==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 12-NOV-12 4HY2 . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PLK1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.C.LEE,J.H.SONG,H.Y.KIM . 221 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11148.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 156 70.6 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 . 64 29.0 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 . 2 0.9 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 . 17 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 52 23.5 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 0 1 0 0 0 1 1 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 . 2 0 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 1 373 A H > 0 0 96 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -21.2 -4.8 -10.1 13.1 2 374 A L H > + 0 0 5 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.892 360.0 52.6 -63.8 -40.8 -6.1 -6.5 13.7 3 375 A S H > S+ 0 0 71 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.881 108.9 50.7 -61.7 -38.7 -9.5 -7.8 14.7 4 376 A D H > S+ 0 0 76 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.889 110.8 48.3 -66.5 -39.8 -7.8 -10.1 17.2 5 377 A M H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.907 106.7 57.5 -66.4 -41.2 -5.9 -7.2 18.6 6 378 A L H X S+ 0 0 24 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.881 109.7 44.7 -56.5 -40.4 -9.1 -5.2 18.8 7 379 A Q H X S+ 0 0 129 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.895 109.5 54.3 -72.3 -40.2 -10.6 -7.9 21.1 8 380 A Q H X S+ 0 0 30 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.918 113.6 43.9 -59.6 -41.3 -7.4 -8.2 23.2 9 381 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.934 108.6 55.6 -68.8 -47.4 -7.6 -4.5 23.8 10 382 A H H X S+ 0 0 89 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.902 110.5 49.0 -49.8 -43.6 -11.4 -4.5 24.5 11 383 A S H X S+ 0 0 46 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.934 112.5 43.5 -64.1 -51.3 -10.7 -7.1 27.1 12 384 A V H < S+ 0 0 0 -4,-1.9 3,-0.3 1,-0.2 4,-0.3 0.924 117.2 47.1 -62.9 -44.6 -7.9 -5.3 28.9 13 385 A N H >< S+ 0 0 33 -4,-3.1 3,-1.9 1,-0.2 -2,-0.2 0.901 107.6 55.7 -64.5 -40.7 -9.7 -1.9 28.8 14 386 A A H 3< S+ 0 0 70 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.812 99.6 62.2 -61.4 -29.3 -13.0 -3.5 30.0 15 387 A S T 3< S- 0 0 36 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.577 101.7-136.5 -73.1 -9.9 -11.1 -4.8 33.1 16 388 A K <> - 0 0 102 -3,-1.9 4,-0.7 -4,-0.3 3,-0.5 0.955 23.0-166.5 50.2 59.0 -10.3 -1.2 34.1 17 389 A P T 4 S+ 0 0 10 0, 0.0 176,-1.4 0, 0.0 -1,-0.1 0.689 81.3 30.3 -48.4 -30.1 -6.7 -2.1 34.9 18 390 A S T 4 S+ 0 0 36 174,-0.2 177,-0.2 176,-0.1 5,-0.1 0.642 97.8 90.1-106.3 -17.8 -5.9 1.1 36.8 19 391 A E T 4 S- 0 0 110 -3,-0.5 2,-0.2 175,-0.1 -3,-0.1 0.913 98.2 -22.3 -44.0 -70.8 -9.3 1.9 38.1 20 392 A R S < S+ 0 0 188 -4,-0.7 -1,-0.1 2,-0.1 0, 0.0 -0.815 93.0 59.2-139.4-180.0 -9.2 0.1 41.5 21 393 A G S S- 0 0 57 -2,-0.2 2,-0.5 2,-0.1 170,-0.0 0.236 96.3 -49.8 77.7 153.2 -7.6 -2.6 43.4 22 394 A L - 0 0 145 1,-0.1 2,-0.5 2,-0.1 -2,-0.1 -0.440 60.8-135.9 -61.9 110.4 -3.9 -2.9 44.2 23 395 A V + 0 0 51 -2,-0.5 169,-0.2 -5,-0.1 3,-0.2 -0.578 26.1 178.0 -73.2 119.0 -2.1 -2.4 40.9 24 396 A R > + 0 0 100 167,-2.7 3,-1.6 -2,-0.5 4,-0.4 -0.466 12.6 160.8-119.1 57.4 0.7 -4.9 40.5 25 397 A Q G > + 0 0 25 1,-0.3 3,-1.8 2,-0.2 4,-0.4 0.803 67.3 64.8 -47.1 -40.5 2.0 -4.0 37.0 26 398 A E G > S+ 0 0 134 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.831 95.1 58.2 -55.7 -36.6 5.3 -5.7 37.5 27 399 A E G < S+ 0 0 88 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.597 98.5 60.9 -72.9 -8.7 3.7 -9.1 37.7 28 400 A A G < S+ 0 0 0 -3,-1.8 156,-2.1 -4,-0.4 -1,-0.3 0.541 79.2 112.6 -93.4 -8.3 2.2 -8.6 34.3 29 401 A E B < -A 183 0A 62 -3,-1.3 154,-0.3 -4,-0.4 3,-0.0 -0.344 43.0-176.1 -64.5 143.4 5.6 -8.3 32.6 30 402 A D > - 0 0 25 152,-3.0 3,-2.4 1,-0.1 4,-0.1 -0.706 10.2-175.8-144.3 86.8 6.5 -11.1 30.3 31 403 A P G > S+ 0 0 107 0, 0.0 3,-0.9 0, 0.0 152,-0.1 0.616 81.9 71.0 -59.2 -12.4 10.1 -10.7 29.0 32 404 A A G 3 S+ 0 0 83 1,-0.2 -3,-0.0 150,-0.1 -2,-0.0 0.672 91.0 59.3 -78.5 -15.4 9.5 -13.8 26.8 33 405 A C G < S+ 0 0 13 -3,-2.4 -1,-0.2 149,-0.1 135,-0.1 0.259 73.7 148.1 -96.5 12.0 7.1 -11.7 24.6 34 406 A I < - 0 0 53 -3,-0.9 2,-0.1 148,-0.1 138,-0.0 -0.147 54.8-105.2 -46.6 136.3 9.8 -9.2 23.7 35 407 A P - 0 0 11 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.376 19.5-155.3 -68.2 145.5 9.2 -7.8 20.2 36 408 A I S S+ 0 0 114 91,-0.3 2,-0.3 1,-0.3 -2,-0.0 0.892 79.5 18.5 -84.9 -47.3 11.4 -9.0 17.3 37 409 A F + 0 0 43 90,-0.1 2,-0.3 19,-0.1 -1,-0.3 -0.919 64.5 152.6-126.8 153.4 10.8 -5.9 15.2 38 410 A W - 0 0 1 -2,-0.3 18,-2.0 -3,-0.1 2,-0.6 -0.948 50.1 -88.7-165.4 162.2 9.6 -2.4 15.7 39 411 A V E +G 55 0B 0 -2,-0.3 16,-0.2 16,-0.2 3,-0.1 -0.744 37.1 175.6 -84.9 118.9 10.1 1.0 14.2 40 412 A S E + 0 0 3 14,-2.2 81,-2.3 -2,-0.6 2,-0.3 0.681 68.5 9.3 -95.0 -21.9 13.1 2.7 15.7 41 413 A K E -G 54 0B 18 13,-1.3 13,-2.5 79,-0.2 2,-0.3 -0.985 63.5-178.8-153.7 153.4 13.1 5.8 13.4 42 414 A W E -G 53 0B 3 -2,-0.3 179,-2.2 11,-0.3 2,-0.4 -0.991 14.0-155.2-154.8 156.3 10.9 7.4 10.8 43 415 A V E -GH 52 220B 13 9,-3.1 9,-2.7 -2,-0.3 2,-1.1 -0.987 14.3-145.2-135.7 122.6 10.7 10.4 8.5 44 416 A D E +G 51 0B 9 175,-3.1 7,-0.2 -2,-0.4 3,-0.2 -0.735 40.7 144.7 -93.5 95.1 7.5 11.8 7.2 45 417 A Y E >>> +G 50 0B 79 5,-1.9 4,-3.2 -2,-1.1 3,-1.5 -0.142 25.4 127.5-116.8 33.9 8.0 13.0 3.7 46 418 A S T 345 + 0 0 42 3,-0.3 -1,-0.1 1,-0.3 5,-0.1 0.623 58.5 73.9 -67.6 -13.6 4.6 12.0 2.5 47 419 A D T 345S+ 0 0 136 -3,-0.2 -1,-0.3 3,-0.2 -2,-0.1 0.806 123.0 5.2 -69.6 -26.0 4.0 15.5 1.1 48 420 A K T <45S- 0 0 116 -3,-1.5 -2,-0.2 2,-0.2 -1,-0.1 0.716 145.0 -3.4-122.9 -45.4 6.4 14.6 -1.7 49 421 A Y T <5S- 0 0 74 -4,-3.2 16,-2.7 1,-0.3 17,-0.3 0.759 93.3 -98.6-121.7 -52.4 7.5 10.9 -1.6 50 422 A G E < -GI 45 64B 0 -5,-1.4 -5,-1.9 14,-0.3 2,-0.5 -0.989 51.7 -35.4 157.4-162.6 6.2 8.9 1.4 51 423 A L E -GI 44 63B 0 12,-2.3 12,-2.4 -2,-0.3 2,-0.4 -0.830 46.6-165.5-100.3 124.0 7.1 7.5 4.8 52 424 A G E +GI 43 62B 0 -9,-2.7 -9,-3.1 -2,-0.5 2,-0.3 -0.879 16.0 167.6-107.8 141.0 10.6 6.4 5.5 53 425 A Y E -GI 42 61B 1 8,-2.9 8,-2.9 -2,-0.4 2,-0.4 -0.971 29.3-138.2-149.0 165.3 11.5 4.3 8.5 54 426 A Q E -GI 41 60B 9 -13,-2.5 -14,-2.2 -2,-0.3 -13,-1.3 -0.974 19.7-141.5-124.0 135.2 14.1 2.2 10.1 55 427 A L E > -G 39 0B 1 4,-2.9 3,-2.2 -2,-0.4 -16,-0.2 -0.572 34.8-101.6 -89.8 164.2 13.4 -1.1 11.8 56 428 A C T 3 S+ 0 0 4 -18,-2.0 -17,-0.1 1,-0.3 -1,-0.1 0.676 121.1 62.6 -59.7 -18.8 15.3 -2.0 15.1 57 429 A D T 3 S- 0 0 36 -19,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.300 120.4-107.3 -88.6 8.5 17.6 -4.4 13.1 58 430 A N S < S+ 0 0 81 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.537 77.7 134.9 78.3 6.9 18.8 -1.4 11.1 59 431 A S - 0 0 0 -4,-0.1 -4,-2.9 16,-0.0 2,-0.3 -0.570 44.5-145.9 -79.8 156.1 17.0 -2.4 8.0 60 432 A V E -IJ 54 72B 5 12,-2.5 12,-3.2 -6,-0.2 2,-0.3 -0.926 17.8-178.2-126.2 151.0 15.2 0.6 6.3 61 433 A G E -IJ 53 71B 1 -8,-2.9 -8,-2.9 -2,-0.3 2,-0.4 -0.943 13.2-156.0-143.5 164.4 12.0 0.8 4.4 62 434 A V E -IJ 52 70B 2 8,-1.6 8,-2.1 -2,-0.3 2,-0.7 -0.993 7.2-158.3-144.1 135.4 9.8 3.3 2.6 63 435 A L E -IJ 51 69B 15 -12,-2.4 -12,-2.3 -2,-0.4 6,-0.2 -0.957 28.9-150.1-111.9 103.6 6.1 3.2 1.9 64 436 A F E > -I 50 0B 11 4,-2.6 3,-1.6 -2,-0.7 -14,-0.3 -0.340 24.2-110.0 -74.6 160.1 5.8 5.5 -1.1 65 437 A N T 3 S+ 0 0 85 -16,-2.7 -15,-0.1 1,-0.3 -1,-0.1 0.754 117.2 65.2 -61.0 -25.6 2.7 7.6 -1.8 66 438 A D T 3 S- 0 0 61 -17,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.192 120.2-109.2 -84.1 18.3 2.0 5.3 -4.8 67 439 A S S < S+ 0 0 68 -3,-1.6 2,-0.3 1,-0.2 -2,-0.2 0.638 79.5 128.1 65.5 17.2 1.4 2.5 -2.3 68 440 A T - 0 0 0 -4,-0.1 -4,-2.6 17,-0.1 2,-0.4 -0.691 46.2-146.3 -99.6 158.1 4.6 0.7 -3.3 69 441 A R E -JK 63 82B 36 13,-2.4 13,-3.4 -2,-0.3 2,-0.5 -0.983 11.6-167.4-131.0 138.7 7.2 -0.3 -0.8 70 442 A L E -JK 62 81B 0 -8,-2.1 -8,-1.6 -2,-0.4 2,-0.5 -0.988 9.2-170.4-125.8 124.0 11.0 -0.6 -0.9 71 443 A I E -JK 61 80B 1 9,-3.1 9,-2.5 -2,-0.5 2,-0.5 -0.965 6.9-164.2-119.8 128.3 12.9 -2.4 1.8 72 444 A L E -JK 60 79B 2 -12,-3.2 -12,-2.5 -2,-0.5 7,-0.2 -0.955 20.8-135.4-111.3 119.6 16.7 -2.4 2.2 73 445 A Y > - 0 0 65 5,-2.8 3,-2.0 -2,-0.5 4,-0.1 -0.193 29.2 -99.6 -68.6 165.0 18.1 -5.1 4.5 74 446 A N T 3 S+ 0 0 95 1,-0.3 -1,-0.1 2,-0.1 -15,-0.0 0.566 116.2 74.3 -64.1 -9.3 20.7 -4.4 7.1 75 447 A D T 3 S- 0 0 95 3,-0.1 -1,-0.3 1,-0.0 -16,-0.0 0.578 104.9-127.6 -79.0 -6.4 23.5 -5.7 4.9 76 448 A G S < S+ 0 0 24 -3,-2.0 -2,-0.1 2,-0.2 3,-0.1 0.588 92.6 58.3 74.4 11.0 23.0 -2.4 3.0 77 449 A D S S+ 0 0 56 1,-0.1 16,-1.6 -4,-0.1 2,-0.3 0.590 72.1 92.3-136.3 -41.4 22.6 -4.1 -0.4 78 450 A S E - L 0 92B 39 14,-0.2 -5,-2.8 15,-0.1 2,-0.4 -0.460 56.1-168.9 -67.0 125.9 19.7 -6.6 -0.5 79 451 A L E -KL 72 91B 4 12,-3.4 12,-2.3 -2,-0.3 2,-0.4 -0.915 15.4-165.5-120.3 144.7 16.5 -4.9 -1.6 80 452 A Q E -KL 71 90B 9 -9,-2.5 -9,-3.1 -2,-0.4 2,-0.5 -0.997 10.1-163.5-128.0 125.3 12.9 -6.0 -1.6 81 453 A Y E -KL 70 89B 20 8,-3.5 8,-1.8 -2,-0.4 2,-0.6 -0.946 3.6-163.8-115.5 129.4 10.3 -4.2 -3.7 82 454 A I E -KL 69 88B 2 -13,-3.4 -13,-2.4 -2,-0.5 6,-0.2 -0.917 10.5-156.5-115.4 109.1 6.5 -4.5 -3.2 83 455 A E > - 0 0 59 4,-2.0 3,-0.9 -2,-0.6 -14,-0.0 0.002 35.8 -97.1 -69.1-178.5 4.3 -3.2 -6.0 84 456 A R T 3 S+ 0 0 138 1,-0.2 -1,-0.1 2,-0.1 -17,-0.0 0.868 123.2 56.6 -71.2 -36.3 0.7 -2.1 -5.6 85 457 A D T 3 S- 0 0 108 1,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.008 124.3-101.3 -85.6 30.8 -0.6 -5.5 -6.7 86 458 A G < + 0 0 44 -3,-0.9 2,-0.5 1,-0.2 -2,-0.1 0.244 68.1 158.0 72.5 -14.7 1.4 -7.2 -4.0 87 459 A T - 0 0 54 -5,-0.1 -4,-2.0 1,-0.1 2,-0.2 -0.197 28.3-156.5 -47.3 96.8 4.1 -8.3 -6.5 88 460 A E E -L 82 0B 103 -2,-0.5 2,-0.3 -6,-0.2 -6,-0.2 -0.579 13.8-175.6 -79.0 142.0 7.1 -8.9 -4.2 89 461 A S E -L 81 0B 49 -8,-1.8 -8,-3.5 -2,-0.2 2,-0.3 -0.999 14.3-147.7-144.1 138.2 10.5 -8.6 -5.9 90 462 A Y E +L 80 0B 159 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.743 34.8 123.6-104.7 152.2 14.0 -9.2 -4.7 91 463 A L E -L 79 0B 25 -12,-2.3 -12,-3.4 -2,-0.3 2,-0.3 -0.933 43.5-104.4-176.1-165.2 17.2 -7.3 -5.9 92 464 A T E -L 78 0B 28 3,-1.4 -14,-0.2 -14,-0.3 -15,-0.1 -0.919 25.2-115.3-141.4 167.5 20.2 -5.3 -4.7 93 465 A V S S+ 0 0 35 -16,-1.6 3,-0.2 -2,-0.3 -15,-0.1 0.752 118.4 50.2 -74.5 -23.3 21.4 -1.7 -4.7 94 466 A S S S+ 0 0 94 1,-0.3 2,-0.5 -17,-0.2 -1,-0.2 0.849 121.3 29.7 -82.7 -37.1 24.2 -2.8 -6.9 95 467 A S S S+ 0 0 81 2,-0.0 -3,-1.4 0, 0.0 -1,-0.3 -0.867 82.2 134.7-128.8 98.7 22.1 -4.6 -9.5 96 468 A H - 0 0 47 -2,-0.5 2,-0.1 -3,-0.2 -5,-0.1 -0.942 60.1 -86.3-139.2 159.4 18.6 -3.2 -9.9 97 469 A P > - 0 0 65 0, 0.0 3,-2.5 0, 0.0 4,-0.3 -0.465 38.4-122.0 -68.4 137.8 16.2 -2.4 -12.8 98 470 A N G > S+ 0 0 136 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.789 108.6 70.6 -47.8 -31.7 16.8 1.2 -14.1 99 471 A S G 3 S+ 0 0 100 1,-0.3 3,-0.4 2,-0.1 4,-0.3 0.772 95.0 52.2 -59.8 -28.5 13.2 1.9 -13.3 100 472 A L G <> S+ 0 0 11 -3,-2.5 4,-2.9 1,-0.2 5,-0.3 0.415 78.9 101.7 -89.6 3.0 13.8 1.7 -9.5 101 473 A M H <> S+ 0 0 94 -3,-1.8 4,-1.9 -4,-0.3 -1,-0.2 0.905 82.3 46.8 -51.3 -49.6 16.7 4.2 -9.7 102 474 A K H > S+ 0 0 147 -3,-0.4 4,-2.1 -4,-0.3 -1,-0.2 0.930 115.7 44.3 -60.8 -48.3 14.5 7.1 -8.4 103 475 A K H > S+ 0 0 32 -4,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.839 113.0 50.4 -68.2 -33.1 13.0 5.1 -5.6 104 476 A I H X S+ 0 0 6 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.836 109.1 53.3 -73.7 -30.1 16.4 3.6 -4.5 105 477 A T H X S+ 0 0 80 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.948 109.6 47.5 -66.1 -48.6 17.9 7.1 -4.5 106 478 A L H X S+ 0 0 26 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.857 109.9 53.0 -60.3 -38.9 15.2 8.4 -2.2 107 479 A L H X S+ 0 0 3 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.919 108.2 50.1 -65.4 -42.1 15.6 5.4 0.1 108 480 A K H X S+ 0 0 105 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.914 109.9 51.2 -61.9 -41.6 19.3 6.1 0.4 109 481 A Y H X S+ 0 0 149 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.951 112.1 46.6 -59.0 -49.6 18.6 9.7 1.2 110 482 A F H X S+ 0 0 5 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.923 111.9 50.6 -56.6 -49.8 16.1 8.6 3.9 111 483 A R H X S+ 0 0 84 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.881 110.6 49.9 -56.7 -42.6 18.6 6.1 5.3 112 484 A N H X S+ 0 0 91 -4,-2.4 4,-1.8 2,-0.2 5,-0.2 0.944 112.2 46.3 -62.0 -53.2 21.3 8.7 5.5 113 485 A Y H X S+ 0 0 59 -4,-2.5 4,-2.5 1,-0.2 5,-0.4 0.920 115.3 46.0 -57.5 -47.8 19.2 11.2 7.2 114 486 A M H X S+ 0 0 2 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.931 112.6 48.9 -63.8 -45.9 17.9 8.8 9.8 115 487 A S H < S+ 0 0 67 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.781 119.4 39.2 -65.2 -28.7 21.2 7.2 10.6 116 488 A E H < S+ 0 0 139 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.794 129.3 20.1 -93.5 -31.7 22.9 10.6 11.1 117 489 A H H < S+ 0 0 99 -4,-2.5 2,-0.3 -5,-0.2 -3,-0.2 0.637 102.1 77.0-117.8 -14.0 20.2 12.6 12.9 118 490 A L S < S- 0 0 11 -4,-1.8 105,-0.3 -5,-0.4 2,-0.2 -0.787 70.3-119.5-109.6 147.3 17.6 10.5 14.6 119 491 A L - 0 0 74 103,-2.5 2,-0.8 -2,-0.3 -2,-0.1 -0.470 27.3-120.6 -75.1 145.8 17.7 8.5 17.8 120 492 A K > - 0 0 62 -2,-0.2 3,-1.4 -79,-0.1 -79,-0.2 -0.786 26.0-136.8 -89.5 109.7 17.1 4.7 17.6 121 493 A A T 3 S+ 0 0 9 -81,-2.3 -83,-0.1 -2,-0.8 -80,-0.0 -0.436 91.1 18.3 -64.4 139.2 14.0 4.0 19.7 122 494 A G T > S+ 0 0 6 -2,-0.1 3,-1.8 56,-0.1 -1,-0.3 0.768 78.7 150.0 70.1 25.8 14.7 0.8 21.8 123 495 A A T < + 0 0 67 -3,-1.4 -2,-0.1 1,-0.3 -1,-0.1 0.762 67.3 59.3 -61.4 -25.5 18.4 1.2 21.3 124 496 A N T 3 S+ 0 0 113 54,-0.2 2,-0.4 -4,-0.1 -1,-0.3 0.193 96.5 84.9 -89.1 16.4 19.0 -0.4 24.7 125 497 A I < - 0 0 31 -3,-1.8 0, 0.0 -69,-0.1 0, 0.0 -0.936 64.3-147.1-126.7 145.7 17.2 -3.6 23.6 126 498 A T 0 0 125 -2,-0.4 -69,-0.1 1,-0.0 -3,-0.0 -0.935 360.0 360.0-105.4 113.1 18.1 -6.8 21.7 127 499 A P 0 0 69 0, 0.0 -91,-0.3 0, 0.0 -90,-0.1 0.027 360.0 360.0 -61.6 360.0 15.0 -7.9 19.8 128 ! 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 0.0 129 508 A L 0 0 69 0, 0.0 18,-0.0 0, 0.0 -56,-0.0 0.000 360.0 360.0 360.0 115.6 11.3 -9.1 7.6 130 509 A P - 0 0 8 0, 0.0 2,-0.3 0, 0.0 -75,-0.0 -0.270 360.0-152.4 -71.6 157.5 8.1 -7.2 7.9 131 510 A Y - 0 0 33 -60,-0.0 16,-2.8 -70,-0.0 2,-1.0 -0.789 33.9 -87.4-121.8 167.6 7.2 -4.1 5.8 132 511 A L E -B 146 0A 0 -2,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.687 38.7-176.6 -81.9 105.9 5.0 -1.1 6.6 133 512 A R E - 0 0 105 12,-1.6 2,-0.3 -2,-1.0 -1,-0.2 0.969 64.3 -28.8 -63.5 -56.5 1.5 -2.1 5.6 134 513 A T E -B 145 0A 58 11,-1.5 11,-2.7 2,-0.0 2,-0.3 -0.967 58.4-171.6-156.3 167.7 -0.1 1.2 6.5 135 514 A W E +B 144 0A 46 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.985 4.6 176.5-160.5 159.1 0.3 4.2 8.7 136 515 A F E -B 143 0A 35 7,-1.8 7,-3.5 -2,-0.3 2,-0.4 -0.962 17.8-137.0-158.3 164.0 -1.4 7.4 9.8 137 516 A R E -B 142 0A 54 -2,-0.3 5,-0.3 5,-0.3 2,-0.2 -0.980 10.4-168.3-132.4 146.7 -0.8 10.2 12.2 138 517 A T - 0 0 27 3,-3.4 3,-0.0 -2,-0.4 -2,-0.0 -0.572 48.9 -87.9-115.2-177.4 -3.1 12.1 14.6 139 518 A R S S+ 0 0 250 -2,-0.2 3,-0.1 1,-0.2 17,-0.0 0.824 128.2 31.6 -64.7 -29.9 -2.3 15.3 16.5 140 519 A S S S+ 0 0 41 1,-0.1 16,-1.7 16,-0.1 17,-0.4 0.543 123.9 16.0-107.2 -8.9 -0.8 13.3 19.3 141 520 A A E - C 0 155A 0 14,-0.2 -3,-3.4 15,-0.1 2,-0.4 -0.991 54.3-128.7-160.1 166.0 0.7 10.2 17.6 142 521 A I E -BC 137 154A 0 12,-1.8 12,-2.2 -2,-0.3 2,-0.5 -0.972 27.8-152.2-117.9 133.2 1.9 8.3 14.6 143 522 A I E -BC 136 153A 0 -7,-3.5 -7,-1.8 -2,-0.4 2,-0.5 -0.945 9.8-169.3-112.0 128.8 0.4 4.9 14.1 144 523 A L E -BC 135 152A 0 8,-3.2 8,-3.5 -2,-0.5 2,-0.6 -0.975 5.3-164.5-123.2 125.7 2.4 2.2 12.3 145 524 A H E -BC 134 151A 9 -11,-2.7 -12,-1.6 -2,-0.5 -11,-1.5 -0.935 12.3-155.9-113.3 112.9 1.0 -1.1 11.2 146 525 A L E > -B 132 0A 1 4,-2.6 3,-2.1 -2,-0.6 -14,-0.2 -0.580 26.0-117.6 -89.2 151.3 3.5 -3.7 10.2 147 526 A S T 3 S+ 0 0 24 -16,-2.8 -15,-0.1 1,-0.3 -1,-0.1 0.581 112.0 66.3 -61.4 -14.3 2.8 -6.6 7.9 148 527 A N T 3 S- 0 0 49 -17,-0.2 -1,-0.3 2,-0.1 19,-0.2 0.368 122.8-103.5 -88.5 4.4 3.6 -9.1 10.7 149 528 A G S < S+ 0 0 0 -3,-2.1 -2,-0.1 1,-0.3 -144,-0.1 0.231 78.7 134.8 95.5 -15.0 0.4 -7.8 12.4 150 529 A S - 0 0 8 15,-0.1 -4,-2.6 -5,-0.1 2,-0.4 -0.373 40.4-154.8 -68.5 147.6 2.2 -5.6 15.0 151 530 A V E -CD 145 164A 0 13,-2.2 13,-3.2 -6,-0.2 2,-0.4 -0.993 6.0-163.2-126.9 124.5 0.9 -2.1 15.6 152 531 A Q E -CD 144 163A 3 -8,-3.5 -8,-3.2 -2,-0.4 2,-0.5 -0.904 3.9-169.5-111.7 135.3 3.2 0.6 16.9 153 532 A I E -CD 143 162A 0 9,-2.8 9,-2.6 -2,-0.4 2,-0.6 -0.974 1.7-168.2-126.2 117.9 2.0 3.9 18.4 154 533 A N E -CD 142 161A 4 -12,-2.2 -12,-1.8 -2,-0.5 2,-0.6 -0.924 13.8-145.4-107.1 120.6 4.5 6.7 19.1 155 534 A F E > -C 141 0A 18 5,-2.9 4,-1.3 -2,-0.6 -14,-0.2 -0.781 6.0-154.1 -90.6 118.0 3.2 9.6 21.2 156 535 A F T 4 S+ 0 0 28 -16,-1.7 -1,-0.1 -2,-0.6 -15,-0.1 0.903 82.6 48.7 -54.7 -54.4 4.7 12.8 20.1 157 536 A Q T 4 S+ 0 0 182 -17,-0.4 -1,-0.2 1,-0.2 -16,-0.1 0.924 125.8 20.3 -58.8 -56.5 4.5 14.9 23.3 158 537 A D T 4 S- 0 0 46 2,-0.1 -1,-0.2 0, 0.0 -2,-0.2 0.439 96.6-126.8 -97.5 -1.4 5.9 12.6 26.0 159 538 A H < + 0 0 80 -4,-1.3 -3,-0.1 1,-0.2 2,-0.1 0.610 57.6 147.1 66.7 14.8 7.8 10.3 23.6 160 539 A T - 0 0 0 -5,-0.2 -5,-2.9 -6,-0.1 2,-0.3 -0.460 29.1-160.5 -78.4 155.5 6.2 7.2 25.1 161 540 A K E -DE 154 174A 5 13,-2.0 13,-2.5 -7,-0.2 2,-0.4 -0.994 14.9-156.1-143.1 147.4 5.5 4.3 22.7 162 541 A L E -DE 153 173A 0 -9,-2.6 -9,-2.8 -2,-0.3 2,-0.5 -0.956 3.3-167.9-120.7 140.2 3.4 1.2 22.5 163 542 A I E -DE 152 172A 3 9,-2.1 9,-2.9 -2,-0.4 2,-0.5 -0.974 12.7-162.4-128.9 111.3 4.2 -1.9 20.4 164 543 A L E -DE 151 171A 1 -13,-3.2 -13,-2.2 -2,-0.5 7,-0.2 -0.871 8.4-172.9-102.2 120.5 1.2 -4.2 20.1 165 544 A C E >> - E 0 170A 20 5,-2.3 5,-2.2 -2,-0.5 4,-1.4 -0.928 7.6-170.9-114.9 108.6 1.8 -7.8 19.0 166 545 A P T 45S+ 0 0 3 0, 0.0 -1,-0.1 0, 0.0 -17,-0.1 0.761 86.8 59.4 -67.4 -25.7 -1.5 -9.7 18.5 167 546 A L T 45S+ 0 0 123 1,-0.2 -18,-0.0 -19,-0.2 -2,-0.0 0.971 116.5 31.6 -66.2 -53.0 0.4 -13.0 18.1 168 547 A M T 45S- 0 0 90 2,-0.1 -1,-0.2 -135,-0.1 3,-0.1 0.660 102.0-135.1 -76.5 -17.1 1.9 -12.7 21.6 169 548 A A T <5 + 0 0 29 -4,-1.4 16,-2.1 1,-0.2 17,-0.5 0.944 66.7 125.2 58.4 44.7 -1.3 -10.9 22.7 170 549 A A E < -EF 165 184A 3 -5,-2.2 -5,-2.3 14,-0.3 2,-0.4 -0.828 53.7-146.6-132.1 169.3 1.3 -8.6 24.4 171 550 A V E -EF 164 183A 0 12,-3.0 12,-3.4 -2,-0.3 2,-0.5 -0.990 5.3-152.9-142.4 129.5 2.2 -4.9 24.5 172 551 A T E -EF 163 182A 2 -9,-2.9 -9,-2.1 -2,-0.4 2,-0.4 -0.895 16.3-163.1-101.2 128.2 5.6 -3.4 24.9 173 552 A Y E -EF 162 181A 12 8,-3.2 8,-2.3 -2,-0.5 2,-0.6 -0.946 8.6-164.9-114.2 133.7 5.5 0.0 26.6 174 553 A I E -EF 161 180A 6 -13,-2.5 -13,-2.0 -2,-0.4 6,-0.2 -0.972 18.2-155.4-117.8 111.3 8.4 2.5 26.4 175 554 A D > - 0 0 31 4,-1.2 3,-2.2 -2,-0.6 -13,-0.0 -0.174 35.1 -90.3 -80.1 177.4 8.0 5.3 29.0 176 555 A E T 3 S+ 0 0 98 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.758 128.1 58.4 -60.9 -25.5 9.4 8.8 29.0 177 556 A K T 3 S- 0 0 167 2,-0.1 -1,-0.3 1,-0.0 -17,-0.0 0.417 119.4-115.8 -82.8 2.7 12.5 7.6 30.8 178 557 A R < + 0 0 136 -3,-2.2 2,-0.2 1,-0.2 -54,-0.2 0.744 58.9 160.6 68.1 27.5 12.9 5.2 27.9 179 558 A D - 0 0 57 1,-0.0 -4,-1.2 2,-0.0 2,-0.6 -0.578 33.0-139.9 -77.9 143.6 12.4 2.1 30.0 180 559 A F E + F 0 174A 28 -2,-0.2 2,-0.4 -6,-0.2 -6,-0.2 -0.919 29.8 164.2-112.1 110.4 11.5 -0.9 27.9 181 560 A R E - F 0 173A 99 -8,-2.3 -8,-3.2 -2,-0.6 2,-0.5 -0.992 20.5-157.9-130.7 129.7 8.8 -3.2 29.4 182 561 A T E - F 0 172A 8 -2,-0.4 -152,-3.0 -10,-0.3 2,-0.3 -0.909 15.3-173.3-107.0 128.0 6.8 -6.0 27.7 183 562 A Y E -AF 29 171A 12 -12,-3.4 -12,-3.0 -2,-0.5 2,-0.5 -0.883 26.4-125.4-120.7 152.2 3.5 -7.1 29.2 184 563 A R E > - F 0 170A 92 -156,-2.1 4,-1.5 -2,-0.3 3,-0.5 -0.835 22.7-138.7 -92.8 128.3 1.0 -9.8 28.4 185 564 A L H > S+ 0 0 4 -16,-2.1 4,-1.5 -2,-0.5 3,-0.2 0.879 100.9 55.4 -55.1 -42.8 -2.4 -8.2 27.9 186 565 A S H > S+ 0 0 58 -17,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.862 107.7 49.7 -60.7 -36.5 -4.2 -11.0 29.8 187 566 A L H > S+ 0 0 28 -3,-0.5 4,-3.6 2,-0.2 5,-0.4 0.801 103.2 59.9 -73.3 -28.1 -1.9 -10.4 32.8 188 567 A L H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.884 105.6 49.1 -65.3 -35.6 -2.6 -6.7 32.8 189 568 A E H < S+ 0 0 74 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.898 115.1 46.3 -65.6 -39.9 -6.3 -7.6 33.2 190 569 A E H < S+ 0 0 126 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.900 130.6 17.1 -69.5 -45.9 -5.1 -9.8 36.1 191 570 A Y H < S- 0 0 60 -4,-3.6 -167,-2.7 1,-0.2 -3,-0.2 0.626 97.9-138.4-107.7 -15.5 -2.8 -7.5 37.9 192 571 A G < - 0 0 5 -4,-2.5 2,-0.3 -5,-0.4 -174,-0.2 -0.219 13.0-124.4 84.9-179.0 -3.7 -4.1 36.5 193 572 A C - 0 0 0 -176,-1.4 -170,-0.0 -4,-0.1 -169,-0.0 -0.981 28.8 -72.2-161.4 166.2 -1.4 -1.2 35.5 194 573 A C > - 0 0 45 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.142 47.3-106.8 -61.6 158.2 -0.7 2.5 36.1 195 574 A K H > S+ 0 0 152 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.858 117.2 59.9 -52.9 -39.1 -3.0 5.3 34.9 196 575 A E H > S+ 0 0 86 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.943 109.7 37.0 -57.5 -55.9 -0.4 6.1 32.2 197 576 A L H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.877 115.2 56.5 -67.9 -35.4 -0.4 2.7 30.4 198 577 A A H X S+ 0 0 1 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.936 107.5 48.9 -61.0 -45.4 -4.1 2.3 30.9 199 578 A S H X S+ 0 0 47 -4,-2.6 4,-2.1 1,-0.2 3,-0.2 0.918 111.3 48.6 -59.2 -46.8 -4.8 5.6 29.2 200 579 A R H X S+ 0 0 17 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.773 107.9 54.9 -66.2 -28.3 -2.6 4.7 26.2 201 580 A L H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.798 106.9 51.1 -75.2 -28.7 -4.2 1.3 25.9 202 581 A R H X S+ 0 0 128 -4,-1.5 4,-1.6 -3,-0.2 -2,-0.2 0.928 112.5 46.1 -71.0 -42.8 -7.6 3.1 25.6 203 582 A Y H X S+ 0 0 52 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.920 107.8 58.4 -62.0 -43.9 -6.1 5.3 22.9 204 583 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.891 103.2 52.2 -52.9 -43.9 -4.6 2.1 21.3 205 584 A R H X S+ 0 0 79 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.927 108.7 50.0 -61.5 -44.1 -8.1 0.6 21.0 206 585 A T H X S+ 0 0 61 -4,-1.6 4,-1.8 1,-0.2 -1,-0.2 0.889 113.2 46.9 -61.4 -39.8 -9.4 3.8 19.2 207 586 A M H X S+ 0 0 9 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.916 109.8 52.1 -68.6 -42.9 -6.4 3.7 16.8 208 587 A V H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.922 110.3 49.4 -58.9 -43.4 -6.8 -0.1 16.1 209 588 A D H X S+ 0 0 52 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.883 108.5 53.5 -62.1 -39.2 -10.5 0.6 15.3 210 589 A K H < S+ 0 0 88 -4,-1.8 4,-0.3 1,-0.2 3,-0.3 0.932 106.8 51.7 -61.8 -45.2 -9.4 3.5 13.0 211 590 A L H >X S+ 0 0 5 -4,-2.6 4,-1.1 1,-0.2 3,-0.8 0.860 108.9 51.9 -58.3 -37.9 -7.0 1.1 11.2 212 591 A L H 3< S+ 0 0 45 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.833 113.4 42.0 -70.1 -33.5 -9.9 -1.3 10.7 213 592 A S T 3< S+ 0 0 99 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.232 115.9 49.8 -98.5 13.1 -12.3 1.3 9.2 214 593 A S T <4 S+ 0 0 73 -3,-0.8 -2,-0.2 -4,-0.3 -1,-0.1 0.535 87.0 107.0-121.1 -18.5 -9.6 2.9 7.0 215 594 A R < 0 0 172 -4,-1.1 -3,-0.0 -5,-0.2 -81,-0.0 0.043 360.0 360.0 -60.5 168.5 -8.1 -0.2 5.3 216 595 A S 0 0 167 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.920 360.0 360.0 179.1 360.0 -8.5 -1.3 1.7 217 !* 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 0.0 218 1 D X 0 0 267 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 136.0 6.8 16.4 13.5 219 2 D L + 0 0 60 -176,-0.1 -175,-3.1 2,-0.1 2,-0.3 0.394 360.0 21.1 -89.0 2.1 8.2 15.5 10.1 220 3 D H B S-H 43 0B 52 -177,-0.3 -177,-0.2 -175,-0.0 3,-0.1 -0.979 87.6 -94.0-161.2 162.0 10.5 13.0 11.8 221 4 D S S S- 0 0 4 -179,-2.2 -2,-0.1 -2,-0.3 -180,-0.1 -0.105 71.3 -46.0 -76.5-178.6 10.9 10.9 14.9 222 5 D X 0 0 45 -104,-0.1 -103,-2.5 1,-0.1 -1,-0.2 -0.114 360.0 360.0 -61.5 135.3 13.0 12.0 18.0 223 6 D M 0 0 109 -105,-0.3 -105,-0.3 -3,-0.1 -1,-0.1 -0.395 360.0 360.0 -81.2 360.0 16.5 13.4 17.2