==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 09-SEP-11 3TQL . COMPND 2 MOLECULE: ARGININE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: COXIELLA BURNETII; . AUTHOR M.RUDOLPH,J.CHEUNG,M.FRANKLIN,M.CASSIDY,E.GARY,F.BURSHTEYN,J . 226 3 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11175.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 0 0 0 0 1 1 3 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 0 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 . 3 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 2 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 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 40 A T 0 0 76 0, 0.0 2,-2.0 0, 0.0 40,-0.1 0.000 360.0 360.0 360.0 63.5 23.5 74.4 37.8 2 41 A D + 0 0 122 36,-0.3 39,-4.7 37,-0.1 2,-0.5 -0.004 360.0 36.2 22.1 -60.9 21.5 71.9 39.9 3 42 A T E +a 41 0A 97 -2,-2.0 2,-0.4 37,-0.2 39,-0.2 -0.937 66.2 167.9-120.0 121.3 18.4 71.7 37.5 4 43 A I E -a 42 0A 3 37,-2.4 39,-1.1 -2,-0.5 2,-0.6 -0.982 20.9-151.5-132.7 122.6 18.8 71.8 33.7 5 44 A K E -a 43 0A 76 -2,-0.4 57,-2.4 37,-0.2 58,-1.7 -0.837 15.8-169.8 -95.7 119.2 16.1 70.9 31.1 6 45 A F E -ab 44 63A 0 37,-2.7 39,-2.8 -2,-0.6 2,-0.3 -0.808 1.8-169.4-102.5 150.0 17.4 69.6 27.8 7 46 A A E +ab 45 64A 0 56,-1.9 58,-1.6 -2,-0.3 2,-0.3 -0.982 14.5 150.2-136.4 154.6 15.3 69.1 24.7 8 47 A T E -a 46 0A 0 37,-2.3 39,-2.8 -2,-0.3 2,-0.5 -0.913 47.5-106.9-155.4 176.3 15.8 67.4 21.3 9 48 A E - 0 0 48 56,-0.3 2,-2.1 -2,-0.3 3,-0.1 -0.984 33.8-141.7-111.5 117.8 13.8 65.7 18.6 10 49 A A S S+ 0 0 5 -2,-0.5 8,-0.4 1,-0.2 7,-0.1 -0.416 72.3 97.9 -84.3 70.6 14.7 62.0 19.0 11 50 A T + 0 0 52 -2,-2.1 164,-0.5 6,-0.2 6,-0.2 -0.079 54.9 85.7-148.4 32.4 14.9 61.1 15.3 12 51 A Y B >> S-E 16 0B 0 4,-2.2 4,-2.0 -3,-0.1 3,-1.0 -0.492 71.4-135.6-145.7 67.6 18.5 61.2 14.2 13 52 A P T 34 S+ 0 0 52 0, 0.0 164,-2.7 0, 0.0 4,-0.1 -0.373 80.0 20.6 -64.0 147.0 20.5 58.1 14.8 14 53 A P T 34 S+ 0 0 34 0, 0.0 12,-2.2 0, 0.0 13,-0.2 -0.993 128.9 47.2 -91.0 -0.4 23.2 57.6 16.0 15 54 A Y T <4 S- 0 0 0 -3,-1.0 12,-2.6 1,-0.3 13,-0.8 0.945 130.1 -10.0 -67.1 -52.0 23.2 61.0 17.7 16 55 A V B < S+E 12 0B 0 -4,-2.0 -4,-2.2 50,-0.2 2,-0.3 -0.990 75.1 139.9-146.8 148.1 19.7 60.7 19.2 17 56 A Y E -F 24 0C 65 7,-2.3 7,-3.2 -2,-0.3 2,-0.6 -0.968 52.6 -77.3-168.3 175.8 16.8 58.3 18.8 18 57 A X E F 23 0C 85 -8,-0.4 5,-0.2 -2,-0.3 -2,-0.0 -0.803 360.0 360.0 -90.3 122.5 14.1 56.4 20.5 19 58 A G 0 0 62 3,-2.6 3,-0.3 -2,-0.6 -1,-0.1 -0.381 360.0 360.0 -63.1 360.0 15.3 53.3 22.3 20 ! 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 21 61 A G 0 0 104 0, 0.0 2,-0.4 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 43.3 10.1 55.1 25.5 22 62 A Q - 0 0 130 -3,-0.3 -3,-2.6 0, 0.0 2,-0.4 -0.880 360.0-112.5-115.9 142.3 13.4 56.8 26.4 23 63 A V E +F 18 0C 18 -2,-0.4 2,-0.2 21,-0.2 -5,-0.2 -0.582 47.4 173.0 -69.5 125.8 15.6 59.1 24.4 24 64 A E E +F 17 0C 77 -7,-3.2 -7,-2.3 -2,-0.4 2,-0.2 -0.748 15.9 83.5-127.2 172.4 18.9 57.2 23.7 25 65 A G S > S- 0 0 0 -2,-0.2 4,-2.2 -9,-0.2 -10,-0.2 -0.518 83.5 -53.2 123.6 175.7 22.0 57.8 21.6 26 66 A F H > S+ 0 0 0 -12,-2.2 4,-2.3 1,-0.2 -11,-0.2 0.910 131.6 44.8 -54.0 -50.2 25.4 59.4 21.6 27 67 A G H > S+ 0 0 0 -12,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.865 109.7 55.6 -67.0 -35.9 24.1 62.9 22.4 28 68 A A H > S+ 0 0 0 -13,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.901 110.5 46.1 -63.4 -37.7 21.8 61.5 25.2 29 69 A D H X S+ 0 0 26 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.886 110.7 52.0 -72.8 -38.6 24.8 59.9 26.8 30 70 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.942 110.8 49.0 -58.1 -50.0 27.0 63.0 26.5 31 71 A V H X S+ 0 0 1 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.938 112.2 47.3 -56.4 -46.7 24.2 65.1 28.1 32 72 A K H X S+ 0 0 108 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.914 112.9 50.4 -64.0 -37.6 23.9 62.5 31.0 33 73 A A H X S+ 0 0 12 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.904 111.1 46.3 -67.4 -42.1 27.6 62.5 31.4 34 74 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 6,-0.2 0.926 111.6 52.9 -67.6 -40.0 28.0 66.3 31.6 35 75 A a H <>S+ 0 0 6 -4,-2.5 5,-2.8 -5,-0.2 4,-0.5 0.905 109.7 48.3 -61.1 -40.6 25.1 66.5 34.0 36 76 A K H ><5S+ 0 0 167 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.929 110.9 51.0 -63.8 -44.1 26.8 64.0 36.2 37 77 A Q H 3<5S+ 0 0 79 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.870 113.8 44.7 -59.0 -36.9 30.0 66.0 36.0 38 78 A X T 3<5S- 0 0 32 -4,-2.3 -36,-0.3 -5,-0.1 -1,-0.2 0.433 108.3-122.4 -86.6 -2.2 28.1 69.2 37.0 39 79 A Q T < 5 + 0 0 153 -3,-1.1 2,-0.3 -4,-0.5 -3,-0.2 0.859 65.2 147.0 55.8 37.3 26.2 67.5 39.8 40 80 A A < - 0 0 17 -5,-2.8 2,-0.5 -6,-0.2 -37,-0.2 -0.700 50.6-132.4-100.3 152.8 23.1 68.7 37.9 41 81 A V E +a 3 0A 90 -39,-4.7 -37,-2.4 -2,-0.3 2,-0.3 -0.922 38.5 176.4-101.1 133.0 19.7 67.0 37.7 42 82 A a E -a 4 0A 36 -2,-0.5 2,-0.3 -39,-0.2 -37,-0.2 -0.893 24.2-163.3-136.6 156.6 18.5 66.9 34.1 43 83 A T E -a 5 0A 81 -39,-1.1 -37,-2.7 -2,-0.3 2,-0.5 -0.959 16.0-140.7-133.3 156.2 15.8 65.6 31.9 44 84 A I E -a 6 0A 38 -2,-0.3 2,-0.4 -39,-0.2 -21,-0.2 -0.977 19.2-161.3-116.9 115.8 15.7 65.2 28.1 45 85 A S E -a 7 0A 35 -39,-2.8 -37,-2.3 -2,-0.5 2,-0.6 -0.792 11.8-138.4 -98.6 140.1 12.4 66.1 26.5 46 86 A N E +a 8 0A 71 -2,-0.4 -37,-0.2 -39,-0.2 -39,-0.0 -0.872 37.4 156.0 -99.0 120.0 11.4 64.9 23.0 47 87 A Q - 0 0 55 -39,-2.8 5,-0.1 -2,-0.6 -40,-0.0 -0.963 49.9 -73.9-142.6 156.4 9.7 67.7 21.0 48 88 A P >> - 0 0 79 0, 0.0 3,-1.9 0, 0.0 4,-0.6 -0.248 43.8-124.0 -53.1 134.1 9.1 68.6 17.3 49 89 A W H >> S+ 0 0 41 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.857 109.0 53.3 -46.4 -48.8 12.3 69.9 15.7 50 90 A D H 34 S+ 0 0 100 1,-0.3 -1,-0.3 2,-0.1 0, 0.0 0.632 106.3 54.1 -68.8 -13.2 10.7 73.2 14.6 51 91 A S H <> S+ 0 0 32 -3,-1.9 4,-2.3 2,-0.1 -1,-0.3 0.586 88.7 82.3 -92.1 -11.9 9.5 74.0 18.1 52 92 A L H S+ 0 0 69 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.925 112.3 48.2 -56.7 -41.5 11.4 78.9 19.9 55 95 A S H X>S+ 0 0 17 -4,-2.3 5,-2.2 2,-0.2 6,-0.9 0.848 110.4 50.7 -67.8 -35.0 11.0 76.9 23.2 56 96 A L H ><5S+ 0 0 2 -4,-2.3 3,-0.6 3,-0.2 -1,-0.2 0.924 111.5 48.4 -65.1 -44.4 14.6 77.6 24.2 57 97 A K H 3<5S+ 0 0 79 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.869 110.1 51.0 -63.7 -37.5 14.1 81.3 23.5 58 98 A L H 3<5S- 0 0 155 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.629 117.0-117.3 -75.0 -14.0 10.9 81.4 25.6 59 99 A G T <<5S+ 0 0 50 -4,-0.7 -3,-0.2 -3,-0.6 -2,-0.1 0.627 77.6 127.8 88.4 15.6 12.8 79.7 28.4 60 100 A K S - 0 0 49 -2,-0.5 4,-2.1 117,-0.1 5,-0.2 -0.940 47.0-115.0-135.4 155.9 26.6 76.9 11.7 72 112 A T T 4 S+ 0 0 81 -2,-0.3 4,-0.5 1,-0.2 -1,-0.1 0.885 116.9 52.3 -57.9 -38.4 27.1 80.6 11.4 73 113 A A T >4 S+ 0 0 66 1,-0.2 3,-1.0 2,-0.2 4,-0.3 0.911 110.2 46.0 -65.3 -44.7 23.4 81.1 10.8 74 114 A R G >> S+ 0 0 44 1,-0.2 4,-2.0 2,-0.2 3,-1.9 0.846 102.2 65.9 -67.2 -31.2 22.4 79.2 13.9 75 115 A Q G 3< S+ 0 0 73 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.656 94.5 61.0 -67.8 -14.5 25.0 81.1 15.9 76 116 A K G <4 S+ 0 0 135 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.686 112.0 36.3 -78.6 -19.3 23.0 84.2 15.3 77 117 A E T <4 S+ 0 0 92 -3,-1.9 119,-0.6 -4,-0.3 2,-0.3 0.719 128.2 8.2-104.7 -31.6 19.9 82.7 17.1 78 118 A V E < S-D 195 0A 0 -4,-2.0 2,-0.4 117,-0.2 -1,-0.2 -0.908 72.2-109.0-142.8 168.7 21.5 80.8 19.9 79 119 A D E -D 194 0A 34 115,-2.4 115,-2.9 -2,-0.3 2,-0.3 -0.891 31.5-151.9-105.5 138.2 24.9 80.2 21.6 80 120 A F E -D 193 0A 21 -2,-0.4 113,-0.2 113,-0.2 110,-0.0 -0.822 10.3-125.6-106.6 149.6 26.7 76.9 21.2 81 121 A T - 0 0 4 111,-2.4 3,-0.1 -2,-0.3 122,-0.1 -0.248 53.2 -70.8 -69.0 169.2 29.1 75.1 23.5 82 122 A D S S- 0 0 89 1,-0.1 110,-0.4 109,-0.1 -1,-0.2 -0.355 71.9 -91.0 -47.4 144.4 32.5 73.9 22.2 83 123 A P - 0 0 55 0, 0.0 108,-0.2 0, 0.0 -1,-0.1 -0.386 34.2-165.4 -66.2 146.9 31.7 71.1 19.8 84 124 A Y S S+ 0 0 1 106,-2.1 2,-0.3 1,-0.2 107,-0.1 0.344 72.2 8.7-115.9 3.7 31.7 67.6 21.3 85 125 A Y B S-H 190 0D 39 105,-0.8 105,-2.2 3,-0.0 -1,-0.2 -0.959 91.3 -77.7-165.3 170.6 31.8 65.6 18.1 86 126 A T - 0 0 27 -2,-0.3 102,-0.1 103,-0.3 95,-0.1 -0.280 59.1 -86.7 -71.6 160.7 32.3 66.3 14.4 87 127 A N - 0 0 18 93,-0.2 93,-2.6 102,-0.2 2,-0.4 -0.226 42.6-124.8 -64.1 159.1 29.6 67.7 12.2 88 128 A S E -I 179 0E 5 91,-0.2 2,-0.6 -21,-0.2 -19,-0.1 -0.856 5.3-147.9-111.0 138.3 27.0 65.3 10.6 89 129 A V E -I 178 0E 17 89,-2.8 89,-1.5 -2,-0.4 2,-0.3 -0.941 30.5-135.8 -97.4 123.1 26.1 65.0 6.9 90 130 A S E -I 177 0E 5 -2,-0.6 66,-0.6 66,-0.3 2,-0.4 -0.652 14.1-159.1 -87.4 135.8 22.4 64.0 6.9 91 131 A F E -IJ 176 155E 0 85,-2.9 85,-2.2 -2,-0.3 2,-0.5 -0.932 11.2-145.8-105.7 137.5 21.0 61.3 4.7 92 132 A I E +IJ 175 154E 1 62,-3.0 62,-2.0 -2,-0.4 2,-0.3 -0.899 33.7 149.9-105.8 128.1 17.2 61.4 4.0 93 133 A A E -IJ 174 153E 3 81,-2.4 81,-2.8 -2,-0.5 60,-0.1 -0.937 52.3 -72.9-150.9 165.6 15.5 58.0 3.7 94 134 A D E > -I 173 0E 46 58,-0.5 3,-1.2 -2,-0.3 79,-0.2 -0.439 39.8-135.3 -63.5 136.0 12.2 56.2 4.2 95 135 A K T 3 S+ 0 0 132 77,-2.8 -1,-0.1 1,-0.2 78,-0.1 0.699 95.3 75.6 -69.0 -17.0 11.6 55.6 7.9 96 136 A N T 3 S+ 0 0 112 76,-0.3 -1,-0.2 1,-0.2 77,-0.1 0.721 97.7 44.9 -71.8 -16.6 10.6 52.0 7.3 97 137 A T S < S- 0 0 71 -3,-1.2 -1,-0.2 2,-0.0 -3,-0.0 -0.911 76.7-144.8-132.3 105.6 14.2 50.9 6.7 98 138 A P - 0 0 118 0, 0.0 2,-0.4 0, 0.0 -3,-0.0 -0.390 19.9-151.4 -62.3 148.3 17.1 51.9 8.9 99 139 A L - 0 0 21 -6,-0.0 2,-0.7 2,-0.0 7,-0.1 -0.971 13.2-139.5-121.8 141.5 20.3 52.4 7.1 100 140 A T - 0 0 97 -2,-0.4 2,-1.9 5,-0.4 76,-0.0 -0.885 21.9-142.8 -92.8 117.0 23.9 52.0 8.2 101 141 A L + 0 0 17 -2,-0.7 2,-0.3 76,-0.2 -1,-0.0 -0.395 61.5 101.0 -84.9 65.9 25.8 54.8 6.6 102 142 A S S > S- 0 0 48 -2,-1.9 4,-2.2 1,-0.1 5,-0.1 -0.853 88.3 -95.9-136.1 170.5 29.1 53.1 5.8 103 143 A K T 4 S+ 0 0 96 -2,-0.3 -1,-0.1 1,-0.2 24,-0.0 0.888 128.2 39.3 -57.2 -39.7 30.7 51.6 2.7 104 144 A Q T >4 S+ 0 0 143 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.905 114.1 53.0 -75.9 -41.3 29.4 48.2 3.8 105 145 A G T 34 S+ 0 0 27 1,-0.3 -5,-0.4 -6,-0.1 -2,-0.2 0.775 112.9 43.9 -65.6 -27.6 26.0 49.4 5.1 106 146 A L T >< S+ 0 0 0 -4,-2.2 3,-2.6 -7,-0.1 -1,-0.3 0.262 80.1 140.7-103.5 11.8 25.2 51.2 1.8 107 147 A K T < S+ 0 0 138 -3,-1.2 24,-0.1 1,-0.3 3,-0.1 -0.336 77.7 9.5 -54.8 125.8 26.4 48.3 -0.4 108 148 A G T 3 S+ 0 0 70 22,-0.8 -1,-0.3 1,-0.3 2,-0.3 0.541 103.1 127.1 78.6 7.7 24.0 48.0 -3.3 109 149 A K < - 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0 0 62 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 -0.492 53.9-153.2 -68.1 116.6 20.7 70.9 2.3 158 198 A T H > S+ 0 0 13 -2,-0.4 4,-3.1 1,-0.2 5,-0.3 0.891 88.4 51.5 -67.4 -41.5 18.6 69.8 5.2 159 199 A P H > S+ 0 0 81 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.923 114.8 44.9 -63.2 -37.2 16.5 72.9 5.8 160 200 A L H > S+ 0 0 92 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.899 114.5 49.0 -68.0 -42.0 15.6 72.9 2.1 161 201 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.956 111.8 47.9 -58.9 -52.4 14.9 69.2 2.1 162 202 A K H X S+ 0 0 47 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.870 110.9 52.2 -58.9 -37.8 12.7 69.4 5.2 163 203 A Q H X S+ 0 0 103 -4,-1.8 4,-2.9 -5,-0.3 -1,-0.2 0.933 110.1 48.0 -65.3 -44.7 10.9 72.3 3.7 164 204 A W H X S+ 0 0 24 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.928 111.9 49.3 -61.1 -46.8 10.2 70.4 0.5 165 205 A L H <>S+ 0 0 10 -4,-2.8 5,-2.8 1,-0.2 -1,-0.2 0.888 114.1 45.9 -63.1 -37.5 9.0 67.3 2.5 166 206 A K H ><5S+ 0 0 138 -4,-2.3 3,-1.8 -5,-0.2 -2,-0.2 0.953 111.2 50.5 -69.6 -49.9 6.7 69.4 4.6 167 207 A Q H 3<5S+ 0 0 128 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.832 115.3 45.5 -53.4 -35.1 5.2 71.5 1.7 168 208 A N T 3<5S- 0 0 85 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.259 112.9-117.7-101.3 13.6 4.5 68.2 -0.1 169 209 A G T < 5 + 0 0 58 -3,-1.8 2,-0.6 1,-0.2 -3,-0.2 0.886 61.2 144.9 57.2 47.6 3.0 66.4 2.9 170 210 A R < + 0 0 70 -5,-2.8 3,-0.2 1,-0.1 -1,-0.2 -0.939 11.7 158.7-117.3 107.0 5.5 63.6 3.2 171 211 A R + 0 0 231 -2,-0.6 -1,-0.1 1,-0.1 -5,-0.1 0.455 60.6 86.2 -96.6 -6.2 6.1 62.5 6.8 172 212 A E S S+ 0 0 80 -3,-0.1 -77,-2.8 -7,-0.1 2,-0.4 0.650 74.7 78.9 -70.5 -14.9 7.4 59.1 5.8 173 213 A Y E +I 94 0E 22 -79,-0.2 2,-0.2 -3,-0.2 -79,-0.2 -0.813 58.1 175.3-109.4 134.1 11.0 60.4 5.2 174 214 A V E -I 93 0E 43 -81,-2.8 -81,-2.4 -2,-0.4 2,-0.3 -0.775 26.8-102.5-132.0 172.5 13.5 60.9 8.1 175 215 A L E -I 92 0E 14 -164,-0.5 2,-0.4 -2,-0.2 -83,-0.2 -0.751 20.1-168.9-104.0 144.9 17.1 61.8 8.7 176 216 A I E -I 91 0E 15 -85,-2.2 -85,-2.9 -2,-0.3 2,-0.4 -0.994 22.8-131.4-127.5 135.2 20.1 59.7 9.6 177 217 A G E -I 90 0E 4 -164,-2.7 -76,-0.2 -2,-0.4 -87,-0.2 -0.717 16.2-168.6 -94.3 138.3 23.3 61.3 10.6 178 218 A K E -I 89 0E 29 -89,-1.5 -89,-2.8 -2,-0.4 2,-0.1 -0.966 23.1-132.3-121.1 111.4 26.8 60.5 9.3 179 219 A P E -I 88 0E 13 0, 0.0 2,-0.8 0, 0.0 -91,-0.2 -0.379 21.5-124.7 -59.2 137.2 29.7 62.0 11.2 180 220 A V + 0 0 0 -93,-2.6 -93,-0.2 1,-0.2 7,-0.1 -0.785 37.0 167.4 -88.8 110.2 32.2 63.6 8.9 181 221 A N + 0 0 111 -2,-0.8 -1,-0.2 -95,-0.1 5,-0.1 0.515 50.1 95.4 -99.2 -9.1 35.6 62.0 9.6 182 222 A D > - 0 0 40 1,-0.1 3,-2.7 3,-0.1 4,-0.2 -0.764 68.3-148.4 -87.2 112.6 37.4 63.5 6.5 183 223 A P G > S+ 0 0 87 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.705 93.4 70.3 -56.7 -20.9 39.1 66.7 7.5 184 224 A N G 3 S+ 0 0 138 1,-0.2 -62,-0.0 -62,-0.0 -2,-0.0 0.661 107.5 36.9 -68.6 -15.2 38.5 68.1 4.0 185 225 A Y G < S+ 0 0 45 -3,-2.7 -1,-0.2 -63,-0.0 2,-0.1 0.205 85.7 136.7-122.4 12.8 34.8 68.4 4.9 186 226 A F < - 0 0 111 -3,-0.9 2,-0.2 -4,-0.2 -5,-0.1 -0.371 26.9-179.2 -61.0 134.4 35.1 69.4 8.6 187 227 A G - 0 0 46 -7,-0.1 -100,-0.2 -2,-0.1 3,-0.1 -0.335 53.6 -68.6-111.0-156.6 32.7 72.0 9.8 188 228 A K S S- 0 0 103 -118,-0.6 2,-0.2 1,-0.2 -117,-0.1 0.762 76.9-126.8 -71.0 -23.7 32.4 73.5 13.3 189 229 A G - 0 0 3 -119,-0.3 -119,-3.1 -106,-0.1 2,-0.3 -0.491 32.7 -53.6 109.7-179.2 31.0 70.3 14.8 190 230 A V B +GH 69 85D 0 -105,-2.2 -106,-2.1 -121,-0.2 -105,-0.8 -0.765 61.1 170.6 -95.2 148.2 27.9 69.4 16.8 191 231 A G - 0 0 0 -123,-1.8 2,-0.5 -2,-0.3 -123,-0.3 -0.890 37.7 -97.2-145.7 173.3 27.2 71.3 20.0 192 232 A I - 0 0 0 -110,-0.4 -111,-2.4 -2,-0.3 2,-0.4 -0.853 39.8-143.2 -94.5 133.4 24.7 72.0 22.7 193 233 A A E +CD 64 80A 0 -129,-2.5 -129,-2.6 -2,-0.5 2,-0.3 -0.809 19.8 178.8-100.6 139.6 22.7 75.2 22.2 194 234 A V E -CD 63 79A 0 -115,-2.9 -115,-2.4 -2,-0.4 -131,-0.2 -0.854 45.3 -71.9-127.8 166.7 21.6 77.6 25.0 195 235 A K E > - D 0 78A 95 -133,-0.5 3,-2.6 -2,-0.3 -117,-0.2 -0.332 64.5 -93.4 -59.6 136.9 19.7 80.8 24.9 196 236 A K T 3 S+ 0 0 112 -119,-0.6 -1,-0.1 1,-0.3 3,-0.1 -0.279 113.6 21.1 -56.7 129.5 21.8 83.6 23.4 197 237 A G T 3 S+ 0 0 54 1,-0.1 2,-2.5 -3,-0.1 -1,-0.3 0.293 80.8 129.5 93.2 -9.2 23.5 85.5 26.2 198 238 A N <> + 0 0 51 -3,-2.6 4,-1.9 1,-0.2 5,-0.1 -0.422 23.9 157.9 -75.8 69.2 23.2 82.7 28.7 199 239 A Q H > + 0 0 155 -2,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.820 62.5 59.0 -68.5 -31.4 27.0 82.9 29.5 200 240 A A H > S+ 0 0 59 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.939 111.1 39.2 -65.2 -48.3 26.7 81.3 32.9 201 241 A L H > S+ 0 0 10 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.894 113.6 56.7 -69.1 -38.2 25.3 78.0 31.7 202 242 A L H X S+ 0 0 28 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.940 108.1 46.7 -59.3 -46.1 27.5 78.0 28.6 203 243 A L H X S+ 0 0 105 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.921 112.5 50.3 -64.2 -41.8 30.7 78.2 30.7 204 244 A K H X S+ 0 0 81 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.913 112.2 47.2 -62.8 -42.8 29.5 75.4 33.0 205 245 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.908 111.9 49.9 -64.8 -44.1 28.7 73.2 30.1 206 246 A N H X S+ 0 0 31 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.902 111.4 48.1 -62.1 -43.5 32.0 73.9 28.4 207 247 A K H X S+ 0 0 132 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.899 112.6 50.0 -62.7 -38.7 33.9 73.1 31.6 208 248 A A H X S+ 0 0 5 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.896 109.9 49.8 -68.1 -40.4 31.9 69.9 32.0 209 249 A L H X S+ 0 0 2 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.909 111.2 49.6 -62.5 -43.0 32.5 68.8 28.4 210 250 A A H X S+ 0 0 55 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.888 109.4 53.1 -63.1 -38.5 36.2 69.4 28.9 211 251 A A H X S+ 0 0 30 -4,-1.9 4,-1.6 2,-0.2 6,-0.2 0.874 106.9 49.1 -68.2 -38.0 36.2 67.4 32.1 212 252 A I H < S+ 0 0 0 -4,-2.0 6,-2.8 1,-0.2 4,-0.5 0.807 110.9 52.4 -73.7 -26.1 34.6 64.3 30.6 213 253 A K H >< S+ 0 0 92 -4,-1.6 3,-0.5 -5,-0.2 -2,-0.2 0.900 111.2 47.9 -67.6 -39.3 37.2 64.5 27.8 214 254 A A H 3< S+ 0 0 89 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.764 112.8 45.8 -73.2 -28.6 39.9 64.6 30.4 215 255 A N T 3< S- 0 0 82 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.372 111.3-107.8-102.2 6.4 38.7 61.7 32.6 216 256 A G S <> S+ 0 0 39 -3,-0.5 4,-1.7 -4,-0.5 5,-0.2 0.276 91.3 110.0 91.6 -12.7 38.0 59.1 30.0 217 257 A V H > S+ 0 0 58 -5,-0.4 4,-1.6 -6,-0.2 -4,-0.2 0.917 80.4 48.5 -61.6 -44.7 34.2 59.3 30.3 218 258 A Y H > S+ 0 0 44 -6,-2.8 4,-2.7 1,-0.2 3,-0.2 0.941 108.5 52.9 -60.9 -49.0 33.9 61.0 26.9 219 259 A A H > S+ 0 0 59 -7,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.861 107.6 52.0 -57.7 -37.4 36.1 58.4 25.1 220 260 A A H X S+ 0 0 64 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.864 109.4 49.4 -69.2 -35.9 34.0 55.5 26.5 221 261 A I H X S+ 0 0 14 -4,-1.6 4,-1.2 -3,-0.2 3,-0.3 0.935 111.1 49.2 -67.6 -45.1 30.8 57.1 25.1 222 262 A V H X S+ 0 0 27 -4,-2.7 4,-2.9 1,-0.2 3,-0.4 0.909 109.1 53.4 -56.4 -42.5 32.4 57.7 21.7 223 263 A Q H < S+ 0 0 140 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.801 101.9 59.9 -66.5 -28.8 33.6 54.0 21.7 224 264 A K H < S+ 0 0 131 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.905 122.0 20.0 -62.8 -42.5 30.1 52.8 22.4 225 265 A Y H < 0 0 54 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.705 360.0 360.0-102.3 -26.7 28.6 54.4 19.2 226 266 A F < 0 0 89 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.073 360.0 360.0-126.5 360.0 31.6 54.9 16.9 227 ! 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 0.0 228 1 A R 0 0 9 0, 0.0 -159,-2.4 0, 0.0 -140,-0.2 0.000 360.0 360.0 360.0 360.0 21.3 68.1 10.9