==== 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 ISOMERASE/TRANSFERASE 20-SEP-00 1FW1 . COMPND 2 MOLECULE: GLUTATHIONE TRANSFERASE ZETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.POLEKHINA,P.G.BOARD,A.C.BLACKBURN,M.W.PARKER . 208 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10443.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 148 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 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 . 9 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 42.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.9 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 1 1 0 0 0 2 1 0 0 1 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 5 A K 0 0 180 0, 0.0 26,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 124.0 46.2 40.3 24.1 2 6 A P - 0 0 22 0, 0.0 26,-3.3 0, 0.0 2,-0.5 -0.363 360.0-145.9 -65.2 139.2 44.3 39.3 21.0 3 7 A I E -aB 28 59A 35 56,-1.9 56,-3.3 24,-0.2 2,-0.5 -0.914 11.6-167.6-108.7 124.1 41.3 37.0 21.5 4 8 A L E -aB 29 58A 0 24,-3.1 26,-2.4 -2,-0.5 2,-0.7 -0.930 12.0-150.4-110.7 122.3 40.4 34.4 18.9 5 9 A Y E +aB 30 57A 29 52,-2.7 52,-0.9 -2,-0.5 2,-0.3 -0.819 39.4 155.5 -89.3 121.2 37.1 32.6 19.1 6 10 A S E -a 31 0A 2 24,-1.4 26,-2.2 -2,-0.7 2,-0.4 -0.918 44.5-140.8-143.9 164.7 37.8 29.2 17.5 7 11 A Y > - 0 0 18 -2,-0.3 3,-2.5 24,-0.2 6,-0.2 -0.997 26.6-133.7-126.9 125.4 36.8 25.5 17.3 8 12 A F T 3 S+ 0 0 29 -2,-0.4 194,-0.1 1,-0.3 -1,-0.1 0.756 103.8 45.3 -51.6 -28.0 39.7 23.1 17.1 9 13 A R T 3 S+ 0 0 105 192,-0.1 2,-0.5 190,-0.0 -1,-0.3 0.176 86.5 107.9-103.8 16.5 38.1 21.2 14.2 10 14 A S <> - 0 0 15 -3,-2.5 4,-2.0 1,-0.2 3,-0.2 -0.836 57.0-152.6 -99.7 129.9 37.0 24.1 12.1 11 15 A S H > S+ 0 0 8 -2,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.924 95.6 57.6 -65.0 -40.0 38.9 24.7 8.9 12 16 A C H > S+ 0 0 20 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.834 108.1 46.2 -59.1 -35.8 38.0 28.4 8.9 13 17 A S H > S+ 0 0 0 -6,-0.2 4,-2.4 1,-0.2 3,-0.4 0.902 105.3 59.3 -73.9 -42.2 39.6 28.9 12.3 14 18 A W H X S+ 0 0 7 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.906 99.4 59.6 -55.0 -38.0 42.7 26.9 11.4 15 19 A R H X S+ 0 0 5 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.919 109.6 42.2 -55.4 -46.0 43.3 29.5 8.6 16 20 A V H X S+ 0 0 0 -4,-1.0 4,-2.4 -3,-0.4 5,-0.2 0.904 110.0 56.5 -70.7 -39.0 43.5 32.3 11.1 17 21 A R H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.908 106.6 51.4 -58.4 -40.7 45.6 30.3 13.6 18 22 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 5,-0.2 0.956 110.5 48.2 -61.5 -45.8 48.2 29.8 10.9 19 23 A A H X S+ 0 0 0 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.874 109.7 51.5 -63.4 -37.8 48.3 33.5 10.1 20 24 A L H <>S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 4,-0.3 0.921 112.5 47.2 -66.1 -39.0 48.6 34.5 13.8 21 25 A A H ><5S+ 0 0 34 -4,-2.2 3,-1.3 -5,-0.2 -2,-0.2 0.916 111.2 49.5 -68.8 -44.1 51.5 32.0 14.1 22 26 A L H 3<5S+ 0 0 43 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.878 113.2 48.0 -61.8 -37.2 53.3 33.2 11.0 23 27 A K T 3<5S- 0 0 17 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.500 109.6-126.5 -80.6 -3.2 52.9 36.8 12.2 24 28 A G T < 5 + 0 0 63 -3,-1.3 2,-0.6 -4,-0.3 -3,-0.2 0.861 54.5 154.7 61.6 35.2 54.3 35.8 15.6 25 29 A I < - 0 0 23 -5,-2.6 2,-0.3 -6,-0.2 -1,-0.2 -0.858 38.8-137.6 -99.9 123.0 51.2 37.3 17.3 26 30 A D + 0 0 142 -2,-0.6 2,-0.3 -3,-0.1 -5,-0.0 -0.587 31.6 176.3 -78.6 135.8 50.4 35.8 20.7 27 31 A Y - 0 0 47 -2,-0.3 2,-0.4 -26,-0.1 -24,-0.2 -0.985 30.7-125.1-144.0 156.4 46.7 35.3 21.3 28 32 A K E -a 3 0A 109 -26,-3.3 -24,-3.1 -2,-0.3 2,-0.4 -0.765 26.5-140.8 -95.8 139.1 44.2 33.9 23.7 29 33 A T E -a 4 0A 30 -2,-0.4 -24,-0.2 -26,-0.2 -26,-0.0 -0.832 14.5-172.0-102.1 137.7 41.8 31.2 22.5 30 34 A V E -a 5 0A 45 -26,-2.4 -24,-1.4 -2,-0.4 2,-0.1 -0.942 25.5-142.5-125.0 101.9 38.1 31.1 23.5 31 35 A P E -a 6 0A 54 0, 0.0 2,-0.5 0, 0.0 -24,-0.2 -0.394 13.3-163.3 -71.3 142.9 36.8 27.8 22.2 32 36 A I - 0 0 10 -26,-2.2 2,-0.7 -2,-0.1 9,-0.1 -0.956 18.3-139.4-127.6 106.1 33.3 27.6 20.8 33 37 A N - 0 0 25 -2,-0.5 7,-2.4 1,-0.2 8,-0.4 -0.569 14.9-167.9 -71.0 111.5 32.1 24.0 20.6 34 38 A L S S+ 0 0 25 -2,-0.7 -1,-0.2 5,-0.2 4,-0.1 0.581 77.5 42.2 -79.5 -8.8 30.3 23.7 17.3 35 39 A I S > S+ 0 0 95 2,-0.1 2,-0.8 1,-0.1 3,-0.8 0.761 80.0 97.3-111.0 -27.6 28.8 20.3 17.9 36 40 A K T 3 S- 0 0 145 1,-0.2 3,-0.2 2,-0.2 -3,-0.1 -0.540 109.7 -28.2 -72.4 103.6 27.5 20.0 21.5 37 41 A D T 3 S- 0 0 167 -2,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.832 134.2 -33.3 64.1 41.3 23.7 20.6 21.6 38 42 A G S < S- 0 0 28 -3,-0.8 -1,-0.3 -4,-0.1 3,-0.3 0.305 108.9-108.7 92.6 -5.1 23.5 23.0 18.6 39 43 A G > - 0 0 9 -3,-0.2 3,-1.2 -4,-0.2 -5,-0.2 0.212 34.4 -74.8 65.7 165.5 26.9 24.0 19.9 40 44 A Q G > S+ 0 0 74 -7,-2.4 3,-0.8 1,-0.2 6,-0.4 0.558 115.4 86.9 -73.7 -7.6 27.8 27.2 21.5 41 45 A Q G 3 S+ 0 0 12 -8,-0.4 -1,-0.2 -3,-0.3 -2,-0.1 0.637 96.1 42.8 -68.4 -8.5 27.6 29.0 18.2 42 46 A F G < S+ 0 0 86 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.485 84.2 116.6-111.3 -8.2 23.9 29.4 18.9 43 47 A S S <> S- 0 0 43 -3,-0.8 4,-2.1 -4,-0.2 5,-0.2 -0.264 81.1-110.0 -58.2 152.3 24.0 30.3 22.6 44 48 A K H > S+ 0 0 187 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.787 114.9 52.8 -55.0 -31.5 22.7 33.8 23.2 45 49 A D H > S+ 0 0 128 2,-0.2 4,-1.0 1,-0.2 3,-0.2 0.922 108.2 43.9 -75.2 -49.4 26.1 35.1 24.0 46 50 A F H >> S+ 0 0 7 -6,-0.4 4,-3.2 1,-0.2 3,-0.8 0.911 110.7 57.9 -64.8 -37.7 28.1 34.0 21.0 47 51 A Q H 3< S+ 0 0 76 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.841 104.4 51.1 -60.2 -32.8 25.3 35.2 18.8 48 52 A A H 3< S+ 0 0 86 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.720 113.2 46.3 -77.1 -21.3 25.6 38.7 20.2 49 53 A L H << S+ 0 0 33 -4,-1.0 -2,-0.2 -3,-0.8 -1,-0.1 0.929 133.7 12.1 -82.1 -52.7 29.4 38.5 19.5 50 54 A N >< - 0 0 6 -4,-3.2 3,-2.3 -5,-0.1 -1,-0.3 -0.913 65.2-164.1-127.6 103.8 29.0 37.2 15.9 51 55 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.702 90.8 63.1 -60.6 -20.0 25.4 37.3 14.5 52 56 A M T 3 S- 0 0 116 2,-0.1 3,-0.1 -5,-0.0 -5,-0.1 0.570 103.4-135.9 -78.9 -9.7 26.4 34.9 11.7 53 57 A K < + 0 0 63 -3,-2.3 2,-0.3 -7,-0.2 -12,-0.1 0.937 60.5 116.9 56.1 54.3 27.1 32.3 14.5 54 58 A Q - 0 0 62 -8,-0.1 -1,-0.2 -4,-0.1 -2,-0.1 -0.943 57.0 -93.2-144.4 160.7 30.3 31.1 13.1 55 59 A V S S+ 0 0 12 -2,-0.3 -42,-0.2 -3,-0.1 -43,-0.2 -0.931 80.3 60.5-116.6 153.8 34.0 31.0 14.1 56 60 A P + 0 0 5 0, 0.0 11,-0.8 0, 0.0 2,-0.4 0.376 51.9 155.7 -89.3 160.2 36.4 32.5 13.7 57 61 A T E -BC 5 66A 0 -52,-0.9 -52,-2.7 9,-0.2 2,-0.4 -0.973 24.6-155.5-135.1 137.9 35.9 36.0 15.2 58 62 A L E -BC 4 65A 0 7,-2.9 7,-2.3 -2,-0.4 2,-0.6 -0.978 9.5-158.0-125.2 130.1 39.0 37.9 16.3 59 63 A K E +BC 3 64A 80 -56,-3.3 -56,-1.9 -2,-0.4 2,-0.3 -0.912 35.9 144.1-101.6 124.6 39.2 40.7 18.9 60 64 A I E > + C 0 63A 5 3,-2.1 3,-3.1 -2,-0.6 -2,-0.1 -0.981 57.2 9.1-159.7 149.7 42.4 42.8 18.3 61 65 A D T 3 S- 0 0 87 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.739 130.0 -58.5 47.2 27.3 43.4 46.4 18.5 62 66 A G T 3 S+ 0 0 81 1,-0.3 -1,-0.3 0, 0.0 2,-0.3 0.622 117.1 96.6 84.9 10.0 40.2 47.1 20.3 63 67 A I E < -C 60 0A 80 -3,-3.1 -3,-2.1 2,-0.0 2,-0.5 -0.864 66.1-127.3-129.8 167.7 37.8 45.9 17.5 64 68 A T E -C 59 0A 65 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.954 25.3-172.2-117.0 128.2 36.0 42.7 16.6 65 69 A I E -C 58 0A 23 -7,-2.3 -7,-2.9 -2,-0.5 2,-0.2 -0.987 5.4-171.0-127.2 129.7 36.4 41.2 13.2 66 70 A H E +C 57 0A 53 -2,-0.4 -9,-0.2 -9,-0.2 -11,-0.1 -0.703 51.6 65.1-107.9 164.0 34.5 38.3 11.6 67 71 A Q S > S- 0 0 113 -11,-0.8 4,-2.5 -2,-0.2 5,-0.2 0.769 72.5-125.4 84.2 106.4 35.4 36.5 8.3 68 72 A S H > S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.853 107.7 44.0 -48.6 -45.8 38.6 34.6 8.1 69 73 A L H > S+ 0 0 25 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.889 111.1 52.6 -72.9 -37.4 40.0 36.3 5.1 70 74 A A H > S+ 0 0 53 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.886 113.3 47.4 -62.0 -32.5 39.0 39.8 6.2 71 75 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.942 111.4 49.4 -72.9 -47.9 40.8 39.0 9.5 72 76 A I H X S+ 0 0 2 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.938 111.7 47.9 -61.2 -42.1 43.9 37.6 7.7 73 77 A E H X S+ 0 0 37 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.866 108.4 55.7 -67.2 -30.1 44.1 40.7 5.4 74 78 A Y H X S+ 0 0 53 -4,-1.6 4,-2.0 -5,-0.3 -1,-0.2 0.940 109.7 46.2 -63.1 -42.5 43.7 42.9 8.5 75 79 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.836 109.8 54.0 -66.0 -36.4 46.7 41.2 10.0 76 80 A E H < S+ 0 0 22 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.913 113.1 43.0 -65.6 -41.3 48.7 41.5 6.8 77 81 A E H < S+ 0 0 139 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.802 120.6 40.0 -74.7 -31.5 48.1 45.3 6.7 78 82 A T H < S+ 0 0 55 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.791 126.3 31.1 -91.6 -27.1 48.8 45.9 10.4 79 83 A R S < S- 0 0 69 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.779 74.8-179.0-126.1 81.4 51.8 43.5 10.9 80 84 A P + 0 0 78 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.814 41.9 101.6 -51.9 -42.3 53.4 43.6 7.5 81 85 A T S S+ 0 0 120 1,-0.1 2,-0.1 2,-0.1 3,-0.0 -0.809 76.9 26.8-106.4 136.1 56.3 41.2 8.2 82 86 A P S S- 0 0 64 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.639 99.5-132.8 -78.8 147.2 56.6 38.4 7.4 83 87 A R - 0 0 100 1,-0.1 -2,-0.1 -2,-0.1 72,-0.1 -0.410 25.5-172.2 -74.2 143.5 54.2 39.0 4.4 84 88 A L S S+ 0 0 4 -4,-0.2 73,-2.2 -2,-0.1 74,-0.3 0.350 77.1 55.9-108.9 -4.1 51.3 36.7 3.5 85 89 A L S S- 0 0 5 71,-0.2 7,-0.1 72,-0.1 -1,-0.1 -0.985 85.4-121.1-127.9 139.9 50.7 38.5 0.2 86 90 A P - 0 0 10 0, 0.0 -2,-0.1 0, 0.0 70,-0.0 -0.207 19.5-121.3 -72.6 180.0 53.1 39.1 -2.6 87 91 A Q S S+ 0 0 139 -4,-0.1 5,-0.0 4,-0.0 3,-0.0 0.861 86.4 82.9 -84.8 -44.9 54.0 42.5 -3.9 88 92 A D S >> S- 0 0 52 1,-0.1 4,-2.3 2,-0.0 3,-0.9 -0.512 75.1-137.9 -70.1 122.7 53.0 42.2 -7.5 89 93 A P H 3> S+ 0 0 97 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.782 101.8 54.4 -49.0 -35.7 49.3 42.9 -8.1 90 94 A K H 3> S+ 0 0 172 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.864 111.0 44.9 -70.3 -35.8 48.9 40.0 -10.6 91 95 A K H <> S+ 0 0 113 -3,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.861 110.4 55.5 -75.4 -29.8 50.4 37.5 -8.1 92 96 A R H X S+ 0 0 66 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.884 105.3 53.3 -68.6 -32.1 48.1 39.1 -5.4 93 97 A A H X S+ 0 0 59 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.2 0.900 106.3 51.5 -71.2 -34.8 45.2 38.3 -7.7 94 98 A S H X S+ 0 0 27 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.934 111.3 48.8 -63.8 -44.7 46.2 34.7 -7.9 95 99 A V H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.948 114.9 44.1 -59.2 -47.7 46.4 34.5 -4.1 96 100 A R H X S+ 0 0 82 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.875 112.4 51.6 -67.2 -37.9 43.0 36.1 -3.7 97 101 A M H X S+ 0 0 91 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.929 113.2 44.1 -64.7 -47.0 41.4 34.0 -6.4 98 102 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 5,-0.2 0.935 114.4 50.7 -64.7 -42.1 42.6 30.7 -4.9 99 103 A S H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.2 5,-0.3 0.932 113.1 45.0 -59.5 -47.2 41.7 31.9 -1.4 100 104 A D H X>S+ 0 0 96 -4,-2.9 4,-2.4 1,-0.2 5,-1.0 0.841 108.4 57.6 -67.7 -34.4 38.1 32.9 -2.5 101 105 A L H X5S+ 0 0 35 -4,-2.2 4,-1.1 -5,-0.2 5,-0.3 0.954 116.5 34.4 -60.4 -49.9 37.7 29.7 -4.5 102 106 A I H X>S+ 0 0 0 -4,-2.3 5,-2.4 3,-0.2 4,-1.6 0.994 125.9 38.8 -67.2 -58.9 38.3 27.6 -1.3 103 107 A A H <5S+ 0 0 18 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.706 133.4 21.7 -68.4 -25.1 36.7 29.9 1.3 104 108 A G H <5S+ 0 0 54 -4,-2.4 -3,-0.2 -5,-0.3 -1,-0.2 0.601 129.4 40.8-115.9 -22.1 33.7 31.0 -0.7 105 109 A G H <X5S+ 0 0 0 -4,-1.6 3,-1.0 -5,-0.3 4,-0.7 0.619 117.8 52.7-125.7 -61.9 34.0 25.0 -1.5 107 111 A Q G >44 S+ 0 0 46 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.833 102.9 54.7 -53.0 -36.5 30.4 27.0 2.4 109 113 A L G <4 S+ 0 0 82 -3,-1.0 -2,-0.2 1,-0.2 21,-0.1 0.678 115.1 37.8 -73.2 -17.3 28.9 24.0 0.7 110 114 A Q G << S+ 0 0 5 -3,-1.8 -1,-0.2 -4,-0.7 -3,-0.1 0.188 86.1 133.4-117.0 16.4 30.2 21.5 3.2 111 115 A N X> - 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