==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 25-MAR-11 2YE3 . COMPND 2 MOLECULE: HEAT SHOCK PROTEIN HSP 90-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.D.ROUGHLEY,R.E.HUBBARD,L.M.BAKER . 208 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10361.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 77.9 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 . 42 20.2 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 . 1 0.5 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 . 17 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 58 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 1 0 0 0 0 0 1 1 1 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 1 3 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 16 A E 0 0 224 0, 0.0 158,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 100.0 70.9 16.6 10.9 2 17 A V E -A 158 0A 85 156,-0.1 2,-0.4 154,-0.0 156,-0.2 -0.830 360.0-155.3-100.0 128.1 72.5 17.9 14.2 3 18 A E E -A 157 0A 79 154,-2.9 154,-2.3 -2,-0.4 2,-0.5 -0.901 8.7-152.5-102.8 138.6 75.2 20.6 14.4 4 19 A T E -A 156 0A 99 -2,-0.4 2,-0.3 152,-0.2 152,-0.2 -0.917 15.2-175.7-114.2 128.1 77.5 20.7 17.5 5 20 A F E -A 155 0A 49 150,-2.9 150,-2.1 -2,-0.5 2,-0.4 -0.926 24.6-119.6-121.2 150.0 79.1 23.9 18.6 6 21 A A E -A 154 0A 83 -2,-0.3 148,-0.3 148,-0.2 3,-0.1 -0.760 29.6-121.9 -82.1 129.0 81.6 24.8 21.3 7 22 A F - 0 0 13 146,-2.1 -1,-0.0 -2,-0.4 2,-0.0 -0.409 40.2 -95.6 -51.4 141.8 80.5 27.3 23.9 8 23 A Q > - 0 0 74 1,-0.1 4,-2.5 -2,-0.1 3,-0.4 -0.385 40.9-109.9 -52.4 145.3 82.7 30.4 24.1 9 24 A A H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.883 118.1 51.8 -48.9 -49.3 85.3 29.8 26.8 10 25 A E H > S+ 0 0 60 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.851 110.9 47.2 -61.2 -39.7 83.8 32.4 29.1 11 26 A I H > S+ 0 0 0 -3,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.902 110.3 52.3 -70.0 -40.0 80.2 30.9 28.8 12 27 A A H X S+ 0 0 30 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.917 111.1 48.6 -63.6 -34.5 81.6 27.4 29.4 13 28 A Q H X S+ 0 0 110 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.895 110.5 50.4 -71.2 -42.6 83.3 28.8 32.6 14 29 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.911 110.3 51.3 -57.8 -46.7 80.0 30.5 33.7 15 30 A M H X S+ 0 0 3 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.912 111.5 44.5 -60.2 -43.9 78.1 27.3 33.2 16 31 A S H X S+ 0 0 56 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.900 110.0 56.0 -75.2 -28.7 80.5 25.2 35.3 17 32 A L H X S+ 0 0 44 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.922 110.5 45.8 -56.7 -47.7 80.6 27.8 38.0 18 33 A I H < S+ 0 0 0 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.891 117.3 43.9 -59.3 -41.4 76.7 27.6 38.2 19 34 A I H < S+ 0 0 61 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.894 122.1 37.3 -74.4 -35.9 76.8 23.8 38.2 20 35 A N H < S+ 0 0 119 -4,-2.8 2,-0.2 -5,-0.2 -2,-0.2 0.699 89.4 96.5 -99.0 -22.9 79.7 23.5 40.7 21 36 A T S < S- 0 0 61 -4,-2.4 2,-0.6 -5,-0.2 -4,-0.0 -0.514 77.1-117.5 -70.4 133.0 79.3 26.3 43.3 22 37 A F + 0 0 187 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 -0.594 55.9 146.5 -65.2 116.2 77.6 25.5 46.6 23 38 A Y - 0 0 32 -2,-0.6 3,-0.1 1,-0.1 -2,-0.0 -0.821 30.7-170.1-163.0 107.9 74.5 27.8 46.5 24 39 A S S S+ 0 0 93 -2,-0.3 2,-2.8 1,-0.2 3,-0.3 0.755 70.3 83.7 -77.3 -29.8 71.2 26.8 48.0 25 40 A N > + 0 0 63 1,-0.2 3,-1.1 2,-0.1 -1,-0.2 -0.211 49.6 144.0 -74.8 54.6 68.9 29.5 46.6 26 41 A K T > + 0 0 39 -2,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.678 45.5 86.9 -71.8 -14.1 68.4 27.6 43.3 27 42 A E T >> + 0 0 11 1,-0.3 3,-1.2 -3,-0.3 4,-0.5 0.629 67.5 80.8 -67.3 -15.5 64.7 28.7 43.0 28 43 A I H <> + 0 0 1 -3,-1.1 4,-2.1 1,-0.3 -1,-0.3 0.591 69.4 83.0 -64.9 -12.5 65.7 32.0 41.2 29 44 A F H <> S+ 0 0 0 -3,-1.7 4,-2.1 1,-0.2 -1,-0.3 0.890 89.7 51.6 -58.5 -36.9 66.1 30.1 37.9 30 45 A L H <> S+ 0 0 1 -3,-1.2 4,-2.6 1,-0.2 5,-0.3 0.941 107.8 50.9 -69.8 -46.1 62.3 30.4 37.3 31 46 A R H X S+ 0 0 56 -4,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.897 111.0 51.0 -51.0 -46.6 62.3 34.2 37.9 32 47 A E H X S+ 0 0 11 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.885 111.9 43.8 -64.9 -42.8 65.1 34.5 35.4 33 48 A L H X S+ 0 0 4 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.871 112.7 51.6 -69.5 -40.0 63.4 32.5 32.6 34 49 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.871 109.0 52.1 -63.8 -36.9 60.0 34.2 33.1 35 50 A S H X S+ 0 0 40 -4,-2.0 4,-2.9 -5,-0.3 -1,-0.2 0.910 109.0 49.0 -65.6 -43.3 61.8 37.5 32.8 36 51 A N H X S+ 0 0 59 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.891 111.8 49.6 -62.0 -42.7 63.5 36.5 29.6 37 52 A S H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.924 109.8 51.9 -57.2 -46.2 60.1 35.4 28.3 38 53 A S H X S+ 0 0 14 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.947 109.7 48.7 -58.8 -48.2 58.6 38.7 29.4 39 54 A D H X S+ 0 0 80 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.910 111.5 49.6 -55.8 -46.5 61.3 40.6 27.5 40 55 A A H X S+ 0 0 9 -4,-2.3 4,-1.8 2,-0.2 41,-1.3 0.850 111.2 49.5 -60.4 -38.9 60.7 38.4 24.3 41 56 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 39,-0.3 -2,-0.2 0.879 108.3 54.0 -69.3 -37.1 56.9 39.1 24.7 42 57 A D H X S+ 0 0 78 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.892 107.2 52.2 -58.4 -42.3 57.7 42.9 25.0 43 58 A K H X S+ 0 0 114 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.895 111.5 43.5 -67.3 -45.5 59.7 42.8 21.7 44 59 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.900 113.2 53.0 -66.1 -42.0 57.0 41.1 19.6 45 60 A R H X S+ 0 0 113 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.969 110.2 48.2 -51.8 -52.1 54.4 43.5 21.2 46 61 A Y H >X S+ 0 0 166 -4,-2.8 3,-1.1 1,-0.2 4,-0.6 0.905 111.8 49.0 -54.0 -48.2 56.5 46.5 20.2 47 62 A E H >X S+ 0 0 64 -4,-2.1 3,-1.0 1,-0.2 4,-0.8 0.906 106.8 56.5 -57.7 -43.7 57.0 45.2 16.6 48 63 A S H 3< S+ 0 0 15 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.628 89.9 75.3 -62.8 -18.7 53.3 44.6 16.3 49 64 A L H << S+ 0 0 118 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.854 113.1 23.7 -63.8 -35.4 52.5 48.3 17.1 50 65 A T H << S+ 0 0 122 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.439 135.8 34.5-111.3 -8.0 53.6 49.3 13.7 51 66 A D >< - 0 0 60 -4,-0.8 3,-1.7 1,-0.1 -1,-0.2 -0.666 60.6-176.8-148.2 85.9 53.0 46.0 11.8 52 67 A P G > S+ 0 0 99 0, 0.0 3,-1.6 0, 0.0 -4,-0.1 0.696 78.3 73.0 -62.2 -16.8 50.0 44.0 13.1 53 68 A S G > S+ 0 0 57 1,-0.3 3,-3.0 2,-0.2 4,-0.3 0.775 76.4 80.0 -71.8 -19.4 50.8 41.1 10.7 54 69 A K G X S+ 0 0 50 -3,-1.7 3,-0.5 1,-0.3 -1,-0.3 0.759 91.0 55.1 -46.8 -28.1 53.7 40.3 13.0 55 70 A L G X S+ 0 0 29 -3,-1.6 3,-1.7 -4,-0.2 -1,-0.3 0.286 74.1 100.1 -97.2 8.0 51.0 38.7 15.1 56 71 A D G < S+ 0 0 117 -3,-3.0 -1,-0.2 1,-0.3 3,-0.2 0.823 76.8 61.7 -56.3 -32.6 49.7 36.5 12.4 57 72 A S G < S- 0 0 35 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.295 133.9 -32.8 -77.4 4.4 51.7 33.6 14.0 58 73 A G < - 0 0 29 -3,-1.7 -1,-0.3 108,-0.1 -2,-0.1 -0.092 48.4-153.0 140.5 124.5 49.6 34.0 17.1 59 74 A K + 0 0 135 -3,-0.2 2,-0.4 -2,-0.1 -3,-0.1 0.714 69.2 93.3 -84.8 -26.3 47.9 37.0 18.8 60 75 A E - 0 0 121 -5,-0.1 2,-0.7 1,-0.0 0, 0.0 -0.625 59.7-158.9 -78.1 126.2 47.9 35.8 22.5 61 76 A L + 0 0 19 -2,-0.4 2,-0.3 17,-0.1 19,-0.1 -0.936 38.4 117.7-107.4 108.0 50.9 37.0 24.4 62 77 A H - 0 0 23 -2,-0.7 17,-1.4 139,-0.2 2,-0.4 -0.972 54.4-113.7-160.5 178.6 51.5 34.9 27.4 63 78 A I E -Bc 78 203A 0 139,-2.7 141,-2.6 -2,-0.3 2,-0.4 -0.972 20.9-166.5-123.8 131.0 53.6 32.4 29.5 64 79 A N E -Bc 77 204A 22 13,-2.5 13,-2.6 -2,-0.4 2,-0.5 -0.963 7.0-157.2-117.7 139.7 52.7 28.8 30.4 65 80 A L E -Bc 76 205A 0 139,-3.1 141,-2.7 -2,-0.4 11,-0.2 -0.975 14.9-175.6-114.3 121.4 54.5 26.6 33.1 66 81 A I E -B 75 0A 48 9,-2.8 9,-1.8 -2,-0.5 2,-0.3 -0.894 5.7-169.1-127.6 99.0 54.1 22.9 32.4 67 82 A P E -B 74 0A 7 0, 0.0 2,-0.3 0, 0.0 7,-0.2 -0.628 1.8-173.2 -79.7 147.1 55.4 20.4 34.9 68 83 A N E >> -B 73 0A 48 5,-2.5 5,-2.0 -2,-0.3 4,-1.1 -0.855 9.2-172.0-139.9 103.0 55.6 16.8 33.9 69 84 A K T 45S+ 0 0 87 -2,-0.3 -1,-0.1 3,-0.2 5,-0.0 0.793 85.4 57.2 -68.0 -26.3 56.6 14.3 36.6 70 85 A Q T 45S+ 0 0 157 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.943 117.1 31.3 -64.9 -53.0 56.9 11.4 34.2 71 86 A D T 45S- 0 0 107 2,-0.1 -1,-0.2 103,-0.0 -2,-0.2 0.599 106.0-128.8 -80.1 -11.5 59.4 13.0 31.9 72 87 A R T <5 + 0 0 73 -4,-1.1 103,-2.2 1,-0.2 2,-0.4 0.928 62.4 135.9 57.0 47.6 60.9 14.9 34.9 73 88 A T E < -BD 68 174A 9 -5,-2.0 -5,-2.5 101,-0.2 2,-0.4 -0.964 46.5-161.5-130.0 144.3 60.6 18.2 33.0 74 89 A L E -BD 67 173A 0 99,-1.7 99,-3.0 -2,-0.4 2,-0.5 -0.994 21.2-163.9-115.8 121.6 59.5 21.8 33.8 75 90 A T E -BD 66 172A 20 -9,-1.8 -9,-2.8 -2,-0.4 2,-0.5 -0.966 11.6-160.5-117.2 133.4 58.8 23.7 30.5 76 91 A I E -BD 65 171A 1 95,-1.9 95,-3.2 -2,-0.5 2,-0.4 -0.975 17.5-173.1-108.7 116.5 58.5 27.5 30.3 77 92 A V E +BD 64 170A 16 -13,-2.6 -13,-2.5 -2,-0.5 2,-0.3 -0.942 6.4 176.2-112.8 130.4 56.6 28.4 27.0 78 93 A D E -BD 63 169A 6 91,-2.8 91,-1.2 -2,-0.4 -15,-0.2 -0.935 32.0-142.1-124.7 157.5 56.2 32.0 25.8 79 94 A T + 0 0 29 -17,-1.4 89,-0.2 -2,-0.3 -16,-0.1 -0.214 61.5 130.5-104.6 40.6 54.6 33.4 22.7 80 95 A G S S- 0 0 0 89,-0.2 -39,-0.3 -18,-0.1 -40,-0.1 0.213 77.7 -62.8 -75.3-157.8 57.3 36.1 22.4 81 96 A I - 0 0 14 -41,-1.3 59,-0.6 -44,-0.2 87,-0.2 0.797 69.8-145.8 -65.2 -31.6 59.5 37.1 19.5 82 97 A G - 0 0 3 57,-0.2 2,-0.4 85,-0.2 57,-0.2 -0.143 15.0 -89.0 86.3 170.5 61.3 33.8 19.2 83 98 A M - 0 0 24 85,-0.4 56,-0.5 62,-0.1 62,-0.2 -0.952 24.4-135.8-122.5 141.2 64.9 33.3 18.2 84 99 A T > - 0 0 25 -2,-0.4 4,-3.3 54,-0.1 5,-0.1 -0.454 36.5-103.9 -76.6 167.4 66.5 32.9 14.8 85 100 A K H > S+ 0 0 60 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.894 126.7 50.6 -57.0 -44.5 69.2 30.1 14.3 86 101 A A H > S+ 0 0 59 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.894 109.5 50.4 -63.2 -41.0 71.8 32.9 14.4 87 102 A D H 4>S+ 0 0 55 2,-0.2 6,-1.9 1,-0.2 5,-0.6 0.949 110.0 51.1 -59.8 -49.4 70.3 34.2 17.6 88 103 A L H X5S+ 0 0 0 -4,-3.3 4,-1.6 4,-0.3 3,-0.3 0.920 111.9 45.1 -52.9 -51.2 70.4 30.7 19.1 89 104 A I H <5S+ 0 0 49 -4,-2.5 2,-2.5 1,-0.2 -1,-0.2 0.916 103.1 67.7 -59.6 -43.3 74.1 30.2 18.2 90 105 A N T >X5S- 0 0 99 -4,-2.5 4,-0.6 1,-0.2 3,-0.6 -0.343 136.5 -75.0 -77.6 58.4 75.0 33.7 19.5 91 106 A N G >45S- 0 0 11 -2,-2.5 3,-1.0 -3,-0.3 -2,-0.2 0.818 85.9 -60.1 55.9 41.7 74.2 32.7 23.0 92 107 A L G 3< + 0 0 131 -2,-0.2 4,-3.2 25,-0.2 3,-0.4 -0.480 52.5 156.6 -94.9 56.8 75.7 39.4 25.1 96 111 A A H > + 0 0 0 -2,-0.5 4,-3.2 1,-0.2 5,-0.2 0.804 58.4 60.2 -65.5 -30.5 76.8 36.5 27.2 97 112 A K H > S+ 0 0 102 -3,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.953 115.6 32.9 -67.4 -43.7 80.5 36.9 26.8 98 113 A S H > S+ 0 0 66 -3,-0.4 4,-2.5 2,-0.2 5,-0.2 0.851 117.3 57.2 -74.4 -35.2 80.6 40.4 28.3 99 114 A G H X S+ 0 0 5 -4,-3.2 4,-2.5 1,-0.2 -2,-0.2 0.937 106.9 49.7 -58.9 -44.6 77.7 39.6 30.6 100 115 A T H X S+ 0 0 2 -4,-3.2 4,-2.7 -5,-0.2 5,-0.2 0.937 109.6 50.8 -58.6 -42.7 79.8 36.8 32.0 101 116 A K H X S+ 0 0 127 -4,-1.5 4,-2.0 -5,-0.2 -2,-0.2 0.956 112.7 45.0 -61.4 -48.9 82.8 39.1 32.5 102 117 A A H X S+ 0 0 42 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.912 113.6 50.7 -58.8 -42.8 80.7 41.7 34.4 103 118 A F H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.911 109.7 51.0 -62.0 -43.2 79.0 38.9 36.5 104 119 A M H X S+ 0 0 41 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.878 109.4 49.3 -63.8 -45.3 82.5 37.3 37.4 105 120 A E H >X S+ 0 0 108 -4,-2.0 4,-2.3 -5,-0.2 3,-0.7 0.958 110.8 51.2 -52.4 -54.3 83.9 40.6 38.6 106 121 A A H 3<>S+ 0 0 20 -4,-2.3 5,-2.2 1,-0.2 -2,-0.2 0.886 103.7 57.7 -55.9 -42.6 80.7 41.2 40.7 107 122 A L H ><5S+ 0 0 39 -4,-2.3 3,-0.6 3,-0.2 -1,-0.2 0.817 110.4 43.2 -60.3 -35.9 81.1 37.8 42.4 108 123 A Q H <<5S+ 0 0 163 -4,-1.4 2,-2.1 -3,-0.7 -2,-0.2 0.988 108.9 59.4 -63.9 -65.1 84.6 38.7 43.6 109 124 A A T 3<5S- 0 0 93 -4,-2.3 -1,-0.2 1,-0.1 -2,-0.2 0.014 134.9 -86.9 -48.0 24.2 83.3 42.2 44.6 110 125 A G T < 5S+ 0 0 66 -2,-2.1 -3,-0.2 -3,-0.6 -1,-0.1 0.098 83.9 135.0 91.2 -22.4 80.8 40.4 47.0 111 126 A A < - 0 0 23 -5,-2.2 2,-0.3 -6,-0.1 -1,-0.2 0.017 41.6-138.8 -50.2 163.7 77.7 39.7 44.7 112 127 A D > - 0 0 68 -89,-0.0 3,-2.0 1,-0.0 4,-0.2 -0.834 28.7 -94.3-125.6 168.7 75.9 36.3 44.7 113 128 A I G > S+ 0 0 6 -2,-0.3 3,-1.8 1,-0.3 12,-0.0 0.740 114.2 70.0 -51.7 -31.0 74.4 33.9 42.1 114 129 A S G > S+ 0 0 26 1,-0.3 3,-0.5 2,-0.1 -1,-0.3 0.720 90.6 61.1 -65.8 -20.3 70.9 35.4 42.5 115 130 A M G X S+ 0 0 54 -3,-2.0 3,-2.1 1,-0.2 4,-0.5 0.457 70.5 109.9 -86.6 0.7 72.0 38.6 40.8 116 131 A I G X > + 0 0 0 -3,-1.8 3,-1.8 1,-0.3 5,-1.2 0.803 69.9 60.3 -39.0 -46.5 72.9 36.8 37.6 117 132 A G G X 5S+ 0 0 30 -3,-0.5 3,-0.8 1,-0.3 -1,-0.3 0.712 92.1 66.6 -64.0 -22.7 69.9 38.4 35.6 118 133 A Q G < 5S+ 0 0 142 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.707 101.3 50.3 -65.8 -18.7 71.4 41.9 36.3 119 134 A F G < 5S- 0 0 46 -3,-1.8 -1,-0.2 -4,-0.5 -2,-0.2 0.334 118.3-111.2-105.7 5.7 74.3 40.8 34.0 120 135 A G T < 5S+ 0 0 41 -3,-0.8 -25,-0.2 -4,-0.2 -3,-0.2 0.725 95.5 97.3 78.2 22.1 72.1 39.6 31.2 121 136 A V > < + 0 0 1 -5,-1.2 3,-1.4 -22,-0.2 4,-0.4 0.065 33.3 126.8-133.4 28.9 72.9 35.9 31.6 122 137 A G G > + 0 0 2 1,-0.3 3,-1.4 -6,-0.2 4,-0.3 0.773 60.5 75.9 -60.2 -28.8 70.0 34.7 33.7 123 138 A F G > S+ 0 0 8 1,-0.2 3,-2.1 2,-0.2 -1,-0.3 0.872 87.4 59.9 -44.1 -44.1 69.3 32.0 31.2 124 139 A Y G X S+ 0 0 1 -3,-1.4 3,-1.8 1,-0.3 -1,-0.2 0.691 83.1 78.9 -72.3 -16.2 72.3 29.9 32.4 125 140 A S G X S+ 0 0 0 -3,-1.4 3,-2.2 -4,-0.4 4,-0.4 0.665 72.0 83.7 -60.3 -13.3 70.8 29.7 35.9 126 141 A A G X> S+ 0 0 0 -3,-2.1 4,-2.2 1,-0.3 3,-1.8 0.860 80.9 64.5 -51.5 -37.8 68.6 27.0 34.3 127 142 A Y G <4 S+ 0 0 2 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.498 79.9 77.9 -72.8 -6.5 71.6 24.8 35.1 128 143 A L G <4 S+ 0 0 0 -3,-2.2 -1,-0.3 -102,-0.1 -2,-0.2 0.810 120.2 9.7 -58.7 -30.9 71.1 25.3 38.9 129 144 A V T <4 S+ 0 0 0 -3,-1.8 47,-3.1 -4,-0.4 2,-0.4 0.615 115.7 77.4-125.6 -22.1 68.3 22.7 38.5 130 145 A A E < -E 175 0A 2 -4,-2.2 45,-0.3 45,-0.3 3,-0.1 -0.810 47.3-165.1-103.8 136.9 68.5 21.1 35.0 131 146 A E E S+ 0 0 105 43,-2.2 2,-0.3 -2,-0.4 44,-0.2 0.698 89.6 17.2 -81.9 -24.6 70.9 18.4 34.0 132 147 A K E -E 174 0A 60 42,-1.3 42,-2.3 -6,-0.1 2,-0.4 -0.996 69.2-158.0-146.1 144.3 70.0 19.2 30.4 133 148 A V E -EF 173 149A 0 16,-2.4 16,-2.1 -2,-0.3 2,-0.4 -0.990 4.7-170.1-127.3 130.3 68.2 22.2 28.8 134 149 A T E -EF 172 148A 8 38,-2.1 38,-3.6 -2,-0.4 2,-0.6 -0.983 5.5-163.8-115.2 129.0 66.3 22.0 25.4 135 150 A V E -EF 171 147A 0 12,-2.5 12,-2.3 -2,-0.4 2,-0.5 -0.940 3.1-170.3-120.3 113.0 65.1 25.3 23.8 136 151 A I E +EF 170 146A 16 34,-2.6 34,-2.8 -2,-0.6 2,-0.3 -0.858 19.3 172.5 -97.8 134.7 62.6 25.1 21.0 137 152 A T E -EF 169 145A 0 8,-2.3 8,-2.1 -2,-0.5 2,-0.4 -0.993 23.7-169.9-149.5 144.8 62.1 28.4 19.3 138 153 A K E -EF 168 144A 46 30,-2.8 30,-2.3 -2,-0.3 2,-0.3 -0.941 6.8-172.7-140.2 118.2 60.3 29.9 16.3 139 154 A H > - 0 0 20 -56,-0.5 3,-1.8 4,-0.5 -57,-0.2 -0.810 35.6-117.8-102.3 151.1 60.9 33.5 15.0 140 155 A N T 3 S+ 0 0 48 -59,-0.6 -1,-0.1 -2,-0.3 -58,-0.1 0.837 113.1 52.0 -55.9 -34.6 58.7 35.0 12.2 141 156 A D T 3 S+ 0 0 129 2,-0.1 2,-0.3 -3,-0.0 -1,-0.3 0.250 114.7 30.1 -88.0 13.4 61.8 35.3 10.0 142 157 A D S < S- 0 0 49 -3,-1.8 2,-0.1 -58,-0.1 -58,-0.0 -0.899 84.7 -81.8-156.4 178.2 63.1 31.8 10.2 143 158 A E - 0 0 113 -2,-0.3 -4,-0.5 1,-0.1 2,-0.4 -0.310 56.0 -84.3 -79.3 172.1 62.3 28.1 10.7 144 159 A Q E -F 138 0A 19 16,-0.2 16,-2.5 -6,-0.2 2,-0.3 -0.678 53.2-173.3 -83.1 131.1 61.6 26.3 14.0 145 160 A Y E -FG 137 159A 20 -8,-2.1 -8,-2.3 -2,-0.4 2,-0.4 -0.900 21.8-144.6-126.4 151.3 64.9 25.1 15.7 146 161 A A E -FG 136 158A 2 12,-3.2 12,-2.3 -2,-0.3 2,-0.4 -0.983 14.2-171.2-115.1 127.7 65.9 23.1 18.7 147 162 A W E -FG 135 157A 1 -12,-2.3 -12,-2.5 -2,-0.4 2,-0.3 -0.853 13.8-179.0-104.8 141.8 69.1 24.1 20.8 148 163 A E E +FG 134 156A 55 8,-2.3 8,-2.0 -2,-0.4 2,-0.3 -0.997 11.8 165.9-147.4 148.4 70.2 21.6 23.4 149 164 A S E -F 133 0A 5 -16,-2.1 -16,-2.4 -2,-0.3 6,-0.1 -0.896 28.5-173.8-159.9 132.5 73.0 21.3 26.0 150 165 A S - 0 0 75 1,-0.5 2,-0.1 4,-0.3 5,-0.1 -0.028 60.1-118.8-101.3 27.6 73.9 19.3 29.0 151 166 A A S > S+ 0 0 13 3,-0.3 3,-0.8 -18,-0.1 -1,-0.5 -0.409 73.6 127.8 67.9-144.1 76.8 21.7 29.5 152 167 A G T 3 S- 0 0 84 1,-0.2 -1,-0.1 -140,-0.2 -140,-0.1 0.779 101.4 -61.1 61.5 22.0 80.3 20.1 29.3 153 168 A G T 3 S+ 0 0 29 1,-0.1 -146,-2.1 -141,-0.1 2,-0.3 0.353 112.4 70.2 101.0 -6.7 81.4 22.7 26.7 154 169 A S E < -A 6 0A 50 -3,-0.8 -4,-0.3 -148,-0.3 -3,-0.3 -0.960 47.2-167.0-147.6 156.5 79.0 22.2 23.7 155 170 A F E -A 5 0A 7 -150,-2.1 -150,-2.9 -2,-0.3 2,-0.3 -0.947 16.9-135.4-141.6 153.6 75.5 22.6 22.5 156 171 A T E -AG 4 148A 31 -8,-2.0 -8,-2.3 -2,-0.3 2,-0.4 -0.853 8.5-162.2-109.2 151.9 73.7 21.4 19.5 157 172 A V E +AG 3 147A 0 -154,-2.3 -154,-2.9 -2,-0.3 2,-0.3 -0.998 17.5 162.4-126.9 135.7 71.3 23.0 17.0 158 173 A R E -AG 2 146A 87 -12,-2.3 -12,-3.2 -2,-0.4 2,-0.2 -0.975 45.7-102.5-143.5 153.4 68.9 21.2 14.7 159 174 A T E - G 0 145A 63 -158,-0.5 2,-0.5 -2,-0.3 -14,-0.3 -0.613 44.7-129.0 -75.8 142.2 65.9 22.2 12.8 160 175 A D + 0 0 23 -16,-2.5 -16,-0.2 -2,-0.2 -1,-0.0 -0.851 31.8 175.1-102.9 131.8 62.9 21.0 14.8 161 176 A T + 0 0 131 -2,-0.5 -1,-0.1 3,-0.1 -16,-0.0 0.593 52.8 99.7-112.1 -19.3 60.2 18.9 13.0 162 177 A G S S- 0 0 40 1,-0.2 3,-0.1 3,-0.0 -2,-0.0 0.211 91.2 -17.2 -42.9-179.0 58.2 18.1 16.2 163 178 A E S S- 0 0 150 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.014 74.3-123.9 -33.7 106.5 55.0 20.1 17.2 164 179 A P - 0 0 103 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.259 23.4-167.0 -54.9 136.5 54.9 23.4 15.3 165 180 A M - 0 0 33 1,-0.1 2,-1.7 -3,-0.1 -27,-0.1 0.590 18.5-140.1-109.5 -5.6 54.6 26.2 17.7 166 181 A G S S- 0 0 35 -27,-0.1 2,-0.2 2,-0.1 -1,-0.1 -0.439 72.4 -14.3 88.9 -69.8 53.7 29.2 15.6 167 182 A R S S+ 0 0 4 -2,-1.7 2,-0.3 -89,-0.1 -28,-0.2 -0.858 99.9 46.8-168.1 138.9 55.9 31.8 17.4 168 183 A G E S- E 0 138A 0 -30,-2.3 -30,-2.8 -2,-0.2 -85,-0.4 -0.868 72.0 -71.5 128.5-164.2 57.8 32.0 20.7 169 184 A T E -DE 78 137A 11 -91,-1.2 -91,-2.8 -2,-0.3 2,-0.5 -0.986 22.5-160.1-138.7 137.1 60.2 29.9 22.8 170 185 A K E -DE 77 136A 59 -34,-2.8 -34,-2.6 -2,-0.3 2,-0.7 -0.997 8.1-162.2-114.8 124.4 59.9 26.7 24.9 171 186 A V E -DE 76 135A 11 -95,-3.2 -95,-1.9 -2,-0.5 2,-0.7 -0.909 8.5-161.7-104.1 108.6 62.6 26.1 27.6 172 187 A I E -DE 75 134A 35 -38,-3.6 -38,-2.1 -2,-0.7 2,-0.7 -0.870 1.4-159.8 -97.8 114.6 62.5 22.4 28.6 173 188 A L E -DE 74 133A 0 -99,-3.0 -99,-1.7 -2,-0.7 2,-0.9 -0.872 6.2-159.8 -96.9 107.3 64.3 21.8 31.9 174 189 A H E -DE 73 132A 42 -42,-2.3 -43,-2.2 -2,-0.7 -42,-1.3 -0.822 32.8-138.3 -81.4 101.4 65.3 18.1 32.4 175 190 A L E - E 0 130A 0 -103,-2.2 -45,-0.3 -2,-0.9 5,-0.1 -0.371 9.1-106.6 -76.8 146.7 65.6 18.5 36.1 176 191 A K > - 0 0 41 -47,-3.1 3,-2.6 1,-0.1 -1,-0.1 -0.361 39.5-107.0 -62.0 149.6 68.4 16.9 38.2 177 192 A E T 3 S+ 0 0 154 1,-0.3 3,-0.5 2,-0.1 -1,-0.1 0.777 120.7 48.1 -58.6 -30.0 67.1 13.9 40.3 178 193 A D T 3 S+ 0 0 117 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.224 100.3 69.0 -92.2 14.2 67.2 15.9 43.5 179 194 A Q X + 0 0 14 -3,-2.6 3,-1.5 -50,-0.1 -1,-0.2 0.076 56.2 117.5-117.3 21.1 65.4 19.0 42.0 180 195 A T G > + 0 0 60 -3,-0.5 3,-1.9 1,-0.3 -1,-0.1 0.577 52.7 86.5 -72.0 -6.9 61.9 17.5 41.6 181 196 A E G > S+ 0 0 77 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.783 79.2 67.8 -58.1 -25.9 60.4 20.0 44.1 182 197 A Y G < S+ 0 0 7 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.1 0.366 91.8 59.6 -80.5 4.2 60.0 22.3 41.0 183 198 A L G < S+ 0 0 4 -3,-1.9 2,-0.4 -116,-0.1 -1,-0.3 0.301 82.7 101.1-102.9 1.4 57.5 20.0 39.6 184 199 A E S <> S- 0 0 84 -3,-1.6 4,-2.3 1,-0.1 3,-0.3 -0.782 71.3-139.0 -92.5 129.0 55.1 20.4 42.6 185 200 A E H > S+ 0 0 83 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.919 101.3 51.4 -51.3 -51.4 52.2 22.8 42.0 186 201 A R H > S+ 0 0 207 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.874 111.5 46.7 -48.5 -49.4 52.5 24.3 45.5 187 202 A R H > S+ 0 0 46 -3,-0.3 4,-2.1 -6,-0.3 -1,-0.2 0.905 112.8 47.9 -67.8 -45.7 56.3 25.1 45.2 188 203 A I H X S+ 0 0 1 -4,-2.3 4,-2.8 -7,-0.2 5,-0.2 0.929 113.5 49.6 -62.6 -44.8 56.0 26.6 41.6 189 204 A K H X S+ 0 0 114 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.896 109.7 50.7 -57.1 -48.7 53.1 28.8 42.8 190 205 A E H X S+ 0 0 99 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.930 113.8 44.9 -52.7 -46.7 55.0 29.9 45.8 191 206 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.4 0.919 112.5 49.6 -71.5 -40.5 58.0 30.8 43.6 192 207 A V H X S+ 0 0 28 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.921 114.1 45.8 -64.0 -44.3 55.9 32.6 40.9 193 208 A K H < S+ 0 0 162 -4,-2.4 4,-0.3 -5,-0.2 -2,-0.2 0.904 116.0 48.2 -63.5 -40.6 54.1 34.6 43.6 194 209 A K H < S+ 0 0 107 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.912 130.7 11.6 -60.0 -52.2 57.6 35.4 45.4 195 210 A H H < S+ 0 0 48 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.525 129.5 41.8-116.9 -5.7 59.6 36.5 42.4 196 211 A S >< + 0 0 7 -4,-1.9 3,-0.8 -5,-0.4 -3,-0.1 -0.074 66.1 120.5-139.9 33.2 57.4 37.1 39.4 197 212 A Q T 3 S+ 0 0 104 -4,-0.3 -4,-0.1 1,-0.2 -1,-0.1 0.667 76.7 49.9 -78.4 -13.8 54.2 38.9 40.6 198 213 A F T 3 S+ 0 0 189 -3,-0.1 2,-0.5 2,-0.0 -1,-0.2 -0.179 73.4 134.2-116.9 36.1 54.5 42.0 38.4 199 214 A I < - 0 0 35 -3,-0.8 2,-0.1 2,-0.1 4,-0.1 -0.762 55.7-136.9 -82.7 134.3 55.0 40.3 35.1 200 215 A G S S+ 0 0 59 -2,-0.5 -1,-0.1 2,-0.1 -3,-0.0 0.135 78.4 66.4 -85.8 25.6 52.8 42.0 32.5 201 216 A Y S S- 0 0 12 -2,-0.1 -139,-0.2 -138,-0.0 -2,-0.1 -0.966 93.3 -93.9-136.8 150.7 51.6 38.8 30.8 202 217 A P - 0 0 75 0, 0.0 -139,-2.7 0, 0.0 2,-0.5 -0.413 33.6-154.9 -69.2 141.0 49.4 36.1 32.1 203 218 A I E -c 63 0A 45 -141,-0.2 2,-0.6 -2,-0.1 -139,-0.2 -0.979 7.0-163.6-113.5 118.9 51.3 33.1 33.6 204 219 A T E -c 64 0A 66 -141,-2.6 -139,-3.1 -2,-0.5 2,-0.8 -0.912 7.4-155.4-108.7 118.1 49.3 29.8 33.5 205 220 A L E -c 65 0A 38 -2,-0.6 -139,-0.2 -141,-0.2 2,-0.1 -0.862 19.0-144.4 -87.6 110.8 50.6 27.0 35.7 206 221 A F - 0 0 84 -141,-2.7 2,-0.2 -2,-0.8 -142,-0.0 -0.419 11.5-141.1 -69.0 151.9 49.3 23.7 34.1 207 222 A V 0 0 99 -2,-0.1 -1,-0.1 -141,-0.1 0, 0.0 -0.659 360.0 360.0-110.4 169.0 48.3 20.9 36.4 208 223 A E 0 0 118 -2,-0.2 -140,-0.1 -142,-0.0 -23,-0.0 -0.886 360.0 360.0-112.3 360.0 48.9 17.2 36.0