==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-FEB-10 2X64 . COMPND 2 MOLECULE: GLUTATHIONE-S-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XYLELLA FASTIDIOSA; . AUTHOR J.R.C.MUNIZ,N.C.RODRIGUES,L.BLEICHER,R.F.TRAVENSOLO,W.GARCIA . 1237 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48244.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 887 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 4.2 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 . 6 0.5 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 . 53 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 156 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 553 44.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 42 3.4 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 11 0 1 0 0 6 5 12 1 0 0 0 12 0 0 0 0 0 0 0 0 0 6 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 3 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 8 4 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 6 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 0 A H 0 0 161 0, 0.0 55,-0.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -49.5 -16.7 -1.1 44.1 2 1 A M E -aB 26 55A 12 23,-0.6 25,-2.7 53,-0.1 2,-0.4 -0.588 360.0-159.6 -74.0 136.9 -13.6 -3.5 43.5 3 2 A K E -aB 27 54A 19 51,-2.4 51,-3.2 -2,-0.3 2,-0.6 -0.980 3.7-157.9-123.2 123.6 -11.1 -3.6 46.4 4 3 A L E -aB 28 53A 0 23,-3.0 25,-2.8 -2,-0.4 2,-0.7 -0.916 11.1-145.1-103.9 120.0 -7.5 -4.8 45.9 5 4 A Y E +aB 29 52A 40 47,-3.0 47,-0.8 -2,-0.6 2,-0.3 -0.788 34.3 175.1 -85.2 111.7 -5.7 -6.0 49.0 6 5 A I E -a 30 0A 0 23,-3.3 25,-2.5 -2,-0.7 5,-0.0 -0.792 36.2-156.1-118.5 165.4 -2.0 -5.0 48.6 7 6 A M > - 0 0 63 -2,-0.3 3,-2.2 23,-0.2 5,-0.2 -0.978 51.5 -96.1-134.8 122.8 1.3 -4.9 50.3 8 7 A P T 3 S- 0 0 58 0, 0.0 3,-0.1 0, 0.0 192,-0.1 -0.269 104.7 -0.1 -52.3 125.0 3.6 -2.2 48.8 9 8 A G T 3 S+ 0 0 15 1,-0.2 160,-0.1 2,-0.0 159,-0.1 0.340 102.9 126.8 79.0 -2.9 6.0 -3.7 46.2 10 9 A A S X S- 0 0 21 -3,-2.2 3,-2.4 1,-0.1 4,-0.3 -0.113 85.5 -84.6 -74.0 177.2 4.6 -7.2 46.6 11 10 A C T > S+ 0 0 12 1,-0.3 3,-1.8 39,-0.2 4,-0.5 0.767 124.7 75.6 -54.0 -27.3 3.3 -9.5 43.7 12 11 A S T 3> S+ 0 0 0 1,-0.3 4,-1.4 2,-0.2 -1,-0.3 0.560 77.4 74.4 -60.4 -14.5 -0.0 -7.6 44.3 13 12 A L H <> S+ 0 0 0 -3,-2.4 4,-2.9 2,-0.2 -1,-0.3 0.795 87.7 61.6 -69.8 -30.2 1.6 -4.6 42.5 14 13 A A H <> S+ 0 0 0 -3,-1.8 4,-2.0 -4,-0.3 -1,-0.2 0.897 106.6 43.3 -61.1 -44.0 1.1 -6.6 39.1 15 14 A D H > S+ 0 0 0 -4,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.858 113.2 53.4 -70.2 -37.3 -2.7 -6.6 39.6 16 15 A H H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.927 109.2 47.6 -61.6 -51.3 -2.5 -2.9 40.7 17 16 A I H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.915 114.3 47.1 -56.8 -49.7 -0.6 -1.9 37.5 18 17 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.893 106.7 56.9 -62.2 -41.4 -3.2 -3.9 35.3 19 18 A L H X>S+ 0 0 0 -4,-2.6 5,-1.0 1,-0.2 4,-0.7 0.868 110.2 46.3 -57.0 -37.6 -6.2 -2.4 37.1 20 19 A R H ><5S+ 0 0 35 -4,-1.6 3,-0.6 -3,-0.2 -1,-0.2 0.896 111.5 50.1 -69.3 -44.6 -4.8 1.1 36.1 21 20 A W H 3<5S+ 0 0 5 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.794 108.0 54.7 -62.5 -34.8 -4.1 -0.1 32.5 22 21 A S H 3<5S- 0 0 2 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.677 104.3-130.5 -73.2 -22.4 -7.8 -1.4 32.3 23 22 A G T <<5 + 0 0 18 -4,-0.7 -3,-0.2 -3,-0.6 -2,-0.1 0.515 54.2 152.9 79.4 8.7 -9.2 2.0 33.3 24 23 A S < - 0 0 21 -5,-1.0 2,-0.4 1,-0.1 -1,-0.3 -0.347 49.8-114.3 -70.4 149.1 -11.4 0.2 36.0 25 24 A S + 0 0 43 -2,-0.1 -23,-0.6 1055,-0.0 2,-0.3 -0.696 51.1 156.4 -83.1 130.2 -12.6 1.9 39.2 26 25 A F E -a 2 0A 35 -2,-0.4 2,-0.3 -25,-0.1 -23,-0.2 -0.991 36.4-135.1-156.8 158.9 -11.0 0.4 42.3 27 26 A D E -a 3 0A 97 -25,-2.7 -23,-3.0 -2,-0.3 2,-0.4 -0.864 21.6-134.9-114.7 147.2 -10.0 0.8 45.9 28 27 A L E -a 4 0A 45 -2,-0.3 2,-0.5 -25,-0.2 -23,-0.2 -0.853 9.6-160.5-103.9 142.4 -6.7 -0.2 47.5 29 28 A Q E -a 5 0A 24 -25,-2.8 -23,-3.3 -2,-0.4 2,-0.4 -0.979 15.3-145.0-123.6 110.6 -6.5 -2.0 50.8 30 29 A F E -a 6 0A 109 -2,-0.5 2,-0.3 -25,-0.2 -23,-0.2 -0.676 20.9-175.8 -83.5 128.8 -3.0 -1.7 52.4 31 30 A L - 0 0 20 -25,-2.5 2,-0.2 -2,-0.4 19,-0.0 -0.829 14.6-151.6-123.1 160.4 -1.7 -4.7 54.5 32 31 A D > - 0 0 104 -2,-0.3 4,-1.8 -25,-0.1 5,-0.2 -0.699 41.3-102.6-114.9 171.8 1.4 -5.6 56.6 33 32 A H T 4 S+ 0 0 72 -2,-0.2 4,-0.3 1,-0.2 -26,-0.0 0.679 130.0 44.4 -69.4 -16.1 3.0 -9.1 57.3 34 33 A Q T >4 S+ 0 0 76 2,-0.1 3,-0.7 3,-0.1 4,-0.2 0.882 110.7 49.1 -90.2 -52.1 1.1 -8.6 60.6 35 34 A S T 34 S+ 0 0 35 1,-0.2 3,-0.5 2,-0.2 6,-0.4 0.718 106.0 58.9 -64.5 -24.2 -2.3 -7.4 59.3 36 35 A M T 3< S+ 0 0 26 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.1 0.802 106.5 48.1 -70.0 -34.9 -2.4 -10.2 56.7 37 36 A K S < S+ 0 0 96 -3,-0.7 -1,-0.2 -4,-0.3 -2,-0.2 0.385 90.4 108.9 -87.0 -0.3 -2.2 -12.8 59.6 38 37 A A S > S- 0 0 35 -3,-0.5 4,-2.0 -4,-0.2 3,-0.5 -0.452 81.9-116.7 -74.8 148.9 -5.0 -10.9 61.5 39 38 A P H > S+ 0 0 112 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.749 109.4 63.9 -61.8 -25.9 -8.5 -12.7 61.7 40 39 A E H 4 S+ 0 0 82 2,-0.2 4,-0.4 1,-0.2 3,-0.2 0.917 113.1 32.5 -62.2 -47.5 -10.3 -9.9 59.7 41 40 A Y H >> S+ 0 0 7 -3,-0.5 4,-3.1 -6,-0.4 3,-0.8 0.813 112.8 62.3 -79.5 -32.2 -8.3 -10.6 56.5 42 41 A L H 3< S+ 0 0 59 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.713 98.0 59.2 -64.7 -20.6 -8.0 -14.4 57.3 43 42 A A T 3< S+ 0 0 83 -4,-1.0 -1,-0.2 -3,-0.2 -2,-0.2 0.799 113.7 36.9 -74.5 -31.6 -11.8 -14.5 57.0 44 43 A L T <4 S+ 0 0 54 -3,-0.8 -2,-0.2 -4,-0.4 -3,-0.1 0.906 137.6 15.9 -84.0 -51.8 -11.5 -13.2 53.4 45 44 A N >< - 0 0 6 -4,-3.1 3,-1.6 -9,-0.1 -1,-0.3 -0.915 62.3-171.1-127.1 101.7 -8.3 -15.1 52.5 46 45 A P T 3 S+ 0 0 94 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.741 85.2 69.6 -63.9 -21.5 -7.4 -18.1 54.8 47 46 A S T 3 S- 0 0 46 2,-0.1 3,-0.1 1,-0.0 -5,-0.1 0.648 99.5-138.3 -68.1 -17.0 -4.0 -18.5 53.0 48 47 A G < + 0 0 8 -3,-1.6 2,-0.3 1,-0.2 -12,-0.1 0.863 59.7 117.1 58.3 44.6 -3.0 -15.1 54.7 49 48 A A - 0 0 41 2,-0.1 -1,-0.2 -4,-0.1 -2,-0.1 -0.964 58.2 -88.8-139.2 152.7 -1.3 -13.8 51.5 50 49 A V S S+ 0 0 18 -2,-0.3 -39,-0.2 -3,-0.1 -44,-0.1 -0.732 81.7 61.8 -99.2 153.1 -1.7 -10.9 49.0 51 50 A P + 0 0 4 0, 0.0 2,-0.3 0, 0.0 -45,-0.1 0.514 55.1 157.8 -81.8 164.6 -3.2 -10.3 46.4 52 51 A A E -B 5 0A 0 -47,-0.8 -47,-3.0 -2,-0.1 2,-0.5 -0.968 22.4-159.2-144.2 132.1 -6.9 -10.6 47.1 53 52 A L E -BC 4 60A 0 7,-3.0 7,-3.0 -2,-0.3 2,-0.6 -0.980 6.5-158.0-117.2 116.2 -9.5 -8.9 44.9 54 53 A Q E +BC 3 59A 41 -51,-3.2 -51,-2.4 -2,-0.5 2,-0.6 -0.860 11.9 179.8 -97.2 121.4 -12.9 -8.3 46.5 55 54 A V E > S-BC 2 58A 25 3,-2.9 3,-1.6 -2,-0.6 2,-0.4 -0.931 70.2 -54.4-120.5 94.7 -15.8 -7.8 44.0 56 55 A G T 3 S- 0 0 35 -2,-0.6 -53,-0.1 -55,-0.5 -2,-0.0 -0.568 121.9 -19.0 72.8-119.0 -18.9 -7.3 46.2 57 56 A D T 3 S+ 0 0 166 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.3 0.624 119.7 97.7 -89.4 -22.2 -19.0 -10.3 48.6 58 57 A W E < -C 55 0A 47 -3,-1.6 -3,-2.9 1,-0.0 2,-0.5 -0.580 57.4-160.9 -77.0 129.0 -16.7 -12.4 46.4 59 58 A V E -C 54 0A 18 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.959 2.8-165.9-112.9 119.1 -13.0 -12.6 47.2 60 59 A L E -C 53 0A 0 -7,-3.0 -7,-3.0 -2,-0.5 239,-0.1 -0.871 7.8-178.9-103.5 132.9 -10.7 -13.8 44.4 61 60 A T + 0 0 20 -2,-0.4 2,-0.5 -9,-0.2 -1,-0.1 0.556 40.3 91.0-117.9 -8.1 -7.2 -14.8 45.5 62 61 A Q > - 0 0 24 236,-0.2 4,-3.9 1,-0.1 5,-0.3 -0.822 59.8-142.1-100.9 135.1 -4.7 -15.8 42.9 63 62 A N H > S+ 0 0 7 -2,-0.5 4,-2.9 1,-0.2 5,-0.2 0.896 109.3 44.9 -44.2 -51.3 -2.3 -13.4 41.0 64 63 A A H > S+ 0 0 14 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.858 117.3 45.0 -62.4 -41.5 -2.9 -15.4 37.8 65 64 A A H > S+ 0 0 0 2,-0.2 4,-2.3 236,-0.2 -2,-0.2 0.904 115.1 47.2 -70.2 -43.9 -6.7 -15.6 38.4 66 65 A I H X S+ 0 0 0 -4,-3.9 4,-2.8 2,-0.2 -2,-0.2 0.929 112.3 49.5 -63.5 -48.0 -6.9 -11.8 39.4 67 66 A L H X S+ 0 0 0 -4,-2.9 4,-2.1 -5,-0.3 -1,-0.2 0.886 114.1 46.1 -58.6 -42.7 -4.8 -10.8 36.3 68 67 A N H X S+ 0 0 6 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.877 111.8 51.0 -69.0 -37.7 -7.1 -12.9 34.0 69 68 A Y H X S+ 0 0 26 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.935 110.6 48.1 -63.6 -48.7 -10.2 -11.5 35.7 70 69 A I H X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.2 3,-0.2 0.914 113.0 49.6 -57.1 -45.4 -9.0 -7.8 35.2 71 70 A T H < S+ 0 0 1 -4,-2.1 3,-0.3 1,-0.2 -2,-0.2 0.908 109.8 51.6 -58.1 -46.9 -8.2 -8.7 31.5 72 71 A D H < S+ 0 0 36 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.791 114.1 41.8 -60.7 -36.4 -11.7 -10.3 31.0 73 72 A I H < S+ 0 0 52 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.641 91.9 104.1 -87.5 -19.7 -13.6 -7.2 32.4 74 73 A A S < S- 0 0 14 -4,-1.4 -51,-0.1 -3,-0.3 2,-0.1 -0.386 82.8-104.9 -66.0 137.2 -11.4 -4.6 30.6 75 74 A P > - 0 0 58 0, 0.0 3,-2.4 0, 0.0 5,-0.3 -0.412 28.5-119.5 -63.1 139.5 -12.9 -2.9 27.5 76 75 A A G > S+ 0 0 88 1,-0.3 3,-1.9 2,-0.2 5,-0.2 0.777 110.7 68.7 -48.9 -34.3 -11.4 -4.3 24.2 77 76 A E G 3 S+ 0 0 89 1,-0.3 -1,-0.3 2,-0.1 900,-0.0 0.697 86.0 68.9 -60.2 -21.4 -10.1 -0.8 23.3 78 77 A R G < S- 0 0 78 -3,-2.4 -1,-0.3 -56,-0.1 -2,-0.2 0.659 98.8-140.2 -71.1 -18.3 -7.6 -1.0 26.3 79 78 A G < + 0 0 12 -3,-1.9 3,-0.3 -4,-0.3 -2,-0.1 0.767 60.3 130.7 61.7 37.0 -5.8 -3.7 24.3 80 79 A L S S+ 0 0 4 -5,-0.3 78,-0.4 1,-0.2 3,-0.1 0.479 71.3 49.2 -95.3 -4.2 -5.0 -6.0 27.2 81 80 A S S > S- 0 0 27 1,-0.4 3,-1.9 -5,-0.2 -1,-0.2 0.131 99.5-136.9-115.2 12.7 -6.3 -9.2 25.5 82 81 A G T 3 S- 0 0 17 -3,-0.3 -1,-0.4 1,-0.3 -3,-0.1 -0.446 77.9 -16.2 64.2-131.6 -4.3 -8.7 22.2 83 82 A D T 3 S- 0 0 67 -2,-0.1 -1,-0.3 -3,-0.1 -7,-0.0 0.433 97.0-114.9 -79.6 -0.3 -6.6 -9.5 19.2 84 83 A G S < S+ 0 0 51 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.442 71.4 135.0 80.1 5.1 -8.9 -11.3 21.7 85 84 A S S > S- 0 0 34 -4,-0.1 4,-2.0 1,-0.1 -1,-0.2 -0.248 71.1-108.3 -77.3 170.2 -8.4 -14.7 20.2 86 85 A L H > S+ 0 0 39 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.873 122.8 51.5 -65.8 -39.6 -7.7 -18.0 22.2 87 86 A K H > S+ 0 0 35 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.867 108.8 52.1 -62.1 -41.0 -4.1 -18.0 21.0 88 87 A A H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.899 112.1 45.2 -63.2 -42.8 -3.8 -14.3 22.2 89 88 A R H X S+ 0 0 21 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.835 111.5 53.4 -70.2 -31.4 -5.1 -15.3 25.6 90 89 A A H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.845 106.9 51.8 -70.2 -35.7 -2.8 -18.3 25.7 91 90 A E H X S+ 0 0 20 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.891 112.0 45.7 -68.6 -41.3 0.3 -16.1 24.9 92 91 A I H X S+ 0 0 1 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.950 113.9 50.7 -64.4 -48.1 -0.7 -13.8 27.9 93 92 A N H X S+ 0 0 13 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.823 106.4 53.0 -58.6 -40.7 -1.3 -16.9 30.1 94 93 A R H X S+ 0 0 37 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.892 113.8 42.9 -65.3 -40.1 2.1 -18.6 29.2 95 94 A W H X S+ 0 0 27 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.826 113.1 51.8 -76.7 -30.6 4.0 -15.4 30.2 96 95 A I H X S+ 0 0 3 -4,-2.3 4,-2.9 2,-0.2 3,-0.2 0.947 112.1 47.8 -65.6 -47.4 1.8 -14.9 33.4 97 96 A A H X>S+ 0 0 2 -4,-2.7 4,-3.1 1,-0.2 5,-0.6 0.804 105.0 60.2 -62.7 -32.6 2.6 -18.6 34.3 98 97 A F H X>S+ 0 0 8 -4,-1.5 5,-2.5 2,-0.2 4,-1.2 0.932 114.8 33.6 -60.8 -48.9 6.4 -17.9 33.7 99 98 A S H <>S+ 0 0 0 -4,-1.5 5,-3.6 3,-0.2 -2,-0.2 0.931 123.2 48.3 -72.2 -43.1 6.5 -15.2 36.4 100 99 A N H <5S+ 0 0 6 -4,-2.9 -2,-0.2 3,-0.2 -3,-0.2 0.863 128.2 16.4 -63.5 -50.0 3.9 -16.9 38.6 101 100 A S H <5S+ 0 0 7 -4,-3.1 -3,-0.2 -5,-0.1 -1,-0.2 0.549 135.0 31.2-109.1 -12.9 5.3 -20.5 38.7 102 101 A D T X>44 S+ 0 0 5 0, 0.0 3,-1.5 0, 0.0 4,-0.3 0.793 100.5 66.0 -65.5 -22.4 8.9 -19.4 43.6 106 105 A M H << S+ 0 0 34 -3,-0.9 3,-0.4 -4,-0.6 4,-0.2 0.680 93.9 62.5 -68.7 -15.1 12.7 -19.0 42.9 107 106 A Y T XX S+ 0 0 2 -3,-1.8 3,-0.8 -4,-0.5 4,-0.7 0.554 75.4 94.1 -84.5 -10.4 12.5 -15.9 45.2 108 107 A W G X4>S+ 0 0 77 -3,-1.5 5,-2.6 1,-0.3 3,-1.0 0.867 85.7 46.9 -50.4 -45.8 11.5 -18.0 48.2 109 108 A A G >45S+ 0 0 12 -3,-0.4 3,-0.7 -4,-0.3 5,-0.4 0.756 110.2 54.5 -67.6 -29.4 15.1 -18.5 49.5 110 109 A L G <45S+ 0 0 18 -3,-0.8 -1,-0.2 -4,-0.2 -2,-0.2 0.503 107.5 51.0 -83.7 -7.6 15.8 -14.7 49.0 111 110 A F G <<5S- 0 0 123 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.2 -0.151 131.6 -84.2-124.5 38.0 12.8 -13.8 51.2 112 111 A G T X 5S+ 0 0 51 -3,-0.7 3,-1.3 11,-0.1 -3,-0.2 0.501 88.9 130.2 74.6 13.9 13.6 -16.0 54.2 113 112 A G T 3 + 0 0 15 -5,-0.4 3,-1.8 -6,-0.2 4,-0.3 0.119 69.9 113.4-107.5 20.4 15.3 -21.3 53.7 115 114 A A G X + 0 0 56 -3,-1.3 3,-1.9 1,-0.3 -1,-0.1 0.797 64.9 73.2 -60.8 -28.7 15.7 -20.1 57.4 116 115 A Y G 3 S+ 0 0 49 1,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.670 80.7 72.6 -57.5 -24.0 14.9 -23.8 58.4 117 116 A L G < S- 0 0 0 -3,-1.8 2,-2.2 1,-0.2 -1,-0.3 0.779 80.3-168.5 -61.8 -29.0 18.5 -24.7 57.2 118 117 A Q < + 0 0 141 -3,-1.9 -1,-0.2 -4,-0.3 -2,-0.1 -0.265 51.3 104.3 69.5 -46.8 19.8 -22.8 60.3 119 118 A D > - 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