==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 14-JUL-10 3NXS . COMPND 2 MOLECULE: LAO/AO TRANSPORT SYSTEM ATPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 306 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15929.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 225 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 10 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 46.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 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 1 0 0 0 1 1 1 1 1 1 0 2 1 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 6 A N > 0 0 156 0, 0.0 4,-2.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -87.7 19.0 29.2 -21.8 2 7 A V H > + 0 0 35 1,-0.2 4,-1.7 2,-0.2 3,-0.1 0.923 360.0 43.5 -56.3 -54.3 21.8 27.9 -19.5 3 8 A H H > S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.807 112.9 52.3 -65.8 -28.6 22.9 31.2 -18.1 4 9 A E H > S+ 0 0 57 -3,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.872 107.4 53.0 -74.0 -35.6 19.2 32.4 -17.5 5 10 A L H X S+ 0 0 20 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.875 106.4 53.5 -64.9 -38.0 18.5 29.2 -15.6 6 11 A A H X S+ 0 0 0 -4,-1.7 4,-2.8 -5,-0.2 -1,-0.2 0.924 108.0 49.8 -61.6 -45.7 21.5 29.9 -13.3 7 12 A Q H X S+ 0 0 77 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.878 107.6 53.3 -65.9 -39.3 20.3 33.3 -12.5 8 13 A S H X>S+ 0 0 34 -4,-1.9 5,-2.7 2,-0.2 4,-0.9 0.911 110.2 47.9 -60.7 -44.5 16.8 32.1 -11.6 9 14 A I H ><5S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.951 111.2 50.8 -57.5 -50.4 18.3 29.5 -9.2 10 15 A R H 3<5S+ 0 0 60 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.849 108.4 53.7 -54.6 -37.4 20.5 32.3 -7.7 11 16 A D H 3<5S- 0 0 126 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.662 121.6-106.9 -73.5 -18.9 17.2 34.4 -7.3 12 17 A G T <<5 + 0 0 36 -3,-1.3 2,-0.9 -4,-0.9 -3,-0.2 0.615 59.3 161.6 100.2 14.5 15.5 31.6 -5.4 13 18 A D >>< - 0 0 70 -5,-2.7 4,-1.9 1,-0.2 3,-0.6 -0.582 23.9-162.8 -69.4 106.0 13.1 30.5 -8.1 14 19 A R H 3> S+ 0 0 198 -2,-0.9 4,-2.1 1,-0.2 -1,-0.2 0.775 86.6 56.5 -63.6 -28.3 12.1 27.0 -6.8 15 20 A S H 3> S+ 0 0 67 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.813 106.3 49.3 -72.0 -34.5 10.8 26.0 -10.3 16 21 A A H <> S+ 0 0 0 -3,-0.6 4,-2.7 2,-0.2 -2,-0.2 0.884 109.3 54.0 -72.0 -37.3 14.1 26.7 -11.9 17 22 A L H X S+ 0 0 9 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.954 110.7 44.4 -57.3 -52.8 15.8 24.7 -9.1 18 23 A A H X S+ 0 0 51 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.852 112.0 53.2 -64.2 -37.2 13.6 21.6 -9.8 19 24 A R H X S+ 0 0 134 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.971 111.6 45.7 -59.6 -51.2 14.1 22.0 -13.6 20 25 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.829 110.6 53.5 -61.9 -36.3 17.9 22.1 -13.1 21 26 A I H X S+ 0 0 1 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.894 111.6 44.4 -67.6 -42.5 17.7 19.1 -10.7 22 27 A T H X S+ 0 0 86 -4,-2.3 4,-0.6 1,-0.2 -2,-0.2 0.832 111.0 57.8 -64.8 -37.1 15.8 17.0 -13.3 23 28 A L H < S+ 0 0 26 -4,-2.4 3,-0.3 -5,-0.2 12,-0.3 0.866 109.6 41.4 -61.4 -38.9 18.3 18.4 -15.8 24 29 A V H < S+ 0 0 11 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.775 112.9 55.0 -81.5 -24.5 21.2 16.9 -13.8 25 30 A E H < S+ 0 0 63 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.557 88.5 114.5 -78.3 -7.4 19.3 13.7 -13.2 26 31 A S < - 0 0 27 -4,-0.6 9,-0.1 -3,-0.3 -3,-0.0 -0.366 55.6-157.8 -78.6 146.5 18.8 13.3 -16.9 27 32 A T + 0 0 121 -2,-0.1 -1,-0.1 4,-0.1 -4,-0.0 0.570 61.5 103.3 -96.2 -13.4 20.3 10.5 -19.0 28 33 A R S > S- 0 0 38 1,-0.1 4,-1.9 4,-0.0 5,-0.1 -0.305 72.2-129.9 -73.8 157.9 20.1 12.3 -22.4 29 34 A A H > S+ 0 0 79 2,-0.2 4,-1.6 1,-0.2 -1,-0.1 0.715 105.4 55.6 -89.8 -23.2 23.2 13.8 -23.9 30 35 A D H > S+ 0 0 100 2,-0.2 4,-1.5 3,-0.1 -1,-0.2 0.866 112.6 44.1 -67.7 -38.9 21.8 17.2 -24.7 31 36 A H H > S+ 0 0 68 2,-0.2 4,-3.1 1,-0.2 -2,-0.2 0.896 110.5 54.8 -73.4 -43.0 20.8 17.5 -21.0 32 37 A R H X S+ 0 0 122 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.919 110.1 45.8 -53.8 -48.8 24.2 16.2 -19.8 33 38 A E H X S+ 0 0 61 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.854 114.7 49.1 -62.1 -38.9 26.1 18.8 -21.9 34 39 A Q H X S+ 0 0 61 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.880 107.0 55.6 -65.2 -44.2 23.6 21.5 -20.5 35 40 A A H X S+ 0 0 2 -4,-3.1 4,-2.5 -12,-0.3 -2,-0.2 0.896 107.9 47.8 -56.5 -45.7 24.1 20.3 -16.9 36 41 A Q H X S+ 0 0 81 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.848 110.2 51.1 -70.4 -34.1 27.9 20.8 -17.1 37 42 A Q H X S+ 0 0 111 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.950 111.1 49.9 -65.5 -47.0 27.6 24.3 -18.6 38 43 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.928 109.0 51.2 -50.8 -49.4 25.2 25.1 -15.8 39 44 A L H < S+ 0 0 16 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.828 108.7 52.1 -63.6 -33.0 27.7 23.8 -13.2 40 45 A L H >< S+ 0 0 101 -4,-1.8 3,-1.6 2,-0.2 -1,-0.2 0.928 109.3 49.0 -63.2 -50.5 30.4 25.9 -14.7 41 46 A D H 3< S+ 0 0 42 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.939 112.7 48.9 -53.4 -49.6 28.3 29.1 -14.5 42 47 A L T >X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 3,-1.3 0.349 77.7 111.7 -77.5 8.7 27.5 28.2 -10.9 43 48 A M T <4 S+ 0 0 108 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.822 71.6 57.0 -53.9 -35.4 31.2 27.6 -10.0 44 49 A P T 34 S+ 0 0 104 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.796 110.9 44.2 -66.7 -27.2 31.4 30.7 -7.7 45 50 A E T X4 S+ 0 0 44 -3,-1.3 3,-2.0 -4,-0.1 -2,-0.2 0.706 89.4 107.6 -85.3 -23.1 28.5 29.4 -5.6 46 51 A A T 3< S+ 0 0 32 -4,-1.4 75,-0.1 1,-0.3 76,-0.0 -0.342 83.5 20.5 -58.1 129.0 29.9 25.8 -5.5 47 52 A G T 3 S+ 0 0 23 73,-0.1 -1,-0.3 3,-0.0 4,-0.1 0.285 84.6 120.1 100.9 -7.1 31.3 25.0 -2.1 48 53 A S < + 0 0 76 -3,-2.0 2,-0.3 73,-0.1 -2,-0.1 0.520 61.1 67.9 -77.3 -2.1 29.4 27.6 -0.2 49 54 A A S S- 0 0 1 -4,-0.1 2,-0.2 71,-0.0 81,-0.2 -0.788 90.1-105.6-107.8 155.4 27.6 25.2 2.1 50 55 A M E -a 130 0A 22 79,-2.3 81,-2.4 -2,-0.3 2,-0.5 -0.591 34.2-143.2 -63.5 139.0 28.9 23.0 4.8 51 56 A H E +a 131 0A 17 -2,-0.2 99,-2.1 79,-0.2 100,-1.1 -0.952 23.6 177.3-111.8 117.4 28.9 19.4 3.6 52 57 A V E -ab 132 151A 2 79,-2.9 81,-2.9 -2,-0.5 2,-0.3 -0.980 14.8-154.7-129.0 122.8 28.1 16.8 6.3 53 58 A G E -ab 133 152A 0 98,-2.4 100,-2.9 -2,-0.5 2,-0.4 -0.706 8.5-168.9 -92.0 145.5 27.7 13.1 5.9 54 59 A I E +ab 134 153A 1 79,-2.7 81,-1.6 -2,-0.3 2,-0.3 -0.964 12.6 166.0-139.2 116.6 25.6 10.9 8.1 55 60 A T E +ab 135 154A 0 98,-2.4 100,-2.3 -2,-0.4 2,-0.2 -0.905 8.3 136.5-127.6 162.7 25.6 7.2 8.2 56 61 A G - 0 0 2 79,-0.9 100,-0.1 -2,-0.3 3,-0.1 -0.778 52.4 -85.9 173.0 156.0 24.4 4.3 10.4 57 62 A V > - 0 0 50 98,-0.4 3,-1.9 109,-0.3 5,-0.3 -0.307 63.0 -76.5 -70.1 156.3 22.7 0.9 9.9 58 63 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 78,-0.0 -0.257 121.5 30.1 -51.2 141.4 18.9 0.7 9.7 59 64 A G T 3 S+ 0 0 56 -3,-0.1 -2,-0.1 1,-0.0 0, 0.0 0.265 85.8 107.9 89.4 -9.2 17.3 1.1 13.2 60 65 A V S < S- 0 0 1 -3,-1.9 96,-0.1 95,-0.1 121,-0.1 0.835 96.2-105.4 -66.6 -30.2 20.1 3.3 14.5 61 66 A G > + 0 0 14 -4,-0.2 4,-2.0 120,-0.1 5,-0.1 0.668 69.7 146.1 105.5 27.2 17.8 6.4 14.5 62 67 A K H > S+ 0 0 23 -5,-0.3 4,-2.9 2,-0.2 5,-0.3 0.936 71.0 47.7 -65.7 -48.6 19.2 8.2 11.4 63 68 A S H > S+ 0 0 39 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.933 114.7 47.6 -54.6 -49.6 15.9 9.7 10.2 64 69 A T H > S+ 0 0 56 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.893 114.1 46.9 -58.8 -42.9 15.0 11.0 13.6 65 70 A T H X S+ 0 0 0 -4,-2.0 4,-3.4 2,-0.2 5,-0.3 0.930 112.4 48.2 -66.4 -48.7 18.5 12.4 14.1 66 71 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.887 113.4 49.3 -61.1 -39.8 18.6 14.1 10.7 67 72 A E H X S+ 0 0 39 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.936 114.3 43.6 -63.3 -47.0 15.1 15.6 11.4 68 73 A A H X S+ 0 0 18 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.918 117.3 46.2 -67.2 -44.2 16.1 16.9 14.9 69 74 A L H X S+ 0 0 3 -4,-3.4 4,-1.7 2,-0.2 -2,-0.2 0.895 111.0 53.5 -65.0 -39.4 19.4 18.2 13.6 70 75 A G H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.3 3,-0.3 0.960 111.4 44.5 -60.7 -51.5 17.7 19.8 10.6 71 76 A M H X S+ 0 0 22 -4,-2.5 4,-3.1 1,-0.2 -1,-0.2 0.871 110.8 54.5 -58.1 -41.9 15.2 21.7 12.8 72 77 A H H X S+ 0 0 53 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.799 111.6 44.9 -62.6 -33.4 17.9 22.8 15.2 73 78 A L H <>S+ 0 0 1 -4,-1.7 5,-2.5 -3,-0.3 -2,-0.2 0.858 112.0 50.7 -79.1 -39.0 19.9 24.3 12.4 74 79 A I H ><5S+ 0 0 15 -4,-2.4 3,-2.4 3,-0.2 -2,-0.2 0.943 107.5 54.2 -62.5 -40.9 16.8 25.9 10.9 75 80 A E H 3<5S+ 0 0 139 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.829 107.1 53.7 -60.2 -30.7 16.0 27.4 14.4 76 81 A A T 3<5S- 0 0 66 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.283 129.0 -97.7 -85.1 6.6 19.5 28.8 14.2 77 82 A G T < 5S+ 0 0 63 -3,-2.4 -3,-0.2 1,-0.3 -2,-0.1 0.503 79.3 130.3 91.8 5.2 18.9 30.5 10.8 78 83 A H < - 0 0 44 -5,-2.5 2,-0.5 -8,-0.1 -1,-0.3 -0.413 53.4-133.4 -82.1 164.4 20.4 28.0 8.4 79 84 A R - 0 0 76 48,-0.2 51,-1.5 -2,-0.1 50,-1.2 -0.997 30.5-155.2-115.9 128.8 18.7 26.6 5.3 80 85 A V E -cd 98 130A 0 17,-2.3 19,-2.8 -2,-0.5 2,-0.4 -0.857 17.6-171.4-118.6 129.8 19.1 22.9 5.1 81 86 A A E -cd 99 131A 0 49,-2.7 51,-3.2 -2,-0.4 2,-0.5 -0.938 8.4-160.5-113.8 142.2 19.1 20.3 2.4 82 87 A V E -cd 100 132A 2 17,-3.0 19,-1.6 -2,-0.4 2,-0.4 -0.979 10.9-176.9-121.0 121.3 19.1 16.6 3.0 83 88 A L E -cd 101 133A 5 49,-3.1 51,-2.9 -2,-0.5 2,-0.4 -0.932 13.4-146.6-120.0 140.9 20.2 14.2 0.2 84 89 A A E - d 0 134A 8 17,-0.9 2,-0.5 -2,-0.4 51,-0.2 -0.839 9.4-169.3-105.8 140.9 20.3 10.4 0.2 85 90 A V 0 0 0 49,-2.6 51,-0.2 -2,-0.4 60,-0.1 -0.887 360.0 360.0-122.0 92.6 22.8 8.2 -1.6 86 91 A D 0 0 91 -2,-0.5 26,-0.1 18,-0.2 49,-0.0 -0.784 360.0 360.0-135.4 360.0 21.2 4.8 -1.3 87 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 88 107 A R 0 0 179 0, 0.0 2,-0.5 0, 0.0 -25,-0.0 0.000 360.0 360.0 360.0 -61.7 9.7 10.0 6.3 89 108 A M >> + 0 0 8 1,-0.2 4,-2.2 2,-0.1 3,-0.6 -0.646 360.0 175.9-115.1 74.5 10.9 13.2 8.0 90 109 A A H 3> S+ 0 0 73 -2,-0.5 4,-1.1 1,-0.3 -1,-0.2 0.839 73.0 51.2 -49.3 -53.6 7.5 14.9 8.4 91 110 A R H 3> S+ 0 0 137 1,-0.2 4,-0.6 2,-0.2 3,-0.4 0.903 116.2 41.8 -50.9 -45.8 8.7 18.0 10.4 92 111 A L H X4 S+ 0 0 1 -3,-0.6 3,-0.8 1,-0.2 -1,-0.2 0.855 104.2 62.6 -79.0 -34.8 11.4 18.8 7.8 93 112 A A H 3< S+ 0 0 69 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.742 106.6 46.4 -65.9 -23.0 9.5 18.1 4.6 94 113 A V H 3< S+ 0 0 126 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.624 87.5 102.5 -93.9 -12.9 7.0 20.9 5.4 95 114 A H X< - 0 0 53 -3,-0.8 3,-1.4 -4,-0.6 -3,-0.0 -0.541 65.7-145.3 -74.8 132.5 9.5 23.5 6.4 96 115 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.740 99.2 54.4 -65.5 -24.2 10.2 26.2 3.6 97 116 A D T 3 S+ 0 0 60 -19,-0.1 -17,-2.3 -18,-0.0 2,-0.4 0.107 98.6 76.0 -98.0 18.1 13.9 26.4 4.7 98 117 A A E < -c 80 0A 12 -3,-1.4 2,-0.4 -19,-0.2 -17,-0.2 -0.969 62.8-158.1-122.5 146.8 14.5 22.7 4.3 99 118 A Y E -c 81 0A 42 -19,-2.8 -17,-3.0 -2,-0.4 2,-0.5 -0.991 8.6-173.2-125.3 129.2 15.0 20.7 1.1 100 119 A I E +c 82 0A 59 -2,-0.4 -17,-0.1 -19,-0.2 -19,-0.0 -0.971 9.0 169.0-129.6 119.9 14.4 17.0 0.9 101 120 A R E -c 83 0A 73 -19,-1.6 -17,-0.9 -2,-0.5 2,-0.1 -0.996 27.8-134.1-123.9 124.5 15.1 14.7 -2.1 102 121 A P - 0 0 95 0, 0.0 -2,-0.0 0, 0.0 -20,-0.0 -0.379 48.7 -72.2 -66.7 165.9 15.0 10.9 -2.0 103 122 A S - 0 0 35 1,-0.1 -18,-0.1 -20,-0.1 3,-0.1 -0.251 57.2-110.9 -59.5 135.5 17.9 9.0 -3.6 104 123 A P - 0 0 23 0, 0.0 -18,-0.2 0, 0.0 -1,-0.1 -0.327 41.6 -84.8 -69.8 151.3 17.8 9.1 -7.4 105 124 A T - 0 0 103 1,-0.1 2,-0.7 6,-0.1 3,-0.2 -0.383 58.2-107.7 -62.9 136.2 17.0 6.0 -9.3 106 125 A S + 0 0 75 1,-0.2 3,-0.2 -3,-0.1 -1,-0.1 -0.528 45.9 166.9 -82.6 109.9 20.2 4.2 -9.7 107 126 A G S S- 0 0 76 -2,-0.7 2,-0.3 1,-0.5 -1,-0.2 0.959 90.5 -46.6 -64.6 -47.2 22.0 4.0 -12.9 108 127 A T > - 0 0 44 -3,-0.2 4,-2.3 1,-0.1 -1,-0.5 -0.889 63.2 -85.3-164.1 176.9 24.6 2.8 -10.5 109 128 A L H > S+ 0 0 57 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.932 134.3 53.5 -61.9 -38.9 26.0 3.8 -7.2 110 129 A G H > S+ 0 0 29 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.848 107.4 48.4 -61.8 -40.1 28.2 6.0 -9.4 111 130 A G H > S+ 0 0 35 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.868 112.3 48.0 -66.2 -42.2 25.2 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4,-2.0 -3,-0.3 -1,-0.2 0.886 110.9 49.1 -66.3 -39.7 34.4 8.6 -13.3 263 282 A V H X S+ 0 0 68 -4,-1.6 4,-2.3 2,-0.2 5,-0.2 0.942 112.8 48.1 -61.5 -49.2 37.2 7.7 -15.7 264 283 A R H X S+ 0 0 135 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.905 111.2 49.6 -59.3 -43.3 37.7 4.4 -13.9 265 284 A D H X S+ 0 0 71 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.893 111.8 48.5 -64.4 -42.1 33.9 3.6 -14.0 266 285 A A H X S+ 0 0 67 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.958 115.0 43.8 -63.4 -51.5 33.6 4.3 -17.7 267 286 A V H X S+ 0 0 97 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.930 117.8 44.8 -62.1 -42.0 36.7 2.2 -18.6 268 287 A L H X S+ 0 0 91 -4,-2.8 4,-2.5 -5,-0.2 3,-0.4 0.858 106.5 59.7 -73.6 -33.9 35.6 -0.7 -16.4 269 288 A D H X S+ 0 0 77 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.844 95.4 62.8 -59.6 -36.8 32.0 -0.7 -17.5 270 289 A R H < S+ 0 0 68 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.880 113.5 35.9 -57.4 -38.8 33.0 -1.3 -21.1 271 290 A V H >< S+ 0 0 37 -4,-0.8 3,-0.8 -3,-0.4 -2,-0.2 0.940 119.5 46.0 -78.3 -47.5 34.4 -4.6 -19.9 272 291 A M H 3< S+ 0 0 84 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.732 117.7 41.7 -72.5 -30.0 31.9 -5.6 -17.2 273 292 A N T 3< S+ 0 0 96 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.362 82.1 125.0 -96.5 -1.2 28.8 -4.9 -19.2 274 293 A H <> - 0 0 58 -3,-0.8 4,-2.8 -5,-0.2 3,-0.3 -0.456 64.1-135.8 -60.9 126.8 30.2 -6.4 -22.4 275 294 A P H > S+ 0 0 93 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.837 103.5 50.5 -58.5 -33.3 27.5 -9.0 -23.4 276 295 A E H > S+ 0 0 72 2,-0.2 4,-1.9 29,-0.2 5,-0.2 0.887 110.7 48.0 -72.1 -38.2 30.2 -11.5 -24.2 277 296 A V H > S+ 0 0 4 -3,-0.3 4,-2.0 -6,-0.2 -1,-0.2 0.932 111.9 50.7 -61.2 -46.9 31.9 -11.0 -20.8 278 297 A R H < S+ 0 0 156 -4,-2.8 4,-0.5 1,-0.2 -2,-0.2 0.857 109.8 52.4 -61.2 -33.4 28.5 -11.3 -19.1 279 298 A R H < S+ 0 0 170 -4,-1.6 4,-0.3 -5,-0.2 -1,-0.2 0.873 121.0 28.0 -70.3 -43.5 27.8 -14.6 -21.0 280 299 A I H X S+ 0 0 25 -4,-1.9 4,-2.7 1,-0.1 3,-0.3 0.610 94.4 91.8 -94.5 -10.7 31.1 -16.4 -20.1 281 300 A R H X S+ 0 0 103 -4,-2.0 4,-2.8 1,-0.3 5,-0.2 0.885 85.5 50.7 -63.7 -39.2 32.0 -14.9 -16.7 282 301 A D H > S+ 0 0 107 -4,-0.5 4,-2.1 1,-0.2 -1,-0.3 0.922 114.0 44.2 -60.2 -44.8 30.2 -17.4 -14.6 283 302 A D H > S+ 0 0 91 -4,-0.3 4,-2.2 -3,-0.3 -1,-0.2 0.851 112.0 53.4 -68.7 -37.6 31.8 -20.4 -16.4 284 303 A V H X S+ 0 0 1 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.948 109.9 47.4 -58.8 -49.4 35.2 -18.7 -16.3 285 304 A E H X S+ 0 0 62 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.896 111.6 51.2 -63.8 -39.3 35.0 -18.1 -12.5 286 305 A Q H X S+ 0 0 81 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.906 107.1 53.1 -59.1 -46.9 33.9 -21.8 -12.0 287 306 A R H <>S+ 0 0 54 -4,-2.2 5,-2.5 1,-0.2 6,-1.2 0.870 110.3 47.8 -64.5 -33.7 36.8 -23.0 -14.1 288 307 A V H ><5S+ 0 0 52 -4,-1.9 3,-1.2 4,-0.2 -1,-0.2 0.933 111.3 50.5 -64.1 -48.1 39.2 -21.0 -11.8 289 308 A R H 3<5S+ 0 0 160 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.883 113.2 46.7 -56.9 -40.5 37.5 -22.4 -8.7 290 309 A L T 3<5S- 0 0 114 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.444 113.5-117.8 -81.9 -4.2 37.9 -26.0 -10.0 291 310 A G T < 5S+ 0 0 63 -3,-1.2 -3,-0.2 -4,-0.3 -4,-0.1 0.705 82.5 120.3 71.0 19.8 41.5 -25.4 -11.0 292 311 A E S - 0 0 76 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.540 31.6-111.2 -76.6 160.4 44.6 -20.5 -13.8 295 314 A P H > S+ 0 0 95 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.860 117.6 52.8 -57.9 -37.6 43.7 -16.9 -12.9 296 315 A A H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.929 111.4 45.9 -69.0 -40.1 46.0 -15.3 -15.5 297 316 A L H > S+ 0 0 104 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.864 113.0 51.2 -66.0 -33.3 44.5 -17.5 -18.2 298 317 A A H X S+ 0 0 5 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.929 108.6 49.9 -73.0 -41.7 41.0 -16.6 -16.9 299 318 A A H X S+ 0 0 50 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.925 111.0 50.7 -59.6 -43.2 41.8 -12.9 -16.9 300 319 A Q H X S+ 0 0 98 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.894 108.3 52.3 -63.8 -35.8 43.1 -13.2 -20.6 301 320 A E H X S+ 0 0 60 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.885 110.5 47.8 -66.3 -38.8 39.9 -15.0 -21.6 302 321 A I H X S+ 0 0 41 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.929 112.6 47.9 -68.7 -43.2 37.8 -12.2 -20.1 303 322 A L H < S+ 0 0 95 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.906 112.2 50.8 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