==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECOMBINATION/INHIBITOR 02-MAR-11 3AVA . COMPND 2 MOLECULE: INTEGRASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1; . AUTHOR T.S.PEAT,J.J.DEADMAN,J.NEWMAN,D.I.RHODES . 316 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14795.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.3 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 . 6 1.9 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 . 15 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 40.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 2 0 0 0 2 0 0 0 2 4 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 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 . 4 0 0 0 0 1 1 2 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 0 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 56 A S 0 0 115 0, 0.0 22,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 38.6 21.4 -11.1 3.0 2 57 A S > - 0 0 46 1,-0.1 3,-1.4 2,-0.0 23,-0.5 -0.345 360.0-101.2 -84.3 168.2 21.0 -10.4 -0.6 3 58 A P T 3 S+ 0 0 28 0, 0.0 -1,-0.1 0, 0.0 143,-0.1 0.745 118.3 46.7 -61.7 -23.6 18.8 -12.5 -2.9 4 59 A G T 3 S+ 0 0 6 51,-0.1 53,-2.3 52,-0.0 52,-2.0 0.275 84.4 112.2-103.8 8.3 21.7 -14.5 -4.5 5 60 A I E < +a 57 0A 29 -3,-1.4 19,-1.4 51,-0.2 20,-0.5 -0.768 37.4 172.8 -90.3 128.4 23.8 -15.4 -1.3 6 61 A W E -aB 58 23A 1 51,-2.3 53,-2.7 -2,-0.5 2,-0.4 -0.924 19.0-147.8-130.3 154.9 24.1 -19.0 -0.2 7 62 A Q E -aB 59 22A 28 15,-2.6 15,-2.9 -2,-0.3 2,-0.2 -0.987 11.5-141.0-123.1 130.9 26.1 -20.8 2.6 8 63 A L E + B 0 21A 1 51,-2.8 2,-0.3 -2,-0.4 13,-0.2 -0.555 22.2 179.3 -85.8 155.0 27.5 -24.3 2.4 9 64 A D E - B 0 20A 10 11,-2.1 11,-3.2 -2,-0.2 2,-0.4 -0.983 12.9-159.3-157.9 137.2 27.4 -26.5 5.5 10 65 A C E + B 0 19A 27 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.979 16.0 171.6-128.0 126.9 28.5 -30.1 6.0 11 66 A T E - B 0 18A 13 7,-2.5 7,-3.1 -2,-0.4 2,-0.4 -0.877 22.4-128.5-133.5 166.2 27.2 -32.2 8.9 12 67 A H E + B 0 17A 112 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.939 28.2 158.9-126.2 143.3 27.6 -35.9 9.7 13 68 A L E > + B 0 16A 46 3,-1.9 3,-2.2 -2,-0.4 -2,-0.0 -0.921 68.7 3.9-158.8 136.8 25.2 -38.7 10.6 14 69 A E T 3 S- 0 0 97 1,-0.3 3,-0.1 -2,-0.3 103,-0.1 0.828 126.7 -62.1 60.7 31.3 25.3 -42.5 10.4 15 70 A G T 3 S+ 0 0 80 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.698 119.5 102.4 63.2 21.4 28.9 -42.3 9.3 16 71 A K E < S-B 13 0A 85 -3,-2.2 -3,-1.9 20,-0.0 2,-0.4 -0.739 71.0-115.9-126.8 173.7 27.9 -40.4 6.2 17 72 A V E -BC 12 34A 7 17,-2.0 17,-2.6 -2,-0.2 2,-0.6 -0.929 14.2-157.8-117.5 137.8 28.0 -36.8 5.2 18 73 A I E -BC 11 33A 4 -7,-3.1 -7,-2.5 -2,-0.4 2,-0.4 -0.971 11.2-158.1-114.4 122.9 25.0 -34.5 4.6 19 74 A L E -BC 10 32A 0 13,-2.5 13,-2.3 -2,-0.6 2,-0.4 -0.836 14.6-172.8-100.2 130.6 26.0 -31.4 2.5 20 75 A V E -BC 9 31A 0 -11,-3.2 -11,-2.1 -2,-0.4 2,-0.4 -0.972 16.9-157.2-125.9 141.4 23.6 -28.6 2.8 21 76 A A E -BC 8 30A 0 9,-2.7 9,-1.9 -2,-0.4 2,-0.5 -0.984 14.8-159.9-115.2 137.1 23.2 -25.3 1.0 22 77 A V E -BC 7 29A 15 -15,-2.9 -15,-2.6 -2,-0.4 2,-0.9 -0.915 18.2-140.3-118.4 126.3 21.4 -22.5 2.8 23 78 A H E >>> -BC 6 28A 0 5,-2.9 4,-3.2 -2,-0.5 3,-0.7 -0.825 24.4-152.2 -84.6 113.1 19.9 -19.4 1.3 24 79 A V T 345S+ 0 0 64 -19,-1.4 -1,-0.2 -2,-0.9 -18,-0.1 0.881 85.0 50.8 -65.7 -38.5 20.9 -17.0 4.0 25 80 A A T 345S+ 0 0 34 -20,-0.5 -1,-0.3 -23,-0.5 -19,-0.1 0.778 127.0 22.6 -68.7 -28.9 18.1 -14.4 3.6 26 81 A S T <45S- 0 0 5 -3,-0.7 -1,-0.2 2,-0.1 -2,-0.2 0.662 93.0-127.6-108.2 -23.3 15.3 -17.0 3.8 27 82 A G T <5 + 0 0 22 -4,-3.2 -3,-0.1 1,-0.3 2,-0.1 0.519 56.1 150.8 75.1 10.7 16.8 -20.0 5.5 28 83 A Y E < -C 23 0A 2 -5,-0.5 -5,-2.9 110,-0.3 2,-0.3 -0.466 27.9-161.2 -66.0 148.9 15.5 -22.3 2.6 29 84 A I E -C 22 0A 0 96,-0.2 2,-0.3 -7,-0.2 -7,-0.2 -0.873 25.7-166.0-136.5 155.1 17.8 -25.3 2.2 30 85 A E E +C 21 0A 9 -9,-1.9 -9,-2.7 -2,-0.3 2,-0.3 -0.963 25.9 175.6-125.8 149.9 18.8 -28.0 -0.4 31 86 A A E -C 20 0A 2 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.994 14.9-172.2-153.2 156.2 20.8 -31.0 0.9 32 87 A E E -C 19 0A 18 -13,-2.3 -13,-2.5 -2,-0.3 2,-0.5 -0.987 24.7-122.2-145.4 158.0 22.2 -34.3 -0.2 33 88 A V E +C 18 0A 31 -2,-0.3 -15,-0.2 -15,-0.2 3,-0.1 -0.878 33.3 171.2 -98.4 133.9 23.9 -37.4 1.4 34 89 A I E -C 17 0A 6 -17,-2.6 -17,-2.0 -2,-0.5 3,-0.1 -0.899 42.1-119.9-134.3 158.3 27.4 -38.2 -0.0 35 90 A P S S- 0 0 106 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.933 94.1 -5.9 -78.5 -25.8 29.8 -40.9 1.5 36 91 A A S S- 0 0 53 -20,-0.1 2,-0.5 -19,-0.1 5,-0.1 -0.990 78.7 -99.9-158.1 159.5 32.4 -38.2 2.1 37 92 A E + 0 0 50 -2,-0.3 2,-0.3 -3,-0.1 3,-0.1 -0.686 51.7 160.6 -86.7 116.4 33.0 -34.5 1.4 38 93 A T > - 0 0 64 -2,-0.5 4,-2.7 1,-0.1 5,-0.2 -0.907 53.3-112.6-124.0 161.3 35.3 -34.1 -1.7 39 94 A G H > S+ 0 0 20 -2,-0.3 4,-2.9 2,-0.2 5,-0.2 0.898 120.0 53.9 -58.9 -42.3 35.9 -31.1 -4.0 40 95 A Q H > S+ 0 0 95 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 111.3 43.6 -61.1 -41.4 34.2 -33.3 -6.8 41 96 A E H > S+ 0 0 56 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 116.0 47.8 -68.8 -40.6 31.1 -33.9 -4.7 42 97 A T H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.922 110.9 51.3 -67.4 -40.1 30.9 -30.3 -3.6 43 98 A A H X S+ 0 0 9 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.918 110.6 48.4 -60.1 -44.5 31.4 -29.0 -7.2 44 99 A Y H X S+ 0 0 29 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.892 109.4 52.2 -65.3 -42.1 28.6 -31.2 -8.5 45 100 A F H X S+ 0 0 7 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.884 110.3 48.5 -60.2 -43.5 26.2 -30.1 -5.8 46 101 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.874 109.0 52.8 -65.5 -36.5 26.9 -26.4 -6.5 47 102 A L H X S+ 0 0 7 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.935 111.2 48.0 -63.3 -43.5 26.3 -27.0 -10.3 48 103 A K H X S+ 0 0 41 -4,-2.5 4,-0.6 1,-0.2 3,-0.4 0.943 113.3 47.4 -55.2 -50.1 23.0 -28.6 -9.3 49 104 A L H >X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 3,-1.3 0.906 109.8 51.7 -61.1 -47.4 22.0 -25.7 -7.1 50 105 A A H 3< S+ 0 0 1 -4,-2.7 5,-0.3 1,-0.3 -1,-0.2 0.722 104.8 55.8 -69.5 -18.3 23.0 -23.0 -9.6 51 106 A G H 3< S+ 0 0 2 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.663 115.4 40.3 -76.6 -17.3 20.8 -24.5 -12.3 52 107 A R H << S+ 0 0 19 -3,-1.3 -2,-0.2 -4,-0.6 -3,-0.1 0.734 124.0 22.4-109.0 -31.5 17.8 -24.4 -10.0 53 108 A W S < S- 0 0 6 -4,-2.1 2,-1.7 -49,-0.0 -1,-0.3 -0.947 89.0 -97.5-134.7 158.7 18.2 -21.0 -8.2 54 109 A P - 0 0 64 0, 0.0 2,-0.7 0, 0.0 -4,-0.1 -0.512 46.8-171.8 -81.6 84.3 20.0 -17.8 -9.1 55 110 A V + 0 0 10 -2,-1.7 -50,-0.1 -5,-0.3 3,-0.1 -0.659 18.3 163.4 -86.9 114.2 23.1 -18.4 -7.1 56 111 A K + 0 0 130 -52,-2.0 25,-2.8 -2,-0.7 2,-0.4 0.827 66.3 15.3 -97.8 -40.5 25.4 -15.3 -7.1 57 112 A T E -ad 5 81A 7 -53,-2.3 -51,-2.3 23,-0.2 2,-0.5 -0.999 59.3-163.4-138.0 136.4 27.7 -16.0 -4.2 58 113 A V E -ad 6 82A 0 23,-2.3 25,-2.7 -2,-0.4 2,-0.7 -0.994 11.1-150.8-122.3 126.2 28.5 -19.0 -2.2 59 114 A H E -ad 7 83A 39 -53,-2.7 -51,-2.8 -2,-0.5 25,-0.2 -0.840 29.8-133.1 -84.7 113.7 30.3 -18.9 1.2 60 115 A T - 0 0 2 23,-2.6 3,-0.1 -2,-0.7 6,-0.0 -0.328 5.2-127.7 -72.2 159.9 32.1 -22.2 1.3 61 116 A D S S- 0 0 39 1,-0.1 2,-0.3 23,-0.1 -51,-0.1 0.669 81.5 -0.4 -86.3 -17.9 31.9 -24.4 4.4 62 117 A N S > S- 0 0 60 -53,-0.1 4,-1.7 1,-0.0 5,-0.1 -0.951 76.6 -97.1-162.5 174.9 35.7 -24.9 5.0 63 118 A G H > S+ 0 0 46 -2,-0.3 4,-2.3 2,-0.2 5,-0.2 0.781 115.6 61.9 -79.7 -20.1 39.1 -24.0 3.6 64 119 A S H > S+ 0 0 97 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.937 108.9 42.3 -72.1 -42.5 39.5 -27.3 1.7 65 120 A N H 4 S+ 0 0 5 2,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.833 113.9 53.0 -71.4 -28.9 36.3 -26.5 -0.4 66 121 A F H < S+ 0 0 72 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.930 115.9 39.4 -67.3 -39.7 37.5 -22.9 -0.8 67 122 A T H < S+ 0 0 95 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.831 87.8 113.0 -76.6 -33.8 40.9 -24.1 -2.1 68 123 A S X - 0 0 24 -4,-2.1 4,-2.4 -5,-0.2 5,-0.1 -0.097 56.4-153.8 -50.7 121.6 39.7 -27.0 -4.3 69 124 A T H > S+ 0 0 93 1,-0.2 4,-2.7 2,-0.2 -1,-0.1 0.867 95.4 58.2 -69.6 -25.1 40.3 -26.2 -7.9 70 125 A T H > S+ 0 0 18 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.889 107.5 46.1 -66.7 -42.9 37.4 -28.5 -8.9 71 126 A V H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.925 112.8 50.4 -65.7 -40.2 35.0 -26.4 -6.7 72 127 A K H X S+ 0 0 83 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.893 108.6 53.2 -63.3 -35.1 36.5 -23.2 -8.3 73 128 A A H X S+ 0 0 16 -4,-2.7 4,-2.9 2,-0.2 -1,-0.2 0.887 109.8 47.3 -63.8 -40.9 36.0 -24.7 -11.7 74 129 A A H X S+ 0 0 6 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.913 111.7 50.0 -69.1 -37.0 32.3 -25.3 -11.0 75 130 A C H <>S+ 0 0 3 -4,-2.4 5,-2.7 2,-0.2 4,-0.5 0.936 112.3 48.7 -69.7 -35.1 31.8 -21.8 -9.6 76 131 A W H ><5S+ 0 0 185 -4,-2.7 3,-1.4 3,-0.2 -2,-0.2 0.963 112.5 48.6 -62.3 -49.2 33.5 -20.5 -12.8 77 132 A W H 3<5S+ 0 0 40 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.932 117.2 40.1 -56.3 -48.8 31.3 -22.6 -15.0 78 133 A A T 3<5S- 0 0 7 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.364 112.2-112.4 -85.0 2.4 28.1 -21.6 -13.2 79 134 A G T < 5 + 0 0 61 -3,-1.4 2,-0.4 -4,-0.5 -3,-0.2 0.840 64.8 147.7 71.0 32.6 28.9 -17.9 -12.7 80 135 A I < - 0 0 13 -5,-2.7 2,-0.6 -6,-0.2 -23,-0.2 -0.873 48.2-132.4-104.9 140.4 29.2 -18.0 -8.9 81 136 A K E -d 57 0A 134 -25,-2.8 -23,-2.3 -2,-0.4 2,-0.5 -0.770 24.9-144.5 -85.4 118.0 31.5 -15.9 -6.8 82 137 A Q E +d 58 0A 30 -2,-0.6 2,-0.3 -25,-0.2 -23,-0.2 -0.752 26.2 175.2 -88.0 126.8 33.2 -18.3 -4.4 83 138 A E E -d 59 0A 53 -25,-2.7 -23,-2.6 -2,-0.5 2,-0.0 -0.833 33.2-101.4-125.2 161.2 33.9 -16.7 -1.0 84 139 A D - 0 0 52 -2,-0.3 -1,-0.1 -25,-0.2 -23,-0.1 -0.238 24.9-133.3 -70.1 173.6 35.2 -17.9 2.3 85 140 A G + 0 0 31 -26,-0.2 -1,-0.1 -78,-0.0 -26,-0.1 0.035 45.4 152.9-122.9 27.9 32.7 -18.7 5.2 86 141 A I - 0 0 92 1,-0.1 2,-2.1 -24,-0.0 3,-0.3 -0.384 49.8-127.0 -57.3 126.8 34.5 -16.9 8.0 87 142 A P + 0 0 53 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.473 43.0 162.0 -80.8 71.0 31.8 -15.8 10.6 88 143 A Y S S+ 0 0 183 -2,-2.1 3,-0.1 1,-0.2 -2,-0.0 0.855 78.4 55.6 -54.1 -34.7 32.8 -12.1 10.7 89 144 A N S > S- 0 0 88 -3,-0.3 3,-3.0 1,-0.1 4,-0.4 -0.887 87.5-152.8 -94.0 102.9 29.3 -11.9 12.2 90 145 A P T >> S+ 0 0 89 0, 0.0 4,-1.0 0, 0.0 3,-0.9 0.760 89.1 75.0 -56.5 -23.5 29.6 -14.3 15.2 91 146 A Q H 3> S+ 0 0 145 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.800 83.9 67.9 -52.6 -34.3 25.8 -14.9 14.9 92 147 A S H <> S+ 0 0 50 -3,-3.0 4,-2.3 1,-0.2 5,-0.3 0.872 94.1 54.9 -55.3 -45.9 26.5 -17.0 11.7 93 148 A Q H <> S+ 0 0 102 -3,-0.9 4,-2.4 -4,-0.4 -1,-0.2 0.958 112.5 42.9 -48.7 -54.7 28.2 -19.8 13.8 94 149 A G H X S+ 0 0 34 -4,-1.0 4,-2.6 1,-0.2 -2,-0.2 0.857 110.7 54.7 -65.1 -39.3 25.2 -20.2 16.0 95 150 A V H X S+ 0 0 93 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.913 112.0 44.0 -62.7 -47.6 22.6 -20.0 13.2 96 151 A I H X S+ 0 0 40 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.896 113.0 52.4 -64.5 -43.0 24.3 -22.9 11.3 97 152 A E H X S+ 0 0 121 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.914 110.9 45.6 -60.0 -44.8 24.8 -25.0 14.5 98 153 A S H X S+ 0 0 75 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.843 109.7 55.0 -79.4 -24.4 21.2 -24.7 15.4 99 154 A M H X S+ 0 0 19 -4,-1.7 4,-3.0 -5,-0.2 5,-0.3 0.928 108.4 49.5 -64.6 -42.0 20.1 -25.5 11.8 100 155 A N H X S+ 0 0 23 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.918 111.4 48.7 -61.1 -41.7 22.1 -28.7 11.9 101 156 A K H X S+ 0 0 164 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.943 111.7 49.2 -63.7 -42.0 20.6 -29.5 15.2 102 157 A E H X S+ 0 0 38 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.919 113.5 47.6 -58.6 -46.2 17.0 -28.8 13.8 103 158 A L H X S+ 0 0 10 -4,-3.0 4,-3.1 1,-0.2 5,-0.2 0.931 111.0 49.2 -65.6 -39.7 17.7 -31.0 10.7 104 159 A K H X S+ 0 0 78 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.895 110.2 52.9 -67.1 -34.1 19.0 -33.8 12.8 105 160 A K H X S+ 0 0 143 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.946 112.0 45.1 -61.0 -47.5 15.9 -33.5 15.0 106 161 A I H X S+ 0 0 9 -4,-2.7 4,-1.4 1,-0.2 5,-0.3 0.915 108.4 55.1 -63.3 -45.8 13.7 -33.8 12.0 107 162 A I H X S+ 0 0 5 -4,-3.1 4,-1.2 1,-0.2 3,-0.4 0.912 107.9 52.1 -53.5 -40.2 15.7 -36.7 10.5 108 163 A G H < S+ 0 0 52 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.893 105.3 54.4 -58.8 -40.8 15.1 -38.5 13.8 109 164 A Q H < S+ 0 0 116 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.701 122.4 27.7 -68.6 -23.7 11.4 -37.9 13.6 110 165 A V H >< S+ 0 0 4 -4,-1.4 3,-2.9 -3,-0.4 4,-0.4 0.471 89.0 100.8-109.0 -8.1 11.2 -39.5 10.1 111 166 A R G >< S+ 0 0 56 -4,-1.2 3,-1.5 1,-0.3 -2,-0.1 0.842 78.4 57.7 -59.5 -32.0 14.1 -41.9 10.2 112 167 A D G 3 S+ 0 0 103 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.381 99.5 60.2 -71.4 -2.8 11.8 -44.9 10.9 113 168 A Q G < S+ 0 0 60 -3,-2.9 195,-2.8 194,-0.1 196,-0.4 0.478 101.9 60.6-101.7 -6.2 9.8 -44.2 7.7 114 169 A A < - 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