==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 14-FEB-07 2OVJ . COMPND 2 MOLECULE: RAC GTPASE-ACTIVATING PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.SHRESTHA,E.PAPAGRIGORIOU,M.SOUNDARARAJAN,J.ELKINS,C.JOHANS . 201 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10268.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 68.7 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 . 5 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 48.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.5 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 0 0 0 1 0 0 2 3 0 0 0 0 0 1 1 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 1 346 A S 0 0 106 0, 0.0 3,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.0 3.7 10.2 23.9 2 347 A M + 0 0 192 1,-0.2 82,-0.1 2,-0.0 83,-0.1 0.226 360.0 107.1 -99.0 16.7 1.0 12.0 22.0 3 348 A E - 0 0 20 80,-0.4 -1,-0.2 1,-0.1 81,-0.1 0.858 62.1-163.8 -59.9 -40.5 2.5 11.2 18.6 4 349 A G - 0 0 17 79,-0.4 81,-2.2 -3,-0.3 82,-0.3 -0.417 37.9 -17.4 75.5-162.8 -0.2 8.6 17.7 5 350 A M > - 0 0 71 79,-0.2 3,-1.8 80,-0.2 4,-0.3 -0.442 58.6-116.1 -92.5 152.8 -0.1 6.0 14.9 6 351 A L G > S+ 0 0 6 1,-0.3 3,-2.5 80,-0.2 4,-0.2 0.841 110.5 66.9 -47.8 -42.8 2.4 6.0 12.0 7 352 A A G > S+ 0 0 63 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.777 88.1 65.7 -62.1 -20.0 -0.5 6.4 9.5 8 353 A D G < S+ 0 0 127 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.665 101.0 52.7 -70.3 -11.4 -1.2 9.9 10.8 9 354 A F G < S+ 0 0 57 -3,-2.5 10,-0.6 -4,-0.3 2,-0.3 0.307 101.8 67.7-109.1 6.4 2.3 10.9 9.4 10 355 A V < - 0 0 31 -3,-1.1 2,-0.1 -4,-0.2 6,-0.1 -0.793 69.1-131.8-122.8 162.7 1.9 9.6 5.8 11 356 A S - 0 0 75 2,-0.3 -2,-0.1 -2,-0.3 -1,-0.0 -0.341 37.1 -96.0 -98.5-171.8 -0.1 10.5 2.8 12 357 A Q S S+ 0 0 184 -2,-0.1 2,-0.3 2,-0.1 4,-0.1 0.596 95.9 93.3 -77.7 -15.1 -2.1 8.3 0.4 13 358 A T S S- 0 0 100 2,-0.1 -2,-0.3 1,-0.0 0, 0.0 -0.605 79.6 -83.0 -91.1 144.9 0.7 8.1 -2.1 14 359 A S S S+ 0 0 69 -2,-0.3 2,-0.1 2,-0.1 184,-0.1 -0.636 105.0 43.4 -97.1 151.8 3.3 5.3 -2.1 15 360 A P S S- 0 0 47 0, 0.0 2,-1.3 0, 0.0 -4,-0.1 0.553 81.7-148.8 -71.9 142.8 5.8 4.7 -0.7 16 361 A M + 0 0 32 106,-0.2 111,-0.4 -2,-0.1 -2,-0.1 -0.665 39.2 144.4 -87.8 90.2 4.2 5.8 2.5 17 362 A I - 0 0 27 -2,-1.3 -6,-0.2 109,-0.1 107,-0.1 -0.995 51.0-111.4-128.9 133.4 7.1 7.2 4.5 18 363 A P > - 0 0 1 0, 0.0 4,-2.2 0, 0.0 3,-0.5 -0.314 21.1-127.5 -66.9 148.2 7.0 10.1 7.0 19 364 A S H > S+ 0 0 76 -10,-0.6 4,-2.8 1,-0.3 5,-0.3 0.890 109.9 59.4 -62.1 -35.4 8.8 13.2 5.9 20 365 A I H > S+ 0 0 10 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.885 107.4 47.4 -58.1 -41.4 10.7 13.3 9.3 21 366 A V H > S+ 0 0 1 -3,-0.5 4,-2.5 2,-0.2 5,-0.3 0.949 112.5 47.2 -68.5 -44.2 12.0 9.9 8.4 22 367 A V H X S+ 0 0 58 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.925 114.9 46.9 -58.9 -45.3 13.1 10.8 4.9 23 368 A H H X S+ 0 0 71 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.884 111.8 49.2 -70.2 -38.6 14.7 14.0 6.1 24 369 A C H X S+ 0 0 0 -4,-2.2 4,-1.9 -5,-0.3 5,-0.2 0.950 113.4 46.2 -65.5 -47.6 16.6 12.4 8.9 25 370 A V H X S+ 0 0 7 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.909 107.6 59.6 -63.1 -39.7 18.0 9.6 6.7 26 371 A N H X S+ 0 0 74 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.930 107.1 44.9 -51.1 -50.4 18.9 12.1 4.1 27 372 A E H X S+ 0 0 22 -4,-1.8 4,-2.1 2,-0.2 5,-0.3 0.899 112.8 49.7 -65.6 -37.4 21.2 14.0 6.4 28 373 A I H X>S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.7 0.923 113.1 47.0 -68.4 -40.7 22.8 10.9 7.8 29 374 A E H <5S+ 0 0 46 -4,-2.9 4,-0.2 -5,-0.2 -2,-0.2 0.887 113.2 50.3 -64.4 -35.5 23.4 9.6 4.3 30 375 A Q H <5S- 0 0 143 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.843 138.1 -5.1 -73.7 -33.1 24.8 12.9 3.2 31 376 A R H <5S+ 0 0 77 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.332 116.8 74.3-150.8 11.4 27.3 13.4 6.1 32 377 A G T ><5S+ 0 0 0 -4,-2.6 3,-2.0 -5,-0.3 -3,-0.2 0.651 70.6 80.5 -97.2 -19.7 27.0 10.6 8.6 33 378 A L T 3 > S- 0 0 14 107,-2.2 3,-2.6 1,-0.2 4,-1.4 0.634 71.3-179.2 84.5 13.7 28.8 5.5 16.6 38 383 A L T <4 S+ 0 0 0 -3,-0.6 -1,-0.2 106,-0.3 4,-0.1 -0.289 74.1 9.0 -51.8 132.0 25.8 6.4 14.6 39 384 A Y T 34 S+ 0 0 0 2,-0.3 -1,-0.3 32,-0.1 -2,-0.1 0.292 123.3 70.0 74.7 -0.9 22.6 5.5 16.4 40 385 A R T <4 S+ 0 0 115 -3,-2.6 2,-0.4 2,-0.1 -2,-0.2 0.557 81.5 71.8-116.5 -17.0 24.6 4.7 19.6 41 386 A I S < S- 0 0 72 -4,-1.4 -2,-0.3 -5,-0.1 2,-0.3 -0.879 84.7-124.8 -95.6 133.6 25.8 8.1 20.7 42 387 A S - 0 0 97 -2,-0.4 30,-0.2 -4,-0.1 29,-0.1 -0.581 19.6-127.3 -79.4 140.1 23.0 10.3 22.1 43 388 A G - 0 0 11 28,-0.7 2,-0.1 -2,-0.3 -1,-0.1 -0.405 46.7 -73.9 -71.5 163.5 22.5 13.7 20.6 44 389 A C > - 0 0 64 1,-0.2 4,-2.3 -2,-0.1 5,-0.2 -0.405 46.3-136.3 -53.6 125.3 22.4 16.7 22.8 45 390 A D H > S+ 0 0 77 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.879 101.4 51.5 -57.2 -45.4 19.0 16.4 24.6 46 391 A R H > S+ 0 0 182 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 110.5 49.2 -59.8 -40.2 18.1 20.1 24.1 47 392 A T H > S+ 0 0 40 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.909 110.5 49.4 -65.8 -44.5 18.8 19.9 20.4 48 393 A V H X S+ 0 0 11 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.941 111.7 49.8 -60.2 -43.8 16.8 16.8 19.9 49 394 A K H X S+ 0 0 80 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.887 109.4 51.3 -62.1 -43.1 13.9 18.4 21.8 50 395 A E H X S+ 0 0 111 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.913 112.1 46.2 -61.7 -40.5 14.1 21.6 19.7 51 396 A L H X S+ 0 0 16 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.879 109.9 53.8 -70.4 -40.2 14.0 19.7 16.4 52 397 A K H X S+ 0 0 21 -4,-2.3 4,-3.3 1,-0.2 5,-0.4 0.921 106.8 53.5 -57.1 -44.3 11.1 17.5 17.7 53 398 A E H X>S+ 0 0 46 -4,-2.4 5,-2.3 1,-0.2 4,-2.1 0.891 106.6 51.6 -59.7 -44.8 9.2 20.8 18.4 54 399 A K H <>S+ 0 0 102 -4,-1.8 6,-2.3 3,-0.2 5,-0.7 0.946 118.1 36.1 -58.2 -46.0 9.7 22.0 14.9 55 400 A F H <5S+ 0 0 21 -4,-2.0 -2,-0.2 4,-0.2 -1,-0.2 0.930 129.9 29.6 -77.4 -42.7 8.4 18.8 13.3 56 401 A L H <5S+ 0 0 54 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.731 132.1 25.6 -97.5 -22.2 5.6 18.0 15.7 57 402 A R T <5S+ 0 0 212 -4,-2.1 -3,-0.2 -5,-0.4 -4,-0.1 0.780 131.7 32.9-104.5 -44.2 4.4 21.4 17.2 58 403 A V T + 0 0 134 1,-0.2 3,-1.7 2,-0.1 4,-0.2 -0.563 48.9 173.0 -79.8 81.2 16.8 22.9 8.5 64 409 A L G > S+ 0 0 5 -2,-1.9 3,-1.6 1,-0.3 -1,-0.2 0.756 70.4 72.6 -66.6 -22.9 18.6 19.6 9.3 65 410 A S G 3 S+ 0 0 80 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.674 98.0 50.6 -63.6 -15.8 21.4 20.5 7.0 66 411 A K G < S+ 0 0 84 -3,-1.7 2,-0.8 2,-0.0 -1,-0.3 0.418 81.3 106.6 -99.9 -1.9 22.4 23.1 9.6 67 412 A V < - 0 0 17 -3,-1.6 6,-0.1 -4,-0.2 -3,-0.0 -0.688 49.1-170.4 -84.0 109.9 22.4 20.6 12.6 68 413 A D + 0 0 149 -2,-0.8 2,-1.2 1,-0.1 -1,-0.2 0.758 68.7 78.6 -72.8 -28.9 26.0 20.0 13.4 69 414 A D >> - 0 0 49 1,-0.2 3,-1.2 2,-0.1 4,-1.0 -0.725 58.9-175.6 -82.1 93.1 25.4 17.2 15.9 70 415 A I H 3> S+ 0 0 2 -2,-1.2 4,-1.9 1,-0.3 3,-0.4 0.825 82.8 61.6 -60.4 -30.8 24.7 14.3 13.5 71 416 A H H 3> S+ 0 0 22 1,-0.2 4,-2.6 2,-0.2 -28,-0.7 0.774 95.4 59.8 -68.1 -25.8 23.9 12.2 16.6 72 417 A A H <> S+ 0 0 0 -3,-1.2 4,-2.1 -30,-0.2 -1,-0.2 0.853 104.9 49.4 -68.3 -32.2 21.0 14.5 17.4 73 418 A I H X S+ 0 0 0 -4,-1.0 4,-2.3 -3,-0.4 -2,-0.2 0.921 111.1 49.0 -71.2 -41.5 19.5 13.6 14.0 74 419 A C H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.940 113.9 47.4 -57.3 -48.2 20.0 9.8 14.8 75 420 A S H X S+ 0 0 18 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.902 109.0 53.1 -60.2 -38.5 18.4 10.4 18.2 76 421 A L H X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.934 109.7 49.2 -63.7 -46.6 15.5 12.4 16.6 77 422 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.943 114.1 45.0 -58.9 -48.8 14.8 9.5 14.2 78 423 A K H X S+ 0 0 22 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.914 112.1 52.1 -63.2 -43.9 14.8 6.9 17.0 79 424 A D H X S+ 0 0 39 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.945 108.8 49.9 -58.1 -46.6 12.7 9.1 19.2 80 425 A F H < S+ 0 0 2 -4,-2.6 4,-0.2 -5,-0.2 -1,-0.2 0.936 116.0 42.0 -59.6 -50.7 10.0 9.6 16.6 81 426 A L H >< S+ 0 0 1 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.937 114.1 50.8 -65.0 -40.8 9.8 5.9 15.8 82 427 A R H 3< S+ 0 0 119 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.810 108.6 53.0 -65.9 -31.1 9.9 4.7 19.5 83 428 A N T 3< S+ 0 0 51 -4,-2.1 -80,-0.4 -5,-0.2 -79,-0.4 0.334 78.4 122.5 -95.2 9.9 7.2 7.1 20.5 84 429 A L S < S- 0 0 12 -3,-1.4 -79,-0.2 -4,-0.2 4,-0.0 -0.312 79.2-109.7 -63.2 153.7 4.7 6.0 17.9 85 430 A K S S+ 0 0 148 -81,-2.2 -80,-0.2 1,-0.1 -1,-0.1 0.786 105.6 12.9 -62.9 -30.7 1.4 4.7 19.4 86 431 A E S S- 0 0 39 -82,-0.3 -80,-0.2 4,-0.0 -1,-0.1 -0.964 101.8 -90.5-134.4 157.8 2.3 1.2 18.4 87 432 A P > - 0 0 10 0, 0.0 3,-2.2 0, 0.0 72,-0.1 -0.221 37.7-106.7 -67.2 159.5 5.8 0.1 17.2 88 433 A L T 3 S+ 0 0 0 70,-0.4 72,-0.1 1,-0.3 40,-0.1 0.853 123.2 49.6 -53.2 -41.5 6.7 0.1 13.6 89 434 A L T 3 S- 0 0 1 70,-2.1 4,-0.4 1,-0.1 -1,-0.3 0.549 116.3-123.9 -78.7 -6.3 6.4 -3.7 13.4 90 435 A T <> - 0 0 4 -3,-2.2 4,-0.6 69,-0.2 -2,-0.1 0.435 9.7-100.3 84.3 151.3 3.0 -3.5 15.1 91 436 A F T >4 S+ 0 0 59 1,-0.2 3,-0.9 2,-0.2 4,-0.5 0.915 119.8 59.6 -62.4 -44.7 1.5 -5.0 18.3 92 437 A R T 34 S+ 0 0 156 1,-0.2 4,-0.3 2,-0.1 3,-0.2 0.870 114.4 32.6 -51.8 -43.0 -0.3 -7.6 16.1 93 438 A L T 3> S+ 0 0 12 -4,-0.4 4,-2.6 1,-0.2 5,-0.3 0.380 85.3 104.3-102.7 4.2 2.9 -9.0 14.6 94 439 A N H S+ 0 0 76 -4,-0.5 4,-3.0 1,-0.2 5,-0.3 0.871 113.0 56.4 -70.5 -35.5 5.4 -12.3 18.5 96 441 A A H > S+ 0 0 41 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.912 108.9 47.4 -60.7 -41.9 5.3 -13.4 14.9 97 442 A F H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.931 114.2 46.6 -63.2 -44.1 8.5 -11.4 14.1 98 443 A M H X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.3 -2,-0.2 0.945 114.4 46.8 -63.7 -47.2 10.2 -12.8 17.2 99 444 A E H X S+ 0 0 112 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.895 111.6 51.1 -66.4 -36.6 9.2 -16.3 16.5 100 445 A A H >< S+ 0 0 5 -4,-2.3 3,-0.9 -5,-0.3 13,-0.2 0.932 111.6 47.7 -62.1 -43.7 10.2 -16.0 12.8 101 446 A A H 3< S+ 0 0 2 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.792 107.3 57.9 -67.9 -29.1 13.7 -14.7 13.8 102 447 A E H 3< S+ 0 0 78 -4,-1.6 -1,-0.2 -5,-0.2 2,-0.2 0.533 72.6 114.2 -85.7 -8.8 14.1 -17.5 16.4 103 448 A I << - 0 0 61 -3,-0.9 6,-0.1 -4,-0.7 7,-0.0 -0.484 66.6-140.3 -61.3 129.4 13.7 -20.3 13.9 104 449 A T S S+ 0 0 140 -2,-0.2 2,-0.4 4,-0.1 -1,-0.1 0.849 79.2 75.9 -73.6 -36.6 17.2 -21.9 14.0 105 450 A D S > S- 0 0 74 1,-0.1 4,-2.2 2,-0.0 5,-0.2 -0.639 75.9-142.2 -74.4 128.2 17.7 -22.7 10.3 106 451 A E H > S+ 0 0 65 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.893 96.4 51.7 -58.3 -45.6 18.4 -19.5 8.3 107 452 A D H > S+ 0 0 126 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.900 113.2 41.6 -63.5 -45.6 16.4 -20.4 5.3 108 453 A N H > S+ 0 0 103 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.844 115.2 53.3 -68.8 -35.5 13.1 -21.3 7.1 109 454 A S H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.914 109.0 48.7 -62.9 -47.1 13.7 -18.2 9.3 110 455 A I H X S+ 0 0 25 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.918 109.8 51.9 -61.0 -43.7 14.0 -16.0 6.3 111 456 A A H X S+ 0 0 55 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.925 110.5 48.3 -58.3 -41.8 10.9 -17.5 4.7 112 457 A A H X S+ 0 0 20 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.855 108.6 54.8 -67.5 -35.1 9.0 -16.7 7.9 113 458 A M H X S+ 0 0 0 -4,-2.1 4,-2.7 -13,-0.2 5,-0.3 0.918 105.9 50.8 -63.4 -44.1 10.3 -13.2 8.0 114 459 A Y H X S+ 0 0 81 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.902 109.8 51.9 -60.4 -40.6 9.1 -12.5 4.5 115 460 A Q H X S+ 0 0 142 -4,-1.8 4,-0.5 -5,-0.2 -2,-0.2 0.933 110.8 46.5 -60.5 -42.3 5.7 -13.7 5.5 116 461 A A H >< S+ 0 0 6 -4,-2.1 3,-1.4 1,-0.2 4,-0.4 0.930 112.1 49.5 -67.5 -45.1 5.6 -11.5 8.5 117 462 A V H >< S+ 0 0 0 -4,-2.7 3,-1.5 1,-0.3 -1,-0.2 0.909 107.1 57.4 -59.5 -40.0 6.7 -8.4 6.5 118 463 A G H 3< S+ 0 0 46 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.624 102.3 55.4 -65.2 -15.1 4.1 -9.2 4.0 119 464 A E T << S+ 0 0 101 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.433 85.0 107.2 -96.3 -5.5 1.4 -9.0 6.7 120 465 A L S < S- 0 0 7 -3,-1.5 -31,-0.1 -4,-0.4 -30,-0.1 -0.454 82.0 -99.1 -67.9 151.4 2.3 -5.5 7.8 121 466 A P > - 0 0 62 0, 0.0 4,-2.3 0, 0.0 5,-0.2 -0.290 43.1-106.7 -58.0 153.4 0.1 -2.5 7.0 122 467 A Q H > S+ 0 0 72 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.893 116.3 50.8 -59.5 -42.9 1.5 -0.6 4.0 123 468 A A H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.926 112.0 48.6 -62.0 -41.6 2.9 2.4 5.9 124 469 A N H > S+ 0 0 10 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.920 113.6 46.3 -63.6 -42.5 4.7 0.2 8.3 125 470 A R H X S+ 0 0 45 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.928 114.1 46.7 -65.8 -44.5 6.1 -1.9 5.5 126 471 A D H X S+ 0 0 6 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.894 115.0 46.1 -65.1 -46.4 7.2 1.0 3.4 127 472 A T H X S+ 0 0 1 -4,-2.4 4,-2.4 -111,-0.4 -1,-0.2 0.920 113.3 50.0 -62.7 -44.3 8.8 2.9 6.3 128 473 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.3 -2,-0.2 0.921 109.8 51.5 -56.5 -48.1 10.5 -0.3 7.4 129 474 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.931 110.5 47.1 -59.7 -45.7 11.9 -0.9 3.9 130 475 A F H X S+ 0 0 41 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.932 113.6 49.3 -60.6 -46.2 13.3 2.6 3.6 131 476 A L H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.906 109.5 51.1 -63.9 -39.6 14.9 2.3 7.0 132 477 A M H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.902 105.9 54.5 -66.6 -40.4 16.4 -1.1 6.3 133 478 A I H X S+ 0 0 35 -4,-2.3 4,-1.2 -5,-0.2 -1,-0.2 0.944 113.8 44.3 -56.9 -44.0 18.0 0.1 3.1 134 479 A H H X S+ 0 0 2 -4,-2.0 4,-1.6 1,-0.2 3,-0.4 0.935 112.0 49.1 -63.1 -52.2 19.6 2.9 5.1 135 480 A L H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.855 104.7 58.9 -65.1 -32.7 20.7 0.8 8.0 136 481 A Q H X S+ 0 0 20 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.907 106.7 50.0 -55.0 -41.3 22.3 -1.8 5.8 137 482 A R H X S+ 0 0 120 -4,-1.2 4,-1.7 -3,-0.4 -2,-0.2 0.851 106.1 54.4 -68.1 -36.1 24.5 1.1 4.4 138 483 A V H < S+ 0 0 0 -4,-1.6 8,-0.4 1,-0.2 6,-0.3 0.923 111.6 45.6 -63.6 -43.6 25.5 2.2 8.0 139 484 A A H < S+ 0 0 25 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.873 112.7 51.1 -65.8 -35.4 26.6 -1.4 8.7 140 485 A Q H < S+ 0 0 140 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.775 86.9 96.1 -74.6 -26.7 28.5 -1.6 5.3 141 486 A S >< - 0 0 19 -4,-1.7 3,-0.9 1,-0.2 5,-0.4 -0.507 66.6-150.7 -68.8 127.2 30.4 1.7 5.8 142 487 A P T 3 S+ 0 0 108 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.597 89.4 60.4 -74.5 -10.2 33.8 0.9 7.2 143 488 A H T 3 S+ 0 0 106 -110,-0.5 -109,-0.1 1,-0.2 -2,-0.1 0.610 89.0 66.8 -90.3 -17.0 34.0 4.2 9.0 144 489 A T S < S- 0 0 0 -3,-0.9 -107,-2.2 -6,-0.3 -106,-0.3 0.640 85.4-141.5 -78.5 -18.7 31.0 4.0 11.3 145 490 A K + 0 0 92 -4,-0.3 2,-0.4 1,-0.2 -6,-0.1 0.858 62.1 125.8 55.2 34.9 32.3 1.2 13.4 146 491 A M - 0 0 14 -5,-0.4 -1,-0.2 -8,-0.4 2,-0.2 -0.996 39.3-173.3-125.7 127.0 28.8 -0.2 13.4 147 492 A D > - 0 0 83 -2,-0.4 4,-1.9 -3,-0.1 5,-0.2 -0.557 45.0 -91.9-106.1 174.8 27.8 -3.7 12.4 148 493 A V H > S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.893 126.4 51.5 -58.0 -38.0 24.4 -5.2 12.0 149 494 A A H > S+ 0 0 44 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.889 107.3 53.0 -67.5 -36.5 24.3 -6.4 15.6 150 495 A N H > S+ 0 0 55 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.879 114.1 43.0 -62.4 -41.9 25.2 -2.9 16.9 151 496 A L H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 3,-0.4 0.884 112.0 53.0 -69.3 -43.6 22.3 -1.5 15.0 152 497 A A H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.843 100.6 63.5 -60.6 -33.0 20.0 -4.3 16.0 153 498 A K H < S+ 0 0 133 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.883 116.1 28.2 -58.5 -43.5 20.8 -3.7 19.7 154 499 A V H X S+ 0 0 28 -4,-0.8 4,-0.8 -3,-0.4 -2,-0.2 0.788 118.9 54.5 -96.9 -25.9 19.3 -0.2 19.6 155 500 A F H X>S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.7 0.716 93.6 74.4 -79.2 -16.8 16.7 -0.6 16.8 156 501 A G H X>S+ 0 0 0 -4,-1.8 5,-2.3 -5,-0.3 4,-1.8 0.977 104.0 35.5 -56.3 -57.3 15.2 -3.6 18.7 157 502 A P H 45S+ 0 0 53 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.821 118.9 55.5 -61.8 -27.9 13.6 -1.3 21.3 158 503 A T H <5S+ 0 0 4 -4,-0.8 -70,-0.4 1,-0.1 -2,-0.2 0.919 126.8 8.4 -75.5 -46.4 12.9 1.3 18.6 159 504 A I H <5S+ 0 0 0 -4,-2.7 -70,-2.1 -72,-0.1 -69,-0.2 0.642 133.4 40.1-116.4 -16.9 10.9 -0.7 16.0 160 505 A V T < - 0 0 82 1,-0.1 4,-2.8 4,-0.0 5,-0.2 -0.329 40.3-107.1 -62.5 154.4 4.9 -6.2 32.9 169 514 A P H > S+ 0 0 89 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.740 118.2 52.1 -63.0 -25.8 8.6 -5.6 33.6 170 515 A V H > S+ 0 0 106 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.945 111.9 45.0 -75.3 -47.2 9.6 -9.3 33.3 171 516 A T H > S+ 0 0 46 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.900 111.1 57.2 -55.2 -41.9 7.9 -9.7 29.9 172 517 A M H X S+ 0 0 65 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.935 107.9 45.1 -54.4 -50.3 9.6 -6.4 29.1 173 518 A L H X S+ 0 0 110 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.902 112.9 50.6 -62.5 -41.5 13.0 -7.9 29.9 174 519 A Q H X S+ 0 0 62 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.923 111.7 48.6 -63.5 -44.0 12.2 -11.1 27.9 175 520 A D H >X S+ 0 0 1 -4,-3.0 4,-1.7 1,-0.2 3,-0.7 0.936 107.6 54.9 -57.3 -48.2 11.1 -8.9 24.9 176 521 A I H 3< S+ 0 0 73 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.856 105.5 53.0 -58.0 -35.0 14.3 -6.9 25.2 177 522 A K H 3< S+ 0 0 129 -4,-1.8 4,-0.3 1,-0.2 -1,-0.3 0.816 115.5 41.2 -66.6 -29.1 16.3 -10.1 24.9 178 523 A R H X S+ 0 0 2 -4,-1.7 4,-1.5 1,-0.2 3,-0.6 0.886 85.5 58.5 -63.4 -44.5 14.2 -7.9 19.8 180 525 A P H 3> S+ 0 0 26 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.907 100.1 56.6 -60.1 -37.8 17.7 -7.6 18.3 181 526 A K H 3> S+ 0 0 96 -4,-0.3 4,-2.3 1,-0.2 5,-0.2 0.874 103.6 55.9 -58.8 -37.0 17.6 -10.9 16.5 182 527 A V H X S+ 0 0 40 -4,-2.3 3,-0.6 -5,-0.2 4,-0.5 0.938 112.1 50.4 -65.9 -43.9 17.2 -11.0 10.4 186 531 A L H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.907 109.4 51.0 -56.4 -43.5 15.5 -8.0 8.7 187 532 A L H 3< S+ 0 0 8 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.722 103.5 60.7 -67.9 -21.2 18.8 -6.4 7.9 188 533 A S H << S+ 0 0 71 -4,-1.1 -1,-0.3 -3,-0.6 -2,-0.2 0.588 80.9 102.2 -80.6 -13.6 20.0 -9.7 6.3 189 534 A L S << S- 0 0 2 -3,-1.2 5,-0.1 -4,-0.5 -3,-0.0 -0.439 87.4 -87.0 -73.2 147.4 17.2 -9.6 3.7 190 535 A P >> - 0 0 54 0, 0.0 4,-2.0 0, 0.0 3,-0.8 -0.174 20.4-127.2 -64.0 149.0 18.4 -8.5 0.3 191 536 A L H 3> S+ 0 0 97 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.894 112.7 56.9 -51.9 -41.3 18.6 -4.9 -0.9 192 537 A E H 3> S+ 0 0 152 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.826 104.5 52.6 -66.2 -29.1 16.6 -5.9 -3.9 193 538 A Y H X4 S+ 0 0 31 -3,-0.8 3,-0.6 2,-0.2 4,-0.4 0.948 113.4 41.3 -68.9 -51.1 13.8 -7.2 -1.7 194 539 A W H >< S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.2 4,-0.2 0.882 109.1 61.0 -65.6 -35.0 13.5 -4.0 0.3 195 540 A S H >< S+ 0 0 25 -4,-2.7 3,-1.9 1,-0.3 4,-0.3 0.776 88.9 71.3 -62.8 -27.8 13.9 -1.8 -2.8 196 541 A Q G X< S+ 0 0 78 -4,-0.9 3,-0.9 -3,-0.6 5,-0.3 0.766 90.8 59.2 -64.1 -23.6 10.8 -3.2 -4.4 197 542 A F G < S+ 0 0 45 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.589 97.7 61.7 -83.4 -6.6 8.6 -1.4 -1.9 198 543 A M G < S+ 0 0 43 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.2 0.510 115.2 8.8 -88.1 -6.7 10.0 2.0 -3.0 199 544 A M S < S- 0 0 105 -3,-0.9 2,-0.6 -4,-0.3 0, 0.0 -0.877 83.9 -87.4-157.1 179.3 8.8 1.8 -6.6 200 545 A V 0 0 149 -2,-0.3 -3,-0.1 -3,-0.0 -4,-0.0 -0.929 360.0 360.0-108.3 109.1 6.7 -0.2 -9.1 201 546 A E 0 0 177 -2,-0.6 -2,-0.0 -5,-0.3 -5,-0.0 -0.685 360.0 360.0-104.5 360.0 8.8 -3.0 -10.7