==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 15-MAR-12 4E67 . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PLK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.SLEDZ,M.HYVONEN,Y.S.TAN,S.LANG,D.SPRING,C.ABELL,R.B.BEST . 219 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10816.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 70.8 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 . 65 29.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 15 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 50 22.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 0 0 1 0 0 0 0 1 0 0 0 0 1 0 1 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 . 1 1 0 3 6 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 2 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 1 374 A L > 0 0 38 0, 0.0 4,-1.9 0, 0.0 210,-0.1 0.000 360.0 360.0 360.0 -40.1 5.7 3.4 -14.2 2 375 A S H > + 0 0 73 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.900 360.0 46.6 -69.1 -42.4 9.1 2.0 -15.3 3 376 A D H > S+ 0 0 104 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.809 109.5 55.1 -69.1 -32.0 7.5 -0.0 -18.1 4 377 A M H > S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.920 107.4 49.7 -65.6 -43.6 5.5 3.0 -19.2 5 378 A L H X S+ 0 0 28 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.886 112.9 47.5 -59.9 -40.9 8.7 5.0 -19.5 6 379 A Q H X S+ 0 0 134 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.879 109.5 52.4 -69.8 -40.8 10.2 2.2 -21.6 7 380 A Q H X S+ 0 0 40 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.896 112.6 46.3 -60.2 -41.6 7.1 1.9 -23.8 8 381 A L H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.884 109.5 52.5 -70.9 -42.2 7.3 5.6 -24.5 9 382 A H H X S+ 0 0 81 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.924 109.3 51.8 -57.2 -44.8 11.0 5.6 -25.2 10 383 A S H X S+ 0 0 53 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.912 114.5 40.7 -59.0 -47.6 10.4 2.8 -27.8 11 384 A V H < S+ 0 0 1 -4,-1.8 3,-0.4 2,-0.2 -2,-0.2 0.909 116.4 49.3 -69.7 -43.5 7.7 4.7 -29.6 12 385 A N H >< S+ 0 0 32 -4,-3.0 3,-1.7 1,-0.2 -2,-0.2 0.892 106.6 55.5 -64.4 -39.2 9.4 8.1 -29.5 13 386 A A H 3< S+ 0 0 88 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.759 98.1 63.9 -65.6 -24.5 12.7 6.7 -30.8 14 387 A S T 3< S- 0 0 12 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.514 101.5-136.6 -75.6 -4.9 10.9 5.3 -33.8 15 388 A K X - 0 0 19 -3,-1.7 3,-1.3 -4,-0.2 -3,-0.1 0.950 24.5-169.2 45.9 66.8 10.1 8.9 -34.8 16 389 A P T 3 S+ 0 0 14 0, 0.0 176,-1.0 0, 0.0 3,-0.4 0.740 76.7 46.0 -63.0 -27.9 6.5 8.1 -35.7 17 390 A S T 3 S+ 0 0 35 174,-0.2 177,-0.2 1,-0.2 3,-0.2 0.529 113.2 48.1 -91.7 -6.9 5.6 11.4 -37.4 18 391 A E S < S+ 0 0 131 -3,-1.3 -1,-0.2 1,-0.1 3,-0.1 -0.131 86.8 78.5-133.3 39.9 8.7 11.7 -39.5 19 392 A R S S- 0 0 172 1,-0.4 2,-0.2 -3,-0.4 -1,-0.1 -0.147 96.5 -80.3-141.8 46.6 9.4 8.4 -41.4 20 393 A G S S+ 0 0 62 -3,-0.2 -1,-0.4 2,-0.0 2,-0.3 -0.637 94.2 23.8 101.0-154.4 7.1 8.2 -44.4 21 394 A L - 0 0 146 -2,-0.2 2,-0.5 -3,-0.1 -3,-0.1 -0.319 67.3-145.2 -59.7 113.0 3.5 7.1 -44.9 22 395 A V + 0 0 53 -2,-0.3 169,-0.2 -5,-0.1 3,-0.1 -0.705 19.9 179.0 -80.2 122.5 1.6 7.6 -41.6 23 396 A R > + 0 0 109 167,-2.9 3,-1.3 -2,-0.5 4,-0.4 -0.445 16.9 156.1-120.8 57.1 -1.0 4.9 -41.2 24 397 A Q G > + 0 0 33 1,-0.3 3,-1.9 2,-0.2 4,-0.5 0.820 65.7 61.5 -57.2 -41.1 -2.4 6.0 -37.8 25 398 A E G > S+ 0 0 73 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.824 98.5 58.7 -55.2 -34.5 -5.8 4.3 -38.1 26 399 A E G < S+ 0 0 97 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.596 99.2 59.1 -74.0 -11.2 -4.1 0.9 -38.4 27 400 A A G < S+ 0 0 0 -3,-1.9 156,-1.9 -4,-0.4 -1,-0.2 0.546 79.0 114.4 -92.7 -10.8 -2.6 1.5 -34.9 28 401 A E B < -A 182 0A 80 -3,-1.1 154,-0.3 -4,-0.5 3,-0.1 -0.413 43.4-174.2 -60.9 129.4 -6.0 1.9 -33.3 29 402 A D > - 0 0 27 152,-2.9 3,-1.9 -2,-0.1 -1,-0.1 -0.810 8.8-178.6-128.6 90.0 -6.7 -0.9 -30.8 30 403 A P G > S+ 0 0 95 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.585 79.6 71.0 -63.1 -12.8 -10.3 -0.5 -29.5 31 404 A A G 3 S+ 0 0 85 1,-0.2 -3,-0.0 150,-0.1 -2,-0.0 0.734 93.1 57.0 -71.1 -24.0 -9.7 -3.6 -27.2 32 405 A C G < S+ 0 0 12 -3,-1.9 -1,-0.2 149,-0.1 150,-0.1 0.238 70.0 140.5 -99.0 11.1 -7.4 -1.4 -25.1 33 406 A I < - 0 0 54 -3,-0.8 148,-0.0 148,-0.1 138,-0.0 -0.350 59.8-109.9 -52.5 126.1 -10.0 1.3 -24.2 34 407 A P - 0 0 11 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.264 15.3-150.7 -64.2 148.6 -9.3 2.2 -20.5 35 408 A I S S+ 0 0 137 1,-0.2 2,-0.4 -3,-0.1 -2,-0.1 0.811 83.2 37.9 -81.1 -35.6 -11.8 1.2 -17.9 36 409 A F + 0 0 47 19,-0.1 2,-0.3 18,-0.1 -1,-0.2 -0.963 61.2 146.4-128.5 129.5 -10.8 4.1 -15.7 37 410 A W - 0 0 11 -2,-0.4 18,-1.8 -3,-0.1 2,-0.6 -0.924 51.4 -93.8-141.7 170.4 -9.8 7.8 -16.3 38 411 A V E +G 54 0B 0 -2,-0.3 16,-0.2 16,-0.2 3,-0.1 -0.809 35.5 177.4 -89.1 119.4 -10.3 11.1 -14.5 39 412 A S E + 0 0 3 14,-2.4 81,-2.0 -2,-0.6 2,-0.3 0.738 67.1 7.0 -91.7 -28.6 -13.4 12.9 -15.8 40 413 A K E -G 53 0B 16 13,-1.5 13,-2.4 79,-0.2 2,-0.3 -0.980 63.2-176.8-150.5 155.4 -13.2 16.0 -13.5 41 414 A W E -G 52 0B 4 -2,-0.3 178,-2.3 11,-0.3 2,-0.4 -0.992 13.6-156.1-154.4 156.3 -10.9 17.6 -10.9 42 415 A V E -GH 51 218B 12 9,-2.8 9,-2.1 -2,-0.3 2,-1.1 -0.976 11.0-151.1-134.8 120.3 -10.6 20.5 -8.5 43 416 A D E +GH 50 217B 4 174,-3.0 174,-1.2 -2,-0.4 7,-0.2 -0.801 39.6 143.5 -90.8 97.9 -7.3 21.8 -7.2 44 417 A Y E >>> +G 49 0B 55 5,-1.9 4,-2.8 -2,-1.1 3,-1.5 -0.171 25.3 127.5-119.2 33.8 -8.1 23.2 -3.8 45 418 A S T 345 + 0 0 34 1,-0.3 5,-0.1 3,-0.3 -1,-0.1 0.675 53.1 78.0 -73.0 -17.5 -4.7 22.1 -2.4 46 419 A D T 345S+ 0 0 99 3,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.751 122.3 4.0 -58.0 -23.5 -3.9 25.6 -1.0 47 420 A K T <45S+ 0 0 120 -3,-1.5 -2,-0.2 2,-0.2 -1,-0.1 0.664 145.2 2.1-124.4 -47.2 -6.3 24.6 1.9 48 421 A Y T <5S- 0 0 73 -4,-2.8 16,-2.4 1,-0.3 2,-0.3 0.796 93.7-100.7-120.6 -51.4 -7.6 21.1 1.6 49 422 A G E < -GI 44 63B 0 -5,-1.3 -5,-1.9 14,-0.3 2,-0.5 -0.989 48.7 -44.3 152.4-158.7 -6.3 19.0 -1.3 50 423 A L E -GI 43 62B 0 12,-2.5 12,-2.9 -2,-0.3 2,-0.3 -0.947 44.0-164.1-117.2 122.4 -7.2 17.7 -4.7 51 424 A G E +GI 42 61B 0 -9,-2.1 -9,-2.8 -2,-0.5 2,-0.3 -0.739 12.5 175.3 -99.7 151.5 -10.7 16.3 -5.5 52 425 A Y E -GI 41 60B 2 8,-2.7 8,-3.0 -2,-0.3 2,-0.4 -0.992 24.3-141.6-151.8 154.1 -11.5 14.2 -8.6 53 426 A Q E -GI 40 59B 7 -13,-2.4 -14,-2.4 -2,-0.3 -13,-1.5 -0.976 20.3-142.3-116.1 132.4 -14.3 12.3 -10.3 54 427 A L E > -G 38 0B 0 4,-2.5 3,-2.2 -2,-0.4 -16,-0.2 -0.474 34.2 -98.9 -83.8 166.6 -13.5 9.1 -12.2 55 428 A C T 3 S+ 0 0 19 -18,-1.8 -17,-0.1 1,-0.3 -1,-0.1 0.672 122.4 61.2 -61.1 -19.0 -15.4 8.2 -15.4 56 429 A D T 3 S- 0 0 39 -19,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.352 120.4-107.3 -88.6 5.2 -17.7 5.9 -13.4 57 430 A N S < S+ 0 0 81 -3,-2.2 -2,-0.1 1,-0.3 2,-0.1 0.428 77.0 136.7 77.2 3.0 -19.0 8.9 -11.4 58 431 A S - 0 0 1 16,-0.0 -4,-2.5 -5,-0.0 2,-0.3 -0.430 44.4-142.0 -67.3 155.3 -17.1 7.7 -8.3 59 432 A V E -IJ 53 71B 2 12,-2.7 12,-2.5 -6,-0.2 2,-0.3 -0.901 18.4-175.4-125.9 150.6 -15.3 10.5 -6.5 60 433 A G E -IJ 52 70B 0 -8,-3.0 -8,-2.7 -2,-0.3 2,-0.4 -0.973 10.1-159.7-141.1 157.6 -12.0 10.8 -4.7 61 434 A V E -IJ 51 69B 0 8,-2.1 8,-1.9 -2,-0.3 2,-0.7 -0.989 7.8-159.2-137.0 129.3 -9.9 13.3 -2.7 62 435 A L E -IJ 50 68B 20 -12,-2.9 -12,-2.5 -2,-0.4 6,-0.2 -0.932 28.5-152.4-100.3 103.8 -6.2 13.3 -2.0 63 436 A F E > -I 49 0B 9 4,-2.4 3,-1.7 -2,-0.7 -14,-0.3 -0.318 25.0-108.4 -74.6 160.6 -6.0 15.5 1.1 64 437 A N T 3 S+ 0 0 90 -16,-2.4 -15,-0.1 1,-0.3 -1,-0.1 0.642 117.2 63.0 -62.6 -18.9 -3.0 17.6 2.1 65 438 A D T 3 S- 0 0 74 -17,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.252 120.9-107.0 -90.8 12.4 -2.1 15.2 5.0 66 439 A S S < S+ 0 0 41 -3,-1.7 2,-0.3 1,-0.3 -2,-0.1 0.658 79.8 129.5 68.5 20.9 -1.6 12.5 2.4 67 440 A T - 0 0 8 -4,-0.1 -4,-2.4 17,-0.1 2,-0.4 -0.697 45.5-145.5 -96.9 158.8 -4.8 10.7 3.3 68 441 A R E -JK 62 81B 38 13,-2.4 13,-2.7 -2,-0.3 2,-0.4 -0.983 11.1-166.4-129.7 135.6 -7.4 9.6 0.7 69 442 A L E -JK 61 80B 0 -8,-1.9 -8,-2.1 -2,-0.4 2,-0.5 -0.986 10.5-170.2-118.5 129.0 -11.2 9.4 0.8 70 443 A I E -JK 60 79B 1 9,-3.0 9,-2.5 -2,-0.4 2,-0.6 -0.970 6.2-164.4-125.3 116.5 -12.9 7.5 -2.0 71 444 A L E -JK 59 78B 2 -12,-2.5 -12,-2.7 -2,-0.5 7,-0.2 -0.901 18.7-138.0-101.2 117.4 -16.7 7.6 -2.5 72 445 A Y > - 0 0 61 5,-2.5 3,-2.0 -2,-0.6 4,-0.1 -0.232 30.2-100.3 -66.3 160.9 -18.0 4.8 -4.8 73 446 A N T 3 S+ 0 0 98 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.543 114.5 75.7 -67.5 -7.7 -20.7 5.7 -7.4 74 447 A D T 3 S- 0 0 100 3,-0.1 -1,-0.3 1,-0.0 -16,-0.0 0.671 105.1-125.3 -74.3 -15.0 -23.5 4.3 -5.2 75 448 A G S < S+ 0 0 18 -3,-2.0 -2,-0.1 2,-0.2 3,-0.0 0.429 93.7 50.9 91.8 1.1 -23.1 7.5 -3.2 76 449 A D S S+ 0 0 57 16,-0.1 16,-2.4 -4,-0.1 17,-0.1 0.594 74.6 98.9-134.8 -42.7 -22.6 5.8 0.2 77 450 A S E - L 0 91B 41 14,-0.2 -5,-2.5 15,-0.1 2,-0.4 -0.353 57.3-165.5 -60.6 126.2 -19.9 3.2 0.0 78 451 A L E -KL 71 90B 2 12,-3.3 12,-3.0 -7,-0.2 2,-0.4 -0.910 21.6-167.6-122.4 141.9 -16.6 4.6 1.3 79 452 A Q E -KL 70 89B 4 -9,-2.5 -9,-3.0 -2,-0.4 2,-0.4 -0.989 11.0-168.4-119.9 137.0 -12.9 3.7 1.2 80 453 A Y E -KL 69 88B 29 8,-2.9 8,-3.3 -2,-0.4 2,-0.5 -0.992 3.2-166.9-125.3 133.5 -10.4 5.6 3.4 81 454 A I E -KL 68 87B 1 -13,-2.7 -13,-2.4 -2,-0.4 6,-0.2 -0.962 10.7-152.7-124.1 113.9 -6.6 5.3 3.1 82 455 A E > - 0 0 70 4,-2.4 3,-1.0 -2,-0.5 -16,-0.0 -0.030 35.8 -94.5 -70.5 178.6 -4.3 6.6 5.8 83 456 A R T 3 S+ 0 0 188 1,-0.2 -1,-0.1 2,-0.1 -17,-0.0 0.902 124.7 54.5 -64.0 -42.7 -0.8 7.9 5.4 84 457 A D T 3 S- 0 0 120 1,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.425 123.9-103.0 -74.3 1.7 0.8 4.5 6.3 85 458 A G < + 0 0 42 -3,-1.0 2,-0.3 1,-0.3 -2,-0.1 0.395 67.7 155.4 91.7 -1.2 -1.3 2.9 3.5 86 459 A T - 0 0 62 -5,-0.1 -4,-2.4 1,-0.1 2,-0.4 -0.452 31.2-150.9 -60.4 116.5 -3.9 1.4 5.9 87 460 A E E -L 81 0B 88 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.796 12.2-168.9 -97.9 133.1 -7.1 0.9 3.9 88 461 A S E -L 80 0B 45 -8,-3.3 -8,-2.9 -2,-0.4 2,-0.5 -0.980 7.8-154.8-123.4 133.9 -10.5 1.1 5.5 89 462 A Y E +L 79 0B 153 -2,-0.4 -10,-0.2 -10,-0.2 2,-0.2 -0.928 39.5 114.9-110.1 127.2 -13.8 0.1 4.0 90 463 A L E -L 78 0B 36 -12,-3.0 -12,-3.3 -2,-0.5 2,-0.3 -0.741 53.5 -96.7-157.8-159.7 -17.1 1.6 5.3 91 464 A T E > -L 77 0B 33 -14,-0.3 3,-0.6 -2,-0.2 -14,-0.2 -0.921 24.9-118.4-132.0 165.5 -19.9 3.9 4.3 92 465 A V G > S+ 0 0 21 -16,-2.4 3,-1.7 -2,-0.3 -1,-0.1 0.921 117.1 57.8 -62.3 -45.9 -20.7 7.6 4.7 93 466 A S G 3 S+ 0 0 93 1,-0.3 -1,-0.2 -17,-0.1 -16,-0.1 0.594 114.4 38.1 -61.6 -11.6 -23.8 6.6 6.7 94 467 A S G < S+ 0 0 73 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.102 84.3 140.1-127.2 22.2 -21.5 4.7 9.1 95 468 A H < - 0 0 46 -3,-1.7 2,-0.2 1,-0.1 -3,-0.1 -0.332 54.7-113.0 -71.8 146.4 -18.5 7.0 9.4 96 469 A P > - 0 0 67 0, 0.0 3,-1.9 0, 0.0 4,-0.1 -0.519 31.9-110.3 -71.2 149.5 -16.7 7.5 12.7 97 470 A N G > S+ 0 0 147 1,-0.3 3,-1.5 2,-0.2 4,-0.3 0.737 113.9 69.4 -49.7 -28.9 -17.0 11.1 14.1 98 471 A S G 3 S+ 0 0 106 1,-0.3 3,-0.3 2,-0.1 4,-0.3 0.787 95.7 51.9 -63.5 -31.2 -13.3 11.6 13.3 99 472 A L G <> S+ 0 0 13 -3,-1.9 4,-2.4 1,-0.2 -1,-0.3 0.281 79.5 106.9 -88.9 10.9 -13.8 11.6 9.6 100 473 A M H <> S+ 0 0 89 -3,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.920 78.1 45.3 -56.8 -54.3 -16.6 14.2 9.8 101 474 A K H > S+ 0 0 144 -3,-0.3 4,-2.5 -4,-0.3 -1,-0.2 0.927 114.9 48.4 -55.1 -49.1 -14.6 17.1 8.3 102 475 A K H > S+ 0 0 35 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.860 110.5 49.9 -65.9 -38.9 -13.2 15.0 5.4 103 476 A I H X S+ 0 0 7 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.918 110.9 50.4 -64.1 -44.2 -16.6 13.6 4.5 104 477 A T H X S+ 0 0 81 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.926 111.0 49.3 -57.9 -47.2 -18.1 17.1 4.4 105 478 A L H X S+ 0 0 18 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.910 110.6 50.0 -59.2 -45.4 -15.2 18.3 2.2 106 479 A L H X S+ 0 0 1 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.925 110.8 48.9 -59.3 -47.4 -15.7 15.3 -0.2 107 480 A K H X S+ 0 0 77 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.862 112.2 49.2 -63.0 -39.0 -19.4 16.0 -0.5 108 481 A Y H X S+ 0 0 125 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.940 114.5 44.2 -60.5 -51.2 -18.8 19.7 -1.2 109 482 A F H X S+ 0 0 4 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.869 112.1 54.7 -61.9 -39.3 -16.2 18.8 -3.8 110 483 A R H X S+ 0 0 72 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.916 108.4 48.0 -60.2 -48.1 -18.5 16.2 -5.2 111 484 A N H X S+ 0 0 85 -4,-2.2 4,-1.9 2,-0.2 5,-0.2 0.905 111.4 48.8 -61.8 -48.1 -21.4 18.7 -5.6 112 485 A Y H X S+ 0 0 78 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.942 114.3 45.9 -57.6 -48.8 -19.3 21.3 -7.4 113 486 A M H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.922 114.3 47.0 -62.5 -47.0 -17.8 18.8 -9.8 114 487 A S H < S+ 0 0 52 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.817 123.1 33.7 -63.2 -32.9 -21.1 17.1 -10.7 115 488 A E H < S+ 0 0 130 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.773 129.1 26.4 -98.2 -30.3 -22.9 20.5 -11.2 116 489 A H H < S+ 0 0 109 -4,-2.7 2,-0.3 -5,-0.2 -3,-0.2 0.416 103.7 74.9-121.5 -0.8 -20.4 22.8 -12.7 117 490 A L S < S- 0 0 11 -4,-1.4 104,-0.3 -5,-0.3 2,-0.3 -0.898 73.0-116.6-122.6 149.7 -17.8 20.8 -14.5 118 491 A L - 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