0.2 39 374 A A H X S+ 0 0 5 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.897 108.9 48.7 -56.3 -45.2 -10.9 9.2 -2.0 40 375 A V H X S+ 0 0 7 -4,-1.6 4,-2.8 1,-0.2 -1,-0.2 0.893 109.5 51.6 -61.4 -42.5 -9.2 12.2 -0.3 41 376 A C H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.836 111.5 48.6 -66.2 -31.8 -5.7 11.0 -1.3 42 377 A Q H < S+ 0 0 88 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.933 118.5 37.5 -70.1 -47.3 -6.8 10.7 -4.9 43 378 A A H < S+ 0 0 90 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.804 135.5 20.0 -76.8 -35.1 -8.4 14.1 -5.1 44 379 A A >< + 0 0 35 -4,-2.8 3,-2.4 -5,-0.2 -1,-0.2 -0.584 64.9 171.5-137.6 75.9 -5.8 15.9 -3.0 45 380 A P T 3 S+ 0 0 52 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.562 77.3 65.4 -66.4 -10.4 -2.5 13.9 -2.8 46 381 A E T 3 S+ 0 0 147 1,-0.1 2,-1.1 4,-0.0 -5,-0.1 0.499 74.0 107.0 -85.9 -4.1 -0.8 16.8 -1.0 47 382 A R X> - 0 0 117 -3,-2.4 4,-1.3 -7,-0.2 3,-1.0 -0.614 49.9-172.5 -83.4 97.5 -3.1 16.4 2.0 48 383 A E H 3> S+ 0 0 28 -2,-1.1 4,-2.4 1,-0.3 5,-0.2 0.863 81.0 57.3 -60.8 -42.3 -0.9 14.9 4.7 49 384 A E H 3> S+ 0 0 34 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.777 105.1 55.2 -56.5 -30.2 -3.7 14.2 7.3 50 385 A A H <> S+ 0 0 0 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.894 109.5 43.0 -71.4 -44.0 -5.4 12.1 4.6 51 386 A W H X S+ 0 0 2 -4,-1.3 4,-2.9 2,-0.2 -2,-0.2 0.866 114.8 51.4 -70.1 -38.7 -2.4 9.8 3.9 52 387 A R H X S+ 0 0 71 -4,-2.4 4,-3.2 2,-0.2 5,-0.2 0.958 111.4 45.9 -63.1 -51.4 -1.8 9.5 7.6 53 388 A S H X S+ 0 0 9 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.890 114.5 49.7 -59.9 -39.8 -5.4 8.5 8.4 54 389 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.964 113.0 45.6 -59.7 -52.8 -5.3 6.1 5.5 55 390 A G H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.930 113.4 49.4 -59.0 -50.7 -2.1 4.5 6.7 56 391 A L H X S+ 0 0 48 -4,-3.2 4,-1.5 1,-0.2 -1,-0.2 0.874 113.9 46.0 -54.2 -42.7 -3.3 4.3 10.3 57 392 A T H X S+ 0 0 0 -4,-2.1 4,-1.5 -5,-0.2 -2,-0.2 0.907 108.5 54.3 -70.9 -45.3 -6.6 2.7 9.3 58 393 A Q H <>S+ 0 0 3 -4,-2.8 5,-2.5 1,-0.2 -1,-0.2 0.857 106.8 51.8 -59.5 -39.0 -5.1 0.1 6.8 59 394 A A H ><5S+ 0 0 12 -4,-1.8 3,-1.5 1,-0.2 -1,-0.2 0.924 110.7 47.0 -64.7 -46.3 -2.7 -1.2 9.5 60 395 A E H 3<5S+ 0 0 26 -4,-1.5 154,-2.2 1,-0.3 155,-0.2 0.753 107.6 59.5 -62.2 -24.8 -5.6 -1.7 12.0 61 396 A N T 3<5S- 0 0 0 -4,-1.5 -1,-0.3 152,-0.2 -2,-0.2 0.045 126.1-104.8 -91.5 23.0 -7.4 -3.3 9.0 62 397 A E T < 5S+ 0 0 29 -3,-1.5 -3,-0.2 1,-0.1 2,-0.2 0.825 87.7 119.4 64.0 34.5 -4.6 -5.9 8.8 63 398 A K >< + 0 0 61 -5,-2.5 4,-2.1 -8,-0.1 3,-0.1 -0.576 23.8 161.5-130.2 71.2 -3.0 -4.4 5.7 64 399 A D H > S+ 0 0 5 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.826 75.0 58.9 -60.2 -34.1 0.6 -3.4 6.7 65 400 A G H > S+ 0 0 38 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.955 111.0 40.2 -60.7 -49.8 1.7 -3.2 3.0 66 401 A L H > S+ 0 0 41 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.834 113.4 57.3 -67.5 -33.0 -0.9 -0.6 2.2 67 402 A A H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.956 106.4 47.8 -60.4 -55.2 -0.2 1.1 5.5 68 403 A I H X S+ 0 0 19 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.916 109.6 52.1 -53.9 -49.0 3.5 1.6 4.7 69 404 A I H X S+ 0 0 43 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.950 115.5 41.8 -54.9 -49.6 2.8 3.0 1.2 70 405 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 3,-0.4 0.906 112.5 52.5 -65.5 -44.6 0.4 5.5 2.6 71 406 A L H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.829 102.6 59.1 -64.7 -32.5 2.5 6.5 5.6 72 407 A N H X S+ 0 0 52 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.858 104.9 50.8 -65.0 -33.2 5.6 7.1 3.4 73 408 A H H X S+ 0 0 51 -4,-1.1 4,-2.1 -3,-0.4 -2,-0.2 0.942 111.7 47.6 -61.4 -47.2 3.5 9.8 1.6 74 409 A A H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.880 110.2 52.4 -61.3 -41.0 2.6 11.3 5.0 75 410 A R H < S+ 0 0 118 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.856 109.2 49.1 -66.1 -37.5 6.2 11.2 6.1 76 411 A M H < S+ 0 0 158 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.923 113.9 46.6 -64.1 -43.5 7.4 13.0 3.0 77 412 A L H < S+ 0 0 74 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.769 133.5 12.0 -74.1 -29.5 4.7 15.7 3.4 78 413 A D >< - 0 0 63 -4,-2.1 3,-1.9 -5,-0.2 -1,-0.3 -0.647 62.5-176.7-150.1 90.8 5.4 16.2 7.2 79 414 A P T 3 S+ 0 0 85 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.505 84.5 59.3 -67.4 -5.0 8.6 14.6 8.4 80 415 A K T 3 + 0 0 58 4,-0.0 2,-1.0 30,-0.0 3,-0.1 0.252 69.0 115.4-106.1 8.5 7.7 15.8 12.0 81 416 A D X> - 0 0 18 -3,-1.9 4,-1.4 1,-0.2 3,-0.6 -0.717 47.5-169.4 -79.1 104.7 4.4 13.9 12.2 82 417 A I H 3> S+ 0 0 58 -2,-1.0 4,-2.5 1,-0.2 -1,-0.2 0.760 79.7 62.4 -73.7 -24.8 5.3 11.5 15.0 83 418 A A H 3> S+ 0 0 42 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.799 103.4 52.1 -66.3 -29.6 2.2 9.3 14.6 84 419 A V H <> S+ 0 0 0 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.933 110.5 45.5 -72.3 -46.7 3.4 8.5 11.1 85 420 A H H X S+ 0 0 9 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.915 112.1 53.0 -62.1 -42.0 6.9 7.5 12.3 86 421 A A H X S+ 0 0 27 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.927 112.1 43.8 -56.9 -49.7 5.3 5.4 15.1 87 422 A A H X S+ 0 0 15 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.838 110.1 55.4 -67.6 -37.6 3.0 3.5 12.8 88 423 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.934 106.9 51.4 -59.8 -44.8 5.8 3.0 10.2 89 424 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.875 111.8 47.5 -57.4 -41.3 7.9 1.4 12.9 90 425 A V H X S+ 0 0 9 -4,-1.5 4,-2.6 2,-0.2 198,-0.3 0.950 114.8 43.1 -66.2 -53.5 5.0 -1.0 13.8 91 426 A S H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.879 114.6 50.5 -64.3 -39.2 4.2 -2.0 10.3 92 427 A H H <>S+ 0 0 16 -4,-2.7 5,-3.3 -5,-0.2 -1,-0.2 0.853 109.8 50.7 -65.1 -38.2 7.9 -2.5 9.4 93 428 A T H ><5S+ 0 0 9 -4,-1.7 3,-1.5 -5,-0.3 -2,-0.2 0.939 110.7 48.8 -61.6 -47.3 8.4 -4.6 12.5 94 429 A N H 3<5S+ 0 0 12 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.890 115.3 45.3 -58.0 -36.1 5.4 -6.8 11.5 95 430 A E T 3<5S- 0 0 84 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.398 113.1-120.9 -88.6 1.7 6.9 -7.0 8.0 96 431 A H T < 5 + 0 0 148 -3,-1.5 2,-0.9 1,-0.2 -3,-0.2 0.913 60.7 149.0 51.6 46.5 10.5 -7.7 9.3 97 432 A N >< + 0 0 66 -5,-3.3 4,-2.6 1,-0.2 -1,-0.2 -0.795 21.4 177.9 -99.3 78.5 11.9 -4.6 7.6 98 433 A A H > S+ 0 0 12 -2,-0.9 4,-2.5 1,-0.2 5,-0.2 0.904 72.3 44.5 -56.0 -51.7 14.5 -4.3 10.4 99 434 A N H > S+ 0 0 92 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.916 115.9 46.9 -60.4 -47.7 16.4 -1.3 9.0 100 435 A A H > S+ 0 0 34 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.848 111.5 53.0 -63.8 -35.9 13.2 0.6 8.1 101 436 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 -9,-0.2 -2,-0.2 0.928 111.3 44.5 -65.2 -45.6 11.7 -0.2 11.5 102 437 A L H X S+ 0 0 5 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.880 111.4 54.1 -67.7 -37.5 14.8 1.2 13.4 103 438 A A H X S+ 0 0 56 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.883 109.9 48.6 -60.1 -39.8 14.8 4.3 11.1 104 439 A S H X S+ 0 0 8 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.898 111.3 47.5 -68.4 -43.9 11.2 4.9 12.0 105 440 A L H X S+ 0 0 3 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.908 113.4 49.0 -62.3 -44.2 11.7 4.6 15.8 106 441 A R H X S+ 0 0 107 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.928 113.6 45.7 -62.8 -43.2 14.7 6.8 15.6 107 442 A A H X S+ 0 0 28 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.837 108.9 58.1 -67.4 -33.6 12.7 9.4 13.6 108 443 A W H < S+ 0 0 7 -4,-2.3 -1,-0.2 -23,-0.2 -2,-0.2 0.911 113.9 37.1 -60.8 -42.4 9.8 9.0 16.0 109 444 A L H >< S+ 0 0 4 -4,-2.1 3,-1.5 1,-0.2 6,-0.3 0.955 118.2 45.9 -76.4 -51.0 12.0 10.0 18.9 110 445 A L H 3< S+ 0 0 44 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.676 99.4 69.1 -74.8 -17.7 14.2 12.7 17.4 111 446 A S T 3< S+ 0 0 33 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.1 0.551 84.1 87.9 -72.8 -8.6 11.2 14.5 15.6 112 447 A Q S X> S- 0 0 21 -3,-1.5 4,-2.0 1,-0.1 3,-1.9 -0.843 73.9-147.6 -95.3 121.7 10.1 15.5 19.1 113 448 A P T 34 S+ 0 0 103 0, 0.0 4,-0.4 0, 0.0 -1,-0.1 0.844 100.4 64.6 -55.2 -34.7 11.6 18.8 20.3 114 449 A Q T 34 S+ 0 0 94 1,-0.2 3,-0.1 2,-0.1 -4,-0.1 0.786 119.7 20.4 -51.6 -34.9 11.4 17.3 23.8 115 450 A Y T <4 S+ 0 0 10 -3,-1.9 -1,-0.2 -6,-0.3 -5,-0.1 0.500 92.4 105.1-115.9 -11.2 13.9 14.6 22.7 116 451 A E < 0 0 126 -4,-2.0 -2,-0.1 1,-0.3 -1,-0.1 0.662 360.0 360.0 -55.0 -24.3 15.6 16.1 19.7 117 452 A Q 0 0 139 -4,-0.4 -1,-0.3 -3,-0.1 -2,-0.1 0.645 360.0 360.0 -71.6 360.0 18.9 16.9 21.6 118 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 119 474 A F 0 0 152 0, 0.0 2,-1.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -76.3 23.7 -9.4 18.6 120 475 A F > - 0 0 28 4,-0.2 3,-1.1 1,-0.2 7,-0.2 -0.732 360.0-167.9 -87.6 97.1 20.8 -8.0 16.4 121 476 A F T 3 S+ 0 0 92 -2,-1.2 -1,-0.2 1,-0.3 37,-0.0 0.749 74.4 57.3 -64.0 -34.6 21.9 -9.4 13.1 122 477 A A T 3 S- 0 0 62 1,-0.2 -1,-0.3 2,-0.1 -23,-0.2 0.774 135.4 -4.6 -70.0 -24.2 19.7 -7.6 10.6 123 478 A A S <> S+ 0 0 1 -3,-1.1 4,-1.8 -25,-0.1 -1,-0.2 -0.332 73.6 175.6-169.7 73.1 21.0 -4.1 11.8 124 479 A P H > S+ 0 0 63 0, 0.0 4,-1.7 0, 0.0 -4,-0.2 0.843 78.8 32.8 -58.4 -53.5 23.3 -4.4 14.8 125 480 A N H > S+ 0 0 128 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.850 115.1 56.7 -79.4 -36.6 24.5 -0.8 15.4 126 481 A E H > S+ 0 0 84 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.855 110.0 49.2 -59.2 -35.1 21.2 0.8 14.3 127 482 A Y H X S+ 0 0 11 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.924 109.6 49.0 -69.6 -49.7 19.6 -1.3 17.0 128 483 A R H X S+ 0 0 31 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.921 111.2 51.4 -56.0 -47.3 22.0 -0.4 19.7 129 484 A E H X S+ 0 0 75 -4,-2.7 4,-3.0 2,-0.2 -1,-0.2 0.916 111.1 46.9 -55.9 -50.2 21.6 3.3 18.8 130 485 A C H X S+ 0 0 3 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.929 112.6 49.8 -58.0 -47.9 17.8 3.1 19.0 131 486 A R H X S+ 0 0 101 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.913 113.9 46.2 -56.4 -44.4 18.0 1.2 22.3 132 487 A T H X S+ 0 0 89 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.931 112.4 48.9 -67.9 -48.0 20.4 3.9 23.7 133 488 A L H X S+ 0 0 45 -4,-3.0 4,-1.9 2,-0.2 -2,-0.2 0.929 113.0 47.3 -56.4 -49.9 18.3 6.8 22.5 134 489 A L H X S+ 0 0 3 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.910 113.8 47.3 -61.4 -43.7 15.0 5.3 24.0 135 490 A H H X S+ 0 0 81 -4,-2.3 4,-1.1 -5,-0.2 -1,-0.2 0.852 111.6 50.4 -64.1 -36.2 16.7 4.6 27.3 136 491 A A H X S+ 0 0 52 -4,-2.4 4,-0.9 2,-0.2 -1,-0.2 0.838 111.8 48.9 -67.1 -35.0 18.2 8.0 27.5 137 492 A A H X S+ 0 0 2 -4,-1.9 4,-1.6 -5,-0.2 3,-0.3 0.855 105.7 56.8 -71.8 -37.5 14.8 9.5 26.7 138 493 A L H < S+ 0 0 29 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.783 104.1 54.4 -64.7 -28.8 13.3 7.3 29.5 139 494 A E H < S+ 0 0 80 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.796 111.4 44.1 -71.4 -30.9 15.8 9.0 31.8 140 495 A M H < S+ 0 0 123 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.700 133.2 18.7 -85.7 -22.4 14.5 12.4 30.8 141 496 A N S >< S- 0 0 53 -4,-1.6 3,-1.3 -5,-0.1 -1,-0.2 -0.547 73.9-178.7-151.1 76.9 10.8 11.4 31.0 142 497 A P T 3 S+ 0 0 73 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.582 76.6 41.7 -62.2 -28.2 10.5 8.2 33.1 143 498 A N T 3 S+ 0 0 91 4,-0.0 2,-0.7 31,-0.0 3,-0.1 -0.116 74.8 136.0-116.8 37.2 6.7 7.5 33.0 144 499 A D <> - 0 0 19 -3,-1.3 4,-2.0 1,-0.1 3,-0.5 -0.772 41.6-157.7 -86.4 114.1 6.1 8.3 29.3 145 500 A A H > S+ 0 0 1 -2,-0.7 4,-2.3 1,-0.2 -1,-0.1 0.790 90.6 54.6 -65.3 -30.9 3.8 5.5 27.9 146 501 A Q H > S+ 0 0 51 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.810 106.4 52.3 -73.8 -30.4 4.8 6.1 24.3 147 502 A L H > S+ 0 0 0 -3,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.930 112.2 45.2 -67.4 -47.7 8.5 5.6 25.3 148 503 A H H X S+ 0 0 8 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.903 114.2 49.6 -59.8 -41.9 7.7 2.3 27.0 149 504 A A H X S+ 0 0 5 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.912 110.0 50.7 -63.3 -45.7 5.5 1.3 24.0 150 505 A S H X S+ 0 0 9 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.864 108.1 51.1 -60.9 -40.9 8.4 2.2 21.6 151 506 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.875 107.6 56.0 -61.7 -37.1 10.8 0.1 23.6 152 507 A G H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.914 108.0 46.8 -56.7 -45.7 8.1 -2.7 23.3 153 508 A V H X S+ 0 0 8 -4,-1.9 4,-2.0 2,-0.2 3,-0.2 0.973 113.1 48.9 -63.6 -51.0 8.3 -2.3 19.4 154 509 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.901 111.9 48.7 -51.1 -46.7 12.1 -2.4 19.5 155 510 A Y H <>S+ 0 0 26 -4,-2.6 5,-3.2 1,-0.2 -1,-0.2 0.810 106.8 55.3 -72.3 -30.7 12.2 -5.4 21.7 156 511 A N H ><5S+ 0 0 7 -4,-2.1 3,-1.3 -3,-0.2 -1,-0.2 0.861 103.3 58.4 -57.8 -40.5 9.6 -7.3 19.5 157 512 A L H 3<5S+ 0 0 18 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.902 111.1 39.5 -58.7 -44.3 12.0 -6.6 16.6 158 513 A S T 3<5S- 0 0 19 -4,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.258 114.4-116.3 -90.6 12.0 14.8 -8.5 18.4 159 514 A N T < 5 + 0 0 101 -3,-1.3 2,-1.0 1,-0.2 -3,-0.2 0.814 69.9 140.1 60.3 30.9 12.4 -11.2 19.7 160 515 A N >< + 0 0 73 -5,-3.2 4,-2.4 1,-0.2 3,-0.3 -0.592 20.4 166.1-101.9 71.1 13.1 -10.2 23.3 161 516 A Y H > + 0 0 52 -2,-1.0 4,-2.6 1,-0.2 -1,-0.2 0.686 64.9 58.6 -71.0 -21.2 9.4 -10.7 24.1 162 517 A D H > S+ 0 0 123 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.944 111.3 40.0 -71.9 -48.5 9.8 -10.7 27.9 163 518 A S H > S+ 0 0 48 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.893 116.9 52.1 -64.1 -40.0 11.4 -7.2 27.9 164 519 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.975 109.8 48.2 -59.1 -52.5 8.9 -6.1 25.3 165 520 A A H X S+ 0 0 9 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.860 110.5 51.9 -56.5 -41.5 6.0 -7.4 27.4 166 521 A A H X S+ 0 0 61 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.936 113.0 44.0 -63.2 -46.6 7.2 -5.6 30.5 167 522 A N H X S+ 0 0 25 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.922 116.3 46.3 -62.6 -43.0 7.6 -2.3 28.8 168 523 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.807 107.7 57.1 -72.7 -32.3 4.2 -2.6 27.0 169 524 A R H X S+ 0 0 91 -4,-2.5 4,-1.6 -5,-0.3 -1,-0.2 0.903 107.7 48.7 -62.0 -43.4 2.5 -3.8 30.3 170 525 A R H X S+ 0 0 98 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.899 108.2 55.3 -60.4 -41.4 3.7 -0.5 31.8 171 526 A A H X S+ 0 0 0 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.892 109.0 45.5 -59.7 -43.0 2.3 1.4 28.8 172 527 A V H < S+ 0 0 7 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.777 107.7 58.0 -73.3 -27.9 -1.2 -0.1 29.3 173 528 A E H < S+ 0 0 136 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.868 113.1 41.1 -61.7 -37.7 -1.1 0.6 33.0 174 529 A L H < S+ 0 0 71 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.794 132.6 23.6 -79.9 -31.7 -0.5 4.2 32.1 175 530 A R >< + 0 0 109 -4,-1.6 3,-1.6 -5,-0.2 -1,-0.2 -0.591 67.4 164.6-135.4 74.2 -3.1 4.2 29.3 176 531 A P T 3 S+ 0 0 54 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.439 75.4 56.0 -78.9 -0.4 -5.6 1.4 29.9 177 532 A D T 3 S+ 0 0 124 31,-0.0 2,-0.9 5,-0.0 -5,-0.1 0.179 77.9 109.8-109.9 13.3 -8.1 2.7 27.3 178 533 A D <> - 0 0 45 -3,-1.6 4,-1.7 1,-0.2 3,-0.4 -0.804 51.8-164.6 -94.9 107.0 -5.7 2.7 24.4 179 534 A A H > S+ 0 0 11 -2,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.843 86.4 54.7 -56.8 -39.0 -6.7 -0.1 22.1 180 535 A Q H > S+ 0 0 62 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.862 106.0 51.6 -67.1 -38.2 -3.4 -0.1 20.2 181 536 A L H > S+ 0 0 1 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.906 109.5 49.1 -65.1 -45.9 -1.4 -0.6 23.4 182 537 A W H X S+ 0 0 33 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.911 113.0 47.5 -61.2 -42.5 -3.5 -3.6 24.4 183 538 A N H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.891 111.3 51.1 -63.7 -37.9 -3.1 -5.1 21.0 184 539 A K H X S+ 0 0 19 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.930 111.3 47.8 -66.0 -45.5 0.6 -4.5 21.0 185 540 A L H X S+ 0 0 3 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 113.2 49.3 -55.6 -46.0 0.9 -6.2 24.4 186 541 A G H X S+ 0 0 0 -4,-2.4 4,-3.2 2,-0.2 -2,-0.2 0.954 110.4 48.0 -61.8 -55.1 -1.2 -9.1 23.1 187 542 A A H X S+ 0 0 0 -4,-2.9 4,-3.1 100,-0.2 99,-0.3 0.891 112.6 51.4 -47.0 -46.1 0.9 -9.6 19.9 188 543 A T H X S+ 0 0 0 -4,-2.1 4,-1.5 -5,-0.2 -2,-0.2 0.958 112.9 43.5 -58.0 -54.4 4.0 -9.5 22.1 189 544 A L H <>S+ 0 0 14 -4,-2.5 5,-2.5 2,-0.2 -2,-0.2 0.898 114.9 50.8 -59.2 -43.0 2.7 -12.1 24.5 190 545 A A H ><5S+ 0 0 6 -4,-3.2 3,-1.5 1,-0.2 -2,-0.2 0.944 110.9 46.0 -61.5 -51.8 1.4 -14.2 21.6 191 546 A N H 3<5S+ 0 0 38 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.743 109.4 58.4 -63.8 -22.7 4.7 -14.2 19.8 192 547 A G T 3<5S- 0 0 33 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 -0.006 123.4-103.9 -95.1 25.1 6.4 -15.0 23.1 193 548 A N T < 5S+ 0 0 145 -3,-1.5 -3,-0.2 1,-0.1 -2,-0.1 0.813 91.6 114.2 57.8 39.2 4.4 -18.2 23.5 194 549 A R >< + 0 0 30 -5,-2.5 4,-2.0 -8,-0.2 3,-0.3 -0.482 28.6 155.5-129.3 62.0 2.0 -16.9 26.1 195 550 A P H > + 0 0 28 0, 0.0 4,-1.8 0, 0.0 -5,-0.1 0.727 66.9 59.0 -67.4 -25.6 -1.3 -17.0 24.1 196 551 A Q H > S+ 0 0 141 2,-0.2 4,-1.2 1,-0.2 -6,-0.1 0.932 111.0 41.6 -68.3 -46.4 -3.7 -17.2 27.1 197 552 A E H > S+ 0 0 88 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.851 110.8 58.5 -64.6 -39.5 -2.4 -13.9 28.5 198 553 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.894 102.0 54.7 -55.9 -42.0 -2.4 -12.5 24.9 199 554 A L H X S+ 0 0 12 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.843 104.0 53.7 -67.4 -34.5 -6.1 -13.2 24.6 200 555 A D H X S+ 0 0 106 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.903 110.9 46.8 -62.5 -42.6 -6.9 -11.3 27.8 201 556 A A H X S+ 0 0 3 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.916 112.5 49.8 -64.6 -43.8 -5.0 -8.3 26.3 202 557 A Y H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.850 106.2 55.9 -62.2 -39.3 -6.9 -8.7 23.0 203 558 A N H X S+ 0 0 67 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.882 107.9 48.8 -60.8 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59.0 -62.3 -37.9 -9.8 -6.2 12.6 214 569 A R H 3> S+ 0 0 3 -154,-2.2 4,-2.8 2,-0.2 -1,-0.3 0.849 105.8 49.1 -56.6 -39.9 -6.1 -6.8 13.5 215 570 A V H <> S+ 0 0 0 -3,-0.7 4,-2.3 -155,-0.2 -2,-0.2 0.922 110.9 50.2 -67.9 -44.8 -7.1 -7.8 17.1 216 571 A M H X S+ 0 0 8 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.910 112.9 46.0 -56.2 -47.7 -9.8 -10.1 15.7 217 572 A Y H X S+ 0 0 43 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.960 111.4 52.1 -60.1 -50.6 -7.2 -11.7 13.4 218 573 A N H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.837 108.2 52.2 -54.0 -38.0 -4.6 -11.9 16.3 219 574 A M H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.907 106.9 51.7 -67.9 -43.5 -7.2 -13.7 18.4 220 575 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.922 111.2 50.5 -53.4 -43.6 -7.9 -16.2 15.7 221 576 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 63,-0.2 0.938 111.6 45.0 -61.9 -48.9 -4.1 -16.8 15.6 222 577 A S H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.893 114.1 49.1 -66.6 -40.6 -3.7 -17.3 19.4 223 578 A Y H <>S+ 0 0 33 -4,-2.6 5,-3.1 2,-0.2 -1,-0.2 0.895 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