==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN, TRANSFERASE 03-FEB-00 1EET . COMPND 2 MOLECULE: HIV-1 REVERSE TRANSCRIPTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR M.HOGBERG,C.SAHLBERG,P.ENGELHARDT,R.NOREEN,J.KANGASMETSA, . 941 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44495.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 580 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 127 13.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 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 . 44 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 243 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 2 2 1 1 1 1 0 2 1 2 1 3 1 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 0 4 1 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 PARALLEL BRIDGES PER LADDER . 6 2 5 2 3 6 2 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 . 3 1 4 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 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 1 A P 0 0 81 0, 0.0 2,-0.4 0, 0.0 202,-0.1 0.000 360.0 360.0 360.0-176.6 -32.5 153.4 186.7 2 2 A I - 0 0 61 200,-0.1 109,-0.2 134,-0.0 199,-0.1 -0.915 360.0-110.8-141.4 105.7 -34.0 149.9 186.7 3 3 A S - 0 0 3 107,-2.9 198,-0.2 198,-0.4 197,-0.1 -0.018 13.2-137.6 -41.3 133.1 -33.9 148.3 183.3 4 4 A P + 0 0 96 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.192 63.4 132.5 -79.2 17.7 -37.3 147.9 181.6 5 5 A I - 0 0 20 195,-0.3 146,-0.0 1,-0.1 195,-0.0 -0.458 68.6 -97.3 -76.2 140.3 -36.2 144.4 180.6 6 6 A E - 0 0 169 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.070 46.7-116.8 -46.6 156.9 -38.3 141.3 181.1 7 7 A T - 0 0 41 106,-0.1 106,-0.1 -3,-0.1 -1,-0.1 -0.739 18.0-113.3-103.5 154.6 -37.4 139.5 184.3 8 8 A V - 0 0 13 104,-0.4 106,-0.5 -2,-0.3 2,-0.1 -0.738 30.9-124.2 -87.6 121.1 -36.0 136.0 184.7 9 9 A P + 0 0 74 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.423 37.8 177.9 -63.6 130.9 -38.4 133.6 186.4 10 10 A V - 0 0 10 -2,-0.1 2,-0.3 104,-0.0 106,-0.0 -0.983 7.6-178.5-137.2 146.6 -36.7 132.0 189.3 11 11 A K - 0 0 138 -2,-0.3 67,-1.8 584,-0.1 2,-0.1 -0.839 29.3 -97.9-136.4 173.8 -37.9 129.6 192.0 12 12 A L B -A 77 0A 17 -2,-0.3 65,-0.3 65,-0.2 64,-0.1 -0.486 54.8 -77.8 -90.7 165.7 -36.7 127.8 195.1 13 13 A K > - 0 0 65 63,-2.3 3,-1.7 -2,-0.1 -1,-0.2 -0.254 61.6 -84.5 -61.1 153.0 -35.4 124.3 195.1 14 14 A P T 3 S+ 0 0 131 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.734 114.9 15.1 -19.2 -89.9 -38.0 121.4 195.1 15 15 A G T 3 S+ 0 0 81 2,-0.0 2,-0.3 0, 0.0 -2,-0.1 -0.178 106.3 101.8 -95.6 43.8 -39.2 120.7 198.6 16 16 A M < - 0 0 84 -3,-1.7 2,-0.3 -2,-0.3 -4,-0.1 -0.800 52.5-149.7-122.9 165.1 -37.9 123.8 200.2 17 17 A D - 0 0 62 -2,-0.3 3,-0.1 1,-0.2 -4,-0.1 -0.843 37.4 -70.6-129.6 164.9 -39.5 127.1 201.4 18 18 A G - 0 0 2 -2,-0.3 -1,-0.2 1,-0.1 2,-0.1 0.048 63.2 -86.4 -49.1 161.5 -38.3 130.7 201.8 19 19 A P - 0 0 0 0, 0.0 36,-1.4 0, 0.0 -1,-0.1 -0.387 34.4-174.4 -74.7 152.7 -35.8 131.6 204.5 20 20 A K B +b 55 0B 139 34,-0.3 2,-0.2 -3,-0.1 36,-0.2 -0.299 20.8 163.4-140.9 51.4 -37.0 132.5 208.0 21 21 A V - 0 0 44 34,-2.4 2,-0.2 1,-0.1 0, 0.0 -0.492 40.7-112.5 -76.7 141.9 -33.8 133.5 209.8 22 22 A K - 0 0 189 -2,-0.2 2,-1.0 1,-0.1 -1,-0.1 -0.524 25.9-123.0 -74.9 135.6 -34.1 135.4 213.1 23 23 A Q - 0 0 30 -2,-0.2 3,-0.1 34,-0.1 -1,-0.1 -0.701 26.6-140.0 -83.3 102.7 -32.8 139.0 213.0 24 24 A W - 0 0 193 -2,-1.0 34,-0.1 1,-0.1 -1,-0.0 -0.372 31.3 -93.1 -64.0 138.5 -30.1 139.3 215.7 25 25 A P - 0 0 91 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.182 42.7-161.3 -54.2 135.7 -30.2 142.6 217.7 26 26 A L - 0 0 26 -3,-0.1 2,-0.1 1,-0.1 33,-0.0 -0.723 19.8-103.8-115.1 166.8 -28.0 145.5 216.4 27 27 A T > - 0 0 60 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.334 34.5-104.4 -84.2 170.0 -26.8 148.6 218.2 28 28 A E H > S+ 0 0 163 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.882 120.3 58.9 -60.8 -39.4 -28.2 152.2 217.7 29 29 A E H > S+ 0 0 122 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.932 112.6 38.3 -54.2 -50.6 -25.1 153.0 215.5 30 30 A K H > S+ 0 0 70 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.888 112.8 55.4 -69.6 -42.6 -25.9 150.2 213.1 31 31 A I H X S+ 0 0 26 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.843 108.9 48.8 -60.7 -36.0 -29.7 150.7 213.2 32 32 A K H X S+ 0 0 131 -4,-2.2 4,-2.4 -5,-0.2 -1,-0.2 0.909 110.0 51.0 -71.2 -42.3 -29.4 154.3 212.2 33 33 A A H X S+ 0 0 7 -4,-1.5 4,-2.9 -5,-0.2 -2,-0.2 0.925 109.8 49.8 -59.5 -48.1 -27.0 153.6 209.3 34 34 A L H X S+ 0 0 0 -4,-2.4 4,-3.7 1,-0.2 5,-0.3 0.903 110.7 50.1 -59.0 -44.0 -29.4 150.9 207.9 35 35 A V H X S+ 0 0 45 -4,-1.7 4,-2.1 2,-0.2 5,-0.2 0.916 112.0 46.3 -62.9 -44.2 -32.3 153.3 208.0 36 36 A E H X S+ 0 0 106 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.958 118.0 45.1 -62.1 -48.4 -30.4 156.1 206.3 37 37 A I H X S+ 0 0 34 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.939 113.9 46.0 -59.7 -55.1 -29.2 153.6 203.7 38 38 A C H X S+ 0 0 0 -4,-3.7 4,-2.6 1,-0.2 -1,-0.2 0.840 110.7 54.2 -60.8 -34.0 -32.5 151.8 203.1 39 39 A T H X S+ 0 0 49 -4,-2.1 4,-1.8 -5,-0.3 -1,-0.2 0.961 107.2 50.3 -64.5 -48.2 -34.4 155.1 202.8 40 40 A E H X S+ 0 0 105 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.899 115.0 44.9 -53.4 -43.4 -32.0 156.3 200.1 41 41 A M H >X>S+ 0 0 28 -4,-2.0 5,-1.2 1,-0.2 6,-0.6 0.834 105.5 60.8 -70.6 -35.7 -32.6 153.0 198.3 42 42 A E H ><5S+ 0 0 69 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.870 99.4 56.7 -61.8 -36.8 -36.4 153.1 198.8 43 43 A K H 3<5S+ 0 0 147 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.778 107.3 48.0 -65.6 -29.1 -36.6 156.3 196.9 44 44 A E H <<5S- 0 0 104 -4,-0.6 -1,-0.2 -3,-0.6 -2,-0.2 0.470 115.0-113.1 -91.9 -3.3 -35.0 154.8 193.8 45 45 A G T <<5S+ 0 0 24 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.407 81.1 123.6 89.5 -2.7 -37.1 151.7 193.8 46 46 A K S + 0 0 4 -2,-1.1 4,-2.9 1,-0.2 5,-0.3 0.120 37.2 118.4 -92.4 20.7 -28.0 135.4 202.2 71 78 A R H > S+ 0 0 181 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.911 78.9 46.0 -55.3 -43.0 -26.7 132.0 203.2 72 79 A E H > S+ 0 0 50 -3,-0.4 4,-1.4 2,-0.2 3,-0.3 0.974 115.9 42.8 -63.8 -55.3 -30.1 130.6 203.9 73 80 A L H > S+ 0 0 0 1,-0.2 4,-0.9 -4,-0.2 3,-0.3 0.897 110.6 56.8 -57.8 -43.8 -31.8 131.9 200.8 74 81 A N H >< S+ 0 0 39 -4,-2.9 3,-0.6 1,-0.2 -1,-0.2 0.880 107.0 48.9 -57.2 -40.0 -28.9 130.9 198.6 75 82 A K H 3< S+ 0 0 120 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.813 115.3 44.7 -69.3 -29.9 -29.1 127.3 199.8 76 83 A R H 3< S+ 0 0 65 -4,-1.4 -63,-2.3 -3,-0.3 2,-0.3 0.463 95.8 97.0 -93.0 -2.7 -32.9 127.3 199.1 77 84 A T B << S-A 12 0A 0 -4,-0.9 -65,-0.2 -3,-0.6 -67,-0.0 -0.711 81.5-106.5 -90.4 139.6 -32.5 129.0 195.7 78 85 A Q - 0 0 20 -67,-1.8 2,-0.2 -2,-0.3 -1,-0.1 0.096 38.2 -95.1 -53.5 171.1 -32.5 126.9 192.6 79 86 A D - 0 0 65 516,-0.1 2,-0.3 -67,-0.1 -1,-0.1 -0.620 36.0-156.1 -91.2 151.5 -29.3 126.2 190.5 80 87 A F - 0 0 27 -2,-0.2 2,-0.3 517,-0.1 515,-0.2 -0.802 29.1 -93.5-121.2 164.3 -28.4 128.3 187.5 81 88 A W - 0 0 58 513,-1.9 517,-0.1 -2,-0.3 515,-0.0 -0.646 59.3 -88.5 -79.8 137.9 -26.3 127.5 184.4 82 89 A E - 0 0 134 -2,-0.3 -1,-0.1 515,-0.1 3,-0.1 -0.034 28.0-128.5 -45.6 141.9 -22.7 128.6 184.9 83 90 A V S S+ 0 0 55 1,-0.2 2,-0.3 -3,-0.1 -1,-0.1 0.797 89.0 9.6 -64.6 -31.8 -21.8 132.2 183.9 84 91 A Q - 0 0 48 1,-0.1 -1,-0.2 3,-0.0 3,-0.1 -0.986 50.8-151.2-153.7 140.2 -18.9 131.0 181.8 85 92 A L S S- 0 0 89 -2,-0.3 2,-0.3 597,-0.3 -1,-0.1 0.745 86.3 -28.2 -78.9 -24.8 -17.4 127.7 180.5 86 93 A G - 0 0 23 593,-0.1 -1,-0.2 592,-0.0 0, 0.0 -0.936 69.3 -91.2-169.0-172.9 -13.9 129.3 180.5 87 94 A I - 0 0 64 -2,-0.3 593,-0.1 -3,-0.1 592,-0.1 -0.965 44.2-105.3-121.0 136.2 -12.0 132.6 180.2 88 95 A P - 0 0 5 0, 0.0 591,-0.1 0, 0.0 282,-0.1 -0.273 32.1-134.6 -58.2 142.3 -10.7 133.9 176.9 89 96 A H > - 0 0 23 1,-0.1 3,-2.0 589,-0.1 4,-0.4 -0.842 11.2-129.2 -99.3 137.5 -7.0 133.5 176.5 90 97 A P G > S+ 0 0 0 0, 0.0 3,-3.0 0, 0.0 217,-0.4 0.919 106.8 61.6 -48.4 -49.8 -5.1 136.6 175.2 91 98 A A G 3 S+ 0 0 0 1,-0.3 216,-0.2 215,-0.1 247,-0.1 0.717 101.3 55.9 -52.1 -20.7 -3.3 134.5 172.5 92 99 A G G < S+ 0 0 1 -3,-2.0 -1,-0.3 214,-0.1 2,-0.1 0.527 87.3 101.0 -90.9 -6.5 -6.7 133.8 171.1 93 100 A L S < S- 0 0 40 -3,-3.0 214,-2.5 -4,-0.4 2,-0.2 -0.448 71.9-122.4 -78.8 150.4 -7.7 137.4 170.7 94 101 A K B -g 307 0E 60 212,-0.2 214,-0.1 -2,-0.1 2,-0.1 -0.551 37.3 -90.6 -87.9 156.4 -7.6 139.2 167.3 95 102 A K - 0 0 121 212,-0.6 2,-0.4 -2,-0.2 130,-0.1 -0.439 49.4-162.3 -64.6 141.3 -5.5 142.3 166.8 96 103 A K - 0 0 48 128,-1.4 84,-0.2 1,-0.1 3,-0.1 -0.993 23.0-158.4-134.1 139.7 -7.6 145.4 167.5 97 104 A K S S+ 0 0 118 82,-0.7 2,-0.4 -2,-0.4 83,-0.2 0.956 82.5 19.3 -77.4 -55.5 -7.2 149.1 166.6 98 105 A S E +H 179 0F 15 81,-2.3 81,-2.4 126,-0.1 2,-0.4 -0.971 65.6 172.5-123.7 133.6 -9.3 150.8 169.3 99 106 A V E +H 178 0F 27 -2,-0.4 113,-1.3 79,-0.2 2,-0.4 -0.995 1.9 176.3-142.1 132.9 -10.5 149.3 172.6 100 107 A T E -H 177 0F 2 77,-2.9 77,-2.9 -2,-0.4 2,-0.5 -0.986 20.8-137.9-136.8 145.9 -12.3 151.0 175.5 101 108 A V E -H 176 0F 3 -2,-0.4 110,-0.8 75,-0.2 109,-0.5 -0.919 15.4-172.4-111.9 123.6 -13.7 149.7 178.7 102 109 A L E -H 175 0F 1 73,-2.6 73,-1.7 -2,-0.5 2,-0.6 -0.934 11.1-152.1-108.3 126.9 -17.1 150.8 180.0 103 110 A D E -H 174 0F 62 -2,-0.5 71,-0.2 71,-0.2 2,-0.2 -0.888 20.9-119.5-110.0 120.7 -18.1 149.8 183.5 104 111 A V > - 0 0 3 69,-2.0 3,-1.0 -2,-0.6 100,-0.2 -0.300 21.9-131.5 -57.6 119.5 -21.9 149.4 184.3 105 112 A G T 3 S- 0 0 37 98,-2.1 -1,-0.1 1,-0.2 99,-0.1 0.831 88.0 -7.3 -35.4 -71.7 -22.9 151.8 187.1 106 113 A D T >> S- 0 0 97 1,-0.2 4,-1.4 97,-0.1 3,-0.6 -0.334 75.0-178.5-133.4 55.3 -24.9 149.6 189.4 107 114 A A G X4 S+ 0 0 4 -3,-1.0 3,-1.4 1,-0.2 -1,-0.2 0.679 77.7 34.0 -13.2 -83.2 -25.2 146.4 187.5 108 115 A Y G >4 S+ 0 0 63 1,-0.3 3,-1.6 2,-0.2 29,-1.2 0.855 116.9 52.5 -51.8 -48.7 -27.3 144.3 189.9 109 116 A F G <4 S+ 0 0 22 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.2 0.615 103.2 60.9 -69.0 -10.9 -29.4 147.1 191.3 110 117 A S G << S+ 0 0 2 -3,-1.4 -107,-2.9 -4,-1.4 -1,-0.3 0.251 92.6 77.6 -98.3 10.6 -30.4 148.2 187.8 111 118 A V S < S- 0 0 4 -3,-1.6 26,-1.7 -5,-0.2 37,-0.1 -0.980 81.5-122.1-125.8 126.2 -32.0 144.8 186.9 112 119 A P B -J 136 0G 14 0, 0.0 2,-0.4 0, 0.0 -104,-0.4 -0.251 19.8-132.4 -63.4 149.6 -35.5 143.8 188.1 113 120 A L - 0 0 2 22,-3.6 5,-0.2 -106,-0.1 -106,-0.1 -0.895 41.9 -83.5-106.6 133.2 -36.0 140.7 190.2 114 121 A D >> - 0 0 26 -106,-0.5 3,-3.5 -2,-0.4 4,-1.2 -0.054 40.3-132.3 -36.1 111.9 -38.8 138.3 189.3 115 122 A E T 34 S+ 0 0 143 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.747 104.5 54.5 -42.1 -33.7 -41.8 139.8 190.9 116 123 A D T 34 S+ 0 0 111 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.553 107.1 49.5 -84.0 -5.4 -42.8 136.4 192.4 117 124 A F T X4 S+ 0 0 1 -3,-3.5 3,-2.1 1,-0.1 4,-0.3 0.687 85.3 85.6-103.3 -21.8 -39.4 135.9 194.0 118 125 A R G >< S+ 0 0 43 -4,-1.2 3,-2.5 1,-0.3 16,-0.6 0.803 76.4 69.3 -48.0 -41.9 -39.0 139.2 195.9 119 126 A K G > S+ 0 0 98 -4,-0.4 3,-0.9 1,-0.3 -1,-0.3 0.764 95.3 57.0 -51.3 -28.7 -41.0 138.1 198.9 120 127 A Y G < S+ 0 0 43 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.622 96.8 62.6 -80.0 -13.3 -38.1 135.7 199.7 121 128 A T G < S+ 0 0 1 -3,-2.5 -1,-0.2 -4,-0.3 -2,-0.2 0.216 76.5 136.4 -95.9 15.5 -35.7 138.6 199.8 122 129 A A < + 0 0 1 -3,-0.9 -66,-0.9 11,-0.2 2,-0.3 -0.356 25.2 168.7 -65.9 137.3 -37.5 140.2 202.8 123 130 A F E -dE 56 132C 1 9,-2.7 9,-2.3 -68,-0.2 2,-0.3 -0.895 19.2-137.8-140.9 171.0 -35.4 141.5 205.6 124 131 A T E - E 0 131C 17 -68,-0.5 -66,-0.4 -2,-0.3 7,-0.2 -0.976 8.1-139.9-139.0 152.9 -36.0 143.7 208.7 125 132 A I E - E 0 130C 3 5,-2.5 5,-1.6 -2,-0.3 -94,-0.0 -0.948 31.7-144.7-110.7 113.6 -34.3 146.6 210.6 126 133 A P 0 0 26 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.193 360.0 360.0 -65.4-173.0 -34.6 146.1 214.4 127 134 A S 0 0 137 2,-0.1 -99,-0.1 -101,-0.0 -100,-0.0 -0.111 360.0 360.0-122.4 360.0 -35.0 148.6 217.3 128 ! 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 0.0 129 141 A G 0 0 88 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 145.7 -39.3 146.7 213.2 130 142 A I E - E 0 125C 68 -5,-1.6 -5,-2.5 -4,-0.2 2,-0.4 -0.724 360.0-154.1 -87.0 131.5 -39.2 148.1 209.6 131 143 A R E + E 0 124C 49 -81,-0.4 -81,-2.1 -2,-0.4 2,-0.3 -0.899 16.5 171.4-115.9 138.6 -39.5 145.5 206.9 132 144 A Y E -CE 49 123C 6 -9,-2.3 -9,-2.7 -2,-0.4 2,-0.3 -0.898 13.6-162.2-135.7 163.5 -38.4 145.6 203.2 133 145 A Q E -C 48 0C 40 -85,-1.5 -85,-2.1 -2,-0.3 2,-0.2 -0.968 29.0-104.2-143.7 155.0 -38.0 143.3 200.2 134 146 A Y E +C 47 0C 0 -16,-0.6 -87,-0.2 -2,-0.3 -13,-0.2 -0.538 24.0 179.2 -85.6 146.6 -36.0 143.6 197.0 135 147 A N S S+ 0 0 17 -89,-2.5 -22,-3.6 -2,-0.2 2,-0.2 0.512 76.3 46.3-114.0 -18.7 -37.3 144.5 193.6 136 148 A V B S-J 112 0G 0 -90,-1.0 -27,-0.2 -24,-0.3 -28,-0.1 -0.682 109.5 -65.2-117.3 172.9 -33.8 144.3 191.9 137 149 A L - 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0 0 3 -3,-1.1 2,-0.4 -10,-0.1 -1,-0.2 -0.348 21.5-163.5 -59.8 140.7 10.6 128.6 182.4 263 275 A K + 0 0 37 27,-0.2 31,-0.1 1,-0.1 4,-0.1 -0.992 28.4 160.1-132.9 137.8 11.5 125.7 184.7 264 276 A V > + 0 0 11 -2,-0.4 4,-2.6 2,-0.1 5,-0.2 0.225 45.0 106.2-139.9 16.3 10.2 124.8 188.1 265 277 A R H > S+ 0 0 93 2,-0.2 4,-1.7 1,-0.2 22,-0.1 0.925 85.6 46.2 -64.2 -46.5 10.9 121.1 188.6 266 278 A Q H > S+ 0 0 31 2,-0.2 4,-0.9 1,-0.2 21,-0.2 0.902 115.5 46.6 -63.5 -41.8 13.8 121.7 191.1 267 279 A L H >> S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.898 111.3 50.8 -67.5 -42.5 11.7 124.2 193.0 268 280 A C H 3< S+ 0 0 53 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.814 100.3 65.6 -66.0 -28.5 8.6 122.0 193.1 269 281 A K H >< S+ 0 0 80 -4,-1.7 3,-1.3 1,-0.2 -1,-0.2 0.884 97.6 55.0 -59.9 -38.1 10.8 119.1 194.4 270 282 A L H << S+ 0 0 31 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.870 97.3 62.4 -63.2 -40.0 11.4 121.1 197.6 271 283 A L T 3< S+ 0 0 50 -4,-0.9 2,-0.3 -3,-0.2 -1,-0.3 0.325 81.4 116.1 -70.9 10.7 7.7 121.6 198.4 272 284 A R < + 0 0 171 -3,-1.3 -3,-0.0 2,-0.1 -4,-0.0 -0.631 55.0 38.8 -86.1 139.0 7.3 117.8 198.7 273 285 A G S S- 0 0 59 -2,-0.3 0, 0.0 2,-0.0 0, 0.0 0.612 102.9 -71.3 93.2 115.1 6.3 116.2 202.0 274 286 A T S S+ 0 0 157 1,-0.1 2,-0.3 0, 0.0 -2,-0.1 -0.012 72.7 165.3 -33.6 119.2 3.8 117.7 204.4 275 287 A K - 0 0 121 -4,-0.1 4,-0.1 4,-0.0 -1,-0.1 -0.963 41.1 -84.7-157.7 139.5 5.5 120.7 205.8 276 288 A A > - 0 0 48 -2,-0.3 3,-1.2 1,-0.1 -34,-0.5 0.077 30.4-136.3 -35.8 130.3 5.0 123.9 207.8 277 289 A L T 3 S+ 0 0 94 1,-0.3 -34,-2.0 -35,-0.1 -33,-0.2 0.757 105.2 41.5 -63.7 -27.9 3.9 126.9 205.7 278 290 A T T 3 S+ 0 0 120 -36,-0.2 -1,-0.3 -37,-0.1 2,-0.3 0.280 90.2 119.8-104.7 10.4 6.3 129.3 207.6 279 291 A E < - 0 0 64 -3,-1.2 -37,-1.5 1,-0.1 2,-0.3 -0.548 65.2-118.2 -82.8 139.8 9.2 126.8 207.6 280 292 A V B -N 241 0I 72 -2,-0.3 -39,-0.3 -39,-0.2 -1,-0.1 -0.547 24.4-163.9 -76.8 135.5 12.6 127.6 206.0 281 293 A I - 0 0 22 -41,-3.0 -41,-0.2 -2,-0.3 2,-0.2 -0.978 17.6-132.5-122.4 115.8 13.6 125.3 203.2 282 294 A P - 0 0 103 0, 0.0 2,-0.2 0, 0.0 -43,-0.1 -0.505 25.4-122.4 -69.0 134.0 17.3 125.4 202.2 283 295 A L - 0 0 31 -2,-0.2 2,-0.2 4,-0.1 -16,-0.1 -0.549 22.0-138.0 -77.7 142.4 17.7 125.7 198.4 284 296 A T > - 0 0 54 -2,-0.2 4,-2.6 -18,-0.1 5,-0.2 -0.485 28.0-102.1 -92.5 167.7 19.7 122.9 196.7 285 297 A E H > S+ 0 0 125 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.929 123.9 50.6 -55.3 -47.3 22.2 123.5 193.9 286 298 A E H > S+ 0 0 96 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.904 112.9 45.4 -58.3 -43.3 19.8 122.3 191.3 287 299 A A H > S+ 0 0 0 -21,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.857 111.6 54.8 -67.8 -34.7 17.1 124.6 192.7 288 300 A E H X S+ 0 0 88 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.917 111.0 43.3 -63.2 -46.3 19.7 127.4 192.8 289 301 A L H X S+ 0 0 96 -4,-2.9 4,-3.6 2,-0.2 -2,-0.2 0.904 114.1 51.2 -66.4 -42.7 20.6 127.0 189.2 290 302 A E H X S+ 0 0 6 -4,-2.4 4,-2.7 -5,-0.2 -27,-0.2 0.944 110.1 47.7 -60.4 -49.8 16.9 126.7 188.2 291 303 A L H X S+ 0 0 3 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.862 114.2 51.1 -59.7 -33.8 16.0 129.9 190.1 292 304 A A H X S+ 0 0 51 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.976 107.8 48.3 -67.7 -57.8 19.0 131.4 188.3 293 305 A E H X S+ 0 0 96 -4,-3.6 4,-2.5 1,-0.2 -2,-0.2 0.912 112.3 51.4 -48.5 -48.2 18.0 130.4 184.8 294 306 A N H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.917 105.9 52.7 -57.8 -46.1 14.5 131.7 185.4 295 307 A R H X S+ 0 0 82 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.919 109.6 52.1 -55.4 -41.6 15.8 135.1 186.6 296 308 A E H >X S+ 0 0 111 -4,-2.3 3,-0.9 1,-0.2 4,-0.6 0.955 109.7 47.2 -56.9 -54.5 17.8 135.2 183.4 297 309 A I H 3< S+ 0 0 38 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.871 112.9 50.5 -56.7 -39.4 14.7 134.5 181.3 298 310 A L H 3< S+ 0 0 25 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.644 88.1 82.6 -78.7 -14.1 12.7 137.0 183.1 299 311 A K H << S+ 0 0 129 -4,-1.2 -1,-0.2 -3,-0.9 -2,-0.1 0.921 87.9 51.7 -58.1 -49.8 15.1 140.0 182.9 300 312 A E S < S- 0 0 129 -4,-0.6 -1,-0.1 -3,-0.3 0, 0.0 -0.807 96.0-111.2 -96.9 121.9 14.2 141.1 179.4 301 313 A P - 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