==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METHYLTRANSFERASE 25-JUL-96 1AQI . COMPND 2 MOLECULE: ADENINE-N6-DNA-METHYLTRANSFERASE TAQI; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR G.SCHLUCKEBIER,W.SAENGER . 766 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34913.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 507 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 15.3 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 . 4 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 . 75 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 143 18.7 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+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 2 0 0 8 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 2 6 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 5 5 2 2 0 4 2 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 . 6 2 2 0 0 0 0 1 1 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 21 A V 0 0 38 0, 0.0 2,-0.2 0, 0.0 87,-0.0 0.000 360.0 360.0 360.0 128.6 31.9 39.8 13.4 2 22 A E - 0 0 132 767,-0.1 166,-0.1 1,-0.1 0, 0.0 -0.598 360.0-122.2 -82.9 144.9 32.1 43.2 15.0 3 23 A T - 0 0 25 -2,-0.2 163,-0.1 163,-0.1 -1,-0.1 -0.756 24.0-134.7 -91.3 114.3 31.4 43.6 18.7 4 24 A P > - 0 0 23 0, 0.0 4,-2.0 0, 0.0 3,-0.4 -0.280 19.9-116.9 -62.3 152.5 28.5 46.1 19.4 5 25 A P H > S+ 0 0 61 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.908 113.2 51.8 -58.2 -44.9 29.2 48.7 22.2 6 26 A E H > S+ 0 0 77 1,-0.2 4,-2.0 2,-0.2 191,-0.3 0.819 108.2 51.7 -64.5 -30.0 26.4 47.4 24.5 7 27 A V H > S+ 0 0 1 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.928 110.1 49.0 -70.6 -43.4 27.7 43.8 24.2 8 28 A V H X S+ 0 0 14 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.918 110.3 52.3 -60.7 -41.2 31.1 45.0 25.3 9 29 A D H X S+ 0 0 72 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.903 107.6 51.8 -59.9 -43.9 29.5 46.9 28.1 10 30 A F H < S+ 0 0 13 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.903 110.7 47.4 -60.8 -43.7 27.7 43.8 29.2 11 31 A M H >X S+ 0 0 0 -4,-2.3 3,-1.0 1,-0.2 4,-0.6 0.871 107.4 55.7 -68.5 -36.7 30.9 41.8 29.3 12 32 A V H 3< S+ 0 0 7 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.839 103.9 54.5 -65.8 -31.9 32.8 44.4 31.2 13 33 A S T 3< S+ 0 0 83 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.569 106.5 51.3 -77.9 -10.2 30.3 44.4 34.0 14 34 A L T <4 S+ 0 0 26 -3,-1.0 2,-0.3 -4,-0.4 -1,-0.2 0.520 96.7 93.7 -95.8 -13.8 30.7 40.6 34.4 15 35 A A < + 0 0 2 -4,-0.6 2,-0.3 -3,-0.5 66,-0.1 -0.657 48.6 168.5 -86.4 138.5 34.5 41.1 34.7 16 36 A E + 0 0 106 -2,-0.3 113,-0.2 64,-0.1 -3,-0.0 -0.984 3.1 167.3-147.0 147.5 36.3 41.5 38.0 17 37 A A - 0 0 21 -2,-0.3 3,-0.1 111,-0.1 6,-0.1 -0.965 37.6-100.9-160.9 147.0 40.0 41.5 38.9 18 38 A P > - 0 0 74 0, 0.0 3,-2.5 0, 0.0 62,-0.1 -0.357 51.3 -89.3 -69.3 151.3 42.0 42.4 42.0 19 39 A R T 3 S+ 0 0 178 1,-0.3 26,-0.2 26,-0.1 3,-0.1 -0.392 120.2 23.5 -60.5 138.4 43.9 45.8 42.1 20 40 A G T 3 S+ 0 0 59 24,-4.0 -1,-0.3 1,-0.3 25,-0.2 0.350 96.9 138.7 84.9 -7.0 47.3 45.2 40.6 21 41 A G < - 0 0 4 -3,-2.5 25,-1.9 23,-0.3 2,-0.4 -0.344 58.8-108.0 -73.3 151.7 46.0 42.1 38.8 22 42 A R E -a 46 0A 75 23,-0.2 59,-1.7 56,-0.2 58,-1.5 -0.692 30.0-165.6 -83.6 128.7 47.0 41.4 35.2 23 43 A V E -ab 47 81A 0 23,-3.3 25,-2.4 -2,-0.4 2,-0.3 -0.959 9.7-172.3-115.6 128.5 44.3 41.9 32.6 24 44 A L E -ab 48 82A 0 57,-2.1 59,-2.2 -2,-0.5 25,-0.2 -0.938 17.1-164.2-127.3 144.5 44.8 40.4 29.1 25 45 A E E > -a 49 0A 6 23,-1.4 25,-1.8 -2,-0.3 3,-0.7 -0.933 16.4-149.1-128.0 106.1 43.0 40.6 25.8 26 46 A P E 3 S+a 50 0A 2 0, 0.0 59,-0.4 0, 0.0 25,-0.1 -0.537 83.8 11.9 -72.5 139.2 44.0 37.9 23.2 27 47 A A T 3 S+ 0 0 7 23,-1.8 24,-0.2 -2,-0.2 58,-0.2 0.895 85.2 167.1 59.6 48.5 43.7 39.0 19.5 28 48 A C X + 0 0 1 22,-1.1 3,-2.4 -3,-0.7 2,-0.3 0.693 14.4 178.4 -68.2 -34.3 43.4 42.7 20.6 29 49 A A T 3 S- 0 0 21 1,-0.3 29,-1.9 2,-0.1 -1,-0.2 -0.449 87.6 -6.6 61.0-114.8 43.9 44.9 17.5 30 50 A H T 3 S- 0 0 84 -2,-0.3 -1,-0.3 27,-0.2 5,-0.1 0.256 106.5-108.6 -93.1 10.3 43.4 48.3 19.1 31 51 A G <> + 0 0 0 -3,-2.4 4,-2.1 28,-0.1 5,-0.2 0.915 47.0 174.5 66.9 54.7 42.4 46.8 22.4 32 52 A P H > S+ 0 0 42 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.799 81.8 42.3 -59.4 -36.1 38.6 47.5 22.7 33 53 A F H > S+ 0 0 3 2,-0.2 4,-2.1 3,-0.2 5,-0.2 0.790 110.4 55.4 -82.9 -31.0 38.2 45.5 26.0 34 54 A L H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.944 113.2 44.4 -63.9 -44.9 41.3 46.8 27.6 35 55 A R H X S+ 0 0 80 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.931 113.8 47.1 -64.9 -50.7 40.0 50.3 27.0 36 56 A A H X S+ 0 0 20 -4,-1.8 4,-1.3 1,-0.2 5,-0.2 0.899 112.2 51.1 -61.8 -39.8 36.4 49.7 28.2 37 57 A F H X S+ 0 0 0 -4,-2.1 4,-3.6 1,-0.2 5,-0.5 0.929 108.1 51.2 -64.1 -45.7 37.6 47.9 31.3 38 58 A R H X S+ 0 0 74 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.871 110.2 49.7 -59.6 -40.2 39.9 50.7 32.4 39 59 A E H < S+ 0 0 92 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.753 121.4 34.0 -69.7 -30.0 37.1 53.3 32.0 40 60 A A H < S+ 0 0 30 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.764 132.4 26.4 -96.5 -31.7 34.7 51.2 34.1 41 61 A H H < S- 0 0 62 -4,-3.6 3,-0.2 1,-0.2 -3,-0.2 0.514 107.1-114.7-110.6 -9.8 37.1 49.6 36.6 42 62 A G < - 0 0 23 -4,-1.7 -1,-0.2 -5,-0.5 -2,-0.1 -0.270 26.1 -74.5 106.0 174.4 40.0 51.9 36.9 43 63 A T S S+ 0 0 87 1,-0.2 2,-1.9 -2,-0.1 -1,-0.1 0.482 89.2 103.9 -92.7 -7.4 43.8 52.2 36.2 44 64 A G + 0 0 23 -3,-0.2 -24,-4.0 -6,-0.1 -23,-0.3 -0.177 67.3 78.3 -75.7 50.5 45.1 50.1 39.0 45 65 A Y S S- 0 0 39 -2,-1.9 2,-0.6 -26,-0.2 -23,-0.2 -0.925 81.4-105.2-147.1 168.1 46.0 47.0 36.9 46 66 A R E -a 22 0A 75 -25,-1.9 -23,-3.3 -2,-0.3 2,-0.5 -0.900 36.9-155.9-100.4 119.1 48.6 45.6 34.4 47 67 A F E +ac 23 63A 7 -2,-0.6 17,-2.9 15,-0.5 2,-0.3 -0.856 16.2 173.4-102.1 128.0 47.2 45.7 30.9 48 68 A V E -ac 24 64A 0 -25,-2.4 -23,-1.4 -2,-0.5 2,-0.4 -0.951 9.5-169.9-130.8 146.9 48.5 43.3 28.1 49 69 A G E -ac 25 65A 0 15,-2.2 17,-3.2 -2,-0.3 2,-0.5 -0.999 8.8-154.0-139.2 134.5 47.4 42.7 24.6 50 70 A V E +ac 26 66A 2 -25,-1.8 -23,-1.8 -2,-0.4 -22,-1.1 -0.959 21.0 167.1-114.1 120.4 48.5 39.9 22.2 51 71 A E E - c 0 67A 0 15,-3.2 17,-1.4 -2,-0.5 18,-0.1 -0.991 26.5-161.2-133.7 136.6 48.2 40.6 18.4 52 72 A I S S+ 0 0 77 -2,-0.4 17,-0.1 15,-0.3 -1,-0.1 0.680 79.1 69.1 -88.5 -22.1 49.7 38.6 15.6 53 73 A D >> - 0 0 68 1,-0.1 3,-2.1 15,-0.1 4,-1.5 -0.866 64.7-161.0-104.0 108.1 49.4 41.3 12.9 54 74 A P T 34 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.746 93.4 59.6 -57.6 -24.8 51.8 44.3 13.6 55 75 A K T 34 S+ 0 0 194 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.732 109.1 44.0 -76.0 -21.6 49.7 46.4 11.3 56 76 A A T <4 S+ 0 0 25 -3,-2.1 2,-0.7 -27,-0.0 -1,-0.2 0.724 85.1 102.8 -92.9 -27.8 46.7 45.8 13.6 57 77 A L < + 0 0 47 -4,-1.5 -27,-0.2 1,-0.1 2,-0.2 -0.462 37.5 151.4 -64.5 105.8 48.4 46.3 16.9 58 78 A D + 0 0 110 -29,-1.9 -1,-0.1 -2,-0.7 -3,-0.0 -0.637 13.2 158.3-139.7 75.7 47.3 49.7 18.0 59 79 A L - 0 0 32 -2,-0.2 -28,-0.1 4,-0.1 6,-0.1 -0.771 40.5-109.6-104.2 146.5 47.3 50.0 21.9 60 80 A P > - 0 0 18 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.258 39.8 -96.8 -68.6 161.5 47.5 53.1 24.0 61 81 A P T 3 S+ 0 0 133 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.752 119.3 60.4 -46.3 -42.0 50.7 53.9 26.1 62 82 A W T 3 S+ 0 0 80 2,-0.1 -15,-0.5 -16,-0.0 2,-0.3 0.618 96.7 76.9 -68.5 -11.1 49.4 52.4 29.4 63 83 A A E < S-c 47 0A 16 -3,-2.1 2,-0.5 -17,-0.1 -15,-0.2 -0.768 76.6-132.4-105.3 147.6 49.0 49.0 27.8 64 84 A E E -c 48 0A 90 -17,-2.9 -15,-2.2 -2,-0.3 2,-0.4 -0.844 23.2-150.1 -97.7 124.6 51.7 46.5 27.0 65 85 A G E -c 49 0A 41 -2,-0.5 2,-0.5 -17,-0.2 -15,-0.2 -0.825 9.6-166.5-102.4 135.5 51.6 45.1 23.4 66 86 A I E -c 50 0A 39 -17,-3.2 -15,-3.2 -2,-0.4 2,-0.9 -0.977 11.5-150.8-121.5 124.3 52.7 41.6 22.4 67 87 A L E +c 51 0A 95 -2,-0.5 2,-0.3 -17,-0.2 -15,-0.3 -0.819 52.7 106.1 -92.6 101.4 53.2 40.6 18.8 68 88 A A S S- 0 0 28 -17,-1.4 2,-1.1 -2,-0.9 -15,-0.1 -0.994 77.9 -89.0-168.9 167.0 52.5 36.9 18.7 69 89 A D >> - 0 0 36 -2,-0.3 3,-2.6 1,-0.2 4,-0.6 -0.783 37.7-153.5 -86.2 100.1 50.3 33.9 17.8 70 90 A F G >4 S+ 0 0 5 -2,-1.1 3,-1.5 1,-0.3 -1,-0.2 0.849 90.9 60.8 -42.5 -44.0 48.3 33.7 21.0 71 91 A L G 34 S+ 0 0 5 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.733 115.2 32.2 -60.7 -24.0 47.8 30.0 20.4 72 92 A L G <4 S+ 0 0 83 -3,-2.6 2,-0.4 2,-0.0 -1,-0.3 0.236 93.6 118.1-116.2 11.0 51.5 29.3 20.5 73 93 A W << - 0 0 34 -3,-1.5 -5,-0.0 -4,-0.6 -23,-0.0 -0.654 40.1-172.8 -85.4 130.7 52.4 32.0 23.0 74 94 A E + 0 0 144 -2,-0.4 -3,-0.0 1,-0.1 -4,-0.0 -0.885 6.4 176.1-125.0 96.3 54.0 30.9 26.3 75 95 A P - 0 0 27 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.658 34.3-136.1 -72.6 -23.4 54.3 33.9 28.6 76 96 A G S S+ 0 0 86 1,-0.3 2,-0.3 0, 0.0 -2,-0.0 0.667 79.0 91.2 70.9 12.6 55.6 32.1 31.7 77 97 A E - 0 0 48 48,-0.0 2,-0.3 46,-0.0 -1,-0.3 -0.937 69.4-137.5-135.8 154.4 53.1 34.2 33.6 78 98 A A - 0 0 33 -2,-0.3 2,-0.3 -3,-0.1 46,-0.2 -0.862 18.7-135.9-114.2 150.6 49.4 33.6 34.6 79 99 A F E - d 0 124A 0 44,-3.1 46,-2.7 -2,-0.3 -56,-0.1 -0.711 11.6-149.7-110.0 160.9 46.6 36.1 34.4 80 100 A D E S+ 0 0 20 -58,-1.5 49,-2.4 1,-0.3 2,-0.4 0.785 87.2 19.6 -91.2 -35.6 43.8 37.2 36.7 81 101 A L E -bd 23 129A 0 -59,-1.7 -57,-2.1 47,-0.2 2,-0.4 -0.999 60.6-175.4-141.7 133.7 41.3 38.2 34.0 82 102 A I E +bd 24 130A 0 47,-1.8 49,-2.5 -2,-0.4 2,-0.3 -1.000 15.3 165.5-130.9 125.8 41.1 37.4 30.4 83 103 A L E + d 0 131A 0 -59,-2.2 2,-0.3 -2,-0.4 49,-0.2 -0.981 13.7 94.4-140.8 153.2 38.6 38.9 28.1 84 104 A G E - d 0 132A 0 47,-1.6 49,-1.3 -2,-0.3 -57,-0.1 -0.952 63.2 -81.5 160.8-177.1 37.9 39.3 24.4 85 105 A N - 0 0 10 -59,-0.4 49,-0.1 -2,-0.3 3,-0.1 -0.958 44.0-155.7-122.4 103.9 36.4 38.3 21.1 86 106 A P - 0 0 1 0, 0.0 27,-0.1 0, 0.0 2,-0.1 -0.450 30.2 -91.9 -80.0 155.8 38.4 35.5 19.6 87 107 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 29,-0.2 -0.435 39.6-140.7 -67.1 141.5 38.4 34.9 15.8 88 108 A Y + 0 0 39 681,-2.1 2,-0.2 24,-0.2 23,-0.0 -0.758 52.0 62.6-100.0 149.6 35.7 32.3 14.8 89 109 A G S S- 0 0 24 -2,-0.3 23,-3.8 2,-0.0 24,-0.2 -0.527 70.0 -84.2 127.5 166.9 36.5 29.8 12.0 90 110 A I 0 0 86 21,-0.2 20,-0.1 -2,-0.2 21,-0.1 -0.567 360.0 360.0-103.6 172.3 38.6 26.9 10.8 91 111 A V 0 0 89 18,-0.3 -1,-0.0 -2,-0.2 -2,-0.0 -0.628 360.0 360.0-120.5 360.0 42.0 26.9 9.1 92 ! 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 93 123 A K 0 0 170 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 112.8 47.8 22.4 7.9 94 124 A A > + 0 0 41 1,-0.2 4,-2.5 0, 0.0 5,-0.1 -0.311 360.0 53.0 90.6 -52.9 50.9 22.1 10.1 95 125 A V H > S+ 0 0 87 -2,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.901 122.8 35.3 -70.3 -38.9 50.1 25.5 11.7 96 126 A K H >> S+ 0 0 40 2,-0.2 4,-2.2 1,-0.2 3,-0.6 0.999 118.8 47.9 -68.0 -69.6 46.9 23.4 12.0 97 127 A D H 3> S+ 0 0 81 1,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.849 111.5 52.6 -36.4 -48.8 48.7 20.1 12.6 98 128 A L H 3X S+ 0 0 77 -4,-2.5 4,-2.6 1,-0.2 3,-0.5 0.947 108.3 51.0 -53.3 -51.6 50.9 21.8 15.2 99 129 A Y H < - 0 0 10 -4,-3.1 3,-1.2 -5,-0.1 -1,-0.1 -0.875 53.4-169.3-114.1 120.9 45.3 21.2 21.9 104 134 A S T 3 S+ 0 0 70 -2,-0.6 -1,-0.1 1,-0.3 -4,-0.0 0.690 89.8 55.3 -69.9 -28.1 43.6 18.3 23.7 105 135 A T T 3 S+ 0 0 3 9,-0.1 2,-0.5 10,-0.1 42,-0.3 0.389 78.2 123.4 -87.5 4.2 40.0 19.4 23.1 106 136 A W < + 0 0 29 -3,-1.2 2,-0.3 -6,-0.2 38,-0.1 -0.551 34.4 162.0 -70.8 117.2 40.7 19.5 19.3 107 137 A K > - 0 0 86 -2,-0.5 3,-0.6 36,-0.3 -2,-0.0 -0.997 48.4 -28.4-140.1 140.8 38.2 17.3 17.6 108 138 A G T 3 S- 0 0 53 -2,-0.3 3,-0.1 1,-0.2 35,-0.0 -0.225 122.2 -24.4 57.3-141.6 37.0 17.0 14.0 109 139 A K T 3 S+ 0 0 96 1,-0.1 -18,-0.3 -19,-0.0 -1,-0.2 0.848 92.9 178.2 -68.6 -34.8 37.2 20.2 12.0 110 140 A Y < - 0 0 0 -3,-0.6 2,-0.3 -20,-0.1 -1,-0.1 -0.107 23.7-104.9 59.3-161.4 37.0 22.1 15.3 111 141 A N >> - 0 0 20 32,-0.1 3,-2.0 1,-0.1 4,-1.3 -0.940 13.1-119.0-162.7 139.1 37.1 25.9 15.4 112 142 A L H 3> S+ 0 0 23 -23,-3.8 4,-2.5 -2,-0.3 5,-0.2 0.839 111.8 62.7 -50.1 -37.3 39.7 28.5 16.3 113 143 A Y H 3> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.793 100.9 53.9 -62.3 -24.6 37.4 29.8 19.1 114 144 A G H <> S+ 0 0 0 -3,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.909 108.7 47.1 -73.8 -43.3 37.6 26.5 20.8 115 145 A A H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.2 -2,-0.2 0.905 110.4 52.7 -64.1 -42.9 41.4 26.5 20.8 116 146 A F H X S+ 0 0 3 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.874 109.1 51.7 -59.5 -38.3 41.4 30.1 22.1 117 147 A L H X S+ 0 0 0 -4,-1.4 4,-2.5 -5,-0.2 5,-0.2 0.971 111.5 44.0 -62.9 -54.9 39.2 28.9 24.9 118 148 A E H X S+ 0 0 2 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.888 116.3 48.8 -57.1 -43.2 41.4 26.0 26.0 119 149 A K H X S+ 0 0 9 -4,-2.6 4,-0.9 2,-0.2 3,-0.3 0.944 110.9 49.3 -61.7 -49.8 44.5 28.2 25.7 120 150 A A H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.2 4,-0.2 0.890 108.1 53.2 -58.6 -43.5 42.9 31.0 27.7 121 151 A V H >< S+ 0 0 1 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.853 107.4 53.8 -61.7 -33.2 41.8 28.7 30.5 122 152 A R H 3< S+ 0 0 127 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.663 103.8 53.9 -76.2 -19.1 45.4 27.4 30.8 123 153 A L T << S+ 0 0 12 -4,-0.9 -44,-3.1 -3,-0.8 2,-0.3 0.330 89.0 110.4 -95.8 8.4 46.9 30.9 31.2 124 154 A L E < -d 79 0A 6 -3,-0.9 -44,-0.2 -46,-0.2 3,-0.1 -0.655 67.1-131.5 -89.5 133.9 44.6 31.5 34.2 125 155 A K E > - 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0 0 23 1,-0.1 2,-0.2 -22,-0.1 -1,-0.1 -0.482 37.0 -91.2 -97.7 166.5 28.5 71.7 22.4 705 351 B P - 0 0 0 0, 0.0 -58,-2.4 0, 0.0 2,-0.3 -0.610 43.0-160.0 -79.0 141.9 24.8 70.9 22.4 706 352 B W B -g 647 0L 0 -2,-0.2 -82,-0.6 -60,-0.2 -58,-0.2 -0.939 21.8-159.8-123.4 151.8 23.8 67.8 24.6 707 353 B R S S- 0 0 59 -60,-2.3 2,-0.3 -2,-0.3 -81,-0.2 0.468 75.5 -2.3-105.0 -8.8 20.8 65.6 24.5 708 354 B E S S+ 0 0 30 -61,-0.4 -84,-0.1 -83,-0.1 -1,-0.0 -0.911 79.3 76.2-162.1-171.9 21.2 64.3 28.1 709 355 B E S S- 0 0 2 -2,-0.3 -86,-0.7 -86,-0.1 2,-0.4 -0.042 79.2 -58.5 79.2 172.6 23.2 64.1 31.4 710 356 B F E -BD 622 687J 7 -23,-2.8 -23,-1.8 -88,-0.1 2,-0.5 -0.757 45.8-156.6 -89.5 135.2 23.5 66.6 34.3 711 357 B H E -BD 621 686J 0 -90,-2.5 -90,-3.5 -2,-0.4 2,-0.6 -0.946 5.0-158.3-120.2 116.1 24.8 70.1 33.5 712 358 B L E -BD 620 685J 0 -27,-2.0 -27,-1.1 -2,-0.5 -92,-0.2 -0.828 10.1-177.5-100.5 120.6 26.4 72.1 36.3 713 359 B L E -B 619 0J 26 -94,-2.5 -94,-3.7 -2,-0.6 -29,-0.1 -0.959 33.5-114.9-112.5 124.9 26.6 75.9 36.1 714 360 B P E -B 618 0J 49 0, 0.0 -96,-0.3 0, 0.0 2,-0.1 -0.249 26.9-116.3 -61.6 144.1 28.4 77.6 39.1 715 361 B K > - 0 0 71 -98,-2.6 3,-1.9 1,-0.1 2,-0.0 -0.435 47.9 -78.6 -75.1 156.4 26.5 79.9 41.4 716 362 B E T 3 S+ 0 0 177 1,-0.3 -1,-0.1 -2,-0.1 3,-0.1 -0.315 117.7 22.7 -62.8 135.4 27.5 83.5 41.5 717 363 B G T 3 S+ 0 0 27 1,-0.3 50,-3.5 49,-0.1 2,-0.5 0.305 92.6 126.2 93.8 -8.7 30.6 84.3 43.6 718 364 B V E < -I 766 0N 14 -3,-1.9 2,-0.4 48,-0.3 -1,-0.3 -0.730 38.0-173.7 -87.7 125.6 31.8 80.7 43.2 719 365 B R E +I 765 0N 147 46,-2.5 46,-2.2 -2,-0.5 2,-0.3 -0.986 11.3 172.2-120.4 129.8 35.3 80.3 41.9 720 366 B L E -I 764 0N 42 -2,-0.4 44,-0.3 44,-0.2 43,-0.1 -0.904 37.9-123.3-135.6 163.2 36.6 76.9 41.1 721 367 B D > - 0 0 75 42,-3.1 4,-2.5 -2,-0.3 3,-0.5 -0.872 24.6-164.5-109.7 96.7 39.6 75.0 39.5 722 368 B P H > S+ 0 0 37 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.848 82.7 55.2 -44.2 -54.0 38.0 72.8 36.8 723 369 B S H > S+ 0 0 92 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.887 116.6 35.6 -54.4 -46.2 41.0 70.5 36.2 724 370 B T H > S+ 0 0 35 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.800 113.7 56.3 -81.7 -30.1 41.2 69.5 39.9 725 371 B L H X S+ 0 0 1 -4,-2.5 4,-2.5 38,-0.2 5,-0.2 0.984 111.7 45.5 -62.5 -49.6 37.5 69.5 40.5 726 372 B V H X S+ 0 0 16 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.920 110.7 51.7 -56.9 -50.6 37.2 67.0 37.6 727 373 B Q H < S+ 0 0 97 -4,-1.9 4,-0.3 -5,-0.2 -1,-0.2 0.900 112.4 48.8 -54.1 -41.4 40.1 64.9 38.8 728 374 B W H >< S+ 0 0 18 -4,-2.2 3,-1.5 1,-0.2 6,-0.4 0.941 108.3 51.1 -63.3 -53.6 38.4 64.7 42.2 729 375 B L H 3< S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.837 114.3 44.2 -56.1 -37.8 34.9 63.8 41.0 730 376 B N T 3< S+ 0 0 36 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.439 91.3 125.6 -88.2 -0.5 36.3 60.9 38.9 731 377 B S S <> S- 0 0 26 -3,-1.5 4,-1.7 -4,-0.3 3,-0.3 -0.137 72.9-120.3 -62.2 156.4 38.6 59.7 41.7 732 378 B E H > S+ 0 0 106 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.744 115.6 57.6 -66.5 -21.4 38.7 56.2 43.1 733 379 B A H > S+ 0 0 52 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.869 103.9 49.9 -76.1 -39.3 37.8 57.7 46.5 734 380 B M H > S+ 0 0 0 -6,-0.4 4,-2.1 -3,-0.3 -2,-0.2 0.858 110.1 51.3 -68.8 -32.9 34.6 59.3 45.1 735 381 B Q H X S+ 0 0 25 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.916 109.3 48.4 -69.9 -44.1 33.5 56.0 43.6 736 382 B K H X S+ 0 0 116 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.872 110.5 54.3 -64.0 -34.5 33.9 54.0 46.8 737 383 B H H X S+ 0 0 7 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.960 112.4 40.7 -62.8 -54.2 32.0 56.8 48.6 738 384 B V H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.822 116.0 51.8 -64.4 -34.2 29.0 56.6 46.3 739 385 B R H X S+ 0 0 126 -4,-2.3 4,-1.3 2,-0.2 -1,-0.2 0.858 109.3 48.9 -70.7 -42.9 29.2 52.8 46.2 740 386 B T H < S+ 0 0 33 -4,-2.2 -141,-0.2 -5,-0.2 -2,-0.2 0.933 117.0 41.1 -62.5 -49.7 29.2 52.4 50.0 741 387 B L H < S+ 0 0 1 -4,-2.0 -142,-2.3 -5,-0.2 -2,-0.2 0.917 130.8 19.3 -67.4 -50.4 26.3 54.7 50.5 742 388 B Y H >< S+ 0 0 7 -4,-2.0 3,-2.3 1,-0.2 4,-0.4 0.416 76.7 179.2-108.3 1.8 23.9 53.7 47.7 743 389 B R T 3< S- 0 0 59 -4,-1.3 -1,-0.2 1,-0.3 3,-0.2 0.005 70.3 -36.6 34.5-127.4 25.0 50.3 46.6 744 390 B D T 3 S+ 0 0 52 1,-0.1 -188,-0.3 -52,-0.0 -1,-0.3 -0.101 94.3 126.6-114.4 32.4 22.7 49.1 43.9 745 391 B F S < S+ 0 0 7 -3,-2.3 -189,-0.3 -225,-0.1 -225,-0.2 0.943 82.5 17.5 -54.2 -51.9 19.4 50.5 45.2 746 392 B V S S- 0 0 5 -4,-0.4 -53,-0.1 -3,-0.2 -1,-0.1 -0.871 78.4-122.3-121.2 156.1 18.8 52.3 41.8 747 393 B P S S+ 0 0 83 0, 0.0 2,-0.3 0, 0.0 -54,-0.1 0.534 89.7 29.7 -75.0 -4.6 20.4 51.7 38.4 748 394 B H S S- 0 0 84 -56,-0.1 -55,-0.3 -57,-0.1 -58,-0.1 -0.999 90.1 -88.0-155.1 153.5 21.7 55.2 37.9 749 395 B L - 0 0 2 -57,-1.9 2,-0.3 -2,-0.3 -57,-0.1 -0.314 48.8-152.4 -58.6 135.3 23.1 58.3 39.8 750 396 B T >> - 0 0 21 1,-0.1 4,-2.6 -4,-0.0 3,-0.7 -0.774 26.4-105.7-113.2 162.7 20.2 60.5 40.8 751 397 B L H 3> S+ 0 0 64 -2,-0.3 4,-2.5 1,-0.3 5,-0.2 0.865 119.2 53.1 -49.7 -45.0 19.9 64.3 41.5 752 398 B R H 34 S+ 0 0 61 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.847 110.9 45.9 -62.5 -37.1 19.7 63.8 45.2 753 399 B M H X4 S+ 0 0 2 -3,-0.7 3,-0.9 2,-0.1 4,-0.2 0.925 113.2 51.2 -70.5 -44.7 22.9 61.7 45.3 754 400 B L H >< S+ 0 0 0 -4,-2.6 3,-1.9 1,-0.2 -140,-0.3 0.923 103.1 55.9 -59.1 -51.6 24.7 64.2 43.1 755 401 B E T 3< S+ 0 0 61 -4,-2.5 -140,-2.1 1,-0.3 -1,-0.2 0.596 106.6 51.3 -62.7 -10.5 23.9 67.4 45.0 756 402 B R T < S+ 0 0 91 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.367 75.1 123.4-105.6 -1.1 25.4 66.0 48.3 757 403 B L < - 0 0 3 -3,-1.9 -143,-3.0 -4,-0.2 2,-0.4 -0.457 67.9-118.0 -61.5 132.2 28.7 64.9 46.8 758 404 B P E -A 613 0I 3 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.645 18.5-153.2 -79.7 126.6 31.4 66.7 48.8 759 405 B V E -A 612 0I 0 -147,-3.4 -147,-2.3 -2,-0.4 2,-0.2 -0.903 27.1-122.2-100.1 112.4 33.7 69.1 47.0 760 406 B R >> - 0 0 79 -2,-0.7 3,-2.3 -149,-0.2 4,-0.5 -0.417 28.9-109.1 -59.3 123.5 37.0 69.2 48.9 761 407 B R T 34 S+ 0 0 136 -151,-0.5 3,-0.2 1,-0.3 -1,-0.1 0.554 110.2 56.2 -22.6 -44.7 37.7 72.8 50.0 762 408 B E T 34 S+ 0 0 124 1,-0.2 -1,-0.3 -38,-0.0 3,-0.1 0.394 99.3 60.4 -84.1 6.8 40.6 73.7 47.7 763 409 B Y T <4 S- 0 0 32 -3,-2.3 -42,-3.1 1,-0.4 2,-0.3 0.789 119.1 -3.1 -98.4 -35.3 38.8 72.9 44.4 764 410 B G E < +I 720 0N 1 -4,-0.5 -1,-0.4 -44,-0.3 2,-0.3 -0.956 63.6 172.5-160.7 140.2 36.0 75.4 44.6 765 411 B F E -I 719 0N 83 -46,-2.2 -46,-2.5 -2,-0.3 2,-0.6 -0.977 33.3-111.1-148.1 157.4 34.7 78.0 47.1 766 412 B H E I 718 0N 118 -2,-0.3 -48,-0.3 -48,-0.2 -49,-0.1 -0.818 360.0 360.0 -96.0 124.2 32.1 80.7 47.4 767 413 B T 0 0 107 -50,-3.5 -2,-0.0 -2,-0.6 0, 0.0 -0.937 360.0 360.0-109.6 360.0 33.6 84.3 47.6 768 !* 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 0.0 769 500 A X 0 0 160 0, 0.0 -681,-2.1 0, 0.0 -767,-0.1 0.000 360.0 360.0 360.0 360.0 35.4 38.1 15.2 770 !* 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 0.0 771 500 B X 0 0 153 0, 0.0 -299,-1.1 0, 0.0 -385,-0.1 0.000 360.0 360.0 360.0 360.0 6.1 39.9 42.1