==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 23-DEC-08 3FN8 . COMPND 2 MOLECULE: ALKYLMERCURY LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.MOMANY,A.SUMMERS,C.CAGLE,J.TESKE . 418 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18369.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 304 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 20.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 32 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 30.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.4 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 0 0 0 3 0 3 5 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 5 6 2 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 0 138 0, 0.0 2,-0.4 0, 0.0 184,-0.0 0.000 360.0 360.0 360.0 165.5 31.1 55.8 54.1 2 2 A K + 0 0 135 1,-0.1 4,-0.1 2,-0.0 0, 0.0 -0.630 360.0 169.9 -72.8 125.2 28.6 53.6 55.8 3 3 A L > + 0 0 28 -2,-0.4 4,-2.6 2,-0.1 3,-0.4 0.491 52.9 92.9-117.5 -8.3 28.8 50.1 54.3 4 4 A A H > S+ 0 0 67 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.864 83.5 56.6 -51.8 -43.6 26.6 48.2 56.8 5 5 A P H > S+ 0 0 43 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.908 110.7 44.4 -56.3 -41.2 23.5 48.7 54.6 6 6 A Y H > S+ 0 0 6 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.928 115.0 47.4 -67.8 -46.8 25.3 47.0 51.7 7 7 A I H X S+ 0 0 18 -4,-2.6 4,-2.0 1,-0.2 5,-0.2 0.933 114.2 49.3 -56.8 -47.1 26.6 44.2 53.9 8 8 A L H X S+ 0 0 95 -4,-3.3 4,-1.4 1,-0.2 -2,-0.2 0.914 114.1 42.1 -59.8 -49.4 23.1 43.7 55.3 9 9 A E H X S+ 0 0 52 -4,-2.4 4,-0.8 -5,-0.2 -1,-0.2 0.804 111.8 57.1 -74.0 -28.8 21.3 43.6 51.9 10 10 A L H X S+ 0 0 15 -4,-2.3 4,-0.7 -5,-0.2 3,-0.4 0.934 111.2 40.9 -61.1 -49.1 24.0 41.4 50.4 11 11 A L H X S+ 0 0 26 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.733 108.5 58.4 -80.7 -21.0 23.6 38.7 53.0 12 12 A T H < S+ 0 0 46 -4,-1.4 4,-0.4 2,-0.2 -1,-0.2 0.724 100.2 60.3 -76.0 -20.6 19.8 38.8 53.2 13 13 A S H < S+ 0 0 28 -4,-0.8 7,-0.3 -3,-0.4 -1,-0.2 0.816 115.5 32.6 -72.1 -32.3 19.8 38.0 49.5 14 14 A V H < S+ 0 0 11 -4,-0.7 7,-1.6 5,-0.2 -2,-0.2 0.748 116.1 56.3 -92.8 -29.6 21.6 34.7 50.2 15 15 A N S < S+ 0 0 62 -4,-2.2 -2,-0.2 5,-0.1 -3,-0.2 0.431 83.6 121.1 -82.6 -0.9 20.0 34.1 53.7 16 16 A R S > S- 0 0 95 -4,-0.4 3,-1.9 1,-0.2 5,-0.2 -0.143 85.0 -70.3 -51.5 155.1 16.6 34.2 52.0 17 17 A T T 3 S+ 0 0 117 1,-0.3 -1,-0.2 42,-0.0 -2,-0.0 -0.306 127.2 5.4 -49.6 129.6 14.3 31.2 52.3 18 18 A N T 3 S+ 0 0 73 1,-0.2 41,-0.3 -3,-0.1 -1,-0.3 0.860 102.6 157.8 52.3 41.0 15.8 28.5 50.1 19 19 A G < - 0 0 18 -3,-1.9 3,-0.5 -4,-0.1 4,-0.3 -0.414 56.3-105.5 -90.1 170.8 18.8 30.8 49.5 20 20 A T S >> S+ 0 0 5 -7,-0.3 4,-3.3 1,-0.2 3,-0.6 0.470 82.0 114.1 -79.5 -2.4 22.3 29.8 48.4 21 21 A A H 3> S+ 0 0 7 -7,-1.6 4,-0.5 1,-0.3 -1,-0.2 0.803 87.1 29.1 -35.6 -59.4 24.0 30.4 51.9 22 22 A D H 34 S+ 0 0 46 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.747 125.2 47.7 -78.0 -27.3 24.9 26.7 52.5 23 23 A L H <> S+ 0 0 0 -3,-0.6 4,-2.2 -4,-0.3 5,-0.2 0.734 94.6 80.1 -84.6 -24.2 25.3 25.8 48.9 24 24 A L H X S+ 0 0 13 -4,-3.3 4,-2.7 2,-0.2 5,-0.2 0.885 89.8 44.2 -55.2 -58.8 27.4 28.8 47.9 25 25 A V H X S+ 0 0 12 -4,-0.5 4,-2.7 1,-0.2 5,-0.2 0.954 116.9 44.7 -58.7 -54.3 30.9 27.8 49.1 26 26 A P H > S+ 0 0 27 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.864 115.1 49.6 -59.1 -36.3 30.9 24.2 47.8 27 27 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.905 111.6 48.3 -67.3 -41.7 29.4 25.4 44.4 28 28 A L H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.900 111.1 50.6 -63.6 -43.7 32.0 28.1 44.1 29 29 A R H < S+ 0 0 130 -4,-2.7 4,-0.3 -5,-0.2 -1,-0.2 0.834 113.5 46.1 -62.0 -35.5 34.8 25.6 44.9 30 30 A E H ><>S+ 0 0 41 -4,-1.7 3,-1.5 -5,-0.2 5,-0.5 0.927 111.8 49.1 -73.7 -46.6 33.4 23.2 42.2 31 31 A L H ><5S+ 0 0 1 -4,-2.9 3,-2.4 1,-0.3 -2,-0.2 0.859 100.1 68.9 -57.9 -35.7 33.0 25.9 39.6 32 32 A A T 3<5S+ 0 0 3 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.687 84.6 69.7 -57.4 -22.3 36.6 27.0 40.4 33 33 A K T < 5S- 0 0 116 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.541 111.5-120.8 -74.3 -7.5 37.7 23.7 38.8 34 34 A G T < 5S+ 0 0 20 -3,-2.4 -2,-0.1 1,-0.3 -3,-0.1 0.618 75.4 105.3 82.0 15.5 36.6 25.2 35.4 35 35 A R S - 0 0 22 -2,-0.5 4,-2.2 32,-0.2 5,-0.1 -0.466 19.8-125.3 -83.4 155.8 25.9 18.8 38.0 39 39 A R H > S+ 0 0 92 2,-0.2 4,-2.4 1,-0.2 -1,-0.1 0.786 113.3 55.3 -66.2 -32.2 23.2 18.8 40.7 40 40 A T H > S+ 0 0 112 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.871 107.6 49.5 -69.2 -38.0 24.0 15.2 41.6 41 41 A T H > S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.944 113.4 46.1 -61.1 -50.2 27.7 16.3 42.2 42 42 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.887 111.7 52.6 -58.3 -43.0 26.4 19.1 44.4 43 43 A A H X>S+ 0 0 14 -4,-2.4 4,-2.0 2,-0.2 5,-1.5 0.938 109.2 48.9 -58.1 -49.8 24.1 16.7 46.1 44 44 A G H <5S+ 0 0 62 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.881 113.9 46.4 -56.8 -42.9 26.9 14.3 46.9 45 45 A I H <5S+ 0 0 79 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.920 120.2 37.5 -66.8 -46.2 29.1 17.1 48.2 46 46 A L H <5S- 0 0 31 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.672 101.0-129.1 -78.8 -19.1 26.4 18.7 50.4 47 47 A D T <5 + 0 0 149 -4,-2.0 -3,-0.2 1,-0.2 -4,-0.1 0.929 62.2 141.0 58.7 48.4 24.8 15.3 51.5 48 48 A W < - 0 0 33 -5,-1.5 -1,-0.2 -6,-0.2 2,-0.1 -0.860 59.1-105.6-113.7 150.3 21.4 16.8 50.4 49 49 A P >> - 0 0 84 0, 0.0 4,-1.4 0, 0.0 3,-1.0 -0.475 36.0-112.7 -65.9 150.3 18.5 15.2 48.6 50 50 A A H 3> S+ 0 0 61 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.823 115.5 64.4 -52.1 -36.9 18.2 16.2 45.0 51 51 A E H 3> S+ 0 0 166 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.873 102.6 46.5 -54.3 -44.7 14.9 18.0 45.9 52 52 A R H <> S+ 0 0 113 -3,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.853 111.6 49.5 -72.7 -38.3 16.7 20.5 48.2 53 53 A V H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.916 114.2 46.4 -65.0 -44.2 19.5 21.3 45.7 54 54 A A H X S+ 0 0 18 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.862 110.7 52.9 -64.6 -39.1 17.0 21.9 42.9 55 55 A A H X S+ 0 0 26 -4,-1.9 4,-1.0 -5,-0.2 -1,-0.2 0.859 110.7 46.5 -66.8 -38.1 14.8 24.1 45.2 56 56 A V H >X S+ 0 0 4 -4,-1.8 4,-1.1 1,-0.2 3,-0.7 0.955 114.4 46.6 -68.4 -50.5 17.7 26.3 46.2 57 57 A L H 3< S+ 0 0 3 -4,-2.2 6,-0.2 1,-0.2 -2,-0.2 0.762 103.5 65.1 -63.1 -28.7 18.9 26.7 42.6 58 58 A E H 3< S+ 0 0 126 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.867 102.9 46.6 -60.7 -40.0 15.3 27.4 41.4 59 59 A Q H << S+ 0 0 86 -4,-1.0 2,-1.9 -3,-0.7 -1,-0.2 0.757 93.5 80.7 -77.0 -26.7 15.2 30.6 43.5 60 60 A A >< + 0 0 13 -4,-1.1 3,-1.8 1,-0.2 -1,-0.2 -0.576 62.8 177.7 -78.7 78.7 18.6 31.7 42.1 61 61 A T T 3 S+ 0 0 93 -2,-1.9 -1,-0.2 1,-0.3 92,-0.1 0.673 70.3 61.4 -61.0 -22.3 17.1 33.0 38.9 62 62 A S T 3 S+ 0 0 4 -3,-0.1 -1,-0.3 2,-0.1 13,-0.1 0.574 72.9 128.0 -83.4 -10.8 20.4 34.3 37.5 63 63 A T < - 0 0 1 -3,-1.8 2,-0.4 -6,-0.2 11,-0.2 -0.160 54.4-136.6 -49.8 135.3 22.1 30.8 37.5 64 64 A E E -B 73 0A 7 9,-2.7 8,-3.0 210,-0.0 9,-1.4 -0.841 24.2-174.3-100.8 134.2 23.7 30.0 34.1 65 65 A Y E -BC 71 275A 15 210,-0.8 210,-0.7 -2,-0.4 6,-0.2 -0.748 14.9-135.1-120.6 164.9 23.2 26.5 32.7 66 66 A D > - 0 0 28 4,-1.6 3,-2.1 -2,-0.2 213,-0.1 -0.526 47.5 -78.9-105.4-175.2 24.5 24.5 29.7 67 67 A K T 3 S+ 0 0 94 1,-0.3 182,-0.1 -2,-0.2 209,-0.1 0.658 131.6 49.9 -55.0 -21.3 22.7 22.2 27.2 68 68 A D T 3 S- 0 0 96 2,-0.1 -1,-0.3 207,-0.0 3,-0.1 0.439 118.4-108.3 -99.0 -2.1 22.6 19.4 29.8 69 69 A G S < S+ 0 0 7 -3,-2.1 2,-0.2 1,-0.3 -30,-0.2 0.617 72.0 144.9 78.8 14.1 21.2 21.5 32.6 70 70 A N - 0 0 48 -32,-0.1 -4,-1.6 1,-0.1 2,-0.4 -0.556 58.1 -98.5 -81.4 151.7 24.6 21.5 34.3 71 71 A I E +AB 37 65A 0 -34,-3.3 -34,-2.7 -6,-0.2 -6,-0.2 -0.599 45.9 163.3 -80.4 125.7 25.7 24.7 36.3 72 72 A I E + 0 0 14 -8,-3.0 6,-2.0 -2,-0.4 2,-0.3 0.588 64.0 20.9-110.3 -21.8 28.0 27.0 34.4 73 73 A G E +DB 77 64A 0 -9,-1.4 -9,-2.7 4,-0.3 -1,-0.3 -0.927 42.5 150.3-161.9 124.9 27.7 30.2 36.4 74 74 A Y S S- 0 0 32 2,-2.8 2,-2.4 -2,-0.3 -11,-0.1 -0.657 94.7 -44.1-150.6 95.9 26.7 31.5 39.8 75 75 A G S S+ 0 0 7 -2,-0.2 20,-1.8 -13,-0.1 2,-0.4 -0.442 144.8 56.7 74.9 -64.8 28.7 34.6 40.7 76 76 A L E S+ E 0 94A 1 -2,-2.4 -2,-2.8 18,-0.2 2,-0.3 -0.822 84.6 179.6 -91.3 136.0 31.7 32.8 39.4 77 77 A T E -DE 73 93A 0 16,-3.1 16,-2.1 -2,-0.4 -4,-0.3 -0.944 45.2-144.2-144.3 157.3 31.2 31.6 35.8 78 78 A L S S+ 0 0 49 -6,-2.0 2,-0.4 -2,-0.3 -5,-0.1 0.470 82.3 91.5 -96.9 -8.7 32.6 29.8 32.8 79 79 A R S S- 0 0 38 -7,-0.3 -2,-0.1 14,-0.1 193,-0.1 -0.775 92.4 -99.0 -88.9 134.1 30.9 32.3 30.4 80 80 A E + 0 0 84 -2,-0.4 2,-0.2 13,-0.1 -2,-0.1 -0.195 50.6 164.2 -56.4 131.8 33.0 35.3 29.4 81 81 A T - 0 0 11 2,-0.2 14,-0.1 -4,-0.1 15,-0.1 -0.795 53.7 -95.7-133.0-177.6 32.3 38.6 31.3 82 82 A S S S+ 0 0 51 -2,-0.2 2,-0.6 13,-0.1 34,-0.3 0.460 106.8 76.9 -82.7 1.0 34.2 41.8 31.7 83 83 A Y E S-F 94 0A 11 11,-0.6 11,-1.9 32,-0.1 2,-0.5 -0.927 70.9-157.5-115.6 107.3 35.7 40.6 35.0 84 84 A V E -FG 93 114A 12 30,-2.8 30,-1.9 -2,-0.6 2,-0.5 -0.736 7.8-172.1 -89.6 128.2 38.5 38.1 34.5 85 85 A F E -FG 92 113A 3 7,-2.8 7,-1.5 -2,-0.5 2,-0.7 -0.867 3.0-172.1-126.9 91.8 39.2 35.8 37.5 86 86 A E E +FG 91 112A 73 26,-2.8 26,-3.0 -2,-0.5 2,-0.4 -0.792 9.9 169.5 -95.6 110.2 42.3 33.7 37.0 87 87 A I E > -FG 90 111A 3 3,-1.2 3,-1.6 -2,-0.7 2,-0.2 -0.982 65.5 -25.7-123.6 130.4 42.8 31.0 39.7 88 88 A D T 3 S- 0 0 97 22,-0.5 24,-0.1 -2,-0.4 -2,-0.0 -0.519 123.8 -39.8 60.8-129.7 45.5 28.4 39.2 89 89 A D T 3 S+ 0 0 169 -2,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.370 114.5 108.1-101.8 2.7 46.0 28.1 35.4 90 90 A R E < - F 0 87A 88 -3,-1.6 -3,-1.2 -58,-0.1 2,-0.8 -0.628 63.2-141.0 -88.1 136.9 42.3 28.4 34.7 91 91 A R E + F 0 86A 135 -2,-0.3 2,-0.2 -5,-0.2 -5,-0.2 -0.853 36.8 161.7 -95.7 106.0 40.7 31.5 33.1 92 92 A L E - F 0 85A 5 -7,-1.5 -7,-2.8 -2,-0.8 2,-0.3 -0.591 24.3-137.1-115.4 178.6 37.3 32.0 34.8 93 93 A Y E -EF 77 84A 24 -16,-2.1 -16,-3.1 -9,-0.2 2,-0.3 -0.929 3.6-147.3-138.1 159.4 35.0 35.0 35.1 94 94 A A E -EF 76 83A 0 -11,-1.9 -11,-0.6 -2,-0.3 -18,-0.2 -0.879 23.1-126.1-123.4 160.9 32.8 36.8 37.7 95 95 A W S S- 0 0 12 -20,-1.8 2,-0.3 -2,-0.3 67,-0.2 0.749 86.6 -2.2 -76.4 -24.9 29.6 38.7 37.4 96 96 A C S > S- 0 0 0 -21,-0.2 4,-1.2 1,-0.1 67,-0.2 -0.972 74.1 -94.0-158.1 171.3 30.9 41.9 39.1 97 97 A A H > S+ 0 0 0 65,-2.1 4,-0.7 -2,-0.3 3,-0.4 0.904 118.7 51.2 -54.0 -49.5 33.8 43.7 40.7 98 98 A L H >> S+ 0 0 1 1,-0.2 4,-1.7 46,-0.2 3,-1.2 0.887 102.6 59.7 -63.2 -41.7 32.8 42.8 44.3 99 99 A D H 3> S+ 0 0 23 1,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.881 100.9 55.8 -48.3 -44.0 32.5 39.1 43.5 100 100 A T H 3< S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.734 110.6 44.7 -66.0 -23.9 36.2 39.1 42.5 101 101 A L H << S+ 0 0 3 -3,-1.2 4,-0.2 -4,-0.7 -1,-0.2 0.711 118.6 43.4 -89.8 -25.5 37.1 40.5 46.0 102 102 A I H >X S+ 0 0 5 -4,-1.7 4,-0.8 -3,-0.2 3,-0.8 0.848 101.6 64.9 -86.4 -41.8 34.8 38.1 47.8 103 103 A F H >X S+ 0 0 8 -4,-3.1 4,-2.5 1,-0.2 3,-1.1 0.860 88.3 64.5 -59.5 -46.9 35.4 34.8 46.1 104 104 A P H 3>>S+ 0 0 0 0, 0.0 5,-1.8 0, 0.0 4,-1.8 0.783 102.5 48.9 -49.1 -38.0 39.1 34.1 47.0 105 105 A A H <45S+ 0 0 42 -3,-0.8 -2,-0.2 24,-0.3 -3,-0.1 0.792 114.7 46.6 -73.6 -27.8 38.4 33.8 50.8 106 106 A L H <<5S+ 0 0 6 -3,-1.1 -1,-0.2 -4,-0.8 -3,-0.1 0.861 118.1 39.8 -80.0 -38.7 35.6 31.4 50.1 107 107 A I H <5S- 0 0 7 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.1 0.779 104.8-129.2 -76.8 -30.1 37.5 29.3 47.6 108 108 A G T <5 + 0 0 40 -4,-1.8 2,-0.3 -5,-0.3 -3,-0.2 0.849 69.6 113.3 77.3 39.0 40.6 29.5 49.7 109 109 A R < - 0 0 122 -5,-1.8 2,-0.5 -6,-0.1 -1,-0.3 -0.946 68.4-118.9-138.7 156.1 42.7 30.5 46.7 110 110 A T - 0 0 67 -2,-0.3 -22,-0.5 19,-0.1 2,-0.4 -0.859 34.1-160.7 -97.0 132.0 44.5 33.6 45.4 111 111 A A E -GH 87 128A 1 17,-2.6 17,-2.3 -2,-0.5 2,-0.7 -0.883 20.9-135.1-117.1 144.0 43.2 35.0 42.1 112 112 A R E -GH 86 127A 148 -26,-3.0 -26,-2.8 -2,-0.4 2,-0.4 -0.884 33.7-163.9 -91.3 114.1 44.6 37.3 39.4 113 113 A V E +GH 85 126A 3 13,-2.9 13,-2.3 -2,-0.7 2,-0.3 -0.841 14.8 166.5-107.1 137.2 41.9 39.7 38.8 114 114 A S E +GH 84 125A 36 -30,-1.9 -30,-2.8 -2,-0.4 11,-0.2 -0.992 7.2 135.0-147.8 154.4 41.6 42.0 35.7 115 115 A S E - H 0 124A 8 9,-2.5 9,-2.5 -2,-0.3 2,-0.3 -0.830 44.2 -93.1-165.8-162.1 39.0 44.2 34.0 116 116 A H E - H 0 123A 112 -34,-0.3 48,-0.4 7,-0.3 2,-0.1 -0.982 42.9 -93.8-135.1 149.9 38.6 47.6 32.4 117 117 A C > - 0 0 3 5,-3.5 4,-1.6 -2,-0.3 48,-0.3 -0.413 28.4-144.7 -61.3 129.5 37.4 50.9 33.9 118 118 A A T 4 S+ 0 0 25 46,-2.0 -1,-0.1 1,-0.2 47,-0.1 0.692 96.7 44.6 -73.4 -19.3 33.7 51.3 33.3 119 119 A A T 4 S+ 0 0 9 45,-0.2 -1,-0.2 3,-0.1 46,-0.1 0.798 133.9 10.2 -91.1 -34.0 33.9 55.1 32.7 120 120 A T T 4 S- 0 0 32 2,-0.1 269,-3.1 268,-0.1 -2,-0.2 0.680 89.6-120.7-121.3 -31.1 37.0 55.3 30.5 121 121 A G < + 0 0 14 -4,-1.6 -3,-0.1 1,-0.3 267,-0.1 0.391 57.2 150.4 97.5 -1.6 37.9 51.8 29.3 122 122 A A - 0 0 20 -6,-0.1 -5,-3.5 1,-0.1 -1,-0.3 -0.381 52.8-102.6 -63.1 138.8 41.4 51.8 30.8 123 123 A P E -H 116 0A 90 0, 0.0 2,-0.3 0, 0.0 -7,-0.3 -0.293 39.9-170.3 -63.9 145.3 42.7 48.4 31.9 124 124 A V E +H 115 0A 5 -9,-2.5 -9,-2.5 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54.9 -66.8 -41.3 30.2 37.5 8.4 223 13 B S H < S+ 0 0 23 -4,-2.5 7,-0.3 1,-0.2 -1,-0.2 0.878 117.5 37.6 -55.4 -39.9 29.6 36.7 12.1 224 14 B V H < S+ 0 0 16 -4,-1.6 7,-1.5 1,-0.2 -2,-0.2 0.894 117.4 47.3 -80.8 -44.8 26.4 35.0 11.1 225 15 B N H < S+ 0 0 69 -4,-3.4 -2,-0.2 5,-0.1 -3,-0.2 0.463 87.0 128.6 -80.3 -1.6 27.5 33.4 7.8 226 16 B R S >< S- 0 0 87 -4,-1.1 3,-2.5 -5,-0.2 5,-0.2 -0.051 79.3 -72.5 -45.6 150.6 30.6 32.1 9.6 227 17 B T T 3 S+ 0 0 120 1,-0.3 -1,-0.2 3,-0.1 3,-0.1 -0.299 126.1 4.5 -51.0 128.8 31.5 28.4 9.3 228 18 B N T 3 S+ 0 0 80 -3,-0.1 -1,-0.3 1,-0.1 41,-0.2 0.788 105.4 154.8 55.3 32.0 29.0 26.5 11.5 229 19 B G < - 0 0 22 -3,-2.5 3,-0.3 -4,-0.2 4,-0.2 -0.076 57.1-105.9 -79.6-175.7 27.3 29.9 12.1 230 20 B T S >> S+ 0 0 6 -7,-0.3 4,-2.3 1,-0.2 3,-0.8 0.446 80.2 113.3 -96.4 -2.0 23.7 30.6 13.0 231 21 B A H 3> S+ 0 0 7 -7,-1.5 4,-0.5 1,-0.3 -1,-0.2 0.803 82.9 37.6 -38.4 -52.5 22.4 32.0 9.6 232 22 B D H 34 S+ 0 0 56 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.742 122.5 40.2 -81.6 -25.6 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243 33 B K T < 5S- 0 0 96 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.688 112.6-121.8 -66.8 -20.5 6.3 32.5 21.9 244 34 B G T < 5S+ 0 0 20 -3,-1.8 -3,-0.1 1,-0.3 -2,-0.1 0.494 73.9 106.5 95.7 6.9 7.9 33.1 25.3 245 35 B R S - 0 0 24 -2,-0.6 4,-2.2 32,-0.2 5,-0.1 -0.392 20.7-120.4 -73.6 153.6 14.3 22.3 23.2 249 39 B R H > S+ 0 0 49 1,-0.2 4,-2.8 30,-0.2 5,-0.1 0.837 114.4 49.5 -60.2 -35.8 17.1 21.2 20.8 250 40 B T H > S+ 0 0 109 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.819 107.8 52.5 -77.1 -32.7 14.8 18.5 19.3 251 41 B T H > S+ 0 0 66 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.943 114.6 44.8 -60.2 -47.1 11.9 20.9 18.8 252 42 B L H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.931 111.2 51.2 -62.0 -50.3 14.4 23.1 17.0 253 43 B A H X>S+ 0 0 11 -4,-2.8 5,-2.7 1,-0.2 4,-0.7 0.805 110.7 51.2 -57.2 -33.1 15.9 20.2 15.0 254 44 B G H <5S+ 0 0 57 -4,-1.7 -1,-0.2 3,-0.2 -2,-0.2 0.869 109.0 48.8 -72.2 -40.0 12.4 19.2 13.9 255 45 B I H <5S+ 0 0 78 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.899 118.3 40.1 -66.0 -42.3 11.4 22.7 12.7 256 46 B L H <5S- 0 0 26 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.636 105.2-128.8 -77.8 -17.1 14.6 23.0 10.7 257 47 B D T <5 + 0 0 146 -4,-0.7 -3,-0.2 -5,-0.2 -4,-0.1 0.945 60.0 147.1 56.2 52.1 14.4 19.4 9.5 258 48 B W < - 0 0 34 -5,-2.7 -1,-0.2 -6,-0.1 2,-0.1 -0.832 57.7-100.8-113.3 150.6 18.0 19.0 10.7 259 49 B P >> - 0 0 90 0, 0.0 3,-1.6 0, 0.0 4,-1.2 -0.476 42.2-112.7 -61.2 144.8 20.0 16.0 12.1 260 50 B A H >> S+ 0 0 59 1,-0.3 4,-1.7 2,-0.2 3,-0.5 0.872 114.3 47.9 -49.1 -49.3 20.3 16.5 15.9 261 51 B E H 3> S+ 0 0 144 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.515 100.5 64.5 -80.5 -4.3 24.0 17.0 15.9 262 52 B R H <> S+ 0 0 123 -3,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.819 107.9 43.7 -76.0 -35.7 23.9 19.6 13.1 263 53 B V H < + 0 0 11 -4,-1.4 3,-1.5 1,-0.2 -1,-0.2 -0.544 64.7 172.2 -79.6 78.1 27.4 29.9 19.5 271 61 B T T 3 + 0 0 87 -2,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.681 68.4 64.7 -66.3 -20.7 28.9 30.0 23.0 272 62 B S T 3 S+ 0 0 4 -3,-0.1 -1,-0.3 2,-0.1 13,-0.1 0.650 72.6 124.8 -77.4 -16.9 26.7 32.9 24.2 273 63 B T < - 0 0 2 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287 274A 0 -9,-1.5 -9,-2.9 4,-0.3 4,-0.3 -0.863 40.2 137.3-160.2 118.8 18.3 32.9 24.8 284 74 B Y S S- 0 0 28 2,-2.5 2,-2.3 -2,-0.3 -43,-0.1 -0.665 97.2 -42.6-149.5 99.9 20.0 33.7 21.5 285 75 B G S S+ 0 0 6 -2,-0.2 20,-1.8 -13,-0.1 2,-0.4 -0.467 143.8 55.5 76.1 -66.5 19.8 37.4 20.7 286 76 B L E S- M 0 304A 1 -2,-2.3 -2,-2.5 18,-0.2 2,-0.3 -0.797 84.7-176.6 -89.5 138.4 16.2 37.3 22.0 287 77 B T E -LM 283 303A 0 16,-3.0 16,-2.1 -2,-0.4 -4,-0.3 -0.978 43.1-147.5-145.4 150.0 16.0 35.9 25.5 288 78 B L S S+ 0 0 47 -6,-2.7 2,-0.4 -2,-0.3 -5,-0.1 0.609 82.9 88.6 -86.6 -14.9 13.6 34.9 28.3 289 79 B R S S- 0 0 32 -7,-0.4 -2,-0.1 1,-0.1 -227,-0.0 -0.716 93.3 -95.4 -90.5 134.4 16.2 36.0 30.9 290 80 B E + 0 0 81 -2,-0.4 2,-0.2 13,-0.1 -1,-0.1 -0.132 51.3 161.8 -55.3 130.4 16.1 39.6 32.0 291 81 B T - 0 0 7 2,-0.1 14,-0.1 -4,-0.1 15,-0.1 -0.755 55.9 -93.9-128.9-177.4 18.4 42.2 30.3 292 82 B S S S+ 0 0 57 -2,-0.2 2,-0.7 13,-0.2 34,-0.3 0.522 108.9 76.5 -71.9 -9.4 18.5 46.0 30.0 293 83 B Y E -N 304 0A 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13.9 313 103 B F H 3X S+ 0 0 10 -4,-2.9 4,-2.1 1,-0.2 3,-0.4 0.813 86.5 65.7 -61.9 -41.6 14.0 41.2 15.4 314 104 B P H 3>>S+ 0 0 0 0, 0.0 5,-1.6 0, 0.0 4,-1.3 0.867 105.3 45.5 -52.3 -40.5 10.5 42.5 14.6 315 105 B A H <45S+ 0 0 42 -3,-0.7 -2,-0.2 24,-0.3 -3,-0.1 0.826 113.0 51.2 -69.4 -32.7 11.0 42.1 10.9 316 106 B L H <5S+ 0 0 4 -4,-0.9 -1,-0.2 -3,-0.4 -77,-0.1 0.789 120.0 33.8 -74.8 -28.7 12.5 38.6 11.4 317 107 B I H <5S- 0 0 15 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.506 105.7-124.9-104.0 -9.6 9.6 37.4 13.5 318 108 B G T <5S+ 0 0 55 -4,-1.3 2,-0.3 -5,-0.3 -3,-0.2 0.831 70.3 108.1 70.0 36.0 6.8 39.4 11.8 319 109 B R < - 0 0 84 -5,-1.6 2,-0.4 -6,-0.2 -1,-0.2 -0.907 69.0-111.0-136.5 164.5 5.5 41.2 14.9 320 110 B T - 0 0 72 -2,-0.3 -22,-0.5 19,-0.1 2,-0.4 -0.848 33.0-158.9 -98.3 132.3 5.5 44.7 16.5 321 111 B A E -OP 297 338A 0 17,-2.6 17,-2.7 -2,-0.4 2,-0.7 -0.887 17.9-142.2-112.6 141.0 7.5 45.2 19.7 322 112 B R E -OP 296 337A 148 -26,-2.4 -26,-2.4 -2,-0.4 2,-0.4 -0.924 31.9-162.4 -95.0 110.8 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57.9-121.9-157.9 161.1 9.2 51.3 10.7 343 133 B I E +Q 338 0A 16 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.880 31.7 179.6-110.1 150.4 9.7 52.8 14.2 344 134 B Q E +Q 337 0A 107 -7,-2.6 -7,-2.9 -2,-0.3 3,-0.2 -0.923 53.3 28.9-143.7 165.1 7.1 54.9 16.0 345 135 B A E - 0 0 54 -2,-0.3 2,-0.8 -9,-0.2 -1,-0.2 0.903 69.8-169.4 47.2 53.0 6.6 56.7 19.3 346 136 B V E - 0 0 25 -10,-0.2 -10,-0.2 -3,-0.1 -1,-0.2 -0.644 12.8-141.5 -78.6 110.1 10.3 57.4 19.7 347 137 B E E S+Q 335 0A 119 -12,-3.1 -12,-2.8 -2,-0.8 2,-0.1 -0.954 88.7 19.0-127.0 113.2 10.7 58.7 23.3 348 138 B P S > S- 0 0 56 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.617 91.6-139.1 -79.4 163.8 12.6 60.8 23.5 349 139 B A T 3 S+ 0 0 77 1,-0.3 -2,-0.1 -2,-0.1 28,-0.1 0.771 97.6 54.4 -60.2 -35.0 12.7 61.8 19.8 350 140 B G T 3 S+ 0 0 45 26,-0.2 28,-0.4 48,-0.1 -1,-0.3 0.130 77.6 156.8 -88.7 20.4 16.5 62.2 19.5 351 141 B M < - 0 0 0 -3,-1.5 48,-2.4 26,-0.2 49,-0.3 -0.122 23.7-159.2 -47.1 137.5 17.3 58.7 20.9 352 142 B A E -TU 375 398C 0 23,-2.7 23,-2.2 46,-0.3 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