==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 29-APR-10 2XD6 . COMPND 2 MOLECULE: ATP-DEPENDENT MOLECULAR CHAPERONE HSP82; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR S.M.ROE,C.PRODROMOU,L.H.PEARL,C.J.MOODY . 214 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10656.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 151 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 18.7 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 . 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 . 15 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.3 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 0 1 0 1 1 1 0 0 0 0 0 0 0 0 1 0 0 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 2 1 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 1 A M 0 0 139 0, 0.0 2,-0.3 0, 0.0 161,-0.1 0.000 360.0 360.0 360.0 124.1 -32.4 -13.9 4.5 2 2 A A - 0 0 80 1,-0.1 158,-0.4 157,-0.0 2,-0.2 -0.513 360.0-140.4 -81.4 128.8 -29.0 -15.1 5.9 3 3 A S - 0 0 68 -2,-0.3 2,-0.4 156,-0.1 156,-0.2 -0.482 9.6-141.9 -73.6 149.9 -26.1 -12.8 6.3 4 4 A E E -A 158 0A 88 154,-2.2 154,-2.0 -2,-0.2 2,-0.4 -0.947 14.3-142.3-109.3 141.4 -22.5 -13.9 5.5 5 5 A T E -A 157 0A 88 -2,-0.4 2,-0.3 152,-0.2 152,-0.2 -0.858 19.2-178.4-107.4 138.3 -19.7 -12.8 7.8 6 6 A F E -A 156 0A 41 150,-2.8 150,-2.1 -2,-0.4 2,-0.4 -0.915 24.5-120.2-130.7 154.9 -16.2 -11.8 6.5 7 7 A E E -A 155 0A 132 -2,-0.3 148,-0.3 148,-0.2 2,-0.2 -0.784 26.1-124.8 -96.8 140.4 -13.0 -10.7 8.2 8 8 A F - 0 0 13 146,-3.6 87,-0.2 -2,-0.4 2,-0.1 -0.541 34.9 -98.6 -73.7 146.0 -11.4 -7.3 7.4 9 9 A Q >> - 0 0 66 85,-2.5 4,-1.7 -2,-0.2 3,-1.2 -0.485 44.2-114.5 -54.3 137.6 -7.8 -7.3 6.3 10 10 A A H 3> S+ 0 0 57 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.817 112.2 55.0 -55.7 -39.0 -6.0 -6.4 9.6 11 11 A E H 3> S+ 0 0 54 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.806 105.5 53.5 -65.8 -29.6 -4.7 -3.0 8.4 12 12 A I H <> S+ 0 0 0 -3,-1.2 4,-2.8 2,-0.2 5,-0.2 0.930 107.3 51.0 -69.3 -44.8 -8.2 -1.9 7.5 13 13 A T H X S+ 0 0 38 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.905 110.9 49.3 -55.8 -41.8 -9.3 -2.8 11.0 14 14 A Q H X S+ 0 0 100 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.921 110.8 49.9 -64.1 -44.4 -6.5 -0.7 12.3 15 15 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.946 109.2 50.3 -61.2 -48.0 -7.4 2.3 10.1 16 16 A M H X S+ 0 0 0 -4,-2.8 4,-3.2 1,-0.2 5,-0.2 0.893 111.1 50.4 -57.6 -39.8 -11.0 2.2 11.1 17 17 A S H X S+ 0 0 57 -4,-1.9 4,-1.5 -5,-0.2 5,-0.2 0.937 109.4 49.7 -65.2 -48.4 -10.0 2.2 14.7 18 18 A L H X S+ 0 0 73 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.947 117.8 42.1 -49.8 -50.3 -7.7 5.2 14.3 19 19 A I H < S+ 0 0 2 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.902 111.8 49.0 -72.5 -43.7 -10.5 7.0 12.5 20 20 A I H < S+ 0 0 35 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.758 119.4 40.5 -72.0 -20.0 -13.5 6.2 14.7 21 21 A N H < S+ 0 0 113 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.644 88.2 113.4 -98.0 -18.8 -11.6 7.1 17.8 22 22 A T < - 0 0 50 -4,-1.3 -3,-0.0 -5,-0.2 -4,-0.0 -0.240 56.7-151.5 -61.2 138.4 -9.7 10.2 16.6 23 23 A V + 0 0 138 4,-0.0 -1,-0.1 0, 0.0 4,-0.1 0.130 41.7 157.8 -90.6 18.6 -10.6 13.6 18.1 24 24 A Y - 0 0 47 -5,-0.1 3,-0.3 1,-0.1 89,-0.0 -0.046 41.1-134.6 -43.5 147.8 -9.5 15.2 14.8 25 25 A S S S+ 0 0 118 1,-0.2 2,-1.2 2,-0.1 3,-0.2 0.857 87.5 58.8 -84.9 -38.9 -11.1 18.6 14.3 26 26 A N > + 0 0 35 1,-0.2 3,-1.6 2,-0.1 -1,-0.2 -0.478 53.2 155.3 -98.3 65.4 -12.4 18.7 10.7 27 27 A K T > + 0 0 31 -2,-1.2 3,-1.7 -3,-0.3 -1,-0.2 0.744 60.6 78.9 -62.1 -22.7 -14.9 15.7 10.7 28 28 A E T >> + 0 0 25 1,-0.3 3,-1.3 -3,-0.2 4,-0.6 0.601 69.1 84.9 -63.8 -13.7 -16.8 17.3 7.8 29 29 A I H <> S+ 0 0 14 -3,-1.6 4,-1.7 1,-0.2 3,-0.3 0.725 70.7 78.7 -63.0 -19.9 -14.2 16.2 5.3 30 30 A F H <> S+ 0 0 0 -3,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.856 87.5 56.7 -56.1 -36.4 -16.0 12.8 5.1 31 31 A L H <> S+ 0 0 3 -3,-1.3 4,-2.3 1,-0.2 5,-0.2 0.907 104.4 50.7 -68.3 -40.2 -18.6 14.3 2.8 32 32 A R H X S+ 0 0 115 -4,-0.6 4,-2.2 -3,-0.3 -1,-0.2 0.919 111.0 49.8 -58.4 -47.1 -16.1 15.4 0.2 33 33 A E H X S+ 0 0 16 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.879 113.2 45.3 -59.1 -42.3 -14.5 12.0 0.2 34 34 A L H X S+ 0 0 5 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.851 112.7 49.4 -75.3 -33.9 -17.9 10.2 -0.3 35 35 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.877 110.5 53.2 -69.4 -35.5 -19.0 12.6 -3.0 36 36 A S H X S+ 0 0 49 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.931 110.0 45.5 -64.7 -46.5 -15.7 12.1 -4.7 37 37 A N H X S+ 0 0 63 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.881 112.5 52.7 -61.0 -38.8 -16.2 8.3 -4.7 38 38 A A H X S+ 0 0 3 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.949 109.4 48.4 -60.6 -49.5 -19.7 8.8 -5.9 39 39 A S H X S+ 0 0 18 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.891 111.4 50.2 -58.1 -44.7 -18.4 10.9 -8.8 40 40 A D H X S+ 0 0 73 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.887 108.2 51.9 -61.4 -41.8 -15.8 8.3 -9.7 41 41 A A H X S+ 0 0 18 -4,-2.3 41,-1.7 1,-0.2 4,-1.7 0.871 111.1 48.8 -64.7 -36.3 -18.4 5.5 -9.7 42 42 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 39,-0.3 -2,-0.2 0.886 106.9 54.9 -67.8 -42.2 -20.5 7.6 -12.0 43 43 A D H X S+ 0 0 58 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.913 107.2 54.0 -52.6 -43.1 -17.4 8.3 -14.3 44 44 A K H X S+ 0 0 125 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.916 109.3 42.6 -66.4 -46.3 -17.0 4.5 -14.5 45 45 A I H X S+ 0 0 1 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.871 116.0 51.2 -66.1 -34.2 -20.6 3.6 -15.7 46 46 A R H X S+ 0 0 111 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.940 113.0 44.8 -68.0 -45.1 -20.4 6.6 -18.1 47 47 A Y H >< S+ 0 0 177 -4,-3.1 3,-1.1 -5,-0.2 4,-0.4 0.926 113.4 49.6 -62.5 -46.6 -17.1 5.4 -19.5 48 48 A K H >X S+ 0 0 75 -4,-2.8 3,-1.4 1,-0.2 4,-0.6 0.887 105.0 59.9 -56.4 -38.0 -18.3 1.8 -19.7 49 49 A S H 3< S+ 0 0 14 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.634 83.2 80.9 -70.8 -15.6 -21.4 2.9 -21.5 50 50 A L T << S+ 0 0 125 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.848 112.1 20.8 -55.9 -34.8 -19.3 4.4 -24.3 51 51 A S T <4 S+ 0 0 118 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.374 136.0 39.1-115.8 0.5 -19.0 0.9 -25.8 52 52 A D >< + 0 0 60 -4,-0.6 3,-1.8 1,-0.1 -1,-0.2 -0.568 65.6 173.5-151.3 73.1 -22.0 -0.6 -24.1 53 53 A P G > S+ 0 0 92 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.785 72.0 67.7 -61.5 -32.1 -24.8 2.0 -24.0 54 54 A K G > S+ 0 0 92 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.621 79.6 81.1 -69.6 -7.8 -27.5 -0.3 -22.6 55 55 A Q G < S+ 0 0 28 -3,-1.8 3,-0.3 1,-0.2 -1,-0.3 0.726 90.5 54.9 -62.9 -20.6 -25.6 -0.4 -19.3 56 56 A L G X S+ 0 0 45 -3,-2.0 3,-2.0 -4,-0.2 -1,-0.2 0.689 84.7 82.7 -84.1 -20.7 -27.2 2.9 -18.6 57 57 A E T < S+ 0 0 143 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.698 76.8 68.0 -65.1 -24.5 -30.8 1.7 -19.1 58 58 A T T 3 S- 0 0 66 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.680 130.9 -2.2 -66.7 -17.2 -31.2 0.3 -15.6 59 59 A E < - 0 0 35 -3,-2.0 -1,-0.3 109,-0.2 -2,-0.1 -0.418 68.3-174.9-173.6 87.7 -31.0 4.0 -14.5 60 60 A P + 0 0 90 0, 0.0 2,-0.5 0, 0.0 -3,-0.1 0.690 62.2 88.5 -69.3 -19.1 -30.5 6.6 -17.2 61 61 A D - 0 0 109 -4,-0.1 2,-0.7 -5,-0.1 0, 0.0 -0.713 65.0-153.7 -87.3 127.9 -30.1 9.5 -14.8 62 62 A L + 0 0 40 -2,-0.5 2,-0.3 17,-0.1 19,-0.1 -0.878 37.6 135.6-102.7 111.4 -26.6 10.2 -13.5 63 63 A F - 0 0 5 -2,-0.7 17,-1.4 140,-0.1 2,-0.4 -0.969 50.1-135.3-153.2 162.0 -26.8 11.9 -10.1 64 64 A I E -Bc 79 205A 0 140,-2.3 142,-3.4 -2,-0.3 2,-0.4 -0.983 31.1-171.2-119.9 133.9 -25.5 12.1 -6.6 65 65 A R E -Bc 78 206A 65 13,-2.9 13,-3.5 -2,-0.4 2,-0.5 -0.995 13.2-159.2-136.1 133.2 -28.2 12.5 -3.9 66 66 A I E -Bc 77 207A 0 140,-3.5 142,-2.7 -2,-0.4 11,-0.2 -0.954 11.3-175.0-116.0 125.1 -27.9 13.2 -0.2 67 67 A T E -B 76 0A 26 9,-2.6 9,-1.9 -2,-0.5 2,-0.2 -0.881 11.5-155.6-130.0 102.1 -30.9 12.3 2.1 68 68 A P E -B 75 0A 17 0, 0.0 7,-0.2 0, 0.0 117,-0.1 -0.529 5.0-169.9 -67.2 134.0 -31.0 13.1 5.8 69 69 A K E >>> -B 74 0A 51 5,-3.3 5,-1.9 -2,-0.2 3,-0.9 -0.705 7.1-179.3-125.4 78.9 -33.3 10.8 7.8 70 70 A P G >45S+ 0 0 84 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.825 75.2 56.1 -50.0 -47.3 -33.4 12.6 11.2 71 71 A E G 345S+ 0 0 178 1,-0.3 -2,-0.0 2,-0.1 0, 0.0 0.878 116.0 37.1 -58.8 -39.7 -35.6 10.1 13.0 72 72 A Q G <45S- 0 0 104 -3,-0.9 -1,-0.3 2,-0.1 3,-0.1 0.472 107.9-124.9 -87.3 -2.5 -33.2 7.3 12.3 73 73 A K T <<5 + 0 0 80 -3,-1.3 104,-1.9 -4,-0.7 2,-0.4 0.923 65.4 142.3 53.1 47.7 -30.2 9.6 12.8 74 74 A V E < -BD 69 176A 3 -5,-1.9 -5,-3.3 102,-0.2 2,-0.4 -0.908 41.2-164.1-122.0 144.5 -29.1 8.5 9.3 75 75 A L E -BD 68 175A 1 100,-2.3 100,-3.0 -2,-0.4 2,-0.4 -0.994 12.9-159.6-125.2 124.5 -27.5 10.2 6.4 76 76 A E E -BD 67 174A 5 -9,-1.9 -9,-2.6 -2,-0.4 2,-0.5 -0.879 9.3-167.8-108.0 134.5 -27.6 8.6 3.0 77 77 A I E -BD 66 173A 5 96,-2.2 96,-2.6 -2,-0.4 2,-0.3 -0.968 19.9-176.5-117.3 112.9 -25.3 9.4 0.1 78 78 A R E +BD 65 172A 24 -13,-3.5 -13,-2.9 -2,-0.5 2,-0.3 -0.832 11.4 175.7-113.0 144.0 -26.6 7.9 -3.1 79 79 A D E -BD 64 171A 11 92,-2.4 92,-1.7 -2,-0.3 -15,-0.2 -0.971 31.9-137.9-138.5 160.3 -25.2 7.7 -6.6 80 80 A S + 0 0 0 -17,-1.4 90,-0.2 -2,-0.3 -16,-0.1 -0.217 62.6 130.2-105.1 38.9 -26.3 6.0 -9.8 81 81 A G S S- 0 0 0 90,-0.1 -39,-0.3 -18,-0.1 -40,-0.1 0.193 79.3 -63.2 -76.3-158.1 -22.8 4.9 -10.7 82 82 A I S S- 0 0 40 -41,-1.7 59,-0.5 1,-0.1 88,-0.2 0.765 70.1-156.3 -67.4 -26.5 -21.5 1.6 -11.7 83 83 A G - 0 0 4 86,-0.2 2,-0.4 57,-0.2 57,-0.2 -0.087 14.7 -89.8 74.9 178.8 -22.4 -0.2 -8.4 84 84 A M - 0 0 29 86,-0.4 56,-0.4 62,-0.1 62,-0.2 -0.996 22.2-136.5-135.3 136.2 -20.8 -3.3 -6.9 85 85 A T > - 0 0 21 -2,-0.4 4,-2.3 54,-0.2 5,-0.2 -0.256 43.5 -95.4 -72.7 172.1 -21.5 -7.0 -7.2 86 86 A K H > S+ 0 0 49 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.939 128.7 48.8 -53.9 -48.3 -21.5 -9.1 -4.1 87 87 A A H > S+ 0 0 66 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.832 109.6 52.2 -64.5 -32.9 -17.9 -10.1 -4.8 88 88 A E H > S+ 0 0 73 2,-0.2 4,-3.2 3,-0.2 5,-0.4 0.896 107.6 51.9 -70.1 -39.4 -16.9 -6.5 -5.4 89 89 A L H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 5,-0.3 0.946 113.9 43.7 -59.1 -50.0 -18.3 -5.5 -2.1 90 90 A I H X>S+ 0 0 28 -4,-2.2 5,-2.1 -5,-0.2 4,-1.1 0.924 122.7 38.2 -58.9 -47.6 -16.4 -8.2 -0.3 91 91 A N H <>S+ 0 0 64 -4,-2.5 5,-1.0 -5,-0.2 -2,-0.2 0.965 120.7 40.5 -71.2 -55.6 -13.2 -7.4 -2.3 92 92 A N H <5S+ 0 0 74 -4,-3.2 -3,-0.2 1,-0.2 -1,-0.2 0.763 123.3 35.0 -67.1 -32.0 -13.2 -3.6 -2.5 93 93 A L H <5S- 0 0 17 -4,-1.6 -1,-0.2 -5,-0.4 -3,-0.2 0.651 129.9 -5.5-105.5 -16.2 -14.4 -2.8 1.0 94 94 A G T <5S+ 0 0 0 -4,-1.1 -85,-2.5 -5,-0.3 -82,-0.2 0.632 113.9 51.7-141.8 -59.5 -13.0 -5.4 3.3 95 95 A T T S+ 0 0 24 20,-0.4 4,-2.7 -3,-0.1 -1,-0.4 -0.628 98.6 65.3 27.2 -68.6 -2.9 3.0 0.6 101 101 A T H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.902 105.0 36.0 -49.0 -58.9 -4.1 1.8 4.1 102 102 A K H > S+ 0 0 33 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.909 117.4 52.3 -66.5 -43.0 -0.7 1.2 5.8 103 103 A A H > S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.857 108.5 51.6 -62.8 -36.3 1.0 4.2 4.1 104 104 A F H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.903 108.3 51.0 -67.2 -41.3 -1.8 6.6 5.2 105 105 A M H X S+ 0 0 17 -4,-1.8 4,-2.3 -5,-0.3 -2,-0.2 0.887 110.6 49.7 -63.1 -38.4 -1.5 5.4 8.8 106 106 A E H X S+ 0 0 124 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.919 110.2 49.8 -64.5 -43.5 2.2 6.0 8.6 107 107 A A H X>S+ 0 0 21 -4,-2.3 5,-2.5 1,-0.2 4,-0.7 0.911 109.8 52.8 -61.0 -41.9 1.6 9.5 7.1 108 108 A L H ><5S+ 0 0 41 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.946 105.8 52.3 -56.6 -51.4 -0.8 10.2 10.0 109 109 A S H 3<5S+ 0 0 110 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.824 107.6 53.5 -54.5 -34.4 1.7 9.2 12.6 110 110 A A H 3<5S- 0 0 94 -4,-1.5 -1,-0.3 -3,-0.1 -2,-0.2 0.619 132.0 -89.4 -79.8 -14.2 4.2 11.6 11.1 111 111 A G T <<5S+ 0 0 64 -3,-1.5 -3,-0.2 -4,-0.7 -2,-0.1 0.419 70.7 155.0 124.3 2.4 1.7 14.5 11.3 112 112 A A < - 0 0 29 -5,-2.5 -1,-0.2 -6,-0.2 2,-0.2 -0.225 49.4-104.3 -62.3 148.8 -0.3 14.4 8.0 113 113 A D > - 0 0 72 1,-0.1 3,-2.5 2,-0.0 4,-0.2 -0.509 19.6-128.5 -73.3 139.2 -3.8 15.8 8.0 114 114 A V G > S+ 0 0 8 1,-0.3 3,-2.1 -2,-0.2 4,-0.2 0.779 105.7 75.6 -58.6 -22.1 -6.6 13.3 7.9 115 115 A S G > S+ 0 0 44 1,-0.3 3,-0.6 2,-0.1 -1,-0.3 0.673 80.4 69.3 -65.5 -14.9 -7.9 15.2 4.9 116 116 A M G X> + 0 0 64 -3,-2.5 3,-2.0 1,-0.2 4,-0.7 0.560 69.5 102.2 -72.9 -7.3 -5.1 13.6 2.9 117 117 A I G X4>S+ 0 0 0 -3,-2.1 5,-1.7 1,-0.3 3,-1.0 0.815 74.9 54.5 -52.6 -37.3 -6.9 10.3 3.2 118 118 A G G X45S+ 0 0 31 -3,-0.6 3,-0.7 1,-0.3 -1,-0.3 0.759 99.7 60.8 -68.8 -24.8 -8.4 10.4 -0.3 119 119 A Q G <45S+ 0 0 158 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.656 104.3 50.6 -76.5 -15.8 -4.9 10.8 -1.8 120 120 A F G <<5S- 0 0 58 -3,-1.0 -20,-0.4 -4,-0.7 -1,-0.2 0.402 117.7-117.6 -97.0 -2.0 -4.1 7.5 -0.3 121 121 A G T < 5S+ 0 0 66 -3,-0.7 -3,-0.2 -4,-0.2 -20,-0.1 0.696 91.3 97.2 81.5 20.8 -7.2 6.0 -1.9 122 122 A V > < + 0 0 8 -5,-1.7 3,-1.3 -22,-0.1 4,-0.2 -0.022 34.3 128.3-129.8 28.6 -9.0 5.0 1.3 123 123 A G G > + 0 0 3 1,-0.3 3,-2.0 -6,-0.2 4,-0.2 0.731 58.5 77.3 -61.5 -25.5 -11.3 8.0 1.8 124 124 A F G > S+ 0 0 14 1,-0.3 3,-1.7 2,-0.2 -1,-0.3 0.900 87.8 58.9 -46.6 -45.9 -14.3 5.7 2.2 125 125 A Y G X S+ 0 0 8 -3,-1.3 3,-1.7 1,-0.3 -1,-0.3 0.586 81.8 84.3 -68.9 -8.4 -13.2 5.0 5.7 126 126 A S G X S+ 0 0 0 -3,-2.0 3,-1.8 1,-0.3 4,-0.3 0.654 70.3 81.3 -65.0 -13.9 -13.4 8.7 6.6 127 127 A L G X> S+ 0 0 0 -3,-1.7 4,-1.5 1,-0.3 3,-1.1 0.731 76.4 70.4 -65.4 -20.0 -17.1 8.1 7.2 128 128 A F G <4 S+ 0 0 0 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.585 79.1 77.2 -77.5 -7.6 -16.2 6.8 10.6 129 129 A L G <4 S+ 0 0 0 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.871 116.5 14.6 -61.1 -36.7 -15.3 10.3 11.6 130 130 A V T <4 S+ 0 0 0 -3,-1.1 48,-3.0 -4,-0.3 2,-0.3 0.524 125.2 56.4-118.6 -9.8 -19.1 11.0 12.0 131 131 A A E < -E 177 0A 0 -4,-1.5 46,-0.2 46,-0.3 -1,-0.1 -0.950 48.8-164.9-129.1 145.0 -20.7 7.5 12.0 132 132 A D E S+ 0 0 72 44,-1.6 2,-0.3 -2,-0.3 45,-0.1 0.438 84.4 30.4-103.9 -2.3 -20.2 4.5 14.2 133 133 A R E -E 176 0A 93 43,-0.9 43,-2.4 -6,-0.1 2,-0.3 -0.989 65.6-172.6-153.1 148.0 -22.0 2.2 11.7 134 134 A V E -EF 175 150A 0 16,-2.2 16,-2.3 -2,-0.3 2,-0.5 -0.994 12.0-160.9-146.5 138.6 -22.5 2.0 8.0 135 135 A Q E -EF 174 149A 23 39,-2.2 39,-3.3 -2,-0.3 2,-0.7 -0.989 10.4-158.2-114.0 127.2 -24.5 0.0 5.4 136 136 A V E -EF 173 148A 1 12,-3.2 12,-2.7 -2,-0.5 2,-0.5 -0.935 10.1-168.0-104.5 112.3 -23.4 0.1 1.8 137 137 A I E +EF 172 147A 0 35,-3.0 35,-3.0 -2,-0.7 2,-0.4 -0.892 14.7 176.6-104.3 122.8 -26.3 -0.9 -0.4 138 138 A S E -EF 171 146A 0 8,-2.6 8,-2.1 -2,-0.5 2,-0.4 -0.981 24.9-172.6-139.8 140.5 -25.3 -1.6 -4.0 139 139 A K E -E 170 0A 42 31,-2.9 31,-2.9 -2,-0.4 2,-0.3 -0.960 9.8-175.7-129.2 110.7 -26.7 -2.7 -7.3 140 140 A S > - 0 0 4 4,-0.5 3,-1.8 -56,-0.4 -57,-0.2 -0.788 38.1-120.5 -93.8 148.8 -24.4 -3.5 -10.2 141 141 A N T 3 S+ 0 0 41 -59,-0.5 -1,-0.1 -2,-0.3 -58,-0.1 0.757 114.9 59.3 -52.8 -24.8 -26.0 -4.4 -13.5 142 142 A D T 3 S+ 0 0 106 2,-0.1 2,-0.3 -59,-0.0 -1,-0.3 0.462 112.0 22.9 -88.8 -4.2 -24.0 -7.6 -13.0 143 143 A D S < S- 0 0 47 -3,-1.8 3,-0.1 -58,-0.1 2,-0.1 -0.899 83.6 -84.9-150.7 174.3 -25.6 -8.8 -9.8 144 144 A E - 0 0 119 -2,-0.3 -4,-0.5 1,-0.1 2,-0.3 -0.273 62.5 -79.7 -72.8 170.5 -28.5 -8.6 -7.4 145 145 A Q - 0 0 4 16,-0.2 16,-2.5 -6,-0.2 2,-0.3 -0.614 56.7-174.6 -76.9 134.8 -28.8 -5.9 -4.8 146 146 A Y E -FG 138 160A 33 -8,-2.1 -8,-2.6 -2,-0.3 2,-0.5 -0.937 21.8-140.5-133.5 153.0 -26.7 -6.5 -1.7 147 147 A I E -FG 137 159A 15 12,-2.8 12,-2.5 -2,-0.3 2,-0.4 -0.971 12.0-168.9-116.0 121.8 -26.1 -4.9 1.7 148 148 A W E -FG 136 158A 0 -12,-2.7 -12,-3.2 -2,-0.5 2,-0.4 -0.912 15.8-169.4-104.5 133.9 -22.5 -4.7 3.1 149 149 A E E +FG 135 157A 49 8,-2.6 8,-2.1 -2,-0.4 2,-0.3 -0.989 12.4 170.2-136.2 137.8 -22.5 -3.7 6.8 150 150 A S E -F 134 0A 3 -16,-2.3 -16,-2.2 -2,-0.4 6,-0.1 -0.998 26.2-170.1-144.2 143.6 -19.8 -2.6 9.3 151 151 A N - 0 0 104 4,-0.5 3,-0.1 -2,-0.3 -18,-0.1 -0.087 68.8 -92.6-116.1 31.7 -19.5 -1.2 12.8 152 152 A A S S+ 0 0 15 1,-0.2 -132,-0.1 -18,-0.1 4,-0.1 0.495 91.3 127.4 68.5 5.4 -15.7 -0.6 12.5 153 153 A G S S- 0 0 28 2,-0.3 -1,-0.2 1,-0.1 -137,-0.1 -0.097 80.7 -91.0 -76.8-174.5 -15.1 -4.0 14.1 154 154 A G S S+ 0 0 31 -3,-0.1 -146,-3.6 -147,-0.1 2,-0.3 0.536 105.8 52.8 -78.3 -5.9 -12.9 -6.6 12.5 155 155 A S E -A 7 0A 47 -148,-0.3 -4,-0.5 -142,-0.1 2,-0.3 -0.944 60.2-167.7-132.5 150.4 -15.7 -8.2 10.6 156 156 A F E -A 6 0A 2 -150,-2.1 -150,-2.8 -2,-0.3 2,-0.3 -0.908 15.6-132.4-128.6 162.4 -18.4 -7.1 8.2 157 157 A T E -AG 5 149A 32 -8,-2.1 -8,-2.6 -2,-0.3 2,-0.4 -0.851 7.2-160.4-113.1 152.4 -21.5 -8.8 6.8 158 158 A V E +AG 4 148A 2 -154,-2.0 -154,-2.2 -2,-0.3 2,-0.4 -0.999 18.5 177.6-127.8 127.9 -22.9 -9.1 3.3 159 159 A T E - G 0 147A 18 -12,-2.5 -12,-2.8 -2,-0.4 -156,-0.1 -0.996 37.1-109.7-135.6 132.6 -26.6 -9.9 2.8 160 160 A L E - G 0 146A 45 -158,-0.4 2,-0.8 -2,-0.4 -14,-0.2 -0.438 48.9-114.7 -54.8 129.5 -28.8 -10.3 -0.2 161 161 A D + 0 0 4 -16,-2.5 -16,-0.2 1,-0.2 -1,-0.1 -0.627 59.0 142.8 -86.0 110.3 -31.1 -7.2 -0.0 162 162 A E S S+ 0 0 129 -2,-0.8 -1,-0.2 -161,-0.1 -2,-0.1 0.068 70.3 55.7-123.5 21.5 -34.7 -7.9 0.6 163 163 A V S S+ 0 0 120 2,-0.1 2,-0.2 0, 0.0 -2,-0.1 0.577 89.9 70.2-130.1 -16.0 -35.4 -4.9 2.9 164 164 A N S S- 0 0 21 1,-0.1 3,-0.1 3,-0.0 -17,-0.0 -0.640 88.8 -83.6-106.4 163.5 -34.4 -1.7 1.1 165 165 A E - 0 0 100 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.257 53.7-103.4 -56.4 147.5 -35.8 0.3 -1.9 166 166 A R - 0 0 137 -4,-0.1 2,-0.4 -21,-0.0 -1,-0.1 -0.595 31.1-155.5 -70.7 131.6 -34.7 -1.0 -5.2 167 167 A I - 0 0 6 -2,-0.3 3,-0.2 1,-0.2 -108,-0.0 -0.910 14.0-140.1-101.3 141.8 -32.0 1.1 -6.8 168 168 A G S S- 0 0 30 -2,-0.4 2,-0.3 1,-0.3 -1,-0.2 0.969 80.3 -27.9 -61.4 -49.0 -31.9 0.8 -10.6 169 169 A R S S+ 0 0 0 -3,-0.1 -1,-0.3 -90,-0.1 2,-0.3 -0.947 103.4 46.1-164.0 142.8 -28.1 0.9 -10.4 170 170 A G E S- E 0 139A 0 -31,-2.9 -31,-2.9 -2,-0.3 -86,-0.4 -0.868 71.5 -62.7 126.3-150.2 -25.5 2.3 -8.1 171 171 A T E -DE 79 138A 8 -92,-1.7 -92,-2.4 -2,-0.3 2,-0.4 -0.990 21.4-158.3-147.7 142.3 -24.7 2.6 -4.5 172 172 A I E -DE 78 137A 0 -35,-3.0 -35,-3.0 -2,-0.3 2,-0.7 -0.996 8.5-156.6-121.4 127.3 -26.1 4.1 -1.2 173 173 A L E -DE 77 136A 21 -96,-2.6 -96,-2.2 -2,-0.4 2,-0.8 -0.922 12.7-163.3 -96.6 111.7 -23.9 4.7 1.8 174 174 A R E -DE 76 135A 31 -39,-3.3 -39,-2.2 -2,-0.7 2,-0.5 -0.871 7.6-163.2 -99.5 105.7 -26.2 4.7 4.7 175 175 A L E -DE 75 134A 0 -100,-3.0 -100,-2.3 -2,-0.8 2,-1.0 -0.805 13.9-151.8 -95.8 124.6 -24.4 6.4 7.6 176 176 A F E -DE 74 133A 38 -43,-2.4 -44,-1.6 -2,-0.5 -43,-0.9 -0.835 31.1-138.2 -91.4 100.6 -25.6 5.9 11.2 177 177 A L E - E 0 131A 7 -104,-1.9 -46,-0.3 -2,-1.0 5,-0.1 -0.234 10.8-110.6 -68.0 145.0 -24.4 9.2 12.7 178 178 A K > - 0 0 25 -48,-3.0 3,-2.1 1,-0.1 -1,-0.1 -0.375 35.6-107.9 -64.0 153.6 -22.8 9.4 16.1 179 179 A D T 3 S+ 0 0 115 1,-0.3 3,-0.5 2,-0.2 -1,-0.1 0.749 119.8 47.6 -59.7 -27.3 -25.0 11.3 18.7 180 180 A D T 3 S+ 0 0 112 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.333 104.8 62.4 -94.8 7.7 -22.8 14.3 18.7 181 181 A Q X + 0 0 13 -3,-2.1 3,-1.5 -51,-0.2 -1,-0.2 0.087 60.8 117.1-119.4 22.6 -22.7 14.5 14.9 182 182 A L G > + 0 0 52 -3,-0.5 3,-1.6 1,-0.3 4,-0.2 0.499 52.8 87.3 -73.3 -3.1 -26.3 15.1 14.1 183 183 A E G > S+ 0 0 67 1,-0.3 3,-1.6 -3,-0.2 7,-0.3 0.745 75.8 69.6 -66.5 -22.4 -25.6 18.4 12.6 184 184 A Y G < S+ 0 0 7 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.1 0.418 87.5 65.0 -80.3 4.9 -25.0 16.6 9.3 185 185 A L G < S+ 0 0 23 -3,-1.6 2,-0.4 -117,-0.1 -1,-0.3 0.543 84.6 100.0 -90.2 -12.0 -28.8 15.9 9.2 186 186 A E S <> S- 0 0 115 -3,-1.6 4,-2.9 -4,-0.2 5,-0.3 -0.620 71.0-141.5 -88.8 128.3 -29.3 19.7 8.9 187 187 A E H > S+ 0 0 90 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.890 101.1 45.7 -49.6 -50.9 -30.0 21.2 5.5 188 188 A K H > S+ 0 0 75 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.924 114.1 47.7 -63.8 -46.5 -28.0 24.4 6.1 189 189 A R H > S+ 0 0 41 -6,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.942 113.8 47.9 -58.8 -48.8 -25.0 22.5 7.5 190 190 A I H X S+ 0 0 2 -4,-2.9 4,-2.5 -7,-0.3 -2,-0.2 0.941 112.3 49.2 -57.0 -51.5 -25.0 20.0 4.6 191 191 A K H X S+ 0 0 99 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.896 110.2 51.5 -53.0 -47.2 -25.3 22.7 2.0 192 192 A E H X S+ 0 0 88 -4,-2.5 4,-1.1 -5,-0.2 -1,-0.2 0.931 111.7 46.0 -58.8 -46.8 -22.4 24.7 3.6 193 193 A V H X S+ 0 0 4 -4,-2.3 4,-1.3 1,-0.2 3,-0.3 0.916 112.6 50.0 -65.7 -43.6 -20.1 21.6 3.6 194 194 A I H X S+ 0 0 23 -4,-2.5 4,-0.9 1,-0.2 3,-0.4 0.938 109.0 50.6 -58.7 -50.5 -20.9 20.6 -0.0 195 195 A K H < S+ 0 0 117 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.762 106.9 58.6 -61.2 -25.7 -20.3 24.1 -1.5 196 196 A R H < S+ 0 0 113 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.896 119.7 17.1 -75.6 -42.4 -17.0 24.3 0.2 197 197 A H H < S+ 0 0 62 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.175 118.5 59.3-124.2 18.5 -15.1 21.3 -1.2 198 198 A S < + 0 0 20 -4,-0.9 3,-0.2 -5,-0.1 -1,-0.2 -0.520 49.2 126.9-151.0 74.8 -17.1 20.2 -4.3 199 199 A E S S+ 0 0 153 -3,-0.2 2,-0.1 1,-0.1 -1,-0.1 0.659 76.6 53.5 -98.3 -27.3 -17.3 23.0 -6.9 200 200 A F S S+ 0 0 179 -3,-0.1 2,-0.5 2,-0.0 -1,-0.1 -0.327 70.6 132.3-109.8 47.9 -16.0 20.9 -9.8 201 201 A V - 0 0 34 -3,-0.2 4,-0.1 1,-0.1 -3,-0.0 -0.896 47.4-151.6 -96.8 125.4 -18.3 17.9 -9.6 202 202 A A S S+ 0 0 82 -2,-0.5 -1,-0.1 2,-0.1 -2,-0.0 0.586 71.6 70.1 -76.6 -10.2 -19.7 17.1 -13.0 203 203 A Y S S- 0 0 18 1,-0.1 -140,-0.1 -140,-0.0 -2,-0.1 -0.767 93.4 -94.8-110.6 153.2 -22.9 15.6 -11.7 204 204 A P - 0 0 72 0, 0.0 -140,-2.3 0, 0.0 2,-0.7 -0.433 32.1-149.0 -58.7 133.5 -26.0 17.1 -10.1 205 205 A I E -c 64 0A 48 -142,-0.2 2,-0.4 -4,-0.1 -140,-0.2 -0.946 18.4-161.5-104.8 108.9 -25.7 16.9 -6.3 206 206 A Q E -c 65 0A 70 -142,-3.4 -140,-3.5 -2,-0.7 2,-0.5 -0.781 9.4-157.8 -98.4 132.0 -29.3 16.6 -5.1 207 207 A L E -c 66 0A 42 -2,-0.4 2,-0.7 -142,-0.2 -140,-0.2 -0.927 11.0-146.6-106.1 126.8 -30.3 17.4 -1.5 208 208 A V - 0 0 57 -142,-2.7 2,-0.4 -2,-0.5 -2,-0.0 -0.853 21.6-174.3 -97.0 115.9 -33.5 15.8 -0.3 209 209 A V - 0 0 72 -2,-0.7 2,-0.7 -142,-0.1 -142,-0.0 -0.918 19.2-146.4-117.2 136.8 -35.4 18.0 2.1 210 210 A T - 0 0 132 -2,-0.4 2,-0.5 -142,-0.1 -2,-0.0 -0.880 22.4-178.2-102.7 115.7 -38.5 17.3 4.1 211 211 A K - 0 0 83 -2,-0.7 2,-0.3 0, 0.0 -2,-0.0 -0.952 24.6-130.5-118.6 128.9 -40.7 20.4 4.6 212 212 A E - 0 0 165 -2,-0.5 2,-0.3 1,-0.0 -2,-0.0 -0.599 25.8-130.9 -74.4 129.8 -43.9 20.6 6.6 213 213 A V 0 0 134 -2,-0.3 -1,-0.0 1,-0.1 0, 0.0 -0.661 360.0 360.0 -81.6 137.5 -46.6 22.3 4.6 214 214 A E 0 0 208 -2,-0.3 -1,-0.1 0, 0.0 0, 0.0 0.352 360.0 360.0-134.8 360.0 -48.5 25.0 6.5