==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 18-APR-07 2PKW . COMPND 2 MOLECULE: UPF0341 PROTEIN YHIQ; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM LT2; . AUTHOR F.FOROUHAR,M.SU,J.SEETHARAMAN,Y.FANG,R.XIAO,K.CUNNINGHAM,L- . 254 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12740.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 167 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 8.7 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 1.2 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 . 22 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 22.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 0 1 0 2 0 3 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 2 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 . 2 0 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 X 0 0 84 0, 0.0 25,-3.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 139.7 4.2 20.4 39.7 2 2 A Q E +a 26 0A 96 23,-0.2 2,-0.3 25,-0.1 25,-0.2 -0.611 360.0 145.2 -87.2 140.9 3.0 18.0 42.4 3 3 A I E -a 27 0A 0 23,-1.9 25,-1.9 -2,-0.3 2,-1.0 -0.952 53.5-102.7-165.7 152.1 3.7 14.3 42.2 4 4 A C E -b 34 0B 1 29,-1.9 31,-2.3 -2,-0.3 2,-0.4 -0.755 38.4-154.7 -87.6 105.8 4.4 11.5 44.7 5 5 A L E -b 35 0B 25 -2,-1.0 2,-0.4 29,-0.2 31,-0.2 -0.657 13.4-173.3 -80.9 131.1 8.1 10.9 44.4 6 6 A X E -b 36 0B 50 29,-2.5 31,-2.4 -2,-0.4 2,-0.6 -0.992 13.8-148.6-129.5 136.6 9.3 7.4 45.5 7 7 A D E +b 37 0B 75 -2,-0.4 31,-0.1 29,-0.2 29,-0.1 -0.904 29.2 155.0-108.4 119.3 12.8 6.1 45.8 8 8 A E + 0 0 91 29,-2.6 -1,-0.1 -2,-0.6 30,-0.1 -0.082 54.5 89.7-128.9 30.6 13.5 2.4 45.1 9 9 A T S S- 0 0 31 29,-0.3 29,-0.1 30,-0.1 -1,-0.1 0.698 74.9-147.1 -97.7 -24.9 17.2 2.6 44.2 10 10 A G + 0 0 79 1,-0.1 28,-0.0 28,-0.0 -2,-0.0 0.925 63.7 116.7 56.4 47.3 18.5 2.1 47.6 11 11 A A - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.518 56.6-156.4-118.0 -15.6 21.5 4.4 46.9 12 12 A T + 0 0 140 1,-0.2 -5,-0.0 2,-0.0 -2,-0.0 0.710 54.2 125.4 41.5 30.3 20.8 7.2 49.4 13 13 A D S S- 0 0 109 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.540 81.7-112.1 -90.3 -10.3 22.9 9.6 47.1 14 14 A G S > S+ 0 0 31 3,-0.0 4,-2.0 4,-0.0 3,-0.3 0.555 72.7 138.2 90.5 9.2 20.1 12.2 46.9 15 15 A A H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.906 70.2 52.5 -52.8 -47.4 19.4 11.6 43.2 16 16 A L H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.877 109.0 49.7 -58.3 -41.1 15.7 11.7 43.6 17 17 A S H > S+ 0 0 91 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.869 112.1 47.9 -66.7 -37.3 15.8 15.0 45.4 18 18 A V H X S+ 0 0 99 -4,-2.0 4,-3.6 2,-0.2 -2,-0.2 0.935 109.6 52.7 -68.3 -46.5 18.1 16.5 42.7 19 19 A L H X S+ 0 0 26 -4,-2.8 4,-2.2 1,-0.2 6,-0.2 0.931 109.5 49.3 -54.8 -48.0 15.8 15.2 39.9 20 20 A A H X>S+ 0 0 10 -4,-2.2 5,-2.5 1,-0.2 4,-0.5 0.936 114.1 44.6 -59.0 -46.7 12.8 16.9 41.6 21 21 A A H ><5S+ 0 0 80 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.916 111.3 55.9 -62.8 -40.9 14.7 20.2 41.9 22 22 A R H 3<5S+ 0 0 141 -4,-3.6 -2,-0.2 1,-0.2 -1,-0.2 0.847 118.7 30.8 -56.7 -41.0 15.9 19.7 38.3 23 23 A W H 3<5S- 0 0 12 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.209 110.7-112.7-106.0 11.8 12.3 19.4 36.9 24 24 A G T <<5 + 0 0 48 -3,-0.9 2,-0.3 -4,-0.5 -3,-0.2 0.852 60.1 159.0 60.3 37.9 10.5 21.6 39.4 25 25 A L < - 0 0 15 -5,-2.5 2,-0.5 -6,-0.2 -23,-0.2 -0.668 29.2-151.9 -92.7 148.0 8.6 18.8 41.0 26 26 A E E -a 2 0A 117 -25,-3.2 -23,-1.9 -2,-0.3 2,-0.1 -0.979 23.4-115.5-124.4 122.1 7.1 19.0 44.5 27 27 A H E -a 3 0A 92 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.303 31.6-176.6 -57.2 128.6 6.6 15.9 46.6 28 28 A D > - 0 0 31 -25,-1.9 3,-2.1 1,-0.1 -1,-0.1 -0.863 12.0-168.3-133.7 95.4 2.9 15.2 47.2 29 29 A E T 3 S+ 0 0 116 -2,-0.4 -1,-0.1 1,-0.3 -25,-0.1 0.786 90.7 46.8 -52.7 -33.2 2.4 12.2 49.5 30 30 A D T 3 S+ 0 0 146 -27,-0.1 -1,-0.3 2,-0.0 -26,-0.1 0.339 82.9 125.9 -93.9 5.1 -1.4 12.2 48.8 31 31 A N < - 0 0 23 -3,-2.1 16,-0.1 1,-0.1 -28,-0.1 -0.356 62.7-135.3 -64.9 144.3 -1.0 12.5 45.0 32 32 A P S S+ 0 0 77 0, 0.0 15,-0.8 0, 0.0 16,-0.5 0.722 88.7 60.6 -72.1 -20.6 -2.8 9.8 42.9 33 33 A X E - C 0 46B 4 13,-0.2 -29,-1.9 14,-0.1 2,-0.4 -0.794 68.8-159.0-108.0 150.3 0.3 9.4 40.7 34 34 A A E -bC 4 45B 0 11,-2.0 11,-2.2 -2,-0.3 2,-0.6 -0.989 10.0-151.9-129.2 139.1 3.8 8.4 41.7 35 35 A L E -bC 5 44B 0 -31,-2.3 -29,-2.5 -2,-0.4 2,-0.5 -0.961 25.9-164.1-107.3 116.2 7.1 9.0 39.9 36 36 A V E -bC 6 43B 0 7,-3.1 7,-2.9 -2,-0.6 2,-0.6 -0.901 15.2-153.5-113.2 128.5 9.4 6.2 40.9 37 37 A X E -bC 7 42B 30 -31,-2.4 -29,-2.6 -2,-0.5 5,-0.2 -0.856 20.1-176.2 -97.5 120.9 13.2 6.0 40.5 38 38 A T - 0 0 17 3,-3.8 -29,-0.3 -2,-0.6 -32,-0.0 -0.623 44.7 -98.0-106.6 173.4 14.4 2.4 40.3 39 39 A P S S+ 0 0 105 0, 0.0 -30,-0.1 0, 0.0 3,-0.1 0.770 124.5 30.5 -63.2 -20.6 18.0 1.2 40.0 40 40 A Q S S- 0 0 154 1,-0.2 2,-0.2 0, 0.0 -31,-0.0 0.856 126.6 -8.1-102.1 -52.2 17.5 1.0 36.3 41 41 A H - 0 0 20 -5,-0.0 -3,-3.8 91,-0.0 2,-0.5 -0.733 60.7-102.5-139.0-174.4 15.0 3.6 35.2 42 42 A L E +C 37 0B 1 -5,-0.2 15,-0.4 -2,-0.2 2,-0.3 -0.977 45.8 178.3-114.5 122.9 12.4 6.3 36.2 43 43 A E E -C 36 0B 21 -7,-2.9 -7,-3.1 -2,-0.5 2,-0.4 -0.838 26.1-126.1-128.7 167.7 8.8 5.1 35.9 44 44 A L E -CD 35 55B 0 11,-2.7 11,-2.4 -2,-0.3 2,-0.4 -0.907 24.2-172.3-112.3 136.2 5.2 6.3 36.4 45 45 A R E -C 34 0B 67 -11,-2.2 -11,-2.0 -2,-0.4 2,-1.1 -0.973 27.5-136.0-130.7 146.4 2.6 4.4 38.5 46 46 A K E > -C 33 0B 30 7,-0.5 3,-3.4 3,-0.4 6,-0.2 -0.772 26.4-155.3 -98.5 86.3 -1.1 4.8 39.1 47 47 A R T 3 S+ 0 0 92 -2,-1.1 -1,-0.2 -15,-0.8 -14,-0.1 0.705 87.4 55.3 -32.2 -47.9 -1.0 4.3 42.9 48 48 A D T 3 S+ 0 0 104 -16,-0.5 -1,-0.3 1,-0.2 -15,-0.1 0.491 110.4 52.1 -73.1 1.2 -4.7 3.2 43.3 49 49 A E X + 0 0 29 -3,-3.4 3,-1.3 1,-0.1 -3,-0.4 -0.625 58.4 162.7-137.4 77.6 -3.9 0.5 40.7 50 50 A P G > S+ 0 0 105 0, 0.0 3,-2.7 0, 0.0 -1,-0.1 0.904 74.2 64.7 -60.4 -43.9 -0.8 -1.6 41.6 51 51 A K G 3 S+ 0 0 153 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.538 91.4 66.2 -60.4 -5.8 -1.7 -4.4 39.3 52 52 A L G < S- 0 0 18 -3,-1.3 -1,-0.3 -6,-0.2 137,-0.1 0.603 95.0-155.1 -89.6 -13.5 -1.3 -2.0 36.4 53 53 A G < - 0 0 33 -3,-2.7 -7,-0.5 -4,-0.2 2,-0.2 0.047 25.0 -59.6 64.8-179.2 2.4 -1.7 37.1 54 54 A G - 0 0 12 -9,-0.1 2,-0.4 -11,-0.0 -9,-0.2 -0.633 42.3-141.1-100.5 159.8 4.6 1.2 36.2 55 55 A I B +D 44 0B 11 -11,-2.4 -11,-2.7 -2,-0.2 2,-0.3 -0.938 21.1 173.5-120.8 142.3 5.4 2.7 32.8 56 56 A F - 0 0 78 -2,-0.4 2,-0.5 -13,-0.2 -13,-0.1 -0.955 37.8 -99.6-143.3 160.8 8.7 4.0 31.5 57 57 A V + 0 0 4 -15,-0.4 2,-0.4 68,-0.4 -15,-0.1 -0.723 42.2 175.1 -83.5 122.6 10.2 5.3 28.2 58 58 A D + 0 0 37 -2,-0.5 6,-0.4 41,-0.2 7,-0.1 -0.929 18.2 166.0-136.1 109.4 12.2 2.6 26.6 59 59 A F S S+ 0 0 3 -2,-0.4 -1,-0.1 70,-0.4 71,-0.1 0.604 77.7 55.1 -94.2 -15.7 13.8 3.2 23.1 60 60 A V S S- 0 0 59 69,-0.1 2,-0.1 4,-0.0 -2,-0.1 0.945 115.7 -3.8 -83.3 -56.4 16.1 0.2 23.3 61 61 A G S >> S+ 0 0 22 4,-0.1 4,-1.1 3,-0.1 3,-0.6 -0.265 92.8 52.6-120.7-154.5 13.8 -2.8 24.0 62 62 A G H 3> S- 0 0 56 1,-0.2 4,-1.7 2,-0.2 5,-0.2 -0.217 113.6 -15.8 63.8-146.7 10.3 -3.8 24.7 63 63 A A H 3> S+ 0 0 83 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.883 136.4 56.2 -59.1 -42.2 7.4 -2.7 22.5 64 64 A X H <> S+ 0 0 15 -3,-0.6 4,-1.9 -6,-0.4 -1,-0.2 0.915 104.6 51.7 -58.8 -46.2 9.5 -0.0 20.8 65 65 A A H X S+ 0 0 36 -4,-1.1 4,-0.7 1,-0.2 -1,-0.2 0.916 114.3 44.1 -57.2 -45.1 12.2 -2.4 19.7 66 66 A H H >X S+ 0 0 113 -4,-1.7 4,-2.3 1,-0.2 3,-1.0 0.905 110.1 54.1 -67.4 -42.5 9.6 -4.7 18.2 67 67 A R H 3X S+ 0 0 63 -4,-2.9 4,-1.9 1,-0.3 6,-0.5 0.824 102.2 60.5 -61.6 -29.4 7.7 -1.8 16.6 68 68 A R H 3< S+ 0 0 110 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.791 114.9 33.5 -67.8 -26.8 11.0 -0.8 14.9 69 69 A K H << S+ 0 0 161 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.2 0.699 136.9 18.6-102.0 -23.5 11.2 -4.2 13.2 70 70 A F H < S+ 0 0 135 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.2 0.407 100.3 86.5-127.2 -3.7 7.5 -5.0 12.5 71 71 A G S < S- 0 0 34 -4,-1.9 -3,-0.1 -5,-0.4 -4,-0.1 0.810 105.9-104.2 -69.4 -29.5 5.8 -1.6 12.8 72 72 A G > - 0 0 43 -5,-0.3 3,-3.0 4,-0.1 -4,-0.1 0.089 38.0-151.2 127.7 -21.4 6.5 -0.8 9.2 73 73 A G G > S+ 0 0 22 -6,-0.5 3,-2.6 1,-0.3 6,-0.3 -0.355 87.2 3.8 56.7-126.9 9.3 1.7 9.6 74 74 A R G 3 S+ 0 0 118 1,-0.3 -1,-0.3 5,-0.1 32,-0.0 0.583 133.3 65.8 -64.7 -4.8 9.2 4.0 6.6 75 75 A G G < S+ 0 0 36 -3,-3.0 -1,-0.3 4,-0.1 -2,-0.2 0.500 77.0 111.2 -93.3 -6.7 6.0 2.0 5.9 76 76 A E S <> S- 0 0 22 -3,-2.6 4,-2.3 1,-0.1 5,-0.2 -0.344 77.6-119.4 -68.5 150.3 4.2 3.3 9.0 77 77 A A H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.920 113.8 51.0 -54.9 -48.5 1.2 5.6 8.5 78 78 A V H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.892 108.6 52.4 -59.7 -39.5 2.8 8.4 10.5 79 79 A A H 4>S+ 0 0 0 -6,-0.3 5,-2.2 1,-0.2 4,-0.4 0.940 111.9 45.0 -62.0 -46.0 5.9 8.1 8.4 80 80 A K H ><5S+ 0 0 117 -4,-2.3 3,-0.7 1,-0.2 -1,-0.2 0.841 109.6 58.2 -66.5 -29.9 3.9 8.4 5.2 81 81 A A H 3<5S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.909 103.6 49.8 -65.2 -43.6 1.9 11.3 6.8 82 82 A V T 3<5S- 0 0 1 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.550 123.7-106.7 -74.2 -5.6 5.0 13.4 7.4 83 83 A G T < 5 + 0 0 14 -3,-0.7 2,-0.8 -4,-0.4 -3,-0.2 0.634 54.4 169.7 92.2 16.0 6.0 12.8 3.8 84 84 A I < + 0 0 10 -5,-2.2 2,-0.3 5,-0.1 -1,-0.2 -0.477 20.5 148.9 -64.0 105.9 8.8 10.3 4.2 85 85 A K B > -E 88 0C 173 -2,-0.8 3,-1.4 3,-0.6 2,-0.1 -0.995 56.2 -25.9-145.0 136.5 9.3 9.3 0.6 86 86 A G T 3 S- 0 0 58 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.416 126.6 -24.5 63.1-131.7 12.3 8.2 -1.4 87 87 A D T 3 S+ 0 0 158 -2,-0.1 2,-0.7 -3,-0.0 -1,-0.2 -0.137 104.2 122.7-104.9 35.7 15.4 9.7 0.2 88 88 A Y B < +E 85 0C 73 -3,-1.4 -3,-0.6 -5,-0.1 23,-0.1 -0.891 30.6 171.3-102.2 110.2 13.5 12.6 1.8 89 89 A L - 0 0 73 -2,-0.7 23,-0.3 -5,-0.1 -5,-0.1 -0.821 20.5-155.8-120.6 87.4 14.0 12.7 5.6 90 90 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 22,-0.2 -0.272 22.3-109.0 -66.6 145.8 12.5 15.9 6.9 91 91 A D - 0 0 26 20,-0.2 76,-2.1 73,-0.1 75,-0.8 -0.592 45.1-159.4 -71.4 134.1 13.5 17.6 10.1 92 92 A V E -fg 113 167D 0 20,-2.8 22,-2.3 -2,-0.3 2,-0.6 -0.936 21.9-159.0-125.0 143.0 10.6 17.1 12.5 93 93 A V E -fg 114 168D 0 74,-2.0 76,-2.6 -2,-0.4 2,-1.1 -0.981 10.8-155.9-117.4 114.5 9.4 18.8 15.6 94 94 A D E > -fg 115 169D 2 20,-2.5 22,-2.9 -2,-0.6 3,-0.9 -0.816 10.8-172.5 -89.1 98.1 7.1 16.6 17.7 95 95 A A T 3 S+ 0 0 4 74,-1.8 59,-0.2 -2,-1.1 -1,-0.2 0.587 79.9 44.5 -71.5 -9.9 5.3 19.4 19.5 96 96 A T T 3 S+ 0 0 23 73,-0.5 -1,-0.2 1,-0.1 4,-0.2 -0.275 72.8 178.8-128.7 44.6 3.4 16.9 21.8 97 97 A A X + 0 0 7 19,-1.4 3,-1.7 -3,-0.9 6,-0.3 0.616 14.4 161.8 -11.5 -65.7 6.3 14.4 22.8 98 98 A G T 3 S- 0 0 14 1,-0.3 -1,-0.1 18,-0.2 28,-0.1 -0.510 75.1 -18.8 70.7-129.9 4.2 12.2 25.0 99 99 A L T 3 S- 0 0 14 -2,-0.3 -1,-0.3 26,-0.0 -41,-0.2 0.392 91.8-116.4 -91.1 1.4 5.9 8.9 25.6 100 100 A G S <> S+ 0 0 0 -3,-1.7 4,-2.5 -4,-0.2 5,-0.2 0.498 74.7 130.1 79.1 5.7 8.1 9.4 22.5 101 101 A R H > S+ 0 0 72 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.948 77.7 34.5 -58.3 -56.4 6.7 6.4 20.6 102 102 A D H > S+ 0 0 14 -5,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.870 115.9 57.2 -68.1 -35.7 6.0 8.2 17.3 103 103 A A H > S+ 0 0 0 -6,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.925 107.7 48.5 -60.0 -42.7 9.0 10.5 17.7 104 104 A F H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.857 107.0 55.1 -65.1 -38.8 11.2 7.5 17.9 105 105 A V H X S+ 0 0 7 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.949 110.1 46.6 -59.9 -48.2 9.7 5.8 14.8 106 106 A L H X>S+ 0 0 0 -4,-2.2 5,-2.1 1,-0.2 4,-0.6 0.860 114.0 47.4 -63.6 -36.0 10.5 9.0 12.8 107 107 A A H ><5S+ 0 0 0 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.909 108.2 56.0 -71.2 -39.9 14.0 9.2 14.1 108 108 A S H 3<5S+ 0 0 25 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.785 104.1 53.4 -61.8 -29.9 14.6 5.5 13.5 109 109 A V H 3<5S- 0 0 22 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.669 133.1 -89.1 -80.0 -16.8 13.7 5.9 9.8 110 110 A G T <<5S+ 0 0 14 -3,-1.1 -3,-0.2 -4,-0.6 -2,-0.1 0.280 81.4 133.6 129.9 -12.8 16.3 8.7 9.6 111 111 A C < - 0 0 0 -5,-2.1 2,-0.8 -6,-0.2 -1,-0.3 -0.396 56.7-124.9 -71.2 145.4 14.5 12.0 10.5 112 112 A R - 0 0 133 -23,-0.3 -20,-2.8 -22,-0.2 2,-0.4 -0.825 39.0-168.3 -89.3 113.3 16.1 14.5 12.8 113 113 A V E -fh 92 147D 2 33,-3.7 35,-2.4 -2,-0.8 2,-0.5 -0.894 21.2-169.9-114.7 137.5 13.4 14.9 15.5 114 114 A R E -fh 93 148D 35 -22,-2.3 -20,-2.5 -2,-0.4 2,-0.4 -0.990 16.3-152.7-120.4 126.1 13.1 17.4 18.3 115 115 A X E -fh 94 149D 0 33,-3.3 35,-3.0 -2,-0.5 2,-0.5 -0.879 1.0-154.8-103.6 134.7 10.4 16.7 20.9 116 116 A L E + h 0 150D 1 -22,-2.9 -19,-1.4 -2,-0.4 2,-0.4 -0.925 16.1 176.8-108.0 122.8 8.7 19.5 22.8 117 117 A E E - h 0 151D 17 33,-2.5 35,-1.4 -2,-0.5 -21,-0.1 -0.989 15.4-179.0-130.3 125.0 7.2 18.5 26.2 118 118 A R + 0 0 95 -2,-0.4 35,-0.1 33,-0.2 -1,-0.1 0.706 61.6 89.2 -92.8 -25.0 5.6 21.0 28.5 119 119 A N > - 0 0 27 1,-0.2 4,-2.3 33,-0.1 5,-0.2 -0.668 67.8-151.0 -79.4 114.5 4.7 18.6 31.4 120 120 A P H > S+ 0 0 24 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.815 94.3 50.2 -54.4 -38.6 7.7 18.4 33.8 121 121 A V H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.928 112.4 47.3 -67.2 -43.3 7.0 14.9 34.9 122 122 A V H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.867 110.5 52.7 -65.6 -35.4 6.7 13.6 31.3 123 123 A A H X S+ 0 0 0 -4,-2.3 4,-3.4 2,-0.2 -1,-0.2 0.908 108.3 50.4 -66.8 -39.4 10.0 15.5 30.4 124 124 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.923 112.4 47.4 -63.5 -40.6 11.7 13.7 33.3 125 125 A L H X S+ 0 0 3 -4,-2.2 4,-1.6 2,-0.2 -68,-0.4 0.909 115.7 44.1 -66.0 -42.5 10.4 10.4 32.0 126 126 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.913 111.0 54.9 -68.0 -42.0 11.4 11.1 28.4 127 127 A D H X S+ 0 0 56 -4,-3.4 4,-2.2 1,-0.2 -2,-0.2 0.908 108.2 48.6 -57.7 -42.3 14.8 12.4 29.6 128 128 A D H X S+ 0 0 34 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.844 109.5 53.3 -65.8 -35.5 15.4 9.2 31.5 129 129 A G H X S+ 0 0 0 -4,-1.6 4,-2.1 1,-0.2 -70,-0.4 0.903 108.9 49.3 -66.7 -39.8 14.5 7.3 28.3 130 130 A L H X S+ 0 0 5 -4,-2.4 4,-3.7 2,-0.2 5,-0.3 0.918 107.1 54.6 -65.6 -44.3 17.0 9.3 26.3 131 131 A T H X S+ 0 0 80 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.965 112.9 41.6 -55.2 -54.8 19.8 8.7 28.7 132 132 A R H X S+ 0 0 55 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.891 116.6 51.6 -60.8 -36.2 19.4 4.9 28.6 133 133 A G H >< S+ 0 0 0 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.904 106.9 50.8 -67.0 -42.2 18.9 5.2 24.8 134 134 A Y H 3< S+ 0 0 64 -4,-3.7 -1,-0.2 1,-0.2 -2,-0.2 0.808 106.4 57.0 -65.9 -29.0 22.0 7.3 24.2 135 135 A A H 3< S+ 0 0 82 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.658 81.9 112.7 -76.7 -15.2 24.0 4.7 26.2 136 136 A D << - 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0 0 34 -2,-0.3 4,-2.2 -35,-0.1 3,-0.9 -0.728 28.3-147.1 -92.2 140.7 5.1 24.8 25.9 154 154 A S T 34 S+ 0 0 5 -2,-0.3 -1,-0.1 -59,-0.2 -59,-0.1 0.385 95.1 67.6 -84.8 4.0 4.5 24.3 22.1 155 155 A L T 34 S+ 0 0 49 3,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.406 122.1 9.0-101.6 0.1 2.1 27.2 22.2 156 156 A T T <4 S+ 0 0 97 -3,-0.9 -2,-0.2 50,-0.0 4,-0.2 0.475 130.0 48.7-145.6 -36.2 4.9 29.8 22.9 157 157 A A S < S+ 0 0 24 -4,-2.2 -3,-0.2 1,-0.2 4,-0.1 0.424 98.3 73.5 -92.1 -0.9 8.3 28.2 22.6 158 158 A L S > S+ 0 0 0 -5,-0.2 3,-1.4 1,-0.2 -1,-0.2 0.886 92.6 51.0 -79.5 -40.6 7.3 26.6 19.2 159 159 A T T 3 S+ 0 0 89 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.649 106.9 57.9 -70.7 -14.2 7.5 29.8 17.2 160 160 A D T 3 S+ 0 0 121 -4,-0.2 -1,-0.3 2,-0.0 2,-0.2 0.480 79.9 117.2 -92.9 -5.1 11.0 30.3 18.7 161 161 A I < - 0 0 17 -3,-1.4 -3,-0.1 -4,-0.1 -68,-0.0 -0.466 55.3-142.2 -68.3 130.2 12.2 27.0 17.4 162 162 A T S S+ 0 0 113 -2,-0.2 2,-0.2 1,-0.2 -2,-0.0 -0.984 73.2 34.6-157.0 144.6 15.1 27.4 14.9 163 163 A P S S- 0 0 81 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.527 98.9-118.6 -65.5 149.5 16.3 26.3 12.4 164 164 A R - 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