==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 30-DEC-09 3L8B . COMPND 2 MOLECULE: DNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE RB69; . AUTHOR P.ALLER,Y.YE,S.S.WALLACE,C.J.BURROWS,S.DOUBLIE . 1792 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 81449.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1270 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 233 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 0.7 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 . 2 0.1 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 . 145 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 163 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 619 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 2.2 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 5 4 0 3 4 8 1 2 2 4 8 4 2 0 0 0 0 0 1 0 0 0 0 1 0 2 4 RESIDUES PER ALPHA HELIX . 1 4 2 0 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 PARALLEL BRIDGES PER LADDER . 8 7 5 8 8 6 4 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 . 6 10 0 0 2 0 0 2 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 1 A M 0 0 106 0, 0.0 2,-0.3 0, 0.0 23,-0.2 0.000 360.0 360.0 360.0 173.9 -5.5 4.4 68.7 2 2 A K - 0 0 107 1,-0.1 2,-0.1 21,-0.1 18,-0.0 -0.534 360.0-123.1 -71.3 132.0 -3.8 1.1 67.8 3 3 A E + 0 0 49 -2,-0.3 2,-0.3 100,-0.1 99,-0.2 -0.441 33.8 177.2 -76.8 148.5 -2.6 -0.8 70.8 4 4 A F E -A 20 0A 0 16,-1.5 16,-3.0 -2,-0.1 2,-0.1 -0.994 26.3-111.0-151.1 148.6 1.1 -1.7 71.2 5 5 A Y E -A 19 0A 0 -2,-0.3 14,-0.3 14,-0.2 3,-0.1 -0.338 15.7-170.8 -77.7 161.5 3.2 -3.4 73.8 6 6 A L E S- 0 0 1 12,-3.3 343,-0.4 1,-0.5 2,-0.3 0.695 72.0 -8.5-113.0 -55.3 5.9 -1.8 76.0 7 7 A T E -A 18 0A 2 11,-1.6 11,-2.0 341,-0.1 -1,-0.5 -0.964 57.9-162.5-143.7 158.9 7.5 -4.8 77.6 8 8 A V E +A 17 0A 1 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.992 9.5 175.8-147.4 137.1 7.0 -8.6 77.8 9 9 A E E -A 16 0A 16 7,-1.9 7,-2.2 -2,-0.3 2,-0.5 -0.951 23.3-139.8-137.6 156.7 8.3 -11.2 80.2 10 10 A Q E +A 15 0A 68 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.975 23.3 173.2-119.1 114.3 7.8 -14.9 80.7 11 11 A I E > -A 14 0A 36 3,-3.0 3,-1.4 -2,-0.5 2,-0.2 -0.888 62.8 -54.8-124.8 99.7 7.7 -15.9 84.4 12 12 A G T 3 S- 0 0 52 -2,-0.5 53,-0.1 1,-0.2 -1,-0.0 -0.499 119.9 -15.9 70.7-136.1 6.7 -19.6 84.8 13 13 A D T 3 S+ 0 0 59 -2,-0.2 2,-0.4 52,-0.1 -1,-0.2 0.318 125.7 82.0 -84.3 9.5 3.5 -20.4 83.0 14 14 A S E < -A 11 0A 11 -3,-1.4 -3,-3.0 18,-0.2 2,-0.5 -0.887 64.3-147.2-123.1 149.7 2.6 -16.8 82.8 15 15 A I E -AB 10 31A 0 16,-2.7 16,-2.9 -2,-0.4 2,-0.6 -0.942 13.3-154.5-110.4 128.0 3.4 -13.9 80.5 16 16 A F E -AB 9 30A 28 -7,-2.2 -7,-1.9 -2,-0.5 2,-0.4 -0.915 18.1-179.7-105.4 118.2 3.6 -10.4 82.0 17 17 A E E -AB 8 29A 0 12,-2.5 12,-1.7 -2,-0.6 2,-0.5 -0.965 19.7-164.9-124.6 135.2 3.0 -7.6 79.6 18 18 A R E +AB 7 28A 2 -11,-2.0 -12,-3.3 -2,-0.4 -11,-1.6 -0.944 32.7 155.8-109.8 133.8 2.9 -3.8 80.0 19 19 A Y E -AB 5 27A 29 8,-2.4 8,-3.3 -2,-0.5 2,-0.6 -0.935 46.2-106.1-152.3 173.2 1.2 -2.1 77.0 20 20 A I E -AB 4 26A 2 -16,-3.0 -16,-1.5 -2,-0.3 6,-0.2 -0.945 39.7-149.8-108.7 117.3 -0.6 1.0 75.8 21 21 A D > - 0 0 16 4,-2.5 3,-2.6 -2,-0.6 -17,-0.0 -0.089 36.5 -80.8 -78.9-179.1 -4.3 0.4 75.2 22 22 A S T 3 S+ 0 0 58 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 0.838 130.6 52.7 -47.2 -43.8 -6.8 1.9 72.7 23 23 A N T 3 S- 0 0 109 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.492 119.9-109.8 -75.1 -4.4 -7.2 5.0 74.9 24 24 A G S < S+ 0 0 7 -3,-2.6 2,-0.4 1,-0.3 -2,-0.2 0.719 74.1 137.7 82.7 20.2 -3.5 5.4 75.0 25 25 A R - 0 0 129 -4,-0.0 -4,-2.5 1,-0.0 -1,-0.3 -0.847 58.0-115.3-104.5 137.3 -3.2 4.5 78.6 26 26 A E E +B 20 0A 63 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.510 42.8 174.4 -69.6 130.2 -0.5 2.2 80.0 27 27 A R E -B 19 0A 100 -8,-3.3 -8,-2.4 -2,-0.3 2,-0.3 -0.828 19.3-147.4-132.0 169.9 -1.8 -1.1 81.3 28 28 A T E +B 18 0A 80 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.973 16.6 172.6-138.7 151.9 -0.5 -4.3 82.7 29 29 A R E -B 17 0A 75 -12,-1.7 -12,-2.5 -2,-0.3 2,-0.5 -0.977 26.1-139.8-162.2 147.8 -1.7 -7.9 82.6 30 30 A E E -B 16 0A 120 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.949 27.2-166.6-110.0 121.4 -0.7 -11.4 83.4 31 31 A V E -B 15 0A 45 -16,-2.9 -16,-2.7 -2,-0.5 2,-1.9 -0.930 27.0-141.4-118.4 136.5 -1.6 -14.1 80.8 32 32 A E - 0 0 126 -2,-0.4 -18,-0.2 -18,-0.2 -19,-0.0 -0.523 38.4-156.6 -87.0 67.3 -1.7 -17.9 81.1 33 33 A Y - 0 0 19 -2,-1.9 32,-0.3 -20,-0.1 59,-0.0 -0.204 11.3-153.2 -53.2 128.0 -0.4 -18.1 77.5 34 34 A K - 0 0 119 30,-0.1 29,-0.1 31,-0.1 30,-0.1 -0.868 21.2-161.7-106.2 98.0 -1.2 -21.4 75.7 35 35 A P - 0 0 1 0, 0.0 27,-2.8 0, 0.0 2,-0.4 -0.295 6.1-143.0 -78.5 162.0 1.6 -21.8 73.1 36 36 A S E +C 61 0B 27 25,-0.2 2,-0.3 49,-0.1 49,-0.2 -0.958 16.9 177.2-126.6 145.4 1.6 -24.0 70.0 37 37 A L E -C 60 0B 2 23,-2.0 23,-3.3 -2,-0.4 2,-0.3 -0.821 19.9-130.5-134.3 173.0 4.5 -26.0 68.5 38 38 A F E -CD 59 83B 28 45,-2.7 45,-2.3 -2,-0.3 2,-0.3 -0.920 15.4-170.9-135.1 158.8 4.4 -28.3 65.5 39 39 A A E -C 58 0B 8 19,-1.6 19,-2.8 -2,-0.3 43,-0.1 -0.982 39.5 -93.4-142.4 148.3 5.6 -31.8 64.4 40 40 A H E -C 57 0B 83 41,-0.4 17,-0.3 -2,-0.3 10,-0.0 -0.331 43.7-166.8 -62.0 145.0 5.6 -33.4 61.0 41 41 A C - 0 0 16 15,-1.7 -1,-0.0 4,-0.1 0, 0.0 -0.894 31.0 -81.6-130.1 160.2 2.5 -35.5 60.2 42 42 A P > - 0 0 69 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.250 38.8-117.6 -61.3 152.6 1.8 -38.0 57.5 43 43 A E T 3 S+ 0 0 141 1,-0.3 14,-0.1 3,-0.0 -2,-0.0 0.896 111.1 68.9 -56.4 -42.5 0.8 -36.6 54.1 44 44 A S T 3 S+ 0 0 109 2,-0.1 2,-0.6 1,-0.0 -1,-0.3 0.779 84.0 84.8 -47.6 -33.3 -2.6 -38.3 54.4 45 45 A Q S < S- 0 0 96 -3,-1.3 2,-0.3 11,-0.0 -4,-0.1 -0.651 77.6-141.9 -80.0 118.0 -3.5 -35.9 57.2 46 46 A A + 0 0 100 -2,-0.6 2,-0.3 10,-0.0 -2,-0.1 -0.620 35.6 147.5 -82.3 133.9 -4.8 -32.6 55.8 47 47 A T - 0 0 47 -2,-0.3 11,-0.1 11,-0.1 0, 0.0 -0.914 51.3-126.3-151.5 173.3 -3.7 -29.4 57.6 48 48 A K S S+ 0 0 116 -2,-0.3 2,-0.5 9,-0.1 10,-0.1 0.531 82.4 92.9-104.0 -8.3 -3.0 -25.9 56.7 49 49 A Y + 0 0 37 8,-0.5 8,-2.7 323,-0.1 2,-0.3 -0.742 47.1 169.9 -93.8 129.0 0.4 -25.8 58.2 50 50 A F E -Ef 56 372C 78 321,-1.0 323,-2.2 -2,-0.5 -10,-0.0 -0.986 29.0-126.3-133.5 142.7 3.6 -26.6 56.2 51 51 A D E > - f 0 373C 5 4,-2.7 3,-2.1 -2,-0.3 323,-0.2 -0.234 45.0 -89.6 -78.3 177.5 7.2 -26.2 57.1 52 52 A I T 3 S+ 0 0 10 321,-0.9 412,-0.1 1,-0.3 -1,-0.1 0.677 127.2 59.2 -65.3 -13.8 9.5 -24.2 54.8 53 53 A Y T 3 S- 0 0 117 2,-0.1 -1,-0.3 370,-0.0 -2,-0.0 0.402 121.4-104.7 -92.5 2.1 10.3 -27.4 52.8 54 54 A G S < S+ 0 0 43 -3,-2.1 -2,-0.1 1,-0.3 318,-0.0 0.564 73.9 141.8 88.0 9.5 6.7 -27.9 52.0 55 55 A K - 0 0 108 1,-0.1 -4,-2.7 -15,-0.0 -1,-0.3 -0.677 54.1-110.9 -88.9 139.7 6.1 -30.8 54.4 56 56 A P B -E 50 0C 5 0, 0.0 -15,-1.7 0, 0.0 2,-0.3 -0.356 34.4-166.6 -68.1 143.3 2.8 -31.0 56.3 57 57 A C E -C 40 0B 0 -8,-2.7 -8,-0.5 -17,-0.3 2,-0.4 -0.961 15.4-137.8-132.0 150.3 2.8 -30.3 60.0 58 58 A T E -C 39 0B 39 -19,-2.8 -19,-1.6 -2,-0.3 2,-0.3 -0.887 26.6-121.9-107.3 136.5 0.2 -30.9 62.8 59 59 A R E -C 38 0B 121 -2,-0.4 2,-0.6 -21,-0.2 -21,-0.2 -0.594 17.2-156.6 -80.3 136.4 -0.3 -28.2 65.4 60 60 A K E -C 37 0B 74 -23,-3.3 -23,-2.0 -2,-0.3 2,-0.5 -0.940 7.4-162.4-115.9 106.9 0.3 -29.0 69.1 61 61 A L E -C 36 0B 88 -2,-0.6 2,-0.3 -25,-0.2 -25,-0.2 -0.780 11.8-154.6 -91.3 127.6 -1.6 -26.7 71.4 62 62 A F - 0 0 21 -27,-2.8 3,-0.1 -2,-0.5 4,-0.0 -0.775 22.6-134.2-107.7 151.8 -0.3 -26.8 75.0 63 63 A A S S- 0 0 58 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.871 89.3 -5.6 -64.8 -40.1 -2.0 -26.0 78.3 64 64 A N S > S- 0 0 31 -30,-0.1 4,-1.4 -29,-0.1 -1,-0.1 -0.943 73.9-100.7-150.2 170.1 1.0 -23.9 79.5 65 65 A M H > S+ 0 0 1 -32,-0.3 4,-2.3 -2,-0.3 5,-0.2 0.802 117.4 60.9 -66.6 -27.7 4.5 -22.9 78.4 66 66 A R H > S+ 0 0 146 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.945 103.6 49.1 -62.2 -50.8 6.0 -25.5 80.8 67 67 A D H > S+ 0 0 68 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.854 110.5 52.0 -57.1 -38.4 4.3 -28.4 79.0 68 68 A A H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.940 110.0 47.4 -66.2 -47.6 5.6 -27.0 75.7 69 69 A S H X S+ 0 0 47 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.940 112.6 49.4 -58.2 -49.3 9.2 -26.8 76.9 70 70 A Q H X S+ 0 0 61 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.856 107.9 54.9 -59.0 -37.3 9.0 -30.3 78.3 71 71 A W H X S+ 0 0 22 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.921 104.6 53.6 -63.4 -43.3 7.6 -31.6 75.0 72 72 A I H X S+ 0 0 25 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.919 108.2 49.9 -57.2 -44.6 10.5 -30.1 73.1 73 73 A K H X S+ 0 0 108 -4,-1.9 4,-3.1 1,-0.2 -1,-0.2 0.905 110.2 50.1 -62.8 -40.8 13.0 -32.0 75.4 74 74 A R H X S+ 0 0 129 -4,-2.0 4,-2.9 2,-0.2 -1,-0.2 0.889 110.5 49.9 -65.4 -37.1 11.1 -35.3 74.8 75 75 A M H X>S+ 0 0 18 -4,-2.5 5,-2.5 2,-0.2 4,-2.3 0.877 112.6 46.9 -67.7 -36.3 11.1 -34.7 71.1 76 76 A E H <5S+ 0 0 112 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.914 112.0 51.8 -68.6 -41.4 14.9 -34.1 71.3 77 77 A D H <5S+ 0 0 132 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.916 115.4 40.6 -58.6 -46.2 15.1 -37.2 73.5 78 78 A I H <5S- 0 0 122 -4,-2.9 -1,-0.2 -5,-0.1 -2,-0.2 0.806 114.7-120.3 -73.5 -30.5 13.2 -39.2 70.8 79 79 A G T <5 + 0 0 59 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.828 65.6 127.1 94.2 36.1 15.1 -37.5 68.0 80 80 A L < - 0 0 103 -5,-2.5 -1,-0.3 -6,-0.1 -2,-0.1 -0.939 65.2 -96.1-124.1 148.1 12.4 -35.8 66.0 81 81 A E - 0 0 28 -2,-0.3 2,-0.7 1,-0.1 -41,-0.4 -0.373 28.2-157.1 -65.7 135.0 12.2 -32.2 64.9 82 82 A A - 0 0 7 -43,-0.1 -43,-0.2 -2,-0.1 295,-0.2 -0.931 21.2-162.0-113.5 102.6 10.1 -30.0 67.1 83 83 A L B +D 38 0B 1 -45,-2.3 -45,-2.7 -2,-0.7 2,-0.1 -0.358 35.8 55.5 -87.5 165.9 9.0 -27.0 64.9 84 84 A G S S- 0 0 5 290,-2.1 2,-0.8 -47,-0.2 -47,-0.1 -0.338 93.2 -36.8 107.5 173.0 7.6 -23.6 65.7 85 85 A M - 0 0 6 -49,-0.2 -49,-0.1 1,-0.2 6,-0.1 -0.574 47.4-175.9 -75.3 106.9 8.6 -20.5 67.8 86 86 A D + 0 0 77 -2,-0.8 2,-1.1 1,-0.1 -1,-0.2 0.641 68.2 81.4 -78.6 -14.9 10.3 -21.9 70.9 87 87 A D > - 0 0 27 1,-0.2 4,-1.6 -3,-0.1 3,-0.5 -0.801 67.6-168.0 -91.5 99.3 10.7 -18.4 72.4 88 88 A F H > S+ 0 0 4 -2,-1.1 4,-3.1 1,-0.2 5,-0.2 0.797 80.2 62.3 -61.1 -31.5 7.1 -18.0 73.7 89 89 A K H > S+ 0 0 41 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.935 106.9 46.5 -59.1 -44.7 7.4 -14.3 74.4 90 90 A L H > S+ 0 0 4 -3,-0.5 4,-2.4 2,-0.2 -1,-0.2 0.884 112.9 48.4 -63.1 -41.9 7.9 -13.8 70.7 91 91 A A H X S+ 0 0 11 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.902 110.9 51.9 -65.7 -40.6 5.0 -16.1 69.8 92 92 A Y H X S+ 0 0 8 -4,-3.1 4,-2.6 2,-0.2 5,-0.2 0.949 110.3 47.7 -60.6 -48.6 2.9 -14.2 72.4 93 93 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.925 111.0 52.0 -58.3 -45.2 3.8 -10.9 70.8 94 94 A S H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.877 112.9 44.0 -59.3 -41.2 3.0 -12.2 67.3 95 95 A D H >< S+ 0 0 87 -4,-2.3 3,-0.6 1,-0.2 -1,-0.2 0.887 117.3 45.2 -71.6 -39.6 -0.4 -13.5 68.4 96 96 A T H 3< S+ 0 0 46 -4,-2.6 2,-0.2 1,-0.2 -2,-0.2 0.794 121.9 35.2 -75.5 -32.8 -1.3 -10.3 70.3 97 97 A Y T 3< + 0 0 3 -4,-2.7 2,-2.5 -5,-0.2 -1,-0.2 -0.522 68.4 166.7-122.7 65.2 -0.1 -7.8 67.7 98 98 A N < + 0 0 82 -3,-0.6 2,-0.3 -2,-0.2 -4,-0.1 -0.327 59.1 57.7 -77.6 57.7 -1.0 -9.6 64.4 99 99 A Y S S- 0 0 66 -2,-2.5 2,-0.5 -5,-0.0 -2,-0.0 -0.964 103.6 -64.5-170.0 171.0 -0.4 -6.5 62.4 100 100 A E - 0 0 121 -2,-0.3 2,-0.3 1,-0.1 244,-0.1 -0.578 60.4-121.7 -71.6 120.4 2.2 -3.8 61.6 101 101 A I - 0 0 16 -2,-0.5 2,-0.6 242,-0.4 -97,-0.1 -0.464 25.2-168.8 -71.5 127.7 2.9 -2.0 64.9 102 102 A K - 0 0 120 -2,-0.3 2,-0.3 -99,-0.2 -100,-0.1 -0.969 17.4-171.0-114.0 111.8 2.3 1.7 64.9 103 103 A Y - 0 0 59 -2,-0.6 2,-0.6 237,-0.0 3,-0.1 -0.771 23.1-146.5-110.8 156.2 3.7 3.1 68.1 104 104 A D > - 0 0 49 -2,-0.3 3,-2.3 1,-0.1 4,-0.3 -0.910 7.2-164.8-119.0 99.2 3.5 6.5 69.8 105 105 A H G > S+ 0 0 100 -2,-0.6 3,-1.9 1,-0.3 -1,-0.1 0.782 83.9 72.3 -55.4 -29.7 6.8 7.3 71.6 106 106 A T G 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.685 98.6 50.5 -61.1 -15.2 5.2 10.1 73.6 107 107 A K G < S+ 0 0 70 -3,-2.3 2,-0.6 2,-0.1 -1,-0.3 0.475 91.0 90.9 -98.8 -7.1 3.4 7.4 75.5 108 108 A I S < S- 0 0 0 -3,-1.9 2,-1.0 -4,-0.3 33,-0.0 -0.829 76.7-134.3 -94.5 121.2 6.5 5.3 76.3 109 109 A R - 0 0 41 -2,-0.6 102,-3.0 100,-0.2 103,-1.8 -0.651 24.2-172.7 -79.6 102.8 8.2 6.3 79.6 110 110 A V E -g 212 0D 25 -2,-1.0 31,-1.9 101,-0.2 2,-0.5 -0.878 6.8-161.2 -99.4 119.7 11.9 6.6 78.8 111 111 A A E -gH 213 140D 0 101,-3.2 103,-3.4 -2,-0.6 2,-0.5 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4,-2.7 1,-0.2 5,-0.3 0.902 105.9 53.4 -60.0 -38.3 14.5 1.0 52.9 477 483 A K H X S+ 0 0 66 -4,-1.3 4,-1.6 1,-0.2 -1,-0.2 0.921 109.7 48.4 -60.2 -45.6 14.1 2.6 49.5 478 484 A E H X S+ 0 0 92 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.930 114.9 42.4 -60.3 -51.9 10.6 3.7 50.3 479 485 A H H X S+ 0 0 38 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.883 112.1 52.5 -67.3 -39.1 11.4 5.2 53.7 480 486 A K H X S+ 0 0 90 -4,-2.7 4,-2.0 -5,-0.3 -1,-0.2 0.866 110.6 51.7 -64.3 -31.7 14.6 6.9 52.4 481 487 A G H X S+ 0 0 32 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.889 108.5 49.0 -69.4 -39.7 12.3 8.3 49.7 482 488 A Y H X S+ 0 0 42 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.908 109.2 54.4 -65.4 -41.4 9.8 9.6 52.3 483 489 A M H X S+ 0 0 18 -4,-2.8 4,-1.9 63,-0.2 -2,-0.2 0.936 110.9 43.9 -56.7 -49.8 12.6 11.2 54.2 484 490 A L H X S+ 0 0 61 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.900 114.2 48.7 -64.7 -44.1 13.9 13.1 51.2 485 491 A A H X S+ 0 0 2 -4,-2.3 4,-3.8 28,-0.3 5,-0.3 0.939 111.2 50.1 -61.7 -47.0 10.4 14.2 50.1 486 492 A A H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.888 110.3 52.3 -57.9 -38.4 9.5 15.4 53.6 487 493 A Q H X S+ 0 0 84 -4,-1.9 4,-1.3 -5,-0.3 -1,-0.2 0.946 113.6 41.5 -62.5 -50.0 12.8 17.3 53.6 488 494 A R H >X S+ 0 0 112 -4,-2.6 4,-1.6 1,-0.2 3,-0.6 0.921 112.4 54.3 -64.8 -44.7 12.0 19.0 50.3 489 495 A N H 3X S+ 0 0 0 -4,-3.8 4,-1.8 1,-0.3 -1,-0.2 0.853 104.7 57.6 -57.8 -31.6 8.4 19.6 51.4 490 496 A G H 3X S+ 0 0 9 -4,-1.8 4,-1.5 -5,-0.3 -1,-0.3 0.873 102.6 52.2 -66.4 -37.2 9.9 21.2 54.4 491 497 A E H < S+ 0 0 127 -4,-2.7 3,-0.8 1,-0.2 4,-0.3 0.887 111.9 47.0 -58.9 -39.3 10.0 29.3 51.5 496 502 A A H >< S+ 0 0 16 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.796 96.1 70.8 -74.0 -31.7 6.3 30.2 52.2 497 503 A L T 3< S+ 0 0 40 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.528 79.6 83.3 -65.2 -3.6 6.9 31.3 55.8 498 504 A H T < S+ 0 0 144 -3,-0.8 -1,-0.2 -4,-0.3 -2,-0.1 0.961 111.2 8.5 -64.0 -53.6 8.7 34.4 54.4 499 505 A N S < S- 0 0 125 -3,-0.8 -1,-0.2 -4,-0.3 2,-0.1 -0.612 83.8-168.9-130.0 72.5 5.5 36.4 53.8 500 506 A P - 0 0 42 0, 0.0 28,-0.2 0, 0.0 29,-0.1 -0.388 26.0-114.0 -65.9 134.2 2.6 34.5 55.4 501 507 A N B -x 528 0I 76 26,-1.4 2,-1.0 24,-0.2 28,-0.6 -0.190 21.0-119.6 -60.4 157.9 -0.9 35.7 54.5 502 508 A L + 0 0 181 26,-0.1 2,-0.2 27,-0.1 -1,-0.1 -0.587 66.4 139.6-100.0 69.1 -2.9 37.2 57.3 503 509 A S - 0 0 46 -2,-1.0 2,-0.7 23,-0.1 26,-0.1 -0.685 59.2-123.6-114.0 165.3 -5.6 34.6 56.9 504 510 A V + 0 0 155 -2,-0.2 2,-0.3 24,-0.1 -2,-0.1 -0.938 63.4 114.3-106.9 108.7 -7.9 32.5 59.1 505 511 A D - 0 0 51 -2,-0.7 3,-0.0 3,-0.0 25,-0.0 -0.893 54.5-108.9-158.7-173.9 -7.3 28.9 58.1 506 512 A E - 0 0 156 -2,-0.3 25,-0.1 25,-0.0 22,-0.1 -0.832 45.2 -77.4-128.0 166.2 -5.9 25.5 59.2 507 513 A P - 0 0 38 0, 0.0 2,-0.2 0, 0.0 25,-0.1 -0.407 56.6-108.2 -62.3 136.2 -2.9 23.4 58.4 508 514 A L - 0 0 39 1,-0.1 2,-1.8 -2,-0.1 12,-0.0 -0.508 26.4-126.3 -68.7 129.6 -3.4 21.6 55.1 509 515 A D + 0 0 156 -2,-0.2 2,-0.2 -3,-0.1 -1,-0.1 -0.540 55.7 145.7 -80.4 80.9 -4.1 17.9 55.7 510 516 A V - 0 0 28 -2,-1.8 2,-0.8 10,-0.0 6,-0.0 -0.650 56.6-108.4-115.2 170.2 -1.4 16.5 53.4 511 517 A D > - 0 0 68 -2,-0.2 3,-1.4 1,-0.1 -2,-0.0 -0.875 24.1-163.1 -98.4 109.5 0.9 13.5 53.3 512 518 A Y T 3 S+ 0 0 15 -2,-0.8 -23,-0.2 1,-0.3 -1,-0.1 0.547 79.4 77.6 -71.6 -4.4 4.4 14.8 53.9 513 519 A R T 3 S+ 0 0 97 -28,-0.1 2,-0.4 -27,-0.1 -28,-0.3 0.543 91.9 59.7 -80.9 -6.3 6.0 11.6 52.6 514 520 A F S < S- 0 0 96 -3,-1.4 3,-0.1 -29,-0.2 -3,-0.1 -0.965 96.8 -97.5-128.5 141.5 5.3 12.8 49.0 515 521 A D - 0 0 83 -2,-0.4 -29,-0.1 1,-0.1 -2,-0.1 -0.305 51.0-103.9 -56.7 126.7 6.5 15.8 47.1 516 522 A F - 0 0 13 -31,-0.2 -1,-0.1 -4,-0.1 -4,-0.0 -0.239 32.4-128.3 -56.2 135.9 3.9 18.5 47.1 517 523 A S > - 0 0 27 -3,-0.1 4,-2.0 1,-0.1 5,-0.1 -0.223 28.0-103.9 -74.7 172.8 1.9 18.9 43.9 518 524 A D H > S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.804 122.0 58.9 -71.6 -25.4 1.5 22.3 42.3 519 525 A E H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.933 109.5 42.9 -65.7 -46.0 -2.0 22.5 43.6 520 526 A I H > S+ 0 0 34 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.860 110.5 55.9 -68.1 -38.1 -0.8 22.1 47.2 521 527 A K H X S+ 0 0 84 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.942 108.7 48.4 -60.1 -45.9 2.1 24.5 46.6 522 528 A E H >X S+ 0 0 47 -4,-2.1 3,-0.6 1,-0.2 4,-0.5 0.942 111.6 48.4 -59.3 -50.0 -0.4 27.2 45.5 523 529 A K H >X S+ 0 0 102 -4,-2.1 3,-1.4 1,-0.2 4,-0.6 0.890 108.2 55.6 -58.1 -40.4 -2.6 26.6 48.5 524 530 A I H >< S+ 0 0 1 -4,-2.5 3,-0.8 1,-0.3 -1,-0.2 0.816 97.1 63.4 -62.6 -32.2 0.4 26.8 50.9 525 531 A K H << S+ 0 0 151 -4,-1.5 -1,-0.3 -3,-0.6 -24,-0.2 0.699 105.7 47.5 -65.8 -17.7 1.3 30.2 49.5 526 532 A K H << S+ 0 0 142 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.557 89.6 107.8-100.2 -11.0 -2.0 31.5 50.9 527 533 A L << - 0 0 13 -3,-0.8 -26,-1.4 -4,-0.6 2,-0.1 -0.161 68.2-110.4 -68.8 162.5 -1.8 30.0 54.4 528 534 A S B > -x 501 0I 11 -28,-0.2 4,-2.7 -26,-0.1 5,-0.2 -0.411 28.7-105.2 -87.8 166.5 -1.2 31.9 57.6 529 535 A A H > S+ 0 0 37 -28,-0.6 4,-2.5 1,-0.2 5,-0.2 0.899 119.2 52.6 -57.9 -44.7 1.9 31.8 59.8 530 536 A K H > S+ 0 0 159 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.913 113.1 43.4 -59.9 -45.1 0.2 29.7 62.5 531 537 A S H > S+ 0 0 2 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.946 114.3 49.2 -66.8 -48.8 -0.9 27.1 59.9 532 538 A L H X S+ 0 0 1 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.894 108.9 52.1 -58.5 -44.3 2.4 27.0 58.1 533 539 A N H X S+ 0 0 84 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.880 108.6 51.6 -61.6 -37.3 4.5 26.6 61.2 534 540 A E H X S+ 0 0 67 -4,-1.4 4,-1.2 -5,-0.2 -1,-0.2 0.817 110.9 49.2 -67.9 -29.8 2.3 23.7 62.3 535 541 A M H X S+ 0 0 0 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.892 107.9 51.9 -75.0 -41.5 2.9 22.1 58.8 536 542 A L H X S+ 0 0 34 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.905 108.2 53.1 -60.8 -41.0 6.7 22.6 59.0 537 543 A F H X S+ 0 0 129 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.891 112.5 44.5 -60.1 -40.1 6.6 20.8 62.4 538 544 A R H X S+ 0 0 91 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.862 110.4 54.1 -72.6 -37.6 4.7 17.9 60.8 539 545 A A H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.921 112.1 44.7 -62.6 -44.6 7.0 17.9 57.7 540 546 A Q H X S+ 0 0 96 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.898 108.5 54.7 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2,-0.1 -0.209 34.5-122.2 -56.2 145.6 28.6 21.3 21.7 1415 523 B S > - 0 0 64 1,-0.1 4,-2.4 -3,-0.1 5,-0.2 -0.323 26.6-103.2 -83.1 171.1 30.6 21.8 24.9 1416 524 B D H > S+ 0 0 144 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.851 125.0 55.9 -64.0 -31.2 30.8 25.1 26.8 1417 525 B E H > S+ 0 0 57 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.891 108.6 45.9 -66.7 -40.4 34.3 25.4 25.3 1418 526 B I H > S+ 0 0 35 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.897 107.8 56.5 -69.4 -41.6 32.9 25.0 21.8 1419 527 B K H X S+ 0 0 22 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.802 107.3 51.1 -60.6 -29.8 30.1 27.5 22.4 1420 528 B E H >X S+ 0 0 103 -4,-1.2 3,-1.0 2,-0.2 4,-0.7 0.951 110.2 45.8 -72.9 -51.2 32.7 30.1 23.4 1421 529 B K H >X S+ 0 0 25 -4,-1.7 3,-1.4 1,-0.3 4,-0.6 0.882 106.3 60.7 -59.1 -40.2 34.9 29.7 20.3 1422 530 B I H >< S+ 0 0 1 -4,-2.4 3,-0.5 1,-0.3 -1,-0.3 0.774 98.3 58.9 -59.6 -26.6 31.8 29.8 18.0 1423 531 B K H << S+ 0 0 128 -3,-1.0 -24,-0.3 -4,-0.6 -1,-0.3 0.752 105.4 49.4 -74.1 -23.6 31.0 33.3 19.3 1424 532 B K H << S+ 0 0 132 -3,-1.4 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17.2 16.3 1786 894 B K - 0 0 124 1,-0.1 -1,-0.1 2,-0.1 5,-0.1 -0.391 14.6-120.7 -75.9 158.8 -37.2 14.8 17.3 1787 895 B A S S+ 0 0 113 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.956 86.7 8.4 -66.2 -51.7 -40.7 16.1 17.6 1788 896 B S S S- 0 0 71 2,-0.1 -1,-0.1 1,-0.1 -2,-0.1 -0.835 73.8-107.9-131.0 167.6 -41.2 15.1 21.3 1789 897 B L S S+ 0 0 152 -2,-0.3 2,-3.6 1,-0.2 -1,-0.1 0.805 103.2 86.3 -61.0 -30.9 -39.3 13.9 24.3 1790 898 B F + 0 0 149 1,-0.2 5,-0.3 4,-0.0 -1,-0.2 -0.265 51.9 135.5 -71.1 59.3 -41.1 10.6 23.9 1791 899 B D + 0 0 75 -2,-3.6 -1,-0.2 4,-0.1 2,-0.1 -0.333 31.6 115.7-103.1 45.6 -38.4 9.5 21.4 1792 900 B M S > S- 0 0 122 -2,-0.1 2,-1.2 1,-0.0 3,-0.8 -0.358 88.0 -78.8 -99.1-174.0 -38.0 6.0 22.8 1793 901 B F T 3 S- 0 0 201 1,-0.3 -2,-0.1 -2,-0.1 -1,-0.0 -0.791 124.0 -9.6 -89.5 98.5 -38.7 2.9 20.9 1794 902 B D T 3 0 0 166 -2,-1.2 -1,-0.3 1,-0.2 -3,-0.1 0.868 360.0 360.0 76.2 40.1 -42.5 3.0 21.4 1795 903 B F < 0 0 69 -3,-0.8 -1,-0.2 -5,-0.3 -4,-0.1 0.413 360.0 360.0 33.0 360.0 -42.1 5.8 23.9