==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 24-AUG-10 2XOZ . COMPND 2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE CHFR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.OBEROI,R.BAYLISS . 425 4 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25595.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 240 56.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 22 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 4 3 3 0 0 0 0 0 0 3 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 424 A P 0 0 169 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.6 21.9 20.9 42.2 2 425 A Y - 0 0 114 2,-0.0 2,-0.4 10,-0.0 15,-0.0 -0.582 360.0-173.8 -67.7 127.3 22.7 22.2 45.7 3 426 A V - 0 0 37 -2,-0.4 2,-0.4 2,-0.0 9,-0.0 -0.993 15.6-171.7-132.0 131.3 26.4 23.0 45.7 4 427 A V + 0 0 56 -2,-0.4 2,-0.2 4,-0.1 -2,-0.0 -0.986 13.2 179.6-123.2 123.7 28.6 24.1 48.6 5 428 A C > - 0 0 11 -2,-0.4 3,-2.7 36,-0.1 38,-0.1 -0.731 48.2 -88.5-116.7 166.5 32.2 25.2 48.0 6 429 A R T 3 S+ 0 0 149 36,-0.5 37,-0.1 1,-0.3 -1,-0.0 0.722 128.7 40.8 -36.4 -31.9 35.1 26.5 50.1 7 430 A Q T 3 S+ 0 0 36 2,-0.1 20,-2.1 19,-0.0 -1,-0.3 0.266 84.5 119.3-113.5 8.5 33.7 30.0 49.6 8 431 A C S < S- 0 0 21 -3,-2.7 -4,-0.1 18,-0.2 2,-0.1 -0.504 73.0 -98.4 -71.7 146.4 30.0 29.5 50.0 9 432 A P >> - 0 0 18 0, 0.0 3,-1.6 0, 0.0 4,-1.3 -0.339 30.7-113.2 -65.4 145.9 28.3 31.4 52.9 10 433 A E H 3> S+ 0 0 108 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.804 113.7 61.2 -54.3 -35.0 27.6 29.5 56.2 11 434 A Y H 3> S+ 0 0 154 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.827 103.5 51.2 -65.2 -29.0 23.8 29.6 55.8 12 435 A R H <4 S+ 0 0 68 -3,-1.6 3,-0.4 2,-0.2 4,-0.4 0.903 107.6 53.4 -69.9 -42.6 24.2 27.6 52.6 13 436 A R H >< S+ 0 0 155 -4,-1.3 3,-1.2 1,-0.2 -2,-0.2 0.930 109.6 45.8 -56.1 -50.6 26.3 25.0 54.3 14 437 A Q H 3< S+ 0 0 134 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.648 106.4 61.3 -73.5 -15.8 23.8 24.3 57.1 15 438 A A T 3< S+ 0 0 60 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.472 81.9 102.7 -92.1 -4.2 20.9 24.1 54.7 16 439 A A S < S- 0 0 38 -3,-1.2 -3,-0.0 -4,-0.4 -13,-0.0 -0.231 89.2 -80.6 -70.4 168.0 22.2 21.1 52.7 17 440 A Q - 0 0 173 1,-0.1 -1,-0.1 -15,-0.0 -2,-0.1 -0.583 53.0-121.2 -70.3 127.1 20.9 17.5 53.2 18 441 A P - 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 -0.179 30.6 -93.9 -66.5 160.4 22.5 15.9 56.2 19 442 A P - 0 0 116 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.194 42.4-101.5 -66.7 164.2 24.6 12.7 56.0 20 443 A H - 0 0 168 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.705 31.7-144.8 -88.8 142.1 23.0 9.3 56.6 21 444 A a 0 0 104 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.930 360.0 360.0-112.1 133.4 23.6 7.6 60.0 22 445 A P 0 0 165 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.263 360.0 360.0 -55.5 360.0 24.1 3.8 60.4 23 ! 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 24 473 A D 0 0 204 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -44.7 38.1 36.7 51.0 25 474 A Y - 0 0 65 1,-0.1 2,-0.4 -17,-0.0 0, 0.0 -0.058 360.0-160.8 -50.5 146.7 35.4 36.2 48.3 26 475 A V - 0 0 88 -17,-0.0 -18,-0.2 -18,-0.0 -1,-0.1 -0.985 26.4-111.4-132.6 122.6 31.9 34.8 49.3 27 476 A C - 0 0 8 -20,-2.1 2,-0.1 -2,-0.4 6,-0.0 -0.279 31.8-141.1 -54.6 129.9 29.6 33.3 46.7 28 477 A P - 0 0 50 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 -0.310 22.7-107.6 -82.1 171.9 26.5 35.4 46.0 29 478 A L S S+ 0 0 92 1,-0.2 -2,-0.0 -2,-0.1 0, 0.0 0.894 117.3 45.2 -71.7 -40.0 23.0 34.0 45.4 30 479 A Q S S+ 0 0 167 2,-0.0 -1,-0.2 0, 0.0 2,-0.1 0.521 95.4 102.3 -84.1 -4.8 22.9 34.7 41.6 31 480 A G - 0 0 35 -3,-0.3 2,-0.2 1,-0.1 15,-0.1 -0.316 61.5-138.6 -77.4 161.0 26.4 33.3 41.1 32 481 A S - 0 0 71 13,-0.4 13,-3.4 -2,-0.1 2,-0.3 -0.746 4.7-134.6-117.7 164.2 27.3 29.9 39.7 33 482 A H E -A 44 0A 46 11,-0.3 2,-0.3 -2,-0.2 -29,-0.0 -0.862 10.3-159.4-113.7 152.3 29.9 27.2 40.4 34 483 A A E -A 43 0A 13 9,-3.0 9,-2.7 -2,-0.3 2,-0.6 -0.951 22.3-119.8-122.8 152.8 32.1 25.2 38.1 35 484 A L E -A 42 0A 108 -2,-0.3 2,-0.1 7,-0.2 6,-0.1 -0.825 29.2-118.3 -91.0 122.3 33.8 21.8 38.8 36 485 A C > - 0 0 1 5,-2.4 4,-1.8 -2,-0.6 32,-0.3 -0.399 18.5-137.9 -53.3 129.9 37.6 21.8 38.7 37 486 A T T 4 S+ 0 0 59 30,-3.5 31,-0.2 2,-0.2 -1,-0.2 0.705 97.7 45.3 -66.8 -22.5 38.5 19.4 35.9 38 487 A C T 4 S+ 0 0 13 29,-0.2 -1,-0.2 3,-0.1 30,-0.1 0.945 128.7 16.6 -87.4 -57.1 41.3 17.9 38.0 39 488 A C T 4 S- 0 0 10 2,-0.1 -2,-0.2 38,-0.0 -1,-0.1 0.479 89.4-130.5-100.4 -4.2 39.9 17.4 41.5 40 489 A F < + 0 0 144 -4,-1.8 -3,-0.1 1,-0.2 28,-0.0 0.586 59.9 139.1 63.6 11.8 36.1 17.6 40.7 41 490 A Q - 0 0 108 -6,-0.1 -5,-2.4 1,-0.1 -1,-0.2 -0.665 56.0-112.1 -85.6 141.2 35.6 20.1 43.6 42 491 A P E +A 35 0A 22 0, 0.0 -36,-0.5 0, 0.0 -7,-0.2 -0.445 35.8 179.0 -73.4 143.5 33.2 23.0 43.0 43 492 A M E -A 34 0A 1 -9,-2.7 -9,-3.0 -2,-0.1 2,-0.2 -0.935 40.9 -89.0-134.8 159.4 34.5 26.6 42.8 44 493 A P E -A 33 0A 4 0, 0.0 2,-1.1 0, 0.0 -11,-0.3 -0.533 43.3-123.3 -67.3 134.5 32.7 29.8 42.1 45 494 A D + 0 0 46 -13,-3.4 -13,-0.4 -2,-0.2 4,-0.2 -0.723 47.1 156.2 -86.2 100.9 32.6 30.5 38.4 46 495 A R > + 0 0 37 -2,-1.1 4,-1.9 1,-0.1 -1,-0.1 0.109 34.1 110.8-113.1 20.6 34.3 33.8 38.0 47 496 A R H > S+ 0 0 63 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.934 79.2 48.9 -60.3 -49.8 35.4 33.6 34.4 48 497 A V H >> S+ 0 0 108 1,-0.2 3,-0.7 2,-0.2 4,-0.6 0.929 111.5 50.8 -58.0 -45.5 33.0 36.1 33.0 49 498 A E H >4 S+ 0 0 79 1,-0.2 3,-1.0 -4,-0.2 -1,-0.2 0.880 106.6 56.1 -53.8 -40.6 34.0 38.6 35.7 50 499 A R H >< S+ 0 0 96 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.765 89.9 72.9 -69.8 -26.0 37.6 38.0 34.8 51 500 A E H << S+ 0 0 132 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.792 114.7 24.9 -60.0 -28.9 37.1 39.0 31.2 52 501 A Q T << S+ 0 0 175 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.114 125.6 55.3-120.4 17.0 36.8 42.6 32.3 53 502 A D X - 0 0 30 -3,-1.1 3,-2.0 -5,-0.1 -1,-0.2 -0.628 55.1-176.4-149.4 89.3 38.8 42.2 35.6 54 503 A P T 3 S+ 0 0 108 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.536 77.8 79.2 -64.8 -3.5 42.3 40.8 35.2 55 504 A R T 3 S+ 0 0 213 2,-0.1 2,-0.3 -5,-0.0 -5,-0.1 0.742 73.6 89.6 -76.7 -23.8 42.6 40.9 39.0 56 505 A V S < S- 0 0 8 -3,-2.0 3,-0.1 -7,-0.1 -3,-0.1 -0.587 89.9-112.8 -71.4 130.9 40.6 37.7 39.2 57 506 A A - 0 0 30 -2,-0.3 -11,-0.1 15,-0.1 15,-0.1 -0.334 38.1 -94.8 -62.6 145.0 42.8 34.6 39.1 58 507 A P - 0 0 26 0, 0.0 13,-0.2 0, 0.0 14,-0.2 -0.293 36.6-176.9 -57.2 144.3 42.6 32.4 36.0 59 508 A Q + 0 0 4 12,-0.1 9,-1.8 -3,-0.1 2,-0.3 0.206 58.9 53.7-131.2 10.7 40.2 29.4 36.3 60 509 A Q B S-B 67 0B 68 7,-0.3 2,-0.3 9,-0.1 -1,-0.1 -0.992 81.8-104.2-143.8 156.7 40.7 27.7 33.0 61 510 A C > - 0 0 0 5,-2.1 4,-1.5 -2,-0.3 90,-0.2 -0.613 26.6-144.0 -70.3 130.4 43.3 26.3 30.6 62 511 A A T 4 S+ 0 0 61 88,-2.5 89,-0.1 -2,-0.3 -1,-0.1 0.564 96.7 45.4 -79.3 -6.8 43.8 28.7 27.7 63 512 A V T 4 S+ 0 0 41 87,-0.2 -1,-0.2 3,-0.1 88,-0.1 0.861 128.1 19.5 -94.3 -56.8 44.3 25.8 25.3 64 513 A C T 4 S- 0 0 43 2,-0.1 -2,-0.2 1,-0.0 87,-0.1 0.593 90.8-139.3 -95.8 -12.1 41.5 23.3 26.1 65 514 A L < + 0 0 92 -4,-1.5 -3,-0.1 1,-0.2 86,-0.0 0.533 53.2 138.2 66.0 9.8 39.3 25.9 27.9 66 515 A Q - 0 0 98 1,-0.1 -5,-2.1 -6,-0.0 2,-0.3 -0.455 57.2-102.8 -76.0 157.7 38.3 23.5 30.7 67 516 A P B +B 60 0B 13 0, 0.0 -30,-3.5 0, 0.0 2,-0.3 -0.653 36.8 179.3 -90.3 142.2 38.2 24.8 34.3 68 517 A F - 0 0 15 -9,-1.8 4,-0.3 -2,-0.3 3,-0.2 -0.994 21.4-152.4-135.4 143.7 40.8 24.2 37.0 69 518 A C >> + 0 0 0 -2,-0.3 4,-2.3 1,-0.2 5,-0.7 0.575 68.6 97.2 -90.9 -7.1 40.9 25.5 40.5 70 519 A H H >5S+ 0 0 57 1,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.840 88.3 36.5 -59.8 -46.4 44.7 25.5 41.2 71 520 A L H 45S+ 0 0 65 -3,-0.2 -1,-0.3 -13,-0.2 -2,-0.1 0.780 115.5 58.4 -74.0 -27.3 45.6 29.2 40.5 72 521 A Y H 45S- 0 0 31 -4,-0.3 -2,-0.2 -3,-0.3 -1,-0.2 0.935 138.7 -24.0 -70.1 -45.7 42.3 30.3 42.0 73 522 A W H <5S- 0 0 42 -4,-2.3 -3,-0.2 -30,-0.0 -2,-0.2 0.272 101.0 -81.4-155.1 14.4 42.8 28.8 45.5 74 523 A G << - 0 0 27 -4,-1.5 2,-0.3 -5,-0.7 -4,-0.1 0.678 41.9-130.9 83.5 116.5 45.2 25.8 45.3 75 524 A C - 0 0 11 -5,-0.1 2,-0.4 2,-0.0 -7,-0.0 -0.687 18.0-162.4 -98.9 151.5 44.1 22.4 44.2 76 525 A T + 0 0 126 -2,-0.3 2,-0.3 2,-0.1 5,-0.1 -0.968 27.7 125.5-140.4 125.8 44.8 19.2 46.1 77 526 A R > - 0 0 112 -2,-0.4 3,-2.2 3,-0.3 2,-0.5 -0.890 63.1 -97.6-168.9 141.4 44.7 15.6 44.9 78 527 A T T 3 S+ 0 0 143 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.552 118.2 29.9 -59.8 115.1 47.1 12.6 44.8 79 528 A G T 3 S+ 0 0 46 -2,-0.5 2,-0.5 1,-0.3 -1,-0.2 0.160 94.3 108.6 115.5 -17.8 48.4 12.9 41.2 80 529 A C < + 0 0 26 -3,-2.2 -3,-0.3 1,-0.1 -1,-0.3 -0.831 38.8 179.2 -96.3 123.9 48.0 16.6 40.9 81 530 A Y S S- 0 0 103 -2,-0.5 -1,-0.1 10,-0.2 12,-0.1 0.452 81.1 -50.7 -96.3 -3.8 51.4 18.5 40.8 82 531 A G - 0 0 4 8,-0.1 9,-0.5 10,-0.1 -1,-0.1 0.377 62.4-150.0 116.9 90.7 49.6 21.8 40.4 83 532 A C S S+ 0 0 5 7,-0.1 70,-1.2 69,-0.1 2,-0.3 0.336 74.0 43.0 -87.0 -0.3 47.2 21.5 37.5 84 533 A L E +C 152 0C 0 68,-0.2 68,-0.2 69,-0.1 -1,-0.1 -0.961 69.5 126.1-145.2 127.2 47.2 25.1 36.1 85 534 A A E -C 151 0C 13 66,-2.0 66,-2.5 -2,-0.3 5,-0.2 -0.971 65.1 -74.8-168.0 156.8 50.2 27.3 35.6 86 535 A P E >> -C 150 0C 32 0, 0.0 3,-2.4 0, 0.0 4,-0.8 -0.453 55.6-114.2 -54.8 139.8 52.1 29.4 33.0 87 536 A F G >4 S+ 0 0 0 62,-2.8 3,-1.2 59,-0.4 61,-0.2 0.865 114.6 56.9 -50.0 -46.6 53.8 26.8 30.8 88 537 A C G 34 S+ 0 0 42 59,-3.0 -1,-0.3 1,-0.3 60,-0.1 0.612 117.0 36.4 -66.2 -9.1 57.3 27.8 31.9 89 538 A E G <4 S+ 0 0 124 -3,-2.4 -1,-0.3 58,-0.3 -2,-0.2 0.395 85.0 127.1-120.6 0.1 56.4 27.1 35.5 90 539 A L << - 0 0 0 -3,-1.2 2,-0.8 -4,-0.8 -7,-0.1 -0.373 58.7-129.8 -64.5 133.4 54.1 24.1 35.2 91 540 A N + 0 0 83 -9,-0.5 -10,-0.2 1,-0.1 -1,-0.1 -0.779 25.6 179.2 -84.8 112.4 55.0 21.1 37.3 92 541 A L - 0 0 2 -2,-0.8 3,-0.2 1,-0.2 -1,-0.1 0.478 44.0-116.7 -92.3 -4.8 55.1 18.0 35.1 93 542 A G > - 0 0 10 1,-0.2 3,-1.5 -12,-0.1 -1,-0.2 0.075 28.9 -73.7 88.5 161.3 56.1 15.7 37.9 94 543 A D T 3 S+ 0 0 149 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.743 127.8 49.6 -65.8 -26.4 59.2 13.6 38.6 95 544 A K T > S+ 0 0 142 1,-0.2 3,-1.5 -3,-0.2 -1,-0.3 0.076 70.6 116.7-102.0 23.6 58.3 11.0 36.0 96 545 A C T < S+ 0 0 10 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.708 72.4 58.2 -67.3 -18.0 57.6 13.3 33.1 97 546 A L T > S+ 0 0 24 -3,-0.4 3,-1.3 2,-0.1 2,-0.4 0.525 78.2 108.9 -87.6 -8.7 60.6 11.8 31.1 98 547 A D T < S- 0 0 86 -3,-1.5 7,-0.1 1,-0.3 5,-0.1 -0.599 104.3 -12.3 -70.1 122.3 59.1 8.3 31.2 99 548 A G T 3> S+ 0 0 14 -2,-0.4 4,-1.5 5,-0.1 -1,-0.3 0.688 93.2 142.3 58.3 19.7 57.9 7.5 27.7 100 549 A V T <4 + 0 0 5 -3,-1.3 2,-0.7 2,-0.2 65,-0.2 0.747 59.0 63.0 -63.6 -26.2 58.4 11.2 26.8 101 550 A L T >4 S- 0 0 1 3,-0.3 3,-3.1 -4,-0.3 7,-0.3 -0.909 137.8 -39.0-102.8 109.6 59.6 10.2 23.4 102 551 A N T 34 S- 0 0 37 -2,-0.7 -2,-0.2 1,-0.3 -1,-0.2 0.750 101.2 -74.3 50.5 29.8 56.9 8.5 21.4 103 552 A N T 3< S+ 0 0 123 -4,-1.5 2,-0.6 1,-0.2 -1,-0.3 0.868 100.8 142.1 49.0 35.0 55.8 6.6 24.5 104 553 A N <> - 0 0 1 -3,-3.1 4,-2.6 -5,-0.1 -3,-0.3 -0.913 40.4-167.4-117.2 105.5 58.9 4.7 23.8 105 554 A S H > S+ 0 0 78 -2,-0.6 4,-1.9 1,-0.2 -1,-0.1 0.785 88.1 53.5 -67.6 -30.2 60.8 3.8 26.9 106 555 A Y H > S+ 0 0 72 89,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.917 114.3 40.8 -70.2 -42.7 63.9 2.7 25.1 107 556 A E H > S+ 0 0 0 -6,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.845 115.5 53.0 -70.5 -32.7 64.1 6.1 23.2 108 557 A S H X S+ 0 0 0 -4,-2.6 4,-2.3 -7,-0.3 -2,-0.2 0.885 106.8 51.7 -69.4 -36.4 63.1 7.9 26.4 109 558 A D H X S+ 0 0 65 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.879 104.0 56.0 -73.4 -36.6 65.9 6.2 28.4 110 559 A I H X S+ 0 0 13 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.927 110.9 46.4 -53.4 -47.1 68.6 7.2 25.9 111 560 A L H X S+ 0 0 1 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.920 109.6 53.0 -64.8 -42.9 67.4 10.8 26.5 112 561 A K H X S+ 0 0 60 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.890 111.0 47.9 -60.0 -41.8 67.4 10.3 30.3 113 562 A N H X S+ 0 0 103 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.884 107.7 55.1 -63.8 -42.9 71.0 9.1 30.1 114 563 A Y H X S+ 0 0 34 -4,-2.4 4,-0.8 -5,-0.2 -2,-0.2 0.922 114.6 39.7 -56.1 -44.8 72.0 12.0 27.9 115 564 A L H ><>S+ 0 0 3 -4,-2.2 5,-2.9 2,-0.2 3,-0.5 0.900 114.8 51.0 -73.3 -43.3 70.7 14.4 30.5 116 565 A A H ><5S+ 0 0 71 -4,-2.7 3,-0.9 1,-0.3 -2,-0.2 0.863 104.7 58.9 -63.6 -38.3 71.9 12.5 33.5 117 566 A T H 3<5S+ 0 0 111 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.840 114.3 36.8 -58.0 -34.0 75.4 12.3 32.0 118 567 A R T <<5S- 0 0 88 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.353 113.6-112.4-105.8 5.9 75.5 16.1 31.8 119 568 A G T < 5 + 0 0 61 -3,-0.9 2,-0.2 -4,-0.4 -3,-0.2 0.725 67.4 147.6 71.2 22.6 73.7 16.8 35.1 120 569 A L < - 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0 0 5 -3,-2.1 2,-0.1 18,-0.2 -4,-0.1 -0.324 69.7-110.2 -60.0 147.0 6.0 -8.7 27.4 223 432 B P >> - 0 0 18 0, 0.0 4,-2.0 0, 0.0 3,-0.9 -0.468 31.1-105.3 -75.5 157.1 2.7 -7.1 28.5 224 433 B E H 3> S+ 0 0 113 1,-0.2 4,-3.7 2,-0.2 5,-0.3 0.865 117.1 59.0 -48.3 -47.7 2.1 -6.6 32.3 225 434 B Y H 34 S+ 0 0 132 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.863 109.7 45.1 -56.2 -34.5 -0.3 -9.5 32.7 226 435 B R H X4 S+ 0 0 40 -3,-0.9 3,-0.7 2,-0.2 4,-0.3 0.931 116.1 45.4 -73.9 -44.5 2.4 -11.8 31.5 227 436 B R H >< S+ 0 0 79 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.920 109.8 54.0 -61.3 -46.9 5.1 -10.2 33.7 228 437 B Q T 3< S+ 0 0 134 -4,-3.7 -1,-0.2 1,-0.3 -2,-0.2 0.628 103.7 60.5 -63.3 -14.0 2.9 -10.1 36.8 229 438 B A T < S+ 0 0 62 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.516 78.9 107.3 -97.8 -6.6 2.3 -13.8 36.4 230 439 B A S < S- 0 0 41 -3,-1.5 -13,-0.1 -4,-0.3 -3,-0.0 -0.173 82.2 -86.7 -64.3 164.8 5.9 -15.1 36.6 231 440 B Q - 0 0 171 1,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.522 47.5-109.6 -70.7 142.7 7.1 -16.9 39.7 232 441 B P - 0 0 103 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.399 32.1-115.6 -68.3 147.1 8.4 -14.7 42.6 233 442 B P - 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0 0 36 -4,-1.0 3,-2.4 -5,-0.1 -1,-0.2 -0.737 58.2-175.7-137.4 88.6 7.6 -8.9 6.8 268 503 B P T 3 S+ 0 0 101 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.467 78.0 80.7 -62.9 -1.3 11.2 -7.7 6.1 269 504 B R T 3 S+ 0 0 217 2,-0.1 2,-0.3 -5,-0.1 -5,-0.1 0.745 73.6 92.7 -74.1 -23.9 10.4 -4.7 8.3 270 505 B V S < S- 0 0 9 -3,-2.4 3,-0.1 -6,-0.1 16,-0.1 -0.533 89.0-110.7 -72.0 132.4 11.1 -6.9 11.3 271 506 B A - 0 0 29 -2,-0.3 -11,-0.1 15,-0.1 15,-0.1 -0.316 35.2 -98.9 -65.0 142.7 14.7 -6.6 12.5 272 507 B P - 0 0 24 0, 0.0 14,-0.2 0, 0.0 13,-0.2 -0.354 34.0-175.8 -59.3 140.5 17.0 -9.7 12.0 273 508 B Q + 0 0 3 12,-0.1 9,-1.9 -3,-0.1 2,-0.3 0.177 60.3 47.6-124.5 12.4 17.4 -11.8 15.2 274 509 B Q B S-F 281 0F 63 7,-0.3 2,-0.3 9,-0.1 90,-0.1 -0.995 83.4-100.3-151.4 156.2 20.0 -14.3 14.0 275 510 B C > - 0 0 0 5,-2.1 4,-1.4 -2,-0.3 90,-0.2 -0.593 28.8-139.7 -72.1 133.6 23.4 -14.7 12.2 276 511 B A T 4 S+ 0 0 49 88,-2.8 -1,-0.1 -2,-0.3 89,-0.1 0.783 96.7 43.3 -69.4 -23.7 22.8 -15.7 8.6 277 512 B V T 4 S+ 0 0 30 87,-0.4 -1,-0.1 1,-0.1 88,-0.1 0.962 127.9 19.1 -88.5 -59.8 25.8 -18.1 8.7 278 513 B C T 4 S- 0 0 48 2,-0.1 -2,-0.1 1,-0.0 -1,-0.1 0.640 91.5-136.2 -93.0 -13.1 25.7 -20.0 12.0 279 514 B L < + 0 0 99 -4,-1.4 -3,-0.1 1,-0.2 -1,-0.0 0.602 49.6 148.1 73.8 12.4 22.0 -19.3 12.7 280 515 B Q - 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0 0 57 0, 0.0 3,-1.6 0, 0.0 -2,-0.1 -0.302 13.5-125.6 -61.2 142.1 52.4 -2.4 -3.7 387 622 B A G > S+ 0 0 61 1,-0.3 3,-2.2 2,-0.2 8,-0.2 0.832 106.3 65.9 -56.5 -37.5 56.0 -3.1 -2.9 388 623 B S G 3 S+ 0 0 102 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.701 98.0 55.6 -61.7 -17.8 57.1 0.5 -3.3 389 624 B E G < S+ 0 0 83 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.275 102.6 68.1 -99.0 12.7 55.0 1.4 -0.3 390 625 B L S < S- 0 0 5 -3,-2.2 5,-0.1 -5,-0.1 -66,-0.0 -0.929 97.5 -86.8-125.9 154.3 56.7 -1.1 2.0 391 626 B P >> - 0 0 16 0, 0.0 4,-1.6 0, 0.0 3,-0.6 -0.304 34.0-132.2 -55.2 142.8 60.2 -1.3 3.4 392 627 B V H 3> S+ 0 0 105 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.798 107.0 62.0 -67.0 -31.4 62.6 -3.0 1.0 393 628 B A H 3> S+ 0 0 73 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.762 103.8 50.8 -66.9 -27.6 63.9 -5.2 3.8 394 629 B V H X4 S+ 0 0 9 -3,-0.6 3,-0.6 2,-0.2 -2,-0.2 0.938 113.3 42.3 -70.2 -50.9 60.3 -6.5 4.2 395 630 B T H 3< S+ 0 0 69 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.579 109.2 62.7 -75.9 -7.7 60.0 -7.3 0.5 396 631 B S H 3< S+ 0 0 82 -4,-1.1 -1,-0.2 -5,-0.1 -2,-0.2 0.743 74.7 107.5 -88.0 -28.7 63.5 -8.8 0.4 397 632 B R S << S- 0 0 28 -4,-0.7 21,-0.1 -3,-0.6 20,-0.1 -0.186 78.1-107.0 -51.1 140.8 63.0 -11.6 2.8 398 633 B P - 0 0 76 0, 0.0 21,-2.2 0, 0.0 2,-0.2 -0.385 40.4-101.3 -66.7 149.5 63.0 -15.2 1.3 399 634 B D B -h 419 0H 90 19,-0.2 2,-0.3 1,-0.1 21,-0.2 -0.478 31.2-117.0 -72.4 139.8 59.6 -16.9 1.2 400 635 B C > - 0 0 5 19,-2.3 3,-0.6 -2,-0.2 25,-0.2 -0.607 18.7-130.6 -71.3 138.2 58.7 -19.5 3.7 401 636 B Y T 3 S+ 0 0 132 -2,-0.3 24,-2.3 1,-0.2 25,-1.5 0.853 109.9 46.9 -53.1 -39.3 58.1 -22.9 2.1 402 637 B W T > S- 0 0 87 22,-0.2 3,-1.6 1,-0.2 -1,-0.2 0.662 91.4-179.9 -83.8 -17.7 54.9 -23.3 4.0 403 638 B G G X - 0 0 0 -3,-0.6 3,-2.0 1,-0.3 20,-0.2 -0.198 62.7 -2.5 60.9-140.4 53.8 -19.8 3.2 404 639 B R G 3 S+ 0 0 72 18,-2.4 -1,-0.3 1,-0.3 19,-0.1 0.659 135.9 55.4 -56.7 -19.9 50.4 -18.5 4.5 405 640 B N G < S+ 0 0 86 -3,-1.6 -1,-0.3 4,-0.0 -2,-0.2 0.369 75.0 132.5 -97.2 3.8 49.8 -22.0 6.1 406 641 B C < - 0 0 4 -3,-2.0 3,-0.4 1,-0.2 4,-0.1 -0.342 43.3-160.8 -61.9 131.2 53.0 -22.0 8.1 407 642 B R S > S+ 0 0 218 1,-0.2 3,-0.5 2,-0.1 -1,-0.2 0.659 88.2 58.9 -86.1 -16.9 52.4 -23.1 11.7 408 643 B T G > S+ 0 0 68 1,-0.2 3,-2.1 2,-0.1 7,-0.2 0.501 78.1 89.6 -87.5 -6.1 55.7 -21.6 12.9 409 644 B Q G 3 S+ 0 0 5 -3,-0.4 -89,-0.3 1,-0.3 -90,-0.2 0.641 72.6 72.9 -68.4 -10.7 54.9 -18.1 11.7 410 645 B V G < S+ 0 0 69 -3,-0.5 2,-0.5 -92,-0.1 -1,-0.3 0.523 82.3 85.4 -78.3 -6.6 53.3 -17.4 15.1 411 646 B K S <> S- 0 0 129 -3,-2.1 4,-2.3 1,-0.1 5,-0.2 -0.887 79.2-138.3-100.5 126.9 56.9 -17.3 16.5 412 647 B A H > S+ 0 0 68 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.851 96.1 50.1 -50.2 -54.0 58.6 -14.0 16.3 413 648 B H H > S+ 0 0 136 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.941 115.6 42.9 -57.1 -50.3 62.1 -15.0 15.2 414 649 B H H > S+ 0 0 40 -6,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.852 112.8 54.0 -62.1 -37.2 60.8 -17.2 12.4 415 650 B A H < S+ 0 0 0 -4,-2.3 -1,-0.2 -7,-0.2 -2,-0.2 0.850 107.6 51.1 -66.5 -35.2 58.2 -14.6 11.3 416 651 B M H < S+ 0 0 46 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.861 111.4 46.8 -69.1 -35.2 60.9 -11.9 11.0 417 652 B K H < S+ 0 0 116 -4,-1.4 2,-0.4 -5,-0.2 -2,-0.2 0.790 112.4 44.4 -84.3 -31.9 63.2 -14.0 8.8 418 653 B F S < S- 0 0 50 -4,-1.7 2,-0.3 -21,-0.1 -19,-0.2 -0.931 78.5-121.8-119.0 142.2 60.7 -15.3 6.3 419 654 B N B -h 399 0H 23 -21,-2.2 -19,-2.3 -2,-0.4 -16,-0.2 -0.576 22.9-176.3 -71.1 135.9 58.0 -13.7 4.3 420 655 B H + 0 0 0 -2,-0.3 2,-1.7 -21,-0.2 -14,-0.1 0.365 58.9 96.4-117.3 3.0 54.6 -15.3 4.9 421 656 B I S S+ 0 0 24 -18,-0.1 2,-0.3 -39,-0.1 -1,-0.1 -0.626 76.6 83.4 -85.4 76.0 52.5 -13.3 2.5 422 657 B C S S- 0 0 16 -2,-1.7 -18,-2.4 -20,-0.0 2,-0.1 -0.979 82.8 -85.0-168.1 165.3 52.9 -16.0 -0.1 423 658 B E - 0 0 105 -2,-0.3 2,-0.5 -20,-0.2 -20,-0.2 -0.411 47.5 -98.4 -80.3 156.0 51.6 -19.4 -1.3 424 659 B Q + 0 0 48 -22,-0.2 -22,-0.2 1,-0.1 -23,-0.1 -0.643 42.8 171.7 -70.3 124.3 52.6 -22.7 0.1 425 660 B T + 0 0 98 -24,-2.3 2,-0.3 -2,-0.5 -23,-0.2 0.526 59.3 51.4-114.7 -8.4 55.2 -24.1 -2.4 426 661 B R + 0 0 107 -25,-1.5 -1,-0.1 1,-0.1 0, 0.0 -0.984 45.8 177.1-131.6 144.8 56.4 -27.2 -0.4 427 662 B F 0 0 156 -2,-0.3 -1,-0.1 -3,-0.1 -25,-0.0 0.267 360.0 360.0-128.5 9.5 54.5 -30.0 1.1 428 663 B K 0 0 110 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.902 360.0 360.0 -60.8 360.0 57.2 -32.4 2.5