==== 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 3CVN . COMPND 2 MOLECULE: PEROXISOME TARGETING SIGNAL 1 RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA BRUCEI; . AUTHOR P.SAMPATHKUMAR,C.ROACH,P.A.M MICHELS,W.G.J.HOL . 305 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13899.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 76.7 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 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 177 58.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 0 1 1 1 0 0 0 1 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 0 124 0, 0.0 41,-0.0 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 165.0 1.2 9.5 -7.5 2 337 A D + 0 0 95 67,-0.1 67,-0.1 2,-0.0 68,-0.1 0.334 360.0 92.5-100.2 0.7 2.7 6.5 -5.7 3 338 A Y S S- 0 0 6 66,-0.1 2,-1.8 67,-0.0 63,-0.0 -0.855 79.0-130.7-103.5 129.5 -0.4 5.8 -3.7 4 339 A P - 0 0 73 0, 0.0 3,-0.1 0, 0.0 251,-0.0 -0.553 31.6-160.9 -80.5 77.7 -2.9 3.3 -5.2 5 340 A F - 0 0 41 -2,-1.8 2,-0.1 1,-0.1 30,-0.0 -0.275 26.9-101.1 -59.8 138.2 -6.1 5.5 -4.9 6 341 A E - 0 0 18 1,-0.1 -1,-0.1 2,-0.1 3,-0.1 -0.412 30.1-142.3 -58.5 132.2 -9.4 3.6 -5.1 7 342 A A S S+ 0 0 99 1,-0.2 2,-1.5 -2,-0.1 -1,-0.1 0.964 89.5 54.8 -65.4 -57.7 -10.9 4.1 -8.6 8 343 A N S S+ 0 0 78 245,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.639 75.5 176.5 -87.3 91.0 -14.6 4.4 -7.8 9 344 A N > + 0 0 16 -2,-1.5 3,-2.1 1,-0.2 4,-0.3 -0.743 17.4 179.6-107.9 86.6 -14.3 7.3 -5.4 10 345 A P G >> S+ 0 0 62 0, 0.0 3,-1.4 0, 0.0 4,-0.5 0.774 81.2 61.7 -58.9 -30.5 -17.7 8.5 -4.2 11 346 A Y G 34 S+ 0 0 22 1,-0.3 9,-0.1 2,-0.2 -2,-0.0 0.571 84.8 76.8 -73.3 -10.0 -16.2 11.2 -1.9 12 347 A M G <4 S+ 0 0 88 -3,-2.1 -1,-0.3 1,-0.2 24,-0.0 0.676 96.7 50.3 -65.5 -16.1 -14.6 12.8 -5.0 13 348 A Y T <4 S+ 0 0 206 -3,-1.4 -2,-0.2 -4,-0.3 -1,-0.2 0.816 92.4 91.8 -88.4 -34.7 -18.1 14.2 -5.6 14 349 A H S < S- 0 0 84 -4,-0.5 -3,-0.0 1,-0.1 0, 0.0 0.164 74.8-123.7 -68.3 179.0 -19.0 15.6 -2.2 15 350 A E S S+ 0 0 190 1,-0.2 3,-0.1 2,-0.1 -1,-0.1 0.921 98.5 15.6 -90.1 -51.6 -18.4 19.2 -0.9 16 351 A N >> + 0 0 81 1,-0.1 4,-2.1 2,-0.1 3,-0.6 -0.532 63.0 159.4-126.4 69.4 -16.3 18.7 2.2 17 352 A P H 3> S+ 0 0 19 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.785 76.2 61.0 -61.8 -25.4 -14.8 15.2 2.3 18 353 A M H 3> S+ 0 0 12 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.914 108.0 43.4 -66.1 -42.4 -12.1 16.3 4.7 19 354 A E H <> S+ 0 0 48 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.909 114.0 51.3 -66.0 -42.7 -14.7 17.2 7.3 20 355 A E H X S+ 0 0 65 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.885 107.6 52.8 -63.7 -41.6 -16.6 14.0 6.5 21 356 A G H X S+ 0 0 0 -4,-2.9 4,-1.3 2,-0.2 -1,-0.2 0.924 110.2 46.9 -57.3 -48.4 -13.4 11.9 7.0 22 357 A L H X S+ 0 0 96 -4,-1.8 4,-0.7 1,-0.2 3,-0.3 0.910 113.6 49.7 -60.9 -42.5 -12.7 13.4 10.4 23 358 A S H >X S+ 0 0 73 -4,-2.2 4,-2.1 1,-0.2 3,-1.4 0.947 107.8 53.9 -56.1 -50.8 -16.4 12.8 11.3 24 359 A M H 3X S+ 0 0 21 -4,-2.8 4,-1.3 1,-0.3 9,-0.2 0.660 95.3 66.7 -69.4 -18.2 -16.2 9.2 10.1 25 360 A L H 3< S+ 0 0 71 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.846 115.1 30.6 -61.8 -34.8 -13.2 8.4 12.4 26 361 A K H << S+ 0 0 97 -3,-1.4 -2,-0.2 -4,-0.7 -1,-0.1 0.841 131.8 29.4 -91.2 -35.4 -15.6 9.0 15.3 27 362 A L H < S+ 0 0 85 -4,-2.1 -3,-0.2 2,-0.1 -2,-0.1 0.431 125.4 7.5-113.3 -1.1 -19.0 7.9 13.9 28 363 A A S < S- 0 0 53 -4,-1.3 2,-0.3 -5,-0.2 -3,-0.1 0.067 95.3 -43.4-145.2-110.2 -18.4 5.2 11.3 29 364 A N > - 0 0 27 1,-0.1 4,-2.0 -2,-0.0 5,-0.1 -0.916 32.8-118.0-142.1 166.7 -15.3 3.2 10.1 30 365 A L H > S+ 0 0 8 187,-0.4 4,-2.6 -2,-0.3 5,-0.2 0.919 112.0 55.0 -65.0 -44.7 -11.7 3.5 9.1 31 366 A A H > S+ 0 0 14 217,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.899 109.9 44.5 -59.7 -48.4 -12.3 2.3 5.5 32 367 A E H > S+ 0 0 60 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.935 114.5 50.2 -61.6 -47.9 -14.9 5.0 4.8 33 368 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 -9,-0.2 -2,-0.2 0.849 109.4 50.9 -56.4 -40.7 -12.7 7.7 6.5 34 369 A A H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.896 108.3 52.6 -68.1 -38.5 -9.7 6.6 4.4 35 370 A L H X S+ 0 0 29 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.919 110.5 47.7 -60.8 -42.5 -11.8 6.9 1.2 36 371 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.907 113.7 46.4 -63.8 -42.5 -12.8 10.5 2.2 37 372 A F H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.874 107.9 58.3 -69.0 -36.0 -9.1 11.4 3.0 38 373 A E H X S+ 0 0 9 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.905 103.6 53.2 -56.4 -45.2 -8.1 9.8 -0.3 39 374 A A H X S+ 0 0 4 -4,-1.9 4,-2.0 2,-0.2 5,-0.2 0.901 109.8 46.5 -56.2 -46.0 -10.5 12.2 -2.1 40 375 A V H X S+ 0 0 8 -4,-1.6 4,-3.1 2,-0.2 -2,-0.2 0.933 111.7 51.1 -64.1 -44.3 -8.9 15.2 -0.5 41 376 A C H < S+ 0 0 1 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.878 111.7 48.6 -59.4 -43.8 -5.4 13.9 -1.3 42 377 A Q H < S+ 0 0 74 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.862 119.9 35.7 -60.4 -44.6 -6.3 13.4 -5.0 43 378 A A H < S+ 0 0 81 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.785 135.5 21.5 -83.5 -32.0 -7.9 16.8 -5.4 44 379 A A >< + 0 0 17 -4,-3.1 3,-2.1 -5,-0.2 -1,-0.2 -0.607 63.6 169.6-139.8 70.6 -5.5 18.8 -3.2 45 380 A P T 3 S+ 0 0 66 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.553 75.0 69.9 -62.6 -10.9 -2.2 16.9 -2.8 46 381 A E T 3 S+ 0 0 131 1,-0.0 2,-0.9 2,-0.0 3,-0.1 0.503 75.6 96.9 -80.1 -5.6 -0.6 19.9 -1.2 47 382 A R <> - 0 0 107 -3,-2.1 4,-1.4 -7,-0.2 3,-0.4 -0.761 50.5-179.4 -88.4 104.4 -2.8 19.3 1.9 48 383 A E H > S+ 0 0 24 -2,-0.9 4,-2.6 1,-0.2 -1,-0.2 0.625 78.8 65.2 -86.2 -14.4 -0.6 17.4 4.3 49 384 A E H > S+ 0 0 34 2,-0.2 4,-2.2 3,-0.2 -1,-0.2 0.820 104.3 48.6 -66.8 -34.7 -3.3 17.2 6.9 50 385 A A H > S+ 0 0 0 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.906 114.2 43.8 -68.3 -46.6 -5.1 15.1 4.3 51 386 A W H X S+ 0 0 2 -4,-1.4 4,-2.9 2,-0.2 -2,-0.2 0.923 114.7 50.6 -63.7 -46.7 -2.1 12.9 3.8 52 387 A R H X S+ 0 0 76 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.919 113.0 45.1 -55.6 -50.4 -1.4 12.7 7.5 53 388 A S H X S+ 0 0 12 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.890 112.7 51.2 -64.5 -39.9 -5.0 11.7 8.3 54 389 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.951 112.8 47.0 -59.8 -47.3 -5.0 9.2 5.4 55 390 A G H X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.907 112.2 47.0 -63.9 -49.2 -1.8 7.7 6.8 56 391 A L H X S+ 0 0 53 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.884 114.0 49.6 -58.2 -41.2 -2.8 7.4 10.4 57 392 A T H X S+ 0 0 2 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.955 107.0 53.8 -65.6 -49.0 -6.1 5.9 9.4 58 393 A Q H <>S+ 0 0 3 -4,-2.6 5,-2.1 1,-0.2 -1,-0.2 0.832 104.5 54.5 -58.1 -37.8 -4.6 3.3 7.1 59 394 A A H ><5S+ 0 0 12 -4,-1.7 3,-1.6 1,-0.2 -1,-0.2 0.929 110.3 46.0 -62.2 -46.7 -2.2 2.0 9.9 60 395 A E H 3<5S+ 0 0 31 -4,-1.5 160,-2.5 1,-0.3 161,-0.2 0.762 107.8 60.7 -60.6 -25.9 -5.3 1.4 12.2 61 396 A N T 3<5S- 0 0 1 -4,-1.6 -1,-0.3 158,-0.2 -2,-0.2 0.259 123.3-106.5 -88.9 11.2 -6.9 -0.2 9.2 62 397 A E T < 5S+ 0 0 31 -3,-1.6 -3,-0.2 -5,-0.2 -2,-0.1 0.836 87.4 117.5 72.3 37.4 -4.1 -2.9 9.0 63 398 A K >< + 0 0 32 -5,-2.1 4,-2.0 -6,-0.1 5,-0.1 -0.570 25.5 161.4-137.2 66.3 -2.5 -1.3 5.9 64 399 A D H > S+ 0 0 5 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.818 74.9 57.0 -57.2 -38.6 1.1 -0.2 6.9 65 400 A G H > S+ 0 0 37 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.936 111.5 41.9 -61.5 -47.8 2.3 -0.0 3.3 66 401 A L H > S+ 0 0 38 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.837 113.1 56.2 -66.6 -32.0 -0.4 2.4 2.4 67 402 A A H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.938 108.0 47.0 -63.3 -46.0 0.2 4.2 5.7 68 403 A I H X S+ 0 0 19 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.940 110.2 51.8 -62.8 -47.9 3.9 4.7 4.9 69 404 A I H X S+ 0 0 45 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.938 115.7 42.1 -56.0 -48.8 3.2 6.0 1.3 70 405 A A H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 3,-0.3 0.907 113.6 51.3 -62.9 -48.5 0.7 8.6 2.6 71 406 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.814 102.9 59.2 -63.5 -29.8 2.9 9.6 5.6 72 407 A N H X S+ 0 0 54 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.865 105.4 50.9 -68.9 -33.8 5.9 10.2 3.4 73 408 A H H X S+ 0 0 48 -4,-1.2 4,-2.4 -3,-0.3 -2,-0.2 0.942 111.5 46.4 -60.6 -50.2 3.8 12.7 1.5 74 409 A A H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.908 109.7 55.2 -60.8 -44.2 2.9 14.4 4.8 75 410 A R H < S+ 0 0 130 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.865 109.5 46.6 -52.0 -44.3 6.6 14.3 5.9 76 411 A M H < S+ 0 0 154 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.926 114.8 46.0 -68.0 -45.5 7.7 16.1 2.8 77 412 A L H < S+ 0 0 76 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.801 133.1 14.8 -69.6 -30.6 4.9 18.8 3.1 78 413 A D >< - 0 0 57 -4,-2.4 3,-1.9 -5,-0.2 -1,-0.3 -0.675 61.3-175.7-149.1 91.2 5.6 19.3 6.8 79 414 A P T 3 S+ 0 0 93 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.542 85.0 58.4 -65.4 -5.1 8.8 17.9 8.2 80 415 A K T 3 + 0 0 56 4,-0.0 2,-1.0 5,-0.0 3,-0.1 0.234 65.9 122.0-112.8 6.6 7.7 19.0 11.7 81 416 A D <> - 0 0 14 -3,-1.9 4,-1.5 1,-0.2 3,-0.2 -0.643 45.6-165.9 -75.0 104.0 4.5 17.1 12.0 82 417 A I H > S+ 0 0 60 -2,-1.0 4,-2.1 1,-0.2 3,-0.3 0.923 83.4 53.9 -61.1 -48.2 5.3 15.1 15.1 83 418 A A H > S+ 0 0 45 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.847 103.7 57.1 -59.7 -34.6 2.4 12.6 14.7 84 419 A V H > S+ 0 0 0 -3,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 108.1 47.0 -61.8 -44.8 3.6 11.8 11.2 85 420 A H H X S+ 0 0 9 -4,-1.5 4,-2.1 -3,-0.3 23,-0.2 0.894 111.1 52.1 -61.8 -42.2 7.1 10.8 12.5 86 421 A A H X S+ 0 0 30 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.908 110.2 47.4 -60.6 -46.4 5.5 8.7 15.2 87 422 A A H X S+ 0 0 15 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.855 111.7 51.2 -65.6 -37.0 3.2 6.8 12.8 88 423 A L H X S+ 0 0 1 -4,-2.0 4,-2.3 -5,-0.2 5,-0.2 0.873 106.9 53.1 -66.2 -41.3 6.2 6.1 10.5 89 424 A A H X S+ 0 0 0 -4,-2.1 4,-1.3 15,-0.2 -2,-0.2 0.925 113.8 44.5 -56.6 -45.3 8.3 4.8 13.4 90 425 A V H X S+ 0 0 9 -4,-1.9 4,-2.2 2,-0.2 218,-0.3 0.941 115.8 43.8 -68.6 -51.2 5.4 2.4 14.2 91 426 A S H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.884 113.5 50.9 -65.3 -41.2 4.7 1.2 10.6 92 427 A H H <>S+ 0 0 17 -4,-2.3 5,-3.0 2,-0.2 -1,-0.2 0.807 109.2 52.5 -64.6 -29.3 8.3 0.8 9.7 93 428 A T H ><5S+ 0 0 9 -4,-1.3 3,-1.7 -5,-0.2 -2,-0.2 0.948 110.3 47.6 -70.4 -44.2 8.9 -1.3 12.8 94 429 A N H 3<5S+ 0 0 12 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.841 113.3 48.9 -59.5 -35.6 6.0 -3.5 11.8 95 430 A E T 3<5S- 0 0 85 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.376 112.6-120.3 -87.4 2.5 7.5 -3.7 8.3 96 431 A H T < 5 + 0 0 155 -3,-1.7 2,-0.8 1,-0.2 -3,-0.2 0.880 63.6 144.5 55.2 41.4 10.9 -4.6 9.7 97 432 A N >< + 0 0 66 -5,-3.0 4,-2.1 1,-0.2 -1,-0.2 -0.803 22.9 177.8-101.7 86.4 12.6 -1.5 8.1 98 433 A A H > S+ 0 0 28 -2,-0.8 4,-2.4 1,-0.2 5,-0.2 0.915 73.3 48.2 -66.1 -44.6 15.1 -0.9 10.9 99 434 A N H > S+ 0 0 103 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.918 115.0 45.4 -57.8 -50.0 16.9 2.1 9.4 100 435 A A H > S+ 0 0 31 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.852 112.2 52.5 -60.9 -37.4 13.7 4.0 8.5 101 436 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 -9,-0.2 -2,-0.2 0.946 112.2 44.1 -67.2 -49.0 12.1 3.2 12.0 102 437 A L H X S+ 0 0 4 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.895 112.9 52.4 -62.3 -42.2 15.1 4.6 13.9 103 438 A A H X S+ 0 0 54 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.901 111.3 47.8 -58.8 -38.6 15.2 7.6 11.5 104 439 A S H X S+ 0 0 8 -4,-2.1 4,-2.6 2,-0.2 -15,-0.2 0.855 110.4 50.2 -74.9 -35.8 11.5 8.3 12.2 105 440 A L H X S+ 0 0 5 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.929 112.2 48.1 -64.6 -44.7 11.9 7.9 16.0 106 441 A R H X S+ 0 0 96 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.946 114.2 46.6 -60.0 -48.1 14.8 10.4 15.9 107 442 A A H X S+ 0 0 29 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.895 109.1 56.0 -59.2 -46.3 12.7 12.8 13.7 108 443 A W H < S+ 0 0 12 -4,-2.6 -1,-0.2 -23,-0.2 4,-0.2 0.921 113.1 40.2 -48.8 -49.0 9.8 12.3 16.1 109 444 A L H >< S+ 0 0 2 -4,-2.1 3,-1.4 1,-0.2 6,-0.3 0.965 118.0 45.2 -70.5 -51.2 11.8 13.5 19.1 110 445 A L H 3< S+ 0 0 29 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.585 99.5 68.1 -77.1 -9.2 13.8 16.3 17.5 111 446 A S T 3< S+ 0 0 25 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.1 0.552 84.3 90.9 -81.6 -6.9 10.8 17.9 15.7 112 447 A Q S X> S- 0 0 22 -3,-1.4 3,-2.3 -4,-0.2 4,-1.1 -0.805 75.1-143.8 -93.3 123.7 9.5 18.8 19.1 113 448 A P T 34 S+ 0 0 101 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.833 101.0 60.7 -52.8 -36.2 10.6 22.3 20.4 114 449 A Q T 34 S+ 0 0 105 1,-0.2 -4,-0.1 2,-0.1 -5,-0.0 0.606 120.6 23.9 -64.7 -19.1 10.8 20.9 23.9 115 450 A Y T X4 S+ 0 0 0 -3,-2.3 3,-2.1 -6,-0.3 -1,-0.2 0.350 89.4 106.6-127.2 1.6 13.5 18.4 22.8 116 451 A E G >< S+ 0 0 126 -4,-1.1 3,-1.9 -3,-0.4 4,-0.2 0.780 71.4 64.8 -65.2 -30.1 15.0 20.0 19.7 117 452 A Q G > S+ 0 0 137 -4,-0.4 3,-0.9 1,-0.3 -1,-0.3 0.568 83.1 77.6 -70.0 -8.9 18.3 21.0 21.4 118 453 A L G X S+ 0 0 6 -3,-2.1 3,-1.1 1,-0.2 -1,-0.3 0.731 79.7 72.9 -67.2 -19.0 19.0 17.3 21.8 119 454 A G G < S+ 0 0 41 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.757 98.3 45.5 -64.4 -25.5 19.9 17.4 18.0 120 455 A S G < S+ 0 0 107 -3,-0.9 -1,-0.2 -4,-0.2 2,-0.2 0.376 89.0 113.3 -99.6 2.4 23.1 19.3 18.9 121 456 A V < - 0 0 73 -3,-1.1 2,-0.6 -4,-0.2 -3,-0.0 -0.480 65.1-129.7 -80.7 143.1 24.3 17.1 21.9 122 457 A N 0 0 102 -2,-0.2 -2,-0.1 0, 0.0 -1,-0.0 -0.848 360.0 360.0 -87.6 121.7 27.4 14.9 21.8 123 458 A L 0 0 113 -2,-0.6 12,-0.1 0, 0.0 16,-0.0 -0.718 360.0 360.0-104.1 360.0 26.3 11.4 23.0 124 ! 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 0.0 125 474 A F 0 0 88 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 103.4 22.1 -5.9 21.3 126 475 A F > + 0 0 30 1,-0.1 3,-1.2 4,-0.1 7,-0.2 -0.741 360.0 168.9-121.1 81.1 21.1 -4.5 17.9 127 476 A F T 3 + 0 0 176 -2,-0.5 -1,-0.1 1,-0.3 4,-0.1 0.614 64.4 68.3 -81.5 -13.2 24.1 -5.3 15.8 128 477 A A T 3 S+ 0 0 93 1,-0.2 -1,-0.3 2,-0.1 -2,-0.0 0.506 128.0 2.3 -78.1 -13.5 22.6 -4.5 12.3 129 478 A A S <> S+ 0 0 3 -3,-1.2 4,-2.2 -31,-0.0 -1,-0.2 -0.167 78.0 160.6-166.5 66.8 22.6 -0.7 13.2 130 479 A P H > S+ 0 0 58 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.801 74.8 45.4 -71.3 -34.5 24.1 -0.3 16.6 131 480 A N H > S+ 0 0 124 2,-0.2 4,-2.6 3,-0.2 5,-0.2 0.893 114.5 48.5 -73.2 -40.0 25.0 3.4 16.5 132 481 A E H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.941 116.5 45.0 -61.0 -44.4 21.7 4.4 15.0 133 482 A Y H X S+ 0 0 6 -4,-2.2 4,-2.7 -7,-0.2 -2,-0.2 0.953 113.5 48.2 -64.8 -53.3 20.0 2.3 17.7 134 483 A R H X S+ 0 0 156 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.874 109.5 53.6 -53.2 -46.6 22.1 3.6 20.5 135 484 A E H X S+ 0 0 59 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.933 111.3 44.9 -57.4 -49.0 21.6 7.2 19.5 136 485 A C H X S+ 0 0 3 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.930 114.4 49.1 -58.4 -48.7 17.8 6.8 19.5 137 486 A R H X S+ 0 0 78 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.904 115.1 44.6 -58.9 -43.7 17.9 5.0 22.8 138 487 A T H X S+ 0 0 54 -4,-3.0 4,-3.0 2,-0.2 -2,-0.2 0.906 111.4 52.1 -68.9 -45.0 20.2 7.7 24.4 139 488 A L H X S+ 0 0 3 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.865 112.0 47.3 -55.7 -42.2 18.2 10.6 22.9 140 489 A L H X S+ 0 0 4 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.852 112.6 48.5 -72.8 -34.7 15.0 9.1 24.4 141 490 A H H X S+ 0 0 83 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.925 110.7 50.9 -64.5 -47.3 16.6 8.5 27.8 142 491 A A H X S+ 0 0 14 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.912 110.3 50.3 -55.5 -44.1 17.9 12.1 27.7 143 492 A A H X S+ 0 0 0 -4,-2.1 4,-4.0 1,-0.2 -1,-0.2 0.876 106.4 55.5 -62.2 -37.7 14.4 13.2 27.0 144 493 A L H < S+ 0 0 26 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.895 105.9 50.8 -66.9 -36.9 13.1 11.1 29.9 145 494 A E H < S+ 0 0 163 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.894 115.9 42.2 -67.3 -37.2 15.5 13.0 32.2 146 495 A M H < S+ 0 0 86 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.918 136.8 17.0 -61.2 -47.9 14.1 16.2 30.8 147 496 A N S >< S+ 0 0 46 -4,-4.0 3,-1.0 -5,-0.1 -1,-0.2 -0.794 71.6 176.8-136.4 90.2 10.6 14.8 30.9 148 497 A P T 3 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.651 78.3 36.6 -75.3 -25.7 10.1 11.8 33.2 149 498 A N T 3 S+ 0 0 107 -5,-0.0 2,-0.7 4,-0.0 3,-0.1 -0.157 76.5 138.2-117.6 32.0 6.4 11.0 33.1 150 499 A D <> - 0 0 19 -3,-1.0 4,-1.7 1,-0.2 3,-0.4 -0.754 43.9-154.3 -79.6 114.4 5.9 11.9 29.4 151 500 A A H > S+ 0 0 2 -2,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.809 90.0 52.0 -61.8 -36.4 3.7 9.1 28.2 152 501 A Q H > S+ 0 0 56 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.772 104.3 56.6 -77.6 -28.3 4.8 9.3 24.6 153 502 A L H > S+ 0 0 0 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.933 111.1 44.3 -61.8 -47.7 8.5 9.1 25.5 154 503 A H H X S+ 0 0 8 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.917 113.9 50.1 -62.4 -42.7 7.7 5.8 27.2 155 504 A A H X S+ 0 0 5 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.914 110.4 50.2 -61.8 -42.1 5.6 4.7 24.3 156 505 A S H X S+ 0 0 9 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.832 108.4 51.5 -68.3 -34.5 8.4 5.6 21.9 157 506 A L H X S+ 0 0 1 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.841 106.0 57.3 -63.8 -33.5 10.9 3.6 23.9 158 507 A G H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.927 108.5 46.0 -64.1 -43.2 8.4 0.7 23.7 159 508 A V H >X S+ 0 0 6 -4,-1.8 4,-2.1 2,-0.2 3,-0.9 0.979 111.5 50.4 -60.4 -57.2 8.6 1.0 19.9 160 509 A L H 3X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.3 3,-0.2 0.913 112.2 49.0 -44.4 -50.4 12.4 1.2 19.9 161 510 A Y H 3<>S+ 0 0 23 -4,-2.9 5,-2.6 1,-0.2 -1,-0.3 0.714 105.5 55.6 -71.5 -23.2 12.5 -1.9 22.1 162 511 A N H X<5S+ 0 0 10 -4,-1.5 3,-1.2 -3,-0.9 -1,-0.2 0.860 103.0 58.3 -67.6 -37.3 10.1 -3.9 19.9 163 512 A L H 3<5S+ 0 0 19 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.840 112.0 39.5 -61.9 -34.8 12.5 -3.2 17.0 164 513 A S T 3<5S- 0 0 12 -4,-1.0 -1,-0.3 2,-0.1 -2,-0.2 0.306 112.6-115.3-100.5 9.7 15.3 -4.9 19.0 165 514 A N T < 5 + 0 0 107 -3,-1.2 2,-1.2 1,-0.2 -3,-0.2 0.777 70.0 139.5 65.0 29.6 13.2 -7.8 20.4 166 515 A N >< + 0 0 55 -5,-2.6 4,-2.2 1,-0.2 -1,-0.2 -0.630 20.8 165.6-102.4 72.8 13.7 -6.5 24.0 167 516 A Y H > + 0 0 51 -2,-1.2 4,-2.7 1,-0.2 -1,-0.2 0.764 64.5 56.8 -67.8 -30.7 10.1 -7.3 24.8 168 517 A D H > S+ 0 0 113 2,-0.2 4,-2.4 -3,-0.2 -1,-0.2 0.929 112.5 40.7 -64.6 -49.1 10.3 -7.0 28.6 169 518 A S H > S+ 0 0 49 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.882 115.9 53.1 -65.1 -39.7 11.7 -3.5 28.5 170 519 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 -9,-0.2 5,-0.2 0.953 110.8 45.2 -58.2 -52.9 9.2 -2.7 25.8 171 520 A A H X S+ 0 0 1 -4,-2.7 4,-3.5 1,-0.2 5,-0.2 0.917 110.1 54.4 -59.0 -46.5 6.3 -3.9 27.8 172 521 A A H X S+ 0 0 60 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.877 113.5 42.9 -58.1 -37.1 7.5 -2.1 31.0 173 522 A N H X S+ 0 0 25 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.905 115.2 47.5 -76.0 -39.5 7.6 1.2 29.0 174 523 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.907 108.6 56.3 -69.2 -36.4 4.3 0.6 27.2 175 524 A R H X S+ 0 0 68 -4,-3.5 4,-2.1 2,-0.2 -1,-0.2 0.910 107.7 47.7 -57.9 -46.1 2.7 -0.4 30.5 176 525 A R H X S+ 0 0 101 -4,-1.5 4,-2.2 -5,-0.2 -1,-0.2 0.906 108.4 56.5 -61.9 -43.0 3.7 3.0 32.1 177 526 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.925 109.7 43.7 -52.6 -48.6 2.4 4.7 29.0 178 527 A V H < S+ 0 0 8 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.854 108.5 58.5 -71.2 -28.8 -1.1 3.2 29.4 179 528 A E H < S+ 0 0 134 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.920 112.8 41.0 -63.6 -38.7 -0.9 3.9 33.2 180 529 A L H < S+ 0 0 61 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.801 132.9 22.9 -73.4 -36.0 -0.5 7.6 32.2 181 530 A R >< + 0 0 111 -4,-1.9 3,-1.6 -5,-0.2 -1,-0.2 -0.590 68.3 165.8-135.0 71.9 -3.1 7.4 29.4 182 531 A P T 3 S+ 0 0 62 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.484 75.0 55.6 -72.6 -6.3 -5.5 4.5 30.1 183 532 A D T 3 S+ 0 0 118 -5,-0.0 2,-0.8 31,-0.0 -5,-0.1 0.209 78.6 109.8-105.6 11.1 -8.1 5.6 27.5 184 533 A D <> - 0 0 42 -3,-1.6 4,-1.8 1,-0.2 3,-0.3 -0.783 51.7-165.9 -92.5 110.2 -5.6 5.7 24.6 185 534 A A H > S+ 0 0 9 -2,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.813 85.1 55.5 -72.8 -30.8 -6.5 2.8 22.4 186 535 A Q H > S+ 0 0 56 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.866 106.6 52.3 -66.8 -36.6 -3.3 2.9 20.4 187 536 A L H > S+ 0 0 1 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.907 109.2 48.6 -68.8 -42.9 -1.3 2.5 23.6 188 537 A W H X S+ 0 0 48 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.931 112.7 48.8 -60.5 -44.9 -3.3 -0.5 24.7 189 538 A N H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.941 110.9 50.1 -58.4 -45.8 -2.8 -2.1 21.2 190 539 A K H X S+ 0 0 20 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.916 111.9 47.2 -58.7 -45.2 0.9 -1.4 21.3 191 540 A L H X S+ 0 0 5 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.922 114.1 49.5 -61.5 -45.2 1.2 -2.9 24.8 192 541 A G H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.927 110.9 47.5 -57.7 -49.7 -0.8 -5.9 23.5 193 542 A A H X S+ 0 0 0 -4,-3.3 4,-2.4 1,-0.2 113,-0.3 0.875 112.5 50.7 -62.6 -38.6 1.3 -6.4 20.4 194 543 A T H X S+ 0 0 1 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.910 112.1 46.1 -64.2 -47.3 4.4 -6.2 22.5 195 544 A L H <>S+ 0 0 2 -4,-2.4 5,-3.1 2,-0.2 -2,-0.2 0.923 112.8 50.2 -60.6 -46.7 3.1 -8.8 24.9 196 545 A A H ><5S+ 0 0 12 -4,-3.0 3,-1.7 3,-0.2 -2,-0.2 0.959 113.5 43.9 -58.2 -52.9 2.0 -11.1 22.2 197 546 A N H 3<5S+ 0 0 38 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.807 108.6 59.1 -66.2 -28.5 5.3 -11.0 20.3 198 547 A G T 3<5S- 0 0 18 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.072 124.4-108.3 -82.7 23.3 7.0 -11.4 23.7 199 548 A N T < 5S+ 0 0 146 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.2 0.789 87.2 120.9 56.5 36.3 5.1 -14.6 24.0 200 549 A R >< + 0 0 94 -5,-3.1 4,-2.1 -8,-0.2 5,-0.1 -0.636 29.0 162.6-119.1 68.2 2.7 -13.5 26.7 201 550 A P H > + 0 0 35 0, 0.0 4,-1.9 0, 0.0 -5,-0.1 0.762 66.9 54.1 -66.1 -27.6 -0.6 -14.0 24.6 202 551 A Q H > S+ 0 0 138 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.939 112.2 41.7 -73.1 -49.9 -3.0 -14.0 27.6 203 552 A E H > S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.885 113.9 55.8 -57.8 -42.3 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