==== 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 TRANSFERASE 02-JUL-02 1M4D . COMPND 2 MOLECULE: AMINOGLYCOSIDE 2'-N-ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR M.W.VETTING,S.S.HEGDE,F.JAVID-MAJD,J.S.BLANCHARD,S.L.RODERIC . 357 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15969.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 261 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 24.6 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 1.7 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 . 35 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 20.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 3 0 0 0 0 0 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 PARALLEL BRIDGES PER LADDER . 0 4 0 4 2 0 2 0 0 0 2 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 0 0 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 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 M 0 0 204 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 120.8 14.9 62.5 31.2 2 2 A H - 0 0 119 1,-0.1 0, 0.0 3,-0.0 0, 0.0 -0.150 360.0 -87.4 -78.1 178.1 16.3 62.6 27.7 3 3 A T - 0 0 121 1,-0.1 -1,-0.1 2,-0.0 0, 0.0 0.572 46.6-132.5 -63.3 -16.3 14.4 61.6 24.6 4 4 A Q > - 0 0 64 1,-0.2 3,-2.3 2,-0.1 -1,-0.1 0.654 36.5-179.1 71.2 21.8 15.3 57.9 24.8 5 5 A V T 3 - 0 0 95 1,-0.3 -1,-0.2 47,-0.1 3,-0.1 -0.278 67.1 -5.1 -62.9 128.9 16.3 57.8 21.1 6 6 A H T 3 S+ 0 0 46 47,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.544 92.6 136.7 62.7 11.3 17.4 54.3 20.1 7 7 A T < - 0 0 69 -3,-2.3 46,-0.3 46,-0.1 -1,-0.2 -0.752 63.7-111.7 -78.3 135.7 17.2 52.9 23.6 8 8 A A - 0 0 14 -2,-0.5 2,-0.4 90,-0.3 44,-0.2 -0.424 28.7-147.4 -71.2 139.9 15.5 49.5 23.3 9 9 A R E -A 51 0A 134 42,-2.9 42,-2.6 -2,-0.1 2,-0.6 -0.872 8.9-134.7-108.6 137.2 12.0 49.4 24.8 10 10 A L E +A 50 0A 40 -2,-0.4 2,-0.4 40,-0.2 40,-0.2 -0.795 29.0 170.8 -97.3 125.6 10.7 46.1 26.4 11 11 A V E -A 49 0A 38 38,-2.6 38,-2.8 -2,-0.6 36,-0.1 -0.993 31.2-125.2-135.0 129.7 7.2 45.1 25.4 12 12 A H E > -A 48 0A 4 -2,-0.4 3,-1.9 36,-0.2 4,-0.3 -0.370 29.1-114.8 -69.6 149.1 5.5 41.7 26.2 13 13 A T G > S+ 0 0 0 34,-2.1 3,-2.0 1,-0.3 -1,-0.1 0.906 117.3 58.9 -47.5 -42.4 4.1 39.9 23.2 14 14 A A G 3 S+ 0 0 20 1,-0.3 -1,-0.3 33,-0.2 273,-0.1 0.711 103.7 53.0 -65.8 -20.7 0.5 40.3 24.6 15 15 A D G < S+ 0 0 85 -3,-1.9 2,-0.5 2,-0.1 -1,-0.3 0.339 80.4 109.2 -95.5 5.9 1.1 44.1 24.6 16 16 A L < - 0 0 15 -3,-2.0 2,-0.1 -4,-0.3 -3,-0.0 -0.680 66.9-135.5 -80.4 124.4 2.1 44.4 20.9 17 17 A D >> - 0 0 86 -2,-0.5 4,-2.5 1,-0.1 3,-0.5 -0.482 30.3-101.7 -74.3 161.0 -0.6 46.1 18.9 18 18 A S H 3> S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.825 119.5 50.8 -47.2 -45.8 -1.4 44.4 15.6 19 19 A E H 3> S+ 0 0 130 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.894 112.0 47.4 -65.0 -39.8 0.6 46.8 13.4 20 20 A T H <> S+ 0 0 13 -3,-0.5 4,-2.8 2,-0.2 5,-0.2 0.921 110.4 52.2 -68.2 -45.4 3.7 46.6 15.5 21 21 A R H X S+ 0 0 69 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.923 111.8 45.6 -55.9 -42.5 3.5 42.9 15.6 22 22 A Q H X S+ 0 0 122 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.903 111.7 52.6 -69.1 -40.6 3.3 42.7 11.8 23 23 A D H X S+ 0 0 31 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.926 111.2 47.1 -57.3 -47.4 6.2 45.3 11.4 24 24 A I H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.958 112.1 50.2 -61.3 -48.4 8.4 43.1 13.7 25 25 A R H X S+ 0 0 98 -4,-2.5 4,-2.1 -5,-0.2 5,-0.2 0.903 114.5 41.8 -60.8 -40.5 7.6 40.0 11.8 26 26 A Q H X S+ 0 0 107 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.926 116.2 49.6 -74.8 -38.9 8.3 41.3 8.4 27 27 A M H X S+ 0 0 5 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.963 114.9 42.3 -60.8 -51.6 11.4 43.2 9.5 28 28 A V H X S+ 0 0 0 -4,-3.0 4,-1.1 -5,-0.2 -2,-0.2 0.917 115.1 51.2 -63.4 -42.4 12.9 40.1 11.3 29 29 A T H <>S+ 0 0 51 -4,-2.1 5,-0.6 -5,-0.3 3,-0.5 0.936 114.5 43.5 -61.0 -43.2 11.9 37.7 8.4 30 30 A G H ><5S+ 0 0 60 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.780 105.8 62.2 -72.3 -28.6 13.5 40.1 5.9 31 31 A A H 3<5S+ 0 0 17 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.810 101.9 53.7 -67.2 -26.6 16.6 40.6 8.1 32 32 A F T ><5S- 0 0 59 -4,-1.1 3,-1.3 -3,-0.5 -1,-0.2 0.257 104.2-126.2 -91.5 7.9 17.4 36.8 7.9 33 33 A A T < 5S- 0 0 86 -3,-1.1 -3,-0.1 1,-0.3 -2,-0.1 0.924 74.6 -42.4 43.6 67.7 17.4 36.5 4.1 34 34 A G T 3 - 0 0 77 -2,-0.5 4,-1.9 1,-0.1 5,-0.1 -0.226 38.0-102.3 -86.3 174.9 10.3 30.1 9.1 38 38 A E H > S+ 0 0 150 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.810 125.9 52.6 -61.6 -36.7 6.8 30.4 10.5 39 39 A T H > S+ 0 0 49 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.898 105.2 52.2 -69.4 -38.7 8.1 28.1 13.3 40 40 A D H 4 S+ 0 0 20 2,-0.2 4,-0.4 1,-0.2 -2,-0.2 0.863 108.9 52.6 -63.2 -34.6 11.0 30.4 14.0 41 41 A W H >< S+ 0 0 15 -4,-1.9 3,-2.1 1,-0.2 4,-0.5 0.954 106.3 52.8 -64.0 -45.5 8.4 33.3 14.2 42 42 A E H >< S+ 0 0 37 -4,-2.2 3,-1.6 1,-0.3 -2,-0.2 0.887 102.7 59.6 -55.9 -37.3 6.4 31.2 16.8 43 43 A H T 3< S+ 0 0 1 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.663 97.4 60.1 -66.4 -14.1 9.6 30.8 18.8 44 44 A T T < S+ 0 0 0 -3,-2.1 3,-0.4 -4,-0.4 2,-0.3 0.538 92.8 90.5 -91.4 -3.1 9.9 34.6 19.2 45 45 A L < + 0 0 9 -3,-1.6 3,-0.1 -4,-0.5 242,-0.1 -0.683 63.4 43.3 -98.4 150.9 6.5 34.8 21.0 46 46 A G S S+ 0 0 1 1,-0.4 -1,-0.2 -2,-0.3 20,-0.1 0.239 101.1 52.0 111.9 -9.8 5.5 34.6 24.6 47 47 A G S S- 0 0 4 -3,-0.4 -34,-2.1 -36,-0.1 2,-0.5 -0.213 96.9 -38.8-130.3-142.9 8.1 36.8 26.3 48 48 A M E -AB 12 64A 9 16,-2.0 16,-2.7 -36,-0.2 2,-0.5 -0.826 42.4-153.8-102.1 124.9 9.7 40.3 26.2 49 49 A H E -AB 11 63A 0 -38,-2.8 -38,-2.6 -2,-0.5 2,-0.6 -0.843 7.6-148.1 -94.3 128.3 10.5 41.9 22.9 50 50 A A E -AB 10 62A 2 12,-3.7 12,-1.5 -2,-0.5 2,-0.4 -0.869 27.5-171.4 -91.8 120.8 13.3 44.5 23.0 51 51 A L E -AB 9 61A 1 -42,-2.6 -42,-2.9 -2,-0.6 2,-0.5 -0.939 21.2-161.9-123.5 138.8 12.4 47.0 20.3 52 52 A I E - B 0 60A 0 8,-2.4 7,-2.7 -2,-0.4 8,-1.0 -0.970 17.8-158.3-119.9 123.9 14.2 50.0 18.8 53 53 A W E + B 0 58A 87 -2,-0.5 -47,-0.5 -46,-0.3 2,-0.3 -0.753 17.5 173.9 -99.4 145.0 12.1 52.5 17.0 54 54 A H E > S- B 0 57A 50 3,-2.4 3,-2.3 -2,-0.3 -2,-0.0 -0.941 77.6 -15.5-149.1 122.9 13.0 55.1 14.3 55 55 A H T 3 S- 0 0 181 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.880 127.2 -54.7 52.0 39.2 10.4 57.2 12.6 56 56 A G T 3 S+ 0 0 61 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.532 117.9 107.1 77.8 4.4 7.6 54.9 13.8 57 57 A A E < S-B 54 0A 24 -3,-2.3 -3,-2.4 -34,-0.0 2,-0.7 -0.861 75.7-113.8-115.5 152.0 9.2 51.8 12.3 58 58 A I E +B 53 0A 0 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.739 35.5 171.5 -83.4 113.7 11.0 48.9 14.1 59 59 A I E + 0 0 0 -7,-2.7 28,-3.4 -2,-0.7 2,-0.3 0.528 67.1 20.0-100.1 -6.6 14.7 49.0 13.1 60 60 A A E +BC 52 86A 0 -8,-1.0 -8,-2.4 26,-0.3 2,-0.3 -0.962 65.2 178.0-157.6 149.1 16.0 46.4 15.6 61 61 A H E +BC 51 85A 0 24,-2.6 24,-2.5 -2,-0.3 2,-0.3 -0.994 11.0 170.4-151.3 146.2 14.4 43.6 17.6 62 62 A A E -B 50 0A 0 -12,-1.5 -12,-3.7 -2,-0.3 2,-0.4 -0.928 17.9-154.3-150.2 135.1 15.4 40.8 20.0 63 63 A A E -BC 49 82A 0 19,-3.0 19,-2.9 -2,-0.3 2,-0.6 -0.924 3.4-156.2-110.9 146.6 12.9 38.7 22.0 64 64 A V E -BC 48 81A 1 -16,-2.7 -16,-2.0 -2,-0.4 2,-0.3 -0.968 20.0-178.3-115.9 115.0 13.7 36.9 25.4 65 65 A I E - C 0 80A 4 15,-2.8 15,-3.4 -2,-0.6 2,-0.4 -0.813 25.7-114.3-114.2 156.0 11.3 34.0 25.9 66 66 A Q E + C 0 79A 10 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.729 48.1 136.8 -94.0 135.7 11.2 31.7 28.9 67 67 A R E - C 0 78A 10 11,-2.4 11,-2.8 -2,-0.4 2,-0.4 -0.879 47.0-102.0-151.7-174.8 12.1 28.0 28.7 68 68 A R E - C 0 77A 17 -2,-0.3 106,-1.1 9,-0.2 2,-0.5 -0.954 20.6-165.1-116.4 139.7 14.1 25.4 30.7 69 69 A L E -DC 173 76A 0 7,-1.5 7,-2.5 -2,-0.4 2,-0.6 -0.996 22.0-134.5-119.6 130.8 17.6 24.1 29.9 70 70 A I E +DC 172 75A 10 102,-3.6 102,-2.2 -2,-0.5 2,-0.4 -0.759 28.8 172.0 -90.7 120.0 18.6 20.9 31.8 71 71 A Y E > S- C 0 74A 19 3,-2.3 3,-2.6 -2,-0.6 100,-0.1 -0.996 72.0 -16.6-128.5 121.0 22.1 20.9 33.2 72 72 A R T 3 S- 0 0 153 -2,-0.4 -1,-0.1 98,-0.4 3,-0.1 0.873 128.5 -53.0 48.7 43.9 23.1 18.1 35.6 73 73 A G T 3 S+ 0 0 52 1,-0.2 2,-0.5 247,-0.0 -1,-0.3 0.518 114.6 118.0 72.1 7.5 19.6 17.1 36.1 74 74 A N E < -C 71 0A 91 -3,-2.6 -3,-2.3 280,-0.0 2,-1.2 -0.924 62.3-138.1-108.6 132.6 18.5 20.6 37.1 75 75 A A E -C 70 0A 10 -2,-0.5 279,-0.3 -5,-0.2 -5,-0.2 -0.709 27.3-153.4 -90.5 95.3 15.9 22.5 34.9 76 76 A L E -C 69 0A 11 -7,-2.5 -7,-1.5 -2,-1.2 2,-0.8 -0.452 18.4-116.1 -73.8 140.6 17.4 25.9 34.9 77 77 A R E -C 68 0A 17 -9,-0.2 35,-2.6 -2,-0.1 36,-1.3 -0.685 45.1-166.2 -80.9 108.7 15.1 28.9 34.4 78 78 A C E -Ce 67 113A 0 -11,-2.8 -11,-2.4 -2,-0.8 2,-0.7 -0.853 30.4-152.8-111.8 132.0 16.3 30.3 31.0 79 79 A G E -Ce 66 114A 0 34,-2.2 36,-1.8 -2,-0.4 2,-0.5 -0.909 29.5-160.5 -88.5 113.5 15.8 33.6 29.1 80 80 A Y E -Ce 65 115A 0 -15,-3.4 -15,-2.8 -2,-0.7 2,-0.6 -0.870 9.6-134.4-105.3 130.8 16.3 32.3 25.5 81 81 A V E +C 64 0A 8 34,-2.7 36,-0.5 -2,-0.5 2,-0.3 -0.717 30.5 172.3 -93.0 119.1 17.1 34.9 22.9 82 82 A E E +C 63 0A 20 -19,-2.9 -19,-3.0 -2,-0.6 -41,-0.0 -0.869 51.0 16.2-124.1 156.4 15.2 34.7 19.6 83 83 A G E - 0 0 6 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.790 65.4-179.2 60.1 38.3 14.8 36.8 16.4 84 84 A V E + 0 0 33 -3,-0.2 2,-0.3 -22,-0.1 -22,-0.2 -0.544 18.7 149.8 -73.5 119.7 17.8 39.1 16.9 85 85 A A E -C 61 0A 6 -24,-2.5 -24,-2.6 -2,-0.6 2,-0.4 -0.996 37.9-161.8-156.1 139.2 17.8 41.4 13.9 86 86 A V E -C 60 0A 16 -2,-0.3 -26,-0.3 -26,-0.2 5,-0.1 -0.980 43.5-106.9-116.5 132.4 18.8 44.9 13.0 87 87 A R > - 0 0 76 -28,-3.4 3,-2.3 -2,-0.4 4,-0.3 -0.393 34.4-115.5 -59.9 144.2 17.1 46.2 9.7 88 88 A A G > S+ 0 0 66 1,-0.3 3,-0.9 2,-0.2 -1,-0.1 0.713 111.4 56.7 -59.8 -29.7 19.8 46.2 7.0 89 89 A D G 3 S+ 0 0 102 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.663 110.7 47.6 -74.7 -11.7 19.9 50.0 6.4 90 90 A W G X S+ 0 0 44 -3,-2.3 3,-0.7 -31,-0.2 5,-0.4 0.268 86.0 118.2-110.3 8.0 20.7 50.5 10.1 91 91 A R T < + 0 0 107 -3,-0.9 -4,-0.0 -4,-0.3 -3,-0.0 -0.270 59.2 41.2 -75.9 156.9 23.5 47.9 10.4 92 92 A G T 3 S+ 0 0 85 1,-0.0 -1,-0.2 -2,-0.0 -4,-0.0 0.534 88.3 94.1 88.1 6.0 27.0 48.7 11.4 93 93 A Q S < S- 0 0 107 -3,-0.7 -2,-0.1 0, 0.0 -1,-0.0 0.152 98.2-109.6-114.7 11.7 26.0 51.2 14.0 94 94 A R S >> S+ 0 0 213 1,-0.1 3,-1.3 3,-0.1 4,-1.0 0.635 71.7 139.3 69.5 18.3 26.1 49.0 17.1 95 95 A L H 3> + 0 0 13 -5,-0.4 4,-2.2 1,-0.3 3,-0.4 0.817 66.7 65.4 -61.4 -31.5 22.3 49.0 17.6 96 96 A V H 3> S+ 0 0 34 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.827 96.4 57.8 -59.2 -27.3 22.6 45.2 18.4 97 97 A S H <> S+ 0 0 38 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.879 104.5 50.0 -67.3 -39.5 24.5 46.4 21.5 98 98 A A H X S+ 0 0 22 -4,-1.0 4,-1.4 -3,-0.4 -90,-0.3 0.887 110.5 50.1 -63.7 -41.2 21.5 48.5 22.5 99 99 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.938 110.9 49.9 -59.9 -43.5 19.3 45.4 22.0 100 100 A L H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.3 5,-0.3 0.804 101.1 61.1 -70.6 -30.8 21.7 43.4 24.2 101 101 A D H X S+ 0 0 90 -4,-1.9 4,-1.7 2,-0.2 -1,-0.3 0.926 112.1 40.4 -55.2 -45.8 21.7 45.9 26.9 102 102 A A H X S+ 0 0 8 -4,-1.4 4,-2.0 -3,-0.2 -2,-0.2 0.929 115.3 49.5 -69.9 -47.7 17.9 45.3 27.3 103 103 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.927 112.5 47.9 -55.7 -47.8 18.1 41.6 26.8 104 104 A E H X S+ 0 0 18 -4,-3.1 4,-3.1 1,-0.2 5,-0.2 0.893 108.3 55.2 -66.3 -33.2 20.9 41.2 29.4 105 105 A Q H X S+ 0 0 89 -4,-1.7 4,-2.0 -5,-0.3 -1,-0.2 0.919 107.0 49.9 -64.0 -39.3 18.9 43.4 31.8 106 106 A V H X S+ 0 0 1 -4,-2.0 4,-1.8 2,-0.2 5,-0.3 0.939 110.6 51.5 -65.8 -41.4 15.9 41.0 31.5 107 107 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.4 0.955 111.4 45.5 -59.9 -52.5 18.3 38.0 32.2 108 108 A R H < S+ 0 0 149 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.875 117.6 45.0 -61.9 -31.1 19.7 39.6 35.3 109 109 A G H < S+ 0 0 17 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.724 130.7 12.0 -87.3 -14.3 16.3 40.6 36.6 110 110 A A H < S+ 0 0 1 -4,-1.8 2,-0.3 -3,-0.4 -3,-0.2 0.598 108.9 56.3-139.8 -11.3 14.3 37.4 35.9 111 111 A Y < - 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