==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 09-JAN-09 3FSI . COMPND 2 MOLECULE: REVERSE TRANSCRIPTASE DOMAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MOLONEY MURINE LEUKEMIA VIRUS; . AUTHOR L.S.GLASS,M.M.GEORGIADIS,K.D.GOODWIN . 248 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12698.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 16.1 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 0.4 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 . 18 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 3 1 1 0 0 0 0 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 0 PARALLEL BRIDGES PER LADDER . 5 2 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 3 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 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 24 A T > 0 0 123 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 112.1 -3.3 60.0 0.4 2 25 A W H > + 0 0 69 1,-0.2 4,-0.7 2,-0.2 225,-0.0 0.837 360.0 52.5 -56.2 -37.7 0.2 59.0 -0.6 3 26 A L H 4 S+ 0 0 72 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.896 110.2 47.0 -69.5 -38.9 0.8 56.9 2.5 4 27 A S H 4 S+ 0 0 74 -3,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.865 110.2 50.1 -71.8 -37.9 -2.3 54.9 2.2 5 28 A D H < S+ 0 0 108 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.614 118.0 38.8 -77.7 -12.4 -2.1 53.9 -1.4 6 29 A F >X + 0 0 32 -4,-0.7 4,-1.0 -3,-0.3 3,-0.9 -0.382 64.2 152.3-135.4 58.2 1.5 52.7 -1.2 7 30 A P T 34 S+ 0 0 65 0, 0.0 3,-0.3 0, 0.0 6,-0.3 0.844 75.5 53.8 -54.9 -39.0 1.8 50.9 2.2 8 31 A Q T 34 S+ 0 0 91 1,-0.2 6,-0.1 -3,-0.1 214,-0.1 0.762 103.5 57.1 -70.3 -26.2 4.6 48.6 0.9 9 32 A A T <4 S+ 0 0 3 -3,-0.9 216,-3.1 -6,-0.1 2,-0.4 0.762 92.3 77.8 -78.9 -27.0 6.8 51.6 -0.2 10 33 A W B >X S-a 225 0A 4 -4,-1.0 4,-2.3 -3,-0.3 3,-0.8 -0.693 70.4-142.8 -92.4 137.7 7.0 53.4 3.1 11 34 A A H 3> S+ 0 0 27 214,-2.6 4,-0.5 -2,-0.4 215,-0.1 0.794 102.5 61.7 -62.1 -28.4 9.3 52.3 6.0 12 35 A E H 34 S+ 0 0 94 213,-0.4 -1,-0.2 1,-0.2 214,-0.1 0.810 122.2 16.4 -68.8 -30.9 6.6 53.4 8.4 13 36 A T H <4 S+ 0 0 70 -3,-0.8 -2,-0.2 -6,-0.3 -1,-0.2 0.441 117.6 61.1-125.4 -0.6 4.1 50.8 7.0 14 37 A G H < S- 0 0 22 -4,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.418 91.2-127.6-110.0 3.2 5.9 48.2 5.0 15 38 A G < - 0 0 46 -4,-0.5 -1,-0.2 -5,-0.2 -2,-0.1 -0.023 56.3 -25.5 74.4 172.9 8.3 46.7 7.5 16 39 A M S S- 0 0 60 1,-0.1 2,-0.1 208,-0.0 108,-0.1 -0.160 74.6-119.0 -55.5 149.3 12.0 46.3 7.0 17 40 A G - 0 0 2 106,-0.2 2,-0.2 107,-0.1 206,-0.2 -0.380 26.9-177.5 -90.6 171.0 13.2 46.1 3.5 18 41 A L - 0 0 56 204,-2.0 2,-1.8 -2,-0.1 111,-0.2 -0.752 27.5-133.9-168.3 114.1 15.1 43.5 1.5 19 42 A A > - 0 0 0 109,-3.4 3,-1.3 -2,-0.2 111,-0.3 -0.564 27.4-178.0 -76.9 86.8 16.2 43.9 -2.1 20 43 A V T 3 S+ 0 0 86 -2,-1.8 -1,-0.2 201,-0.8 202,-0.1 0.706 74.6 56.8 -61.1 -23.5 15.0 40.5 -3.4 21 44 A R T 3 S+ 0 0 169 200,-0.5 2,-0.5 -3,-0.1 -1,-0.3 0.656 91.0 87.5 -84.1 -15.1 16.2 40.9 -6.9 22 45 A Q S < S- 0 0 18 -3,-1.3 108,-0.3 1,-0.0 3,-0.1 -0.752 78.9-127.7 -93.4 122.5 19.8 41.5 -5.8 23 46 A A - 0 0 74 -2,-0.5 109,-0.1 1,-0.1 3,-0.1 -0.293 42.9 -86.3 -62.1 146.8 22.1 38.6 -5.3 24 47 A P - 0 0 42 0, 0.0 107,-0.3 0, 0.0 2,-0.2 -0.327 55.9-107.0 -56.3 132.5 23.9 38.4 -1.9 25 48 A L B -c 131 0B 21 105,-2.7 107,-3.2 -3,-0.1 2,-0.5 -0.414 24.5-153.7 -71.7 135.1 27.0 40.5 -2.1 26 49 A I - 0 0 90 -2,-0.2 -1,-0.0 105,-0.2 -3,-0.0 -0.921 9.8-151.9-105.6 129.2 30.5 38.9 -2.2 27 50 A I - 0 0 11 -2,-0.5 2,-0.1 105,-0.1 111,-0.1 -0.867 10.8-145.9-108.2 101.7 33.2 41.1 -0.9 28 51 A P - 0 0 82 0, 0.0 66,-1.7 0, 0.0 2,-0.2 -0.394 11.5-142.0 -68.5 140.1 36.6 40.4 -2.5 29 52 A L B -D 93 0C 65 64,-0.3 64,-0.3 1,-0.1 63,-0.1 -0.584 27.4 -92.1 -97.2 161.0 39.7 40.8 -0.4 30 53 A K > - 0 0 72 62,-2.6 3,-1.4 -2,-0.2 -1,-0.1 -0.327 45.5-102.9 -66.3 157.6 43.1 42.1 -1.5 31 54 A A T 3 S+ 0 0 108 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.743 119.0 37.3 -55.9 -30.3 45.6 39.5 -2.7 32 55 A T T 3 S+ 0 0 133 2,-0.0 -1,-0.3 60,-0.0 2,-0.1 0.370 86.4 132.7-105.9 5.7 47.6 39.5 0.5 33 56 A S < - 0 0 32 -3,-1.4 -4,-0.1 59,-0.2 59,-0.0 -0.315 28.7-179.4 -66.0 135.9 44.8 39.9 3.1 34 57 A T - 0 0 93 -2,-0.1 -2,-0.0 1,-0.0 -4,-0.0 -0.960 40.9 -84.7-129.5 146.1 44.6 37.8 6.2 35 58 A P - 0 0 60 0, 0.0 2,-0.4 0, 0.0 36,-0.1 -0.142 40.6-153.1 -52.1 141.9 41.9 38.0 8.9 36 59 A V - 0 0 19 102,-0.1 36,-2.2 2,-0.0 2,-0.6 -0.968 5.4-161.4-121.2 136.0 42.5 40.5 11.6 37 60 A S B -e 72 0D 62 -2,-0.4 2,-0.5 34,-0.3 36,-0.2 -0.913 7.0-171.4-122.0 102.4 41.1 40.2 15.1 38 61 A I - 0 0 57 34,-3.5 2,-0.1 -2,-0.6 -2,-0.0 -0.820 26.7-121.1 -94.7 126.0 41.0 43.4 17.1 39 62 A K - 0 0 139 -2,-0.5 2,-0.4 1,-0.1 33,-0.0 -0.383 28.4-108.2 -67.7 142.2 40.0 42.9 20.8 40 63 A Q - 0 0 36 33,-0.1 -1,-0.1 34,-0.1 3,-0.1 -0.578 32.0-127.4 -72.4 121.9 36.9 44.8 22.0 41 64 A Y - 0 0 46 -2,-0.4 34,-0.2 34,-0.2 -1,-0.1 -0.475 42.7 -85.2 -68.6 139.6 37.9 47.7 24.2 42 65 A P - 0 0 124 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.156 47.2-149.4 -47.1 134.5 36.1 47.5 27.6 43 66 A M - 0 0 31 -3,-0.1 35,-0.1 33,-0.0 33,-0.0 -0.946 13.8-118.9-115.0 132.1 32.7 49.2 27.2 44 67 A S > - 0 0 61 -2,-0.4 4,-2.2 33,-0.4 5,-0.2 -0.160 24.5-115.5 -61.4 158.9 31.0 50.9 30.2 45 68 A Q H > S+ 0 0 124 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.880 116.3 60.0 -65.4 -35.4 27.7 49.6 31.4 46 69 A E H > S+ 0 0 133 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.935 108.8 43.1 -56.9 -46.5 26.1 52.9 30.3 47 70 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.905 113.2 51.1 -66.5 -43.6 27.2 52.3 26.7 48 71 A R H X S+ 0 0 48 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.889 110.6 48.7 -62.3 -41.0 26.2 48.7 26.7 49 72 A L H < S+ 0 0 95 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.856 112.0 50.0 -68.1 -34.1 22.7 49.5 28.0 50 73 A G H < S+ 0 0 21 -4,-1.6 4,-0.4 -5,-0.3 -2,-0.2 0.913 117.5 39.2 -68.9 -41.9 22.3 52.2 25.4 51 74 A I H >X S+ 0 0 2 -4,-2.4 4,-1.7 1,-0.2 3,-1.1 0.830 97.6 81.2 -75.4 -36.6 23.4 49.9 22.6 52 75 A K H 3X S+ 0 0 77 -4,-2.7 4,-2.6 1,-0.3 5,-0.2 0.807 86.9 52.9 -40.5 -52.7 21.6 46.8 23.8 53 76 A P H 3> S+ 0 0 79 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.871 110.8 49.2 -56.5 -38.2 18.1 47.6 22.5 54 77 A H H <> S+ 0 0 60 -3,-1.1 4,-2.3 -4,-0.4 -2,-0.2 0.886 110.1 49.5 -69.5 -40.1 19.5 48.2 19.0 55 78 A I H X S+ 0 0 3 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.910 111.6 50.5 -64.5 -40.9 21.4 44.9 19.0 56 79 A Q H X S+ 0 0 94 -4,-2.6 4,-2.6 -5,-0.2 -2,-0.2 0.920 110.2 48.5 -63.6 -44.1 18.3 43.1 20.1 57 80 A R H X S+ 0 0 101 -4,-2.1 4,-2.1 1,-0.2 6,-0.2 0.927 112.2 48.8 -62.0 -45.1 16.2 44.6 17.4 58 81 A L H <>S+ 0 0 5 -4,-2.3 5,-1.7 2,-0.2 6,-1.7 0.842 111.6 49.5 -64.5 -34.5 18.8 43.7 14.7 59 82 A L H ><5S+ 0 0 38 -4,-2.0 3,-1.1 4,-0.2 -1,-0.2 0.917 110.8 49.8 -69.5 -43.3 19.0 40.2 16.0 60 83 A D H 3<5S+ 0 0 119 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.851 111.0 50.1 -62.8 -34.1 15.2 39.9 15.9 61 84 A Q T 3<5S- 0 0 78 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.539 112.1-121.4 -81.5 -7.4 15.2 41.2 12.4 62 85 A G T < 5S+ 0 0 31 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.544 83.7 117.0 78.6 6.5 17.9 38.7 11.3 63 86 A I S > + 0 0 3 -2,-1.3 4,-3.1 1,-0.2 3,-0.6 0.182 36.1 114.0 -94.2 16.0 35.8 48.7 10.4 87 116 A R H 3> S+ 0 0 162 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.867 77.1 49.6 -57.3 -38.6 38.9 50.6 9.3 88 117 A E H 34 S+ 0 0 59 -3,-0.4 4,-0.4 2,-0.2 -1,-0.3 0.770 113.7 46.4 -72.9 -24.5 41.2 47.5 9.6 89 118 A V H X> S+ 0 0 0 -3,-0.6 3,-1.1 2,-0.2 4,-0.7 0.899 109.5 54.9 -79.5 -42.0 38.7 45.4 7.6 90 119 A N H >< S+ 0 0 25 -4,-3.1 3,-1.1 1,-0.3 -2,-0.2 0.887 102.8 56.4 -55.8 -42.5 38.4 48.2 5.0 91 120 A K T 3< S+ 0 0 121 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.744 108.9 47.6 -61.7 -25.7 42.2 48.2 4.5 92 121 A R T <4 S+ 0 0 58 -3,-1.1 -62,-2.6 -4,-0.4 2,-0.4 0.484 92.1 93.6 -96.7 -3.5 42.1 44.5 3.6 93 122 A V B << S-D 29 0C 1 -3,-1.1 -64,-0.3 -4,-0.7 -66,-0.0 -0.752 84.7-107.2 -93.9 134.7 39.2 44.7 1.1 94 123 A E - 0 0 101 -66,-1.7 2,-0.1 -2,-0.4 -2,-0.1 -0.294 39.8-113.6 -58.0 137.2 40.0 45.1 -2.6 95 124 A D - 0 0 102 -4,-0.1 2,-0.3 3,-0.0 -1,-0.1 -0.403 28.0-158.7 -74.8 150.0 39.2 48.6 -3.9 96 125 A I - 0 0 63 -2,-0.1 72,-0.0 1,-0.0 -1,-0.0 -0.890 34.1 -85.0-124.2 157.3 36.4 49.2 -6.4 97 126 A H - 0 0 145 -2,-0.3 2,-1.2 1,-0.1 -1,-0.0 -0.382 42.5-118.2 -63.0 135.1 35.9 52.2 -8.8 98 127 A P + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 67,-0.0 -0.624 44.6 165.6 -76.4 98.6 34.1 55.1 -7.1 99 128 A T + 0 0 60 -2,-1.2 -2,-0.1 2,-0.1 69,-0.0 0.547 37.9 103.8 -94.3 -8.4 31.0 55.3 -9.3 100 129 A V S S- 0 0 35 93,-0.0 2,-0.1 1,-0.0 93,-0.1 -0.633 72.0-131.0 -75.9 123.3 28.8 57.5 -7.2 101 130 A P - 0 0 42 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.415 22.7-106.8 -71.4 150.4 28.8 61.0 -8.8 102 131 A N > - 0 0 81 1,-0.1 4,-2.5 -2,-0.1 3,-0.4 -0.510 35.6-108.4 -74.0 149.9 29.5 64.0 -6.5 103 132 A P H > S+ 0 0 32 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.833 116.1 57.5 -46.2 -41.8 26.3 66.0 -5.9 104 133 A Y H > S+ 0 0 166 1,-0.2 4,-0.7 2,-0.2 0, 0.0 0.950 112.2 39.9 -58.7 -49.7 27.5 68.9 -8.1 105 134 A N H >4 S+ 0 0 89 -3,-0.4 3,-0.8 1,-0.2 4,-0.4 0.902 113.3 55.1 -67.1 -40.2 27.9 66.8 -11.2 106 135 A L H >< S+ 0 0 24 -4,-2.5 3,-1.6 1,-0.3 -2,-0.2 0.928 107.7 49.2 -58.3 -46.1 24.7 64.8 -10.4 107 136 A L H >< S+ 0 0 11 -4,-2.7 3,-1.4 1,-0.3 -1,-0.3 0.648 92.6 76.8 -69.8 -13.4 22.6 67.9 -10.3 108 137 A S T << S+ 0 0 92 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.704 87.0 64.3 -69.2 -15.3 24.1 69.1 -13.6 109 138 A G T < S+ 0 0 41 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.1 0.148 77.5 99.1 -93.6 19.4 21.8 66.5 -15.2 110 139 A L < - 0 0 22 -3,-1.4 139,-0.0 139,-0.1 -1,-0.0 -0.910 63.8-152.6-109.7 105.7 18.6 68.4 -14.1 111 140 A P > - 0 0 41 0, 0.0 3,-2.2 0, 0.0 136,-0.1 -0.511 22.7-122.3 -80.5 145.8 17.2 70.5 -16.9 112 141 A P T 3 S+ 0 0 90 0, 0.0 3,-0.1 0, 0.0 136,-0.1 0.634 107.3 74.9 -58.2 -15.9 15.1 73.7 -16.4 113 142 A S T 3 S+ 0 0 70 1,-0.2 2,-0.8 134,-0.1 -3,-0.0 0.784 89.6 61.5 -68.7 -27.2 12.3 72.0 -18.4 114 143 A H < + 0 0 22 -3,-2.2 88,-0.3 1,-0.1 -1,-0.2 -0.804 57.7 149.8-105.7 94.0 11.6 69.7 -15.4 115 144 A Q + 0 0 57 -2,-0.8 2,-0.6 86,-0.3 131,-0.3 0.322 43.9 89.4-107.9 7.8 10.6 71.9 -12.4 116 145 A W E -I 201 0G 50 85,-2.3 85,-2.4 87,-0.1 2,-0.3 -0.933 63.6-166.3-106.6 120.2 8.2 69.7 -10.4 117 146 A Y E -IJ 200 234G 0 117,-3.2 117,-2.9 -2,-0.6 2,-0.4 -0.814 25.9-174.9-118.8 150.8 10.1 67.7 -7.9 118 147 A T E -I 199 0G 1 81,-2.0 81,-2.9 -2,-0.3 2,-0.5 -0.999 13.5-165.5-133.5 128.3 9.7 64.7 -5.5 119 148 A V E +IJ 198 231G 10 112,-2.5 112,-2.2 -2,-0.4 2,-0.4 -0.977 10.0 175.3-120.6 127.5 12.5 63.8 -3.1 120 149 A L E -I 197 0G 1 77,-2.2 77,-3.4 -2,-0.5 2,-0.4 -0.960 14.4-159.9-128.1 145.6 12.6 60.5 -1.3 121 150 A D E -I 196 0G 27 -2,-0.4 105,-2.6 105,-0.3 2,-0.4 -0.994 22.1-127.8-125.4 134.3 15.3 59.0 0.9 122 151 A L B > -B 225 0A 4 73,-2.5 3,-0.8 -2,-0.4 2,-0.3 -0.691 22.0-127.3 -85.0 130.5 15.4 55.3 1.5 123 152 A K T 3 S- 0 0 102 101,-2.7 101,-0.3 -2,-0.4 -106,-0.2 -0.589 83.8 -9.8 -79.9 134.3 15.4 54.1 5.1 124 153 A D T 3 S+ 0 0 79 -2,-0.3 4,-0.4 1,-0.1 3,-0.3 0.875 81.4 173.1 45.0 46.9 18.2 51.7 6.3 125 154 A A X + 0 0 3 -3,-0.8 3,-2.0 1,-0.2 4,-0.4 0.880 68.8 52.9 -50.5 -51.1 19.2 51.3 2.6 126 155 A F G > S+ 0 0 35 1,-0.3 3,-1.9 2,-0.2 33,-0.8 0.900 102.3 59.9 -56.3 -41.2 22.3 49.3 3.2 127 156 A F G 3 S+ 0 0 21 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.2 0.561 91.9 69.4 -65.2 -7.4 20.4 46.8 5.3 128 157 A C G < S+ 0 0 1 -3,-2.0 -109,-3.4 -4,-0.4 2,-0.6 0.696 87.4 77.4 -82.5 -18.4 18.2 46.1 2.3 129 158 A L S < S- 0 0 2 -3,-1.9 30,-2.5 -4,-0.4 2,-0.1 -0.814 80.5-134.0 -97.6 121.6 21.1 44.4 0.5 130 159 A R B -L 158 0H 82 -2,-0.6 -105,-2.7 -108,-0.3 2,-0.4 -0.384 10.4-139.2 -71.2 149.4 22.0 40.9 1.6 131 160 A L B -c 25 0B 2 26,-2.5 -105,-0.2 -107,-0.3 5,-0.1 -0.898 27.2-111.7-105.7 136.7 25.7 39.9 2.2 132 161 A H >> - 0 0 67 -107,-3.2 3,-1.8 -2,-0.4 4,-1.3 -0.410 25.9-118.5 -67.2 144.7 26.7 36.5 1.0 133 162 A P T 34 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -107,-0.0 0.772 113.2 61.4 -55.3 -27.0 27.5 34.0 3.8 134 163 A T T 34 S+ 0 0 94 1,-0.2 4,-0.1 2,-0.1 -108,-0.1 0.749 110.5 39.6 -72.7 -21.3 31.1 33.7 2.6 135 164 A S T X4 S+ 0 0 5 -3,-1.8 3,-1.1 -110,-0.3 4,-0.4 0.592 93.8 84.9-100.9 -15.1 31.6 37.5 3.2 136 165 A Q G >< S+ 0 0 32 -4,-1.3 3,-1.4 1,-0.2 20,-0.4 0.856 79.8 64.0 -55.8 -39.0 29.7 37.7 6.4 137 166 A P G > S+ 0 0 46 0, 0.0 3,-1.5 0, 0.0 -66,-0.3 0.791 87.7 71.6 -57.7 -29.1 32.6 36.7 8.7 138 167 A L G < S+ 0 0 9 -3,-1.1 -2,-0.2 1,-0.3 -102,-0.1 0.798 98.4 48.1 -56.4 -31.3 34.6 39.7 7.7 139 168 A F G < S+ 0 0 0 -3,-1.4 -1,-0.3 -4,-0.4 17,-0.1 0.162 79.3 137.7-102.5 18.9 32.4 42.0 9.7 140 169 A A < + 0 0 0 -3,-1.5 -67,-1.7 15,-0.1 2,-0.3 -0.245 23.4 175.6 -67.2 150.1 32.2 40.2 13.0 141 170 A F E -G 154 0E 0 13,-2.3 13,-2.6 -69,-0.2 2,-0.3 -0.932 32.2 -97.5-144.8 166.1 32.4 42.0 16.4 142 171 A E E -G 153 0E 70 -69,-0.4 2,-0.3 -2,-0.3 11,-0.3 -0.669 32.1-179.2 -93.7 144.0 32.0 40.8 20.0 143 172 A W + 0 0 20 9,-3.5 2,-0.4 -2,-0.3 7,-0.3 -0.895 3.9 175.6-143.6 113.0 28.8 41.1 22.1 144 173 A R - 0 0 94 -2,-0.3 3,-0.1 5,-0.1 7,-0.1 -0.955 17.8-159.4-121.7 135.6 28.6 40.0 25.7 145 174 A D - 0 0 18 -2,-0.4 3,-0.1 5,-0.2 -2,-0.0 -0.883 14.1-149.8-114.2 95.7 25.7 40.4 28.1 146 175 A P S S+ 0 0 74 0, 0.0 2,-1.4 0, 0.0 3,-0.2 0.742 93.0 57.7 -30.3 -47.9 27.0 40.1 31.7 147 176 A E S S- 0 0 141 1,-0.3 -3,-0.0 -3,-0.1 0, 0.0 -0.475 139.2 -49.9 -90.7 64.6 23.8 38.6 32.9 148 177 A M S S+ 0 0 146 -2,-1.4 -1,-0.3 -3,-0.1 2,-0.2 0.840 80.2 171.1 70.5 108.4 23.8 35.6 30.5 149 178 A G - 0 0 24 -3,-0.2 2,-0.1 1,-0.1 -5,-0.1 -0.494 31.5 -66.4-128.7-161.1 24.3 36.5 26.9 150 179 A I - 0 0 53 -7,-0.3 -5,-0.2 -2,-0.2 -1,-0.1 -0.403 64.6 -72.8 -91.4 169.1 25.0 35.0 23.5 151 180 A S S S- 0 0 83 -2,-0.1 -2,-0.1 1,-0.1 3,-0.1 0.763 72.6 -91.2 -20.4 -92.8 28.0 33.0 22.2 152 181 A G S S+ 0 0 16 1,-0.5 -9,-3.5 -85,-0.3 2,-0.3 0.214 95.1 47.8-161.3 -53.4 30.6 35.7 21.8 153 182 A Q E -FG 67 142E 34 -86,-0.8 -86,-1.7 -11,-0.3 -1,-0.5 -0.735 52.5-170.6-108.3 155.9 30.6 37.3 18.3 154 183 A L E -FG 66 141E 0 -13,-2.6 -13,-2.3 -2,-0.3 2,-0.3 -0.899 8.6-173.8-133.2 159.0 27.8 38.6 16.1 155 184 A T E -F 65 0E 2 -90,-2.0 -90,-2.3 -2,-0.3 2,-0.3 -0.965 26.4 -94.3-151.4 168.5 28.0 39.6 12.4 156 185 A W E -F 64 0E 19 -20,-0.4 -92,-0.2 -2,-0.3 -17,-0.2 -0.631 13.9-170.0 -90.8 143.0 25.9 41.2 9.7 157 186 A T S S+ 0 0 22 -94,-2.1 -26,-2.5 -2,-0.3 2,-0.3 0.316 79.8 55.7-106.2 2.6 23.8 39.4 7.1 158 187 A R B S-L 130 0H 30 -95,-0.5 -28,-0.2 -28,-0.3 -31,-0.2 -0.883 108.9 -73.6-130.4 161.1 23.3 42.7 5.3 159 188 A L - 0 0 0 -30,-2.5 -30,-0.2 -33,-0.8 2,-0.1 -0.345 63.3-134.8 -54.2 120.7 25.6 45.3 3.8 160 189 A P > - 0 0 0 0, 0.0 3,-1.0 0, 0.0 6,-0.2 -0.443 5.1-111.3 -90.5 158.7 27.0 47.1 6.9 161 190 A Q T 3 S+ 0 0 128 1,-0.2 -77,-0.1 -2,-0.1 3,-0.1 -0.459 102.3 35.5 -73.1 152.2 27.5 50.8 7.9 162 191 A G T 3 S+ 0 0 49 1,-0.3 2,-0.5 -2,-0.1 -1,-0.2 0.282 83.2 125.0 87.9 -12.9 31.2 51.8 8.2 163 192 A F X - 0 0 5 -3,-1.0 3,-1.8 1,-0.1 -1,-0.3 -0.716 63.9-133.2 -83.7 127.3 32.3 49.5 5.3 164 193 A K T 3 S+ 0 0 62 -2,-0.5 4,-0.3 1,-0.3 -1,-0.1 0.750 101.1 43.7 -52.6 -31.0 34.2 51.6 2.7 165 194 A N T 3> S+ 0 0 14 1,-0.2 4,-2.8 2,-0.1 5,-0.3 0.446 83.6 96.5 -98.2 1.8 32.3 50.2 -0.3 166 195 A S H <> S+ 0 0 1 -3,-1.8 4,-2.5 1,-0.2 5,-0.3 0.914 84.2 48.7 -59.1 -45.6 28.7 50.2 1.1 167 196 A P H > S+ 0 0 51 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.946 116.1 43.2 -59.8 -46.5 27.7 53.5 -0.5 168 197 A T H > S+ 0 0 18 -4,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.913 114.6 48.8 -65.1 -45.1 29.1 52.5 -4.0 169 198 A L H X S+ 0 0 28 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.881 113.5 47.4 -64.9 -36.8 27.6 49.0 -3.8 170 199 A F H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.3 5,-0.3 0.948 111.1 50.0 -69.5 -46.1 24.2 50.3 -2.8 171 200 A D H X S+ 0 0 2 -4,-2.5 4,-1.9 -5,-0.3 -2,-0.2 0.906 113.6 47.1 -57.0 -41.7 24.2 53.0 -5.5 172 201 A E H X S+ 0 0 56 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.916 111.7 50.4 -68.3 -40.8 25.1 50.4 -8.1 173 202 A A H X S+ 0 0 1 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.919 111.4 47.0 -62.9 -45.1 22.5 47.9 -6.8 174 203 A L H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.870 107.9 56.8 -67.0 -35.4 19.7 50.5 -6.9 175 204 A H H < S+ 0 0 71 -4,-1.9 4,-0.5 -5,-0.3 -1,-0.2 0.913 107.6 48.6 -60.7 -40.6 20.7 51.6 -10.4 176 205 A R H >< S+ 0 0 129 -4,-1.9 3,-0.7 1,-0.2 4,-0.4 0.904 113.2 47.5 -65.2 -40.0 20.3 48.0 -11.6 177 206 A D H 3< S+ 0 0 22 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.738 115.6 43.6 -74.2 -23.3 16.9 47.7 -9.9 178 207 A L T 3X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.1 -1,-0.2 0.328 83.8 98.1-103.9 8.4 15.6 51.1 -11.3 179 208 A A H <> S+ 0 0 46 -3,-0.7 4,-1.6 -4,-0.5 -1,-0.1 0.923 85.5 47.3 -60.8 -45.0 16.9 50.6 -14.8 180 209 A D H > S+ 0 0 98 -4,-0.4 4,-2.5 1,-0.2 5,-0.2 0.898 107.2 56.7 -64.6 -41.5 13.5 49.4 -16.1 181 210 A F H > S+ 0 0 7 -4,-0.3 4,-1.4 1,-0.2 -1,-0.2 0.921 105.9 51.2 -55.9 -44.8 11.7 52.3 -14.4 182 211 A R H < S+ 0 0 83 -4,-2.0 -1,-0.2 1,-0.2 6,-0.2 0.894 110.7 49.1 -59.6 -39.7 13.9 54.7 -16.3 183 212 A I H < S+ 0 0 117 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.879 110.9 48.8 -68.0 -38.8 13.0 53.0 -19.5 184 213 A Q H < S+ 0 0 117 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.697 116.8 43.9 -74.3 -19.7 9.3 53.0 -18.8 185 214 A H >< + 0 0 55 -4,-1.4 3,-1.9 -5,-0.2 -1,-0.3 -0.506 64.8 160.9-126.8 64.6 9.4 56.7 -18.0 186 215 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.700 74.1 56.6 -55.7 -26.5 11.6 58.3 -20.7 187 216 A D T 3 S+ 0 0 124 -3,-0.1 2,-0.3 2,-0.1 15,-0.3 0.345 93.0 83.8 -93.5 7.8 10.2 61.8 -19.9 188 217 A L < - 0 0 24 -3,-1.9 2,-0.5 -6,-0.2 13,-0.2 -0.803 69.7-138.1-108.7 152.8 11.1 61.8 -16.3 189 218 A I E -K 200 0G 41 11,-2.5 11,-2.9 -2,-0.3 2,-0.5 -0.927 19.5-172.8-107.8 131.0 14.5 62.7 -14.7 190 219 A L E -K 199 0G 8 -2,-0.5 2,-0.5 9,-0.2 9,-0.2 -0.963 2.7-169.5-128.9 115.2 15.7 60.5 -11.9 191 220 A L E -K 198 0G 12 7,-2.9 7,-2.4 -2,-0.5 2,-0.5 -0.887 5.2-165.5-104.5 133.4 18.8 61.4 -9.9 192 221 A Q E +K 197 0G 2 -2,-0.5 2,-0.4 5,-0.2 5,-0.2 -0.979 17.2 172.9-122.4 126.7 20.2 58.8 -7.5 193 222 A Y E > -K 196 0G 72 3,-2.1 3,-2.2 -2,-0.5 2,-0.7 -0.765 68.9 -76.6-130.1 83.8 22.8 59.6 -4.8 194 223 A V T 3 S- 0 0 14 -2,-0.4 -1,-0.1 1,-0.3 -20,-0.0 -0.472 118.3 -5.7 59.5-104.7 23.0 56.4 -2.9 195 224 A D T 3 S+ 0 0 50 -2,-0.7 -73,-2.5 -3,-0.1 2,-0.6 0.403 117.7 92.0 -99.6 4.8 19.8 56.5 -0.8 196 225 A D E < -IK 121 193G 46 -3,-2.2 -3,-2.1 -75,-0.2 2,-0.4 -0.872 57.6-170.7-105.0 116.2 18.7 60.0 -1.8 197 226 A L E -IK 120 192G 2 -77,-3.4 -77,-2.2 -2,-0.6 2,-0.4 -0.856 13.2-170.4-113.4 139.8 16.4 60.2 -4.8 198 227 A L E -IK 119 191G 0 -7,-2.4 -7,-2.9 -2,-0.4 2,-0.5 -0.990 3.8-169.2-126.0 123.4 15.1 63.1 -6.9 199 228 A L E -IK 118 190G 1 -81,-2.9 -81,-2.0 -2,-0.4 2,-0.4 -0.957 10.0-168.5-112.3 128.0 12.4 62.6 -9.4 200 229 A A E +IK 117 189G 0 -11,-2.9 -11,-2.5 -2,-0.5 2,-0.3 -0.966 7.8 175.5-122.7 135.9 11.8 65.6 -11.8 201 230 A A E -I 116 0G 0 -85,-2.4 -85,-2.3 -2,-0.4 -86,-0.3 -0.877 37.3-124.5-132.7 164.7 8.9 66.1 -14.2 202 231 A T S S+ 0 0 68 -2,-0.3 2,-0.3 -15,-0.3 -87,-0.1 0.688 94.1 27.0 -82.0 -21.3 7.7 68.9 -16.5 203 232 A S S > S- 0 0 39 -87,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.938 79.3-114.6-139.4 161.4 4.2 69.1 -14.9 204 233 A E H > S+ 0 0 94 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.848 118.4 53.0 -62.8 -33.4 2.6 68.5 -11.6 205 234 A L H > S+ 0 0 94 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.960 107.6 47.9 -65.7 -53.9 0.6 65.7 -13.2 206 235 A D H > S+ 0 0 50 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.847 113.0 51.1 -56.0 -35.1 3.6 64.0 -14.7 207 236 A C H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.890 109.6 48.4 -71.4 -39.8 5.2 64.2 -11.2 208 237 A Q H X S+ 0 0 57 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.949 116.8 42.3 -64.6 -48.0 2.2 62.8 -9.4 209 238 A Q H X S+ 0 0 102 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.870 116.4 48.7 -66.3 -38.8 2.0 59.9 -11.9 210 239 A G H X S+ 0 0 2 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.891 110.8 50.4 -68.5 -39.6 5.7 59.4 -11.9 211 240 A T H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.880 109.0 51.5 -66.1 -38.8 5.9 59.4 -8.1 212 241 A R H X S+ 0 0 105 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.937 112.3 46.9 -62.2 -45.7 3.1 56.8 -7.8 213 242 A A H X S+ 0 0 23 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.874 112.7 49.1 -63.9 -39.2 5.0 54.6 -10.2 214 243 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.924 111.6 48.4 -67.9 -44.0 8.3 55.1 -8.4 215 244 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.944 112.8 48.1 -61.8 -46.3 6.8 54.3 -5.0 216 245 A Q H X S+ 0 0 108 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.922 114.3 46.9 -60.1 -43.5 5.1 51.2 -6.3 217 246 A T H X S+ 0 0 28 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.932 112.5 48.3 -64.3 -48.5 8.4 50.0 -8.0 218 247 A L H X>S+ 0 0 0 -4,-3.0 5,-2.4 1,-0.2 4,-0.9 0.920 112.7 49.4 -59.2 -44.1 10.5 50.7 -4.9 219 248 A G H ><5S+ 0 0 1 -4,-2.6 3,-0.7 -5,-0.2 -1,-0.2 0.920 111.5 47.5 -61.9 -45.3 8.1 48.9 -2.7 220 249 A N H 3<5S+ 0 0 79 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.836 109.3 54.8 -64.9 -33.9 7.9 45.8 -4.9 221 250 A L H 3<5S- 0 0 9 -4,-2.1 -201,-0.8 -5,-0.2 -200,-0.5 0.666 122.3-104.2 -74.3 -18.7 11.7 45.7 -5.2 222 251 A G T <<5S+ 0 0 6 -4,-0.9 -204,-2.0 -3,-0.7 2,-0.2 0.517 77.3 128.2 107.9 6.5 12.0 45.6 -1.4 223 252 A Y < - 0 0 0 -5,-2.4 2,-0.4 -206,-0.2 -1,-0.4 -0.600 43.5-149.1 -93.3 157.8 13.2 49.2 -0.7 224 253 A R - 0 0 26 -101,-0.3 -101,-2.7 -2,-0.2 2,-0.3 -0.987 5.6-157.1-133.2 125.3 11.5 51.5 1.9 225 254 A A B -aB 10 122A 0 -216,-3.1 -214,-2.6 -2,-0.4 2,-0.7 -0.681 29.2-105.0 -98.9 152.6 11.3 55.2 1.7 226 255 A S > - 0 0 12 -105,-2.6 4,-1.2 -2,-0.3 -105,-0.3 -0.660 26.1-170.4 -79.5 113.8 10.8 57.6 4.6 227 256 A A T 4 S+ 0 0 27 -2,-0.7 -1,-0.2 1,-0.2 -224,-0.1 0.873 86.3 57.8 -69.5 -35.9 7.2 58.9 4.6 228 257 A K T 4 S+ 0 0 176 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.894 114.9 34.4 -60.9 -42.8 8.1 61.4 7.3 229 258 A K T 4 S+ 0 0 141 -108,-0.1 -1,-0.2 2,-0.0 -2,-0.2 0.594 89.4 124.7 -90.5 -11.8 10.8 63.1 5.2 230 259 A A < - 0 0 24 -4,-1.2 2,-0.5 -109,-0.1 -110,-0.2 -0.139 43.5-160.8 -54.4 139.8 9.2 62.7 1.8 231 260 A Q E -J 119 0G 35 -112,-2.2 -112,-2.5 7,-0.1 2,-0.5 -0.958 17.4-162.6-123.0 106.6 8.7 65.8 -0.3 232 261 A I E - 0 0 34 -2,-0.5 -114,-0.2 -114,-0.2 -24,-0.1 -0.839 53.9 -27.2-107.8 126.2 6.1 65.1 -3.0 233 262 A C E S+ 0 0 14 -2,-0.5 2,-0.3 1,-0.2 -115,-0.2 0.887 87.4 150.5 45.8 57.1 5.4 67.0 -6.2 234 263 A Q E -J 117 0G 86 -117,-2.9 -117,-3.2 -3,-0.2 -1,-0.2 -0.739 53.8-137.3-113.6 162.5 6.6 70.3 -5.0 235 264 A K S S+ 0 0 77 -2,-0.3 11,-1.3 1,-0.2 2,-0.3 0.449 97.3 43.1 -95.0 -1.7 8.1 73.3 -6.9 236 265 A Q E S+M 245 0I 84 9,-0.2 2,-0.3 -119,-0.2 -1,-0.2 -0.950 71.5 160.7-146.1 119.8 10.7 73.7 -4.1 237 266 A V E -M 244 0I 1 7,-2.0 7,-3.2 -2,-0.3 2,-0.6 -0.955 37.8-121.2-140.2 158.9 12.6 70.9 -2.4 238 267 A K E +M 243 0I 142 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.885 39.1 167.1 -99.4 124.0 15.7 70.3 -0.3 239 268 A Y E > -M 242 0I 5 3,-2.8 3,-2.2 -2,-0.6 -2,-0.1 -0.958 62.6 -20.0-145.1 122.7 18.0 67.8 -2.0 240 269 A L T 3 S- 0 0 36 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.852 127.7 -47.8 51.2 43.4 21.6 67.0 -1.1 241 270 A G T 3 S+ 0 0 90 1,-0.3 2,-0.3 -138,-0.0 -1,-0.3 0.407 119.3 108.7 82.2 -4.5 22.1 70.3 0.8 242 271 A Y E < -M 239 0I 67 -3,-2.2 -3,-2.8 7,-0.0 2,-0.7 -0.746 65.6-137.1-105.8 155.0 20.6 72.3 -2.0 243 272 A L E -M 238 0I 56 -2,-0.3 2,-0.6 -5,-0.2 -5,-0.2 -0.940 23.6-154.2-107.8 105.5 17.3 74.1 -2.2 244 273 A L E +M 237 0I 0 -7,-3.2 -7,-2.0 -2,-0.7 2,-0.4 -0.751 23.7 166.1 -85.0 122.0 16.0 73.3 -5.6 245 274 A K E > -MN 236 248I 102 3,-1.4 3,-2.1 -2,-0.6 -9,-0.2 -0.922 61.9 -32.1-144.0 113.4 13.6 76.1 -6.7 246 275 A E T 3 S- 0 0 110 -11,-1.3 -131,-0.1 -2,-0.4 3,-0.1 0.908 123.2 -42.5 43.8 63.6 12.3 76.6 -10.2 247 276 A G T 3 S+ 0 0 25 1,-0.2 2,-0.4 -133,-0.2 -1,-0.3 0.192 105.7 130.8 76.2 -19.3 15.4 75.4 -12.1 248 277 A Q B < N 245 0I 139 -3,-2.1 -3,-1.4 1,-0.2 -1,-0.2 -0.577 360.0 360.0 -76.2 123.4 17.8 77.2 -9.8 249 278 A R 0 0 159 -2,-0.4 -5,-0.2 -5,-0.2 -1,-0.2 -0.371 360.0 360.0 70.4 360.0 20.6 74.9 -8.5