==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 28-APR-11 3RQI . COMPND 2 MOLECULE: RESPONSE REGULATOR PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA PSEUDOMALLEI; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 170 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9897.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.8 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 . 1 0.6 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 . 9 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 68 40.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 0 1 3 0 2 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 1 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 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 1 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 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 3 A D 0 0 154 0, 0.0 25,-0.0 0, 0.0 45,-0.0 0.000 360.0 360.0 360.0 173.5 14.6 18.5 2.5 2 4 A K + 0 0 81 23,-0.1 25,-2.2 45,-0.1 2,-0.5 -0.226 360.0 150.0-130.6 46.4 16.5 15.4 3.7 3 5 A N E -a 27 0A 27 23,-0.2 44,-2.4 42,-0.1 45,-1.8 -0.715 23.8-169.7 -82.6 128.2 17.3 15.9 7.4 4 6 A F E -ab 28 48A 0 23,-2.6 25,-2.5 -2,-0.5 2,-0.6 -0.968 13.0-157.1-124.8 130.1 17.5 12.5 9.2 5 7 A L E -ab 29 49A 0 43,-2.5 45,-2.5 -2,-0.4 2,-0.6 -0.944 7.3-163.2-108.5 119.4 17.7 11.9 13.1 6 8 A V E -ab 30 50A 0 23,-2.9 25,-2.5 -2,-0.6 2,-0.7 -0.913 4.2-169.8-101.1 116.1 19.1 8.6 14.1 7 9 A I E +ab 31 51A 1 43,-2.2 45,-2.0 -2,-0.6 2,-0.3 -0.903 32.5 125.2-110.8 106.4 18.3 7.8 17.8 8 10 A D - 0 0 5 23,-2.2 47,-0.1 -2,-0.7 6,-0.1 -0.945 54.0-142.0-159.5 134.1 20.3 4.7 19.0 9 11 A D S S+ 0 0 57 -2,-0.3 2,-1.1 45,-0.2 23,-0.1 0.641 85.6 88.0 -74.1 -16.3 22.6 4.2 22.0 10 12 A N > - 0 0 75 1,-0.2 4,-2.5 2,-0.1 5,-0.2 -0.765 61.5-171.8 -85.0 101.9 24.9 1.9 19.9 11 13 A E H > S+ 0 0 119 -2,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.757 80.4 54.8 -72.4 -24.7 27.2 4.6 18.4 12 14 A V H > S+ 0 0 112 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.963 112.0 42.3 -71.3 -52.6 28.9 2.1 16.0 13 15 A F H > S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.921 114.5 52.9 -54.3 -43.5 25.6 1.0 14.5 14 16 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.896 108.7 49.5 -66.2 -38.8 24.4 4.6 14.4 15 17 A G H X S+ 0 0 6 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.885 109.2 50.9 -65.2 -40.4 27.5 5.7 12.5 16 18 A T H X S+ 0 0 79 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.914 113.4 45.7 -63.7 -41.5 27.2 2.9 9.9 17 19 A L H X S+ 0 0 9 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.941 112.5 51.4 -66.5 -46.0 23.6 3.9 9.3 18 20 A A H X S+ 0 0 3 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.926 109.4 49.5 -57.1 -49.1 24.5 7.6 9.2 19 21 A R H X S+ 0 0 123 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.912 110.7 49.9 -60.1 -41.2 27.2 7.0 6.6 20 22 A G H X S+ 0 0 1 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.901 113.1 46.6 -63.9 -39.7 24.9 4.9 4.4 21 23 A L H ><>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 3,-1.0 0.909 109.4 54.2 -66.5 -41.8 22.2 7.6 4.5 22 24 A E H ><5S+ 0 0 96 -4,-2.8 3,-2.2 1,-0.3 -2,-0.2 0.904 102.3 57.4 -60.6 -39.6 24.8 10.4 3.8 23 25 A R H 3<5S+ 0 0 185 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.739 106.1 52.0 -63.6 -20.2 25.9 8.5 0.7 24 26 A R T <<5S- 0 0 114 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.248 130.0 -97.3 -97.5 9.0 22.2 8.8 -0.4 25 27 A G T < 5S+ 0 0 49 -3,-2.2 2,-0.2 1,-0.3 -3,-0.2 0.595 77.2 137.4 91.1 10.8 22.2 12.5 0.2 26 28 A Y < - 0 0 34 -5,-2.3 2,-0.6 -8,-0.1 -1,-0.3 -0.621 51.1-135.3 -87.7 149.3 20.7 12.7 3.7 27 29 A A E -a 3 0A 50 -25,-2.2 -23,-2.6 -2,-0.2 2,-0.4 -0.951 34.0-159.6-101.2 118.1 22.0 15.1 6.3 28 30 A V E -a 4 0A 21 -2,-0.6 2,-0.3 -25,-0.2 -23,-0.2 -0.838 21.1-174.7-114.8 133.5 22.2 13.0 9.5 29 31 A R E -a 5 0A 122 -25,-2.5 -23,-2.9 -2,-0.4 2,-0.4 -0.919 16.9-148.3-113.2 149.4 22.3 13.8 13.2 30 32 A Q E -a 6 0A 65 -2,-0.3 2,-0.4 -25,-0.2 -23,-0.2 -0.937 11.2-170.7-119.0 143.1 22.7 11.1 15.8 31 33 A A E -a 7 0A 0 -25,-2.5 -23,-2.2 -2,-0.4 3,-0.1 -0.998 4.1-171.2-128.6 135.4 21.4 11.0 19.4 32 34 A H + 0 0 35 -2,-0.4 2,-0.3 -25,-0.2 -25,-0.1 0.402 69.3 18.5-110.6 -0.1 22.6 8.2 21.8 33 35 A N S > S- 0 0 51 23,-0.1 4,-2.1 -25,-0.1 5,-0.1 -0.932 88.3 -91.2-158.2 175.1 20.2 8.8 24.7 34 36 A K H > S+ 0 0 18 21,-0.3 4,-2.4 -2,-0.3 5,-0.2 0.878 120.2 54.1 -65.9 -38.4 16.9 10.5 25.6 35 37 A D H > S+ 0 0 118 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.937 112.3 43.8 -58.5 -51.2 18.5 13.8 26.6 36 38 A E H > S+ 0 0 69 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.881 111.7 54.0 -62.0 -41.4 20.4 14.1 23.3 37 39 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.927 112.3 43.1 -60.1 -47.7 17.3 13.0 21.3 38 40 A L H X S+ 0 0 72 -4,-2.4 4,-0.8 2,-0.2 -2,-0.2 0.871 113.0 53.0 -67.7 -35.8 15.1 15.7 22.9 39 41 A K H >< S+ 0 0 158 -4,-2.3 3,-0.7 -5,-0.2 4,-0.3 0.972 115.5 39.9 -60.1 -55.4 17.8 18.4 22.6 40 42 A L H >X S+ 0 0 22 -4,-2.7 4,-1.7 1,-0.2 3,-1.6 0.904 113.5 52.7 -59.8 -46.0 18.2 17.7 18.8 41 43 A A H 3< S+ 0 0 3 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.618 111.0 50.1 -70.1 -12.8 14.5 17.3 18.1 42 44 A G T << S+ 0 0 57 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.453 114.0 44.9 -97.1 -3.8 14.0 20.7 19.8 43 45 A A T <4 S+ 0 0 82 -3,-1.6 2,-0.3 -4,-0.3 -2,-0.2 0.696 114.1 24.3-113.8 -25.6 16.6 22.4 17.8 44 46 A E S < S- 0 0 59 -4,-1.7 2,-0.4 -41,-0.0 -1,-0.3 -0.958 74.6-109.1-145.6 152.2 16.3 21.4 14.1 45 47 A K - 0 0 123 -2,-0.3 2,-0.4 -3,-0.1 -42,-0.1 -0.770 32.8-165.0 -86.8 130.0 13.5 20.1 11.8 46 48 A F - 0 0 1 -2,-0.4 -42,-0.2 -5,-0.1 3,-0.1 -0.907 20.7-164.6-114.6 140.0 13.8 16.5 10.6 47 49 A E S S+ 0 0 30 -44,-2.4 28,-2.6 -2,-0.4 2,-0.3 0.758 83.5 27.7 -87.4 -29.0 12.0 14.9 7.8 48 50 A F E -bc 4 75A 30 -45,-1.8 -43,-2.5 26,-0.2 2,-0.3 -0.982 64.2-176.9-134.6 144.3 12.9 11.3 9.0 49 51 A I E -bc 5 76A 0 26,-1.9 28,-2.8 -2,-0.3 2,-0.4 -0.991 9.7-159.3-141.2 131.6 13.6 9.9 12.4 50 52 A T E -bc 6 77A 4 -45,-2.5 -43,-2.2 -2,-0.3 2,-0.4 -0.919 12.6-160.3-107.3 142.9 14.6 6.4 13.5 51 53 A V E -bc 7 78A 0 26,-2.4 28,-2.3 -2,-0.4 2,-0.2 -0.975 7.7-151.7-129.2 119.3 14.0 5.3 17.1 52 54 A X - 0 0 13 -45,-2.0 3,-0.2 -2,-0.4 28,-0.2 -0.605 9.8-150.2 -79.3 143.6 15.7 2.4 19.0 53 55 A L S S+ 0 0 19 -2,-0.2 7,-2.8 1,-0.2 2,-1.8 0.922 88.6 53.4 -82.5 -49.5 13.6 0.9 21.8 54 56 A H E S+E 59 0B 104 5,-0.2 2,-1.9 6,-0.1 -1,-0.2 -0.580 73.9 178.1 -87.1 78.1 16.2 -0.3 24.2 55 57 A L E > -E 58 0B 1 -2,-1.8 3,-2.4 3,-1.1 2,-0.3 -0.384 49.7 -94.0 -87.5 69.0 17.9 3.0 24.4 56 58 A G T 3 S- 0 0 34 -2,-1.9 -23,-0.1 1,-0.3 -1,-0.1 -0.534 105.3 -10.8 60.6-122.5 20.7 2.3 26.9 57 59 A N T 3 S+ 0 0 165 -2,-0.3 -1,-0.3 -3,-0.1 2,-0.2 0.506 129.6 82.8 -79.4 -6.5 19.2 3.3 30.3 58 60 A D E < S-E 55 0B 50 -3,-2.4 -3,-1.1 -4,-0.0 2,-0.7 -0.612 79.6-119.7-106.2 156.3 16.3 5.0 28.4 59 61 A S E -E 54 0B 57 -2,-0.2 4,-0.3 -5,-0.2 -5,-0.2 -0.879 16.1-167.6 -92.2 112.3 12.9 3.9 26.9 60 62 A G S >> S+ 0 0 0 -7,-2.8 3,-1.3 -2,-0.7 4,-0.7 0.838 90.1 61.4 -62.2 -32.7 12.8 4.7 23.1 61 63 A L H >> S+ 0 0 39 -8,-0.5 3,-1.4 1,-0.3 4,-0.5 0.922 98.0 56.6 -60.1 -41.4 9.1 4.0 23.2 62 64 A S H 34 S+ 0 0 73 1,-0.3 -1,-0.3 -9,-0.2 -2,-0.2 0.624 101.4 59.5 -65.6 -15.5 8.7 6.9 25.7 63 65 A L H <> S+ 0 0 4 -3,-1.3 4,-2.4 -4,-0.3 -1,-0.3 0.679 84.9 79.0 -84.3 -19.2 10.3 9.2 23.1 64 66 A I H S+ 0 0 46 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.888 111.8 52.5 -60.7 -36.7 7.2 13.9 22.5 67 69 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.905 107.4 50.5 -63.6 -43.7 9.0 13.5 19.1 68 70 A C H < S+ 0 0 31 -4,-2.4 -1,-0.2 26,-0.2 -3,-0.1 0.876 110.5 51.0 -60.7 -36.1 5.7 13.6 17.3 69 71 A D H < S+ 0 0 134 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.875 118.1 37.6 -69.3 -39.5 4.8 16.8 19.3 70 72 A L H < S+ 0 0 81 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.771 129.0 33.1 -77.6 -28.1 8.2 18.4 18.3 71 73 A Q >< + 0 0 12 -4,-2.5 3,-1.0 -5,-0.2 -1,-0.2 -0.545 64.2 160.9-132.5 64.7 8.3 17.0 14.8 72 74 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.779 79.4 48.3 -64.8 -26.8 4.7 16.9 13.5 73 75 A D T 3 S+ 0 0 132 -3,-0.1 -5,-0.1 -27,-0.1 -2,-0.1 0.668 91.0 105.6 -82.9 -18.5 5.8 16.7 9.9 74 76 A A < - 0 0 10 -3,-1.0 2,-0.5 -7,-0.2 -26,-0.2 -0.255 68.3-130.9 -67.6 144.3 8.5 13.9 10.4 75 77 A R E -c 48 0A 68 -28,-2.6 -26,-1.9 21,-0.0 2,-0.5 -0.846 30.0-158.3 -86.1 130.7 8.1 10.3 9.3 76 78 A I E -c 49 0A 2 -2,-0.5 21,-2.0 19,-0.2 22,-1.3 -0.960 12.2-174.9-123.5 126.1 9.1 8.2 12.4 77 79 A L E -cd 50 98A 0 -28,-2.8 -26,-2.4 -2,-0.5 2,-0.4 -0.970 20.7-139.3-123.0 127.2 10.2 4.6 12.2 78 80 A V E -cd 51 99A 0 20,-2.3 22,-2.9 -2,-0.5 2,-0.5 -0.724 21.7-173.1 -78.0 128.8 11.0 2.3 15.2 79 81 A L E + d 0 100A 3 -28,-2.3 2,-0.4 -2,-0.4 -26,-0.2 -0.953 18.0 167.1-129.1 109.5 14.1 0.3 14.3 80 82 A T E - d 0 101A 0 20,-2.3 22,-2.5 -2,-0.5 3,-0.3 -0.971 49.8-157.2-141.0 140.8 14.8 -2.4 16.9 81 83 A G S S+ 0 0 44 -2,-0.4 -1,-0.1 20,-0.2 20,-0.1 0.363 100.7 62.1 -85.8 1.9 16.8 -5.5 17.8 82 84 A Y S S+ 0 0 143 2,-0.1 -1,-0.2 5,-0.0 5,-0.1 -0.430 78.0 176.0-120.3 54.1 14.1 -6.3 20.4 83 85 A A + 0 0 28 -3,-0.3 2,-0.3 19,-0.2 3,-0.1 -0.347 6.1 154.6 -72.0 141.8 11.1 -6.7 18.1 84 86 A S > - 0 0 44 1,-0.1 4,-1.9 77,-0.1 5,-0.2 -0.974 50.5-122.3-156.5 150.8 7.7 -7.7 19.4 85 87 A I H > S+ 0 0 122 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.920 112.0 56.7 -57.0 -43.2 4.0 -7.4 18.6 86 88 A A H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 109.2 43.0 -60.9 -43.6 3.4 -5.7 21.9 87 89 A T H > S+ 0 0 36 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.836 112.3 54.5 -70.8 -28.6 5.9 -2.9 21.4 88 90 A A H X S+ 0 0 23 -4,-1.9 4,-2.1 2,-0.2 5,-0.2 0.945 107.8 49.9 -68.0 -45.7 4.8 -2.4 17.8 89 91 A V H X S+ 0 0 76 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.948 115.9 42.3 -53.8 -53.2 1.2 -1.9 18.9 90 92 A Q H X S+ 0 0 77 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.888 110.7 56.0 -68.0 -37.8 2.2 0.7 21.5 91 93 A A H X>S+ 0 0 0 -4,-2.6 5,-2.8 1,-0.2 4,-0.6 0.899 109.0 46.8 -59.0 -39.6 4.7 2.4 19.2 92 94 A V H ><5S+ 0 0 84 -4,-2.1 3,-1.1 3,-0.2 -1,-0.2 0.909 110.0 52.9 -71.4 -38.9 2.0 3.0 16.6 93 95 A K H 3<5S+ 0 0 156 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.889 106.7 54.2 -60.2 -34.8 -0.4 4.3 19.3 94 96 A D H 3<5S- 0 0 43 -4,-2.1 -1,-0.3 -5,-0.1 -26,-0.2 0.602 133.1 -90.1 -74.9 -14.8 2.3 6.7 20.4 95 97 A G T <<5S+ 0 0 30 -3,-1.1 -3,-0.2 -4,-0.6 -19,-0.2 0.390 72.5 149.9 120.8 -0.1 2.5 8.1 16.9 96 98 A A < - 0 0 6 -5,-2.8 -1,-0.3 -6,-0.2 -19,-0.2 -0.356 37.5-149.7 -61.9 141.2 5.2 6.0 15.1 97 99 A D S S- 0 0 57 -21,-2.0 2,-0.3 1,-0.2 21,-0.3 0.753 72.0 -10.9 -81.1 -27.1 4.6 5.6 11.4 98 100 A N E -d 77 0A 19 -22,-1.3 -20,-2.3 19,-0.1 2,-0.4 -0.963 57.2-138.0-163.1 177.6 6.2 2.2 11.0 99 101 A Y E -d 78 0A 34 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.988 16.3-176.5-153.1 128.8 8.3 -0.4 12.8 100 102 A L E -d 79 0A 31 -22,-2.9 -20,-2.3 -2,-0.4 2,-0.3 -0.995 22.0-127.7-132.7 137.8 11.2 -2.6 11.5 101 103 A A E -d 80 0A 52 -2,-0.4 -20,-0.2 -22,-0.2 -2,-0.0 -0.659 43.5 -88.5 -75.2 135.6 13.3 -5.4 13.1 102 104 A K S S+ 0 0 43 -22,-2.5 -19,-0.2 -2,-0.3 2,-0.1 -0.567 101.3 61.4 -68.8 146.8 17.0 -5.1 12.9 103 105 A P S S+ 0 0 130 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.542 71.6 144.8 -84.6 145.0 18.9 -6.1 10.9 104 106 A A - 0 0 31 -4,-0.1 2,-0.2 -2,-0.1 -2,-0.0 -0.967 40.6-126.9-135.8 149.8 17.6 -3.9 8.1 105 107 A N > - 0 0 105 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.507 31.5-102.0 -93.7 170.3 19.6 -2.2 5.3 106 108 A V H > S+ 0 0 21 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.902 120.1 53.5 -59.6 -45.6 19.4 1.4 4.3 107 109 A E H > S+ 0 0 62 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.900 111.7 45.3 -53.6 -43.5 17.1 0.8 1.3 108 110 A S H > S+ 0 0 43 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.840 110.4 53.6 -74.5 -30.6 14.6 -1.1 3.4 109 111 A I H X S+ 0 0 3 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.960 112.2 44.8 -65.5 -49.9 14.8 1.6 6.2 110 112 A L H >< S+ 0 0 24 -4,-2.8 3,-0.5 1,-0.2 4,-0.4 0.904 112.6 52.0 -58.1 -44.0 14.0 4.3 3.6 111 113 A A H >< S+ 0 0 52 -4,-2.5 3,-1.6 1,-0.2 -1,-0.2 0.917 106.7 53.6 -56.3 -44.0 11.2 2.1 2.1 112 114 A A H 3< S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.723 103.9 58.0 -68.1 -22.1 9.6 1.6 5.5 113 115 A L T << S+ 0 0 1 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.537 86.1 101.9 -82.5 -10.3 9.5 5.4 6.0 114 116 A Q S X S- 0 0 92 -3,-1.6 3,-1.9 -4,-0.4 4,-0.3 -0.437 85.6 -85.8 -79.6 155.3 7.4 6.1 2.9 115 117 A T T 3 S+ 0 0 95 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 -0.237 113.2 10.5 -53.2 138.9 3.7 6.9 2.9 116 118 A N T 3> S+ 0 0 121 -3,-0.1 4,-1.9 1,-0.1 -1,-0.3 0.475 86.7 128.5 70.6 5.1 1.5 3.8 2.8 117 119 A A H <> S+ 0 0 10 -3,-1.9 4,-2.6 1,-0.2 5,-0.2 0.923 70.7 52.3 -59.7 -42.9 4.5 1.4 3.5 118 120 A S H > S+ 0 0 66 -4,-0.3 4,-2.7 -21,-0.3 -1,-0.2 0.876 106.2 52.9 -58.7 -42.3 2.7 -0.2 6.4 119 121 A E H > S+ 0 0 125 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.925 111.7 46.1 -63.1 -42.7 -0.4 -1.0 4.3 120 122 A V H X S+ 0 0 80 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.913 113.4 49.7 -62.3 -41.8 1.8 -2.7 1.7 121 123 A Q H X S+ 0 0 61 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.901 108.4 52.5 -68.5 -38.5 3.8 -4.6 4.3 122 124 A A H X S+ 0 0 47 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.927 110.8 47.3 -62.3 -45.2 0.6 -5.9 6.0 123 125 A E H X S+ 0 0 89 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.924 110.5 51.5 -60.3 -47.0 -0.8 -7.2 2.7 124 126 A E H X S+ 0 0 100 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.904 109.8 51.9 -57.0 -39.8 2.5 -8.9 1.9 125 127 A A H >< S+ 0 0 62 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.917 107.1 50.6 -65.0 -43.1 2.4 -10.6 5.4 126 128 A L H 3< S+ 0 0 138 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.824 110.9 50.4 -65.2 -28.8 -1.1 -11.9 4.9 127 129 A E H 3< S+ 0 0 118 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.645 112.7 48.5 -78.7 -19.9 -0.0 -13.4 1.5 128 130 A N S << S- 0 0 109 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.1 -0.509 73.4-178.9-124.9 62.9 3.0 -15.1 3.1 129 131 A P - 0 0 106 0, 0.0 2,-0.4 0, 0.0 -3,-0.1 -0.334 23.1-130.9 -59.9 146.2 2.0 -16.9 6.3 130 132 A V - 0 0 98 -5,-0.0 2,-0.3 2,-0.0 40,-0.1 -0.828 23.9-178.2-108.6 138.3 4.8 -18.6 8.1 131 133 A V - 0 0 86 -2,-0.4 2,-0.3 38,-0.1 37,-0.2 -0.993 10.6-161.0-130.5 140.7 5.2 -22.2 9.4 132 134 A L 0 0 80 35,-2.2 38,-0.0 -2,-0.3 -2,-0.0 -0.934 360.0 360.0-125.9 144.1 8.2 -23.6 11.2 133 135 A S 0 0 138 -2,-0.3 -1,-0.0 36,-0.0 36,-0.0 -0.106 360.0 360.0 -79.6 360.0 9.5 -27.1 11.9 134 ! 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 0.0 135 139 A L > 0 0 118 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -45.6 9.5 -34.1 21.3 136 140 A E H > + 0 0 100 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.850 360.0 58.5 -65.1 -35.5 9.9 -30.3 21.3 137 141 A W H > S+ 0 0 142 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.912 103.7 49.2 -56.6 -48.5 6.2 -30.5 20.2 138 142 A E H > S+ 0 0 39 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.830 110.1 51.6 -62.4 -34.6 5.3 -32.4 23.4 139 143 A H H X S+ 0 0 99 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.878 111.5 46.0 -71.5 -39.6 7.2 -29.8 25.6 140 144 A I H X S+ 0 0 11 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.838 110.7 53.0 -71.7 -35.1 5.3 -26.9 24.1 141 145 A Q H X S+ 0 0 71 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.803 110.9 49.3 -67.2 -29.6 1.9 -28.7 24.3 142 146 A R H X S+ 0 0 166 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.916 112.9 43.4 -74.8 -47.0 2.7 -29.3 28.0 143 147 A V H X S+ 0 0 25 -4,-2.0 4,-0.6 2,-0.2 -2,-0.2 0.857 114.1 52.9 -66.5 -36.2 3.6 -25.6 28.8 144 148 A L H <>S+ 0 0 12 -4,-2.0 5,-2.6 1,-0.2 6,-0.7 0.901 111.1 45.7 -65.8 -42.5 0.7 -24.4 26.8 145 149 A A H ><5S+ 0 0 74 -4,-1.5 3,-1.2 1,-0.2 -2,-0.2 0.834 109.6 54.9 -68.1 -36.0 -1.7 -26.7 28.7 146 150 A E H 3<5S+ 0 0 84 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.616 108.2 51.0 -70.4 -15.9 -0.2 -25.6 32.0 147 151 A N T 3<5S- 0 0 55 -4,-0.6 3,-0.4 -3,-0.5 -1,-0.2 0.097 123.5-102.5-109.3 21.1 -0.9 -22.0 31.0 148 152 A N T < 5S- 0 0 152 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.850 76.2 -57.6 58.5 41.8 -4.6 -22.6 30.2 149 153 A N S - 0 0 77 -6,-0.7 4,-2.4 -3,-0.4 -1,-0.2 -0.853 32.5-169.3-102.6 106.6 -2.4 -19.1 26.5 151 155 A I H > S+ 0 0 46 -2,-0.7 4,-3.0 2,-0.2 5,-0.1 0.798 86.4 57.3 -67.7 -28.7 0.3 -18.5 23.9 152 156 A S H > S+ 0 0 83 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.964 112.6 39.5 -66.0 -51.7 1.5 -15.2 25.5 153 157 A A H > S+ 0 0 31 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.864 117.1 51.2 -61.8 -40.5 2.2 -16.9 28.8 154 158 A T H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.924 107.7 53.0 -64.4 -44.4 3.6 -19.9 27.1 155 159 A A H X>S+ 0 0 7 -4,-3.0 5,-2.1 1,-0.2 4,-0.7 0.930 110.6 46.8 -54.1 -50.6 5.9 -17.7 24.9 156 160 A R H <5S+ 0 0 72 -4,-2.1 3,-0.5 1,-0.2 -1,-0.2 0.877 112.8 49.2 -62.4 -39.7 7.3 -16.0 28.1 157 161 A A H <5S+ 0 0 65 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.885 115.2 43.5 -66.3 -39.5 7.8 -19.3 29.9 158 162 A L H <5S- 0 0 37 -4,-2.5 -1,-0.2 2,-0.1 -2,-0.2 0.471 107.0-127.4 -83.1 -5.4 9.7 -20.8 26.8 159 163 A N T <5S+ 0 0 154 -4,-0.7 2,-0.3 -3,-0.5 -3,-0.2 0.869 70.2 117.6 52.6 42.6 11.7 -17.6 26.3 160 164 A M S - 0 0 112 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.416 29.2-126.1 -71.0 150.1 8.6 -15.0 20.6 162 166 A R H > S+ 0 0 41 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.923 113.2 55.2 -60.5 -41.3 4.8 -15.5 20.4 163 167 A R H > S+ 0 0 57 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.889 106.9 50.4 -58.8 -41.2 5.1 -15.5 16.5 164 168 A T H > S+ 0 0 45 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.911 109.8 49.5 -63.3 -48.6 7.7 -18.3 16.7 165 169 A L H X S+ 0 0 4 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.945 112.3 48.6 -51.4 -52.6 5.4 -20.5 19.0 166 170 A Q H X S+ 0 0 132 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.845 110.7 49.3 -59.1 -40.5 2.5 -19.9 16.6 167 171 A R H < S+ 0 0 7 -4,-2.0 -35,-2.2 1,-0.2 -1,-0.2 0.842 112.8 48.3 -70.5 -33.2 4.5 -20.8 13.5 168 172 A K H < S+ 0 0 61 -4,-1.9 -2,-0.2 -37,-0.2 -1,-0.2 0.764 112.8 48.0 -76.8 -27.7 5.8 -24.0 15.2 169 173 A L H < S+ 0 0 45 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.707 89.8 108.7 -83.1 -23.9 2.2 -24.9 16.3 170 174 A A < 0 0 44 -4,-1.5 -38,-0.1 -5,-0.2 -3,-0.0 -0.191 360.0 360.0 -59.3 145.8 0.8 -24.3 12.8 171 175 A K 0 0 141 -40,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.255 360.0 360.0 -70.0 360.0 -0.4 -27.3 10.7