==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 28-DEC-10 3Q5L . COMPND 2 MOLECULE: HEAT SHOCK PROTEIN 83-1; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MAJOR; . AUTHOR A.K.WERNIMONT,W.TEMPEL,Y.H.LIN,A.HUTCHINSON,F.MACKENZIE,A.FA . 854 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40076.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 628 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 164 19.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 4 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 . 58 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 126 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.7 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 0 4 0 0 1 7 4 0 0 0 0 0 0 0 0 0 1 3 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 0 0 1 4 5 10 0 4 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 4 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 N > 0 0 122 0, 0.0 3,-1.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 161.5 -46.2 -90.6 -30.5 2 -4 A L T 3 + 0 0 153 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.785 360.0 61.9 -57.4 -30.9 -49.6 -91.6 -29.0 3 -3 A Y T 3 S+ 0 0 198 2,-0.0 -1,-0.2 0, 0.0 2,-0.0 0.560 73.7 118.8 -82.2 -9.3 -48.0 -91.4 -25.5 4 -2 A F < + 0 0 132 -3,-1.1 3,-0.1 1,-0.1 0, 0.0 -0.308 30.7 169.1 -58.6 137.6 -47.1 -87.7 -25.7 5 -1 A Q - 0 0 194 1,-0.4 2,-0.3 -2,-0.0 -1,-0.1 0.700 51.3 -21.7-121.0 -40.4 -48.9 -85.7 -22.9 6 0 A G - 0 0 44 2,-0.0 -1,-0.4 158,-0.0 2,-0.3 -0.992 41.3-144.5-167.8 169.4 -47.4 -82.1 -22.7 7 1 A M - 0 0 83 158,-0.6 158,-1.7 -2,-0.3 2,-0.4 -0.981 8.8-170.4-148.1 133.9 -44.6 -79.7 -23.4 8 2 A T E -A 164 0A 77 -2,-0.3 2,-0.4 156,-0.2 156,-0.2 -0.989 6.9-160.9-125.6 134.2 -43.3 -76.7 -21.5 9 3 A E E -A 163 0A 63 154,-1.8 154,-1.8 -2,-0.4 2,-0.5 -0.933 6.2-151.5-113.9 136.2 -40.7 -74.1 -22.8 10 4 A T E -A 162 0A 92 -2,-0.4 2,-0.3 152,-0.2 152,-0.2 -0.946 17.4-178.3-108.9 125.4 -38.7 -71.8 -20.6 11 5 A F E -A 161 0A 65 150,-2.9 150,-2.3 -2,-0.5 2,-0.2 -0.905 24.8-124.8-118.2 147.5 -37.5 -68.4 -22.0 12 6 A A E -A 160 0A 38 -2,-0.3 148,-0.2 148,-0.2 2,-0.2 -0.550 36.1-110.5 -76.9 153.7 -35.4 -65.6 -20.5 13 7 A F - 0 0 3 146,-2.1 87,-0.2 -2,-0.2 2,-0.1 -0.531 35.3 -95.8 -78.5 152.8 -37.0 -62.2 -20.5 14 8 A Q > - 0 0 63 85,-2.4 4,-2.4 -2,-0.2 3,-0.3 -0.501 47.9-107.8 -62.4 143.2 -35.8 -59.4 -22.8 15 9 A A H > S+ 0 0 28 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.825 114.8 47.3 -54.1 -46.0 -33.4 -57.4 -20.6 16 10 A E H > S+ 0 0 58 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.925 112.6 49.8 -64.0 -42.5 -35.5 -54.2 -20.0 17 11 A I H > S+ 0 0 5 -3,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.906 109.9 52.3 -62.8 -39.0 -38.6 -56.3 -19.2 18 12 A N H X S+ 0 0 5 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.853 109.2 49.8 -59.9 -37.8 -36.4 -58.3 -16.7 19 13 A Q H X S+ 0 0 59 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.922 110.1 50.2 -68.2 -44.1 -35.3 -55.0 -15.2 20 14 A L H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.881 109.1 51.6 -63.0 -40.0 -38.9 -53.8 -14.9 21 15 A M H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.919 111.1 47.5 -63.3 -44.4 -40.0 -57.1 -13.2 22 16 A S H X S+ 0 0 31 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.932 113.2 48.6 -58.4 -47.2 -37.2 -56.8 -10.6 23 17 A L H X S+ 0 0 48 -4,-2.5 4,-0.9 1,-0.2 3,-0.2 0.938 115.3 42.9 -64.0 -48.6 -38.0 -53.2 -9.9 24 18 A I H >< S+ 0 0 0 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.946 113.2 50.6 -62.1 -49.3 -41.7 -53.8 -9.5 25 19 A I H 3< S+ 0 0 5 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.767 120.7 36.7 -64.3 -23.6 -41.4 -57.0 -7.4 26 20 A N H 3< S+ 0 0 34 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.462 88.1 123.5-103.5 -6.4 -38.9 -55.2 -5.0 27 21 A T << - 0 0 15 -4,-0.9 522,-0.1 -3,-0.9 -3,-0.0 -0.220 56.1-145.7 -68.0 150.4 -40.4 -51.7 -4.9 28 22 A F + 0 0 71 520,-0.2 -1,-0.1 2,-0.0 521,-0.1 0.126 47.3 149.4 -91.2 18.0 -41.4 -50.1 -1.6 29 23 A Y - 0 0 23 1,-0.1 3,-0.2 -5,-0.1 -2,-0.0 -0.309 39.5-150.6 -55.1 134.1 -44.2 -48.3 -3.4 30 24 A S S S+ 0 0 117 1,-0.2 2,-0.3 2,-0.1 3,-0.2 0.392 80.0 67.1 -96.0 0.8 -47.0 -47.9 -0.8 31 25 A N > + 0 0 58 1,-0.2 3,-1.3 2,-0.0 -1,-0.2 -0.493 53.7 152.8-122.6 63.0 -50.1 -48.0 -3.1 32 26 A K G > + 0 0 34 -2,-0.3 3,-2.0 1,-0.3 -1,-0.2 0.796 53.7 83.3 -64.3 -32.0 -50.0 -51.6 -4.3 33 27 A E G > + 0 0 44 1,-0.3 3,-1.8 -3,-0.2 4,-0.5 0.707 67.6 86.5 -47.5 -25.6 -53.7 -51.8 -4.8 34 28 A I G <> + 0 0 13 -3,-1.3 4,-1.4 1,-0.3 -1,-0.3 0.646 68.1 81.5 -53.6 -19.3 -53.3 -50.2 -8.3 35 29 A F H <> S+ 0 0 0 -3,-2.0 4,-2.2 96,-0.2 -1,-0.3 0.852 86.0 55.6 -54.3 -39.1 -52.6 -53.6 -9.8 36 30 A L H <> S+ 0 0 2 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.919 103.1 52.8 -67.0 -44.1 -56.3 -54.5 -10.0 37 31 A R H > S+ 0 0 41 -4,-0.5 4,-2.7 1,-0.2 -1,-0.2 0.878 111.1 49.4 -56.8 -39.1 -57.3 -51.4 -12.1 38 32 A E H X S+ 0 0 14 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.924 110.4 48.0 -68.4 -44.4 -54.6 -52.4 -14.5 39 33 A L H X S+ 0 0 6 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.919 115.5 45.9 -62.7 -40.2 -55.7 -56.0 -14.8 40 34 A I H X S+ 0 0 7 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.924 109.7 53.9 -69.0 -45.2 -59.3 -54.9 -15.3 41 35 A S H X S+ 0 0 48 -4,-2.7 4,-1.6 -5,-0.2 -1,-0.2 0.898 108.0 51.2 -51.4 -44.1 -58.2 -52.2 -17.8 42 36 A N H X S+ 0 0 72 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.863 108.2 51.5 -65.4 -36.8 -56.4 -54.9 -19.8 43 37 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.845 107.0 53.7 -66.4 -36.0 -59.6 -57.1 -19.8 44 38 A S H X S+ 0 0 9 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.846 108.8 48.9 -68.2 -34.8 -61.6 -54.2 -21.1 45 39 A D H X S+ 0 0 57 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.921 110.4 50.9 -69.5 -46.3 -59.2 -53.7 -24.0 46 40 A A H X S+ 0 0 13 -4,-2.2 4,-1.7 1,-0.2 41,-1.6 0.907 112.6 46.7 -53.2 -46.6 -59.3 -57.5 -24.8 47 41 A C H X S+ 0 0 0 -4,-2.4 4,-1.9 39,-0.3 -2,-0.2 0.912 109.6 54.2 -67.7 -41.4 -63.1 -57.3 -24.8 48 42 A D H X S+ 0 0 18 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.911 106.2 53.0 -54.4 -45.3 -63.1 -54.1 -27.0 49 43 A K H X S+ 0 0 93 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.935 110.5 44.0 -64.3 -48.0 -60.9 -55.8 -29.6 50 44 A I H X S+ 0 0 1 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.857 110.3 58.7 -62.6 -33.2 -63.2 -58.9 -30.1 51 45 A R H X S+ 0 0 64 -4,-1.9 4,-0.7 1,-0.2 -2,-0.2 0.940 106.1 46.9 -61.2 -46.3 -66.1 -56.5 -30.1 52 46 A Y H >X S+ 0 0 44 -4,-2.3 3,-0.6 1,-0.2 4,-0.6 0.843 109.4 54.2 -64.8 -33.9 -64.7 -54.6 -33.1 53 47 A Q H >X S+ 0 0 98 -4,-1.8 4,-1.9 1,-0.2 3,-0.7 0.876 103.1 58.7 -63.5 -36.5 -64.0 -57.9 -34.9 54 48 A S H 3< S+ 0 0 20 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.679 89.7 71.0 -67.8 -21.2 -67.6 -58.8 -34.4 55 49 A L H << S+ 0 0 113 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.866 115.4 23.5 -67.8 -36.3 -68.9 -55.7 -36.3 56 50 A T H << S+ 0 0 130 -3,-0.7 -2,-0.2 -4,-0.6 -1,-0.2 0.714 139.4 29.5 -94.8 -27.9 -67.7 -57.1 -39.6 57 51 A D >< - 0 0 77 -4,-1.9 3,-1.4 -5,-0.2 -1,-0.2 -0.765 60.1-178.9-140.7 88.1 -67.7 -60.8 -38.6 58 52 A P G > S+ 0 0 91 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.731 76.0 75.5 -55.5 -30.3 -70.3 -61.8 -35.9 59 53 A S G > S+ 0 0 83 1,-0.3 3,-2.4 2,-0.2 -5,-0.1 0.756 76.2 76.4 -57.8 -28.1 -69.1 -65.5 -35.9 60 54 A V G < S+ 0 0 14 -3,-1.4 -1,-0.3 1,-0.3 -6,-0.1 0.776 84.3 65.1 -56.4 -28.5 -65.9 -64.5 -33.9 61 55 A L G X S- 0 0 30 -3,-1.6 3,-1.9 1,-0.2 -1,-0.3 0.621 85.5-171.5 -68.3 -14.2 -68.1 -64.3 -30.7 62 56 A G T < - 0 0 60 -3,-2.4 -1,-0.2 1,-0.2 -2,-0.0 -0.302 63.7 -33.7 58.6-138.4 -68.7 -68.1 -31.0 63 57 A E T 3 S+ 0 0 111 1,-0.2 -1,-0.2 2,-0.0 -4,-0.0 -0.255 132.9 75.0-104.2 41.2 -71.4 -69.2 -28.5 64 58 A S < + 0 0 41 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.0 -0.475 45.7 144.2-149.5 70.0 -70.2 -66.5 -25.9 65 59 A P + 0 0 84 0, 0.0 2,-1.3 0, 0.0 -3,-0.1 0.607 47.3 92.4 -87.4 -15.5 -71.4 -63.0 -27.1 66 60 A R - 0 0 96 -5,-0.1 2,-0.3 2,-0.0 19,-0.1 -0.668 69.7-155.9 -83.3 94.7 -72.0 -61.5 -23.6 67 61 A L + 0 0 23 -2,-1.3 137,-0.5 -20,-0.1 2,-0.3 -0.530 28.5 141.3 -80.6 132.2 -68.6 -59.8 -22.9 68 62 A C E -b 204 0A 52 -2,-0.3 17,-0.8 135,-0.2 2,-0.4 -0.991 43.1-119.8-167.6 159.5 -67.7 -59.3 -19.3 69 63 A I E -bC 205 84A 0 135,-2.7 137,-3.1 -2,-0.3 2,-0.4 -0.859 22.7-163.8-113.6 139.9 -65.0 -59.4 -16.7 70 64 A R E -bC 206 83A 14 13,-2.5 13,-2.5 -2,-0.4 2,-0.5 -0.979 8.7-152.6-127.9 135.8 -64.9 -61.5 -13.5 71 65 A V E -bC 207 82A 0 135,-3.6 137,-2.6 -2,-0.4 11,-0.2 -0.926 14.9-169.3-107.4 130.9 -62.8 -61.3 -10.3 72 66 A V E - C 0 81A 41 9,-2.9 9,-1.2 -2,-0.5 2,-0.1 -0.835 5.5-167.9-130.1 93.9 -62.2 -64.5 -8.5 73 67 A P E - C 0 80A 8 0, 0.0 2,-0.3 0, 0.0 7,-0.2 -0.494 2.5-167.9 -71.0 150.0 -60.6 -64.7 -5.0 74 68 A D E >> - C 0 79A 40 5,-1.4 5,-1.7 -2,-0.1 4,-1.4 -0.794 9.3-176.0-142.8 94.0 -59.5 -68.1 -3.7 75 69 A K T 45S+ 0 0 63 -2,-0.3 -1,-0.1 1,-0.2 5,-0.0 0.817 84.0 53.9 -60.4 -33.4 -58.7 -68.1 0.0 76 70 A E T 45S+ 0 0 179 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.938 117.3 32.6 -70.7 -49.5 -57.5 -71.8 -0.1 77 71 A N T 45S- 0 0 98 2,-0.1 -1,-0.2 99,-0.0 -2,-0.2 0.574 105.0-126.2 -82.8 -9.6 -54.9 -71.4 -3.0 78 72 A K T <5 + 0 0 20 -4,-1.4 99,-1.6 1,-0.2 2,-0.3 0.938 65.8 130.4 62.8 48.9 -54.1 -67.9 -1.9 79 73 A T E < -CD 74 176A 20 -5,-1.7 -5,-1.4 97,-0.2 2,-0.4 -0.989 47.5-156.3-138.3 144.3 -54.7 -66.5 -5.4 80 74 A L E -CD 73 175A 2 95,-1.7 95,-3.3 -2,-0.3 2,-0.4 -0.955 19.0-164.4-117.6 137.3 -56.7 -63.7 -7.0 81 75 A T E -CD 72 174A 12 -9,-1.2 -9,-2.9 -2,-0.4 2,-0.5 -0.964 15.5-164.2-130.1 139.4 -57.8 -64.1 -10.6 82 76 A V E -CD 71 173A 3 91,-2.0 91,-3.1 -2,-0.4 2,-0.3 -0.994 22.9-179.6-119.4 120.6 -59.1 -61.6 -13.2 83 77 A E E +CD 70 172A 72 -13,-2.5 -13,-2.5 -2,-0.5 2,-0.3 -0.923 8.9 176.8-126.5 151.3 -60.7 -63.3 -16.2 84 78 A D E -CD 69 171A 21 87,-2.4 87,-2.0 -2,-0.3 -15,-0.2 -0.963 34.6-136.3-143.3 159.8 -62.4 -62.2 -19.4 85 79 A N + 0 0 19 -17,-0.8 85,-0.2 -2,-0.3 84,-0.1 -0.206 64.9 129.6-105.6 40.1 -63.9 -63.6 -22.6 86 80 A G S S- 0 0 0 85,-0.1 -39,-0.3 -18,-0.1 -40,-0.1 0.181 81.5 -66.5 -76.2-160.0 -62.1 -61.0 -24.8 87 81 A I S S- 0 0 33 -41,-1.6 59,-0.4 -42,-0.1 83,-0.2 0.818 71.5-161.1 -64.9 -31.3 -60.0 -61.7 -27.9 88 82 A G - 0 0 3 81,-0.1 2,-0.4 57,-0.1 57,-0.2 0.002 16.2 -77.3 69.0-179.4 -57.4 -63.6 -25.9 89 83 A M - 0 0 50 81,-0.4 56,-0.4 56,-0.1 62,-0.2 -0.924 24.0-139.6-131.7 139.1 -53.8 -64.4 -27.0 90 84 A T > - 0 0 24 -2,-0.4 4,-2.3 54,-0.2 5,-0.2 -0.300 41.7 -98.7 -81.4 171.1 -51.9 -66.8 -29.3 91 85 A K H > S+ 0 0 54 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.939 126.9 49.9 -56.0 -48.9 -48.6 -68.4 -28.4 92 86 A A H > S+ 0 0 49 1,-0.2 4,-3.8 2,-0.2 5,-0.5 0.929 108.3 53.4 -55.3 -48.6 -46.7 -65.7 -30.4 93 87 A D H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 5,-0.4 0.914 114.2 42.4 -51.8 -47.3 -48.7 -63.0 -28.6 94 88 A L H X S+ 0 0 0 -4,-2.3 4,-1.4 3,-0.2 -2,-0.2 0.951 118.4 42.9 -68.3 -49.8 -47.6 -64.5 -25.3 95 89 A V H <>S+ 0 0 19 -4,-3.4 5,-2.3 -5,-0.2 6,-0.3 0.928 125.1 34.3 -63.9 -45.6 -44.0 -65.2 -26.2 96 90 A N H ><>S+ 0 0 59 -4,-3.8 5,-2.2 -5,-0.3 3,-0.8 0.968 128.5 30.3 -73.6 -55.9 -43.5 -61.8 -28.0 97 91 A N H 3<5S+ 0 0 89 -4,-2.0 -3,-0.2 -5,-0.5 -2,-0.2 0.550 122.3 47.7 -90.0 -9.6 -45.7 -59.3 -26.1 98 92 A L T 3<5S- 0 0 19 -4,-1.4 -1,-0.2 -5,-0.4 -2,-0.1 -0.095 133.7 -16.8-121.4 35.2 -45.4 -60.9 -22.7 99 93 A G T < 5S+ 0 0 0 -3,-0.8 -85,-2.4 2,-0.2 -3,-0.2 0.031 118.8 48.8 176.3 -56.4 -41.7 -61.5 -22.5 100 94 A T T > - 0 0 152 -2,-0.3 3,-1.0 23,-0.1 4,-0.5 -0.251 39.4 -88.9 -85.4-179.5 -42.1 -52.0 -26.6 104 98 A S H 3> S+ 0 0 60 1,-0.2 4,-1.5 2,-0.1 5,-0.1 0.623 116.8 71.2 -70.7 -12.7 -41.0 -48.5 -26.0 105 99 A G H 3> S+ 0 0 0 20,-0.2 4,-3.1 2,-0.2 5,-0.3 0.777 82.9 66.4 -77.5 -29.2 -42.8 -48.2 -22.7 106 100 A T H <> S+ 0 0 2 -3,-1.0 4,-1.6 1,-0.2 -1,-0.2 0.960 111.6 33.6 -58.0 -53.8 -40.6 -50.5 -20.7 107 101 A K H X S+ 0 0 120 -4,-0.5 4,-2.7 2,-0.2 -1,-0.2 0.915 118.8 52.7 -68.4 -43.2 -37.6 -48.2 -20.9 108 102 A A H X S+ 0 0 10 -4,-1.5 4,-2.9 1,-0.2 -2,-0.2 0.918 108.4 50.4 -64.4 -43.4 -39.6 -45.0 -20.8 109 103 A F H X S+ 0 0 1 -4,-3.1 4,-2.4 2,-0.2 -1,-0.2 0.892 111.3 48.3 -59.9 -42.4 -41.5 -46.0 -17.7 110 104 A M H X S+ 0 0 29 -4,-1.6 4,-2.2 -5,-0.3 -2,-0.2 0.902 112.5 49.2 -66.4 -37.3 -38.3 -46.9 -15.9 111 105 A E H X S+ 0 0 102 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.883 109.9 51.5 -66.5 -38.8 -36.9 -43.5 -17.1 112 106 A A H <>S+ 0 0 31 -4,-2.9 5,-2.6 2,-0.2 -2,-0.2 0.913 110.3 48.8 -62.8 -43.8 -40.0 -41.7 -15.8 113 107 A L H ><5S+ 0 0 1 -4,-2.4 3,-1.8 3,-0.2 -2,-0.2 0.913 107.9 54.5 -61.8 -43.7 -39.7 -43.4 -12.4 114 108 A E H 3<5S+ 0 0 23 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.856 106.8 52.1 -57.2 -36.3 -36.0 -42.4 -12.3 115 109 A A T 3<5S- 0 0 54 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.195 132.7 -90.0 -88.4 15.3 -37.1 -38.8 -12.9 116 110 A G T < 5S+ 0 0 42 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.654 76.6 148.8 92.0 17.1 -39.6 -38.9 -10.0 117 111 A G < - 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