==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-JUL-03 1PZ0 . COMPND 2 MOLECULE: IOLS PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR A.H.EHRENSBERGER,D.K.WILSON . 311 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14534.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 2 0.6 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 . 20 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 3.2 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 1 0 2 2 0 0 2 2 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 3 1 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 PARALLEL BRIDGES PER LADDER . 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 2 A K 0 0 184 0, 0.0 2,-0.3 0, 0.0 291,-0.0 0.000 360.0 360.0 360.0 -62.6 24.8 1.2 72.9 2 3 A K - 0 0 92 11,-0.2 2,-0.4 12,-0.1 11,-0.2 -0.965 360.0-168.5-145.7 126.3 24.9 5.0 72.7 3 4 A A E -A 12 0A 21 9,-3.0 9,-2.6 -2,-0.3 2,-0.5 -0.923 21.6-130.3-115.3 136.3 24.3 7.5 69.8 4 5 A K E -A 11 0A 89 -2,-0.4 2,-1.2 7,-0.2 7,-0.2 -0.725 23.3-130.0 -85.0 129.4 25.2 11.2 69.8 5 6 A L > - 0 0 0 5,-2.3 3,-1.8 -2,-0.5 5,-0.4 -0.665 47.2 -84.5 -84.2 93.9 22.2 13.2 68.6 6 7 A G T 3 S- 0 0 4 -2,-1.2 191,-0.2 1,-0.3 190,-0.1 -0.135 102.9 -8.6 50.0-133.7 23.6 15.6 66.0 7 8 A K T 3 S+ 0 0 66 189,-1.1 -1,-0.3 164,-0.4 190,-0.1 0.552 117.0 91.5 -72.5 -10.9 25.2 18.8 67.2 8 9 A S S < S- 0 0 6 -3,-1.8 142,-0.1 163,-0.2 141,-0.0 -0.253 82.9-121.6 -81.8 172.8 24.0 18.2 70.8 9 10 A D + 0 0 145 140,-0.3 2,-0.5 -5,-0.1 -1,-0.1 0.020 67.6 132.8 -99.4 23.2 25.8 16.5 73.7 10 11 A L - 0 0 12 -5,-0.4 -5,-2.3 139,-0.1 2,-0.6 -0.679 38.2-167.4 -83.7 124.2 22.9 14.0 74.0 11 12 A Q E +A 4 0A 93 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.955 19.3 171.9-110.3 116.6 24.0 10.4 74.2 12 13 A V E -A 3 0A 0 -9,-2.6 -9,-3.0 -2,-0.6 4,-0.1 -0.959 41.3-109.7-135.7 150.2 21.1 8.0 73.8 13 14 A F - 0 0 34 -2,-0.3 37,-0.3 -11,-0.2 36,-0.2 -0.512 46.4-113.6 -66.2 134.7 20.3 4.3 73.4 14 15 A P S S+ 0 0 20 0, 0.0 261,-1.8 0, 0.0 2,-0.5 0.533 102.3 66.6 -52.0 -8.0 19.1 4.0 69.8 15 16 A I B +b 275 0B 0 259,-0.2 34,-0.4 261,-0.1 35,-0.2 -0.943 66.2 177.9-121.9 111.9 15.6 3.1 70.9 16 17 A G - 0 0 0 259,-3.2 2,-0.4 -2,-0.5 35,-0.2 -0.442 27.7-108.8 -99.7 178.4 13.6 5.8 72.7 17 18 A L E -c 51 0C 0 33,-2.5 35,-3.3 259,-0.2 2,-0.5 -0.943 13.1-145.9-118.1 131.6 10.1 5.7 74.0 18 19 A G E -c 52 0C 3 259,-2.1 261,-0.4 -2,-0.4 3,-0.3 -0.808 12.8-168.2 -90.3 129.8 7.0 7.5 72.6 19 20 A T > + 0 0 0 33,-2.3 3,-1.8 -2,-0.5 35,-0.1 0.053 49.8 115.9-110.5 25.4 4.7 8.5 75.4 20 21 A N T 3 S+ 0 0 34 1,-0.3 7,-0.2 32,-0.1 -1,-0.2 0.719 82.2 51.7 -65.3 -18.3 1.5 9.5 73.7 21 22 A A T 3 S+ 0 0 4 258,-0.4 2,-0.9 -3,-0.3 -1,-0.3 0.252 87.3 91.6-101.1 10.1 -0.2 6.6 75.4 22 23 A V S < S- 0 0 0 -3,-1.8 44,-0.2 1,-0.1 43,-0.2 -0.844 122.2 -29.0-105.9 92.5 1.0 7.6 78.9 23 24 A G S S+ 0 0 1 -2,-0.9 2,-1.8 1,-0.2 3,-0.3 0.633 94.8 141.5 75.6 12.9 -1.8 9.8 80.2 24 25 A G >> + 0 0 0 1,-0.2 4,-2.0 37,-0.1 3,-1.3 -0.458 13.2 156.1 -86.5 65.1 -2.7 10.9 76.6 25 26 A H T 34 + 0 0 81 -2,-1.8 -1,-0.2 1,-0.3 5,-0.1 0.771 67.0 59.0 -62.5 -30.2 -6.4 10.8 77.4 26 27 A N T 34 S+ 0 0 77 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.673 115.6 37.9 -73.5 -14.3 -7.3 13.3 74.6 27 28 A L T <4 S+ 0 0 80 -3,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.714 123.6 31.9-106.5 -29.2 -5.7 10.8 72.2 28 29 A Y S < S- 0 0 76 -4,-2.0 3,-0.4 -8,-0.1 2,-0.3 -0.990 70.7-134.9-135.6 141.2 -6.8 7.5 73.7 29 30 A P S S+ 0 0 104 0, 0.0 -3,-0.1 0, 0.0 -5,-0.0 -0.717 84.9 17.1 -95.0 145.5 -9.9 6.3 75.6 30 31 A N S S+ 0 0 163 -2,-0.3 2,-0.3 1,-0.2 -5,-0.0 0.881 77.5 170.6 65.7 40.5 -9.7 4.2 78.8 31 32 A L - 0 0 32 -3,-0.4 2,-0.7 -6,-0.1 -1,-0.2 -0.645 27.9-143.2 -81.4 139.6 -6.0 4.8 79.4 32 33 A N > - 0 0 98 -2,-0.3 4,-1.8 1,-0.2 3,-0.2 -0.937 6.8-157.0-102.8 116.7 -4.8 3.4 82.8 33 34 A E H > S+ 0 0 53 -2,-0.7 4,-3.0 1,-0.2 5,-0.2 0.862 90.6 55.8 -64.3 -37.4 -2.3 5.9 84.1 34 35 A E H > S+ 0 0 120 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.860 106.9 51.6 -63.5 -33.6 -0.6 3.5 86.4 35 36 A T H > S+ 0 0 54 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.915 110.5 49.4 -66.5 -41.6 -0.0 1.3 83.4 36 37 A G H X S+ 0 0 2 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.927 111.9 46.8 -61.9 -45.7 1.5 4.3 81.7 37 38 A K H X S+ 0 0 16 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.907 111.0 52.4 -63.0 -40.9 3.7 5.0 84.6 38 39 A E H X S+ 0 0 82 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.822 108.1 52.1 -64.9 -32.2 4.8 1.4 84.8 39 40 A L H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.940 111.3 45.5 -69.0 -47.4 5.7 1.5 81.1 40 41 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.931 114.3 49.9 -58.9 -46.8 7.9 4.6 81.6 41 42 A R H X S+ 0 0 45 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.917 111.0 48.7 -57.2 -49.9 9.4 3.0 84.7 42 43 A E H X S+ 0 0 25 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.935 107.8 56.0 -57.2 -49.0 10.1 -0.2 82.8 43 44 A A H <>S+ 0 0 0 -4,-2.8 5,-2.6 1,-0.2 -2,-0.2 0.935 109.8 43.5 -49.2 -57.0 11.7 1.7 79.9 44 45 A I H ><5S+ 0 0 19 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.885 113.8 53.3 -58.2 -39.4 14.2 3.4 82.1 45 46 A R H 3<5S+ 0 0 151 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.914 107.0 51.6 -60.9 -45.5 14.9 0.1 83.9 46 47 A N T 3<5S- 0 0 54 -4,-3.0 -1,-0.3 -5,-0.1 -2,-0.2 0.200 127.8 -92.6 -80.5 15.8 15.5 -1.7 80.6 47 48 A G T < 5S+ 0 0 37 -3,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.582 71.5 150.5 89.5 7.4 18.1 0.9 79.4 48 49 A V < - 0 0 4 -5,-2.6 -1,-0.3 -6,-0.2 -32,-0.1 -0.600 21.1-174.7 -74.4 135.3 16.0 3.3 77.4 49 50 A T + 0 0 15 -34,-0.4 30,-2.6 -2,-0.3 2,-0.5 0.883 58.7 58.4 -95.9 -50.7 17.5 6.8 77.6 50 51 A X E - d 0 79C 0 -37,-0.3 -33,-2.5 28,-0.2 2,-0.6 -0.742 54.8-168.8 -94.9 127.4 15.1 9.1 75.8 51 52 A L E -cd 17 80C 0 28,-2.4 30,-2.4 -2,-0.5 2,-0.7 -0.950 14.6-155.9-108.2 119.3 11.5 9.6 76.7 52 53 A D E +cd 18 81C 0 -35,-3.3 -33,-2.3 -2,-0.6 30,-0.2 -0.876 28.7 146.8-103.6 114.3 9.7 11.6 74.0 53 54 A T - 0 0 0 28,-2.9 2,-0.3 -2,-0.7 -33,-0.1 -0.569 23.3-161.6-127.8-169.0 6.6 13.5 75.2 54 55 A A > - 0 0 0 28,-0.2 3,-0.6 -2,-0.2 6,-0.4 -0.963 35.7-105.8-171.8 160.0 4.7 16.7 74.4 55 56 A Y T 3 >S+ 0 0 23 28,-1.8 5,-1.4 -2,-0.3 6,-0.2 0.892 116.6 58.9 -61.3 -42.0 2.1 19.2 75.8 56 57 A I T > 5S+ 0 0 21 3,-0.2 2,-1.5 2,-0.2 3,-0.9 0.772 80.4 96.7 -60.7 -26.3 -0.6 17.9 73.5 57 58 A Y G X >S- 0 0 36 -3,-0.6 5,-2.0 1,-0.3 3,-0.6 -0.505 122.1 -27.3 -67.8 93.2 -0.2 14.5 75.0 58 59 A G G > 5S- 0 0 12 -2,-1.5 3,-1.8 1,-0.2 -1,-0.3 0.729 107.0 -79.1 70.6 21.9 -3.0 14.7 77.5 59 60 A I G < 5S- 0 0 70 -3,-0.9 -3,-0.2 1,-0.3 -1,-0.2 0.899 105.4 -31.6 53.7 43.1 -2.7 18.5 77.7 60 61 A G G <>5S+ 0 0 68 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.834 76.8 57.2 -59.3 -34.7 -0.8 15.0 81.7 62 63 A S H > S+ 0 0 0 -6,-0.4 4,-2.1 -9,-0.3 -2,-0.2 0.868 112.1 54.1 -65.9 -35.1 4.6 15.2 81.2 64 65 A E H X S+ 0 0 73 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.957 109.8 43.9 -64.5 -51.5 3.0 15.0 84.7 65 66 A L H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.914 115.0 49.8 -60.0 -43.8 3.0 11.2 84.9 66 67 A I H X S+ 0 0 0 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.885 108.4 55.1 -60.9 -38.8 6.6 11.1 83.4 67 68 A G H X S+ 0 0 3 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.856 106.8 49.4 -63.7 -36.2 7.5 13.7 86.0 68 69 A E H >< S+ 0 0 61 -4,-1.8 3,-0.9 1,-0.2 4,-0.4 0.944 111.8 47.0 -68.9 -47.3 6.2 11.5 88.9 69 70 A V H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 4,-0.4 0.832 102.6 66.8 -62.2 -30.8 8.1 8.4 87.7 70 71 A L H >< S+ 0 0 12 -4,-1.9 3,-1.5 1,-0.3 -1,-0.2 0.804 86.7 67.1 -61.1 -32.5 11.2 10.5 87.2 71 72 A R T << S+ 0 0 164 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.748 93.6 62.9 -59.4 -24.3 11.5 11.1 91.0 72 73 A E T < S+ 0 0 93 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.693 108.3 38.1 -74.5 -22.7 12.3 7.3 91.2 73 74 A F S < S- 0 0 58 -3,-1.5 2,-0.5 -4,-0.4 3,-0.1 -0.497 98.4 -80.0-118.6-173.4 15.5 7.6 89.2 74 75 A N > - 0 0 93 -2,-0.2 3,-1.8 1,-0.1 4,-0.2 -0.828 33.8-141.4 -93.5 126.3 18.4 9.9 88.8 75 76 A R G > S+ 0 0 33 -2,-0.5 3,-2.0 1,-0.3 -1,-0.1 0.883 98.1 60.2 -53.5 -44.0 17.6 12.8 86.5 76 77 A E G 3 S+ 0 0 130 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.593 96.7 62.3 -64.9 -9.4 21.0 12.8 84.8 77 78 A D G < S+ 0 0 91 -3,-1.8 2,-0.4 1,-0.0 -1,-0.3 0.463 98.3 66.3 -93.2 -3.5 20.4 9.3 83.6 78 79 A V < - 0 0 1 -3,-2.0 2,-0.7 -4,-0.2 -28,-0.2 -0.965 67.8-146.2-126.6 137.1 17.4 10.2 81.5 79 80 A V E -d 50 0C 11 -30,-2.6 -28,-2.4 -2,-0.4 2,-0.6 -0.883 18.1-161.4-100.5 110.4 17.0 12.4 78.4 80 81 A I E -d 51 0C 0 -2,-0.7 40,-2.3 -30,-0.2 39,-0.8 -0.829 8.9-176.8 -94.5 122.8 13.6 14.1 78.5 81 82 A A E +de 52 120C 0 -30,-2.4 -28,-2.9 -2,-0.6 2,-0.3 -0.977 12.9 161.2-121.3 119.3 12.5 15.5 75.1 82 83 A T E - e 0 121C 0 38,-2.3 40,-2.6 -2,-0.5 2,-0.3 -0.799 18.2-151.1-131.1 176.5 9.2 17.4 75.0 83 84 A K E - e 0 122C 2 -2,-0.3 -28,-1.8 38,-0.2 2,-0.3 -0.929 7.8-171.7-146.1 167.5 7.4 19.9 72.7 84 85 A A E + e 0 123C 4 38,-1.2 40,-1.7 -2,-0.3 41,-0.4 -0.979 37.3 112.6-158.6 153.8 5.0 22.8 72.5 85 86 A A + 0 0 0 1,-0.3 11,-2.2 -2,-0.3 2,-0.4 -0.011 49.2 111.0 169.2 -35.3 3.1 24.8 69.9 86 87 A H E -I 95 0D 19 9,-0.2 2,-0.6 7,-0.1 -1,-0.3 -0.480 48.1-166.9 -65.5 117.0 -0.5 23.9 70.5 87 88 A R E -I 94 0D 82 7,-2.4 7,-1.8 -2,-0.4 5,-0.1 -0.945 23.1-120.6-111.5 118.6 -2.3 27.0 71.9 88 89 A K E +I 93 0D 83 -2,-0.6 5,-0.2 5,-0.2 2,-0.0 -0.272 48.6 146.0 -56.8 134.2 -5.7 26.3 73.3 89 90 A Q - 0 0 118 3,-2.3 2,-0.7 0, 0.0 4,-0.2 0.228 66.3 -9.8-131.9-102.3 -8.5 28.3 71.6 90 91 A G S S- 0 0 59 1,-0.1 3,-0.1 2,-0.1 -2,-0.0 -0.848 118.3 -57.2-113.5 92.3 -12.1 27.0 71.1 91 92 A N S S+ 0 0 180 -2,-0.7 2,-0.3 1,-0.1 -1,-0.1 0.766 132.6 66.9 40.3 29.2 -12.0 23.4 71.9 92 93 A D S S- 0 0 109 -5,-0.1 -3,-2.3 2,-0.0 2,-0.3 -0.926 82.1-115.1-159.3 172.9 -9.3 23.2 69.3 93 94 A F E -I 88 0D 63 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.809 10.5-159.8-123.1 161.9 -5.8 24.6 68.9 94 95 A V E -I 87 0D 58 -7,-1.8 -7,-2.4 -2,-0.3 2,-0.3 -0.968 35.4-108.7-132.5 143.6 -3.9 27.1 66.8 95 96 A F E -I 86 0D 76 -2,-0.3 2,-0.4 -9,-0.2 33,-0.3 -0.610 34.1-172.8 -81.0 136.1 -0.1 26.9 66.5 96 97 A D + 0 0 13 -11,-2.2 29,-0.1 -2,-0.3 -12,-0.0 -0.993 21.2 164.8-131.2 125.8 1.9 29.6 68.2 97 98 A N + 0 0 0 -2,-0.4 -1,-0.1 26,-0.1 5,-0.1 0.203 33.4 136.3-120.4 10.6 5.7 30.0 67.9 98 99 A S > - 0 0 33 1,-0.1 4,-2.4 4,-0.1 3,-0.4 -0.297 65.3-115.7 -63.0 144.1 5.9 33.5 69.4 99 100 A P H > S+ 0 0 41 0, 0.0 4,-2.3 0, 0.0 5,-0.3 0.865 113.6 50.3 -45.6 -48.4 8.8 34.1 71.8 100 101 A D H > S+ 0 0 127 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.894 112.8 46.6 -61.6 -41.5 6.5 34.8 74.8 101 102 A F H > S+ 0 0 18 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.875 112.2 49.3 -70.0 -38.9 4.5 31.7 74.2 102 103 A L H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.913 112.4 46.6 -67.9 -43.5 7.5 29.4 73.7 103 104 A K H X S+ 0 0 51 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.911 113.5 49.2 -64.4 -43.3 9.3 30.6 76.9 104 105 A K H X S+ 0 0 115 -4,-1.9 4,-2.4 -5,-0.3 5,-0.3 0.927 108.5 55.4 -60.3 -43.8 6.0 30.3 78.9 105 106 A S H X S+ 0 0 6 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.901 107.3 49.0 -55.4 -44.1 5.7 26.8 77.4 106 107 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.947 111.0 48.2 -62.9 -50.5 9.1 25.8 78.7 107 108 A D H X S+ 0 0 65 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.865 113.9 47.4 -59.0 -37.6 8.5 27.1 82.2 108 109 A E H X S+ 0 0 61 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.817 109.9 53.3 -73.4 -31.3 5.1 25.3 82.4 109 110 A S H X S+ 0 0 1 -4,-1.9 4,-2.7 -5,-0.3 5,-0.2 0.922 107.1 51.8 -67.9 -42.4 6.7 22.1 81.0 110 111 A L H X>S+ 0 0 17 -4,-2.4 5,-1.9 1,-0.2 4,-0.8 0.865 110.3 48.9 -61.2 -40.0 9.4 22.2 83.8 111 112 A K H <5S+ 0 0 176 -4,-1.5 3,-0.3 2,-0.2 -1,-0.2 0.930 112.5 46.7 -67.3 -45.8 6.7 22.5 86.4 112 113 A R H <5S+ 0 0 50 -4,-2.2 -2,-0.2 1,-0.2 -45,-0.2 0.899 116.9 43.9 -63.9 -38.8 4.6 19.7 85.0 113 114 A L H <5S- 0 0 1 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.621 103.1-138.6 -78.7 -12.9 7.8 17.5 84.8 114 115 A N T <5 + 0 0 116 -4,-0.8 2,-0.3 -3,-0.3 -3,-0.2 0.893 60.5 122.2 55.4 42.6 8.8 18.7 88.2 115 116 A T S > - 0 0 46 0, 0.0 4,-1.6 0, 0.0 3,-1.0 -0.381 28.2-138.1 -54.2 121.9 10.0 34.2 61.9 132 133 A K H 3> S+ 0 0 7 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.729 99.1 57.4 -60.1 -25.5 11.3 30.8 62.8 133 134 A D H 3> S+ 0 0 25 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.815 107.9 49.8 -75.0 -26.6 14.8 32.0 63.7 134 135 A E H <> S+ 0 0 98 -3,-1.0 4,-1.6 2,-0.2 -2,-0.2 0.842 108.3 51.8 -77.2 -35.4 13.2 34.3 66.2 135 136 A A H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.943 112.7 46.2 -64.3 -47.3 11.1 31.5 67.7 136 137 A V H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.874 107.9 56.1 -63.0 -38.7 14.3 29.4 68.0 137 138 A N H X S+ 0 0 52 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.873 104.7 54.4 -62.0 -34.3 16.1 32.4 69.6 138 139 A A H >X S+ 0 0 1 -4,-1.6 4,-1.1 2,-0.2 3,-0.5 0.925 111.3 43.0 -64.1 -45.5 13.4 32.5 72.2 139 140 A L H 3X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 3,-0.4 0.875 107.3 62.9 -67.7 -33.5 14.0 28.9 73.0 140 141 A N H 3X S+ 0 0 22 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.809 96.3 59.0 -60.7 -28.1 17.7 29.7 72.9 141 142 A E H S+ 0 0 13 -4,-1.1 5,-2.9 -3,-0.4 6,-0.9 0.828 110.7 55.4 -69.1 -30.5 15.9 29.2 77.9 143 144 A K H ><5S+ 0 0 66 -4,-1.9 3,-1.8 4,-0.2 -2,-0.2 0.957 107.9 46.8 -66.2 -48.6 18.9 27.2 76.7 144 145 A K H 3<5S+ 0 0 166 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.825 108.9 55.5 -62.0 -33.1 21.4 29.8 77.9 145 146 A A T 3<5S- 0 0 72 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.502 119.3-115.5 -77.2 -3.4 19.5 30.0 81.2 146 147 A G T < 5S+ 0 0 43 -3,-1.8 -3,-0.2 2,-0.3 -2,-0.1 0.641 83.8 120.7 79.0 14.4 20.1 26.3 81.5 147 148 A K S - 0 0 33 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.529 34.6-101.6 -89.1 166.5 9.2 22.6 55.8 158 159 A L H > S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.930 125.4 50.6 -54.5 -44.2 12.8 22.7 54.4 159 160 A E H > S+ 0 0 133 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.925 111.1 46.1 -59.3 -49.2 12.4 26.5 54.1 160 161 A Q H > S+ 0 0 54 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.829 112.1 52.7 -65.0 -31.5 11.2 26.9 57.7 161 162 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.948 107.4 51.0 -67.7 -49.4 14.0 24.7 58.9 162 163 A K H < S+ 0 0 111 -4,-2.7 6,-0.2 1,-0.2 -2,-0.2 0.923 112.5 46.8 -53.1 -47.7 16.6 26.7 57.1 163 164 A E H >< S+ 0 0 70 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.923 112.7 48.8 -61.7 -45.8 15.2 29.9 58.7 164 165 A A H 3< S+ 0 0 3 -4,-2.3 3,-0.4 1,-0.3 5,-0.4 0.843 114.8 45.5 -63.4 -34.1 15.1 28.3 62.1 165 166 A N T >< S+ 0 0 7 -4,-2.8 3,-1.9 1,-0.2 -1,-0.3 0.091 76.0 121.0 -96.7 22.3 18.6 27.0 61.7 166 167 A K T < S+ 0 0 128 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.868 88.6 30.0 -50.8 -40.9 19.7 30.4 60.4 167 168 A D T 3 S- 0 0 105 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.132 119.6-107.1-106.6 16.9 22.2 30.6 63.3 168 169 A G S < S+ 0 0 32 -3,-1.9 -3,-0.1 -6,-0.2 -2,-0.1 0.809 79.1 131.6 63.0 34.1 22.7 26.9 63.5 169 170 A L + 0 0 32 -5,-0.4 2,-0.7 -19,-0.0 -18,-0.4 0.449 40.7 96.1 -95.7 -1.2 20.7 26.4 66.7 170 171 A V + 0 0 0 1,-0.2 -18,-0.2 -9,-0.1 -163,-0.1 -0.808 39.4 166.7 -93.3 115.1 18.6 23.5 65.5 171 172 A D + 0 0 8 -20,-2.4 27,-2.7 -2,-0.7 2,-0.4 0.736 62.7 35.2 -96.6 -27.4 20.1 20.2 66.7 172 173 A V E -gh 152 198C 0 -21,-1.1 -19,-2.0 25,-0.2 2,-0.4 -0.977 54.3-166.6-135.6 144.9 17.2 17.9 65.9 173 174 A L E -gh 153 199C 2 25,-2.6 27,-3.2 -2,-0.4 2,-0.6 -0.993 8.4-162.4-125.4 130.0 14.4 17.5 63.4 174 175 A Q E +gh 154 200C 6 -21,-1.8 -19,-1.5 -2,-0.4 2,-0.3 -0.965 25.7 159.5-115.8 117.9 11.5 15.2 64.0 175 176 A G E - h 0 201C 9 25,-1.5 27,-1.3 -2,-0.6 2,-0.3 -0.937 46.6 -89.1-139.3 162.4 9.5 14.4 60.9 176 177 A E E + h 0 202C 79 -2,-0.3 2,-0.3 25,-0.2 8,-0.3 -0.513 57.4 154.5 -68.8 124.8 7.1 11.9 59.3 177 178 A Y + 0 0 0 25,-1.8 2,-0.3 -2,-0.3 5,-0.2 -0.946 2.2 131.9-159.0 131.3 9.1 9.1 57.6 178 179 A N B > -K 181 0F 0 3,-1.5 3,-1.0 -2,-0.3 27,-0.1 -0.948 66.7 -78.0-163.0 178.0 8.5 5.4 56.7 179 180 A L T 3 S+ 0 0 5 25,-0.5 3,-0.3 -2,-0.3 26,-0.1 0.702 128.8 46.3 -61.6 -21.3 8.9 2.9 53.9 180 181 A L T 3 S+ 0 0 34 1,-0.2 2,-0.3 24,-0.1 -1,-0.3 0.565 119.5 39.8 -96.5 -12.6 5.7 4.3 52.2 181 182 A N B < +K 178 0F 33 -3,-1.0 -3,-1.5 1,-0.1 3,-0.4 -0.695 62.4 153.7-138.7 83.9 6.7 7.9 52.6 182 183 A R > + 0 0 13 -2,-0.3 3,-1.6 -3,-0.3 4,-0.5 0.186 32.6 117.6 -98.2 16.5 10.4 8.4 51.9 183 184 A E T >> + 0 0 85 1,-0.3 4,-2.6 2,-0.2 3,-1.9 0.834 63.0 71.0 -51.7 -39.5 10.4 12.0 50.8 184 185 A A H 3>>S+ 0 0 5 -3,-0.4 5,-3.1 -8,-0.3 4,-2.5 0.825 87.7 66.1 -48.2 -36.1 12.5 13.2 53.7 185 186 A E H <45S+ 0 0 42 -3,-1.6 -1,-0.3 3,-0.2 -2,-0.2 0.844 114.4 28.1 -56.1 -36.8 15.5 11.4 52.1 186 187 A K H <45S+ 0 0 153 -3,-1.9 -2,-0.2 -4,-0.5 -1,-0.2 0.856 131.3 36.2 -93.3 -41.3 15.4 13.9 49.2 187 188 A T H <5S+ 0 0 53 -4,-2.6 -3,-0.2 3,-0.1 4,-0.2 0.858 134.1 11.3 -82.4 -39.2 13.9 16.9 50.9 188 189 A F T X5S+ 0 0 38 -4,-2.5 4,-2.6 -5,-0.3 3,-0.4 0.827 109.7 68.8-109.7 -46.7 15.5 16.8 54.4 189 190 A F H > S+ 0 0 78 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.947 115.9 38.6 -49.6 -52.8 20.8 16.1 52.5 191 192 A Y H > S+ 0 0 33 -3,-0.4 4,-3.1 2,-0.2 -2,-0.2 0.936 117.3 47.5 -63.9 -51.7 20.4 19.2 54.7 192 193 A T H <>S+ 0 0 0 -4,-2.6 5,-3.2 1,-0.2 -1,-0.2 0.919 113.9 47.7 -57.5 -47.4 20.3 17.6 58.1 193 194 A K H ><5S+ 0 0 126 -4,-2.9 3,-0.9 -5,-0.3 -1,-0.2 0.899 113.6 49.9 -60.3 -41.3 23.2 15.3 57.3 194 195 A E H 3<5S+ 0 0 146 -4,-1.9 -2,-0.2 -5,-0.4 -1,-0.2 0.950 116.9 38.0 -61.9 -52.8 25.1 18.4 56.1 195 196 A H T 3<5S- 0 0 74 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.148 112.3-115.4 -87.9 17.9 24.3 20.6 59.1 196 197 A N T < 5 + 0 0 81 -3,-0.9 -189,-1.1 1,-0.2 2,-0.5 0.859 60.6 156.5 50.2 41.6 24.8 17.6 61.5 197 198 A I < - 0 0 5 -5,-3.2 -25,-0.2 -191,-0.2 -1,-0.2 -0.863 42.1-126.8 -97.1 127.6 21.1 17.8 62.6 198 199 A S E -h 172 0C 2 -27,-2.7 -25,-2.6 -2,-0.5 2,-0.5 -0.508 19.4-141.9 -73.8 142.9 19.8 14.5 63.9 199 200 A F E -h 173 0C 0 72,-1.6 74,-0.5 -27,-0.2 75,-0.4 -0.929 16.0-173.5-111.9 121.0 16.7 13.2 62.3 200 201 A I E -h 174 0C 0 -27,-3.2 -25,-1.5 -2,-0.5 75,-0.1 -0.941 12.8-156.0-114.1 113.7 14.0 11.5 64.3 201 202 A P E -h 175 0C 2 0, 0.0 75,-0.5 0, 0.0 2,-0.3 -0.439 7.4-167.1 -84.5 161.6 11.2 9.9 62.3 202 203 A Y E +h 176 0C 68 -27,-1.3 -25,-1.8 1,-0.2 73,-0.0 -0.950 66.9 41.1-143.5 157.1 7.7 9.2 63.6 203 204 A F + 0 0 58 -2,-0.3 3,-0.2 -27,-0.2 -1,-0.2 0.921 66.2 152.7 68.1 46.4 4.9 7.2 62.0 204 205 A P S S+ 0 0 20 0, 0.0 -25,-0.5 0, 0.0 -24,-0.1 0.685 71.4 41.6 -80.5 -17.6 7.4 4.5 61.0 205 206 A L S >S- 0 0 42 -27,-0.1 5,-2.5 -26,-0.1 3,-0.4 0.419 99.7-133.5-108.6 -1.0 4.9 1.6 61.1 206 207 A V T > 5S- 0 0 1 1,-0.2 3,-1.6 3,-0.2 5,-0.1 0.910 74.2 -44.4 47.8 55.7 2.0 3.5 59.5 207 208 A S T 3 5S- 0 0 51 1,-0.3 -1,-0.2 2,-0.1 19,-0.0 0.786 113.3 -51.5 63.7 30.4 -0.7 2.4 62.0 208 209 A G T > >S+ 0 0 12 -3,-0.4 3,-2.0 5,-0.0 5,-1.6 0.224 112.7 116.5 92.8 -14.5 0.5 -1.2 62.0 209 210 A L G X 5S+ 0 0 2 -3,-1.6 3,-0.6 1,-0.3 -3,-0.2 0.879 83.9 39.1 -54.0 -41.3 0.4 -1.4 58.2 210 211 A L G 3 - 0 0 75 -2,-0.2 3,-1.4 27,-0.0 26,-0.1 -0.800 43.4 -93.0-134.3 174.8 -3.9 -9.2 56.3 216 217 A E T 3 S+ 0 0 70 -2,-0.3 22,-0.1 1,-0.3 23,-0.1 0.740 125.4 55.3 -65.1 -21.4 -5.4 -8.6 52.8 217 218 A D T 3 S+ 0 0 137 21,-0.1 -1,-0.3 2,-0.0 21,-0.0 0.507 80.3 120.9 -89.7 -5.5 -8.8 -9.6 54.2 218 219 A T < - 0 0 39 -3,-1.4 2,-0.3 1,-0.0 -4,-0.1 -0.250 39.7-176.1 -59.9 144.4 -8.7 -7.1 57.1 219 220 A T - 0 0 121 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.981 12.9-144.4-142.7 151.8 -11.5 -4.5 57.2 220 221 A F - 0 0 32 -2,-0.3 3,-0.1 4,-0.1 2,-0.0 -0.837 27.7 -97.4-118.8 155.4 -12.3 -1.6 59.4 221 222 A P > - 0 0 88 0, 0.0 3,-2.1 0, 0.0 6,-0.2 -0.287 50.6 -87.3 -68.0 153.5 -15.6 -0.1 60.7 222 223 A E T 3 S+ 0 0 176 1,-0.3 3,-0.1 3,-0.0 0, 0.0 -0.341 117.7 28.2 -59.4 138.8 -17.3 2.8 58.9 223 224 A G T 3 S+ 0 0 79 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.221 83.1 136.6 92.8 -17.2 -16.0 6.1 60.3 224 225 A D X - 0 0 38 -3,-2.1 3,-0.6 1,-0.2 -1,-0.3 -0.533 53.9-143.0 -66.8 118.5 -12.6 4.5 61.1 225 226 A L G > S+ 0 0 139 -2,-0.4 3,-0.7 1,-0.2 -1,-0.2 0.646 91.5 71.5 -59.6 -13.7 -10.1 7.1 60.0 226 227 A R G > S+ 0 0 66 1,-0.2 3,-3.0 2,-0.2 2,-1.4 0.962 87.5 55.9 -70.1 -52.1 -7.8 4.3 58.9 227 228 A N G < S+ 0 0 54 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.059 111.5 51.5 -72.3 35.8 -9.8 3.0 55.8 228 229 A E G < S+ 0 0 136 -2,-1.4 -1,-0.3 -3,-0.7 -2,-0.2 0.152 78.8 97.3-149.8 8.1 -9.4 6.7 54.8 229 230 A Q S < S- 0 0 56 -3,-3.0 2,-0.4 1,-0.1 -2,-0.1 0.769 84.6-128.2 -75.9 -28.2 -5.6 7.1 55.2 230 231 A E S > S+ 0 0 81 -4,-0.4 3,-1.3 4,-0.0 6,-0.2 -0.546 104.1 67.4 111.6 -60.4 -4.8 6.5 51.5 231 232 A H T 3 S+ 0 0 31 -2,-0.4 9,-0.2 1,-0.3 -4,-0.1 0.540 107.3 48.0 -66.4 -3.0 -2.1 3.8 52.0 232 233 A F T 3 S+ 0 0 11 -6,-0.2 -1,-0.3 4,-0.1 5,-0.2 0.500 94.5 99.9-110.4 -12.8 -5.2 1.9 53.2 233 234 A K S X> S- 0 0 80 -3,-1.3 3,-1.3 4,-0.1 4,-1.2 -0.359 86.7 -33.8 -79.6 159.0 -7.5 2.8 50.3 234 235 A G H >> S- 0 0 69 1,-0.3 3,-1.1 2,-0.2 4,-0.7 0.162 124.0 -16.3 32.7-142.2 -8.4 0.7 47.3 235 236 A E H 3> S+ 0 0 123 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.615 124.4 81.3 -63.7 -13.3 -5.7 -1.6 46.0 236 237 A R H <> S+ 0 0 114 -3,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.908 90.5 49.7 -60.4 -43.1 -3.1 0.4 48.0 237 238 A F H < S+ 0 0 3 -4,-2.3 3,-2.1 1,-0.2 -2,-0.2 0.891 101.4 63.1 -71.1 -39.0 5.3 -5.9 53.5 245 246 A N G >< S+ 0 0 81 -4,-2.0 3,-2.0 1,-0.3 -1,-0.2 0.705 83.9 75.9 -59.3 -20.9 5.1 -9.7 53.7 246 247 A K G 3 S+ 0 0 112 -3,-0.5 -1,-0.3 -4,-0.3 4,-0.3 0.530 87.8 62.9 -69.1 -2.7 8.0 -9.9 51.3 247 248 A L G <> S+ 0 0 0 -3,-2.1 4,-2.1 1,-0.1 -1,-0.3 0.476 75.0 95.1 -95.6 -8.4 10.1 -9.0 54.4 248 249 A A H <> S+ 0 0 25 -3,-2.0 4,-2.8 1,-0.2 5,-0.2 0.886 80.8 52.4 -50.4 -47.8 9.1 -12.2 56.2 249 250 A P H > S+ 0 0 76 0, 0.0 4,-3.3 0, 0.0 -1,-0.2 0.932 109.1 48.8 -57.6 -46.0 12.2 -14.1 55.1 250 251 A I H > S+ 0 0 12 -4,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.889 111.5 50.7 -61.0 -39.0 14.6 -11.4 56.4 251 252 A A H <>S+ 0 0 3 -4,-2.1 5,-2.2 2,-0.2 4,-0.4 0.948 111.2 47.5 -63.0 -49.3 12.7 -11.3 59.7 252 253 A E H ><5S+ 0 0 128 -4,-2.8 3,-2.1 1,-0.2 -2,-0.2 0.955 108.0 57.0 -55.3 -51.4 13.0 -15.1 60.0 253 254 A K H 3<5S+ 0 0 118 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.873 114.8 36.4 -47.1 -46.7 16.7 -14.9 59.1 254 255 A H T 3<5S- 0 0 53 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.314 110.9-119.8 -92.9 8.1 17.3 -12.5 62.1 255 256 A N T < 5S+ 0 0 135 -3,-2.1 -3,-0.2 -4,-0.4 2,-0.2 0.859 79.0 99.5 56.2 41.1 14.8 -14.3 64.4 256 257 A V S > - 0 0 86 -2,-0.2 4,-1.7 -3,-0.1 3,-0.6 -0.655 38.6-100.9-108.3 167.5 9.4 -9.8 63.4 258 259 A I H 3> S+ 0 0 18 1,-0.2 4,-2.9 -2,-0.2 5,-0.2 0.902 120.7 56.6 -52.5 -45.1 8.7 -7.6 60.3 259 260 A P H 3> S+ 0 0 24 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.895 105.0 52.6 -57.2 -37.3 8.3 -4.5 62.5 260 261 A H H <> S+ 0 0 5 -3,-0.6 4,-2.6 2,-0.2 -2,-0.2 0.903 111.7 45.6 -63.6 -40.8 11.8 -5.0 63.9 261 262 A I H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.923 112.3 51.1 -67.3 -45.5 13.3 -5.3 60.4 262 263 A V H X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.952 115.3 41.8 -56.6 -52.6 11.4 -2.3 59.2 263 264 A L H X S+ 0 0 6 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.900 110.7 56.0 -63.4 -42.3 12.6 -0.2 62.1 264 265 A A H X S+ 0 0 8 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.895 104.3 56.2 -57.6 -37.4 16.1 -1.5 62.0 265 266 A W H X S+ 0 0 4 -4,-2.3 4,-0.6 2,-0.2 3,-0.5 0.958 107.1 47.3 -58.5 -51.7 16.2 -0.4 58.4 266 267 A Y H >< S+ 0 0 0 -4,-1.6 3,-1.8 1,-0.3 6,-0.3 0.931 110.8 52.6 -54.7 -48.4 15.3 3.2 59.4 267 268 A L H 3< S+ 0 0 38 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.821 99.6 63.9 -58.2 -31.9 18.0 3.1 62.1 268 269 A A H 3< S+ 0 0 49 -4,-1.8 -1,-0.3 -3,-0.5 -2,-0.2 0.648 77.3 106.2 -67.8 -15.8 20.5 2.0 59.5 269 270 A R S X< S- 0 0 57 -3,-1.8 3,-2.0 -4,-0.6 -3,-0.0 -0.495 75.5-135.5 -66.6 127.6 20.1 5.4 57.7 270 271 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.854 103.9 57.7 -51.8 -33.5 23.2 7.4 58.4 271 272 A E T 3 S+ 0 0 18 -73,-0.1 -72,-1.6 2,-0.0 2,-0.5 0.542 96.1 70.8 -77.5 -9.1 20.9 10.4 59.1 272 273 A I < + 0 0 4 -3,-2.0 -72,-0.1 -6,-0.3 3,-0.1 -0.938 45.6 170.0-114.6 129.0 18.9 8.7 61.9 273 274 A D + 0 0 43 -74,-0.5 2,-0.3 -2,-0.5 -1,-0.1 0.709 67.0 16.8-105.8 -26.0 20.3 8.0 65.3 274 275 A I - 0 0 0 -75,-0.4 2,-0.3 -259,-0.1 -1,-0.3 -0.995 58.5-145.2-149.7 152.6 17.3 7.0 67.3 275 276 A L B -b 15 0B 2 -261,-1.8 -259,-3.2 -2,-0.3 -73,-0.1 -0.802 6.4-152.6-112.9 156.9 13.7 5.8 66.9 276 277 A I + 0 0 23 -75,-0.5 -259,-0.2 -2,-0.3 -261,-0.1 -0.411 21.1 179.8-128.7 59.1 10.7 6.6 69.1 277 278 A P - 0 0 12 0, 0.0 -259,-2.1 0, 0.0 11,-0.1 -0.299 24.4-125.5 -60.6 142.2 8.3 3.7 68.8 278 279 A G + 0 0 38 -261,-0.2 2,-0.3 -259,-0.1 -259,-0.1 -0.093 29.2 177.7 -80.5-177.9 5.2 4.0 70.9 279 280 A A - 0 0 12 -261,-0.4 -258,-0.4 1,-0.1 3,-0.1 -0.889 30.2-159.5 179.0 151.2 3.7 1.7 73.5 280 281 A K S S+ 0 0 83 -2,-0.3 2,-0.3 1,-0.2 -241,-0.2 0.699 81.8 37.5-109.2 -33.5 0.8 1.3 75.9 281 282 A R S >> S- 0 0 107 1,-0.1 4,-1.2 -242,-0.1 3,-0.5 -0.837 78.5-116.1-123.6 159.8 2.4 -1.4 78.2 282 283 A A H >> S+ 0 0 19 -2,-0.3 4,-1.9 1,-0.2 3,-1.0 0.923 112.4 56.6 -53.5 -53.3 5.8 -2.3 79.6 283 284 A D H 3> S+ 0 0 82 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.810 103.0 55.6 -51.2 -36.1 6.0 -5.7 77.8 284 285 A Q H <> S+ 0 0 57 -3,-0.5 4,-1.4 2,-0.2 -1,-0.3 0.855 104.8 53.5 -66.8 -35.6 5.6 -3.9 74.5 285 286 A L H < S+ 0 0 26 -4,-1.4 3,-1.8 -3,-0.4 4,-0.3 0.891 99.9 61.2 -69.4 -40.4 10.6 -2.5 70.9 289 290 A I G >< S+ 0 0 25 -4,-2.1 3,-2.0 1,-0.3 4,-0.3 0.776 85.7 75.0 -57.8 -28.8 14.1 -2.7 72.3 290 291 A K G > S+ 0 0 81 -4,-0.5 3,-1.9 -3,-0.3 4,-0.4 0.763 79.6 74.9 -57.4 -24.1 14.9 -5.9 70.4 291 292 A T G X S+ 0 0 3 -3,-1.8 3,-1.4 1,-0.3 -1,-0.3 0.851 86.8 61.9 -56.2 -35.5 15.2 -3.7 67.3 292 293 A A G < S+ 0 0 30 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.667 96.1 59.3 -66.4 -17.8 18.5 -2.5 68.6 293 294 A D G < S+ 0 0 128 -3,-1.9 -1,-0.3 -4,-0.3 2,-0.2 0.563 85.8 102.4 -88.3 -8.6 19.9 -6.1 68.4 294 295 A V < - 0 0 21 -3,-1.4 2,-0.4 -4,-0.4 -3,-0.0 -0.531 45.6-178.0 -80.3 140.7 19.2 -6.2 64.7 295 296 A T - 0 0 118 -2,-0.2 2,-0.1 -41,-0.0 -30,-0.0 -0.864 13.3-158.1-138.9 98.5 22.0 -5.8 62.2 296 297 A L - 0 0 15 -2,-0.4 2,-0.1 -32,-0.1 -46,-0.0 -0.461 19.9-118.4 -75.3 149.2 20.8 -6.0 58.6 297 298 A S > - 0 0 46 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.449 24.8-111.9 -82.6 162.3 23.3 -6.9 55.9 298 299 A Q H > S+ 0 0 155 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.879 123.5 57.0 -61.5 -31.2 24.1 -4.4 53.1 299 300 A E H > S+ 0 0 152 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.905 106.9 45.9 -63.9 -44.2 22.3 -7.0 51.0 300 301 A D H > S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.935 112.0 51.4 -64.3 -47.1 19.1 -6.8 53.1 301 302 A I H X S+ 0 0 37 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.866 110.2 48.9 -57.9 -41.8 19.2 -3.0 53.2 302 303 A S H X S+ 0 0 61 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.914 109.7 51.3 -66.4 -45.1 19.4 -2.7 49.5 303 304 A F H X S+ 0 0 97 -4,-1.9 4,-3.6 1,-0.2 5,-0.2 0.942 112.1 46.0 -57.4 -50.1 16.6 -5.2 48.8 304 305 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.906 111.3 53.6 -59.8 -43.2 14.3 -3.3 51.1 305 306 A D H < S+ 0 0 49 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.913 115.6 38.7 -57.6 -47.7 15.4 0.0 49.5 306 307 A K H >< S+ 0 0 144 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.910 112.9 56.4 -71.0 -42.8 14.5 -1.3 46.1 307 308 A L H 3< S+ 0 0 27 -4,-3.6 -2,-0.2 1,-0.3 -1,-0.2 0.874 115.7 38.1 -56.7 -38.7 11.4 -3.1 47.3 308 309 A F T 3< S+ 0 0 6 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.275 85.3 153.3-108.9 47.2 10.0 0.1 48.7 309 310 A A < - 0 0 52 -3,-1.5 -3,-0.1 1,-0.1 -4,-0.0 -0.505 39.4-147.0 -76.1 142.3 11.2 2.4 45.9 310 311 A P 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.973 360.0 360.0 -72.8 -56.9 9.2 5.6 45.4 311 312 A G 0 0 120 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.149 360.0 360.0 144.2 360.0 9.6 5.9 41.6