==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE/CHAPERONE INHIBITOR 21-JUL-11 3B25 . COMPND 2 MOLECULE: HEAT SHOCK PROTEIN HSP 90-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.A.FUKAMI,N.ONO . 210 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11065.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 161 76.7 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 19.0 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 . 16 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.4 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 0 0 0 0 0 1 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 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 16 A E 0 0 127 0, 0.0 2,-0.5 0, 0.0 158,-0.4 0.000 360.0 360.0 360.0 63.0 59.9 28.9 11.0 2 17 A V - 0 0 88 156,-0.1 2,-0.4 154,-0.0 156,-0.2 -0.843 360.0-158.6-100.2 123.8 58.6 27.8 14.4 3 18 A E E -A 157 0A 91 154,-2.6 154,-2.1 -2,-0.5 2,-0.4 -0.845 5.5-152.8-100.4 140.8 55.8 25.1 14.6 4 19 A T E -A 156 0A 98 -2,-0.4 2,-0.3 152,-0.2 152,-0.2 -0.941 15.2-176.9-115.2 131.7 53.7 24.9 17.8 5 20 A F E -A 155 0A 52 150,-3.0 150,-2.2 -2,-0.4 2,-0.4 -0.912 24.5-124.2-125.8 152.3 52.1 21.6 18.8 6 21 A A E -A 154 0A 83 -2,-0.3 148,-0.3 148,-0.2 2,-0.1 -0.768 29.5-123.3 -91.7 139.4 49.7 20.5 21.6 7 22 A F - 0 0 21 146,-2.0 -1,-0.0 -2,-0.4 2,-0.0 -0.471 40.2 -90.6 -69.0 158.3 51.0 17.6 23.8 8 23 A Q >> - 0 0 62 1,-0.1 4,-2.4 -2,-0.1 3,-0.6 -0.382 42.6-110.7 -62.1 145.4 48.7 14.6 24.0 9 24 A A H 3> S+ 0 0 66 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.837 117.9 55.0 -51.6 -35.8 46.3 15.2 26.9 10 25 A E H 3> S+ 0 0 56 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.865 109.5 46.6 -67.6 -38.1 47.9 12.3 28.9 11 26 A I H <> S+ 0 0 2 -3,-0.6 4,-2.9 2,-0.2 -2,-0.2 0.904 110.8 51.8 -71.3 -43.5 51.4 13.9 28.6 12 27 A A H X S+ 0 0 27 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.913 111.9 47.6 -60.6 -38.6 50.0 17.4 29.5 13 28 A Q H X S+ 0 0 108 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.923 111.1 50.5 -68.8 -38.1 48.4 15.7 32.7 14 29 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.931 111.5 48.8 -60.9 -47.5 51.7 13.9 33.5 15 30 A M H X S+ 0 0 2 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.929 110.2 50.4 -61.8 -42.8 53.6 17.3 33.2 16 31 A S H X S+ 0 0 61 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.901 109.9 51.5 -61.9 -38.7 51.0 19.1 35.4 17 32 A L H X S+ 0 0 37 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.902 110.0 48.7 -62.1 -44.7 51.4 16.3 38.1 18 33 A I H < S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.896 117.3 41.5 -63.1 -39.9 55.2 16.7 38.0 19 34 A I H < S+ 0 0 67 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.872 123.1 37.5 -74.7 -39.2 55.0 20.5 38.4 20 35 A N H < S+ 0 0 126 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.786 89.4 95.6 -87.2 -37.4 52.2 20.5 41.0 21 36 A T S < S- 0 0 65 -4,-2.5 2,-0.5 -5,-0.2 -4,-0.0 -0.410 77.3-122.0 -61.1 132.1 52.8 17.6 43.3 22 37 A F + 0 0 185 -2,-0.1 2,-0.2 2,-0.0 -1,-0.1 -0.637 52.6 149.2 -74.1 121.6 54.7 18.4 46.5 23 38 A Y - 0 0 34 -2,-0.5 3,-0.1 105,-0.1 -2,-0.0 -0.794 31.3-166.9-160.7 105.1 57.7 16.1 46.3 24 39 A S S S+ 0 0 92 -2,-0.2 2,-2.1 1,-0.2 3,-0.3 0.766 71.7 83.1 -71.6 -27.1 61.1 17.1 47.8 25 40 A N > + 0 0 60 1,-0.2 3,-1.1 2,-0.1 -1,-0.2 -0.285 48.9 144.4 -78.6 55.7 63.4 14.4 46.2 26 41 A K T > + 0 0 38 -2,-2.1 3,-2.1 1,-0.2 -1,-0.2 0.720 46.9 85.9 -67.6 -24.2 63.8 16.4 42.9 27 42 A E T >> + 0 0 16 -3,-0.3 3,-1.6 1,-0.3 4,-0.6 0.660 69.1 80.8 -54.3 -21.5 67.5 15.4 42.3 28 43 A I H <> S+ 0 0 1 -3,-1.1 4,-2.0 1,-0.3 -1,-0.3 0.665 70.6 80.9 -61.7 -17.5 66.3 12.2 40.5 29 44 A F H <> S+ 0 0 0 -3,-2.1 4,-2.1 1,-0.2 -1,-0.3 0.879 90.5 53.1 -54.5 -38.1 65.7 14.2 37.3 30 45 A L H <> S+ 0 0 1 -3,-1.6 4,-2.6 1,-0.2 5,-0.3 0.935 106.1 49.9 -68.5 -43.4 69.5 13.9 36.7 31 46 A R H X S+ 0 0 62 -4,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.893 111.5 51.5 -56.7 -42.6 69.6 10.1 37.0 32 47 A E H X S+ 0 0 14 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.898 112.1 44.0 -65.2 -43.4 66.6 9.9 34.5 33 48 A L H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.899 113.9 49.5 -69.8 -38.7 68.2 12.1 31.9 34 49 A I H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.919 110.7 52.3 -64.9 -38.5 71.6 10.4 32.2 35 50 A S H X S+ 0 0 41 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.915 108.9 49.2 -61.1 -43.8 69.7 7.0 31.8 36 51 A N H X S+ 0 0 59 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.904 111.7 49.5 -62.2 -40.9 68.0 8.4 28.6 37 52 A S H X S+ 0 0 4 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.924 110.2 50.2 -62.4 -47.8 71.5 9.4 27.3 38 53 A S H X S+ 0 0 14 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.911 110.2 50.5 -57.8 -45.1 72.9 5.9 28.1 39 54 A D H X S+ 0 0 93 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.907 111.9 47.7 -59.4 -43.8 70.0 4.2 26.3 40 55 A A H X S+ 0 0 18 -4,-2.1 4,-1.8 2,-0.2 41,-1.8 0.817 112.8 48.6 -67.2 -35.3 70.6 6.5 23.2 41 56 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 39,-0.3 -2,-0.2 0.900 109.4 52.2 -72.5 -39.6 74.3 5.7 23.3 42 57 A D H X S+ 0 0 58 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.919 109.1 52.7 -58.6 -42.9 73.6 2.0 23.6 43 58 A K H X S+ 0 0 118 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.926 111.7 41.9 -60.4 -51.1 71.3 2.3 20.5 44 59 A I H X S+ 0 0 1 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.912 114.5 52.7 -64.5 -40.9 73.9 4.0 18.2 45 60 A R H X S+ 0 0 114 -4,-2.5 4,-0.5 1,-0.2 -2,-0.2 0.930 112.1 46.2 -58.7 -46.3 76.7 1.6 19.5 46 61 A Y H >X S+ 0 0 166 -4,-2.7 3,-1.0 1,-0.2 4,-0.5 0.903 113.8 46.9 -61.7 -47.8 74.4 -1.4 18.6 47 62 A E H >X S+ 0 0 48 -4,-2.3 4,-1.7 1,-0.2 3,-0.8 0.842 104.5 61.9 -65.7 -33.4 73.5 -0.1 15.2 48 63 A S H 3< S+ 0 0 13 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.628 90.6 69.9 -67.4 -17.2 77.2 0.7 14.4 49 64 A L H << S+ 0 0 136 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.864 111.7 28.3 -69.1 -37.6 78.1 -3.0 14.7 50 65 A T H << S+ 0 0 125 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.702 136.0 32.0 -93.7 -25.3 76.2 -3.9 11.5 51 66 A D >< - 0 0 64 -4,-1.7 3,-1.8 1,-0.1 -1,-0.2 -0.780 63.5-179.3-133.2 90.3 76.7 -0.5 9.8 52 67 A P G > S+ 0 0 88 0, 0.0 3,-1.7 0, 0.0 -4,-0.1 0.710 77.1 72.8 -63.8 -21.0 80.0 1.2 10.9 53 68 A S G > S+ 0 0 59 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.632 76.8 79.8 -67.3 -14.6 79.3 4.4 8.7 54 69 A K G < S+ 0 0 54 -3,-1.8 3,-0.4 1,-0.3 -1,-0.3 0.672 89.9 55.7 -65.6 -14.6 76.6 5.3 11.4 55 70 A L G X S+ 0 0 26 -3,-1.7 3,-2.1 1,-0.2 -1,-0.3 0.345 75.0 97.6 -97.9 3.8 79.7 6.6 13.4 56 71 A D T < S+ 0 0 132 -3,-1.8 -1,-0.2 1,-0.3 3,-0.2 0.790 80.1 59.6 -61.1 -25.6 80.9 8.9 10.5 57 72 A S T 3 S- 0 0 36 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.356 134.1 -35.3 -82.1 1.8 79.0 11.7 12.5 58 73 A G < - 0 0 24 -3,-2.1 -1,-0.3 108,-0.1 -2,-0.1 -0.135 43.0-152.0 140.3 122.9 81.3 11.0 15.5 59 74 A K + 0 0 139 -3,-0.2 2,-0.3 -2,-0.1 -3,-0.1 0.744 69.7 98.0 -83.2 -27.9 83.0 7.9 17.1 60 75 A E - 0 0 129 -5,-0.1 2,-0.6 1,-0.1 0, 0.0 -0.493 55.9-162.6 -70.4 126.1 83.1 9.2 20.7 61 76 A L + 0 0 33 -2,-0.3 2,-0.3 17,-0.1 19,-0.1 -0.941 37.5 124.5-112.3 102.6 80.2 7.9 22.9 62 77 A H - 0 0 50 -2,-0.6 17,-1.4 139,-0.2 2,-0.4 -0.934 51.9-124.9-153.1 174.0 80.0 10.0 26.0 63 78 A I E -Bc 78 203A 0 139,-2.4 141,-2.4 -2,-0.3 2,-0.4 -0.999 19.3-164.2-128.9 131.7 77.9 12.3 28.2 64 79 A N E -Bc 77 204A 28 13,-2.5 13,-3.0 -2,-0.4 2,-0.6 -0.948 6.4-157.1-116.4 137.8 78.8 15.9 29.2 65 80 A L E -Bc 76 205A 0 139,-3.0 141,-2.8 -2,-0.4 11,-0.2 -0.972 16.1-175.1-112.9 118.6 77.2 17.8 32.1 66 81 A I E -B 75 0A 51 9,-2.9 9,-2.2 -2,-0.6 2,-0.2 -0.874 6.7-169.4-123.9 101.6 77.5 21.5 31.6 67 82 A P E -B 74 0A 8 0, 0.0 2,-0.3 0, 0.0 7,-0.2 -0.611 1.2-171.5 -85.9 145.8 76.3 23.9 34.3 68 83 A N E >> -B 73 0A 45 5,-2.3 5,-2.0 -2,-0.2 4,-1.0 -0.859 10.1-174.1-139.9 102.5 76.1 27.7 33.4 69 84 A K T 45S+ 0 0 98 -2,-0.3 -1,-0.1 3,-0.2 5,-0.0 0.819 84.9 58.0 -66.3 -33.7 75.4 30.1 36.3 70 85 A Q T 45S+ 0 0 184 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.913 119.2 29.3 -62.7 -46.8 75.2 33.2 34.0 71 86 A D T 45S- 0 0 107 2,-0.1 -1,-0.2 -3,-0.0 -2,-0.2 0.517 104.8-129.0 -89.3 -8.7 72.3 31.6 31.9 72 87 A R T <5 + 0 0 77 -4,-1.0 103,-1.7 1,-0.2 2,-0.4 0.929 62.8 136.3 54.5 49.9 71.0 29.5 34.9 73 88 A T E < -BD 68 174A 11 -5,-2.0 -5,-2.3 101,-0.2 2,-0.5 -0.968 46.7-159.6-124.5 147.6 71.1 26.4 32.8 74 89 A L E -BD 67 173A 1 99,-1.8 99,-2.7 -2,-0.4 2,-0.5 -0.994 19.7-161.7-121.8 120.9 72.2 22.8 33.3 75 90 A T E -BD 66 172A 16 -9,-2.2 -9,-2.9 -2,-0.5 2,-0.6 -0.907 11.1-161.9-107.6 134.0 72.8 21.0 30.0 76 91 A I E -BD 65 171A 0 95,-2.4 95,-2.7 -2,-0.5 2,-0.4 -0.969 19.3-172.8-112.1 112.7 73.0 17.2 29.6 77 92 A V E +BD 64 170A 25 -13,-3.0 -13,-2.5 -2,-0.6 2,-0.3 -0.919 7.6 174.9-110.3 135.7 74.8 16.4 26.3 78 93 A D E -BD 63 169A 6 91,-2.6 91,-1.0 -2,-0.4 -15,-0.2 -0.942 33.9-142.8-132.5 161.2 75.2 13.0 24.7 79 94 A T + 0 0 24 -17,-1.4 89,-0.2 -2,-0.3 -16,-0.1 -0.218 61.4 132.3-109.1 40.1 76.5 11.7 21.4 80 95 A G S S- 0 0 0 89,-0.2 -39,-0.3 -18,-0.1 -40,-0.1 0.122 78.7 -67.2 -74.0-163.7 73.8 9.0 21.3 81 96 A I - 0 0 16 -41,-1.8 59,-0.5 1,-0.1 87,-0.2 0.751 69.5-151.6 -61.6 -30.1 71.5 8.1 18.3 82 97 A G - 0 0 4 85,-0.2 2,-0.4 57,-0.2 57,-0.2 -0.140 16.6 -83.4 78.7-179.9 69.7 11.4 18.4 83 98 A M - 0 0 36 85,-0.4 56,-0.4 62,-0.1 62,-0.2 -0.979 25.4-138.4-129.1 139.7 66.1 12.0 17.3 84 99 A T > - 0 0 24 -2,-0.4 4,-2.2 54,-0.1 5,-0.2 -0.374 40.4-100.2 -81.1 171.2 64.5 12.6 13.9 85 100 A K H > S+ 0 0 60 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.901 127.2 53.7 -57.3 -40.9 61.7 15.3 13.6 86 101 A A H >>S+ 0 0 50 2,-0.2 4,-2.3 1,-0.2 5,-2.0 0.882 107.3 51.1 -62.3 -38.4 59.2 12.4 13.6 87 102 A D H 4>S+ 0 0 34 3,-0.2 5,-1.7 1,-0.2 6,-0.3 0.941 113.6 45.0 -61.2 -50.2 60.7 11.1 16.9 88 103 A L H <5S+ 0 0 19 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.869 122.7 33.3 -59.7 -49.0 60.5 14.6 18.5 89 104 A I H <5S- 0 0 43 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.886 135.8 -9.4 -78.2 -50.4 56.9 15.4 17.4 90 105 A N T X5S+ 0 0 96 -4,-2.3 4,-1.9 -5,-0.3 3,-0.2 0.790 114.6 60.3-122.5 -55.3 55.0 12.1 17.4 91 106 A N H > S+ 0 0 15 -6,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.785 107.7 55.6 -75.6 -32.0 54.9 10.8 22.7 94 109 A T H X S+ 0 0 73 -4,-1.9 4,-0.5 2,-0.2 3,-0.5 0.916 110.7 44.4 -63.9 -45.8 52.9 7.9 21.3 95 110 A I H >X S+ 0 0 126 -4,-1.6 4,-0.9 1,-0.2 3,-0.7 0.912 109.6 57.8 -62.7 -44.7 55.1 5.4 23.2 96 111 A A H 3X S+ 0 0 6 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.680 89.4 76.4 -60.1 -26.1 54.9 7.7 26.3 97 112 A K H 3X S+ 0 0 91 -4,-0.9 4,-1.8 -3,-0.5 -1,-0.2 0.905 98.2 40.2 -53.7 -54.0 51.1 7.5 26.4 98 113 A S H <>S+ 0 0 23 -4,-2.2 5,-2.7 1,-0.2 3,-0.6 0.892 109.6 52.2 -63.3 -39.7 51.1 3.3 40.2 107 122 A L H ><5S+ 0 0 36 -4,-2.6 3,-1.2 1,-0.2 -1,-0.2 0.861 106.9 51.1 -63.9 -40.2 51.1 6.7 42.0 108 123 A Q H 3<5S+ 0 0 161 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.680 110.4 53.1 -69.6 -18.8 47.4 6.4 43.1 109 124 A A T <<5S- 0 0 89 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.273 135.5 -79.2 -98.9 3.7 48.4 2.9 44.5 110 125 A G T < 5S+ 0 0 70 -3,-1.2 -3,-0.2 1,-0.3 -2,-0.1 0.342 86.1 130.7 115.4 -5.5 51.4 4.2 46.6 111 126 A A < - 0 0 21 -5,-2.7 -1,-0.3 -8,-0.1 2,-0.3 -0.253 46.2-133.6 -72.8 167.6 54.3 4.7 44.2 112 127 A D > - 0 0 68 1,-0.0 3,-1.9 -89,-0.0 4,-0.1 -0.783 24.2-101.3-122.4 167.0 56.3 7.9 44.2 113 128 A I G > S+ 0 0 5 1,-0.3 3,-2.2 -2,-0.3 -1,-0.0 0.809 113.1 70.1 -54.7 -33.2 57.6 10.3 41.5 114 129 A S G > S+ 0 0 24 1,-0.3 3,-0.5 2,-0.1 -1,-0.3 0.712 89.2 65.1 -60.8 -17.4 61.2 8.9 41.7 115 130 A M G X + 0 0 56 -3,-1.9 3,-1.8 1,-0.2 4,-0.4 0.449 67.9 108.9 -85.9 3.2 59.8 5.7 40.1 116 131 A I G X > + 0 0 0 -3,-2.2 3,-1.7 1,-0.3 5,-1.2 0.773 69.0 62.2 -45.0 -41.8 59.0 7.6 36.8 117 132 A G G X 5S+ 0 0 30 -3,-0.5 3,-1.6 1,-0.3 -1,-0.3 0.779 90.2 66.6 -61.2 -29.0 61.8 5.8 34.9 118 133 A Q G < 5S+ 0 0 148 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.662 102.5 50.1 -67.5 -12.5 60.3 2.4 35.4 119 134 A F G < 5S- 0 0 48 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.298 113.7-116.6-107.8 5.5 57.4 3.7 33.1 120 135 A G T < 5S+ 0 0 65 -3,-1.6 -3,-0.2 -21,-0.1 3,-0.2 0.630 92.2 100.4 69.3 18.4 59.7 5.0 30.3 121 136 A V > < + 0 0 3 -5,-1.2 3,-1.5 -22,-0.1 4,-0.3 0.080 35.2 127.5-119.6 22.9 58.6 8.6 30.7 122 137 A G G > + 0 0 1 1,-0.3 3,-1.8 -6,-0.2 4,-0.3 0.721 57.6 74.6 -52.8 -31.9 61.7 9.8 32.7 123 138 A F G > S+ 0 0 44 1,-0.3 3,-2.2 -3,-0.2 -1,-0.3 0.890 88.3 61.5 -51.1 -42.2 62.4 12.8 30.4 124 139 A Y G X S+ 0 0 25 -3,-1.5 3,-2.0 1,-0.3 -1,-0.3 0.697 82.0 79.1 -63.4 -13.7 59.4 14.6 31.9 125 140 A S G X S+ 0 0 0 -3,-1.8 3,-2.1 -4,-0.3 4,-0.3 0.679 72.5 82.6 -64.9 -16.0 61.1 14.6 35.4 126 141 A A G X> S+ 0 0 0 -3,-2.2 4,-1.9 -4,-0.3 3,-1.6 0.845 79.7 67.0 -54.3 -31.9 63.1 17.5 33.9 127 142 A Y G <4 S+ 0 0 2 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.548 80.4 76.3 -72.4 -3.2 60.1 19.6 35.0 128 143 A L G <4 S+ 0 0 2 -3,-2.1 -1,-0.3 1,-0.1 -2,-0.2 0.800 118.9 11.7 -68.8 -31.7 60.8 18.9 38.7 129 144 A V T <4 S+ 0 0 0 -3,-1.6 47,-2.8 -4,-0.3 2,-0.4 0.574 116.5 76.3-122.6 -18.8 63.6 21.5 38.4 130 145 A A E < -E 175 0A 2 -4,-1.9 45,-0.3 45,-0.3 3,-0.1 -0.869 46.6-167.1-106.0 135.2 63.2 23.4 35.0 131 146 A E E S+ 0 0 113 43,-2.3 2,-0.3 -2,-0.4 44,-0.1 0.709 90.1 18.3 -83.0 -22.9 60.7 26.1 34.2 132 147 A K E -E 174 0A 64 42,-1.2 42,-2.8 -6,-0.1 2,-0.4 -0.993 68.8-158.7-146.2 142.2 61.6 25.6 30.5 133 148 A V E -EF 173 149A 0 16,-2.1 16,-2.1 -2,-0.3 2,-0.4 -0.992 3.6-168.2-125.5 132.0 63.4 22.7 28.6 134 149 A T E -EF 172 148A 8 38,-2.5 38,-3.8 -2,-0.4 2,-0.5 -0.981 5.7-164.8-117.4 132.3 65.1 23.1 25.3 135 150 A V E -EF 171 147A 4 12,-3.1 12,-3.0 -2,-0.4 2,-0.5 -0.968 3.7-170.4-122.4 115.9 66.2 19.9 23.4 136 151 A I E +EF 170 146A 9 34,-2.7 34,-3.1 -2,-0.5 2,-0.3 -0.902 19.3 172.7-102.8 128.1 68.7 20.1 20.6 137 152 A T E -EF 169 145A 0 8,-2.5 8,-2.3 -2,-0.5 2,-0.3 -0.987 23.0-171.5-142.2 150.9 69.0 16.9 18.6 138 153 A K E -E 168 0A 45 30,-2.6 30,-2.5 -2,-0.3 2,-0.3 -0.954 6.8-173.5-143.7 117.2 70.6 15.5 15.5 139 154 A H > - 0 0 23 4,-0.4 3,-1.6 -56,-0.4 -57,-0.2 -0.798 37.0-116.0-104.8 151.7 69.9 11.9 14.1 140 155 A N T 3 S+ 0 0 52 -59,-0.5 -1,-0.1 -2,-0.3 -58,-0.1 0.817 114.8 51.0 -56.3 -31.5 72.0 10.5 11.1 141 156 A D T 3 S+ 0 0 132 2,-0.1 -1,-0.3 -3,-0.0 2,-0.2 0.337 114.6 36.3 -90.7 5.4 68.8 10.4 9.0 142 157 A D S < S- 0 0 45 -3,-1.6 2,-0.1 -58,-0.1 -58,-0.1 -0.838 82.6 -91.3-148.3 177.7 67.6 14.0 9.6 143 158 A E - 0 0 118 -2,-0.2 -4,-0.4 1,-0.1 2,-0.3 -0.375 56.1 -80.2 -85.2 174.7 68.6 17.6 10.1 144 159 A Q - 0 0 18 16,-0.2 16,-2.9 -6,-0.1 2,-0.3 -0.622 52.4-171.2 -79.6 131.8 69.3 19.3 13.5 145 160 A Y E -FG 137 159A 14 -8,-2.3 -8,-2.5 -2,-0.3 2,-0.5 -0.909 20.4-145.8-125.2 155.0 66.2 20.4 15.4 146 161 A A E -FG 136 158A 2 12,-2.8 12,-1.9 -2,-0.3 2,-0.3 -0.987 16.4-171.1-119.6 117.9 65.4 22.4 18.5 147 162 A W E +FG 135 157A 11 -12,-3.0 -12,-3.1 -2,-0.5 2,-0.3 -0.835 11.7 179.8-101.4 146.7 62.3 21.3 20.6 148 163 A E E +FG 134 156A 58 8,-2.1 8,-2.9 -2,-0.3 2,-0.3 -0.987 11.0 167.6-153.6 142.0 61.2 23.5 23.4 149 164 A S E -F 133 0A 5 -16,-2.1 -16,-2.1 -2,-0.3 6,-0.1 -0.949 28.3-173.6-155.4 139.2 58.5 23.7 26.1 150 165 A S - 0 0 74 1,-0.6 2,-0.1 4,-0.3 5,-0.1 -0.027 58.9-118.9-109.0 27.9 57.6 25.6 29.2 151 166 A A S > S+ 0 0 13 3,-0.3 3,-1.1 1,-0.1 -1,-0.6 -0.477 72.4 129.8 65.3-143.8 54.7 23.1 29.7 152 167 A G T 3 S- 0 0 85 1,-0.2 -1,-0.1 -140,-0.1 3,-0.1 0.651 101.4 -65.2 68.5 14.7 51.2 24.7 29.7 153 168 A G T 3 S+ 0 0 29 1,-0.2 -146,-2.0 -141,-0.1 2,-0.3 0.358 112.9 77.4 90.9 3.5 50.1 22.1 27.1 154 169 A S E < -A 6 0A 51 -3,-1.1 -3,-0.3 -148,-0.3 -4,-0.3 -0.943 47.2-171.0-141.9 162.4 52.3 22.9 24.1 155 170 A F E -A 5 0A 12 -150,-2.2 -150,-3.0 -2,-0.3 2,-0.3 -0.944 16.4-136.9-142.6 160.1 55.8 22.6 22.7 156 171 A T E -AG 4 148A 33 -8,-2.9 -8,-2.1 -2,-0.3 2,-0.4 -0.879 9.5-165.0-119.1 158.1 57.6 24.1 19.7 157 172 A V E +AG 3 147A 1 -154,-2.1 -154,-2.6 -2,-0.3 2,-0.3 -0.996 14.9 164.8-138.8 134.2 59.9 22.5 17.1 158 173 A R E - G 0 146A 89 -12,-1.9 -12,-2.8 -2,-0.4 -156,-0.1 -0.978 45.9 -98.2-142.5 153.3 62.2 24.5 14.6 159 174 A T E - G 0 145A 64 -158,-0.4 2,-0.6 -2,-0.3 -14,-0.3 -0.508 48.3-123.2 -66.9 141.0 65.1 23.5 12.5 160 175 A D + 0 0 29 -16,-2.9 -16,-0.2 -23,-0.2 -1,-0.1 -0.856 33.0 177.0 -98.7 124.8 68.2 24.5 14.4 161 176 A T + 0 0 136 -2,-0.6 -1,-0.1 3,-0.0 -16,-0.0 0.233 53.1 106.3-102.0 5.9 70.7 27.0 12.8 162 177 A G S S- 0 0 38 1,-0.2 -18,-0.1 -18,-0.0 3,-0.1 0.087 90.2 -36.4 -70.4-171.0 72.9 27.0 16.0 163 178 A E S S- 0 0 162 1,-0.1 -1,-0.2 2,-0.1 -2,-0.0 -0.316 74.0-113.8 -52.5 116.9 76.3 25.3 16.4 164 179 A P - 0 0 105 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.359 25.1-160.1 -59.1 137.9 76.1 21.9 14.5 165 180 A M - 0 0 43 1,-0.1 2,-1.6 3,-0.1 -27,-0.1 0.526 16.7-139.8 -93.9 -21.6 76.3 18.9 16.9 166 181 A G S S- 0 0 36 -27,-0.1 2,-0.2 2,-0.1 -108,-0.1 -0.520 73.8 -20.2 91.4 -70.8 77.4 16.0 14.6 167 182 A R S S+ 0 0 5 -2,-1.6 2,-0.3 -89,-0.1 -28,-0.2 -0.870 100.0 50.7-168.4 139.5 75.0 13.4 16.3 168 183 A G E S- E 0 138A 0 -30,-2.5 -30,-2.6 -2,-0.2 -85,-0.4 -0.858 70.2 -69.6 131.5-165.5 73.2 13.2 19.6 169 184 A T E -DE 78 137A 12 -91,-1.0 -91,-2.6 -2,-0.3 2,-0.5 -0.994 23.6-163.2-136.2 139.0 70.9 15.1 22.0 170 185 A K E -DE 77 136A 56 -34,-3.1 -34,-2.7 -2,-0.4 2,-0.7 -0.987 7.4-162.8-123.5 116.3 71.4 18.1 24.2 171 186 A V E -DE 76 135A 12 -95,-2.7 -95,-2.4 -2,-0.5 2,-0.6 -0.906 7.6-163.5-100.2 110.9 68.8 18.7 27.0 172 187 A I E -DE 75 134A 31 -38,-3.8 -38,-2.5 -2,-0.7 2,-0.7 -0.877 2.4-158.8-100.4 116.7 69.1 22.3 28.3 173 188 A L E -DE 74 133A 0 -99,-2.7 -99,-1.8 -2,-0.6 2,-1.2 -0.854 6.0-157.0 -98.3 110.9 67.3 22.8 31.6 174 189 A H E -DE 73 132A 42 -42,-2.8 -43,-2.3 -2,-0.7 -42,-1.2 -0.776 33.6-135.0 -85.8 98.1 66.4 26.4 32.3 175 190 A L E - E 0 130A 1 -103,-1.7 -45,-0.3 -2,-1.2 2,-0.1 -0.209 6.6-110.4 -65.7 145.9 66.3 26.0 36.0 176 191 A K > - 0 0 40 -47,-2.8 3,-2.5 1,-0.1 -1,-0.1 -0.406 38.3-106.6 -64.9 147.3 63.6 27.4 38.4 177 192 A E G > S+ 0 0 157 1,-0.3 3,-0.5 2,-0.1 -1,-0.1 0.779 119.8 46.5 -48.0 -38.6 64.8 30.3 40.6 178 193 A D G 3 S+ 0 0 119 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.243 100.8 68.9 -91.8 10.5 64.9 28.1 43.7 179 194 A Q G X + 0 0 12 -3,-2.5 3,-1.5 -50,-0.1 -1,-0.2 0.084 55.9 118.6-117.7 24.1 66.7 25.1 42.0 180 195 A T G X + 0 0 59 -3,-0.5 3,-1.8 1,-0.3 4,-0.2 0.543 53.8 85.3 -68.3 -7.8 70.2 26.7 41.5 181 196 A E G > S+ 0 0 76 1,-0.3 3,-1.7 -3,-0.2 -1,-0.3 0.808 78.8 69.1 -61.6 -27.3 71.9 24.0 43.7 182 197 A Y G < S+ 0 0 6 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.1 0.397 91.9 58.0 -72.2 0.4 71.9 21.9 40.5 183 198 A L G < S+ 0 0 6 -3,-1.8 2,-0.4 -116,-0.1 -1,-0.3 0.419 85.0 103.9-100.0 -10.8 74.6 24.3 39.0 184 199 A E <> - 0 0 87 -3,-1.7 4,-2.5 -4,-0.2 3,-0.3 -0.661 68.8-142.2 -82.0 126.6 76.9 23.6 41.9 185 200 A E H > S+ 0 0 79 -2,-0.4 4,-2.6 1,-0.2 5,-0.2 0.894 101.2 49.4 -49.7 -52.9 79.9 21.3 41.2 186 201 A R H > S+ 0 0 224 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.857 112.3 49.4 -56.3 -40.2 79.7 19.5 44.6 187 202 A R H > S+ 0 0 45 -3,-0.3 4,-2.2 -6,-0.3 -2,-0.2 0.931 111.4 46.1 -69.2 -47.2 76.0 18.9 44.2 188 203 A I H X S+ 0 0 1 -4,-2.5 4,-2.8 -7,-0.2 5,-0.2 0.943 112.6 51.5 -61.9 -45.8 76.2 17.4 40.7 189 204 A K H X S+ 0 0 117 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.902 109.9 50.7 -55.5 -44.4 79.1 15.2 41.7 190 205 A E H X S+ 0 0 114 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.917 112.3 45.7 -59.0 -46.3 77.1 13.9 44.7 191 206 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.4 0.906 112.8 49.2 -66.5 -44.5 74.0 13.1 42.6 192 207 A V H X S+ 0 0 26 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.933 113.2 47.6 -60.6 -45.1 76.1 11.4 39.8 193 208 A K H < S+ 0 0 161 -4,-2.5 4,-0.5 -5,-0.2 -2,-0.2 0.900 115.9 44.9 -63.4 -41.2 77.9 9.2 42.5 194 209 A K H < S+ 0 0 135 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.918 132.4 13.9 -68.6 -45.5 74.6 8.3 44.3 195 210 A H H < S+ 0 0 47 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.594 131.4 35.2-111.0 -17.5 72.5 7.5 41.2 196 211 A S >< + 0 0 7 -4,-2.6 3,-1.3 -5,-0.4 -3,-0.2 0.102 68.3 123.4-131.0 23.5 74.7 7.1 38.1 197 212 A Q T 3 S+ 0 0 122 -4,-0.5 -1,-0.1 1,-0.2 -4,-0.1 0.706 78.7 45.9 -63.9 -22.6 78.0 5.5 39.3 198 213 A F T 3 S+ 0 0 177 -3,-0.1 -1,-0.2 2,-0.0 -2,-0.1 0.339 73.1 137.3-105.2 10.1 77.8 2.4 36.9 199 214 A I < - 0 0 47 -3,-1.3 2,-0.3 1,-0.1 4,-0.1 -0.306 56.2-131.6 -57.9 133.1 76.8 4.2 33.6 200 215 A G S S+ 0 0 59 2,-0.1 -1,-0.1 -138,-0.0 -3,-0.0 -0.060 80.9 66.5 -83.6 30.0 78.9 2.6 30.8 201 216 A Y S S- 0 0 20 -2,-0.3 -139,-0.2 -138,-0.0 2,-0.1 -0.976 94.8 -91.1-144.5 148.1 80.1 5.8 29.2 202 217 A P - 0 0 80 0, 0.0 -139,-2.4 0, 0.0 2,-0.5 -0.439 35.1-157.2 -63.9 135.7 82.3 8.6 30.5 203 218 A I E -c 63 0A 45 -141,-0.2 2,-0.6 -4,-0.1 -139,-0.2 -0.975 7.4-163.9-114.4 113.0 80.4 11.4 32.2 204 219 A T E -c 64 0A 68 -141,-2.4 -139,-3.0 -2,-0.5 2,-0.8 -0.875 6.7-155.4-103.7 117.5 82.4 14.7 32.2 205 220 A L E -c 65 0A 36 -2,-0.6 -139,-0.2 -141,-0.2 2,-0.1 -0.843 17.2-146.3 -91.5 109.8 81.2 17.3 34.6 206 221 A F - 0 0 84 -141,-2.8 2,-0.3 -2,-0.8 -142,-0.0 -0.407 9.8-141.1 -71.8 150.4 82.3 20.6 33.2 207 222 A V - 0 0 91 -141,-0.1 2,-0.3 -2,-0.1 -23,-0.0 -0.759 22.0 -98.1-111.3 162.0 83.3 23.4 35.6 208 223 A E - 0 0 59 -2,-0.3 -140,-0.1 1,-0.1 -23,-0.0 -0.605 13.0-142.4 -89.5 141.3 82.6 27.1 35.4 209 224 A K 0 0 206 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.787 360.0 360.0 -64.8 -36.5 85.1 29.7 34.2 210 225 A E 0 0 138 0, 0.0 -2,-0.1 0, 0.0 -141,-0.1 -0.448 360.0 360.0 -79.8 360.0 84.1 32.4 36.7