==== 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 TRANSFERASE 19-AUG-09 3IQ7 . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE HASPIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.FILIPPAKOPOULOS,J.ESWARAN,T.KEATES,N.BURGESS-BROWN,O.FEDOR . 328 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15556.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 18.3 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 . 5 1.5 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 . 21 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 1 1 0 1 0 0 0 0 0 2 0 1 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 1 0 1 2 1 2 1 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 2 1 0 0 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 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 1 471 A G 0 0 122 0, 0.0 93,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-126.2 -9.8 -9.0 -29.5 2 472 A P - 0 0 59 0, 0.0 93,-0.2 0, 0.0 127,-0.0 -0.268 360.0-138.7 -69.1 150.5 -7.3 -11.6 -28.2 3 473 A V E -a 95 0A 38 91,-2.3 93,-2.2 1,-0.1 5,-0.0 -0.680 27.7-101.5 -96.6 156.7 -4.4 -13.2 -30.3 4 474 A P E >> -a 96 0A 76 0, 0.0 3,-1.3 0, 0.0 4,-0.7 -0.339 37.8-104.1 -69.7 163.5 -3.5 -16.9 -30.2 5 475 A F H >> S+ 0 0 14 91,-0.6 4,-2.6 1,-0.2 3,-0.7 0.853 118.9 65.9 -53.5 -40.5 -0.3 -17.8 -28.1 6 476 A S H 34 S+ 0 0 78 1,-0.2 -1,-0.2 2,-0.2 8,-0.1 0.727 89.9 64.0 -60.7 -24.4 1.6 -18.3 -31.4 7 477 A H H <4 S+ 0 0 115 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.934 119.3 25.3 -57.5 -46.7 1.3 -14.5 -32.2 8 478 A C H << S+ 0 0 9 -3,-0.7 -2,-0.2 -4,-0.7 -1,-0.2 0.699 135.4 33.6 -85.0 -31.0 3.4 -13.8 -29.1 9 479 A L S < S- 0 0 2 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.1 -0.632 73.5-179.3-134.3 69.4 5.3 -17.0 -28.9 10 480 A P > - 0 0 62 0, 0.0 4,-2.2 0, 0.0 3,-0.3 -0.252 50.0 -85.5 -64.7 168.2 6.0 -18.4 -32.3 11 481 A T H > S+ 0 0 94 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.772 126.0 47.3 -48.6 -48.6 7.9 -21.8 -32.3 12 482 A E H > S+ 0 0 58 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.927 114.8 48.8 -66.1 -40.9 11.5 -20.6 -32.1 13 483 A K H 4 S+ 0 0 41 -3,-0.3 3,-0.3 1,-0.2 19,-0.2 0.881 113.1 47.2 -63.6 -40.5 10.6 -18.2 -29.3 14 484 A L H >< S+ 0 0 23 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.889 108.5 55.3 -67.3 -40.0 8.7 -21.1 -27.4 15 485 A Q H 3< S+ 0 0 131 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.729 106.9 51.1 -65.3 -21.4 11.6 -23.5 -27.9 16 486 A R T 3< S+ 0 0 159 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.495 84.9 118.8 -95.6 0.6 14.0 -21.0 -26.3 17 487 A C < + 0 0 13 -3,-1.4 2,-0.4 -4,-0.2 14,-0.2 -0.450 36.2 178.1 -72.1 133.0 11.7 -20.5 -23.2 18 488 A E E -B 30 0A 71 12,-2.2 12,-3.1 -2,-0.2 2,-0.3 -0.997 32.9-118.7-128.6 132.2 13.2 -21.4 -19.8 19 489 A K E +B 29 0A 15 -2,-0.4 10,-0.3 87,-0.3 3,-0.1 -0.544 35.4 171.1 -72.9 129.6 11.1 -20.9 -16.7 20 490 A I E - 0 0 48 8,-2.7 2,-0.3 1,-0.3 9,-0.2 0.479 56.8 -13.7-118.3 -9.2 12.9 -18.4 -14.4 21 491 A G E -B 28 0A 14 7,-1.6 7,-2.5 2,-0.0 -1,-0.3 -0.994 50.3-164.0-177.9 179.4 10.2 -17.7 -11.7 22 492 A E E +B 27 0A 49 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.984 6.1 173.9-163.0 163.2 6.7 -17.9 -10.4 23 493 A G E > -B 26 0A 18 3,-2.0 3,-1.6 -2,-0.3 -2,-0.0 -0.932 59.4 -74.8-160.1-174.6 4.2 -16.7 -7.9 24 494 A V T 3 S+ 0 0 87 -2,-0.3 30,-0.2 1,-0.3 -1,-0.1 0.899 126.7 65.4 -51.6 -37.2 0.5 -17.0 -7.2 25 495 A F T 3 S- 0 0 49 1,-0.1 19,-0.4 18,-0.1 2,-0.4 0.735 116.4 -99.7 -56.0 -29.9 0.1 -14.7 -10.2 26 496 A G E < -B 23 0A 6 -3,-1.6 -3,-2.0 17,-0.2 2,-0.3 -0.978 56.1 -26.9 144.0-134.2 1.4 -17.2 -12.6 27 497 A E E -BC 22 42A 5 15,-2.0 15,-2.6 -2,-0.4 2,-0.4 -0.905 31.4-151.8-136.8 149.6 4.7 -17.9 -14.4 28 498 A V E -BC 21 41A 25 -7,-2.5 -8,-2.7 -2,-0.3 -7,-1.6 -0.990 16.6-176.5-127.0 125.4 7.8 -16.2 -15.7 29 499 A F E -BC 19 40A 1 11,-2.6 11,-3.4 -2,-0.4 2,-0.4 -0.953 17.1-142.9-120.2 141.4 9.8 -17.4 -18.6 30 500 A Q E +BC 18 39A 58 -12,-3.1 -12,-2.2 -2,-0.4 9,-0.2 -0.856 37.4 141.5 -94.4 138.8 13.0 -16.1 -20.1 31 501 A T E - C 0 38A 2 7,-2.3 7,-2.1 -2,-0.4 2,-0.4 -0.748 47.3 -91.5-152.7-162.1 13.4 -16.3 -23.9 32 502 A I E - C 0 37A 58 5,-0.2 2,-0.5 -19,-0.2 -16,-0.1 -0.994 26.0-172.7-126.8 128.3 14.8 -14.3 -26.9 33 503 A A E > S- C 0 36A 15 3,-3.2 3,-1.2 -2,-0.4 -2,-0.0 -0.989 79.6 -19.0-121.8 120.8 12.8 -11.8 -29.0 34 504 A D T 3 S- 0 0 159 -2,-0.5 -1,-0.2 1,-0.3 0, 0.0 0.931 129.7 -50.2 43.0 58.7 14.7 -10.4 -32.1 35 505 A H T 3 S+ 0 0 187 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.671 119.0 113.6 57.9 24.6 18.0 -11.5 -30.7 36 506 A T E < -C 33 0A 79 -3,-1.2 -3,-3.2 100,-0.0 -1,-0.2 -0.986 69.8-117.9-128.4 128.6 17.3 -9.8 -27.4 37 507 A P E +C 32 0A 62 0, 0.0 100,-0.9 0, 0.0 2,-0.3 -0.357 40.2 173.1 -63.2 137.2 16.7 -11.5 -24.0 38 508 A V E -CD 31 136A 2 -7,-2.1 -7,-2.3 98,-0.2 2,-0.4 -0.965 29.0-135.5-141.6 161.6 13.3 -10.9 -22.5 39 509 A A E -CD 30 135A 12 96,-2.5 96,-3.3 -2,-0.3 2,-0.5 -0.982 19.0-156.7-120.8 127.4 11.3 -12.1 -19.5 40 510 A I E -CD 29 134A 4 -11,-3.4 -11,-2.6 -2,-0.4 2,-0.5 -0.944 2.5-162.3-111.9 118.7 7.6 -13.0 -20.1 41 511 A K E -CD 28 133A 14 92,-2.7 92,-2.9 -2,-0.5 2,-0.5 -0.910 10.2-163.2-103.1 123.9 5.2 -12.9 -17.3 42 512 A I E -CD 27 132A 3 -15,-2.6 -15,-2.0 -2,-0.5 2,-0.5 -0.969 8.3-177.9-118.7 122.2 2.0 -14.9 -18.1 43 513 A I E - D 0 131A 6 88,-2.6 88,-3.0 -2,-0.5 2,-0.2 -0.979 22.3-135.2-127.1 119.1 -1.1 -14.4 -16.0 44 514 A A E - D 0 130A 11 -2,-0.5 13,-0.6 -19,-0.4 2,-0.3 -0.506 33.3-175.4 -69.7 132.7 -4.4 -16.3 -16.5 45 515 A I E +eD 57 129A 3 84,-2.5 84,-0.7 -2,-0.2 13,-0.2 -0.944 47.3 10.6-129.8 157.0 -7.4 -13.9 -16.4 46 516 A E S S+ 0 0 107 11,-2.7 12,-0.1 -2,-0.3 84,-0.1 0.387 87.1 123.7 72.0 2.0 -11.2 -14.0 -16.5 47 517 A G - 0 0 16 10,-0.3 9,-0.6 82,-0.2 -1,-0.2 -0.521 62.8-130.7 -96.4 163.9 -11.6 -17.8 -16.0 48 518 A P S S+ 0 0 108 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.626 73.3 99.4 -87.8 -15.5 -13.5 -19.8 -13.4 49 519 A D S S- 0 0 60 1,-0.1 7,-0.4 6,-0.1 2,-0.2 -0.463 77.5-113.8 -75.4 147.4 -10.8 -22.2 -12.3 50 520 A L - 0 0 98 5,-0.1 2,-0.4 -2,-0.1 5,-0.2 -0.538 31.2-162.0 -69.7 140.5 -8.7 -21.7 -9.2 51 521 A V B > -G 54 0B 17 3,-3.1 3,-1.8 -2,-0.2 67,-0.0 -0.986 67.5 -20.8-131.7 117.2 -5.1 -21.1 -10.1 52 522 A N T 3 S- 0 0 18 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.872 130.0 -47.3 53.9 39.8 -2.4 -21.5 -7.4 53 523 A G T 3 S+ 0 0 67 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.457 122.8 83.5 85.6 -0.3 -5.0 -21.1 -4.6 54 524 A S B < S-G 51 0B 57 -3,-1.8 -3,-3.1 -30,-0.2 -1,-0.2 -0.945 78.6-107.1-134.3 156.9 -6.8 -18.1 -5.9 55 525 A H - 0 0 133 -2,-0.3 -5,-0.1 -5,-0.2 2,-0.1 -0.458 52.4 -95.8 -73.7 155.1 -9.5 -17.1 -8.3 56 526 A Q - 0 0 23 -9,-0.6 -11,-0.2 -7,-0.4 -1,-0.1 -0.427 37.7-109.7 -75.6 146.0 -8.3 -15.4 -11.5 57 527 A K B -e 45 0A 62 -13,-0.6 -11,-2.7 -2,-0.1 -10,-0.3 -0.409 27.4-127.6 -65.6 152.9 -8.2 -11.7 -11.8 58 528 A T > - 0 0 49 -13,-0.2 4,-1.6 -12,-0.1 5,-0.2 -0.468 33.0 -98.5 -84.4 167.5 -10.6 -9.9 -14.2 59 529 A F H > S+ 0 0 102 1,-0.2 4,-1.2 2,-0.2 3,-0.3 0.908 126.3 51.8 -53.8 -45.0 -9.3 -7.5 -16.8 60 530 A E H 4 S+ 0 0 73 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.832 108.6 50.1 -64.0 -35.9 -10.2 -4.6 -14.5 61 531 A E H 4 S+ 0 0 110 -3,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.782 112.5 46.3 -74.1 -25.9 -8.3 -6.1 -11.6 62 532 A I H X S+ 0 0 2 -4,-1.6 4,-1.7 -3,-0.3 3,-0.3 0.660 92.9 82.8 -88.6 -16.3 -5.1 -6.7 -13.7 63 533 A L H X S+ 0 0 65 -4,-1.2 4,-3.0 -5,-0.2 5,-0.3 0.897 81.7 59.0 -59.4 -41.3 -5.2 -3.2 -15.2 64 534 A P H > S+ 0 0 28 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.922 106.3 48.3 -57.8 -41.5 -3.5 -1.4 -12.3 65 535 A E H > S+ 0 0 8 -4,-0.3 4,-2.5 -3,-0.3 5,-0.2 0.921 112.9 49.6 -60.9 -41.1 -0.3 -3.6 -12.7 66 536 A I H X S+ 0 0 8 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.954 112.1 46.6 -63.5 -52.1 -0.3 -2.9 -16.4 67 537 A I H X S+ 0 0 58 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.917 115.2 45.6 -54.1 -46.8 -0.7 0.9 -16.0 68 538 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.3 5,-0.3 0.900 109.3 54.1 -72.8 -38.8 2.0 1.1 -13.3 69 539 A S H X S+ 0 0 1 -4,-2.5 4,-1.8 -5,-0.2 20,-0.2 0.911 113.1 45.2 -57.4 -45.3 4.5 -1.1 -15.2 70 540 A K H X S+ 0 0 113 -4,-2.1 4,-1.3 -5,-0.2 -2,-0.2 0.932 113.1 48.6 -62.3 -48.4 4.1 1.2 -18.2 71 541 A E H < S+ 0 0 42 -4,-2.7 4,-0.4 1,-0.2 3,-0.3 0.917 114.1 45.8 -62.4 -43.4 4.4 4.4 -16.2 72 542 A L H >< S+ 0 0 2 -4,-2.9 3,-1.1 1,-0.2 4,-0.3 0.838 105.2 60.5 -68.5 -33.6 7.5 3.2 -14.3 73 543 A S H >< S+ 0 0 22 -4,-1.8 3,-1.0 -5,-0.3 -1,-0.2 0.830 98.4 62.0 -61.2 -29.8 9.2 1.9 -17.6 74 544 A L G >X S+ 0 0 89 -4,-1.3 3,-1.8 -3,-0.3 4,-0.6 0.704 80.9 81.0 -68.1 -21.7 9.0 5.5 -18.8 75 545 A L G <4 S+ 0 0 3 -3,-1.1 8,-1.3 -4,-0.4 3,-0.4 0.735 79.6 66.5 -62.8 -23.5 11.2 6.9 -16.1 76 546 A S G <4 S+ 0 0 54 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.1 0.720 108.4 39.6 -68.4 -21.3 14.4 5.8 -17.9 77 547 A G T <4 S+ 0 0 64 -3,-1.8 -1,-0.2 -4,-0.2 -2,-0.2 0.395 96.5 100.3-109.2 -0.6 13.7 8.4 -20.7 78 548 A E < - 0 0 95 -4,-0.6 4,-0.1 -3,-0.4 -3,-0.0 -0.127 56.6-152.1 -77.7-178.4 12.4 11.2 -18.6 79 549 A V S S+ 0 0 114 2,-0.2 3,-0.4 3,-0.0 122,-0.2 0.730 82.3 38.4-123.6 -57.2 14.4 14.3 -17.5 80 550 A C S S+ 0 0 81 1,-0.3 121,-2.8 120,-0.1 2,-0.4 0.844 133.3 24.8 -69.6 -39.7 13.4 16.0 -14.2 81 551 A N S S+ 0 0 20 118,-0.2 2,-0.4 119,-0.2 -1,-0.3 -0.871 89.5 158.6-128.1 93.0 12.8 12.7 -12.5 82 552 A R B +H 198 0C 60 116,-1.8 116,-2.6 -2,-0.4 2,-0.3 -0.960 5.6 149.3-123.2 137.6 14.8 10.0 -14.4 83 553 A T - 0 0 7 -8,-1.3 3,-0.3 -2,-0.4 -5,-0.2 -0.953 36.9-152.4-160.7 146.9 16.1 6.6 -13.3 84 554 A E S S+ 0 0 89 112,-0.5 4,-0.1 -2,-0.3 -8,-0.1 0.275 72.9 105.2 -95.5 12.4 16.9 3.3 -15.0 85 555 A G + 0 0 1 129,-0.1 130,-2.6 76,-0.1 2,-0.4 0.433 63.3 71.2 -78.7 -2.1 16.1 1.5 -11.8 86 556 A F B S-j 215 0D 8 -3,-0.3 130,-0.2 128,-0.2 -10,-0.1 -0.937 94.4 -96.1-113.6 144.8 12.7 0.0 -12.8 87 557 A I - 0 0 3 128,-2.1 2,-0.3 -2,-0.4 -2,-0.1 -0.189 37.3-116.2 -59.2 138.2 12.3 -2.7 -15.3 88 558 A G - 0 0 13 -4,-0.1 48,-2.4 -14,-0.1 2,-0.6 -0.551 20.8-148.4 -74.5 133.7 11.6 -1.9 -18.9 89 559 A L E - 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0 0 1 -3,-0.7 11,-0.6 10,-0.1 2,-0.3 -0.071 41.2-159.5 -71.1 167.5 1.8 -1.0 -6.1 222 692 A R E +NO 176 231F 6 -46,-2.1 -46,-2.7 9,-0.2 2,-0.3 -0.992 18.7 152.6-144.9 139.1 0.1 2.5 -6.0 223 693 A L E - O 0 230F 4 7,-2.2 7,-2.8 -2,-0.3 2,-0.3 -0.922 22.1-146.5-154.1 177.0 0.8 5.7 -7.8 224 694 A E E - O 0 229F 29 -51,-2.3 2,-0.4 -2,-0.3 5,-0.2 -0.991 7.1-167.0-151.2 147.3 -1.1 8.8 -8.9 225 695 A R E > S- O 0 228F 135 3,-1.8 3,-2.2 -2,-0.3 -52,-0.1 -0.989 82.1 -11.2-136.4 127.3 -1.0 11.3 -11.8 226 696 A D T 3 S- 0 0 160 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.850 130.2 -54.0 49.3 44.6 -3.0 14.6 -11.6 227 697 A G T 3 S+ 0 0 52 1,-0.2 2,-0.6 0, 0.0 -1,-0.3 0.485 108.9 123.3 73.9 6.1 -4.9 13.3 -8.6 228 698 A I E < -O 225 0F 120 -3,-2.2 -3,-1.8 2,-0.0 2,-0.3 -0.910 50.8-151.2-101.7 117.5 -6.0 10.0 -10.2 229 699 A V E -O 224 0F 50 -2,-0.6 2,-0.4 -5,-0.2 -5,-0.2 -0.697 11.6-166.7 -92.6 137.6 -4.8 7.1 -8.1 230 700 A V E +O 223 0F 27 -7,-2.8 -7,-2.2 -2,-0.3 2,-0.3 -0.995 32.8 133.1-120.7 124.9 -4.1 3.7 -9.6 231 701 A F E -O 222 0F 62 -2,-0.4 2,-0.6 -9,-0.2 -9,-0.2 -0.980 57.6 -94.3-161.1 169.6 -3.7 1.0 -7.0 232 702 A C - 0 0 27 -11,-0.6 2,-1.1 -12,-0.4 -171,-0.0 -0.904 32.6-144.2 -97.7 117.4 -4.5 -2.5 -5.7 233 703 A D + 0 0 104 -2,-0.6 3,-0.3 1,-0.2 29,-0.0 -0.701 32.9 160.6 -82.0 98.1 -7.4 -2.5 -3.3 234 704 A V > + 0 0 8 -2,-1.1 3,-0.7 1,-0.2 -1,-0.2 0.079 36.1 116.0-106.2 19.3 -6.4 -5.2 -0.8 235 705 A S T 3 S+ 0 0 33 1,-0.2 -1,-0.2 26,-0.1 -2,-0.0 0.723 86.0 35.5 -61.0 -26.1 -8.8 -3.9 1.9 236 706 A M T 3 S+ 0 0 178 -3,-0.3 2,-1.2 1,-0.0 -1,-0.2 0.403 89.7 105.8-106.0 -2.4 -10.8 -7.2 1.7 237 707 A D < + 0 0 68 -3,-0.7 4,-0.3 1,-0.2 3,-0.1 -0.670 42.2 173.2 -78.1 97.7 -7.8 -9.5 1.1 238 708 A E > + 0 0 65 -2,-1.2 3,-1.3 1,-0.2 -1,-0.2 0.890 68.8 59.3 -77.6 -38.0 -7.5 -11.1 4.6 239 709 A D G > S+ 0 0 128 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.749 89.3 69.5 -62.3 -31.9 -4.8 -13.7 3.7 240 710 A L G 3 S+ 0 0 32 1,-0.2 3,-0.4 2,-0.1 -1,-0.3 0.790 104.2 46.0 -53.9 -26.1 -2.2 -11.1 2.6 241 711 A F G < S+ 0 0 17 -3,-1.3 -1,-0.2 -4,-0.3 -2,-0.2 0.317 100.9 63.3-109.6 8.2 -1.9 -10.1 6.3 242 712 A T S < S+ 0 0 102 -3,-1.4 -1,-0.2 -4,-0.1 -2,-0.1 0.062 71.1 127.0-120.0 19.7 -1.7 -13.5 8.0 243 713 A G - 0 0 19 -3,-0.4 2,-0.3 6,-0.3 3,-0.0 -0.323 35.5-172.6 -73.3 163.5 1.6 -14.8 6.6 244 714 A D + 0 0 146 1,-0.1 3,-0.1 -2,-0.0 -2,-0.0 -0.967 46.9 57.4-151.1 165.7 4.5 -16.1 8.8 245 715 A G S S+ 0 0 74 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.476 97.5 59.9 91.7 4.1 8.2 -17.2 8.9 246 716 A D S >> S- 0 0 42 1,-0.1 3,-1.4 -3,-0.0 4,-0.5 -0.965 81.0-122.4-160.6 141.4 9.7 -14.1 7.4 247 717 A Y H >> S+ 0 0 56 -2,-0.3 4,-1.3 1,-0.2 3,-1.1 0.791 104.5 78.5 -52.9 -30.3 9.9 -10.5 8.2 248 718 A Q H >> S+ 0 0 27 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.870 90.1 53.5 -42.2 -46.0 8.3 -9.9 4.7 249 719 A F H <> S+ 0 0 60 -3,-1.4 4,-1.0 1,-0.3 -6,-0.3 0.712 100.8 58.2 -76.6 -21.6 4.9 -10.8 6.2 250 720 A D H S+ 0 0 71 -4,-1.9 5,-1.6 1,-0.2 4,-0.5 0.852 110.3 51.2 -69.4 -36.9 -2.2 -1.9 6.8 257 727 A K H ><5S+ 0 0 107 -4,-2.2 3,-0.6 1,-0.2 -1,-0.2 0.921 112.3 46.8 -61.2 -45.1 -1.9 -0.5 10.3 258 728 A E H 3<5S+ 0 0 65 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.726 118.5 38.8 -79.9 -21.3 -0.4 2.8 9.0 259 729 A N H ><5S- 0 0 3 -4,-1.6 3,-2.5 -5,-0.2 -1,-0.2 0.273 103.2-124.1-107.9 6.3 -3.0 3.4 6.2 260 730 A N T <<5S- 0 0 102 -3,-0.6 -3,-0.2 -4,-0.5 -4,-0.1 0.866 70.5 -60.6 58.3 35.1 -6.0 2.2 8.2 261 731 A N T 3 + 0 0 52 -2,-0.7 3,-2.4 -4,-0.1 4,-0.3 -0.738 11.2 180.0-127.6 81.1 2.0 6.6 2.4 268 738 A P T >> S+ 0 0 28 0, 0.0 3,-1.3 0, 0.0 4,-0.9 0.684 71.6 82.9 -59.9 -13.4 5.6 6.8 1.1 269 739 A Y H 3> S+ 0 0 60 1,-0.3 4,-2.1 2,-0.2 3,-0.3 0.807 76.1 72.0 -56.1 -27.3 6.7 5.4 4.5 270 740 A S H <> S+ 0 0 3 -3,-2.4 4,-1.9 1,-0.2 -1,-0.3 0.871 90.7 56.8 -62.0 -33.0 5.9 2.0 3.0 271 741 A N H <> S+ 0 0 0 -3,-1.3 4,-2.2 -4,-0.3 -1,-0.2 0.897 106.2 51.2 -61.7 -34.4 8.9 2.3 0.8 272 742 A V H X S+ 0 0 0 -4,-0.9 4,-2.4 -3,-0.3 -2,-0.2 0.918 105.8 54.5 -68.4 -42.0 11.1 2.8 3.9 273 743 A L H X S+ 0 0 3 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.914 111.0 45.2 -56.4 -44.2 9.6 -0.3 5.5 274 744 A W H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.925 111.4 52.1 -69.5 -39.9 10.6 -2.4 2.5 275 745 A L H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.871 110.1 49.5 -61.1 -36.8 14.0 -0.9 2.4 276 746 A H H X S+ 0 0 22 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.932 110.1 50.8 -67.4 -46.4 14.4 -1.8 6.1 277 747 A Y H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.909 112.8 47.2 -51.6 -46.1 13.3 -5.4 5.3 278 748 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.871 108.4 52.7 -67.2 -39.4 15.9 -5.5 2.5 279 749 A T H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.877 108.5 53.0 -64.4 -39.3 18.7 -4.0 4.7 280 750 A D H X S+ 0 0 12 -4,-2.3 4,-1.9 2,-0.2 5,-0.4 0.935 106.9 50.8 -59.6 -48.1 17.9 -6.8 7.2 281 751 A K H X S+ 0 0 1 -4,-2.1 4,-2.6 1,-0.2 5,-0.4 0.923 109.8 52.0 -55.1 -44.3 18.2 -9.5 4.5 282 752 A M H < S+ 0 0 1 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.837 113.9 42.0 -63.5 -34.6 21.5 -8.0 3.6 283 753 A L H < S+ 0 0 50 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.720 129.8 22.7 -83.5 -21.7 22.8 -8.1 7.3 284 754 A K H < S+ 0 0 148 -4,-1.9 -3,-0.2 -3,-0.3 -2,-0.2 0.719 123.8 38.2-117.7 -32.1 21.5 -11.6 8.1 285 755 A Q S < S+ 0 0 84 -4,-2.6 2,-0.4 -5,-0.4 -3,-0.2 0.300 92.5 89.4-118.8 9.4 20.9 -13.8 5.1 286 756 A M - 0 0 17 -5,-0.4 2,-0.4 -4,-0.3 -139,-0.2 -0.897 52.8-157.1-115.0 138.9 23.8 -13.0 2.7 287 757 A T - 0 0 81 -141,-2.2 -138,-0.6 -2,-0.4 2,-0.4 -0.879 18.0-151.0-109.6 142.4 27.2 -14.6 2.4 288 758 A F B -m 149 0E 26 -2,-0.4 -138,-0.2 1,-0.1 -137,-0.2 -0.894 21.7-137.5-121.3 145.8 29.9 -12.6 0.8 289 759 A K S S+ 0 0 105 -140,-2.0 2,-0.4 -2,-0.4 -138,-0.2 0.918 100.8 46.6 -65.1 -42.2 33.1 -13.5 -1.1 290 760 A T S S- 0 0 65 -140,-3.5 -138,-0.3 -141,-0.2 -1,-0.1 -0.876 93.0-135.1-105.6 134.6 35.1 -10.9 0.8 291 761 A K - 0 0 118 -2,-0.4 2,-1.5 1,-0.1 3,-0.4 0.115 24.8 -85.3 -88.9-177.4 34.6 -10.8 4.6 292 762 A C S S+ 0 0 67 1,-0.2 -1,-0.1 -4,-0.1 -141,-0.0 -0.653 94.0 93.6 -77.5 72.5 34.1 -9.0 7.7 293 763 A N + 0 0 118 -2,-1.5 -1,-0.2 1,-0.1 3,-0.1 0.445 53.4 72.6-159.2 9.5 37.9 -8.3 8.2 294 764 A T S > S- 0 0 63 -3,-0.4 4,-2.8 1,-0.1 5,-0.2 -0.879 73.4-119.1-116.8 162.1 39.7 -5.0 6.9 295 765 A P H > S+ 0 0 113 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.931 113.9 49.0 -62.3 -48.6 39.3 -1.5 8.5 296 766 A A H > S+ 0 0 67 1,-0.2 4,-1.2 2,-0.2 0, 0.0 0.866 117.1 45.2 -55.5 -40.0 37.8 0.2 5.3 297 767 A M H > S+ 0 0 31 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.892 107.9 52.5 -72.2 -48.4 35.3 -2.7 5.1 298 768 A K H X S+ 0 0 44 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.799 107.7 55.9 -60.0 -32.4 34.3 -3.0 8.8 299 769 A Q H X S+ 0 0 89 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.902 104.5 51.4 -64.3 -44.9 33.4 0.8 8.6 300 770 A I H X S+ 0 0 38 -4,-1.2 4,-2.1 1,-0.2 -2,-0.2 0.950 111.6 48.4 -59.9 -46.8 31.1 0.1 5.7 301 771 A K H X S+ 0 0 64 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.839 108.4 52.8 -58.3 -39.2 29.4 -2.6 7.8 302 772 A R H X S+ 0 0 143 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.906 109.6 50.9 -66.7 -37.7 29.1 -0.2 10.7 303 773 A K H X S+ 0 0 91 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.892 108.6 50.0 -65.3 -39.1 27.4 2.2 8.4 304 774 A I H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.895 111.8 48.7 -68.3 -37.6 24.9 -0.3 7.1 305 775 A Q H X S+ 0 0 82 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.900 110.7 50.1 -67.0 -38.4 24.1 -1.3 10.7 306 776 A E H X S+ 0 0 47 -4,-2.3 4,-1.1 2,-0.2 5,-0.2 0.918 110.7 50.5 -67.4 -36.2 23.6 2.3 11.7 307 777 A F H >X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 3,-0.7 0.955 108.2 53.7 -61.5 -48.3 21.3 2.8 8.6 308 778 A H H 3< S+ 0 0 43 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.901 112.1 42.4 -52.0 -46.0 19.4 -0.3 9.7 309 779 A R H 3< S+ 0 0 179 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.605 124.9 34.2 -83.8 -10.9 18.7 1.1 13.2 310 780 A T H X< S+ 0 0 33 -4,-1.1 3,-2.1 -3,-0.7 -2,-0.2 0.635 92.8 83.6-115.3 -24.5 17.9 4.7 12.1 311 781 A M G >< S+ 0 0 0 -4,-3.1 3,-2.0 1,-0.3 -3,-0.1 0.835 79.8 68.7 -54.1 -31.7 16.2 4.4 8.7 312 782 A L G 3 S+ 0 0 54 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.609 89.8 65.5 -68.6 -7.2 12.7 3.8 10.2 313 783 A N G < S+ 0 0 143 -3,-2.1 2,-0.3 2,-0.0 -1,-0.3 0.211 85.8 89.1 -94.3 12.5 12.8 7.4 11.5 314 784 A F S < S- 0 0 41 -3,-2.0 -42,-0.1 -45,-0.1 3,-0.1 -0.855 73.3-139.2-109.1 151.7 12.7 8.8 8.0 315 785 A S S S- 0 0 74 -2,-0.3 2,-0.3 1,-0.1 -43,-0.1 0.545 71.3 -6.8 -94.5 -9.2 9.4 9.5 6.2 316 786 A S S > S- 0 0 13 -47,-0.1 4,-2.1 1,-0.1 -47,-0.1 -0.966 74.3 -92.8-170.6 166.7 10.0 8.3 2.6 317 787 A A H > S+ 0 0 0 -49,-0.4 4,-3.1 -2,-0.3 -150,-0.2 0.865 126.4 54.9 -58.2 -39.3 12.7 7.0 0.3 318 788 A T H > S+ 0 0 37 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.924 106.9 49.8 -60.4 -45.9 13.2 10.6 -0.8 319 789 A D H > S+ 0 0 47 2,-0.2 4,-1.7 1,-0.2 5,-0.3 0.921 113.5 45.8 -61.0 -46.0 13.8 11.6 2.8 320 790 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 7,-0.2 0.950 114.1 48.2 -59.2 -50.7 16.4 8.8 3.3 321 791 A L H < S+ 0 0 12 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.921 119.7 37.3 -58.5 -45.7 18.1 9.6 -0.0 322 792 A C H < S+ 0 0 58 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.693 131.0 23.3 -80.8 -22.9 18.4 13.3 0.7 323 793 A Q H < S+ 0 0 121 -4,-1.7 2,-0.2 -3,-0.2 -3,-0.2 0.597 88.0 104.5-125.9 -18.0 19.1 13.2 4.5 324 794 A H >< - 0 0 2 -4,-2.5 3,-1.3 -5,-0.3 4,-0.2 -0.526 63.7-136.3 -78.2 139.9 20.6 9.9 5.6 325 795 A S G > S+ 0 0 63 1,-0.3 3,-1.5 -2,-0.2 -1,-0.1 0.750 96.0 75.0 -65.6 -24.9 24.3 9.8 6.4 326 796 A L G 3 S+ 0 0 4 1,-0.3 -1,-0.3 -23,-0.1 -166,-0.1 0.838 102.0 41.6 -52.9 -31.6 24.8 6.5 4.6 327 797 A F G < 0 0 29 -3,-1.3 -1,-0.3 -7,-0.2 -2,-0.2 0.331 360.0 360.0-105.4 1.8 24.5 8.3 1.3 328 798 A K < 0 0 192 -3,-1.5 -5,-0.0 -4,-0.2 -3,-0.0 -0.315 360.0 360.0 -85.9 360.0 26.6 11.4 2.2