==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-FEB-04 1S9E . COMPND 2 MOLECULE: POL POLYPROTEIN [CONTAINS:REVERSE TRANSCRIPTASE]; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR K.DAS,A.D.CLARK JR.,D.W.LUDOVICI,M.J.KUKLA,B.DECORTE, . 979 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49053.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 601 61.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 123 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 58 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 237 24.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 6 1 1 2 1 0 1 1 1 0 1 4 3 1 1 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 5 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 PARALLEL BRIDGES PER LADDER . 7 2 6 3 4 2 3 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 2 2 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 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 76 0, 0.0 2,-0.3 0, 0.0 214,-0.1 0.000 360.0 360.0 360.0 -41.0 170.8 -17.6 77.2 2 2 A I - 0 0 61 212,-0.1 211,-0.2 146,-0.0 116,-0.2 -0.977 360.0-146.1-133.0 145.7 170.5 -14.2 75.4 3 3 A S - 0 0 13 114,-1.9 209,-0.1 -2,-0.3 210,-0.1 -0.611 28.7-114.6-118.2 171.6 169.5 -13.5 71.8 4 4 A P + 0 0 100 0, 0.0 2,-0.1 0, 0.0 114,-0.1 -0.108 67.1 143.1 -87.0 30.2 170.0 -11.3 68.7 5 5 A I - 0 0 18 207,-0.1 2,-0.2 1,-0.1 158,-0.0 -0.438 58.5-110.7 -69.8 150.1 166.4 -10.2 69.2 6 6 A E - 0 0 156 -2,-0.1 2,-0.3 157,-0.1 -1,-0.1 -0.562 35.3-118.3 -80.5 150.0 165.9 -6.6 68.3 7 7 A T - 0 0 51 -2,-0.2 113,-0.1 113,-0.1 -1,-0.1 -0.673 12.0-127.2 -94.3 149.0 165.2 -4.4 71.4 8 8 A V - 0 0 16 111,-0.3 113,-0.5 -2,-0.3 151,-0.0 -0.807 34.0-119.3 -85.8 124.3 162.0 -2.4 71.9 9 9 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 597,-0.1 -0.383 37.3-160.6 -66.0 139.9 163.0 1.2 72.6 10 10 A V - 0 0 13 111,-0.1 2,-0.3 -2,-0.0 113,-0.0 -0.712 11.5-164.0-121.7 171.9 161.9 2.3 76.0 11 11 A K - 0 0 154 -2,-0.2 74,-3.1 113,-0.0 2,-0.3 -0.999 20.0-125.3-153.4 153.5 161.2 5.4 78.0 12 12 A L B -A 84 0A 25 -2,-0.3 72,-0.3 72,-0.3 69,-0.1 -0.732 57.9 -78.5 -94.9 148.2 160.7 6.9 81.4 13 13 A K > - 0 0 58 70,-3.5 3,-0.7 -2,-0.3 -1,-0.1 -0.246 61.9 -91.0 -49.6 135.3 157.5 9.0 82.0 14 14 A P T 3 S+ 0 0 144 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.516 117.1 21.1 -11.0 -64.3 158.0 12.5 80.5 15 15 A G T 3 S+ 0 0 77 2,-0.0 -2,-0.1 0, 0.0 -3,-0.0 0.842 105.9 91.0 -88.1 -36.7 159.4 14.5 83.4 16 16 A M < - 0 0 86 -3,-0.7 2,-0.3 67,-0.1 -4,-0.1 0.362 52.2-163.7 -50.7-179.4 160.8 11.7 85.6 17 17 A D - 0 0 67 1,-0.1 -4,-0.1 110,-0.0 -1,-0.1 -0.957 38.8 -41.4-162.2 169.3 164.2 10.1 85.8 18 18 A G - 0 0 6 -2,-0.3 2,-0.3 1,-0.1 39,-0.1 0.100 62.9 -98.3 -42.1 146.3 166.0 7.1 87.1 19 19 A P - 0 0 0 0, 0.0 38,-1.4 0, 0.0 2,-0.5 -0.488 30.5-171.8 -71.8 126.9 165.3 5.5 90.6 20 20 A K B +b 57 0B 134 36,-0.4 2,-0.4 -2,-0.3 38,-0.1 -0.650 30.0 140.1-117.7 73.6 167.7 6.5 93.3 21 21 A V - 0 0 36 36,-1.3 2,-0.2 -2,-0.5 58,-0.0 -0.923 31.8-158.2-113.2 142.0 166.7 4.2 96.3 22 22 A K + 0 0 96 -2,-0.4 2,-0.1 35,-0.1 -2,-0.0 -0.651 21.5 173.2-116.9 174.3 169.4 2.6 98.5 23 23 A Q + 0 0 60 -2,-0.2 37,-0.3 35,-0.1 108,-0.1 -0.501 9.4 166.8-178.9 99.5 169.6 -0.4 100.9 24 24 A W + 0 0 126 -2,-0.1 114,-0.1 108,-0.1 108,-0.0 0.128 26.8 124.3-115.8 20.7 173.0 -1.1 102.2 25 25 A P - 0 0 96 0, 0.0 2,-0.4 0, 0.0 111,-0.1 -0.353 48.9-141.4 -73.8 166.3 172.7 -3.6 105.1 26 26 A L - 0 0 41 109,-0.1 2,-1.2 106,-0.1 3,-0.1 -0.874 25.6-172.5-143.1 112.5 174.7 -6.8 104.7 27 27 A T >> - 0 0 77 -2,-0.4 3,-3.6 1,-0.2 4,-0.5 -0.535 26.3-151.8 -93.9 62.7 173.9 -10.5 105.6 28 28 A E H 3> S+ 0 0 138 -2,-1.2 4,-2.0 1,-0.3 5,-0.2 0.539 94.2 53.5 5.1 -60.6 177.5 -11.6 104.8 29 29 A E H 34 S+ 0 0 102 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.955 113.9 41.5 -56.3 -50.2 176.1 -15.0 104.0 30 30 A K H X> S+ 0 0 81 -3,-3.6 4,-3.1 2,-0.2 3,-2.4 0.943 105.7 62.0 -64.7 -47.4 173.6 -13.5 101.6 31 31 A I H 3X S+ 0 0 19 -4,-0.5 4,-3.0 1,-0.3 -1,-0.2 0.914 111.3 41.2 -43.5 -45.9 176.1 -11.0 100.1 32 32 A K H 3X S+ 0 0 80 -4,-2.0 4,-0.8 -5,-0.2 -1,-0.3 0.597 110.5 60.6 -76.6 -12.2 178.1 -14.1 99.0 33 33 A A H <> S+ 0 0 2 -3,-2.4 4,-1.5 -4,-0.4 -2,-0.2 0.928 113.1 34.8 -78.5 -46.3 174.7 -15.5 98.1 34 34 A L H X S+ 0 0 10 -4,-3.1 4,-2.9 2,-0.2 3,-0.3 0.978 113.6 56.6 -69.4 -57.6 174.1 -12.7 95.6 35 35 A V H X S+ 0 0 48 -4,-3.0 4,-2.9 1,-0.3 5,-0.3 0.848 106.5 52.3 -41.1 -44.2 177.7 -12.3 94.4 36 36 A E H X S+ 0 0 100 -4,-0.8 4,-2.2 -5,-0.2 -1,-0.3 0.969 112.9 45.1 -57.1 -52.0 177.7 -15.9 93.5 37 37 A I H X S+ 0 0 45 -4,-1.5 4,-0.6 -3,-0.3 -2,-0.2 0.932 114.3 46.9 -56.4 -54.2 174.5 -15.3 91.4 38 38 A C H >X S+ 0 0 0 -4,-2.9 4,-4.1 1,-0.2 3,-1.5 0.936 110.5 52.6 -57.7 -46.9 175.8 -12.1 89.8 39 39 A T H 3X S+ 0 0 51 -4,-2.9 4,-1.5 1,-0.3 -1,-0.2 0.890 112.9 44.4 -58.3 -37.8 179.1 -13.7 88.9 40 40 A E H 3< S+ 0 0 98 -4,-2.2 4,-0.5 -5,-0.3 -1,-0.3 0.577 119.5 45.8 -81.2 -4.5 177.2 -16.5 87.3 41 41 A M H <<>S+ 0 0 33 -3,-1.5 5,-1.2 -4,-0.6 6,-0.8 0.758 112.3 44.7-104.3 -36.8 175.0 -13.9 85.7 42 42 A E H ><5S+ 0 0 62 -4,-4.1 3,-0.8 2,-0.2 -3,-0.2 0.849 111.4 56.7 -73.9 -35.7 177.5 -11.4 84.5 43 43 A K T 3<5S+ 0 0 165 -4,-1.5 -1,-0.2 -5,-0.5 -2,-0.2 0.962 109.5 45.2 -57.0 -49.5 179.4 -14.3 83.2 44 44 A E T 3 5S- 0 0 99 -4,-0.5 -1,-0.3 -5,-0.1 -2,-0.2 0.538 116.9-120.6 -70.7 -9.9 176.3 -15.2 81.2 45 45 A G T < 5S+ 0 0 25 -3,-0.8 -3,-0.2 -4,-0.2 -2,-0.1 0.306 79.2 121.2 89.0 -11.3 175.9 -11.6 80.2 46 46 A K S + 0 0 46 -17,-1.8 3,-0.5 -2,-0.3 4,-0.1 -0.822 25.9 171.8-105.0 98.4 162.5 -4.2 93.9 77 77 A F T >> + 0 0 4 -2,-0.9 4,-3.4 1,-0.2 3,-1.1 0.324 39.9 119.3 -87.7 10.2 161.7 -2.1 90.9 78 78 A R H 3> S+ 0 0 176 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.707 82.2 43.0 -47.4 -23.2 158.6 -0.6 92.5 79 79 A E H <4 S+ 0 0 53 -3,-0.5 -1,-0.3 2,-0.2 -2,-0.1 0.721 113.4 48.8 -97.1 -26.4 160.3 2.8 92.1 80 80 A L H X> S+ 0 0 0 -3,-1.1 3,-1.8 2,-0.1 4,-0.6 0.916 112.2 50.8 -75.0 -45.7 161.6 2.3 88.6 81 81 A N H >< S+ 0 0 36 -4,-3.4 3,-2.6 1,-0.3 -2,-0.2 0.960 100.0 60.9 -53.3 -56.8 158.3 1.1 87.5 82 82 A K T 3< S+ 0 0 114 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.1 0.459 112.4 44.0 -53.5 5.4 156.5 4.1 88.9 83 83 A R T <4 S+ 0 0 61 -3,-1.8 -70,-3.5 2,-0.1 2,-0.3 0.498 92.7 94.6-128.8 -6.3 158.7 5.9 86.4 84 84 A T B << S-A 12 0A 0 -3,-2.6 -72,-0.3 -4,-0.6 -67,-0.0 -0.670 77.3-101.2 -94.3 144.0 158.5 3.9 83.2 85 85 A Q - 0 0 31 -74,-3.1 2,-0.2 -2,-0.3 -1,-0.1 0.073 42.2 -94.7 -51.7 167.1 156.1 4.5 80.3 86 86 A D - 0 0 66 520,-0.1 2,-0.3 69,-0.0 523,-0.1 -0.638 39.5-153.3 -86.2 145.4 152.9 2.5 79.7 87 87 A F - 0 0 26 -2,-0.2 519,-0.2 521,-0.1 3,-0.1 -0.834 33.1 -77.0-119.9 158.1 152.9 -0.5 77.3 88 88 A W - 0 0 45 517,-3.0 521,-0.1 -2,-0.3 -1,-0.1 -0.264 64.1-101.6 -53.1 131.7 150.4 -2.2 75.2 89 89 A E - 0 0 96 519,-0.2 -1,-0.1 1,-0.1 -3,-0.0 0.246 25.4-133.5 -46.9 174.8 148.2 -4.4 77.5 90 90 A V S S- 0 0 87 -3,-0.1 2,-0.2 1,-0.1 3,-0.1 0.884 77.8 -13.2-100.0 -80.6 148.6 -8.2 77.9 91 91 A Q - 0 0 67 1,-0.1 3,-0.1 602,-0.1 -1,-0.1 -0.652 60.8-177.5-130.3 70.1 145.5 -10.3 77.8 92 92 A L S S+ 0 0 85 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.737 81.6 18.4 -41.0 -27.2 142.8 -7.7 78.1 93 93 A G S S- 0 0 29 597,-0.1 -1,-0.2 -3,-0.1 3,-0.1 -0.925 84.3-124.9-152.4 124.4 140.4 -10.7 78.0 94 94 A I - 0 0 75 -2,-0.3 597,-0.1 -3,-0.1 596,-0.1 -0.539 36.7-111.5 -71.4 122.3 141.2 -14.4 78.7 95 95 A P - 0 0 5 0, 0.0 595,-0.1 0, 0.0 -1,-0.1 -0.178 30.9-123.6 -54.0 140.7 140.1 -16.7 75.8 96 96 A H > - 0 0 24 593,-0.2 3,-1.7 1,-0.1 4,-0.2 -0.729 4.7-139.9 -92.8 135.8 137.2 -18.9 76.7 97 97 A P G > S+ 0 0 0 0, 0.0 3,-3.1 0, 0.0 222,-0.2 0.892 97.3 73.4 -55.6 -46.4 137.6 -22.7 76.2 98 98 A A G 3 S+ 0 0 0 1,-0.3 219,-0.0 220,-0.1 252,-0.0 0.706 105.8 41.0 -41.9 -23.5 134.1 -23.1 74.9 99 99 A G G < S+ 0 0 8 -3,-1.7 -1,-0.3 219,-0.1 219,-0.1 0.389 90.9 103.3-109.0 -2.6 135.7 -21.5 71.7 100 100 A L S < S- 0 0 45 -3,-3.1 219,-1.9 -4,-0.2 2,-0.4 -0.342 72.7-111.0 -73.0 166.4 139.0 -23.2 71.6 101 101 A K - 0 0 113 217,-0.2 219,-0.1 1,-0.1 -1,-0.1 -0.858 28.3 -94.4-111.9 143.9 139.5 -26.0 69.0 102 102 A K - 0 0 96 -2,-0.4 2,-0.3 217,-0.3 135,-0.2 -0.064 44.7-179.5 -49.4 133.5 139.9 -29.7 69.3 103 103 A K - 0 0 18 133,-1.1 89,-0.2 1,-0.1 3,-0.1 -0.947 30.3-149.1-138.1 157.8 143.4 -31.2 69.3 104 104 A K S S+ 0 0 95 87,-2.6 2,-0.5 1,-0.3 88,-0.2 0.934 86.7 22.8 -88.3 -57.6 145.1 -34.5 69.6 105 105 A S E -F 191 0E 19 86,-1.5 86,-3.1 88,-0.2 2,-0.4 -0.938 63.3-177.1-119.6 130.3 148.4 -33.7 71.3 106 106 A V E -F 190 0E 39 -2,-0.5 2,-0.3 84,-0.3 84,-0.3 -0.984 6.3-176.8-126.1 133.2 149.0 -30.7 73.5 107 107 A T E -F 189 0E 26 82,-4.2 82,-3.6 -2,-0.4 2,-0.5 -0.948 14.3-149.1-130.4 150.5 152.4 -29.9 75.0 108 108 A V E -F 188 0E 34 -2,-0.3 2,-0.3 80,-0.3 80,-0.2 -0.958 8.9-161.5-125.0 121.3 153.6 -27.2 77.4 109 109 A L E -F 187 0E 8 78,-2.8 78,-1.3 -2,-0.5 2,-0.9 -0.691 26.1-117.8 -94.5 148.0 157.1 -25.8 77.3 110 110 A D E +F 186 0E 72 107,-0.5 76,-0.2 -2,-0.3 3,-0.1 -0.786 36.2 169.7 -91.1 106.9 158.6 -23.9 80.3 111 111 A V + 0 0 6 74,-1.4 4,-0.4 -2,-0.9 75,-0.2 -0.200 40.2 116.8-103.6 33.7 159.3 -20.4 79.0 112 112 A G S > S+ 0 0 3 73,-0.4 3,-0.9 1,-0.2 -1,-0.1 1.000 73.1 39.7 -68.4 -71.5 160.0 -19.2 82.6 113 113 A D G > S+ 0 0 117 1,-0.2 3,-0.9 -3,-0.1 4,-0.3 0.510 94.0 106.1 -62.0 4.1 163.7 -18.1 82.7 114 114 A A G >> + 0 0 4 1,-0.2 3,-3.4 2,-0.2 4,-0.8 0.860 59.8 62.3 -49.7 -57.3 162.9 -16.8 79.2 115 115 A Y G X4 S+ 0 0 37 -3,-0.9 34,-1.3 -4,-0.4 3,-1.1 0.818 94.4 63.2 -50.3 -32.1 162.8 -13.0 79.7 116 116 A F G <4 S+ 0 0 23 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.711 99.8 58.2 -64.9 -13.9 166.5 -12.9 80.9 117 117 A S G <4 S+ 0 0 5 -3,-3.4 -114,-1.9 -4,-0.3 -1,-0.3 0.761 90.8 85.3 -82.2 -27.8 167.1 -14.1 77.3 118 118 A V S << S- 0 0 2 -3,-1.1 31,-0.7 -4,-0.8 42,-0.1 -0.655 84.3-115.5 -86.4 132.4 165.5 -11.1 75.8 119 119 A P B -H 148 0F 9 0, 0.0 2,-0.5 0, 0.0 -111,-0.3 -0.076 18.9-132.8 -57.6 151.3 167.5 -7.9 75.3 120 120 A L - 0 0 0 27,-1.7 2,-0.3 -113,-0.1 5,-0.2 -0.948 38.6 -92.9-114.6 131.1 166.8 -4.7 77.1 121 121 A D >> - 0 0 21 -113,-0.5 3,-3.7 -2,-0.5 4,-0.7 -0.121 41.5-131.4 -44.5 96.9 166.8 -1.5 75.1 122 122 A E H >> S+ 0 0 109 1,-0.3 3,-3.2 -2,-0.3 4,-0.5 0.686 101.0 53.0 -11.6 -78.1 170.4 -0.5 75.6 123 123 A D H 34 S+ 0 0 111 1,-0.3 -1,-0.3 2,-0.2 3,-0.3 0.686 105.7 54.3 -41.6 -30.5 169.6 3.1 76.6 124 124 A F H X> S+ 0 0 3 -3,-3.7 3,-1.5 1,-0.2 4,-0.6 0.645 87.2 81.2 -84.4 -12.9 167.2 2.1 79.3 125 125 A R H XX S+ 0 0 35 -3,-3.2 3,-2.4 -4,-0.7 4,-0.5 0.903 73.2 75.4 -57.2 -44.3 169.7 -0.1 81.0 126 126 A K H 3< S+ 0 0 78 -4,-0.5 -70,-0.5 1,-0.3 3,-0.4 0.725 97.3 49.5 -42.3 -26.1 171.4 2.7 82.8 127 127 A Y H <4 S+ 0 0 41 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.767 92.2 73.0 -87.9 -26.0 168.4 2.8 85.1 128 128 A T H << + 0 0 0 -3,-2.4 -1,-0.2 -4,-0.6 -2,-0.2 0.588 69.5 134.9 -66.2 -5.8 168.3 -0.8 85.9 129 129 A A < + 0 0 0 -4,-0.5 16,-0.3 -3,-0.4 2,-0.2 -0.161 27.3 173.8 -52.2 117.0 171.4 -0.3 88.1 130 130 A F E -D 144 0C 0 14,-2.0 14,-0.9 -73,-0.2 2,-0.4 -0.614 21.3-137.6-112.3 177.4 171.2 -2.0 91.5 131 131 A T E -D 143 0C 15 -73,-0.8 -71,-0.3 -2,-0.2 12,-0.2 -0.933 3.7-154.8-146.2 115.2 174.2 -2.2 94.0 132 132 A I E -D 142 0C 0 10,-2.2 10,-0.7 -2,-0.4 2,-0.2 -0.822 27.5-129.0 -91.9 113.9 175.2 -5.3 96.0 133 133 A P - 0 0 20 0, 0.0 2,-0.6 0, 0.0 -2,-0.0 -0.422 8.3-130.4 -68.4 132.0 177.0 -4.1 99.2 134 134 A S > - 0 0 45 -2,-0.2 5,-0.5 1,-0.1 4,-0.5 -0.767 47.3 -94.9 -80.4 122.0 180.3 -5.6 100.0 135 135 A I T 5S- 0 0 61 -2,-0.6 -107,-0.1 -107,-0.1 -109,-0.1 0.387 82.6 -30.1 -10.4 -57.7 179.9 -6.6 103.7 136 136 A N T 5S+ 0 0 117 -111,-0.1 2,-1.1 -108,-0.0 -1,-0.1 0.583 100.7 81.3-138.9 -65.2 181.3 -3.7 105.8 137 137 A N T 5S- 0 0 142 1,-0.2 -2,-0.1 0, 0.0 -1,-0.0 0.494 98.5-105.7 -32.2 -4.5 184.1 -1.2 105.2 138 138 A E T 5 - 0 0 141 -2,-1.1 -1,-0.2 -4,-0.5 -3,-0.1 0.981 61.0-175.6 65.3 66.7 181.6 0.9 103.2 139 139 A T < - 0 0 47 -5,-0.5 -5,-0.0 1,-0.0 0, 0.0 -0.137 44.9 -82.8 -85.7-174.1 183.5 -0.3 100.1 140 140 A P S S- 0 0 135 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.868 70.1-126.4 -63.7 -27.4 182.8 0.8 96.5 141 141 A G - 0 0 14 -10,-0.0 2,-0.3 2,-0.0 -9,-0.1 0.680 19.1 -94.5 86.8 112.2 180.1 -1.8 96.4 142 142 A I E - D 0 132C 31 -10,-0.7 -10,-2.2 -11,-0.1 2,-0.4 -0.419 57.5-162.0 -59.5 116.2 180.0 -4.4 93.7 143 143 A R E - D 0 131C 38 -2,-0.3 -93,-2.6 -93,-0.3 2,-0.3 -0.910 14.8-174.1-119.2 136.1 177.6 -2.8 91.2 144 144 A Y E -CD 49 130C 2 -14,-0.9 -14,-2.0 -2,-0.4 2,-0.4 -0.822 16.1-159.8-124.9 161.4 175.5 -3.9 88.2 145 145 A Q E -C 48 0C 35 -97,-1.9 -97,-2.1 -2,-0.3 2,-0.2 -0.965 33.4-113.8-131.2 138.9 173.2 -2.8 85.4 146 146 A Y E -C 47 0C 8 -21,-0.5 -99,-0.3 -2,-0.4 -18,-0.2 -0.507 24.3-177.5 -79.5 146.3 170.8 -5.2 83.6 147 147 A N S S+ 0 0 23 -101,-3.1 -27,-1.7 -2,-0.2 -100,-0.2 0.439 72.2 36.4-116.0 -9.6 171.2 -6.2 80.0 148 148 A V B S-H 119 0F 0 -102,-0.9 -32,-0.2 -29,-0.2 -31,-0.1 -0.405 110.9 -49.6-125.2-154.2 168.0 -8.3 79.8 149 149 A L - 0 0 0 -34,-1.3 -31,-0.1 -31,-0.7 -32,-0.1 -0.684 54.6-133.7 -96.0 104.0 164.6 -8.2 81.1 150 150 A P - 0 0 0 0, 0.0 6,-0.1 0, 0.0 -35,-0.0 -0.056 16.3-125.6 -42.5 139.6 164.6 -7.6 84.9 151 151 A Q S S+ 0 0 91 1,-0.2 5,-0.0 5,-0.1 -2,-0.0 0.817 106.1 38.9 -64.8 -29.4 162.2 -10.0 86.7 152 152 A G S S+ 0 0 38 4,-0.1 -1,-0.2 3,-0.0 4,-0.1 0.940 87.1 117.0 -86.8 -44.9 160.4 -7.1 88.4 153 153 A W > - 0 0 3 2,-0.1 3,-0.9 1,-0.1 -75,-0.1 0.430 65.8-122.9 -28.0 149.4 160.2 -4.3 85.8 154 154 A K T 3 S+ 0 0 63 1,-0.2 4,-0.4 -77,-0.2 -1,-0.1 0.941 105.0 44.7 -64.8 -50.8 157.0 -2.9 84.3 155 155 A G T 3> S+ 0 0 0 1,-0.2 4,-1.9 2,-0.1 5,-0.2 0.254 87.8 92.3 -85.5 17.0 157.7 -3.5 80.7 156 156 A S H <> S+ 0 0 6 -3,-0.9 4,-1.9 2,-0.2 5,-0.2 0.954 82.1 48.5 -76.7 -50.3 158.9 -7.1 80.9 157 157 A P H > S+ 0 0 77 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.952 120.8 41.2 -54.0 -44.5 155.9 -9.1 80.4 158 158 A A H > S+ 0 0 13 -4,-0.4 4,-3.6 2,-0.2 5,-0.2 0.998 113.2 47.7 -61.7 -74.4 155.0 -7.0 77.4 159 159 A I H X S+ 0 0 3 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.782 117.5 50.9 -39.7 -29.3 158.5 -6.6 75.7 160 160 A F H X S+ 0 0 20 -4,-1.9 4,-2.9 -5,-0.2 5,-0.3 0.987 109.6 42.4 -76.0 -69.0 158.6 -10.3 76.3 161 161 A Q H X S+ 0 0 38 -4,-3.0 4,-2.6 -5,-0.2 5,-0.2 0.862 115.8 55.8 -45.5 -40.1 155.3 -11.5 74.8 162 162 A S H >X S+ 0 0 29 -4,-3.6 4,-1.5 -5,-0.2 3,-0.9 0.984 110.8 40.1 -53.4 -75.1 156.1 -9.1 72.1 163 163 A S H 3X S+ 0 0 5 -4,-2.0 4,-1.9 1,-0.3 -2,-0.2 0.851 115.0 52.2 -39.9 -49.5 159.5 -10.6 71.3 164 164 A M H 3X S+ 0 0 2 -4,-2.9 4,-1.7 1,-0.2 -1,-0.3 0.910 105.0 55.9 -60.0 -41.0 158.2 -14.2 71.7 165 165 A T H > S+ 0 0 66 0, 0.0 4,-1.8 0, 0.0 3,-0.9 0.962 119.2 41.7 -50.8 -61.5 157.8 -17.7 61.0 171 171 A F H 3< S+ 0 0 17 -4,-0.6 4,-0.4 1,-0.3 -2,-0.2 0.927 112.9 56.0 -45.7 -52.0 157.5 -21.1 62.6 172 172 A K H >< S+ 0 0 100 -4,-3.0 3,-0.6 2,-0.2 -1,-0.3 0.855 109.7 46.6 -50.2 -40.8 153.8 -20.3 63.1 173 173 A K H << S+ 0 0 171 -4,-2.8 -2,-0.2 -3,-0.9 -1,-0.2 1.000 109.8 48.9 -65.0 -69.8 153.5 -19.8 59.3 174 174 A Q T 3< S+ 0 0 149 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.424 121.5 41.6 -53.4 4.6 155.3 -22.8 58.1 175 175 A N X + 0 0 16 -3,-0.6 3,-1.2 -4,-0.4 -1,-0.3 -0.341 61.3 162.7-153.7 67.0 153.1 -24.8 60.5 176 176 A P T 3 S+ 0 0 102 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.764 70.6 68.8 -58.8 -28.1 149.5 -23.6 60.6 177 177 A D T 3 S+ 0 0 60 1,-0.1 2,-0.7 2,-0.1 -5,-0.1 0.838 83.7 87.6 -61.8 -30.6 148.2 -26.8 62.3 178 178 A I < - 0 0 7 -3,-1.2 2,-0.5 -6,-0.1 13,-0.2 -0.589 65.9-153.9 -80.0 108.7 150.0 -25.9 65.5 179 179 A V E -G 190 0E 73 11,-1.6 11,-2.3 -2,-0.7 2,-0.6 -0.655 13.4-169.9 -79.4 127.5 148.2 -23.7 68.0 180 180 A I E +G 189 0E 30 -2,-0.5 2,-0.5 9,-0.2 9,-0.2 -0.924 12.8 165.9-122.5 107.1 150.7 -21.9 70.1 181 181 A Y E -G 188 0E 48 7,-1.2 7,-3.5 -2,-0.6 2,-0.3 -0.980 16.4-160.7-120.4 130.2 149.4 -20.0 73.1 182 182 A Q E -G 187 0E 27 -2,-0.5 5,-0.3 5,-0.3 2,-0.3 -0.848 6.5-172.9-107.1 147.2 151.7 -18.7 75.8 183 183 A Y E > -G 186 0E 33 3,-3.4 3,-1.1 -2,-0.3 2,-0.2 -0.703 56.5 -72.4-142.3 87.9 150.5 -17.8 79.3 184 184 A M T 3 S+ 0 0 117 1,-0.3 -1,-0.2 -2,-0.3 -73,-0.1 -0.437 125.7 9.0 62.7-123.0 153.2 -16.2 81.4 185 185 A D T 3 S+ 0 0 87 -2,-0.2 -74,-1.4 -3,-0.1 -73,-0.4 0.513 126.8 79.9 -68.7 6.5 155.8 -18.9 82.4 186 186 A D E < -FG 110 183E 53 -3,-1.1 -3,-3.4 -76,-0.2 2,-0.4 -0.857 50.6-178.8-120.3 147.9 153.9 -21.2 80.0 187 187 A L E -FG 109 182E 0 -78,-1.3 -78,-2.8 -2,-0.3 -5,-0.3 -0.913 19.6-160.1-142.5 103.1 153.9 -21.7 76.2 188 188 A Y E -FG 108 181E 30 -7,-3.5 -7,-1.2 -2,-0.4 2,-0.4 -0.611 5.2-166.4 -89.7 148.4 151.4 -24.4 75.1 189 189 A V E -FG 107 180E 3 -82,-3.6 -82,-4.2 -2,-0.2 2,-0.4 -0.994 9.1-179.2-133.6 124.6 151.7 -26.2 71.8 190 190 A G E +FG 106 179E 2 -11,-2.3 -11,-1.6 -2,-0.4 -84,-0.3 -0.968 9.0 155.9-126.8 147.6 148.8 -28.2 70.5 191 191 A S E -F 105 0E 1 -86,-3.1 -87,-2.6 -2,-0.4 -86,-1.5 -0.846 46.8-113.5-151.7-171.6 148.5 -30.3 67.2 192 192 A D S S+ 0 0 60 -2,-0.2 2,-0.1 -88,-0.2 -86,-0.1 0.134 75.8 104.0-120.9 22.5 146.9 -33.1 65.2 193 193 A L S S- 0 0 43 -88,-0.1 2,-0.4 3,-0.1 -88,-0.2 -0.326 82.0 -97.0 -87.9 178.8 149.9 -35.4 64.7 194 194 A E > - 0 0 149 -2,-0.1 4,-1.8 -90,-0.1 5,-0.3 -0.875 48.1 -93.5-101.8 134.2 150.2 -38.6 66.8 195 195 A I H > S+ 0 0 97 -2,-0.4 4,-1.5 1,-0.2 -1,-0.1 0.553 123.8 55.3 -15.1 -40.5 152.5 -38.2 69.9 196 196 A G H >> S+ 0 0 47 2,-0.2 3,-1.9 1,-0.1 4,-0.7 0.971 117.0 31.2 -62.8 -80.6 155.6 -39.4 68.0 197 197 A Q H >> S+ 0 0 113 1,-0.3 3,-2.0 -3,-0.2 4,-1.7 0.841 116.0 62.1 -42.0 -45.9 155.5 -36.9 65.1 198 198 A H H 3X S+ 0 0 3 -4,-1.8 4,-2.3 1,-0.3 -1,-0.3 0.881 101.8 51.0 -52.1 -40.0 154.0 -34.4 67.5 199 199 A R H <>S+ 0 0 1 -4,-3.1 3,-2.3 1,-0.3 5,-1.4 0.906 108.0 57.3 -54.4 -42.8 163.6 -21.0 69.9 210 210 A L H ><5S+ 0 0 72 -4,-2.0 3,-1.7 1,-0.3 -1,-0.3 0.894 96.4 62.0 -58.0 -38.7 167.1 -22.1 71.0 211 211 A R T 3<5S+ 0 0 166 -4,-2.2 -1,-0.3 -3,-0.4 -2,-0.2 0.679 103.2 54.0 -63.4 -9.6 168.4 -20.4 67.9 212 212 A W T < 5S- 0 0 86 -3,-2.3 -1,-0.3 -4,-0.4 2,-0.2 -0.171 120.3-106.1-116.0 42.3 167.0 -17.3 69.4 213 213 A G T < 5S+ 0 0 9 -3,-1.7 2,-0.6 -211,-0.2 -3,-0.2 0.338 86.5 119.4 57.7 -10.2 168.7 -17.5 72.8 214 214 A L < - 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