==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 24-FEB-09 3GDH . COMPND 2 MOLECULE: TRIMETHYLGUANOSINE SYNTHASE HOMOLOG; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.MONECKE,A.DICKMANNS,R.FICNER . 630 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25744.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 477 75.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 11.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 7.3 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 . 3 0.5 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 . 60 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 102 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 6 4 6 0 3 0 0 3 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 8 3 3 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 3 0 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 1 634 A L 0 0 142 0, 0.0 14,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 120.0 23.8 10.3 -70.8 2 635 A P > - 0 0 30 0, 0.0 4,-2.9 0, 0.0 5,-0.3 -0.231 360.0-109.1 -53.2 152.6 23.6 9.1 -67.2 3 636 A P H > S+ 0 0 105 0, 0.0 4,-1.8 0, 0.0 0, 0.0 0.899 120.0 51.2 -52.9 -47.0 20.0 8.4 -66.0 4 637 A E H > S+ 0 0 52 27,-0.2 4,-0.8 1,-0.2 7,-0.1 0.905 114.0 45.4 -58.2 -43.2 20.0 11.4 -63.8 5 638 A I H >4 S+ 0 0 8 1,-0.2 3,-0.9 2,-0.2 6,-0.3 0.955 113.3 46.0 -66.9 -52.4 21.1 13.6 -66.6 6 639 A A H 3< S+ 0 0 64 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.790 104.1 67.4 -63.0 -26.4 18.8 12.3 -69.3 7 640 A A H 3< S+ 0 0 73 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.820 104.0 37.9 -65.6 -33.8 15.9 12.5 -66.9 8 641 A V X< - 0 0 16 -3,-0.9 3,-1.4 -4,-0.8 4,-0.3 -0.973 59.3-148.5-133.5 131.9 15.8 16.3 -66.7 9 642 A P G > S+ 0 0 106 0, 0.0 3,-1.8 0, 0.0 4,-0.3 0.860 99.7 63.5 -53.6 -41.4 16.3 19.3 -69.1 10 643 A E G 3 S+ 0 0 104 1,-0.3 3,-0.4 2,-0.1 4,-0.3 0.655 94.6 60.4 -65.7 -15.8 17.7 21.4 -66.2 11 644 A L G X> S+ 0 0 0 -3,-1.4 4,-2.2 -6,-0.3 3,-0.6 0.574 78.9 90.7 -86.2 -7.9 20.7 19.1 -65.8 12 645 A A H <> S+ 0 0 59 -3,-1.8 4,-2.4 -4,-0.3 -1,-0.2 0.872 83.4 52.3 -56.3 -39.6 21.9 19.6 -69.3 13 646 A K H 3> S+ 0 0 124 -3,-0.4 4,-1.2 -4,-0.3 -1,-0.2 0.821 108.7 50.7 -70.2 -28.2 24.2 22.5 -68.4 14 647 A Y H <4 S+ 0 0 40 -3,-0.6 7,-0.2 -4,-0.3 -1,-0.2 0.915 110.6 48.6 -73.0 -42.5 25.9 20.5 -65.6 15 648 A W H >< S+ 0 0 57 -4,-2.2 3,-2.1 1,-0.2 4,-0.2 0.931 108.2 55.0 -57.8 -46.7 26.5 17.6 -68.0 16 649 A A H 3< S+ 0 0 68 -4,-2.4 3,-0.3 1,-0.3 -1,-0.2 0.856 114.1 40.8 -56.0 -35.9 27.9 20.1 -70.6 17 650 A Q T >X S+ 0 0 62 -4,-1.2 4,-1.8 1,-0.2 3,-1.6 0.151 76.8 124.7 -99.9 20.9 30.4 21.3 -67.9 18 651 A R H <> S+ 0 0 53 -3,-2.1 4,-2.9 1,-0.3 -1,-0.2 0.812 74.1 51.9 -51.6 -34.0 31.2 17.9 -66.5 19 652 A Y H 34 S+ 0 0 94 -3,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.734 106.5 52.0 -79.3 -22.5 34.9 18.4 -67.1 20 653 A R H <4 S+ 0 0 82 -3,-1.6 22,-1.8 2,-0.1 23,-0.6 0.763 113.0 47.7 -77.3 -27.7 34.9 21.8 -65.2 21 654 A L H < S+ 0 0 12 -4,-1.8 2,-0.4 1,-0.3 21,-0.3 0.952 135.7 3.2 -75.0 -51.9 33.2 19.9 -62.4 22 655 A F >< - 0 0 3 -4,-2.9 3,-1.8 -5,-0.2 -1,-0.3 -0.935 59.0-160.4-137.1 115.7 35.6 17.0 -62.4 23 656 A S T 3 S+ 0 0 67 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.853 99.8 48.5 -59.6 -34.4 38.6 16.9 -64.8 24 657 A R T > S+ 0 0 103 1,-0.2 3,-2.2 2,-0.1 5,-0.3 0.066 74.8 130.0 -92.1 25.7 38.9 13.2 -64.3 25 658 A F G X> + 0 0 16 -3,-1.8 4,-1.9 1,-0.3 3,-1.1 0.828 67.2 54.2 -49.8 -41.7 35.2 12.7 -65.0 26 659 A D G 34 S+ 0 0 109 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.584 88.2 79.4 -74.7 -9.2 35.6 10.0 -67.6 27 660 A D G <4 S- 0 0 91 -3,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.269 130.0 -72.5 -80.4 11.6 37.7 7.9 -65.2 28 661 A G T <4 S+ 0 0 28 -3,-1.1 -2,-0.2 1,-0.2 -3,-0.1 0.712 72.8 168.1 109.1 26.5 34.4 6.8 -63.6 29 662 A I < - 0 0 10 -4,-1.9 2,-0.4 -5,-0.3 -1,-0.2 -0.431 13.8-165.0 -70.2 142.0 33.0 9.8 -61.6 30 663 A K + 0 0 111 64,-0.3 2,-0.3 38,-0.1 68,-0.1 -0.978 13.6 167.1-131.7 146.4 29.4 9.5 -60.4 31 664 A L - 0 0 6 -2,-0.4 2,-0.2 67,-0.0 -27,-0.2 -0.963 22.4-137.2-144.9 158.6 26.9 12.0 -59.1 32 665 A D > - 0 0 34 -2,-0.3 4,-2.6 -28,-0.1 5,-0.2 -0.580 46.8 -82.1-105.0-179.5 23.1 12.1 -58.3 33 666 A R H > S+ 0 0 127 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.908 131.8 38.8 -46.9 -58.8 20.7 14.9 -59.1 34 667 A E H > S+ 0 0 67 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.852 111.9 60.6 -62.6 -36.3 21.5 17.0 -56.0 35 668 A G H > S+ 0 0 4 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.930 104.3 48.4 -56.5 -47.3 25.2 16.1 -56.5 36 669 A W H < S+ 0 0 3 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.928 113.4 46.8 -59.3 -48.4 25.3 17.7 -59.9 37 670 A F H < S+ 0 0 46 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.783 122.5 34.5 -61.9 -29.6 23.6 20.9 -58.7 38 671 A S H < S+ 0 0 35 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.615 80.7 116.4-110.3 -15.8 25.8 21.3 -55.6 39 672 A V < - 0 0 9 -4,-2.0 28,-0.1 -5,-0.2 3,-0.0 -0.328 67.1-119.0 -66.4 135.1 29.3 20.0 -56.4 40 673 A T - 0 0 2 1,-0.1 -1,-0.1 2,-0.1 5,-0.1 -0.615 35.6-109.0 -72.0 124.6 32.0 22.7 -56.2 41 674 A P > - 0 0 13 0, 0.0 4,-2.5 0, 0.0 -20,-0.3 -0.232 30.1-115.5 -55.1 146.0 33.7 23.0 -59.6 42 675 A E H > S+ 0 0 31 -22,-1.8 4,-2.8 -21,-0.3 5,-0.2 0.843 110.5 51.0 -59.5 -42.4 37.2 21.6 -59.6 43 676 A K H > S+ 0 0 77 -23,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.925 114.4 45.7 -62.8 -42.2 39.2 24.8 -60.2 44 677 A I H > S+ 0 0 4 2,-0.2 4,-2.5 -3,-0.2 -2,-0.2 0.917 113.5 48.6 -65.4 -43.5 37.3 26.5 -57.4 45 678 A A H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.898 111.8 50.4 -63.0 -41.1 37.7 23.6 -55.0 46 679 A E H X S+ 0 0 111 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.922 110.0 50.6 -61.2 -44.6 41.4 23.4 -55.8 47 680 A H H X S+ 0 0 84 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.939 111.2 47.4 -59.1 -49.3 41.8 27.1 -55.2 48 681 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.912 111.4 50.9 -59.6 -43.4 40.0 26.9 -51.8 49 682 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.878 109.0 52.7 -63.2 -36.7 42.1 23.9 -50.8 50 683 A G H X S+ 0 0 25 -4,-2.2 4,-0.5 2,-0.2 -2,-0.2 0.930 109.4 47.7 -64.7 -45.6 45.3 25.8 -51.7 51 684 A R H >X S+ 0 0 53 -4,-2.3 4,-2.8 1,-0.2 3,-0.8 0.907 112.4 49.8 -62.7 -41.0 44.3 28.8 -49.6 52 685 A V H 3X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.937 109.0 50.7 -63.2 -46.3 43.5 26.5 -46.6 53 686 A S H 3< S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.553 117.6 43.5 -70.4 -5.5 46.8 24.6 -46.9 54 687 A Q H << S+ 0 0 161 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.844 121.9 27.8 -99.4 -51.9 48.5 28.1 -47.0 55 688 A S H < S+ 0 0 60 -4,-2.8 2,-0.3 -5,-0.1 -3,-0.2 0.431 113.6 53.4-102.1 -1.6 46.9 30.2 -44.3 56 689 A F S < S- 0 0 20 -4,-1.6 2,-0.4 -5,-0.3 70,-0.1 -0.924 91.4 -94.8-130.0 156.1 45.6 27.7 -41.7 57 690 A K - 0 0 123 -2,-0.3 -3,-0.1 68,-0.2 -2,-0.1 -0.622 52.2-174.4 -61.9 127.5 47.0 24.8 -39.6 58 691 A C + 0 0 37 -2,-0.4 23,-0.2 -5,-0.1 3,-0.2 0.093 43.4 107.0-130.4 21.2 45.9 22.2 -42.1 59 692 A D S S+ 0 0 94 1,-0.2 22,-3.5 21,-0.2 2,-0.5 0.984 89.3 25.0 -68.1 -56.7 46.5 18.6 -40.8 60 693 A V E +a 81 0A 20 20,-0.2 65,-2.0 22,-0.1 66,-1.8 -0.936 69.2 178.8-117.2 121.4 42.9 17.7 -40.2 61 694 A V E -ab 82 126A 0 20,-2.5 22,-2.6 -2,-0.5 2,-0.6 -0.960 19.1-144.5-119.4 134.7 40.0 19.3 -41.9 62 695 A V E -ab 83 127A 0 64,-2.7 66,-3.4 -2,-0.4 2,-0.9 -0.886 2.6-160.5 -93.9 122.1 36.3 18.4 -41.5 63 696 A D E > -ab 84 128A 0 20,-2.3 22,-2.8 -2,-0.6 3,-0.7 -0.865 15.2-172.3 -96.4 95.5 34.2 18.7 -44.6 64 697 A A T 3 S+ 0 0 1 64,-1.9 51,-0.3 -2,-0.9 -1,-0.1 0.683 78.1 24.9 -72.3 -25.0 30.9 18.9 -42.8 65 698 A F T 3 S+ 0 0 5 63,-0.4 -1,-0.3 21,-0.1 21,-0.2 -0.623 76.9 168.4-135.4 70.8 28.6 18.7 -45.8 66 699 A C X + 0 0 0 19,-2.7 3,-2.5 -3,-0.7 6,-0.3 0.617 8.4 177.3 -73.8 -15.4 30.8 16.8 -48.2 67 700 A G T 3 S- 0 0 1 18,-0.3 28,-0.4 1,-0.3 -1,-0.2 -0.206 72.4 -14.1 49.4-128.8 28.2 15.9 -50.8 68 701 A V T 3 S- 0 0 1 564,-1.3 -1,-0.3 -33,-0.2 -38,-0.1 0.295 104.4 -97.6 -91.0 11.7 29.9 14.1 -53.7 69 702 A G S <> S+ 0 0 0 -3,-2.5 4,-3.1 563,-0.1 5,-0.3 0.535 75.0 141.3 93.5 9.0 33.4 15.0 -52.6 70 703 A G H > S+ 0 0 2 562,-1.0 4,-1.1 -4,-0.3 -3,-0.1 0.934 87.7 25.7 -44.6 -60.6 34.2 18.1 -54.8 71 704 A N H > S+ 0 0 0 -5,-0.2 4,-2.4 2,-0.2 5,-0.2 0.879 118.7 60.4 -71.8 -41.3 35.9 19.9 -51.9 72 705 A T H > S+ 0 0 1 -6,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.935 104.5 49.9 -52.6 -50.5 36.9 16.7 -50.0 73 706 A I H X S+ 0 0 1 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.908 110.4 49.5 -56.2 -45.2 38.9 15.4 -52.9 74 707 A Q H X S+ 0 0 9 -4,-1.1 4,-0.9 -5,-0.3 -1,-0.2 0.887 109.6 50.8 -67.8 -38.6 40.8 18.7 -53.3 75 708 A F H ><>S+ 0 0 0 -4,-2.4 5,-1.6 1,-0.2 3,-0.7 0.915 111.1 49.7 -60.1 -44.1 41.7 18.9 -49.6 76 709 A A H ><5S+ 0 0 2 -4,-2.3 3,-1.6 1,-0.2 -2,-0.2 0.878 102.8 60.4 -64.3 -37.4 43.0 15.3 -49.7 77 710 A L H 3<5S+ 0 0 81 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.757 100.6 55.4 -63.9 -24.2 45.1 16.1 -52.8 78 711 A T T <<5S- 0 0 60 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.574 124.7-103.5 -83.4 -9.6 47.0 18.7 -50.8 79 712 A G T < 5S+ 0 0 43 -3,-1.6 2,-0.2 -4,-0.4 -3,-0.2 0.517 73.8 140.1 101.3 6.1 47.9 16.1 -48.2 80 713 A M < - 0 0 4 -5,-1.6 2,-0.5 1,-0.0 -1,-0.3 -0.557 56.3-119.5 -76.9 145.4 45.4 17.1 -45.5 81 714 A R E -a 60 0A 89 -22,-3.5 -20,-2.5 -2,-0.2 2,-0.4 -0.783 37.0-154.8 -82.5 125.9 43.6 14.4 -43.5 82 715 A V E -ac 61 108A 0 25,-2.1 27,-2.3 -2,-0.5 2,-0.7 -0.859 21.9-158.9-110.7 135.8 39.9 14.8 -44.2 83 716 A I E -ac 62 109A 0 -22,-2.6 -20,-2.3 -2,-0.4 2,-0.6 -0.941 23.4-160.5-103.0 107.4 36.9 13.8 -42.2 84 717 A A E -ac 63 110A 0 25,-2.2 27,-3.2 -2,-0.7 2,-0.4 -0.804 10.1-174.6 -98.9 120.0 34.0 13.8 -44.7 85 718 A I E + c 0 111A 0 -22,-2.8 -19,-2.7 -2,-0.6 -18,-0.3 -0.925 12.5 160.2-120.2 129.7 30.5 14.0 -43.4 86 719 A D E - c 0 112A 0 25,-2.3 27,-1.4 -2,-0.4 6,-0.1 -0.981 34.4-145.3-145.5 142.0 27.2 13.8 -45.1 87 720 A I S S+ 0 0 75 -2,-0.3 27,-0.1 25,-0.2 25,-0.1 0.708 86.5 77.2 -74.5 -19.7 23.7 13.0 -43.8 88 721 A D > - 0 0 44 1,-0.1 4,-1.6 25,-0.1 3,-0.4 -0.821 68.1-156.1 -96.3 119.3 22.8 11.2 -47.0 89 722 A P H > S+ 0 0 16 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.849 95.3 59.6 -62.0 -33.4 24.3 7.7 -47.3 90 723 A V H > S+ 0 0 78 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.895 103.2 51.3 -61.4 -39.7 24.0 7.9 -51.1 91 724 A K H > S+ 0 0 2 -3,-0.4 4,-3.4 2,-0.2 5,-0.2 0.912 107.6 52.7 -63.7 -42.2 26.3 11.0 -51.1 92 725 A I H X S+ 0 0 3 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.920 109.3 49.0 -58.9 -45.8 28.9 9.1 -49.0 93 726 A A H X S+ 0 0 53 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.909 114.2 46.0 -59.3 -45.0 28.9 6.2 -51.5 94 727 A L H X S+ 0 0 26 -4,-2.2 4,-2.7 2,-0.2 -64,-0.3 0.948 113.2 49.2 -63.5 -48.4 29.3 8.7 -54.4 95 728 A A H X S+ 0 0 1 -4,-3.4 4,-2.3 -28,-0.4 -2,-0.2 0.867 110.0 51.3 -59.4 -40.3 32.0 10.6 -52.5 96 729 A R H X S+ 0 0 69 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.917 111.3 48.1 -64.3 -43.3 33.9 7.4 -51.7 97 730 A N H X S+ 0 0 39 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.914 113.3 47.0 -60.4 -45.0 33.8 6.4 -55.4 98 731 A N H X S+ 0 0 0 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.869 108.2 55.0 -70.0 -34.7 35.0 9.7 -56.6 99 732 A A H <>S+ 0 0 0 -4,-2.3 5,-2.3 -5,-0.2 6,-0.6 0.873 108.2 49.8 -64.9 -36.6 37.8 9.9 -54.1 100 733 A E H ><5S+ 0 0 118 -4,-1.6 3,-2.1 1,-0.2 -2,-0.2 0.934 104.9 56.9 -68.1 -45.0 39.1 6.6 -55.3 101 734 A V H 3<5S+ 0 0 23 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.857 110.3 45.9 -49.4 -37.6 38.9 7.8 -58.9 102 735 A Y T 3<5S- 0 0 14 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.408 115.2-121.2 -90.7 1.4 41.3 10.6 -57.8 103 736 A G T < 5S+ 0 0 54 -3,-2.1 -3,-0.2 -4,-0.1 -2,-0.1 0.690 88.1 94.5 72.4 21.5 43.5 8.2 -56.0 104 737 A I > < + 0 0 19 -5,-2.3 3,-2.0 1,-0.1 -4,-0.2 0.136 34.7 118.3-131.0 23.4 43.2 9.7 -52.5 105 738 A A G > S+ 0 0 6 -6,-0.6 3,-2.2 1,-0.3 291,-0.4 0.885 73.1 64.3 -54.7 -37.7 40.4 7.8 -50.8 106 739 A D G 3 S+ 0 0 100 1,-0.3 -1,-0.3 289,-0.2 290,-0.1 0.571 92.5 63.3 -65.8 -9.7 42.9 6.6 -48.2 107 740 A K G < S+ 0 0 71 -3,-2.0 -25,-2.1 288,-0.2 2,-0.4 0.435 98.5 72.2 -90.9 0.6 43.3 10.2 -47.0 108 741 A I E < -c 82 0A 1 -3,-2.2 288,-2.4 -27,-0.2 2,-0.5 -0.916 59.3-156.9-127.1 141.4 39.7 10.3 -45.9 109 742 A E E -c 83 0A 18 -27,-2.3 -25,-2.2 -2,-0.4 2,-0.4 -0.981 26.2-148.5-111.2 120.4 37.4 9.0 -43.2 110 743 A F E -cd 84 398A 1 287,-2.8 289,-1.6 -2,-0.5 2,-0.5 -0.748 14.6-173.7 -96.7 133.0 33.8 9.0 -44.3 111 744 A I E -cd 85 399A 0 -27,-3.2 -25,-2.3 -2,-0.4 2,-0.8 -0.977 18.2-155.2-126.7 120.0 30.8 9.5 -42.0 112 745 A C E +cd 86 400A 3 287,-2.6 289,-2.8 -2,-0.5 2,-0.3 -0.855 57.7 104.4 -84.1 112.2 27.2 9.2 -42.8 113 746 A G S S- 0 0 7 -27,-1.4 2,-0.7 -2,-0.8 -25,-0.1 -0.984 76.4 -79.4-176.2 172.5 25.8 11.4 -40.1 114 747 A D >> - 0 0 44 287,-0.4 3,-1.6 -2,-0.3 4,-1.3 -0.819 29.1-155.1 -95.3 112.3 24.2 14.8 -39.1 115 748 A F H 3> S+ 0 0 4 -2,-0.7 4,-2.6 -51,-0.3 3,-0.3 0.834 92.3 63.7 -57.2 -33.3 26.9 17.4 -38.7 116 749 A L H 34 S+ 0 0 46 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.803 111.3 36.6 -61.1 -29.8 24.7 19.4 -36.3 117 750 A L H <4 S+ 0 0 64 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.565 119.8 47.5-100.7 -11.8 24.8 16.5 -33.8 118 751 A L H >< S+ 0 0 0 -4,-1.3 3,-2.2 -3,-0.3 268,-0.2 0.767 91.9 78.8 -93.8 -32.3 28.4 15.4 -34.5 119 752 A A G >< S+ 0 0 0 -4,-2.6 3,-2.0 1,-0.3 -3,-0.1 0.818 84.2 59.7 -49.2 -47.0 30.1 18.9 -34.3 120 753 A S G 3 S+ 0 0 36 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.642 113.2 40.2 -61.3 -13.2 30.2 19.2 -30.5 121 754 A F G < S+ 0 0 37 -3,-2.2 265,-2.3 230,-0.0 266,-0.5 0.106 94.8 102.8-125.7 21.4 32.3 16.1 -30.3 122 755 A L < - 0 0 8 -3,-2.0 2,-0.4 264,-0.2 263,-0.0 -0.781 50.4-160.3-103.4 150.6 34.6 16.6 -33.3 123 756 A K + 0 0 104 -2,-0.3 2,-0.3 42,-0.0 42,-0.1 -0.993 29.0 130.6-132.5 126.4 38.2 17.8 -33.2 124 757 A A - 0 0 18 40,-0.5 -63,-0.2 -2,-0.4 3,-0.1 -0.985 56.4-121.0-164.5 167.8 40.0 19.4 -36.1 125 758 A D S S+ 0 0 32 -65,-2.0 42,-0.4 -2,-0.3 2,-0.4 0.862 97.2 22.4 -84.5 -39.2 42.2 22.3 -37.3 126 759 A V E -b 61 0A 0 -66,-1.8 -64,-2.7 -70,-0.1 2,-0.5 -0.982 61.1-157.1-132.4 139.6 39.8 23.5 -40.0 127 760 A V E -be 62 168A 0 40,-2.2 42,-2.7 -2,-0.4 2,-0.5 -0.980 10.6-160.5-113.4 124.3 36.1 23.2 -40.7 128 761 A F E -be 63 169A 0 -66,-3.4 -64,-1.9 -2,-0.5 2,-0.6 -0.906 6.3-159.5-103.7 128.3 34.8 23.6 -44.2 129 762 A L E + e 0 170A 0 40,-3.5 42,-3.2 -2,-0.5 -66,-0.1 -0.904 28.2 153.2-115.9 108.7 31.1 24.4 -44.7 130 763 A S + 0 0 3 -2,-0.6 3,-0.1 40,-0.2 42,-0.1 -0.485 27.8 171.8-126.8 65.4 29.3 23.8 -47.9 131 764 A P - 0 0 4 0, 0.0 2,-0.2 0, 0.0 -66,-0.1 -0.014 42.7 -77.7 -70.4 170.5 25.7 23.2 -46.8 132 765 A P - 0 0 25 0, 0.0 19,-0.4 0, 0.0 -94,-0.0 -0.495 35.3-168.2 -66.9 138.1 22.5 22.9 -48.8 133 766 A W - 0 0 40 -2,-0.2 39,-0.0 17,-0.1 -95,-0.0 0.493 58.8 -83.9-103.8 -10.2 21.2 26.3 -50.1 134 767 A G S S- 0 0 58 17,-0.1 3,-0.5 16,-0.1 16,-0.0 0.669 71.7 -78.7 113.0 27.3 17.8 25.1 -51.2 135 768 A G S > S- 0 0 37 1,-0.2 3,-2.0 2,-0.2 4,-0.1 -0.113 80.1 -42.4 74.0-178.0 18.5 23.7 -54.7 136 769 A P G > S+ 0 0 56 0, 0.0 3,-1.3 0, 0.0 -1,-0.2 0.698 127.8 76.0 -55.0 -22.5 19.0 25.8 -57.9 137 770 A D G > + 0 0 119 -3,-0.5 3,-2.1 1,-0.3 4,-0.4 0.645 68.6 87.9 -66.3 -16.0 16.0 28.0 -56.8 138 771 A Y G X S+ 0 0 36 -3,-2.0 3,-0.9 1,-0.3 -1,-0.3 0.756 80.7 62.6 -52.2 -26.2 18.2 29.7 -54.2 139 772 A A G < S+ 0 0 48 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.651 83.2 75.0 -79.9 -16.0 19.1 32.2 -56.9 140 773 A T G < S+ 0 0 118 -3,-2.1 2,-0.3 -4,-0.1 -1,-0.2 0.676 77.4 92.4 -71.8 -17.7 15.6 33.5 -57.4 141 774 A A S < S- 0 0 22 -3,-0.9 3,-0.2 -4,-0.4 8,-0.0 -0.635 76.5-141.7 -73.6 132.9 16.0 35.4 -54.1 142 775 A E S S+ 0 0 183 -2,-0.3 2,-0.4 1,-0.3 -1,-0.2 0.915 93.6 14.9 -59.5 -44.1 17.3 39.0 -54.7 143 776 A T S S- 0 0 66 -3,-0.1 2,-0.6 34,-0.0 -1,-0.3 -0.992 84.3-130.1-134.9 126.2 19.4 38.6 -51.6 144 777 A F B -u 176 0B 2 31,-3.4 33,-2.0 -2,-0.4 2,-0.7 -0.655 16.3-155.3 -82.2 119.5 20.1 35.2 -50.0 145 778 A D > - 0 0 42 -2,-0.6 4,-2.5 31,-0.2 5,-0.3 -0.835 2.7-160.3 -94.8 114.3 19.5 35.3 -46.2 146 779 A I T 4 S+ 0 0 0 -2,-0.7 8,-2.8 1,-0.2 9,-0.2 0.630 89.8 49.1 -74.6 -10.4 21.6 32.6 -44.5 147 780 A R T 4 S+ 0 0 119 6,-0.2 -1,-0.2 7,-0.2 3,-0.1 0.901 123.6 24.2 -87.1 -51.2 19.4 32.7 -41.5 148 781 A T T 4 S+ 0 0 99 1,-0.2 -2,-0.2 5,-0.1 5,-0.0 0.669 125.4 44.2 -94.6 -20.8 15.9 32.4 -43.1 149 782 A M S < S+ 0 0 85 -4,-2.5 2,-0.4 -11,-0.0 -1,-0.2 0.378 101.1 75.1-108.8 3.3 16.6 30.8 -46.4 150 783 A M - 0 0 3 -5,-0.3 4,-0.2 -3,-0.1 -17,-0.1 -0.952 69.6-136.2-123.3 134.2 19.0 28.0 -45.3 151 784 A S S S+ 0 0 104 -2,-0.4 2,-0.2 -19,-0.4 -17,-0.1 -0.970 98.7 38.1-134.1 119.3 18.2 24.8 -43.5 152 785 A P S S- 0 0 31 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.518 117.5-105.0 -64.8 157.2 20.0 24.1 -41.3 153 786 A D > - 0 0 48 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.284 22.8-133.5 -52.4 129.3 20.3 27.8 -40.3 154 787 A G H > S+ 0 0 0 -8,-2.8 4,-1.4 1,-0.2 -7,-0.2 0.793 104.4 50.2 -62.0 -33.3 23.6 29.3 -41.4 155 788 A F H > S+ 0 0 34 -9,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.861 110.6 50.8 -71.6 -36.0 24.3 30.9 -38.0 156 789 A E H > S+ 0 0 70 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.926 108.1 51.4 -68.4 -43.8 23.6 27.7 -36.2 157 790 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.903 112.8 47.4 -55.4 -41.1 26.0 25.7 -38.4 158 791 A F H X S+ 0 0 10 -4,-1.4 4,-2.0 -5,-0.2 -2,-0.2 0.906 108.2 53.9 -70.5 -42.3 28.6 28.3 -37.7 159 792 A R H X S+ 0 0 121 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.934 112.0 44.5 -57.3 -48.3 28.0 28.3 -33.9 160 793 A L H >X S+ 0 0 8 -4,-2.4 3,-1.4 1,-0.2 4,-0.6 0.911 110.4 54.7 -63.0 -42.6 28.5 24.5 -33.8 161 794 A S H >X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.3 3,-1.2 0.850 98.9 63.9 -58.7 -33.6 31.5 24.7 -36.0 162 795 A K H 3< S+ 0 0 82 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.731 91.2 64.4 -65.3 -21.0 33.0 27.2 -33.5 163 796 A K H << S+ 0 0 120 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.823 109.2 40.7 -68.3 -29.7 33.0 24.4 -30.9 164 797 A I H << S- 0 0 20 -3,-1.2 -40,-0.5 -4,-0.6 2,-0.3 0.892 129.6 -30.2 -82.5 -45.8 35.6 22.6 -33.1 165 798 A T < - 0 0 20 -4,-2.0 -1,-0.3 -42,-0.1 -40,-0.1 -0.989 38.2-124.3-168.2 162.2 37.8 25.5 -34.3 166 799 A N S S+ 0 0 91 -2,-0.3 2,-1.2 -41,-0.1 -4,-0.1 0.610 91.5 89.6 -90.4 -15.5 38.0 29.2 -35.1 167 800 A N + 0 0 26 -42,-0.4 -40,-2.2 43,-0.1 2,-0.4 -0.699 59.9 160.1 -86.5 92.4 39.4 28.3 -38.6 168 801 A I E -e 127 0A 0 -2,-1.2 41,-3.0 41,-0.5 2,-0.5 -0.929 28.5-160.7-122.2 136.3 36.2 28.1 -40.6 169 802 A V E -eF 128 208A 0 -42,-2.7 -40,-3.5 -2,-0.4 2,-0.5 -0.980 10.9-162.3-117.1 124.2 35.7 28.2 -44.4 170 803 A Y E -eF 129 207A 0 37,-2.9 37,-2.6 -2,-0.5 2,-0.6 -0.927 6.0-159.0-114.8 121.0 32.1 29.0 -45.6 171 804 A F E + F 0 206A 6 -42,-3.2 35,-0.2 -2,-0.5 -2,-0.0 -0.873 30.7 168.2-101.6 116.9 31.1 28.2 -49.2 172 805 A L E - F 0 205A 0 33,-2.8 33,-2.8 -2,-0.6 4,-0.1 -0.828 37.2 -78.3-138.5 162.3 28.1 30.4 -50.0 173 806 A P E > - F 0 204A 0 0, 0.0 3,-1.6 0, 0.0 31,-0.2 -0.220 37.2-123.6 -61.7 150.8 25.7 31.7 -52.7 174 807 A R T 3 S+ 0 0 88 29,-0.6 30,-0.1 1,-0.3 29,-0.0 0.596 113.8 53.8 -72.3 -10.4 26.9 34.6 -54.9 175 808 A N T 3 S+ 0 0 31 2,-0.1 -31,-3.4 30,-0.1 -1,-0.3 0.117 81.9 137.4-106.3 19.7 23.8 36.5 -53.8 176 809 A A B < -u 144 0B 11 -3,-1.6 2,-0.8 -33,-0.2 -31,-0.2 -0.360 67.6-104.5 -65.6 143.7 24.5 36.0 -50.1 177 810 A D > - 0 0 51 -33,-2.0 4,-2.5 1,-0.2 5,-0.2 -0.605 32.0-161.8 -69.0 106.4 24.0 39.0 -47.8 178 811 A I H > S+ 0 0 81 -2,-0.8 4,-2.3 1,-0.2 5,-0.2 0.795 88.5 57.0 -69.1 -29.4 27.7 40.0 -47.2 179 812 A D H > S+ 0 0 128 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.943 110.3 45.8 -60.5 -48.4 26.8 42.0 -44.1 180 813 A Q H > S+ 0 0 21 2,-0.2 4,-0.7 1,-0.2 -2,-0.2 0.936 112.6 49.5 -57.4 -51.8 25.3 38.8 -42.7 181 814 A V H >< S+ 0 0 0 -4,-2.5 3,-1.2 1,-0.2 4,-0.4 0.916 111.5 48.5 -56.4 -46.6 28.2 36.7 -43.6 182 815 A A H >< S+ 0 0 39 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.867 102.4 63.8 -62.2 -35.9 30.7 39.1 -42.1 183 816 A S H >< S+ 0 0 59 -4,-1.8 3,-1.5 1,-0.3 -1,-0.2 0.669 83.2 77.9 -67.3 -15.4 28.7 39.3 -38.9 184 817 A L T << S+ 0 0 14 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.851 81.4 68.5 -59.3 -33.3 29.4 35.6 -38.3 185 818 A A T < S- 0 0 14 -3,-1.6 -1,-0.3 -4,-0.4 5,-0.2 0.691 94.8-153.5 -61.4 -19.1 32.8 36.5 -37.1 186 819 A G X - 0 0 41 -3,-1.5 3,-1.2 -4,-0.2 2,-0.2 -0.243 48.3 -7.8 72.5-166.7 31.3 38.2 -34.0 187 820 A P T 3 S- 0 0 136 0, 0.0 3,-0.1 0, 0.0 -4,-0.0 -0.444 140.3 -9.0 -68.2 126.4 32.9 41.1 -32.1 188 821 A G T 3 S+ 0 0 75 -2,-0.2 -2,-0.1 1,-0.2 -3,-0.0 0.498 99.5 159.5 65.2 2.1 36.5 41.8 -33.3 189 822 A G < - 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