==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 03-JAN-01 1HU0 . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR J.C.FROMME,S.D.BRUNER,W.YANG,M.KARPLUS,G.L.VERDINE . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14259.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 8.6 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 . 4 1.3 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 . 1 0.3 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 . 13 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 38.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 2 0 1 2 0 1 1 4 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 9 A G 0 0 95 0, 0.0 9,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -55.1 28.5 -13.1 37.2 2 10 A S + 0 0 114 4,-0.1 2,-0.3 9,-0.0 4,-0.1 0.430 360.0 73.0 -89.9 -0.1 24.8 -13.1 37.8 3 11 A E S S+ 0 0 153 2,-0.1 160,-0.1 160,-0.1 0, 0.0 -0.729 85.3 17.0-111.5 162.1 25.1 -10.5 40.5 4 12 A G S S- 0 0 12 -2,-0.3 2,-0.3 158,-0.2 158,-0.0 -0.090 106.0 -23.8 75.0-175.1 25.9 -6.8 40.3 5 13 A H - 0 0 28 158,-0.1 -2,-0.1 37,-0.1 2,-0.1 -0.548 69.6-127.7 -74.0 133.3 25.7 -4.4 37.4 6 14 A R - 0 0 31 -2,-0.3 2,-0.3 -4,-0.1 37,-0.1 -0.343 18.3-160.3 -78.3 160.3 26.0 -6.2 34.0 7 15 A T > - 0 0 36 1,-0.1 4,-1.9 -2,-0.1 52,-0.0 -0.923 32.2-113.4-133.9 156.2 28.5 -5.2 31.3 8 16 A L T 4 S+ 0 0 50 -2,-0.3 6,-0.2 1,-0.2 -1,-0.1 0.899 117.8 46.9 -58.4 -40.5 28.1 -6.1 27.6 9 17 A A T 4 S+ 0 0 88 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.880 112.4 47.3 -69.7 -41.5 31.2 -8.3 27.9 10 18 A S T 4 S+ 0 0 67 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.821 123.9 27.4 -74.3 -33.8 30.3 -10.1 31.1 11 19 A T S >< S+ 0 0 16 -4,-1.9 3,-2.9 1,-0.1 -1,-0.2 -0.369 70.4 165.0-128.5 57.2 26.7 -11.1 30.3 12 20 A P G > S+ 0 0 85 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.815 74.6 54.7 -35.7 -58.0 26.6 -11.3 26.4 13 21 A A G 3 S+ 0 0 87 1,-0.3 -5,-0.1 64,-0.0 -2,-0.0 0.582 99.9 69.2 -60.7 -8.5 23.3 -13.2 26.1 14 22 A L G < S+ 0 0 33 -3,-2.9 2,-0.3 -6,-0.2 -1,-0.3 -0.151 83.3 78.1-108.0 41.3 21.7 -10.4 28.2 15 23 A W < - 0 0 22 -3,-0.8 2,-0.3 53,-0.1 53,-0.2 -0.997 52.0-163.0-146.3 141.7 21.8 -7.4 25.8 16 24 A A E -A 67 0A 17 51,-2.5 51,-3.2 -2,-0.3 2,-0.3 -0.886 20.3-132.9-118.4 153.4 19.7 -6.3 22.8 17 25 A S E -A 66 0A 52 -2,-0.3 49,-0.2 49,-0.2 47,-0.1 -0.767 11.7-161.7-111.9 156.3 20.8 -3.7 20.3 18 26 A I E -A 65 0A 7 47,-1.1 47,-1.9 -2,-0.3 2,-0.2 -0.999 35.9-112.4-131.0 123.4 19.2 -0.7 18.8 19 27 A P E +A 64 0A 108 0, 0.0 45,-0.2 0, 0.0 44,-0.0 -0.430 59.6 143.1 -59.5 122.7 20.8 0.7 15.6 20 28 A C - 0 0 5 43,-2.3 41,-0.1 -2,-0.2 -2,-0.1 -0.649 40.6-143.4-167.8 104.1 22.2 4.0 16.6 21 29 A P >> - 0 0 34 0, 0.0 3,-2.9 0, 0.0 4,-0.7 -0.402 28.2-118.8 -69.0 145.6 25.5 5.6 15.3 22 30 A R T 34 S+ 0 0 73 40,-2.0 3,-0.3 1,-0.3 41,-0.1 0.725 114.4 70.9 -58.3 -17.4 27.4 7.6 17.9 23 31 A S T 34 S+ 0 0 53 39,-0.3 96,-0.9 1,-0.2 -1,-0.3 0.747 102.3 42.9 -69.1 -22.4 26.9 10.5 15.6 24 32 A E T <4 S+ 0 0 25 -3,-2.9 2,-0.2 1,-0.3 -1,-0.2 0.535 129.7 14.1 -97.0 -12.4 23.2 10.4 16.7 25 33 A L < - 0 0 0 -4,-0.7 2,-0.5 -3,-0.3 -1,-0.3 -0.830 47.6-174.3-169.4 126.8 23.9 9.8 20.4 26 34 A R >> - 0 0 44 93,-2.3 3,-2.9 -2,-0.2 4,-1.3 -0.874 11.5-166.3-122.9 92.8 26.8 10.1 22.8 27 35 A L H >> S+ 0 0 2 -2,-0.5 4,-2.1 1,-0.3 3,-0.6 0.866 87.4 61.9 -44.7 -46.8 25.6 8.8 26.2 28 36 A D H 34 S+ 0 0 56 1,-0.2 -1,-0.3 2,-0.2 13,-0.0 0.627 111.5 40.1 -59.2 -12.6 28.7 10.3 28.0 29 37 A L H <4 S+ 0 0 3 -3,-2.9 -1,-0.2 90,-0.2 -2,-0.2 0.618 121.6 38.6-110.0 -19.7 27.4 13.7 26.8 30 38 A V H X<>S+ 0 0 0 -4,-1.3 3,-1.0 -3,-0.6 5,-0.5 0.885 110.6 51.9 -95.7 -51.9 23.7 13.3 27.4 31 39 A L T 3<5S+ 0 0 1 -4,-2.1 8,-0.4 1,-0.2 3,-0.2 0.736 117.4 33.0 -63.2 -29.0 23.3 11.3 30.6 32 40 A P T 3 5S+ 0 0 49 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.301 93.7 94.5-110.9 13.2 25.5 13.4 33.0 33 41 A S T < 5S- 0 0 4 -3,-1.0 -2,-0.1 1,-0.0 4,-0.1 0.205 104.7 -93.0 -90.8 15.6 24.9 16.8 31.5 34 42 A G T 5S+ 0 0 13 2,-0.5 3,-0.2 -3,-0.2 -3,-0.1 0.750 100.8 103.0 84.5 21.0 22.1 18.0 33.7 35 43 A Q S S-B 46 0A 23 3,-1.0 3,-2.7 -3,-0.2 -1,-0.1 -0.982 113.1 -68.1-142.9 148.1 31.3 0.7 35.2 44 52 A P T 3 S- 0 0 108 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.055 117.8 -3.6 -41.9 125.6 33.3 2.4 32.4 45 53 A A T 3 S+ 0 0 53 1,-0.2 2,-0.5 -4,-0.1 15,-0.4 0.522 110.8 107.6 66.9 8.4 31.1 3.2 29.4 46 54 A H E < -B 43 0A 20 -3,-2.7 -3,-1.0 13,-0.1 2,-0.5 -0.973 51.8-162.9-119.7 125.7 28.1 1.6 31.0 47 55 A W E - C 0 58A 20 11,-2.8 11,-2.2 -2,-0.5 2,-0.4 -0.913 3.6-165.6-112.5 128.8 25.3 3.8 32.4 48 56 A S E +BC 40 57A 1 -8,-3.0 -8,-2.2 -2,-0.5 2,-0.3 -0.871 25.8 119.7-114.1 146.6 22.7 2.5 34.8 49 57 A G E - C 0 56A 1 7,-2.1 7,-2.7 -2,-0.4 2,-0.6 -0.984 59.1 -71.5 179.3 178.0 19.4 4.1 35.8 50 58 A V E + C 0 55A 12 -12,-0.5 2,-0.4 -2,-0.3 5,-0.2 -0.831 42.4 173.3 -98.2 126.1 15.6 3.9 35.9 51 59 A L E > S- C 0 54A 7 3,-3.2 3,-0.7 -2,-0.6 35,-0.1 -0.977 73.0 -10.2-133.8 115.9 13.7 4.2 32.7 52 60 A A T 3 S- 0 0 64 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.934 128.5 -55.9 61.8 46.4 10.0 3.6 32.5 53 61 A D T 3 S+ 0 0 128 1,-0.2 2,-0.3 -3,-0.1 -1,-0.2 0.683 121.8 96.8 60.3 20.4 10.0 2.2 36.1 54 62 A Q E < S-C 51 0A 52 -3,-0.7 -3,-3.2 17,-0.0 2,-0.3 -0.962 76.4-113.0-134.5 153.0 12.6 -0.4 35.3 55 63 A V E +CD 50 70A 2 15,-1.0 15,-2.1 -2,-0.3 2,-0.3 -0.707 37.9 177.9 -90.3 138.2 16.3 -0.4 35.8 56 64 A W E -CD 49 69A 1 -7,-2.7 -7,-2.1 -2,-0.3 2,-0.4 -0.916 24.3-154.2-135.4 160.5 18.6 -0.4 32.8 57 65 A T E -CD 48 68A 0 11,-1.5 11,-1.3 -2,-0.3 2,-0.4 -0.987 21.8-169.5-131.7 135.0 22.3 -0.3 31.9 58 66 A L E +CD 47 67A 0 -11,-2.2 -11,-2.8 -2,-0.4 2,-0.3 -0.985 12.8 164.4-132.0 143.0 23.2 1.1 28.5 59 67 A T E - D 0 66A 10 7,-1.8 7,-3.0 -2,-0.4 2,-0.4 -0.971 19.4-143.3-150.8 157.4 26.5 1.2 26.6 60 68 A Q E - D 0 65A 34 -15,-0.4 5,-0.2 -2,-0.3 2,-0.2 -0.964 9.2-162.0-136.0 148.5 27.3 1.9 23.0 61 69 A T - 0 0 63 3,-2.2 -39,-0.1 -2,-0.4 -41,-0.0 -0.525 56.5 -78.3-106.7-179.7 29.7 0.8 20.3 62 70 A E S S+ 0 0 110 1,-0.2 -40,-2.0 -2,-0.2 -39,-0.3 0.845 128.8 11.8 -52.1 -36.0 30.4 2.8 17.2 63 71 A E S S+ 0 0 106 -42,-0.2 -43,-2.3 -41,-0.1 2,-0.3 0.489 118.5 70.6-122.7 -3.7 27.1 1.8 15.5 64 72 A Q E -A 19 0A 58 -45,-0.2 -3,-2.2 -47,-0.1 2,-0.6 -0.875 56.0-150.3-122.3 151.1 25.0 0.2 18.3 65 73 A L E -AD 18 60A 0 -47,-1.9 -47,-1.1 -2,-0.3 2,-0.4 -0.947 27.4-152.1-113.0 105.6 23.2 1.2 21.4 66 74 A H E -AD 17 59A 21 -7,-3.0 -7,-1.8 -2,-0.6 2,-0.4 -0.668 14.4-171.4 -85.9 130.9 23.3 -1.8 23.7 67 75 A C E +AD 16 58A 0 -51,-3.2 -51,-2.5 -2,-0.4 2,-0.3 -0.932 12.5 176.9-126.1 145.7 20.5 -2.3 26.2 68 76 A T E - D 0 57A 0 -11,-1.3 -11,-1.5 -2,-0.4 2,-0.3 -0.989 12.6-154.5-146.2 135.5 19.8 -4.6 29.2 69 77 A V E - D 0 56A 1 -2,-0.3 2,-0.6 7,-0.3 7,-0.2 -0.879 7.8-155.5-116.4 146.0 16.9 -4.7 31.7 70 78 A Y E D 0 55A 14 -15,-2.1 -15,-1.0 -2,-0.3 -2,-0.0 -0.971 360.0 360.0-117.5 112.6 16.6 -6.0 35.2 71 79 A R 0 0 111 -2,-0.6 4,-0.1 2,-0.1 -17,-0.0 -0.119 360.0 360.0 -99.5 360.0 13.0 -6.8 36.0 72 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 73 83 A S 0 0 164 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 19.2 11.2 -13.3 36.7 74 84 A Q - 0 0 174 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.493 360.0 -96.6 -71.5 127.6 14.1 -15.2 35.0 75 85 A A + 0 0 64 -2,-0.3 2,-0.2 -4,-0.1 -1,-0.1 -0.140 62.5 153.6 -44.5 114.3 16.8 -12.9 33.5 76 86 A S - 0 0 52 -7,-0.2 -7,-0.3 -62,-0.1 -5,-0.1 -0.563 43.5 -73.0-129.6-165.8 16.0 -12.5 29.8 77 87 A R - 0 0 51 -2,-0.2 2,-0.1 1,-0.1 -9,-0.1 -0.597 53.4 -92.0 -94.6 155.6 16.6 -10.1 26.9 78 88 A P - 0 0 7 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 -0.470 47.4-127.1 -65.0 136.3 14.9 -6.7 26.5 79 89 A T > - 0 0 53 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.365 22.5-107.1 -77.4 163.6 11.9 -7.4 24.3 80 90 A P H > S+ 0 0 102 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.796 123.8 55.6 -62.5 -22.3 11.4 -5.3 21.2 81 91 A D H > S+ 0 0 136 2,-0.2 4,-0.8 1,-0.2 0, 0.0 0.903 107.6 45.4 -73.5 -43.7 8.6 -3.6 23.1 82 92 A E H >> S+ 0 0 27 1,-0.2 4,-1.0 2,-0.2 3,-0.6 0.849 110.0 55.6 -67.3 -36.4 10.8 -2.6 26.1 83 93 A L H 3X S+ 0 0 19 -4,-2.4 4,-2.2 1,-0.3 3,-0.4 0.838 98.9 62.0 -65.1 -31.5 13.5 -1.4 23.6 84 94 A E H 3X S+ 0 0 88 -4,-1.0 4,-2.0 1,-0.3 -1,-0.3 0.831 96.9 58.1 -62.8 -31.0 10.8 0.8 22.2 85 95 A A H S+ 0 0 63 -4,-2.2 5,-2.4 1,-0.2 6,-0.3 0.890 110.5 47.1 -58.6 -39.6 13.8 4.7 21.7 88 98 A K H ><5S+ 0 0 136 -4,-2.0 3,-1.2 3,-0.2 -1,-0.2 0.886 106.7 56.8 -70.9 -37.7 11.2 7.1 23.0 89 99 A Y H 3<5S+ 0 0 23 -4,-1.8 35,-3.1 1,-0.3 -2,-0.2 0.917 116.6 35.4 -59.3 -44.5 13.3 8.2 26.0 90 100 A F T 3<5S- 0 0 0 -4,-2.1 -1,-0.3 33,-0.2 -2,-0.2 0.243 105.9-130.1 -91.8 11.1 16.1 9.3 23.6 91 101 A Q T X 5 + 0 0 33 -3,-1.2 3,-1.5 1,-0.2 -3,-0.2 0.877 37.3 177.4 39.4 52.6 13.5 10.5 21.0 92 102 A L T 3 < + 0 0 22 -5,-2.4 -1,-0.2 1,-0.3 4,-0.1 0.566 65.2 73.1 -63.6 -10.2 15.5 8.5 18.4 93 103 A D T 3 S+ 0 0 133 -6,-0.3 2,-0.4 2,-0.1 -1,-0.3 0.826 79.4 85.0 -72.6 -31.4 13.0 9.3 15.6 94 104 A V S < S- 0 0 36 -3,-1.5 2,-0.9 -4,-0.1 3,-0.1 -0.594 85.2-132.8 -71.7 123.9 14.4 12.8 15.5 95 105 A T >> - 0 0 70 -2,-0.4 4,-1.4 1,-0.2 3,-0.7 -0.719 15.1-164.2 -83.1 108.8 17.5 12.8 13.3 96 106 A L H 3> S+ 0 0 1 -2,-0.9 4,-2.8 1,-0.2 5,-0.2 0.864 86.5 60.4 -61.0 -36.6 20.2 14.6 15.1 97 107 A A H 3> S+ 0 0 57 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.823 103.0 51.5 -61.8 -31.7 22.3 15.0 11.9 98 108 A Q H <> S+ 0 0 131 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.907 112.4 44.9 -72.2 -41.9 19.5 17.0 10.2 99 109 A L H X S+ 0 0 26 -4,-1.4 4,-3.0 2,-0.2 5,-0.3 0.943 113.2 49.8 -66.3 -47.6 19.2 19.4 13.1 100 110 A Y H X S+ 0 0 24 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.910 109.8 52.7 -56.7 -44.5 23.0 19.8 13.4 101 111 A H H X S+ 0 0 126 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.961 112.8 43.8 -54.6 -55.9 23.2 20.5 9.7 102 112 A H H X S+ 0 0 84 -4,-2.2 4,-2.1 2,-0.2 3,-0.3 0.961 114.8 46.9 -55.7 -57.7 20.6 23.2 9.9 103 113 A W H X S+ 0 0 1 -4,-3.0 4,-1.7 1,-0.3 8,-0.3 0.919 113.8 48.9 -53.3 -47.0 21.9 24.9 13.1 104 114 A G H < S+ 0 0 5 -4,-3.0 7,-0.3 -5,-0.3 -1,-0.3 0.869 108.4 55.1 -61.0 -35.7 25.5 24.8 11.7 105 115 A S H < S+ 0 0 76 -4,-2.2 -1,-0.2 -3,-0.3 -2,-0.2 0.898 117.1 34.8 -62.6 -43.8 24.2 26.3 8.4 106 116 A V H < S+ 0 0 72 -4,-2.1 2,-0.3 1,-0.2 -1,-0.2 0.564 122.9 45.2 -89.3 -12.2 22.6 29.3 10.1 107 117 A D >X - 0 0 12 -4,-1.7 4,-2.7 -5,-0.3 3,-0.5 -0.788 58.6-168.8-140.1 97.9 25.2 29.7 12.9 108 118 A S H 3> S+ 0 0 94 -2,-0.3 4,-2.5 1,-0.3 -1,-0.1 0.853 92.2 51.9 -48.8 -43.3 28.9 29.5 12.0 109 119 A H H 3> S+ 0 0 33 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.887 108.7 49.9 -65.2 -38.9 29.9 29.3 15.7 110 120 A F H <> S+ 0 0 0 -3,-0.5 4,-3.9 -7,-0.2 5,-0.3 0.960 109.1 53.2 -61.8 -49.7 27.5 26.4 16.3 111 121 A Q H X S+ 0 0 106 -4,-2.7 4,-1.2 -7,-0.3 -2,-0.2 0.936 109.2 49.2 -46.9 -53.7 29.0 24.7 13.3 112 122 A E H < S+ 0 0 123 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.876 118.6 37.7 -55.7 -43.6 32.5 25.2 14.8 113 123 A V H >X S+ 0 0 25 -4,-2.2 3,-1.4 1,-0.2 4,-1.0 0.888 108.6 61.3 -78.0 -41.6 31.5 23.8 18.2 114 124 A A H 3< S+ 0 0 5 -4,-3.9 -1,-0.2 1,-0.3 -2,-0.2 0.728 90.3 72.4 -58.4 -24.7 29.2 21.0 17.0 115 125 A Q T 3< S+ 0 0 136 -4,-1.2 3,-0.3 -5,-0.3 -1,-0.3 0.843 106.2 34.7 -60.1 -36.1 32.1 19.4 15.1 116 126 A K T <4 S+ 0 0 128 -3,-1.4 2,-0.2 -4,-0.3 -1,-0.2 0.645 120.3 49.6 -94.8 -17.3 33.6 18.3 18.4 117 127 A F S < S+ 0 0 39 -4,-1.0 3,-0.4 3,-0.0 -1,-0.2 -0.487 70.1 153.7-124.2 66.2 30.4 17.5 20.3 118 128 A Q + 0 0 88 -3,-0.3 -94,-0.1 -2,-0.2 3,-0.1 -0.399 51.1 48.6 -86.6 167.9 28.1 15.4 18.3 119 129 A G + 0 0 0 -96,-0.9 -93,-2.3 1,-0.2 2,-0.8 0.642 67.5 140.3 81.5 13.8 25.4 13.1 19.6 120 130 A V + 0 0 1 -3,-0.4 2,-0.2 -95,-0.2 -1,-0.2 -0.825 22.9 154.3 -94.6 107.9 23.9 15.6 22.1 121 131 A R - 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