==== 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 BIOSYNTHETIC PROTEIN 12-MAR-09 3GLV . COMPND 2 MOLECULE: LIPOPOLYSACCHARIDE CORE BIOSYNTHESIS PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA VOLCANIUM GSS1; . AUTHOR R.ZHANG,A.SATHER,S.CLANCY,A.JOACHIMIAK,MIDWEST CENTER FOR ST . 244 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13266.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 16.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 0 0.0 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 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 70 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.6 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 1 0 3 1 1 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 4 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 0 A G 0 0 114 0, 0.0 2,-0.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.4 36.4 69.4 -12.0 2 1 A M - 0 0 156 28,-0.1 2,-0.2 27,-0.0 27,-0.0 -0.834 360.0-142.3-102.8 98.7 34.8 66.0 -12.2 3 2 A I - 0 0 67 -2,-0.8 27,-2.7 1,-0.1 28,-1.9 -0.388 8.7-148.1 -72.9 127.1 37.0 63.7 -14.2 4 3 A R E -a 31 0A 70 26,-0.2 83,-2.7 -2,-0.2 84,-2.1 -0.872 11.3-167.2-102.2 122.1 35.2 61.2 -16.5 5 4 A V E -ab 32 88A 0 26,-2.7 28,-3.0 -2,-0.6 2,-0.5 -0.888 5.0-156.5-108.7 132.6 36.8 57.8 -17.1 6 5 A M E +ab 33 89A 3 82,-2.9 84,-2.9 -2,-0.4 2,-0.3 -0.969 12.7 179.2-112.5 125.1 35.6 55.5 -19.9 7 6 A A E -a 34 0A 0 26,-2.5 28,-3.5 -2,-0.5 2,-0.3 -0.871 7.6-162.9-116.9 155.7 36.2 51.8 -19.7 8 7 A T E +a 35 0A 60 82,-0.4 2,-0.3 -2,-0.3 28,-0.2 -0.936 22.8 118.7-137.0 161.8 35.0 49.2 -22.3 9 8 A G E -a 36 0A 25 26,-1.7 28,-2.5 -2,-0.3 -2,-0.0 -0.938 59.8-103.2 164.1 174.5 34.5 45.4 -22.6 10 9 A V - 0 0 18 -2,-0.3 -1,-0.1 26,-0.2 32,-0.1 0.838 37.8-166.4 -84.4 -46.2 32.1 42.5 -23.2 11 10 A F + 0 0 7 2,-0.1 3,-0.2 -3,-0.1 49,-0.1 0.930 24.5 157.8 55.1 52.2 31.8 41.5 -19.5 12 11 A D S S+ 0 0 34 1,-0.3 2,-0.6 38,-0.0 -1,-0.0 0.996 70.9 16.6 -70.3 -64.5 30.1 38.2 -20.4 13 12 A I S S- 0 0 46 123,-0.0 -1,-0.3 38,-0.0 -2,-0.1 -0.953 93.1-127.5-109.5 114.5 30.9 36.2 -17.3 14 13 A L + 0 0 3 -2,-0.6 123,-0.3 123,-0.3 2,-0.3 -0.350 39.8 161.9 -66.9 135.8 32.0 38.6 -14.5 15 14 A H >> - 0 0 70 -2,-0.1 4,-1.8 121,-0.1 3,-0.7 -0.899 54.2 -91.1-145.4 177.4 35.2 37.8 -12.8 16 15 A L H 3> S+ 0 0 32 -2,-0.3 4,-2.4 1,-0.3 5,-0.1 0.701 119.1 62.9 -70.8 -19.5 37.9 39.4 -10.7 17 16 A G H 3> S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.900 105.7 46.3 -63.2 -42.3 39.9 40.5 -13.7 18 17 A H H <> S+ 0 0 35 -3,-0.7 4,-2.8 2,-0.2 5,-0.3 0.924 110.8 52.7 -64.3 -48.6 37.0 42.7 -14.7 19 18 A I H X S+ 0 0 8 -4,-1.8 4,-3.0 1,-0.2 5,-0.3 0.909 108.7 49.7 -55.2 -43.6 36.7 44.0 -11.2 20 19 A H H X S+ 0 0 37 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.948 112.7 48.1 -64.4 -42.6 40.4 45.0 -11.2 21 20 A Y H X S+ 0 0 27 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.955 117.7 40.0 -59.7 -51.5 40.0 46.8 -14.5 22 21 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.939 116.5 48.8 -64.6 -49.7 36.9 48.6 -13.4 23 22 A K H X S+ 0 0 72 -4,-3.0 4,-1.7 -5,-0.3 -1,-0.2 0.883 113.7 45.8 -59.9 -42.5 38.0 49.4 -9.9 24 23 A E H < S+ 0 0 48 -4,-2.4 4,-0.5 -5,-0.3 -1,-0.2 0.878 111.2 53.8 -72.6 -32.3 41.4 50.7 -11.0 25 24 A S H >< S+ 0 0 0 -4,-1.8 3,-1.6 -5,-0.3 4,-0.2 0.930 107.0 51.6 -64.0 -43.9 39.7 52.8 -13.7 26 25 A K H >< S+ 0 0 52 -4,-2.4 3,-2.0 1,-0.3 -1,-0.2 0.886 99.8 64.4 -60.4 -36.7 37.4 54.4 -11.1 27 26 A K T 3< S+ 0 0 140 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.694 93.5 63.4 -58.9 -21.3 40.4 55.3 -9.0 28 27 A L T < S- 0 0 68 -3,-1.6 -1,-0.3 -4,-0.5 2,-0.2 0.561 116.8 -6.9 -86.5 -7.8 41.6 57.6 -11.8 29 28 A G S < S- 0 0 18 -3,-2.0 -25,-0.2 -4,-0.2 3,-0.1 -0.682 74.4 -89.4-155.8-149.8 38.6 60.0 -11.7 30 29 A D S S+ 0 0 91 -27,-2.7 2,-0.4 1,-0.3 -26,-0.2 0.585 100.9 40.1-118.8 -24.3 35.2 60.8 -10.3 31 30 A E E -a 4 0A 43 -28,-1.9 -26,-2.7 2,-0.0 2,-0.6 -0.990 63.9-157.5-131.9 125.8 32.8 59.2 -12.7 32 31 A L E -a 5 0A 0 -2,-0.4 36,-2.2 33,-0.2 35,-1.4 -0.934 8.9-172.9-102.3 117.7 33.2 55.7 -14.3 33 32 A V E -ac 6 68A 0 -28,-3.0 -26,-2.5 -2,-0.6 2,-0.5 -0.950 9.4-158.3-103.6 124.8 31.2 55.2 -17.6 34 33 A V E -ac 7 69A 0 34,-3.2 36,-2.7 -2,-0.5 2,-0.7 -0.915 4.6-152.8-107.1 130.0 31.4 51.6 -18.8 35 34 A V E -ac 8 70A 9 -28,-3.5 -26,-1.7 -2,-0.5 2,-0.5 -0.898 12.7-157.1-105.6 116.4 30.7 50.9 -22.5 36 35 A V E -ac 9 71A 0 34,-3.2 36,-2.2 -2,-0.7 -26,-0.2 -0.798 21.0-114.1 -99.0 125.4 29.4 47.4 -22.9 37 36 A A - 0 0 19 -28,-2.5 19,-0.1 -2,-0.5 20,-0.1 -0.293 27.5-120.0 -62.6 134.3 29.9 45.7 -26.3 38 37 A R > - 0 0 63 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.339 28.0-109.5 -59.3 154.7 26.7 44.8 -28.3 39 38 A D H > S+ 0 0 42 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.891 118.6 52.4 -58.0 -40.2 26.2 41.2 -29.2 40 39 A S H > S+ 0 0 54 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.943 109.6 48.8 -61.7 -48.7 26.9 41.8 -32.9 41 40 A T H > S+ 0 0 30 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.958 113.0 46.6 -55.0 -54.0 30.2 43.5 -32.1 42 41 A A H <>S+ 0 0 0 -4,-2.4 5,-2.5 1,-0.2 3,-0.4 0.943 114.5 47.9 -54.9 -48.9 31.4 40.7 -29.8 43 42 A R H ><5S+ 0 0 142 -4,-2.6 3,-2.0 1,-0.2 -1,-0.2 0.917 109.9 52.2 -55.1 -46.4 30.3 38.1 -32.3 44 43 A N H 3<5S+ 0 0 126 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.761 106.3 54.2 -67.1 -25.8 32.1 40.0 -35.1 45 44 A N T 3<5S- 0 0 114 -4,-1.8 -1,-0.3 -3,-0.4 -2,-0.2 0.117 124.6-106.4 -90.7 20.5 35.3 40.0 -33.0 46 45 A G T < 5S+ 0 0 67 -3,-2.0 2,-0.3 -5,-0.1 -3,-0.2 0.805 88.1 112.0 62.5 32.3 35.0 36.2 -32.6 47 46 A K < - 0 0 120 -5,-2.5 -2,-0.1 -6,-0.2 -3,-0.1 -0.742 50.4-161.6-133.1 92.0 33.8 36.1 -29.0 48 47 A I - 0 0 114 -2,-0.3 2,-0.3 -5,-0.2 -8,-0.1 -0.542 16.4-143.3 -66.9 118.7 30.2 34.8 -28.9 49 48 A P - 0 0 14 0, 0.0 4,-0.1 0, 0.0 -6,-0.0 -0.690 8.7-147.5 -88.4 147.6 28.9 35.8 -25.4 50 49 A I S S+ 0 0 139 -2,-0.3 2,-0.4 2,-0.1 -2,-0.0 0.742 85.2 63.3 -80.5 -26.4 26.5 33.5 -23.6 51 50 A F S S- 0 0 53 1,-0.0 -38,-0.0 2,-0.0 87,-0.0 -0.845 92.0-116.3 -97.9 139.8 24.6 36.4 -21.9 52 51 A D > - 0 0 70 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.227 30.5-102.5 -74.6 165.3 22.7 38.8 -24.2 53 52 A E H > S+ 0 0 37 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.831 118.6 50.6 -64.1 -36.5 23.7 42.5 -24.3 54 53 A N H > S+ 0 0 98 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.906 112.1 48.7 -69.0 -38.9 20.9 43.9 -22.1 55 54 A S H > S+ 0 0 32 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.943 111.8 48.4 -62.7 -45.7 21.7 41.3 -19.4 56 55 A R H X S+ 0 0 5 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.898 113.3 47.5 -63.8 -42.8 25.4 42.1 -19.6 57 56 A L H X S+ 0 0 34 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.926 111.6 50.5 -60.6 -50.3 24.8 45.8 -19.3 58 57 A A H < S+ 0 0 39 -4,-2.5 4,-0.3 2,-0.2 -2,-0.2 0.879 110.8 48.6 -57.7 -42.5 22.4 45.5 -16.4 59 58 A L H >< S+ 0 0 9 -4,-2.4 3,-2.2 1,-0.2 4,-0.2 0.965 109.0 51.8 -66.0 -48.6 24.8 43.3 -14.4 60 59 A I H >< S+ 0 0 1 -4,-2.2 3,-1.7 1,-0.3 6,-0.2 0.873 103.4 61.2 -52.3 -36.7 27.7 45.7 -14.9 61 60 A S T 3< S+ 0 0 42 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.609 93.0 66.2 -66.3 -14.5 25.4 48.6 -13.7 62 61 A E T < S+ 0 0 28 -3,-2.2 125,-3.1 -4,-0.3 126,-0.4 0.485 77.1 107.6 -89.9 -3.4 25.1 46.8 -10.3 63 62 A L B X S-E 186 0B 0 -3,-1.7 3,-1.9 123,-0.2 123,-0.2 -0.603 72.0-132.7 -80.2 135.2 28.8 47.3 -9.4 64 63 A K T 3 S+ 0 0 84 121,-3.1 -1,-0.1 -2,-0.3 122,-0.1 0.874 105.5 51.1 -48.2 -44.7 29.7 49.8 -6.7 65 64 A V T 3 S+ 0 0 20 120,-0.3 2,-0.7 -34,-0.0 -1,-0.3 0.601 91.2 90.2 -78.8 -8.1 32.4 51.3 -8.8 66 65 A V < + 0 0 1 -3,-1.9 3,-0.1 -6,-0.2 -33,-0.1 -0.752 43.8 175.8 -96.1 119.2 30.3 51.8 -11.9 67 66 A D S S+ 0 0 72 -35,-1.4 2,-0.3 -2,-0.7 -34,-0.2 0.929 71.7 4.5 -83.4 -43.1 28.5 55.2 -12.2 68 67 A R E -c 33 0A 102 -36,-2.2 -34,-3.2 2,-0.0 2,-0.4 -0.999 59.9-164.7-146.1 143.7 27.0 54.7 -15.7 69 68 A A E +c 34 0A 18 -2,-0.3 2,-0.3 -36,-0.2 -34,-0.2 -0.995 12.8 172.7-132.7 135.9 26.8 51.9 -18.2 70 69 A I E -c 35 0A 46 -36,-2.7 -34,-3.2 -2,-0.4 2,-0.3 -0.952 34.8-105.0-136.6 156.3 25.9 52.1 -21.9 71 70 A L E -c 36 0A 32 -2,-0.3 -34,-0.2 -36,-0.2 -36,-0.0 -0.575 41.4-127.0 -74.9 140.9 25.8 49.9 -24.9 72 71 A G - 0 0 7 -36,-2.2 2,-0.6 -2,-0.3 -1,-0.1 -0.073 29.9 -83.4 -78.0-176.5 28.5 50.7 -27.5 73 72 A H > - 0 0 38 3,-0.2 3,-1.8 1,-0.1 2,-0.2 -0.860 39.9-113.6-104.8 124.3 28.2 51.4 -31.2 74 73 A E T 3 S- 0 0 97 -2,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.388 96.2 -20.3 -32.8 -21.8 28.0 48.6 -33.5 75 74 A G T 3 S+ 0 0 74 -2,-0.2 -1,-0.3 1,-0.1 2,-0.2 0.162 116.1 87.9-180.0 46.1 31.3 49.1 -35.3 76 75 A D <> + 0 0 74 -3,-1.8 4,-1.1 1,-0.1 -3,-0.2 -0.698 39.0 174.5-161.7 83.4 32.3 52.7 -34.6 77 76 A M H > S+ 0 0 96 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.902 80.3 58.5 -69.8 -41.5 34.4 53.4 -31.5 78 77 A M H > S+ 0 0 33 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.856 100.0 59.6 -61.9 -32.1 35.1 57.0 -32.2 79 78 A K H > S+ 0 0 95 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.911 106.4 47.6 -60.4 -41.1 31.3 57.6 -32.3 80 79 A T H X S+ 0 0 9 -4,-1.1 4,-2.9 -3,-0.4 3,-0.4 0.942 111.5 50.0 -61.2 -44.0 31.1 56.4 -28.7 81 80 A V H X S+ 0 0 7 -4,-2.4 4,-2.9 1,-0.3 -2,-0.2 0.918 109.1 51.5 -64.0 -43.6 34.0 58.6 -27.7 82 81 A I H < S+ 0 0 84 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.771 115.9 42.9 -57.9 -30.3 32.5 61.7 -29.3 83 82 A E H < S+ 0 0 111 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.872 119.4 39.3 -89.3 -37.5 29.2 60.9 -27.4 84 83 A V H < S- 0 0 8 -4,-2.9 -2,-0.2 -5,-0.1 -3,-0.2 0.839 85.5-159.7 -79.3 -36.0 30.6 60.0 -24.0 85 84 A K < - 0 0 159 -4,-2.9 -81,-0.1 -5,-0.4 -3,-0.1 0.956 18.1-171.7 58.7 53.1 33.3 62.7 -24.1 86 85 A P - 0 0 3 0, 0.0 -81,-0.2 0, 0.0 3,-0.1 -0.366 30.1-145.4 -71.8 155.0 35.5 61.1 -21.4 87 86 A D S S+ 0 0 76 -83,-2.7 27,-2.6 1,-0.3 2,-0.4 0.708 89.7 28.2 -80.6 -31.3 38.6 62.8 -19.9 88 87 A I E -bd 5 114A 16 -84,-2.1 -82,-2.9 25,-0.2 2,-0.5 -0.997 64.6-157.4-137.0 135.1 40.3 59.4 -19.7 89 88 A I E -bd 6 115A 8 25,-3.1 27,-3.2 -2,-0.4 2,-0.5 -0.968 18.9-147.7-112.1 129.5 40.1 56.2 -21.7 90 89 A T E - d 0 116A 0 -84,-2.9 -82,-0.4 -2,-0.5 2,-0.3 -0.834 15.7-177.9-102.4 127.9 41.2 53.1 -19.9 91 90 A L E - d 0 117A 14 25,-2.5 27,-3.2 -2,-0.5 5,-0.0 -0.898 33.4 -98.2-116.3 156.4 42.8 50.0 -21.6 92 91 A G > - 0 0 12 -2,-0.3 3,-1.7 25,-0.2 28,-0.1 -0.276 40.0-106.3 -62.0 156.5 44.0 46.6 -20.1 93 92 A Y T 3 S+ 0 0 110 26,-0.3 3,-0.2 1,-0.3 27,-0.1 0.800 118.5 55.4 -54.4 -36.9 47.8 46.2 -19.3 94 93 A D T 3 S+ 0 0 128 1,-0.2 2,-0.9 2,-0.1 3,-0.4 0.587 86.4 89.1 -73.1 -11.4 48.4 44.0 -22.4 95 94 A Q <> + 0 0 53 -3,-1.7 4,-2.0 1,-0.2 -1,-0.2 -0.244 34.5 130.6 -98.8 49.8 46.9 46.5 -24.9 96 95 A K H > S+ 0 0 91 -2,-0.9 4,-2.2 -3,-0.2 -1,-0.2 0.798 76.8 54.3 -69.8 -25.8 49.9 48.7 -26.0 97 96 A F H > S+ 0 0 148 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.961 109.8 44.3 -72.8 -52.1 49.0 48.2 -29.7 98 97 A D H > S+ 0 0 69 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.865 112.1 57.5 -57.5 -33.8 45.4 49.4 -29.2 99 98 A E H X S+ 0 0 49 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.940 107.8 43.9 -61.4 -51.3 46.9 52.2 -27.1 100 99 A A H X S+ 0 0 59 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.891 114.4 50.7 -61.4 -42.3 49.1 53.5 -29.9 101 100 A E H X S+ 0 0 87 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.908 112.2 45.7 -64.1 -44.2 46.3 53.2 -32.5 102 101 A L H X S+ 0 0 8 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.884 109.8 56.3 -66.1 -38.0 43.8 55.1 -30.3 103 102 A Q H X S+ 0 0 67 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.908 104.5 51.5 -61.6 -43.5 46.5 57.7 -29.6 104 103 A S H X S+ 0 0 80 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.887 109.9 50.4 -60.8 -40.9 47.0 58.4 -33.4 105 104 A K H X S+ 0 0 92 -4,-1.5 4,-2.0 2,-0.2 5,-0.2 0.952 112.3 46.9 -59.6 -48.4 43.2 58.9 -33.8 106 105 A I H X>S+ 0 0 5 -4,-2.4 4,-2.4 1,-0.2 5,-1.2 0.910 113.1 48.9 -55.2 -51.1 43.2 61.4 -30.9 107 106 A N H <5S+ 0 0 105 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.870 109.1 50.8 -63.1 -44.4 46.2 63.3 -32.1 108 107 A K H <5S+ 0 0 199 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.916 117.2 40.4 -59.5 -43.4 44.9 63.6 -35.7 109 108 A L H <5S- 0 0 108 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.815 102.7-136.3 -78.2 -28.1 41.5 65.0 -34.5 110 109 A G T <5 + 0 0 58 -4,-2.4 -3,-0.2 -5,-0.2 2,-0.1 0.800 47.4 152.1 77.9 27.0 43.2 67.1 -31.7 111 110 A I < - 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