==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 09-AUG-11 3TCP . COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE MER; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.LIU,C.YANG,C.SIMPSON,D.DERYCKERE,A.VAN DEUSEN,M.MILEY,D.B. . 506 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26664.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 333 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 33 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 0 3 1 0 4 0 0 0 0 1 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 4 0 2 2 3 1 1 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 0 2 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 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 1 577 A L > 0 0 178 0, 0.0 3,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -60.2 13.2 -33.8 38.2 2 578 A E T 3 + 0 0 149 1,-0.2 53,-0.0 2,-0.1 0, 0.0 -0.243 360.0 113.3-101.5 42.6 14.2 -34.1 34.5 3 579 A D T 3 S+ 0 0 128 -2,-0.4 -1,-0.2 1,-0.2 0, 0.0 0.786 72.6 59.0 -79.6 -31.7 11.2 -36.1 33.3 4 580 A V S < S+ 0 0 8 -3,-0.5 71,-1.5 51,-0.1 -1,-0.2 0.716 80.1 111.3 -71.0 -23.7 10.0 -33.2 31.1 5 581 A V B -a 75 0A 61 69,-0.2 2,-0.4 1,-0.0 71,-0.2 -0.321 55.2-158.0 -57.6 125.7 13.4 -33.3 29.1 6 582 A I - 0 0 33 69,-2.5 71,-0.4 -2,-0.1 2,-0.3 -0.854 25.2-101.9-107.2 143.4 12.8 -34.6 25.6 7 583 A D > - 0 0 92 -2,-0.4 3,-2.1 1,-0.1 4,-0.2 -0.505 24.1-135.3 -66.5 126.4 15.6 -36.1 23.4 8 584 A R G > S+ 0 0 64 -2,-0.3 3,-1.9 1,-0.3 -1,-0.1 0.791 100.2 68.3 -49.8 -36.3 16.9 -33.6 20.8 9 585 A N G 3 S+ 0 0 138 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.712 90.8 61.1 -61.0 -23.1 16.8 -36.2 18.1 10 586 A L G < S+ 0 0 70 -3,-2.1 17,-2.0 17,-0.0 2,-0.4 0.439 96.8 79.3 -81.0 -1.0 13.0 -36.3 18.2 11 587 A L E < -B 26 0A 2 -3,-1.9 2,-0.4 15,-0.2 15,-0.2 -0.903 55.6-169.4-120.3 136.9 12.9 -32.6 17.2 12 588 A I E -B 25 0A 112 13,-1.4 13,-1.9 -2,-0.4 2,-0.4 -0.992 15.4-150.0-124.1 123.9 13.3 -30.8 13.8 13 589 A L E +B 24 0A 46 -2,-0.4 11,-0.2 11,-0.2 2,-0.1 -0.774 20.0 170.9 -99.5 137.8 13.7 -27.0 13.7 14 590 A G E - 0 0 35 9,-3.4 -1,-0.1 -2,-0.4 10,-0.0 -0.117 42.2 -16.3-117.6-145.5 12.6 -24.8 10.9 15 591 A K E - 0 0 168 7,-0.1 8,-2.1 1,-0.1 -1,-0.3 -0.210 69.8-102.1 -66.6 150.2 12.1 -21.1 10.0 16 592 A I E -B 22 0A 118 6,-0.2 6,-0.3 1,-0.1 -1,-0.1 -0.558 34.5-176.2 -75.1 133.1 12.1 -18.4 12.7 17 593 A L 0 0 80 4,-2.9 5,-0.2 1,-0.3 -1,-0.1 0.911 360.0 360.0 -96.2 -61.9 8.6 -17.2 13.5 18 594 A G 0 0 55 3,-1.0 3,-1.5 0, 0.0 -1,-0.3 -0.907 360.0 360.0-109.4 360.0 9.0 -14.3 16.1 19 ! 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 20 600 A S 0 0 71 0, 0.0 20,-2.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 133.3 14.1 -16.6 19.3 21 601 A V E - C 0 39A 46 -3,-1.5 -4,-2.9 18,-0.2 -3,-1.0 -0.872 360.0-176.1-103.3 122.7 11.0 -18.7 18.6 22 602 A M E -BC 16 38A 28 16,-2.5 16,-3.1 -2,-0.5 2,-0.2 -0.702 27.3-109.7-112.3 161.0 11.2 -21.3 15.7 23 603 A E E + C 0 37A 48 -8,-2.1 -9,-3.4 -2,-0.2 2,-0.3 -0.605 45.3 173.1 -83.7 153.9 8.8 -23.6 14.0 24 604 A G E -BC 13 36A 2 12,-2.0 12,-2.7 -11,-0.2 2,-0.5 -0.981 35.5-127.7-157.4 163.8 9.3 -27.3 14.6 25 605 A N E -BC 12 35A 71 -13,-1.9 -13,-1.4 -2,-0.3 2,-0.5 -0.980 24.6-162.8-119.3 115.6 8.2 -30.9 14.2 26 606 A L E -BC 11 34A 9 8,-3.1 8,-3.1 -2,-0.5 2,-0.6 -0.847 9.3-147.3 -96.9 131.1 8.0 -33.0 17.4 27 607 A K E - C 0 33A 118 -17,-2.0 6,-0.2 -2,-0.5 5,-0.1 -0.886 23.9-153.4 -95.9 123.5 7.9 -36.8 17.1 28 608 A Q > - 0 0 62 4,-2.4 3,-1.0 -2,-0.6 -1,-0.0 -0.251 29.5-103.7 -91.8 175.5 5.8 -38.2 19.9 29 609 A E T 3 S+ 0 0 208 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.753 116.1 66.5 -65.3 -25.1 5.7 -41.6 21.8 30 610 A D T 3 S- 0 0 109 2,-0.1 2,-0.3 1,-0.1 -1,-0.2 0.273 114.8-110.6 -85.6 12.5 2.5 -42.4 19.8 31 611 A G S < S+ 0 0 51 -3,-1.0 -1,-0.1 1,-0.3 -2,-0.1 -0.151 85.6 105.0 89.7 -39.3 4.4 -42.6 16.5 32 612 A T - 0 0 71 -2,-0.3 -4,-2.4 -5,-0.1 2,-0.4 -0.139 66.7-123.1 -74.2 168.4 2.7 -39.5 15.0 33 613 A S E -C 27 0A 77 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.2 -0.946 18.6-156.7-118.4 135.8 4.3 -36.0 14.6 34 614 A L E -C 26 0A 69 -8,-3.1 -8,-3.1 -2,-0.4 2,-0.4 -0.858 20.8-119.1-112.7 143.8 3.1 -32.7 16.0 35 615 A K E +C 25 0A 79 -2,-0.4 53,-1.8 -10,-0.2 2,-0.3 -0.670 44.4 177.6 -76.7 129.3 3.7 -29.2 14.9 36 616 A V E -CD 24 87A 0 -12,-2.7 -12,-2.0 -2,-0.4 2,-0.4 -0.808 31.7-130.2-129.0 167.9 5.4 -27.2 17.6 37 617 A A E -CD 23 86A 16 49,-3.0 49,-2.5 -2,-0.3 2,-0.6 -0.985 21.3-155.7-116.3 135.0 6.9 -23.8 18.5 38 618 A V E -CD 22 85A 0 -16,-3.1 -16,-2.5 -2,-0.4 2,-0.6 -0.886 3.8-164.8-119.3 100.8 10.4 -23.8 20.0 39 619 A K E -CD 21 84A 65 45,-1.4 45,-1.9 -2,-0.6 2,-0.5 -0.761 11.7-151.1 -81.0 117.4 11.4 -20.8 22.1 40 620 A T E - D 0 83A 22 -20,-2.7 2,-0.3 -2,-0.6 43,-0.2 -0.831 19.5-128.4 -87.1 126.1 15.2 -20.8 22.6 41 621 A M - 0 0 57 41,-2.3 2,-1.5 -2,-0.5 -1,-0.0 -0.583 2.6-140.8 -79.7 133.8 16.0 -19.1 25.9 42 622 A K + 0 0 194 -2,-0.3 2,-0.2 39,-0.1 -1,-0.1 -0.691 49.1 173.1 -86.3 79.3 18.5 -16.3 26.2 43 623 A L - 0 0 30 -2,-1.5 2,-0.6 39,-0.1 8,-0.0 -0.616 36.1-111.7-107.2 152.8 19.9 -17.8 29.4 44 624 A D - 0 0 95 -2,-0.2 6,-0.4 2,-0.0 7,-0.3 -0.710 32.2-179.2 -86.0 115.7 22.8 -17.0 31.8 45 625 A N + 0 0 89 -2,-0.6 4,-0.1 1,-0.2 5,-0.1 -0.161 61.6 65.8 -90.4-165.6 25.5 -19.6 32.0 46 626 A S S S+ 0 0 134 -2,-0.1 2,-0.2 2,-0.0 -1,-0.2 0.761 108.0 57.6 52.3 26.7 28.6 -19.3 34.2 47 627 A S S > S- 0 0 66 -3,-0.2 3,-0.7 0, 0.0 4,-0.5 -0.600 73.3-151.5 179.1 115.0 26.0 -19.6 37.0 48 628 A Q T 3> S+ 0 0 53 1,-0.2 4,-1.8 -2,-0.2 5,-0.1 0.361 80.3 90.1 -79.0 8.2 23.6 -22.6 37.4 49 629 A R H 3> S+ 0 0 136 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.858 85.6 45.4 -75.7 -38.7 21.0 -20.3 39.1 50 630 A E H <> S+ 0 0 83 -3,-0.7 4,-0.9 -6,-0.4 -1,-0.2 0.832 116.2 48.1 -70.6 -33.1 19.2 -19.2 35.9 51 631 A I H > S+ 0 0 46 -4,-0.5 4,-1.9 -7,-0.3 -2,-0.2 0.844 108.7 52.5 -77.5 -34.4 19.1 -22.8 34.6 52 632 A E H X S+ 0 0 109 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.869 110.5 46.8 -69.2 -38.1 17.8 -24.3 37.9 53 633 A E H X S+ 0 0 102 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.778 109.3 58.9 -70.5 -29.0 14.9 -21.9 38.2 54 634 A F H X S+ 0 0 26 -4,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.943 110.1 38.5 -63.8 -54.9 14.2 -22.6 34.5 55 635 A L H X S+ 0 0 61 -4,-1.9 4,-3.2 2,-0.2 5,-0.3 0.877 112.4 59.0 -65.0 -41.3 13.7 -26.4 34.9 56 636 A S H X S+ 0 0 87 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.892 112.5 38.5 -56.8 -44.4 11.9 -25.9 38.3 57 637 A E H X S+ 0 0 77 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.887 113.5 58.4 -72.6 -39.6 9.2 -23.8 36.5 58 638 A A H X S+ 0 0 5 -4,-2.2 4,-2.2 2,-0.2 3,-0.3 0.937 106.3 46.3 -53.2 -54.3 9.3 -26.1 33.5 59 639 A A H X S+ 0 0 36 -4,-3.2 4,-0.8 1,-0.3 -1,-0.2 0.870 113.7 49.3 -58.3 -39.8 8.4 -29.2 35.5 60 640 A C H < S+ 0 0 61 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.813 111.9 50.7 -67.3 -31.1 5.6 -27.2 37.2 61 641 A M H >< S+ 0 0 21 -4,-2.0 3,-1.6 -3,-0.3 11,-0.7 0.810 100.0 60.7 -79.7 -33.7 4.5 -26.1 33.8 62 642 A K H 3< S+ 0 0 91 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.793 100.0 58.5 -62.6 -28.5 4.3 -29.6 32.2 63 643 A D T 3< S+ 0 0 125 -4,-0.8 2,-0.6 -5,-0.2 -1,-0.3 0.342 81.4 109.7 -82.6 5.8 1.8 -30.5 34.9 64 644 A F < + 0 0 6 -3,-1.6 2,-0.3 8,-0.1 8,-0.3 -0.763 39.4 169.5 -87.7 117.4 -0.5 -27.7 33.7 65 645 A S + 0 0 67 -2,-0.6 5,-0.1 6,-0.1 6,-0.1 -0.703 19.8 127.4-135.0 82.4 -3.6 -29.0 31.9 66 646 A H > - 0 0 37 3,-0.4 3,-2.0 -2,-0.3 -2,-0.0 -0.995 60.8-125.6-137.6 140.8 -6.4 -26.5 31.2 67 647 A P T 3 S+ 0 0 81 0, 0.0 80,-0.1 0, 0.0 58,-0.1 0.623 113.5 47.4 -60.7 -14.0 -8.2 -25.6 27.9 68 648 A N T 3 S+ 0 0 10 56,-0.1 86,-1.9 85,-0.1 2,-0.4 0.087 101.9 72.0-114.8 20.2 -7.2 -21.9 28.4 69 649 A V B < S-f 154 0B 0 -3,-2.0 -3,-0.4 84,-0.3 86,-0.1 -0.999 85.8-112.2-134.3 131.9 -3.5 -22.5 29.3 70 650 A I - 0 0 7 84,-2.1 2,-0.5 -2,-0.4 -4,-0.1 -0.266 32.8-121.3 -58.3 147.2 -0.8 -23.5 26.7 71 651 A R - 0 0 115 -6,-0.1 2,-1.1 -8,-0.0 -9,-0.1 -0.835 10.1-138.4 -94.4 125.4 0.7 -27.0 27.3 72 652 A L - 0 0 7 -11,-0.7 14,-0.2 -2,-0.5 3,-0.1 -0.732 19.7-172.5 -82.2 101.0 4.5 -27.3 27.8 73 653 A L - 0 0 42 12,-1.5 2,-0.3 -2,-1.1 -1,-0.2 0.737 53.8 -60.6 -71.1 -24.5 5.2 -30.4 25.7 74 654 A G E - E 0 85A 0 11,-1.0 11,-2.8 -3,-0.1 2,-0.4 -0.948 44.7 -95.5 165.1-178.5 8.8 -30.6 26.9 75 655 A V E -aE 5 84A 1 -71,-1.5 -69,-2.5 -2,-0.3 2,-0.3 -0.994 27.9-169.8-130.8 128.5 12.3 -29.2 27.2 76 656 A C E - E 0 83A 0 7,-2.6 7,-3.0 -2,-0.4 2,-0.3 -0.836 2.4-163.4-113.3 153.9 15.3 -29.8 25.0 77 657 A I E E 0 82A 71 -71,-0.4 -69,-0.2 -2,-0.3 -2,-0.0 -0.996 360.0 360.0-139.4 132.2 18.9 -28.8 25.5 78 658 A E 0 0 131 3,-1.4 -1,-0.1 -2,-0.3 -2,-0.0 0.445 360.0 360.0 -83.8 360.0 21.8 -28.6 22.9 79 ! 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 80 665 A P 0 0 113 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 76.6 24.1 -25.7 26.0 81 666 A K - 0 0 145 -39,-0.0 -3,-1.4 -41,-0.0 2,-0.2 -0.733 360.0-138.3 -94.8 121.7 20.9 -23.9 24.9 82 667 A P E - E 0 77A 3 0, 0.0 -41,-2.3 0, 0.0 2,-0.4 -0.569 20.1-168.0 -77.2 138.8 17.6 -24.6 26.7 83 668 A M E -DE 40 76A 3 -7,-3.0 -7,-2.6 -2,-0.2 2,-0.3 -0.943 12.0-149.8-135.6 109.9 14.5 -24.9 24.4 84 669 A V E -DE 39 75A 18 -45,-1.9 -45,-1.4 -2,-0.4 2,-0.5 -0.617 16.6-144.2 -78.5 135.5 10.9 -25.0 25.6 85 670 A I E +DE 38 74A 0 -11,-2.8 -12,-1.5 -2,-0.3 -11,-1.0 -0.901 24.9 174.8-105.1 126.4 8.6 -27.0 23.3 86 671 A L E -D 37 0A 24 -49,-2.5 -49,-3.0 -2,-0.5 -14,-0.1 -0.936 37.7 -92.3-131.0 150.3 5.1 -25.7 22.8 87 672 A P E -D 36 0A 21 0, 0.0 2,-0.4 0, 0.0 -51,-0.2 -0.354 44.1-122.4 -55.5 135.9 2.0 -26.5 20.6 88 673 A F - 0 0 70 -53,-1.8 2,-0.7 -64,-0.1 -53,-0.1 -0.730 20.0-155.2 -83.2 130.5 2.0 -24.6 17.4 89 674 A M > - 0 0 16 -2,-0.4 3,-1.8 1,-0.1 57,-0.1 -0.905 4.6-162.4-109.2 103.6 -1.2 -22.4 17.0 90 675 A K T 3 S+ 0 0 136 -2,-0.7 -1,-0.1 1,-0.3 57,-0.1 0.758 89.4 59.0 -57.6 -26.8 -1.9 -21.8 13.3 91 676 A Y T 3 S- 0 0 109 55,-0.5 -1,-0.3 1,-0.2 56,-0.1 0.627 98.0-155.8 -80.7 -13.7 -4.2 -18.9 14.1 92 677 A G < - 0 0 21 -3,-1.8 54,-1.7 54,-0.3 -1,-0.2 -0.144 36.8 -12.8 79.3-167.5 -1.4 -17.0 15.9 93 678 A D B > -G 145 0B 36 52,-0.2 4,-1.6 1,-0.1 52,-0.2 -0.335 57.0-126.1 -70.2 151.6 -1.5 -14.4 18.7 94 679 A L H > S+ 0 0 0 50,-2.9 4,-2.0 47,-0.7 48,-0.2 0.780 105.4 63.7 -68.8 -29.6 -4.8 -12.6 19.6 95 680 A H H > S+ 0 0 47 46,-0.9 4,-1.7 49,-0.3 3,-0.2 0.968 106.4 41.0 -57.8 -55.7 -3.2 -9.2 19.1 96 681 A T H > S+ 0 0 26 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.891 111.7 57.7 -62.4 -42.1 -2.5 -9.6 15.4 97 682 A Y H X S+ 0 0 48 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.897 105.1 51.5 -52.2 -44.7 -5.9 -11.3 14.9 98 683 A L H X S+ 0 0 0 -4,-2.0 4,-0.7 2,-0.2 -1,-0.2 0.911 111.0 45.9 -63.9 -45.7 -7.6 -8.2 16.3 99 684 A L H >< S+ 0 0 26 -4,-1.7 3,-2.0 1,-0.2 -2,-0.2 0.981 112.5 51.5 -57.7 -57.1 -5.8 -5.8 14.0 100 685 A Y H >< S+ 0 0 77 -4,-2.9 3,-1.9 1,-0.3 6,-0.2 0.798 99.1 66.4 -46.1 -37.8 -6.5 -8.2 11.0 101 686 A S H 3< S+ 0 0 0 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.800 92.4 61.2 -60.6 -29.1 -10.2 -8.2 12.0 102 687 A R T << S+ 0 0 35 -3,-2.0 373,-2.3 -4,-0.7 2,-0.4 0.198 95.6 80.7 -84.5 14.7 -10.4 -4.5 11.1 103 688 A L B < S-I 474 0C 4 -3,-1.9 3,-0.2 371,-0.3 2,-0.1 -0.945 81.8-120.2-118.1 143.6 -9.5 -5.3 7.5 104 689 A E S S+ 0 0 75 369,-2.4 2,-1.0 -2,-0.4 371,-0.1 -0.392 105.5 29.3 -63.2 158.1 -11.6 -6.6 4.6 105 690 A T S S+ 0 0 127 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 0.013 112.8 85.3 69.8 -32.3 -10.3 -9.9 3.3 106 691 A G S S- 0 0 26 -2,-1.0 -1,-0.3 1,-0.2 -5,-0.1 -0.292 101.6 -42.9 -78.9 178.5 -9.1 -10.4 6.9 107 692 A P S S- 0 0 38 0, 0.0 -4,-0.3 0, 0.0 -1,-0.2 0.150 73.7 -89.7 -40.3 158.4 -11.4 -11.9 9.6 108 693 A K - 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0 0 117 -3,-0.6 6,-0.2 -4,-0.3 5,-0.1 -0.251 60.4-119.1 -51.9 136.8 2.1 1.1 -8.0 491 839 B T S S+ 0 0 94 4,-0.1 -69,-0.2 1,-0.1 -1,-0.1 0.889 98.4 58.9 -51.7 -57.2 5.5 -0.4 -8.5 492 840 B D S > S- 0 0 83 1,-0.2 3,-2.7 2,-0.0 4,-0.5 -0.702 81.7-139.8 -80.7 117.6 6.9 2.0 -11.1 493 841 B P G > S+ 0 0 29 0, 0.0 3,-2.1 0, 0.0 -1,-0.2 0.816 100.0 63.3 -39.9 -45.1 6.9 5.6 -9.7 494 842 B L G 3 S+ 0 0 145 1,-0.3 -3,-0.1 -3,-0.0 -2,-0.0 0.718 94.4 60.7 -61.3 -23.0 5.8 7.0 -13.0 495 843 B D G < S+ 0 0 98 -3,-2.7 -1,-0.3 -5,-0.1 -4,-0.1 0.680 86.7 96.8 -74.2 -18.6 2.5 5.0 -12.8 496 844 B R S < S- 0 0 4 -3,-2.1 -8,-0.2 -4,-0.5 -9,-0.1 -0.488 80.6-115.3 -74.0 141.5 1.7 6.9 -9.5 497 845 B P - 0 0 17 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.295 29.8-107.5 -68.9 158.7 -0.6 9.9 -9.8 498 846 B T > - 0 0 62 1,-0.1 4,-2.4 -63,-0.0 3,-0.3 -0.406 31.1-107.1 -77.2 164.5 0.6 13.5 -9.0 499 847 B F H > S+ 0 0 3 1,-0.2 4,-3.0 2,-0.2 -117,-0.2 0.858 120.5 55.8 -60.1 -36.5 -0.6 15.2 -5.8 500 848 B S H > S+ 0 0 43 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.820 108.5 47.2 -69.0 -32.5 -2.8 17.5 -7.9 501 849 B V H > S+ 0 0 63 -3,-0.3 4,-1.9 2,-0.2 3,-0.3 0.958 114.0 48.3 -64.9 -52.9 -4.6 14.5 -9.4 502 850 B L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.901 108.5 53.8 -53.0 -50.1 -5.0 12.9 -6.0 503 851 B R H X S+ 0 0 54 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.873 110.1 46.9 -53.3 -43.6 -6.3 16.1 -4.5 504 852 B L H X S+ 0 0 93 -4,-1.3 4,-2.0 -3,-0.3 -1,-0.2 0.836 108.2 55.5 -74.1 -30.9 -9.0 16.4 -7.1 505 853 B Q H X S+ 0 0 83 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.924 111.6 43.3 -67.1 -45.4 -10.1 12.7 -6.8 506 854 B L H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.882 112.5 54.1 -63.3 -41.4 -10.7 13.1 -3.0 507 855 B E H X S+ 0 0 72 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.902 111.7 43.0 -60.4 -45.2 -12.5 16.5 -3.5 508 856 B K H X S+ 0 0 114 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.810 114.4 51.3 -75.7 -32.1 -15.0 15.1 -6.0 509 857 B L H X S+ 0 0 19 -4,-1.6 4,-1.1 -5,-0.2 -2,-0.2 0.949 111.2 47.8 -63.8 -51.7 -15.4 12.0 -3.9 510 858 B L H >< S+ 0 0 52 -4,-3.1 3,-0.8 1,-0.2 -2,-0.2 0.924 113.4 47.6 -53.6 -49.0 -16.1 14.1 -0.8 511 859 B E H 3< S+ 0 0 145 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.830 107.4 58.7 -61.4 -31.5 -18.5 16.3 -2.9 512 860 B S H 3< 0 0 86 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.701 360.0 360.0 -74.7 -21.1 -20.2 13.0 -4.1 513 861 B L << 0 0 90 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.1 0.040 360.0 360.0 -68.2 360.0 -21.0 11.8 -0.6