==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 06-JUL-10 2XJX . COMPND 2 MOLECULE: HEAT SHOCK PROTEIN HSP 90-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.W.MURRAY,M.G.CARR,O.CALLAGHAN,G.CHESSARI,M.CONGREVE,S.COWA . 221 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11848.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 18.6 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 . 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 . 1 0.5 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 . 11 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 1 0 0 1 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 0 1 2 2 0 1 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 0 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 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 11 A P 0 0 161 0, 0.0 2,-1.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-133.4 35.3 9.0 30.4 2 12 A M + 0 0 179 2,-0.0 2,-0.2 0, 0.0 0, 0.0 -0.500 360.0 39.7 62.2 -95.8 36.3 5.6 31.4 3 13 A E S S- 0 0 175 -2,-1.1 2,-0.4 1,-0.0 0, 0.0 -0.506 77.4-152.1 -86.4 146.3 34.3 3.7 28.8 4 14 A E - 0 0 188 -2,-0.2 2,-0.4 2,-0.0 -2,-0.0 -0.948 12.4-177.2-121.7 139.9 34.1 4.9 25.2 5 15 A E - 0 0 80 -2,-0.4 2,-0.4 2,-0.1 160,-0.1 -1.000 29.0-122.7-139.1 134.1 31.3 4.4 22.7 6 16 A E + 0 0 98 -2,-0.4 158,-2.5 2,-0.0 2,-0.4 -0.649 37.7 171.6 -76.3 126.2 31.2 5.6 19.1 7 17 A V E -A 163 0A 68 -2,-0.4 2,-0.4 156,-0.2 156,-0.2 -0.975 12.9-163.4-140.9 119.4 28.1 7.8 18.7 8 18 A E E -A 162 0A 40 154,-2.9 154,-2.4 -2,-0.4 2,-0.4 -0.919 8.1-145.7-112.4 133.0 27.5 9.8 15.4 9 19 A T E +A 161 0A 102 -2,-0.4 2,-0.3 152,-0.2 152,-0.2 -0.838 22.1 178.5-103.7 129.7 25.1 12.7 15.1 10 20 A F E -A 160 0A 49 150,-2.8 150,-2.1 -2,-0.4 2,-0.4 -0.910 26.0-131.7-129.9 153.3 23.2 13.2 11.8 11 21 A A E -A 159 0A 72 -2,-0.3 148,-0.3 148,-0.2 3,-0.1 -0.865 34.5-113.5 -97.3 141.8 20.7 15.6 10.4 12 22 A F - 0 0 10 146,-1.8 87,-0.2 -2,-0.4 86,-0.1 -0.423 44.6 -91.6 -63.4 145.7 17.8 14.0 8.6 13 23 A Q > - 0 0 40 85,-3.1 4,-2.6 87,-0.2 3,-0.4 -0.265 47.4-106.1 -57.5 140.0 17.8 14.8 4.9 14 24 A A H > S+ 0 0 75 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.842 117.1 44.6 -46.9 -42.1 15.8 18.0 4.4 15 25 A E H > S+ 0 0 44 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.891 112.1 52.7 -75.0 -31.9 12.7 16.5 2.9 16 26 A I H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 -2,-0.2 0.925 110.0 49.8 -65.6 -40.9 12.6 13.6 5.4 17 27 A A H X S+ 0 0 30 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.931 110.1 50.1 -62.8 -42.6 12.8 16.2 8.2 18 28 A Q H X S+ 0 0 108 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.923 112.5 48.1 -60.9 -43.6 9.9 18.1 6.6 19 29 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.924 109.8 50.4 -62.4 -48.4 7.9 14.9 6.4 20 30 A M H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.910 108.9 53.0 -59.3 -38.0 8.6 13.9 9.9 21 31 A S H X S+ 0 0 62 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.904 110.5 47.5 -67.2 -35.8 7.4 17.4 11.1 22 32 A L H X S+ 0 0 32 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.974 111.9 50.7 -63.8 -51.0 4.2 16.9 9.1 23 33 A I H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.841 119.3 36.1 -54.1 -41.1 3.7 13.4 10.7 24 34 A I H < S+ 0 0 55 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.788 122.7 39.7 -83.6 -39.2 4.2 14.7 14.2 25 35 A N H < S+ 0 0 121 -4,-2.5 2,-0.4 -5,-0.2 -2,-0.2 0.396 104.7 69.6 -98.1 -0.9 2.6 18.1 14.0 26 36 A T S < S- 0 0 57 -4,-1.6 2,-0.3 -5,-0.1 0, 0.0 -0.940 83.2-116.5-118.4 142.6 -0.5 17.4 11.9 27 37 A F + 0 0 164 -2,-0.4 2,-0.4 0, 0.0 -3,-0.1 -0.593 35.3 179.0 -79.4 132.9 -3.4 15.3 13.0 28 38 A Y - 0 0 25 -2,-0.3 3,-0.3 -5,-0.1 2,-0.1 -1.000 18.4-140.6-131.1 136.2 -3.9 12.2 10.9 29 39 A S S S+ 0 0 64 -2,-0.4 89,-0.4 1,-0.2 0, 0.0 -0.423 78.7 38.0 -82.4 173.7 -6.6 9.6 11.4 30 40 A N > + 0 0 99 -2,-0.1 3,-0.9 1,-0.1 -1,-0.2 0.863 60.3 158.8 55.4 49.7 -6.0 5.8 11.1 31 41 A K T > + 0 0 24 -3,-0.3 3,-2.5 1,-0.2 4,-0.2 0.607 48.6 93.9 -74.2 -15.8 -2.5 5.7 12.6 32 42 A E T >> + 0 0 14 1,-0.3 3,-1.6 2,-0.1 4,-0.5 0.719 65.7 80.8 -55.7 -16.4 -2.8 1.9 13.4 33 43 A I H <> + 0 0 3 -3,-0.9 4,-2.0 1,-0.3 -1,-0.3 0.634 68.1 84.4 -67.5 -8.8 -1.1 1.2 10.1 34 44 A F H <> S+ 0 0 0 -3,-2.5 4,-1.9 1,-0.2 -1,-0.3 0.880 89.1 51.7 -60.0 -35.0 2.3 2.0 11.7 35 45 A L H <> S+ 0 0 3 -3,-1.6 4,-2.7 -4,-0.2 5,-0.2 0.893 104.9 54.5 -69.5 -38.3 2.3 -1.6 12.9 36 46 A R H X S+ 0 0 46 -4,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.913 108.5 49.9 -59.7 -43.5 1.7 -3.0 9.5 37 47 A E H X S+ 0 0 20 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.920 111.2 48.2 -63.5 -41.9 4.7 -1.0 8.2 38 48 A L H X S+ 0 0 8 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.929 113.1 46.9 -64.4 -46.1 7.0 -2.4 10.9 39 49 A I H X S+ 0 0 1 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.879 110.4 54.3 -66.8 -33.1 5.9 -6.0 10.4 40 50 A S H X S+ 0 0 45 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.925 108.7 47.8 -64.7 -42.9 6.3 -5.5 6.6 41 51 A N H X S+ 0 0 76 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.911 112.6 49.2 -64.9 -39.1 9.9 -4.4 7.1 42 52 A S H X S+ 0 0 4 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.932 110.2 51.2 -64.9 -46.5 10.5 -7.3 9.4 43 53 A S H X S+ 0 0 16 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.921 109.8 49.4 -58.5 -44.8 9.0 -9.7 6.9 44 54 A D H X S+ 0 0 98 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.904 112.2 48.2 -59.7 -41.0 11.2 -8.3 4.1 45 55 A A H X S+ 0 0 19 -4,-2.1 4,-1.9 2,-0.2 41,-1.7 0.865 112.4 49.0 -67.2 -36.9 14.3 -8.7 6.3 46 56 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 39,-0.3 5,-0.2 0.926 108.6 53.2 -69.9 -44.9 13.3 -12.2 7.2 47 57 A D H X S+ 0 0 57 -4,-2.9 4,-2.8 -5,-0.2 -2,-0.2 0.897 107.8 53.2 -51.5 -44.6 12.8 -13.1 3.5 48 58 A K H X S+ 0 0 97 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.937 110.8 42.7 -62.0 -49.6 16.3 -11.8 2.8 49 59 A I H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.904 114.5 52.2 -65.8 -38.0 18.1 -13.9 5.4 50 60 A R H X S+ 0 0 114 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.958 111.3 47.3 -61.2 -48.1 16.0 -17.0 4.4 51 61 A Y H >X S+ 0 0 165 -4,-2.8 3,-0.8 1,-0.2 4,-0.6 0.912 113.2 47.0 -58.0 -47.2 16.9 -16.4 0.7 52 62 A E H >X S+ 0 0 39 -4,-2.6 4,-1.9 1,-0.2 3,-1.1 0.879 106.9 59.2 -63.6 -36.3 20.6 -16.0 1.4 53 63 A S H 3< S+ 0 0 21 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.688 87.4 74.0 -67.2 -20.8 20.5 -19.1 3.7 54 64 A L H << S+ 0 0 131 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.865 113.8 26.4 -55.7 -37.7 19.3 -21.3 0.7 55 65 A T H << S+ 0 0 129 -3,-1.1 -2,-0.2 -4,-0.6 -1,-0.2 0.746 133.8 32.1 -98.2 -31.8 22.9 -21.0 -0.5 56 66 A D >< - 0 0 61 -4,-1.9 3,-2.1 1,-0.1 -1,-0.2 -0.745 55.4-178.5-136.4 88.8 24.9 -20.5 2.7 57 67 A P G > S+ 0 0 89 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.746 79.5 75.8 -53.4 -26.9 23.4 -22.2 5.8 58 68 A S G > S+ 0 0 60 1,-0.3 3,-2.0 2,-0.2 4,-0.3 0.736 77.5 72.9 -62.8 -20.4 26.3 -20.6 7.8 59 69 A K G < S+ 0 0 59 -3,-2.1 3,-0.4 1,-0.3 -1,-0.3 0.716 91.2 58.7 -67.2 -17.7 24.5 -17.3 7.6 60 70 A L G X S+ 0 0 31 -3,-2.2 3,-2.2 -4,-0.2 -1,-0.3 0.414 73.4 100.4 -89.5 2.5 22.1 -18.7 10.2 61 71 A D T < S+ 0 0 121 -3,-2.0 3,-0.2 1,-0.3 -1,-0.2 0.862 81.0 55.3 -50.6 -39.1 25.0 -19.3 12.7 62 72 A S T 3 S- 0 0 35 -3,-0.4 -1,-0.3 -4,-0.3 2,-0.1 0.243 132.9 -14.0 -80.4 5.9 23.8 -16.1 14.4 63 73 A G < - 0 0 25 -3,-2.2 -1,-0.3 108,-0.1 -2,-0.0 -0.221 53.8-162.9 154.4 112.0 20.2 -17.2 14.9 64 74 A K + 0 0 149 -3,-0.2 2,-0.5 -2,-0.1 -3,-0.1 0.675 68.5 83.5 -87.0 -19.5 18.5 -20.2 13.3 65 75 A E - 0 0 124 -5,-0.1 2,-0.7 2,-0.0 19,-0.0 -0.767 62.8-155.0 -95.2 128.4 14.9 -19.2 14.0 66 76 A L + 0 0 26 -2,-0.5 2,-0.3 17,-0.1 19,-0.1 -0.884 43.8 120.8-102.4 105.0 13.1 -16.8 11.7 67 77 A H - 0 0 40 -2,-0.7 17,-1.4 139,-0.2 2,-0.4 -0.964 52.1-123.7-156.4 173.9 10.4 -15.1 13.6 68 78 A I E -Bc 83 208A 0 139,-2.5 141,-2.3 -2,-0.3 2,-0.4 -0.992 17.5-164.9-127.4 138.3 8.8 -11.8 14.9 69 79 A N E -Bc 82 209A 23 13,-2.8 13,-2.8 -2,-0.4 2,-0.5 -0.966 6.1-155.6-121.5 139.0 8.0 -10.9 18.5 70 80 A L E -Bc 81 210A 4 139,-2.9 141,-2.9 -2,-0.4 11,-0.2 -0.969 13.8-173.4-115.1 130.5 5.7 -8.0 19.6 71 81 A I E -B 80 0A 42 9,-3.3 9,-2.2 -2,-0.5 2,-0.3 -0.837 8.9-173.7-131.4 92.3 6.4 -6.7 23.0 72 82 A P E -B 79 0A 27 0, 0.0 2,-0.5 0, 0.0 7,-0.2 -0.646 8.2-166.3 -82.5 143.9 4.2 -4.1 24.7 73 83 A N E >> -B 78 0A 47 5,-3.1 5,-1.7 -2,-0.3 4,-1.0 -0.886 14.4-174.2-134.1 104.3 5.5 -2.9 28.0 74 84 A K T 45S+ 0 0 134 -2,-0.5 -1,-0.1 1,-0.2 5,-0.1 0.650 80.5 70.1 -68.4 -18.6 3.1 -0.9 30.2 75 85 A Q T 45S+ 0 0 142 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.931 119.6 15.1 -64.6 -46.1 5.9 -0.2 32.7 76 86 A D T 45S- 0 0 85 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.2 0.306 104.1-115.6-116.0 14.8 7.7 2.1 30.3 77 87 A R T <5 + 0 0 74 -4,-1.0 103,-1.9 1,-0.2 2,-0.3 0.905 68.3 138.8 54.6 45.7 5.0 2.8 27.7 78 88 A T E < -BD 73 179A 5 -5,-1.7 -5,-3.1 101,-0.2 2,-0.4 -0.894 43.0-159.2-116.2 156.2 7.0 1.1 24.9 79 89 A L E -BD 72 178A 1 99,-2.1 99,-3.0 -2,-0.3 2,-0.4 -0.995 18.3-167.3-130.5 119.5 6.0 -1.2 22.1 80 90 A T E -BD 71 177A 16 -9,-2.2 -9,-3.3 -2,-0.4 2,-0.5 -0.912 11.3-162.8-113.1 138.1 8.9 -3.2 20.7 81 91 A I E -BD 70 176A 1 95,-2.4 95,-2.8 -2,-0.4 2,-0.4 -0.986 14.4-172.7-116.4 123.4 8.9 -5.3 17.5 82 92 A V E +BD 69 175A 28 -13,-2.8 -13,-2.8 -2,-0.5 2,-0.3 -0.940 6.2 174.4-118.4 135.8 11.8 -7.8 17.3 83 93 A D E -BD 68 174A 8 91,-2.9 91,-0.9 -2,-0.4 -15,-0.2 -0.933 33.4-139.4-135.3 160.9 12.7 -9.9 14.3 84 94 A T + 0 0 24 -17,-1.4 89,-0.2 -2,-0.3 -16,-0.1 -0.211 58.8 134.4-108.3 41.2 15.5 -12.2 13.4 85 95 A G S S- 0 0 0 89,-0.2 -39,-0.3 -18,-0.1 -40,-0.1 0.099 77.1 -71.7 -75.8-165.9 15.9 -11.0 9.9 86 96 A I - 0 0 18 -41,-1.7 59,-0.4 1,-0.1 87,-0.2 0.711 68.1-149.4 -65.2 -19.6 19.1 -10.1 8.0 87 97 A G - 0 0 5 85,-0.2 2,-0.4 57,-0.1 57,-0.2 -0.087 17.1 -84.1 75.3 179.7 19.7 -7.0 10.0 88 98 A M - 0 0 33 85,-0.4 56,-0.3 62,-0.1 62,-0.2 -0.964 26.1-135.2-127.4 147.5 21.4 -3.8 8.8 89 99 A T > - 0 0 32 -2,-0.4 4,-2.4 54,-0.1 5,-0.2 -0.251 41.7 -95.9 -82.3 177.6 25.0 -2.8 8.4 90 100 A K H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.948 128.3 48.4 -62.0 -44.1 26.1 0.7 9.5 91 101 A A H > S+ 0 0 52 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.912 108.7 54.9 -63.6 -39.6 25.8 2.0 5.9 92 102 A D H > S+ 0 0 57 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.914 110.0 46.3 -61.9 -43.6 22.3 0.4 5.7 93 103 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 6,-0.2 0.957 115.2 46.0 -59.1 -53.1 21.2 2.3 8.8 94 104 A I H <>S+ 0 0 30 -4,-2.6 5,-1.9 1,-0.2 6,-0.4 0.890 119.2 40.7 -58.5 -42.9 22.6 5.6 7.6 95 105 A N H <5S+ 0 0 67 -4,-3.0 3,-0.4 -5,-0.2 5,-0.4 0.842 123.6 36.7 -72.3 -42.5 21.2 5.2 4.0 96 106 A N H <5S+ 0 0 79 -4,-2.6 -2,-0.2 -5,-0.3 -3,-0.2 0.735 115.1 52.6 -85.7 -26.6 17.8 3.9 5.0 97 107 A L T <5S- 0 0 11 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.1 -0.050 125.1 -56.6-110.0 32.7 17.1 5.8 8.2 98 108 A G T 5S+ 0 0 1 -3,-0.4 -85,-3.1 2,-0.2 -3,-0.1 0.305 97.9 98.1 138.5 -24.2 17.7 9.4 7.2 99 109 A T S - 0 0 51 1,-0.1 3,-1.5 -4,-0.1 4,-0.4 -0.942 18.8-126.0-111.7 134.7 14.1 8.9 -0.6 103 113 A S T 3 S+ 0 0 136 -2,-0.4 4,-0.4 1,-0.2 3,-0.2 0.779 104.4 45.2 -46.0 -42.1 12.4 9.0 -4.0 104 114 A G T 3> S+ 0 0 13 20,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.527 83.4 95.8 -91.5 0.6 8.9 9.2 -2.7 105 115 A T H <> S+ 0 0 0 -3,-1.5 4,-2.5 1,-0.2 5,-0.2 0.902 86.4 42.0 -55.3 -56.9 9.2 11.8 0.0 106 116 A K H > S+ 0 0 115 -4,-0.4 4,-2.7 -3,-0.2 -1,-0.2 0.934 116.8 47.6 -59.3 -49.3 8.1 14.9 -1.8 107 117 A A H > S+ 0 0 50 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.879 111.2 52.6 -62.2 -35.0 5.3 13.3 -3.7 108 118 A F H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.946 108.7 48.4 -68.6 -40.9 4.1 11.7 -0.5 109 119 A M H X S+ 0 0 8 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.919 110.6 52.5 -63.6 -41.0 4.1 15.0 1.4 110 120 A E H X S+ 0 0 130 -4,-2.7 4,-1.1 1,-0.2 -1,-0.2 0.901 109.9 48.7 -62.6 -36.7 2.1 16.5 -1.6 111 121 A A H <>S+ 0 0 27 -4,-2.2 5,-2.6 2,-0.2 3,-0.3 0.903 111.4 49.1 -66.8 -42.4 -0.4 13.7 -1.3 112 122 A L H ><5S+ 0 0 8 -4,-2.6 3,-2.8 1,-0.2 -2,-0.2 0.960 107.5 54.6 -62.1 -46.8 -0.8 14.2 2.4 113 123 A Q H 3<5S+ 0 0 130 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.789 106.1 53.4 -57.7 -24.9 -1.2 17.9 1.9 114 124 A A T 3<5S- 0 0 91 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.404 130.4 -95.0 -88.4 -2.1 -4.1 17.0 -0.5 115 125 A G T < 5 + 0 0 61 -3,-2.8 -3,-0.2 -4,-0.2 -2,-0.2 0.627 65.8 163.4 98.5 15.2 -5.7 14.9 2.2 116 126 A A < - 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