==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-NOV-08 3F6H . COMPND 2 MOLECULE: ALPHA-ISOPROPYLMALATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: LEPTOSPIRA INTERROGANS; . AUTHOR P.ZHANG,J.MA,G.ZHAO,J.DING . 246 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14520.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 156 63.4 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 . 74 30.1 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 . 3 1.2 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 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 22.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 0 0 0 0 0 0 0 0 0 2 2 0 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 1 2 4 1 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 4 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 1 390 A K 0 0 158 0, 0.0 3,-0.1 0, 0.0 109,-0.0 0.000 360.0 360.0 360.0 115.9 30.4 4.7 -0.6 2 391 A V + 0 0 56 1,-0.2 25,-0.6 24,-0.0 2,-0.4 0.800 360.0 42.1 -97.0 -38.5 33.6 4.6 1.3 3 392 A L E -A 26 0A 5 106,-0.2 2,-0.4 23,-0.1 -1,-0.2 -0.923 64.1-170.9-117.4 138.2 33.6 8.0 2.9 4 393 A T E -A 25 0A 42 21,-2.2 21,-3.2 -2,-0.4 2,-1.0 -0.992 22.8-142.5-130.1 127.2 30.7 9.8 4.6 5 394 A I E -A 24 0A 24 -2,-0.4 19,-0.3 19,-0.2 3,-0.1 -0.802 23.2-174.9 -80.1 104.4 30.4 13.4 5.8 6 395 A K E - 0 0 123 17,-2.0 2,-0.3 -2,-1.0 18,-0.2 0.880 61.8 -19.3 -72.1 -40.3 28.3 12.6 8.9 7 396 A S E +A 23 0A 59 16,-1.7 16,-2.6 -3,-0.1 -1,-0.3 -0.977 58.2 174.1-162.1 158.1 27.9 16.3 9.8 8 397 A C E -A 22 0A 41 -2,-0.3 2,-0.4 14,-0.2 14,-0.2 -0.947 12.2-158.3-160.5 151.5 29.3 19.7 9.3 9 398 A N E -A 21 0A 38 12,-1.3 12,-1.6 -2,-0.3 2,-0.4 -0.955 8.7-165.5-139.8 122.7 28.3 23.3 10.2 10 399 A I E -A 20 0A 38 -2,-0.4 2,-0.4 10,-0.2 10,-0.2 -0.878 5.2-172.6-109.1 136.6 29.6 26.3 8.3 11 400 A H E +A 19 0A 56 8,-2.5 8,-1.7 -2,-0.4 2,-0.2 -0.986 19.8 134.1-137.7 122.1 29.3 29.8 9.7 12 401 A S E + 0 0 68 -2,-0.4 2,-0.3 6,-0.2 5,-0.1 -0.861 8.0 121.7-150.5-177.0 30.0 33.1 8.0 13 402 A G E > -A 16 0A 44 3,-0.5 3,-1.1 -2,-0.2 2,-0.6 -0.881 66.3 -35.2 144.3-175.3 28.7 36.6 7.3 14 403 A I T 3 S+ 0 0 185 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.726 131.3 16.1 -83.7 117.6 29.6 40.3 7.8 15 404 A G T 3 S+ 0 0 79 -2,-0.6 2,-0.4 1,-0.3 -1,-0.2 0.316 111.3 101.6 99.5 -3.2 31.5 40.8 11.0 16 405 A I E < -A 13 0A 52 -3,-1.1 -3,-0.5 114,-0.0 -1,-0.3 -0.940 69.3-136.4-116.9 132.7 32.1 37.0 11.1 17 406 A R E - 0 0 103 -2,-0.4 21,-0.1 -5,-0.1 -6,-0.1 -0.793 39.8-108.5 -82.9 123.8 35.4 35.3 10.2 18 407 A P E + 0 0 20 0, 0.0 19,-1.5 0, 0.0 2,-0.3 -0.224 51.3 158.6 -56.2 137.2 34.4 32.2 8.1 19 408 A H E -AB 11 36A 0 -8,-1.7 -8,-2.5 17,-0.3 2,-0.3 -0.979 17.6-167.0-157.2 153.9 34.8 28.8 9.9 20 409 A A E -AB 10 35A 0 15,-2.6 15,-1.7 23,-0.3 2,-0.4 -0.978 12.4-146.5-142.3 154.6 33.6 25.3 9.6 21 410 A Q E -AB 9 34A 12 -12,-1.6 -12,-1.3 -2,-0.3 2,-0.4 -0.943 18.4-162.9-115.6 145.6 33.5 22.0 11.6 22 411 A I E -AB 8 33A 5 11,-2.5 11,-2.4 -2,-0.4 2,-0.4 -0.989 13.0-173.8-131.1 139.6 33.6 18.6 9.8 23 412 A E E +AB 7 32A 43 -16,-2.6 -17,-2.0 -2,-0.4 -16,-1.7 -0.948 19.1 174.9-129.8 109.4 32.7 15.2 11.0 24 413 A L E -AB 5 31A 1 7,-2.6 7,-3.0 -2,-0.4 2,-0.4 -0.931 24.2-141.5-122.1 144.3 33.5 12.4 8.6 25 414 A E E +AB 4 30A 62 -21,-3.2 -21,-2.2 -2,-0.4 2,-0.3 -0.860 28.5 161.1 -99.8 132.2 33.3 8.6 8.7 26 415 A Y E > -AB 3 29A 32 3,-2.7 3,-1.3 -2,-0.4 -23,-0.1 -0.879 66.6 -15.6-155.6 118.3 36.1 6.6 7.1 27 416 A Q T 3 S- 0 0 147 -25,-0.6 2,-0.3 -2,-0.3 3,-0.1 0.920 124.4 -52.4 52.9 53.8 37.0 2.9 7.7 28 417 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.042 119.2 102.5 79.3 -28.5 35.1 2.5 11.0 29 418 A K E < -B 26 0A 137 -3,-1.3 -3,-2.7 -2,-0.3 2,-0.4 -0.611 62.1-142.7 -90.9 148.7 36.7 5.6 12.5 30 419 A I E -B 25 0A 88 -2,-0.2 2,-0.4 -5,-0.2 -5,-0.2 -0.935 12.7-159.4-111.5 131.2 35.1 9.0 12.8 31 420 A H E -B 24 0A 22 -7,-3.0 -7,-2.6 -2,-0.4 2,-0.4 -0.941 4.8-168.7-115.4 131.9 37.2 12.2 12.4 32 421 A K E +B 23 0A 83 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.961 15.2 162.9-119.6 134.9 36.2 15.7 13.7 33 422 A E E -B 22 0A 36 -11,-2.4 -11,-2.5 -2,-0.4 2,-0.3 -0.947 19.5-158.4-146.3 163.4 38.0 18.9 12.7 34 423 A I E +B 21 0A 11 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.962 17.8 157.7-139.8 156.3 37.6 22.7 12.7 35 424 A S E -B 20 0A 17 -15,-1.7 -15,-2.6 -2,-0.3 12,-0.2 -0.928 29.5-128.3-173.0 153.5 39.1 25.5 10.7 36 425 A E E +B 19 0A 34 -2,-0.3 2,-0.3 -17,-0.3 -17,-0.3 -0.347 31.9 165.7 -92.6-178.9 38.7 29.1 9.5 37 426 A G - 0 0 13 -19,-1.5 6,-0.1 -2,-0.1 3,-0.1 -0.972 52.6 -86.5-176.6-179.2 39.0 30.3 5.9 38 427 A D S S+ 0 0 154 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.787 112.3 7.9 -75.7 -31.7 38.4 33.2 3.5 39 428 A G S > S- 0 0 12 1,-0.1 4,-2.5 -21,-0.1 5,-0.2 -0.886 86.1 -97.4-140.2 172.4 34.9 31.8 2.9 40 429 A G H > S+ 0 0 6 209,-0.6 4,-1.9 -2,-0.3 -29,-0.1 0.937 123.4 41.7 -56.8 -54.9 32.6 29.2 4.4 41 430 A Y H > S+ 0 0 6 208,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.844 115.4 53.0 -62.0 -35.9 33.3 26.5 1.8 42 431 A D H > S+ 0 0 47 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.854 107.6 50.0 -67.4 -38.4 37.0 27.4 1.9 43 432 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -23,-0.3 0.860 109.4 53.9 -65.9 -36.4 37.0 27.0 5.7 44 433 A F H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.874 107.7 48.6 -64.5 -40.6 35.4 23.6 5.2 45 434 A M H X S+ 0 0 23 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.841 108.8 53.4 -71.4 -34.7 38.1 22.5 2.8 46 435 A N H X S+ 0 0 61 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.913 112.6 44.8 -62.5 -44.7 40.8 23.6 5.3 47 436 A A H X S+ 0 0 0 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.922 114.2 49.1 -64.1 -46.7 39.2 21.5 8.0 48 437 A L H X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.2 3,-0.3 0.889 106.7 56.9 -59.7 -41.9 38.7 18.6 5.6 49 438 A T H X S+ 0 0 50 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.857 98.0 61.1 -60.2 -38.1 42.4 18.8 4.5 50 439 A K H X S+ 0 0 88 -4,-1.4 4,-1.5 2,-0.2 -1,-0.2 0.923 113.5 36.3 -54.2 -47.4 43.5 18.4 8.1 51 440 A I H X S+ 0 0 1 -4,-1.2 4,-2.5 -3,-0.3 5,-0.3 0.926 113.3 59.0 -67.9 -48.1 41.9 15.0 8.2 52 441 A T H <>S+ 0 0 7 -4,-3.0 5,-2.7 1,-0.2 4,-0.3 0.845 107.7 46.3 -49.7 -41.2 42.8 14.3 4.6 53 442 A N H ><5S+ 0 0 107 -4,-2.8 3,-1.0 3,-0.2 -1,-0.2 0.908 109.3 54.1 -70.1 -44.1 46.5 14.7 5.4 54 443 A R H 3<5S+ 0 0 151 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.899 111.9 44.7 -54.8 -44.5 46.2 12.5 8.5 55 444 A L T 3<5S- 0 0 56 -4,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.522 114.5-119.7 -80.4 -7.2 44.7 9.7 6.4 56 445 A G T < 5 + 0 0 69 -3,-1.0 2,-0.4 -4,-0.3 -3,-0.2 0.755 66.2 137.5 73.9 26.2 47.3 10.3 3.7 57 446 A I < - 0 0 21 -5,-2.7 2,-0.5 -6,-0.2 -1,-0.3 -0.890 44.8-142.9-105.3 134.6 44.9 11.2 0.9 58 447 A S - 0 0 105 -2,-0.4 -5,-0.0 -5,-0.0 -9,-0.0 -0.846 12.6-137.6 -99.3 128.4 45.6 14.0 -1.5 59 448 A I - 0 0 32 -2,-0.5 3,-0.1 1,-0.1 53,-0.0 -0.687 23.9-114.3 -85.2 131.0 42.6 16.2 -2.6 60 449 A P - 0 0 18 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.137 39.3 -92.5 -55.7 157.1 42.5 17.2 -6.3 61 450 A K - 0 0 145 25,-1.9 25,-1.8 1,-0.1 2,-0.7 -0.498 34.3-115.3 -76.2 142.0 42.9 20.8 -7.3 62 451 A L E +C 85 0B 63 23,-0.2 23,-0.2 -2,-0.2 3,-0.1 -0.707 38.6 171.1 -76.0 112.5 39.8 23.0 -7.7 63 452 A I E - 0 0 91 21,-2.4 2,-0.3 -2,-0.7 22,-0.2 0.803 64.1 -5.8 -93.5 -37.0 39.7 23.9 -11.4 64 453 A D E -C 84 0B 89 20,-1.4 20,-2.1 2,-0.0 -1,-0.4 -0.986 53.8-159.2-158.5 157.3 36.3 25.5 -11.5 65 454 A Y E +C 83 0B 51 -2,-0.3 2,-0.4 18,-0.2 18,-0.2 -0.975 14.8 175.7-145.2 120.3 33.2 26.1 -9.3 66 455 A E E -C 82 0B 66 16,-2.1 16,-2.0 -2,-0.4 2,-0.5 -0.993 12.1-166.6-135.8 132.0 29.7 26.9 -10.6 67 456 A V E +C 81 0B 48 -2,-0.4 2,-0.3 14,-0.2 14,-0.2 -0.967 19.4 167.9-121.0 118.7 26.4 27.4 -8.8 68 457 A R E -C 80 0B 142 12,-2.9 12,-2.9 -2,-0.5 -2,-0.0 -0.855 20.3-146.8-128.7 161.4 23.1 27.4 -10.8 69 458 A I - 0 0 89 -2,-0.3 10,-0.1 10,-0.2 3,-0.1 -0.970 24.7-108.0-129.9 144.5 19.4 27.2 -10.2 70 459 A P > - 0 0 52 0, 0.0 3,-1.0 0, 0.0 7,-0.0 -0.293 60.2 -65.6 -63.6 154.5 16.4 25.7 -12.1 71 460 A P T 3 S+ 0 0 138 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.003 114.5 10.7 -49.5 139.4 13.9 28.1 -13.9 72 461 A G T 3 S+ 0 0 83 1,-0.2 2,-0.1 -3,-0.1 5,-0.0 0.614 85.5 172.1 73.1 17.4 11.7 30.5 -11.9 73 462 A G < - 0 0 35 -3,-1.0 -1,-0.2 1,-0.1 -4,-0.0 -0.319 19.9-156.2 -69.0 134.9 13.5 29.9 -8.6 74 463 A K - 0 0 168 -2,-0.1 3,-0.5 1,-0.0 -1,-0.1 0.164 47.9 -78.4 -80.5-154.1 12.7 31.9 -5.5 75 464 A T S S+ 0 0 151 1,-0.2 -2,-0.1 0, 0.0 -1,-0.0 0.718 133.1 55.2 -83.1 -21.7 15.2 32.3 -2.6 76 465 A D S S+ 0 0 118 23,-0.0 -1,-0.2 2,-0.0 -3,-0.0 0.311 84.4 138.8 -90.1 6.9 14.3 28.8 -1.3 77 466 A A - 0 0 16 -3,-0.5 2,-0.1 1,-0.1 20,-0.1 -0.126 61.0-105.0 -56.3 143.9 15.2 27.3 -4.7 78 467 A L - 0 0 89 18,-0.1 2,-0.4 1,-0.0 -1,-0.1 -0.397 38.0-139.9 -63.2 146.8 17.2 24.1 -5.0 79 468 A V E - D 0 97B 14 18,-1.9 18,-1.9 -10,-0.1 2,-0.7 -0.951 13.0-158.8-120.2 132.1 20.8 24.6 -6.1 80 469 A E E -CD 68 96B 60 -12,-2.9 -12,-2.9 -2,-0.4 2,-0.6 -0.937 17.8-179.6-102.8 108.0 22.9 22.6 -8.5 81 470 A T E -CD 67 95B 0 14,-2.7 14,-2.4 -2,-0.7 2,-0.5 -0.954 5.9-168.2-111.0 119.3 26.5 23.3 -7.8 82 471 A R E -CD 66 94B 62 -16,-2.0 -16,-2.1 -2,-0.6 2,-0.5 -0.909 1.2-165.4-105.4 127.9 29.0 21.5 -10.0 83 472 A I E -CD 65 93B 0 10,-3.4 10,-2.8 -2,-0.5 2,-0.5 -0.959 8.2-150.4-111.5 128.4 32.7 21.5 -9.0 84 473 A T E -CD 64 92B 13 -20,-2.1 -21,-2.4 -2,-0.5 -20,-1.4 -0.867 16.8-165.4-100.3 132.5 35.3 20.5 -11.6 85 474 A W E CD 62 91B 2 6,-3.9 6,-2.3 -2,-0.5 -23,-0.2 -0.770 360.0 360.0-115.4 157.2 38.5 18.8 -10.3 86 475 A N 0 0 59 -25,-1.8 -25,-1.9 -2,-0.3 4,-0.2 -0.993 360.0 360.0-127.6 360.0 42.0 18.1 -11.7 87 ! 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 88 483 A D 0 0 170 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-109.1 44.3 16.3 -18.2 89 484 A Q + 0 0 108 1,-0.2 2,-0.4 -3,-0.1 -4,-0.0 0.802 360.0 158.2 54.8 33.7 42.8 14.1 -15.4 90 485 A T + 0 0 70 -4,-0.2 2,-0.3 -6,-0.0 -4,-0.2 -0.723 9.9 158.1 -94.0 135.4 39.8 16.4 -15.2 91 486 A F E -D 85 0B 47 -6,-2.3 -6,-3.9 -2,-0.4 2,-0.3 -0.974 25.7-135.0-148.9 161.3 36.4 15.4 -13.8 92 487 A K E -D 84 0B 137 -2,-0.3 2,-0.4 -8,-0.3 -8,-0.2 -0.897 8.9-166.7-122.0 149.1 33.3 17.0 -12.3 93 488 A T E -D 83 0B 5 -10,-2.8 -10,-3.4 -2,-0.3 2,-0.4 -0.993 10.6-158.0-130.2 142.3 31.1 16.4 -9.3 94 489 A M E -D 82 0B 69 -2,-0.4 2,-0.4 -12,-0.3 -12,-0.2 -0.926 5.1-166.2-121.3 144.3 27.6 17.9 -8.7 95 490 A G E -D 81 0B 0 -14,-2.4 -14,-2.7 -2,-0.4 2,-0.5 -0.990 4.5-160.4-125.7 138.7 25.6 18.5 -5.6 96 491 A V E +D 80 0B 63 -2,-0.4 -16,-0.2 -16,-0.2 -18,-0.1 -0.980 31.1 133.4-121.5 123.2 21.9 19.4 -5.4 97 492 A H E -D 79 0B 54 -18,-1.9 -18,-1.9 -2,-0.5 6,-0.1 -0.975 62.2-118.6-163.7 146.8 20.5 20.9 -2.2 98 493 A P S S+ 0 0 74 0, 0.0 2,-0.5 0, 0.0 -18,-0.1 0.720 106.8 66.1 -62.3 -21.2 18.2 23.8 -1.0 99 494 A D S > S- 0 0 70 1,-0.1 4,-1.7 -20,-0.1 -20,-0.1 -0.927 76.4-153.9-104.3 123.4 21.3 25.1 0.8 100 495 A Q H > S+ 0 0 110 -2,-0.5 4,-1.0 1,-0.2 -1,-0.1 0.843 93.4 48.6 -67.9 -37.4 24.1 26.2 -1.5 101 496 A T H > S+ 0 0 50 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.844 111.2 52.2 -72.3 -31.8 27.1 25.6 0.9 102 497 A V H > S+ 0 0 38 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.847 103.8 57.1 -68.3 -36.2 25.7 22.1 1.7 103 498 A A H X S+ 0 0 0 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.809 104.6 52.1 -66.3 -30.3 25.5 21.3 -2.1 104 499 A A H X S+ 0 0 0 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.788 107.6 52.4 -73.4 -30.5 29.2 22.0 -2.4 105 500 A V H X S+ 0 0 5 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.896 108.8 50.1 -69.1 -42.0 29.8 19.6 0.5 106 501 A H H X S+ 0 0 60 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.905 111.0 49.3 -58.9 -44.1 27.8 16.9 -1.3 107 502 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.855 112.3 47.6 -65.3 -37.2 29.9 17.6 -4.4 108 503 A T H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.870 110.8 51.6 -71.4 -37.5 33.1 17.3 -2.4 109 504 A E H X S+ 0 0 21 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.898 109.6 49.5 -65.2 -42.2 31.9 14.1 -0.7 110 505 A K H X S+ 0 0 95 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.895 111.1 50.2 -62.4 -42.1 31.1 12.6 -4.2 111 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0D 64 -2,-0.3 2,-0.4 -17,-0.2 -17,-0.2 -0.945 9.3-162.9-135.8 152.9 34.1 39.2 38.2 221 490 B G E -H 202 0D 1 -19,-1.3 -19,-2.4 -2,-0.3 2,-0.4 -0.988 4.4-161.6-130.0 143.7 31.8 39.8 35.2 222 491 B V E +H 201 0D 80 -2,-0.4 -21,-0.2 -21,-0.2 3,-0.1 -0.987 31.7 136.4-124.7 121.5 28.3 41.1 34.9 223 492 B H E -H 200 0D 55 -23,-1.4 -23,-2.1 -2,-0.4 6,-0.1 -0.984 61.2-122.9-160.5 147.0 26.3 40.4 31.8 224 493 B P S S+ 0 0 82 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.830 108.3 60.7 -56.5 -34.3 22.8 39.3 30.5 225 494 B D S > S- 0 0 69 1,-0.1 4,-1.7 -25,-0.1 5,-0.1 -0.887 75.8-155.9 -99.5 123.2 24.8 36.5 28.7 226 495 B Q H > S+ 0 0 107 -2,-0.5 4,-1.9 2,-0.2 5,-0.1 0.826 94.1 55.3 -68.7 -34.2 26.6 34.2 31.2 227 496 B T H > S+ 0 0 41 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.920 110.5 46.6 -62.4 -44.2 29.1 33.1 28.6 228 497 B V H > S+ 0 0 33 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.816 107.1 58.2 -66.9 -32.8 30.0 36.8 28.0 229 498 B A H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.903 106.1 48.1 -63.8 -42.8 30.2 37.4 31.8 230 499 B A H X S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.892 111.9 50.7 -62.0 -41.5 32.9 34.7 32.1 231 500 B V H X S+ 0 0 6 -4,-1.7 4,-2.3 2,-0.2 3,-0.4 0.942 109.6 50.1 -60.2 -50.2 34.7 36.4 29.1 232 501 B H H X S+ 0 0 69 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.947 109.6 50.7 -50.2 -53.9 34.4 39.8 30.9 233 502 B A H X S+ 0 0 0 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.756 110.3 50.9 -59.4 -27.4 35.8 38.3 34.1 234 503 B T H X S+ 0 0 0 -4,-1.4 4,-2.8 -3,-0.4 -1,-0.2 0.869 108.3 50.5 -76.7 -39.8 38.7 36.8 32.1 235 504 B E H X S+ 0 0 26 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.870 110.3 50.9 -64.3 -38.6 39.5 40.2 30.4 236 505 B K H X S+ 0 0 111 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.916 111.0 48.6 -63.6 -44.7 39.5 41.8 33.9 237 506 B M H X S+ 0 0 1 -4,-1.5 4,-1.9 -5,-0.2 3,-0.3 0.946 110.7 51.0 -57.0 -51.8 41.9 39.1 35.1 238 507 B L H X S+ 0 0 1 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.885 110.8 47.6 -55.9 -44.3 44.2 39.6 32.0 239 508 B N H < S+ 0 0 14 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.805 109.3 54.0 -70.4 -29.8 44.4 43.4 32.5 240 509 B Q H < S+ 0 0 102 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.859 113.8 41.8 -68.7 -37.1 45.2 42.9 36.2 241 510 B I H < S+ 0 0 37 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.683 119.6 42.5 -86.5 -20.3 48.1 40.6 35.5 242 511 B L S < S+ 0 0 29 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.301 85.6 125.8-105.8 5.8 49.4 42.7 32.5 243 512 B Q - 0 0 105 -4,-0.3 3,-0.1 -3,-0.2 -3,-0.1 -0.493 68.0-114.1 -66.6 126.4 48.9 46.0 34.3 244 513 B P - 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.343 53.0 -73.1 -59.2 143.7 52.1 48.1 34.4 245 514 B W - 0 0 199 1,-0.1 -3,-0.0 2,-0.1 0, 0.0 -0.078 38.2-137.7 -45.6 129.8 53.5 48.6 38.0 246 515 B Q 0 0 152 1,-0.2 -1,-0.1 -3,-0.1 0, 0.0 0.772 360.0 360.0 -59.6 -31.1 51.3 51.0 39.9 247 516 B I 0 0 187 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.145 360.0 360.0 71.2 360.0 54.4 52.7 41.4 248 !* 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 0.0 249 1 A I 0 0 117 0, 0.0 -209,-0.6 0, 0.0 -208,-0.4 0.000 360.0 360.0 360.0 360.0 34.5 30.5 -1.7 250 !* 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 0.0 251 1 B I 0 0 128 0, 0.0 -88,-2.5 0, 0.0 -91,-0.3 0.000 360.0 360.0 360.0 360.0 32.8 24.8 31.4