==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 31-MAR-12 4EGI . COMPND 2 MOLECULE: HEAT SHOCK PROTEIN HSP 90-ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.J.CHEN,S.P.WOOD . 216 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11269.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 146 67.6 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 18.5 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 . 10 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 25.5 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 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 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 10 A Q 0 0 146 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 164.9 2.8 -11.7 -23.1 2 11 A P - 0 0 126 0, 0.0 2,-0.2 0, 0.0 0, 0.0 -0.133 360.0 -86.5 -62.2 163.2 5.7 -14.1 -22.3 3 12 A M - 0 0 183 1,-0.1 2,-0.2 0, 0.0 0, 0.0 -0.515 46.6-134.7 -65.1 133.5 5.7 -16.0 -19.0 4 13 A E - 0 0 90 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.475 14.1-145.8 -84.1 163.3 7.2 -14.0 -16.1 5 14 A E - 0 0 190 -2,-0.2 2,-0.4 2,-0.0 -1,-0.0 -0.964 13.4-174.7-129.0 143.7 9.7 -15.4 -13.7 6 15 A E - 0 0 109 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.994 22.2-129.4-140.2 136.2 10.2 -14.6 -10.0 7 16 A E - 0 0 168 -2,-0.4 158,-0.4 158,-0.0 2,-0.4 -0.636 25.4-172.7 -80.5 140.0 12.9 -15.9 -7.6 8 17 A V - 0 0 64 -2,-0.3 2,-0.5 156,-0.1 156,-0.2 -0.995 11.7-156.7-132.7 139.6 11.8 -17.4 -4.3 9 18 A E E -A 163 0A 67 154,-2.6 154,-2.7 -2,-0.4 2,-0.5 -0.980 8.8-161.8-116.9 122.2 14.0 -18.5 -1.4 10 19 A T E -A 162 0A 98 -2,-0.5 2,-0.3 152,-0.2 152,-0.2 -0.919 11.2-171.6-108.7 126.3 12.5 -21.1 0.9 11 20 A F E -A 161 0A 47 150,-3.1 150,-2.1 -2,-0.5 2,-0.4 -0.909 21.8-124.8-118.7 149.6 14.1 -21.4 4.3 12 21 A A E -A 160 0A 70 -2,-0.3 148,-0.3 148,-0.2 2,-0.1 -0.753 31.9-118.3 -88.8 134.4 13.7 -23.9 7.2 13 22 A F - 0 0 12 146,-2.0 87,-0.2 -2,-0.4 86,-0.1 -0.489 39.4 -93.7 -61.1 143.4 12.9 -22.4 10.6 14 23 A Q > - 0 0 40 85,-3.0 4,-2.2 -2,-0.1 3,-0.2 -0.303 45.8-109.0 -50.6 140.6 15.4 -23.0 13.3 15 24 A A H > S+ 0 0 68 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.812 115.6 45.0 -56.5 -43.3 14.2 -26.3 15.1 16 25 A E H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.876 112.4 51.6 -71.6 -35.2 13.1 -24.7 18.4 17 26 A I H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.938 109.9 50.4 -61.2 -46.0 11.3 -21.8 16.5 18 27 A A H X S+ 0 0 28 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.907 111.6 48.6 -58.7 -42.7 9.5 -24.5 14.5 19 28 A Q H X S+ 0 0 114 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.921 110.5 50.3 -65.3 -42.4 8.6 -26.3 17.7 20 29 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.919 110.0 50.1 -60.2 -46.2 7.4 -23.1 19.3 21 30 A M H X S+ 0 0 2 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.925 110.3 51.4 -58.0 -43.9 5.2 -22.3 16.3 22 31 A S H X S+ 0 0 62 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.926 110.9 47.7 -58.4 -47.1 3.8 -25.9 16.5 23 32 A L H X S+ 0 0 51 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.911 113.3 47.5 -62.3 -46.6 2.9 -25.4 20.2 24 33 A I H < S+ 0 0 3 -4,-2.6 3,-0.2 1,-0.2 -1,-0.2 0.876 117.6 43.7 -58.5 -42.5 1.3 -21.9 19.5 25 34 A I H < S+ 0 0 53 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.884 119.0 36.6 -73.8 -42.0 -0.7 -23.3 16.6 26 35 A N H < S+ 0 0 117 -4,-2.4 2,-0.3 -5,-0.2 -1,-0.2 0.301 104.1 72.4-106.3 7.9 -1.9 -26.6 17.9 27 36 A T S < S- 0 0 65 -4,-0.8 2,-0.3 -3,-0.2 0, 0.0 -0.962 79.1-116.2-124.5 140.9 -2.7 -25.8 21.5 28 37 A F + 0 0 162 -2,-0.3 2,-0.4 0, 0.0 -2,-0.1 -0.596 35.0 173.2 -76.6 130.9 -5.5 -23.8 23.0 29 38 A Y - 0 0 27 -2,-0.3 3,-0.3 105,-0.1 2,-0.1 -0.983 22.1-143.5-127.1 143.3 -4.6 -20.6 24.9 30 39 A S S S+ 0 0 74 -2,-0.4 89,-0.3 1,-0.2 0, 0.0 -0.404 82.9 50.8 -87.5 176.9 -7.0 -18.1 26.2 31 40 A N > + 0 0 49 -2,-0.1 3,-1.5 1,-0.1 -1,-0.2 0.844 59.4 154.8 68.3 33.5 -5.9 -14.5 26.0 32 41 A K T > + 0 0 32 -3,-0.3 3,-2.2 1,-0.3 4,-0.2 0.735 54.8 85.4 -67.3 -20.5 -5.0 -14.6 22.3 33 42 A E T >> + 0 0 20 1,-0.3 3,-1.7 2,-0.2 4,-0.6 0.700 67.8 79.1 -54.6 -24.3 -5.7 -10.9 22.1 34 43 A I H <> S+ 0 0 0 -3,-1.5 4,-2.2 1,-0.3 -1,-0.3 0.650 70.8 83.7 -63.5 -14.0 -2.1 -10.1 23.3 35 44 A F H <> S+ 0 0 0 -3,-2.2 4,-2.1 1,-0.2 -1,-0.3 0.917 90.6 50.4 -52.5 -39.7 -0.9 -10.9 19.6 36 45 A L H <> S+ 0 0 2 -3,-1.7 4,-2.6 1,-0.2 5,-0.2 0.915 107.5 51.0 -69.8 -43.3 -1.8 -7.2 18.8 37 46 A R H X S+ 0 0 49 -4,-0.6 4,-2.3 1,-0.2 -1,-0.2 0.885 110.7 51.2 -53.7 -44.6 0.1 -5.8 21.8 38 47 A E H X S+ 0 0 14 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.909 111.3 44.7 -66.3 -38.3 3.2 -7.8 20.7 39 48 A L H X S+ 0 0 4 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.879 114.0 50.5 -73.7 -36.6 3.1 -6.6 17.1 40 49 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.909 109.2 51.6 -66.4 -41.3 2.5 -3.0 18.2 41 50 A S H X S+ 0 0 41 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.919 108.3 50.9 -60.0 -43.2 5.4 -3.3 20.6 42 51 A N H X S+ 0 0 59 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.903 111.5 48.2 -62.8 -38.0 7.6 -4.6 17.7 43 52 A S H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.938 110.2 52.2 -66.0 -41.0 6.5 -1.5 15.6 44 53 A S H X S+ 0 0 11 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.931 110.7 47.6 -61.9 -42.4 7.3 0.8 18.5 45 54 A D H X S+ 0 0 78 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.899 112.2 49.5 -62.3 -39.1 10.8 -0.7 18.8 46 55 A A H X S+ 0 0 15 -4,-1.9 41,-1.9 2,-0.2 4,-1.7 0.809 110.9 49.3 -71.1 -38.0 11.4 -0.4 15.1 47 56 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 39,-0.3 -2,-0.2 0.865 108.2 54.8 -68.4 -41.2 10.2 3.3 15.2 48 57 A D H X S+ 0 0 44 -4,-2.6 4,-2.9 -5,-0.2 5,-0.3 0.925 105.6 53.0 -55.5 -43.6 12.5 3.9 18.1 49 58 A K H X S+ 0 0 118 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.933 113.8 40.8 -66.8 -45.0 15.5 2.6 16.1 50 59 A I H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.878 113.4 54.1 -70.4 -36.0 14.9 4.9 13.1 51 60 A R H X S+ 0 0 75 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.960 113.8 41.3 -60.7 -54.2 14.1 7.9 15.3 52 61 A Y H >X S+ 0 0 128 -4,-2.9 3,-1.0 1,-0.2 4,-1.0 0.949 114.8 51.8 -61.6 -43.5 17.4 7.5 17.3 53 62 A E H 3X S+ 0 0 71 -4,-2.4 4,-2.0 -5,-0.3 3,-0.3 0.862 107.8 53.4 -54.2 -40.3 19.4 6.8 14.1 54 63 A S H 3< S+ 0 0 12 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.660 93.0 70.4 -75.0 -21.6 17.9 9.9 12.5 55 64 A L H << S+ 0 0 123 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.944 111.2 32.9 -59.3 -45.2 19.0 12.2 15.3 56 65 A T H < S+ 0 0 134 -4,-1.0 -2,-0.2 -3,-0.3 -1,-0.2 0.836 135.4 26.5 -79.8 -38.4 22.5 11.7 14.2 57 66 A D >< - 0 0 63 -4,-2.0 3,-2.5 -5,-0.2 -1,-0.2 -0.725 62.4-175.9-131.5 87.9 21.8 11.4 10.5 58 67 A P G > S+ 0 0 90 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.705 77.6 76.2 -58.3 -19.0 18.6 13.2 9.4 59 68 A S G > S+ 0 0 59 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.698 75.7 79.5 -67.0 -15.9 18.9 11.8 5.8 60 69 A K G < S+ 0 0 57 -3,-2.5 3,-0.5 1,-0.3 -1,-0.3 0.739 89.0 56.7 -58.5 -19.0 17.7 8.5 7.2 61 70 A L G X S+ 0 0 28 -3,-2.0 3,-2.7 1,-0.2 -1,-0.3 0.346 70.6 102.0 -97.5 10.9 14.2 10.1 7.0 62 71 A D T < S+ 0 0 132 -3,-2.1 -1,-0.2 1,-0.3 3,-0.1 0.824 79.0 61.1 -57.3 -29.1 14.5 10.8 3.3 63 72 A S T 3 S- 0 0 33 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.324 133.4 -44.9 -81.6 5.5 12.3 7.7 3.0 64 73 A G < - 0 0 31 -3,-2.7 -1,-0.3 108,-0.1 -2,-0.1 -0.033 40.7-143.3 135.5 132.3 9.6 9.5 5.0 65 74 A K S S+ 0 0 163 -3,-0.1 2,-0.3 -2,-0.1 -3,-0.1 0.728 70.3 101.0 -89.3 -21.1 9.5 11.6 8.1 66 75 A E - 0 0 127 -5,-0.1 2,-0.6 1,-0.1 0, 0.0 -0.477 53.9-163.6 -75.8 125.3 6.3 10.4 9.6 67 76 A L + 0 0 33 -2,-0.3 2,-0.3 17,-0.1 19,-0.1 -0.931 39.6 116.4-110.2 103.2 6.8 7.9 12.5 68 77 A H - 0 0 23 -2,-0.6 17,-1.6 139,-0.1 2,-0.4 -0.958 55.0-120.2-161.3 176.7 3.5 6.0 13.1 69 78 A I E -Bc 84 209A 0 139,-1.9 141,-2.0 -2,-0.3 2,-0.4 -0.993 18.9-164.9-133.4 129.7 1.5 2.8 13.1 70 79 A N E -Bc 83 210A 27 13,-2.4 13,-2.7 -2,-0.4 2,-0.5 -0.966 7.3-153.8-119.0 135.5 -1.7 2.1 11.1 71 80 A L E -Bc 82 211A 2 139,-2.5 141,-2.8 -2,-0.4 11,-0.2 -0.956 13.7-173.9-109.4 128.2 -4.1 -0.8 11.8 72 81 A I E -B 81 0A 65 9,-3.0 9,-2.1 -2,-0.5 2,-0.3 -0.853 4.8-170.8-132.4 94.5 -6.0 -1.9 8.7 73 82 A P E -B 80 0A 14 0, 0.0 2,-0.4 0, 0.0 7,-0.2 -0.657 2.1-170.6 -84.4 140.7 -8.8 -4.6 9.1 74 83 A N E >> -B 79 0A 50 5,-2.6 5,-1.6 -2,-0.3 4,-1.2 -0.883 9.6-173.7-134.6 103.8 -10.2 -6.0 5.9 75 84 A K T 45S+ 0 0 149 -2,-0.4 -1,-0.1 1,-0.2 5,-0.0 0.824 84.6 58.3 -70.4 -27.4 -13.3 -8.2 6.3 76 85 A Q T 45S+ 0 0 180 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.961 118.1 28.7 -65.1 -52.3 -13.4 -9.1 2.7 77 86 A D T 45S- 0 0 99 2,-0.1 -1,-0.2 -3,-0.0 -2,-0.2 0.467 104.8-127.7 -79.7 -12.4 -9.8 -10.6 2.6 78 87 A R T <5 + 0 0 88 -4,-1.2 103,-2.1 1,-0.2 2,-0.4 0.924 63.4 136.1 54.0 47.3 -10.1 -11.6 6.3 79 88 A T E < -BD 74 180A 13 -5,-1.6 -5,-2.6 101,-0.2 2,-0.5 -0.944 46.1-159.3-123.9 137.6 -6.8 -9.8 7.0 80 89 A L E -BD 73 179A 1 99,-1.7 99,-2.8 -2,-0.4 2,-0.4 -0.992 19.6-162.9-109.3 118.8 -5.6 -7.5 9.8 81 90 A T E -BD 72 178A 15 -9,-2.1 -9,-3.0 -2,-0.5 2,-0.5 -0.872 10.3-164.0-106.9 133.8 -2.6 -5.5 8.7 82 91 A I E -BD 71 177A 1 95,-2.6 95,-2.8 -2,-0.4 2,-0.4 -0.982 16.2-173.3-116.9 113.4 -0.2 -3.7 11.1 83 92 A V E +BD 70 176A 23 -13,-2.7 -13,-2.4 -2,-0.5 2,-0.3 -0.903 6.1 176.4-114.6 133.7 1.9 -1.1 9.2 84 93 A D E -BD 69 175A 6 91,-2.6 91,-1.1 -2,-0.4 -15,-0.2 -0.945 32.5-140.2-129.6 157.9 4.7 0.9 10.7 85 94 A T + 0 0 26 -17,-1.6 89,-0.2 -2,-0.3 -16,-0.1 -0.144 61.5 129.9-101.5 38.1 7.3 3.4 9.3 86 95 A G S S- 0 0 0 89,-0.2 -39,-0.3 -18,-0.1 -40,-0.1 0.181 78.7 -68.8 -78.7-163.7 10.1 2.1 11.4 87 96 A I - 0 0 17 -41,-1.9 59,-0.5 1,-0.1 87,-0.2 0.788 68.2-159.7 -61.8 -31.8 13.6 1.0 10.5 88 97 A G - 0 0 5 85,-0.2 2,-0.4 57,-0.1 57,-0.2 -0.144 18.4 -78.1 74.3-177.7 12.5 -2.0 8.5 89 98 A M - 0 0 30 85,-0.4 56,-0.4 62,-0.1 62,-0.2 -0.977 23.5-138.7-128.8 132.6 14.5 -5.0 7.6 90 99 A T > - 0 0 23 -2,-0.4 4,-2.5 54,-0.2 5,-0.2 -0.377 43.5-100.9 -68.3 167.7 17.2 -5.7 5.0 91 100 A K H > S+ 0 0 54 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.932 127.6 49.5 -59.4 -47.3 16.9 -9.2 3.4 92 101 A A H > S+ 0 0 55 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.895 110.4 50.6 -55.4 -43.9 19.7 -10.4 5.6 93 102 A D H > S+ 0 0 56 2,-0.2 4,-3.4 1,-0.2 5,-0.4 0.893 111.2 50.1 -61.0 -41.1 17.9 -9.0 8.7 94 103 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.943 112.6 43.1 -63.8 -49.4 14.6 -10.7 7.6 95 104 A I H <>S+ 0 0 22 -4,-2.3 5,-1.8 1,-0.2 6,-0.3 0.907 121.4 43.6 -66.4 -39.1 16.1 -14.1 7.1 96 105 A N H ><>S+ 0 0 67 -4,-2.4 5,-1.2 -5,-0.3 3,-0.6 0.941 120.9 34.9 -67.2 -53.6 18.1 -13.8 10.4 97 106 A N H 3<5S+ 0 0 89 -4,-3.4 -3,-0.2 1,-0.2 -2,-0.2 0.675 116.6 51.9 -86.5 -22.0 15.5 -12.3 12.7 98 107 A L T 3<5S- 0 0 15 -4,-2.0 -1,-0.2 -5,-0.4 -2,-0.1 -0.159 128.3 -33.6-117.1 46.7 12.4 -14.0 11.4 99 108 A G T < 5S+ 0 0 1 -3,-0.6 -85,-3.0 2,-0.2 -3,-0.2 0.147 112.9 67.9 154.8 -26.6 13.3 -17.6 11.4 100 109 A T T - 0 0 79 1,-0.1 3,-1.4 -4,-0.1 4,-0.4 -0.888 11.8-127.0-113.7 142.3 16.5 -16.9 19.5 104 113 A S T 3 S+ 0 0 132 -2,-0.4 4,-0.4 1,-0.3 3,-0.3 0.831 102.6 44.2 -60.8 -36.8 17.7 -16.9 23.0 105 114 A G T 3> S+ 0 0 12 20,-0.5 4,-2.1 1,-0.2 -1,-0.3 0.437 83.0 94.8 -93.3 -0.0 14.4 -17.3 24.8 106 115 A T H <> S+ 0 0 2 -3,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.931 88.2 44.1 -55.5 -50.5 12.7 -20.0 22.7 107 116 A K H > S+ 0 0 124 -4,-0.4 4,-1.8 -3,-0.3 5,-0.2 0.931 116.4 45.5 -61.1 -51.4 13.7 -23.0 24.9 108 117 A A H > S+ 0 0 49 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.884 111.3 54.1 -64.2 -38.4 12.8 -21.3 28.2 109 118 A F H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.947 107.1 49.2 -65.8 -41.2 9.6 -20.0 26.8 110 119 A M H X S+ 0 0 29 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.875 112.2 49.1 -63.3 -40.0 8.3 -23.5 25.7 111 120 A E H X S+ 0 0 120 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.913 112.1 48.8 -62.6 -47.4 9.2 -24.9 29.1 112 121 A A H <>S+ 0 0 28 -4,-2.7 5,-2.6 -5,-0.2 -2,-0.2 0.911 111.3 50.7 -54.7 -41.4 7.3 -22.0 30.8 113 122 A L H ><5S+ 0 0 8 -4,-2.3 3,-1.0 3,-0.2 -2,-0.2 0.910 111.3 44.8 -69.7 -50.6 4.2 -22.5 28.6 114 123 A Q H 3<5S+ 0 0 84 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.923 105.9 61.3 -50.9 -57.6 3.8 -26.2 29.2 115 124 A A T 3<5S- 0 0 92 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.486 133.6 -93.6 -54.9 -4.2 4.4 -25.6 33.0 116 125 A G T < 5 + 0 0 62 -3,-1.0 -3,-0.2 1,-0.2 -2,-0.2 0.501 68.9 159.5 109.8 9.0 1.2 -23.4 32.6 117 126 A A < - 0 0 31 -5,-2.6 -1,-0.2 -6,-0.2 2,-0.2 -0.263 49.3-105.0 -59.5 146.7 2.5 -19.9 31.9 118 127 A D > - 0 0 68 1,-0.1 3,-2.5 -89,-0.1 4,-0.2 -0.562 26.1-121.6 -68.4 136.8 -0.1 -17.5 30.3 119 128 A I G > S+ 0 0 1 1,-0.3 3,-2.0 -89,-0.3 4,-0.2 0.713 106.2 82.6 -54.3 -23.2 0.8 -17.0 26.5 120 129 A S G > S+ 0 0 25 1,-0.3 3,-0.6 2,-0.1 -1,-0.3 0.650 77.2 69.1 -52.6 -20.3 1.0 -13.2 27.5 121 130 A M G X> S+ 0 0 91 -3,-2.5 3,-0.9 1,-0.2 4,-0.8 0.610 71.3 94.1 -74.2 -13.5 4.6 -14.0 28.8 122 131 A I G X4>S+ 0 0 0 -3,-2.0 5,-1.3 1,-0.2 3,-0.7 0.777 76.6 57.8 -51.0 -39.7 5.8 -14.5 25.2 123 132 A G G X45S+ 0 0 25 -3,-0.6 3,-1.9 1,-0.2 5,-0.3 0.882 100.4 58.2 -63.1 -36.9 7.0 -10.8 24.7 124 133 A Q G <45S+ 0 0 166 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.712 102.4 54.9 -65.5 -25.3 9.4 -11.1 27.7 125 134 A F G <<5S- 0 0 59 -4,-0.8 -20,-0.5 -3,-0.7 -1,-0.3 0.346 113.9-118.1 -89.8 3.2 11.1 -14.0 26.0 126 135 A G T < 5S+ 0 0 44 -3,-1.9 3,-0.2 -22,-0.1 -3,-0.2 0.549 93.5 97.4 71.4 12.4 11.8 -11.9 22.8 127 136 A V > < + 0 0 1 -5,-1.3 3,-1.3 1,-0.1 4,-0.2 0.007 37.7 126.0-118.1 25.6 9.7 -14.3 20.6 128 137 A G G > + 0 0 4 -5,-0.3 3,-2.0 1,-0.3 4,-0.3 0.748 58.6 73.0 -57.3 -34.5 6.5 -12.2 20.6 129 138 A F G > S+ 0 0 19 1,-0.3 3,-2.3 -3,-0.2 -1,-0.3 0.895 88.8 61.3 -42.7 -47.6 6.3 -12.1 16.8 130 139 A Y G X S+ 0 0 3 -3,-1.3 3,-1.4 1,-0.3 -1,-0.3 0.579 80.1 82.0 -68.8 -9.2 5.2 -15.7 16.8 131 140 A S G X S+ 0 0 0 -3,-2.0 3,-2.4 1,-0.3 4,-0.5 0.736 72.2 81.5 -63.6 -21.5 2.1 -14.8 18.8 132 141 A A G X> S+ 0 0 0 -3,-2.3 4,-2.1 -4,-0.3 3,-1.7 0.876 82.3 63.6 -44.0 -39.3 0.7 -13.8 15.4 133 142 A Y G <4 S+ 0 0 0 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.512 82.5 75.1 -73.7 -6.0 0.0 -17.6 15.0 134 143 A L G <4 S+ 0 0 2 -3,-2.4 -1,-0.3 -102,-0.1 -2,-0.2 0.830 120.2 11.9 -66.6 -29.9 -2.5 -17.5 17.9 135 144 A V T <4 S+ 0 0 0 -3,-1.7 47,-3.1 -4,-0.5 2,-0.4 0.579 118.4 71.4-124.8 -18.0 -4.9 -15.8 15.4 136 145 A A E < -E 181 0A 1 -4,-2.1 45,-0.3 45,-0.3 3,-0.1 -0.863 49.2-164.6-112.1 137.0 -3.4 -16.1 11.9 137 146 A E E S+ 0 0 103 43,-2.4 2,-0.3 -2,-0.4 44,-0.2 0.723 89.0 19.5 -82.2 -21.1 -3.1 -19.2 9.8 138 147 A K E -E 180 0A 65 42,-1.3 42,-2.5 -6,-0.1 2,-0.4 -0.989 68.9-160.0-148.1 140.1 -0.7 -17.4 7.6 139 148 A V E -EF 179 155A 0 16,-2.4 16,-2.1 -2,-0.3 2,-0.4 -0.993 2.8-168.0-124.1 135.0 1.5 -14.3 8.1 140 149 A T E -EF 178 154A 13 38,-2.0 38,-3.3 -2,-0.4 2,-0.5 -0.977 5.2-163.6-118.4 133.9 3.0 -12.1 5.4 141 150 A V E -EF 177 153A 1 12,-2.8 12,-2.8 -2,-0.4 2,-0.5 -0.980 2.4-169.2-121.9 122.1 5.7 -9.6 6.4 142 151 A I E +EF 176 152A 11 34,-2.7 34,-3.2 -2,-0.5 2,-0.4 -0.906 17.3 176.8-110.3 130.3 6.5 -6.8 3.9 143 152 A T E -EF 175 151A 0 8,-2.6 8,-2.3 -2,-0.5 2,-0.4 -0.997 20.7-175.0-147.4 143.2 9.6 -4.8 4.8 144 153 A K E -E 174 0A 43 30,-2.6 30,-2.7 -2,-0.4 2,-0.3 -0.968 6.8-175.2-141.8 116.7 11.8 -2.0 3.4 145 154 A H > - 0 0 19 4,-0.4 3,-1.8 -56,-0.4 -57,-0.1 -0.793 38.6-113.8-107.1 150.8 14.9 -0.7 5.0 146 155 A N T 3 S+ 0 0 49 -59,-0.5 -58,-0.1 -2,-0.3 -1,-0.0 0.797 113.9 51.8 -53.9 -31.0 16.9 2.3 3.7 147 156 A D T 3 S+ 0 0 129 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.310 114.3 27.6 -94.3 5.9 19.8 0.0 2.8 148 157 A D S < S- 0 0 45 -3,-1.8 2,-0.1 -58,-0.1 -58,-0.0 -0.877 84.1 -83.6-151.7-177.6 18.0 -2.6 0.7 149 158 A E - 0 0 115 -2,-0.3 2,-0.5 1,-0.1 -4,-0.4 -0.244 55.6 -80.5 -85.2 177.4 15.0 -3.3 -1.5 150 159 A Q - 0 0 18 16,-0.2 16,-2.5 -6,-0.1 2,-0.3 -0.698 51.7-171.7 -88.5 127.6 11.5 -4.2 -0.5 151 160 A Y E -FG 143 165A 17 -8,-2.3 -8,-2.6 -2,-0.5 2,-0.5 -0.874 17.8-144.4-119.5 152.2 11.0 -7.9 0.5 152 161 A A E -FG 142 164A 10 12,-2.6 12,-2.0 -2,-0.3 2,-0.4 -0.980 14.4-173.5-116.1 124.8 8.0 -10.2 1.3 153 162 A W E +FG 141 163A 0 -12,-2.8 -12,-2.8 -2,-0.5 2,-0.3 -0.921 11.5 175.3-104.9 143.5 8.4 -12.9 3.9 154 163 A E E +FG 140 162A 61 8,-2.1 8,-2.5 -2,-0.4 2,-0.3 -0.995 9.6 171.7-150.2 151.2 5.6 -15.4 4.4 155 164 A S E -F 139 0A 4 -16,-2.1 -16,-2.4 -2,-0.3 6,-0.1 -0.965 27.5-174.2-155.7 139.2 4.7 -18.5 6.3 156 165 A S - 0 0 73 1,-0.5 2,-0.1 4,-0.3 5,-0.1 -0.128 60.5-117.0-106.6 30.5 1.8 -20.8 7.1 157 166 A A S > S+ 0 0 17 3,-0.3 3,-0.9 1,-0.1 -1,-0.5 -0.384 71.2 134.9 58.5-142.4 4.1 -22.6 9.5 158 167 A G T 3 S- 0 0 83 1,-0.2 -1,-0.1 -140,-0.1 3,-0.1 0.615 99.4 -69.1 71.9 8.4 4.8 -26.3 8.6 159 168 A G T 3 S+ 0 0 26 1,-0.3 -146,-2.0 -141,-0.1 2,-0.3 0.474 112.5 82.4 95.0 3.5 8.6 -25.6 9.4 160 169 A S E < -A 12 0A 55 -3,-0.9 -4,-0.3 -148,-0.3 -3,-0.3 -0.943 46.9-173.5-138.8 156.7 9.3 -23.3 6.4 161 170 A F E -A 11 0A 2 -150,-2.1 -150,-3.1 -2,-0.3 2,-0.3 -0.955 17.2-138.3-140.5 155.9 9.0 -19.7 5.3 162 171 A T E -AG 10 154A 27 -8,-2.5 -8,-2.1 -2,-0.3 2,-0.4 -0.898 9.0-164.4-114.3 152.2 9.7 -18.0 1.9 163 172 A V E +AG 9 153A 1 -154,-2.7 -154,-2.6 -2,-0.3 2,-0.3 -0.989 19.9 156.1-127.9 135.2 11.5 -14.7 1.1 164 173 A R E - G 0 152A 72 -12,-2.0 -12,-2.6 -2,-0.4 2,-0.3 -0.986 51.4 -84.0-146.6 161.7 11.2 -13.0 -2.3 165 174 A T E - G 0 151A 67 -158,-0.4 2,-0.4 -2,-0.3 -14,-0.3 -0.552 57.1-110.9 -64.7 134.9 11.5 -9.5 -3.7 166 175 A D - 0 0 35 -16,-2.5 -16,-0.2 -2,-0.3 -1,-0.1 -0.493 33.3-178.0 -77.9 124.3 8.2 -7.8 -3.2 167 176 A T + 0 0 105 -2,-0.4 -1,-0.2 2,-0.0 -2,-0.0 0.448 60.6 91.2 -96.7 -0.3 6.3 -7.2 -6.4 168 177 A G S S- 0 0 36 1,-0.2 -2,-0.0 0, 0.0 -16,-0.0 -0.097 94.8 -37.1 -77.5-171.5 3.4 -5.5 -4.3 169 178 A E - 0 0 69 1,-0.1 -1,-0.2 -2,-0.0 -2,-0.0 -0.170 66.7-123.1 -51.8 113.0 2.9 -1.8 -3.4 170 179 A P - 0 0 123 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.307 23.3-156.0 -60.1 144.6 6.2 -0.1 -2.6 171 180 A M - 0 0 31 1,-0.1 3,-0.2 3,-0.1 -28,-0.0 -0.925 19.2-132.6-115.6 148.7 6.6 1.4 0.9 172 181 A G S S- 0 0 48 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.947 80.7 -31.0 -67.5 -45.8 9.0 4.2 1.6 173 182 A R S S+ 0 0 8 -89,-0.1 2,-0.3 -3,-0.1 -1,-0.3 -0.887 96.5 52.5-173.6 138.4 10.3 2.5 4.8 174 183 A G E S- E 0 144A 0 -30,-2.7 -30,-2.6 -2,-0.3 -85,-0.4 -0.885 70.2 -67.9 132.1-158.1 9.0 0.2 7.5 175 184 A T E -DE 84 143A 14 -91,-1.1 -91,-2.6 -2,-0.3 2,-0.4 -0.994 25.1-163.2-139.5 138.6 7.3 -3.0 8.0 176 185 A K E -DE 83 142A 51 -34,-3.2 -34,-2.7 -2,-0.4 2,-0.6 -0.994 7.2-162.1-123.2 122.8 3.8 -4.3 7.3 177 186 A V E -DE 82 141A 13 -95,-2.8 -95,-2.6 -2,-0.4 2,-0.7 -0.959 6.9-161.9-109.4 117.4 2.6 -7.5 9.0 178 187 A I E -DE 81 140A 35 -38,-3.3 -38,-2.0 -2,-0.6 2,-0.8 -0.905 2.9-158.6-101.6 110.4 -0.5 -9.0 7.3 179 188 A L E -DE 80 139A 0 -99,-2.8 -99,-1.7 -2,-0.7 2,-1.0 -0.810 5.4-157.1 -97.1 112.7 -2.3 -11.5 9.5 180 189 A H E -DE 79 138A 41 -42,-2.5 -43,-2.4 -2,-0.8 -42,-1.3 -0.773 32.1-137.5 -86.3 102.3 -4.5 -13.9 7.5 181 190 A L E - E 0 136A 0 -103,-2.1 -45,-0.3 -2,-1.0 5,-0.1 -0.319 5.8-111.7 -74.9 147.2 -6.9 -14.7 10.3 182 191 A K > - 0 0 39 -47,-3.1 3,-2.2 1,-0.1 -1,-0.1 -0.331 35.9-109.2 -65.0 151.9 -8.2 -18.1 11.2 183 192 A E G > S+ 0 0 135 1,-0.3 3,-0.6 2,-0.1 -1,-0.1 0.816 118.5 49.8 -57.9 -30.3 -12.0 -18.5 10.5 184 193 A D G 3 S+ 0 0 90 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.336 102.8 63.0 -93.5 13.0 -12.8 -18.4 14.3 185 194 A Q G X + 0 0 15 -3,-2.2 3,-1.4 -50,-0.2 -1,-0.2 0.087 58.6 118.8-124.4 28.9 -10.8 -15.3 15.0 186 195 A T G X + 0 0 60 -3,-0.6 3,-2.2 1,-0.3 4,-0.3 0.609 52.1 87.6 -75.3 -7.0 -12.6 -12.7 12.9 187 196 A E G > S+ 0 0 70 1,-0.3 3,-1.8 -3,-0.2 6,-0.3 0.796 77.3 70.3 -57.3 -26.7 -13.5 -10.6 16.0 188 197 A Y G < S+ 0 0 9 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.1 0.388 90.1 59.3 -76.0 6.5 -10.1 -8.9 15.4 189 198 A L G < S+ 0 0 8 -3,-2.2 2,-0.4 -116,-0.1 -1,-0.3 0.440 84.7 100.3-104.3 -2.8 -11.5 -7.3 12.3 190 199 A E S <> S- 0 0 100 -3,-1.8 4,-2.2 -4,-0.3 5,-0.2 -0.675 70.3-142.9 -88.6 126.7 -14.2 -5.5 14.4 191 200 A E H > S+ 0 0 87 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.847 99.6 52.6 -61.4 -36.2 -13.3 -1.9 15.2 192 201 A R H > S+ 0 0 212 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.906 111.3 47.2 -64.1 -39.9 -14.8 -2.0 18.7 193 202 A R H > S+ 0 0 34 -6,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.878 111.8 49.5 -68.5 -40.4 -12.7 -5.1 19.5 194 203 A I H X S+ 0 0 1 -4,-2.2 4,-2.5 -7,-0.2 5,-0.2 0.938 112.3 48.3 -63.5 -46.9 -9.5 -3.6 18.1 195 204 A K H X S+ 0 0 117 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.912 109.3 53.8 -60.9 -40.6 -10.1 -0.4 20.1 196 205 A E H X S+ 0 0 103 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.922 112.9 43.1 -59.4 -45.2 -10.8 -2.4 23.3 197 206 A I H X S+ 0 0 3 -4,-2.1 4,-2.9 2,-0.2 5,-0.4 0.888 112.2 51.0 -76.0 -34.6 -7.5 -4.3 23.0 198 207 A V H X S+ 0 0 28 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.946 113.9 46.1 -64.0 -44.9 -5.3 -1.2 22.0 199 208 A K H < S+ 0 0 122 -4,-2.2 -2,-0.2 -5,-0.2 4,-0.2 0.877 116.7 44.9 -62.6 -44.4 -6.7 0.6 25.0 200 209 A K H < S+ 0 0 134 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.931 132.4 12.7 -68.6 -45.5 -6.2 -2.3 27.3 201 210 A H H < S+ 0 0 44 -4,-2.9 -3,-0.2 -5,-0.1 -2,-0.2 0.542 123.0 50.2-112.4 -11.1 -2.6 -3.4 26.2 202 211 A S < + 0 0 6 -4,-2.3 3,-0.3 -5,-0.4 -1,-0.1 -0.157 60.1 116.0-133.0 40.8 -1.1 -0.7 24.1 203 212 A Q S S+ 0 0 93 -4,-0.2 3,-0.3 -3,-0.2 -1,-0.1 0.683 72.5 67.4 -79.9 -18.3 -1.5 2.6 26.0 204 213 A F + 0 0 97 -3,-0.2 -1,-0.2 1,-0.2 -2,-0.1 0.843 67.1 118.7 -56.3 -34.7 2.5 2.8 26.3 205 214 A I - 0 0 22 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 0.192 55.3-149.9 -57.8 -35.1 3.4 3.3 22.7 206 215 A G S S+ 0 0 66 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.0 0.431 71.5 69.6 94.6 -4.9 5.2 6.6 22.0 207 216 A Y S S- 0 0 26 -138,-0.0 -1,-0.2 -139,-0.0 -139,-0.1 -0.986 91.5 -89.3-140.9 157.9 3.8 7.1 18.4 208 217 A P - 0 0 78 0, 0.0 -139,-1.9 0, 0.0 2,-0.4 -0.346 37.1-160.2 -64.0 134.6 0.5 7.8 16.8 209 218 A I E -c 69 0A 53 -141,-0.2 2,-0.4 -2,-0.1 -139,-0.2 -0.956 6.3-168.8-116.8 136.2 -1.7 4.8 16.1 210 219 A T E -c 70 0A 59 -141,-2.0 -139,-2.5 -2,-0.4 2,-0.5 -0.997 10.5-153.3-126.9 127.1 -4.6 5.1 13.5 211 220 A L E -c 71 0A 42 -2,-0.4 2,-0.7 -141,-0.2 -139,-0.2 -0.872 11.9-150.6 -92.7 122.8 -7.3 2.5 12.9 212 221 A F - 0 0 100 -141,-2.8 2,-0.5 -2,-0.5 -2,-0.0 -0.851 11.7-157.9 -95.3 120.9 -8.7 2.7 9.5 213 222 A V - 0 0 71 -2,-0.7 2,-0.2 -141,-0.1 -139,-0.1 -0.818 13.5-128.4-104.6 129.2 -12.3 1.6 9.4 214 223 A E + 0 0 137 -2,-0.5 -140,-0.0 -141,-0.2 -1,-0.0 -0.491 30.4 168.8 -78.8 135.5 -13.9 0.3 6.2 215 224 A K 0 0 106 -2,-0.2 -1,-0.1 0, 0.0 -2,-0.0 0.617 360.0 360.0-121.0 -17.4 -17.2 1.9 5.2 216 225 A E 0 0 202 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.891 360.0 360.0-100.4 360.0 -17.8 0.7 1.5