==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-APR-13 4BHZ . COMPND 2 MOLECULE: DUAL SPECIFICITY PROTEIN KINASE TTK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.R.LANGDON,I.M.WESTWOOD,R.L.M.VAN MONTFORT,N.BROWN,J.BLAGG . 251 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12619.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 16.3 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 . 1 0.4 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 . 16 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 2 1 0 1 0 1 1 0 0 0 0 0 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 1 1 1 2 1 1 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 1 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 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 1 516 A Q 0 0 112 0, 0.0 11,-1.5 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 131.7 14.0 -56.3 17.1 2 517 A S E -A 11 0A 84 9,-0.2 2,-0.3 23,-0.0 9,-0.2 -0.822 360.0-171.1-136.1 171.3 14.5 -54.7 20.5 3 518 A M E -A 10 0A 25 7,-1.5 7,-2.9 -2,-0.2 2,-0.6 -0.946 17.6-133.8-164.9 145.9 15.2 -51.3 22.4 4 519 A S E +A 9 0A 67 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.905 18.2 177.6-112.1 112.3 15.9 -50.0 26.0 5 520 A V E > S-A 8 0A 0 3,-2.0 3,-2.3 -2,-0.6 -2,-0.0 -0.959 78.3 -22.3-111.3 123.1 14.1 -47.0 27.5 6 521 A K T 3 S- 0 0 123 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.877 126.6 -50.1 40.2 59.1 15.2 -46.2 31.2 7 522 A G T 3 S+ 0 0 76 -3,-0.2 2,-0.4 1,-0.2 -1,-0.3 0.271 114.7 116.4 70.7 -10.6 16.5 -49.8 31.9 8 523 A R E < -A 5 0A 63 -3,-2.3 -3,-2.0 19,-0.0 2,-0.3 -0.776 62.1-131.5 -96.2 132.5 13.2 -51.4 30.5 9 524 A I E -A 4 0A 56 -2,-0.4 19,-0.5 -5,-0.2 2,-0.4 -0.683 22.5-171.0 -85.5 131.3 13.3 -53.7 27.4 10 525 A Y E -AB 3 27A 15 -7,-2.9 -7,-1.5 -2,-0.3 2,-0.5 -0.994 13.3-145.6-126.5 130.9 10.8 -53.1 24.6 11 526 A S E -AB 2 26A 56 15,-3.0 15,-2.3 -2,-0.4 -9,-0.2 -0.843 20.7-127.8 -98.8 127.3 10.2 -55.3 21.5 12 527 A I E + B 0 25A 54 -11,-1.5 13,-0.2 -2,-0.5 3,-0.1 -0.515 29.1 172.9 -73.7 139.0 9.2 -53.6 18.2 13 528 A L E - 0 0 85 11,-3.3 2,-0.3 1,-0.5 12,-0.2 0.725 65.4 -23.2-108.9 -48.3 6.1 -54.9 16.5 14 529 A K E - B 0 24A 100 10,-1.2 10,-3.3 0, 0.0 -1,-0.5 -0.973 62.1-105.6-159.8 159.4 5.7 -52.4 13.6 15 530 A Q E - B 0 23A 120 -2,-0.3 8,-0.3 8,-0.3 10,-0.0 -0.771 28.5-180.0 -90.8 137.1 6.6 -48.8 12.6 16 531 A I 0 0 94 6,-3.3 7,-0.2 -2,-0.4 -1,-0.2 0.846 360.0 360.0 -97.6 -68.7 3.8 -46.2 12.8 17 532 A G 0 0 55 5,-0.3 6,-0.1 0, 0.0 3,-0.1 0.194 360.0 360.0-105.0 360.0 5.3 -42.8 11.7 18 ! 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 19 536 A S 0 0 112 0, 0.0 20,-2.8 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -51.2 14.6 -37.2 12.2 20 537 A S E - C 0 38A 60 18,-0.2 2,-0.4 -3,-0.1 18,-0.2 -0.974 360.0-179.2-125.9 130.9 11.6 -38.9 14.0 21 538 A K E - C 0 37A 20 16,-1.8 16,-3.5 -2,-0.4 2,-0.4 -0.949 12.4-155.8-119.5 135.2 10.3 -42.5 13.8 22 539 A V E - C 0 36A 41 -2,-0.4 -6,-3.3 14,-0.2 2,-0.3 -0.947 17.0-172.4-113.0 136.5 7.2 -43.8 15.9 23 540 A F E -BC 15 35A 37 12,-2.0 12,-2.8 -2,-0.4 2,-0.5 -0.945 27.9-125.9-129.8 155.2 6.8 -47.5 16.6 24 541 A Q E +BC 14 34A 39 -10,-3.3 -11,-3.3 -2,-0.3 -10,-1.2 -0.855 44.7 177.1 -96.4 122.8 4.3 -49.9 18.1 25 542 A V E -BC 12 33A 0 8,-2.7 8,-2.6 -2,-0.5 2,-0.4 -0.844 29.0-139.7-128.4 165.5 6.1 -51.9 20.9 26 543 A L E -BC 11 32A 50 -15,-2.3 -15,-3.0 -2,-0.3 6,-0.2 -0.992 20.8-144.5-122.7 134.2 5.6 -54.6 23.7 27 544 A N E > -B 10 0A 29 4,-2.2 3,-1.7 -2,-0.4 -17,-0.2 -0.176 38.0 -89.2 -85.8-176.7 7.2 -54.3 27.2 28 545 A E T 3 S+ 0 0 102 -19,-0.5 -18,-0.1 1,-0.3 -1,-0.1 0.837 130.7 55.3 -61.2 -34.2 8.6 -57.2 29.4 29 546 A K T 3 S- 0 0 74 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.218 122.2-111.2 -82.6 12.5 5.0 -57.6 31.0 30 547 A K < + 0 0 74 -3,-1.7 2,-0.3 1,-0.2 -2,-0.1 0.711 68.1 148.6 60.7 31.2 3.7 -58.0 27.3 31 548 A Q - 0 0 100 1,-0.0 -4,-2.2 0, 0.0 2,-0.3 -0.745 47.2-118.2 -96.3 141.7 1.8 -54.7 27.2 32 549 A I E +C 26 0A 91 -2,-0.3 55,-0.4 -6,-0.2 2,-0.3 -0.592 41.7 158.3 -84.1 130.3 1.4 -52.6 24.1 33 550 A Y E -C 25 0A 33 -8,-2.6 -8,-2.7 -2,-0.3 2,-0.4 -0.863 37.5-117.9-139.4 175.5 2.9 -49.0 23.8 34 551 A A E -CD 24 85A 9 51,-2.2 51,-3.1 -2,-0.3 2,-0.6 -0.970 23.2-159.8-117.1 130.0 4.1 -46.4 21.3 35 552 A I E -CD 23 84A 0 -12,-2.8 -12,-2.0 -2,-0.4 2,-0.6 -0.951 2.3-158.1-114.7 117.7 7.7 -45.3 21.2 36 553 A K E -CD 22 83A 73 47,-2.5 47,-1.6 -2,-0.6 2,-0.5 -0.824 9.7-164.5 -91.7 120.5 8.6 -42.1 19.6 37 554 A Y E -CD 21 82A 62 -16,-3.5 -16,-1.8 -2,-0.6 2,-0.4 -0.913 7.0-175.8-103.0 132.4 12.3 -42.0 18.6 38 555 A V E -CD 20 81A 8 43,-2.1 43,-1.9 -2,-0.5 2,-0.6 -0.998 18.6-141.6-130.1 128.4 13.8 -38.6 17.7 39 556 A N E - D 0 80A 52 -20,-2.8 41,-0.3 -2,-0.4 3,-0.2 -0.832 15.4-177.6 -93.4 120.2 17.4 -38.1 16.4 40 557 A L > + 0 0 11 39,-2.6 3,-1.8 -2,-0.6 40,-0.2 0.448 54.1 106.2 -92.9 -4.4 19.0 -34.9 18.0 41 558 A E T 3 S+ 0 0 138 38,-0.8 -1,-0.2 1,-0.3 39,-0.1 0.795 90.6 26.2 -46.4 -47.9 22.3 -35.4 15.9 42 559 A E T 3 S+ 0 0 104 -3,-0.2 2,-0.4 37,-0.1 -1,-0.3 -0.083 99.2 120.4-110.2 33.6 21.7 -32.5 13.4 43 560 A A < - 0 0 30 -3,-1.8 -3,-0.0 1,-0.0 2,-0.0 -0.852 50.5-142.4-108.7 134.8 19.4 -30.4 15.7 44 561 A D > - 0 0 84 -2,-0.4 4,-2.6 1,-0.0 5,-0.1 -0.162 31.2 -99.6 -81.2 174.0 20.1 -26.8 17.0 45 562 A N H > S+ 0 0 122 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.882 123.4 51.8 -66.8 -41.0 19.4 -25.2 20.4 46 563 A Q H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.904 113.9 46.8 -62.5 -37.1 16.1 -23.4 19.3 47 564 A T H > S+ 0 0 15 2,-0.2 4,-2.0 1,-0.2 105,-0.3 0.924 112.9 48.3 -67.5 -47.2 15.1 -26.9 18.0 48 565 A L H X S+ 0 0 31 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.878 112.4 49.0 -60.9 -42.4 16.2 -28.6 21.3 49 566 A D H X S+ 0 0 95 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.931 109.0 51.4 -65.2 -41.6 14.3 -26.0 23.4 50 567 A S H X S+ 0 0 12 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.894 113.7 46.8 -59.1 -39.0 11.2 -26.5 21.3 51 568 A Y H X S+ 0 0 38 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.811 114.2 44.9 -70.2 -41.4 11.5 -30.3 21.9 52 569 A R H X S+ 0 0 118 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.773 113.3 52.8 -75.6 -30.6 12.1 -30.0 25.7 53 570 A N H X S+ 0 0 74 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.924 109.5 46.3 -71.4 -43.5 9.3 -27.5 26.0 54 571 A E H X S+ 0 0 21 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.913 113.0 50.4 -65.0 -42.9 6.7 -29.7 24.3 55 572 A I H X S+ 0 0 9 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.925 110.7 49.0 -58.4 -50.5 7.8 -32.8 26.4 56 573 A A H X S+ 0 0 53 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.867 113.4 46.9 -59.1 -40.2 7.5 -30.8 29.7 57 574 A Y H X S+ 0 0 82 -4,-1.9 4,-3.2 2,-0.2 5,-0.2 0.941 113.9 47.5 -67.1 -44.8 4.0 -29.5 28.6 58 575 A L H X S+ 0 0 5 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.881 112.0 50.4 -60.5 -43.8 2.9 -33.1 27.6 59 576 A N H < S+ 0 0 75 -4,-3.0 4,-0.4 -5,-0.2 3,-0.3 0.932 117.4 39.8 -61.5 -45.8 4.2 -34.5 30.9 60 577 A K H >< S+ 0 0 52 -4,-2.1 3,-1.1 1,-0.2 4,-0.5 0.925 112.4 52.7 -69.7 -49.6 2.3 -31.8 33.0 61 578 A L H 3X S+ 0 0 1 -4,-3.2 4,-1.0 1,-0.2 3,-0.2 0.581 91.9 77.8 -67.9 -8.9 -1.0 -31.7 31.0 62 579 A Q T >< S+ 0 0 31 -4,-0.8 3,-0.6 -3,-0.3 -1,-0.2 0.903 91.9 51.5 -64.1 -44.6 -1.3 -35.5 31.4 63 580 A Q T <4 S+ 0 0 93 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.727 108.2 54.5 -64.6 -26.2 -2.5 -35.0 35.0 64 581 A H T 34 S+ 0 0 115 -4,-0.5 2,-0.3 -3,-0.2 -1,-0.2 0.691 115.9 14.4 -85.3 -23.0 -5.2 -32.5 33.8 65 582 A S X< - 0 0 9 -4,-1.0 3,-0.9 -3,-0.6 -1,-0.2 -0.966 44.4-149.1-158.5 142.9 -7.0 -34.5 31.1 66 583 A D T 3 S+ 0 0 70 -2,-0.3 4,-0.1 1,-0.2 -1,-0.1 0.591 98.0 73.9 -81.5 -9.1 -7.5 -38.0 29.7 67 584 A K T 3 S+ 0 0 16 77,-0.1 78,-2.8 2,-0.1 2,-0.4 0.327 83.9 81.0 -85.4 4.8 -8.1 -36.4 26.3 68 585 A I B < S-f 145 0B 0 -3,-0.9 78,-0.1 76,-0.2 -3,-0.1 -0.942 98.8 -98.0-110.2 130.1 -4.3 -35.7 26.1 69 586 A I - 0 0 8 76,-1.6 2,-0.3 -2,-0.4 -2,-0.1 -0.162 40.6-110.3 -47.4 134.6 -2.1 -38.7 25.1 70 587 A R - 0 0 44 -4,-0.1 16,-1.9 -8,-0.0 2,-0.5 -0.575 25.8-162.6 -72.9 130.3 -0.4 -40.7 28.0 71 588 A L E +E 85 0A 8 -2,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.994 12.4 175.8-114.4 110.7 3.4 -40.2 28.3 72 589 A Y E - 0 0 121 12,-3.0 2,-0.3 -2,-0.5 13,-0.2 0.828 58.3 -20.3 -87.0 -41.7 4.6 -43.1 30.5 73 590 A D E -E 84 0A 50 11,-1.3 11,-3.1 2,-0.0 -1,-0.3 -0.972 54.9-159.3-162.3 165.3 8.4 -42.5 30.4 74 591 A Y E -E 83 0A 69 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.988 9.5-155.2-154.6 152.7 11.2 -40.9 28.5 75 592 A E E -E 82 0A 36 7,-2.1 7,-1.9 -2,-0.3 2,-0.5 -0.999 18.2-171.2-128.4 122.7 15.0 -41.1 28.0 76 593 A I E +E 81 0A 73 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.977 12.9 157.5-124.3 125.8 16.9 -38.0 26.8 77 594 A T - 0 0 42 3,-2.8 -2,-0.0 -2,-0.5 -37,-0.0 -0.670 56.4 -96.6-127.4-176.2 20.5 -37.7 25.7 78 595 A D S S+ 0 0 144 -2,-0.2 3,-0.1 1,-0.1 -2,-0.0 0.629 124.7 39.3 -77.6 -14.9 22.5 -35.3 23.5 79 596 A Q S S+ 0 0 87 1,-0.2 -39,-2.6 -39,-0.1 -38,-0.8 0.725 122.9 3.2-105.2 -30.7 22.1 -37.7 20.5 80 597 A Y E -D 39 0A 56 -41,-0.3 -3,-2.8 -40,-0.2 2,-0.3 -0.961 48.1-137.9-153.4 170.5 18.4 -38.9 20.9 81 598 A I E -DE 38 76A 6 -43,-1.9 -43,-2.1 -2,-0.3 2,-0.4 -0.982 13.6-169.3-131.6 137.9 15.0 -38.9 22.6 82 599 A Y E -DE 37 75A 48 -7,-1.9 -7,-2.1 -2,-0.3 2,-0.5 -0.998 7.2-169.7-126.6 127.0 12.8 -42.0 23.4 83 600 A M E -DE 36 74A 12 -47,-1.6 -47,-2.5 -2,-0.4 2,-0.7 -0.990 12.4-152.6-125.5 120.8 9.3 -41.4 24.5 84 601 A V E +DE 35 73A 0 -11,-3.1 -12,-3.0 -2,-0.5 -11,-1.3 -0.842 34.7 160.4 -92.2 110.6 7.1 -44.3 25.9 85 602 A M E -DE 34 71A 17 -51,-3.1 -51,-2.2 -2,-0.7 -14,-0.2 -0.704 43.7 -80.5-123.7 177.2 3.5 -43.3 25.1 86 603 A E - 0 0 24 -16,-1.9 2,-0.5 -2,-0.2 -53,-0.2 -0.545 44.9-121.6 -81.3 147.5 0.1 -44.9 24.8 87 604 A C - 0 0 23 -55,-0.4 2,-0.1 -2,-0.2 -55,-0.1 -0.816 25.1-156.8 -92.2 126.2 -0.7 -46.7 21.6 88 605 A G - 0 0 17 -2,-0.5 51,-0.2 1,-0.1 3,-0.1 -0.403 20.8-125.7 -88.7 174.2 -3.8 -45.5 19.6 89 606 A N S S- 0 0 119 49,-3.2 2,-0.3 1,-0.4 50,-0.1 0.936 81.3 -29.7 -83.3 -53.4 -5.8 -47.4 17.1 90 607 A I E -G 138 0B 58 48,-0.8 48,-2.8 3,-0.0 -1,-0.4 -0.939 68.7 -98.2-156.7 161.6 -5.5 -45.0 14.1 91 608 A D E > -G 137 0B 47 -2,-0.3 4,-1.7 46,-0.2 46,-0.3 -0.533 38.2-111.5 -84.9 162.4 -5.2 -41.2 13.8 92 609 A L H > S+ 0 0 0 44,-2.4 4,-2.4 41,-0.8 42,-0.2 0.870 113.0 55.3 -61.3 -38.9 -8.4 -39.1 13.1 93 610 A N H > S+ 0 0 33 40,-0.3 4,-3.0 43,-0.3 5,-0.2 0.953 110.5 41.2 -61.0 -57.8 -7.3 -38.2 9.5 94 611 A S H > S+ 0 0 47 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.829 113.8 55.0 -63.8 -29.1 -6.7 -41.8 8.2 95 612 A W H X S+ 0 0 82 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.937 113.7 41.3 -65.7 -45.3 -9.9 -43.0 10.0 96 613 A L H < S+ 0 0 16 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.919 112.6 53.6 -66.9 -46.4 -11.9 -40.2 8.2 97 614 A K H < S+ 0 0 82 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.884 112.9 44.7 -56.1 -41.6 -10.1 -40.8 4.8 98 615 A K H < S+ 0 0 89 -4,-2.1 2,-0.3 -5,-0.2 -1,-0.2 0.798 103.0 79.1 -72.9 -32.9 -11.0 -44.6 5.0 99 616 A K < - 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0 0 48 -2,-1.1 6,-0.1 -3,-0.4 5,-0.1 -0.933 55.1-142.3-106.3 113.7 -16.4 -16.4 11.4 234 774 A R S S+ 0 0 47 -2,-0.6 -69,-0.2 4,-0.1 -1,-0.1 0.702 85.0 74.2 -44.8 -36.5 -13.4 -14.5 9.8 235 775 A D S >> S- 0 0 75 1,-0.2 3,-1.6 -71,-0.1 4,-0.7 -0.787 70.6-154.5 -87.1 113.2 -13.2 -12.0 12.7 236 776 A P G >4 S+ 0 0 34 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.845 97.9 59.9 -52.8 -33.7 -11.7 -13.6 15.8 237 777 A K G 34 S+ 0 0 129 1,-0.2 -3,-0.1 -3,-0.1 -2,-0.0 0.782 108.4 43.2 -61.5 -33.3 -13.6 -11.0 17.8 238 778 A Q G <4 S+ 0 0 138 -3,-1.6 2,-0.2 -5,-0.1 -1,-0.2 0.402 95.8 104.9 -93.1 -5.8 -17.0 -12.3 16.3 239 779 A R S << S- 0 0 5 -3,-0.8 -8,-0.2 -4,-0.7 -9,-0.1 -0.585 77.0-107.9 -84.0 143.2 -16.0 -16.0 16.8 240 780 A I - 0 0 22 -10,-1.5 2,-0.2 -2,-0.2 -1,-0.1 -0.283 33.9-127.1 -64.5 145.4 -17.4 -18.3 19.6 241 781 A S > - 0 0 30 1,-0.1 4,-2.3 -64,-0.0 5,-0.2 -0.557 19.5-111.3 -92.4 161.6 -15.0 -19.3 22.5 242 782 A I H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.944 120.0 51.0 -59.8 -45.1 -14.2 -22.8 23.7 243 783 A P H 4 S+ 0 0 80 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.867 112.9 48.6 -59.3 -31.6 -16.0 -22.3 27.1 244 784 A E H >4 S+ 0 0 118 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.861 108.9 51.7 -73.2 -36.8 -19.0 -21.1 24.9 245 785 A L H >< S+ 0 0 0 -4,-2.3 3,-1.0 1,-0.2 6,-0.3 0.856 103.7 58.5 -66.9 -34.0 -18.8 -24.1 22.6 246 786 A L T 3< S+ 0 0 45 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.616 110.5 43.2 -72.1 -11.0 -18.8 -26.5 25.7 247 787 A A T < S+ 0 0 74 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.371 87.3 118.7-111.7 -1.9 -22.2 -24.9 26.7 248 788 A H S X> S- 0 0 17 -3,-1.0 4,-1.3 -4,-0.3 3,-1.1 -0.359 76.0-116.6 -64.2 144.3 -23.7 -25.0 23.1 249 789 A P H 3> S+ 0 0 57 0, 0.0 4,-2.9 0, 0.0 -1,-0.1 0.777 111.5 65.8 -52.4 -31.1 -26.9 -27.1 22.7 250 790 A Y H 34 S+ 0 0 0 -27,-0.3 -26,-0.1 1,-0.2 -4,-0.1 0.873 109.9 35.7 -58.5 -39.7 -25.1 -29.4 20.2 251 791 A V H <4 S+ 0 0 12 -3,-1.1 -1,-0.2 -6,-0.3 -5,-0.1 0.734 129.1 35.0 -83.3 -28.7 -22.7 -30.7 22.9 252 792 A Q H < S+ 0 0 112 -4,-1.3 2,-0.3 -5,-0.0 -2,-0.2 0.764 93.7 84.1-102.4 -39.7 -25.4 -30.6 25.7 253 793 A I < 0 0 104 -4,-2.9 -5,-0.0 -5,-0.2 0, 0.0 -0.602 360.0 360.0 -77.0 137.9 -28.8 -31.6 24.4 254 794 A Q 0 0 224 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.785 360.0 360.0 -95.6 360.0 -29.8 -35.3 24.0