==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-AUG-06 2HYO . COMPND 2 MOLECULE: RV0805N97A; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR A.R.SHENOY,M.CAPUDER,P.DRASKOVIC,D.LAMBA,S.S.VISWESWARIAH,M. . 227 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10099.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 11.9 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 . 4 1.8 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 . 25 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 47 20.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 1 1 0 0 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 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 PARALLEL BRIDGES PER LADDER . 1 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 10 A P 0 0 148 0, 0.0 218,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 124.8 -19.5 -2.5 -2.8 2 11 A R - 0 0 227 1,-0.0 2,-0.1 2,-0.0 3,-0.0 -0.765 360.0-131.9 -89.0 123.1 -20.2 1.2 -3.1 3 12 A P - 0 0 30 0, 0.0 216,-0.2 0, 0.0 3,-0.1 -0.378 5.2-137.5 -66.8 148.5 -17.2 3.5 -2.6 4 13 A D S S+ 0 0 69 214,-2.2 2,-0.3 1,-0.2 215,-0.2 0.897 87.9 7.9 -66.5 -42.1 -17.4 6.5 -0.3 5 14 A Y E -A 218 0A 13 213,-1.4 213,-2.7 2,-0.0 2,-0.4 -0.961 61.5-150.2-139.6 151.4 -15.5 8.6 -2.9 6 15 A V E -A 217 0A 23 -2,-0.3 32,-3.3 211,-0.2 33,-1.1 -0.992 19.8-176.9-125.3 124.2 -14.2 8.4 -6.4 7 16 A L E -Ab 216 39A 0 209,-3.5 209,-2.9 -2,-0.4 2,-0.5 -0.880 19.5-142.2-115.1 150.9 -11.0 10.3 -7.4 8 17 A L E -Ab 215 40A 1 31,-2.7 33,-3.4 -2,-0.3 2,-0.6 -0.957 14.4-161.4-111.2 130.3 -9.3 10.6 -10.7 9 18 A H E +Ab 214 41A 0 205,-3.2 205,-2.8 -2,-0.5 2,-0.4 -0.911 17.2 167.7-118.4 102.6 -5.5 10.7 -10.5 10 19 A I E - b 0 42A 2 31,-2.5 33,-1.9 -2,-0.6 2,-0.3 -0.916 11.7-172.0-115.5 143.0 -3.7 12.1 -13.6 11 20 A S B +e 208 0B 0 196,-0.6 198,-0.8 201,-0.4 199,-0.2 -0.943 44.1 9.3-141.2 159.6 -0.1 13.0 -13.8 12 21 A D + 0 0 1 32,-1.4 198,-1.1 -2,-0.3 197,-1.0 0.866 52.6 169.5 50.1 61.1 2.8 14.6 -15.7 13 22 A T - 0 0 0 31,-0.5 33,-0.2 196,-0.2 10,-0.1 0.779 19.7-161.8 -73.9 -29.1 0.8 16.2 -18.6 14 23 A H - 0 0 27 31,-3.1 5,-0.2 30,-0.2 33,-0.2 0.833 14.7-177.0 49.5 47.0 3.8 18.3 -19.9 15 24 A L B f 47 0C 0 31,-1.8 33,-2.5 30,-0.2 34,-0.6 -0.468 360.0 360.0 -73.2 143.2 1.8 20.8 -21.9 16 25 A I 0 0 91 31,-0.2 41,-0.1 32,-0.2 -1,-0.0 -0.711 360.0 360.0-122.1 360.0 3.8 23.4 -23.9 17 ! 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 18 36 A D > 0 0 130 0, 0.0 4,-1.1 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 157.6 1.9 15.9 -28.8 19 37 A A H > + 0 0 14 -5,-0.2 4,-1.6 1,-0.2 5,-0.2 0.656 360.0 70.6 -67.3 -19.2 0.8 16.3 -25.2 20 38 A D H > S+ 0 0 47 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.974 108.9 27.4 -63.5 -59.6 -2.3 18.3 -26.3 21 39 A D H > S+ 0 0 73 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.555 113.0 66.2 -88.6 -8.9 -4.3 15.5 -27.8 22 40 A R H X S+ 0 0 156 -4,-1.1 4,-0.8 2,-0.2 -1,-0.2 0.925 113.1 35.0 -67.6 -48.3 -2.8 12.8 -25.7 23 41 A L H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 3,-0.3 0.880 115.7 58.2 -68.5 -40.8 -4.5 14.5 -22.8 24 42 A G H X S+ 0 0 19 -4,-1.9 4,-1.9 1,-0.2 5,-0.2 0.941 106.3 46.7 -52.8 -53.5 -7.5 15.4 -25.0 25 43 A E H X S+ 0 0 107 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.716 110.5 53.9 -65.9 -25.6 -8.3 11.8 -25.9 26 44 A L H X S+ 0 0 13 -4,-0.8 4,-2.1 -3,-0.3 -1,-0.2 0.913 105.4 53.2 -72.6 -47.5 -8.0 10.7 -22.3 27 45 A L H X S+ 0 0 12 -4,-2.2 4,-2.1 1,-0.2 3,-0.5 0.963 113.3 42.2 -49.7 -58.8 -10.5 13.2 -21.1 28 46 A E H X S+ 0 0 110 -4,-1.9 4,-3.3 1,-0.2 5,-0.2 0.875 108.5 59.7 -61.1 -37.7 -13.1 12.1 -23.6 29 47 A Q H X S+ 0 0 115 -4,-1.5 4,-0.7 1,-0.2 -1,-0.2 0.886 112.6 39.9 -58.4 -38.5 -12.4 8.4 -23.0 30 48 A L H <>S+ 0 0 12 -4,-2.1 5,-1.1 -3,-0.5 4,-0.3 0.758 112.8 54.6 -80.6 -28.1 -13.3 9.0 -19.3 31 49 A N H ><5S+ 0 0 75 -4,-2.1 3,-1.0 -5,-0.2 -2,-0.2 0.910 111.2 46.8 -63.5 -42.3 -16.2 11.3 -20.2 32 50 A Q H 3<5S+ 0 0 156 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.664 99.9 66.4 -76.4 -20.8 -17.5 8.4 -22.4 33 51 A S T 3<5S- 0 0 73 -4,-0.7 -1,-0.3 -5,-0.2 -2,-0.2 0.606 105.5-128.5 -74.9 -12.8 -17.0 5.8 -19.7 34 52 A G T < 5 + 0 0 58 -3,-1.0 2,-0.2 -4,-0.3 -3,-0.1 0.675 53.0 156.8 72.4 18.8 -19.7 7.6 -17.7 35 53 A L < - 0 0 40 -5,-1.1 -1,-0.3 1,-0.0 -2,-0.1 -0.557 27.8-163.5 -75.3 136.6 -17.5 7.8 -14.7 36 54 A R - 0 0 161 -2,-0.2 -30,-0.1 -3,-0.1 2,-0.1 -0.765 10.8-171.7-125.3 86.8 -18.3 10.6 -12.2 37 55 A P - 0 0 4 0, 0.0 -30,-0.2 0, 0.0 3,-0.1 -0.399 27.2-136.7 -72.8 152.1 -15.4 11.3 -9.8 38 56 A D S S+ 0 0 55 -32,-3.3 34,-2.5 1,-0.2 2,-0.3 0.795 88.6 12.1 -72.0 -32.7 -15.7 13.6 -6.8 39 57 A A E -bc 7 72A 0 -33,-1.1 -31,-2.7 32,-0.3 2,-0.6 -0.999 59.0-146.1-147.4 147.3 -12.3 15.1 -7.7 40 58 A I E -bc 8 73A 0 32,-3.3 34,-3.3 -2,-0.3 2,-0.6 -0.967 22.7-165.4-113.5 115.7 -9.7 15.2 -10.4 41 59 A V E -bc 9 74A 0 -33,-3.4 -31,-2.5 -2,-0.6 2,-0.6 -0.910 7.3-165.8-107.8 119.9 -6.2 15.4 -9.0 42 60 A F E -bc 10 75A 0 32,-2.8 34,-1.7 -2,-0.6 2,-0.8 -0.921 9.8-155.7-105.3 110.2 -3.3 16.3 -11.3 43 61 A T - 0 0 0 -33,-1.9 146,-0.2 -2,-0.6 145,-0.2 -0.197 47.6 -72.5 -94.4 46.1 -0.0 15.5 -9.5 44 62 A G S S+ 0 0 0 -2,-0.8 -32,-1.4 32,-0.5 -31,-0.5 -0.162 97.0 83.0 104.4 173.8 2.4 17.9 -11.1 45 63 A D + 0 0 4 -33,-0.2 -31,-3.1 -34,-0.1 -30,-0.2 0.897 51.8 155.1 52.4 45.6 4.4 18.6 -14.3 46 64 A L + 0 0 0 30,-0.3 -31,-1.8 -33,-0.2 2,-0.4 0.925 67.7 30.0 -66.9 -45.8 1.2 20.3 -15.6 47 65 A A B > S-f 15 0C 0 -33,-0.2 3,-0.6 1,-0.1 -1,-0.2 -0.952 75.5-144.2-116.4 135.8 3.2 22.5 -17.9 48 66 A D T 3 S+ 0 0 46 -33,-2.5 -32,-0.2 -2,-0.4 -1,-0.1 0.847 102.6 16.7 -69.4 -38.4 6.5 21.3 -19.4 49 67 A K T 3 S- 0 0 129 -34,-0.6 -1,-0.2 2,-0.1 32,-0.1 -0.049 109.3-108.9-121.0 29.1 8.3 24.7 -19.3 50 68 A G < + 0 0 5 -3,-0.6 35,-0.1 1,-0.2 -34,-0.1 0.801 58.9 177.1 48.3 37.1 5.9 26.3 -16.9 51 69 A E > - 0 0 62 -36,-0.3 4,-1.8 1,-0.1 3,-0.4 -0.504 39.4-139.3 -82.2 134.8 4.5 28.4 -19.8 52 70 A P H >> S+ 0 0 41 0, 0.0 4,-2.3 0, 0.0 3,-0.6 0.936 108.1 52.1 -49.4 -51.2 1.7 30.9 -19.4 53 71 A A H 3> S+ 0 0 54 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.800 108.0 51.4 -54.4 -36.3 0.3 29.8 -22.8 54 72 A A H 3> S+ 0 0 0 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.789 109.6 49.0 -76.0 -30.7 0.5 26.1 -21.7 55 73 A Y H S+ 0 0 67 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.955 111.6 52.4 -57.5 -46.8 -15.2 22.2 -18.9 65 83 A F H X S+ 0 0 17 -4,-0.5 4,-1.0 1,-0.2 -2,-0.2 0.865 113.3 43.1 -55.2 -42.2 -14.5 18.5 -18.5 66 84 A A H <>S+ 0 0 3 -4,-2.1 5,-2.8 2,-0.2 4,-0.4 0.829 109.5 55.9 -76.6 -35.5 -14.6 18.7 -14.7 67 85 A A H ><5S+ 0 0 72 -4,-2.1 3,-0.8 -5,-0.2 -2,-0.2 0.883 103.8 55.2 -65.0 -40.4 -17.6 21.0 -14.5 68 86 A Q H 3<5S+ 0 0 130 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.876 113.4 41.0 -56.2 -42.8 -19.7 18.5 -16.5 69 87 A L T 3<5S- 0 0 14 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.418 110.0-124.0 -89.0 -1.3 -19.0 15.8 -14.0 70 88 A G T < 5 + 0 0 63 -3,-0.8 2,-0.3 -4,-0.4 -3,-0.2 0.806 59.2 155.7 61.5 32.8 -19.4 18.2 -11.1 71 89 A A < - 0 0 13 -5,-2.8 2,-0.3 -6,-0.1 -32,-0.3 -0.726 46.9-118.9-100.4 139.4 -15.9 17.3 -10.0 72 90 A E E -c 39 0A 103 -34,-2.5 -32,-3.3 -2,-0.3 2,-0.5 -0.538 26.4-134.7 -70.5 130.7 -13.5 19.3 -7.9 73 91 A L E -c 40 0A 32 -2,-0.3 2,-0.5 -34,-0.2 -32,-0.2 -0.804 20.2-170.5 -90.1 127.0 -10.3 20.2 -9.7 74 92 A V E -c 41 0A 7 -34,-3.3 -32,-2.8 -2,-0.5 2,-0.4 -0.950 3.1-167.4-122.4 112.5 -7.2 19.7 -7.6 75 93 A W E -c 42 0A 27 -2,-0.5 2,-0.4 -34,-0.2 -32,-0.1 -0.833 0.4-165.8-103.3 136.4 -3.9 21.0 -9.1 76 94 A V - 0 0 0 -34,-1.7 -32,-0.5 -2,-0.4 -30,-0.3 -0.944 24.3-114.5-120.2 136.4 -0.5 20.2 -7.7 77 95 A M - 0 0 2 23,-0.4 39,-0.5 -2,-0.4 74,-0.3 -0.533 33.7-167.2 -65.4 130.3 2.9 21.9 -8.4 78 96 A G > - 0 0 0 -2,-0.3 3,-0.8 73,-0.1 -34,-0.1 -0.721 36.9 -98.1-109.8 170.0 5.4 19.7 -10.3 79 97 A A T 3 S+ 0 0 12 1,-0.2 42,-0.2 -2,-0.2 41,-0.2 0.819 122.8 47.9 -53.9 -38.0 9.2 20.2 -10.9 80 98 A H T 3 S+ 0 0 55 42,-0.1 -1,-0.2 39,-0.1 42,-0.0 0.727 96.5 93.3 -81.5 -20.1 8.6 21.6 -14.4 81 99 A D S < S- 0 0 14 -3,-0.8 2,-0.5 -32,-0.1 -4,-0.0 -0.125 70.3-131.8 -67.9 165.5 5.9 24.1 -13.3 82 100 A D > - 0 0 55 1,-0.1 4,-2.1 37,-0.1 5,-0.3 -0.986 9.0-147.8-121.8 118.6 6.3 27.7 -12.3 83 101 A R H > S+ 0 0 16 -2,-0.5 4,-1.9 1,-0.2 13,-0.1 0.825 95.7 45.3 -55.1 -41.2 4.5 28.7 -9.1 84 102 A A H > S+ 0 0 18 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.911 114.3 44.9 -73.3 -47.0 3.7 32.3 -10.2 85 103 A E H > S+ 0 0 62 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.771 114.4 51.3 -68.7 -26.8 2.5 31.5 -13.8 86 104 A L H X>S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 5,-1.3 0.918 110.9 46.9 -74.1 -47.0 0.3 28.6 -12.4 87 105 A R H <5S+ 0 0 20 -4,-1.9 6,-3.5 -5,-0.3 4,-0.4 0.896 119.7 43.4 -55.2 -40.8 -1.2 30.8 -9.8 88 106 A K H <5S+ 0 0 105 -4,-2.0 4,-0.3 4,-0.2 -2,-0.2 0.921 126.4 24.2 -74.8 -50.3 -1.8 33.5 -12.5 89 107 A F H <5S+ 0 0 43 -4,-2.6 -3,-0.2 -5,-0.1 -30,-0.2 0.537 132.1 32.0-103.7 -7.9 -3.1 31.5 -15.5 90 108 A L T <5S+ 0 0 3 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.1 0.694 128.5 28.6-114.6 -33.7 -4.6 28.4 -13.8 91 109 A L S -G 109 0D 13 3,-3.7 3,-2.6 -2,-0.5 2,-0.3 -0.884 69.8 -66.3-109.3 97.0 -14.6 16.8 -0.2 107 125 A D T 3 S- 0 0 132 -2,-0.7 37,-0.0 1,-0.3 -1,-0.0 -0.465 121.4 -12.7 51.0-112.5 -17.5 16.2 2.2 108 126 A G T 3 S+ 0 0 11 -2,-0.3 36,-2.3 -3,-0.1 2,-0.5 0.555 120.1 94.7 -88.6 -9.9 -15.7 14.3 5.0 109 127 A L E < -G 106 0D 0 -3,-2.6 -3,-3.7 34,-0.2 2,-0.5 -0.732 63.4-148.5 -90.0 124.8 -12.5 13.5 3.0 110 128 A R E -Gh 105 146D 6 35,-2.4 37,-3.3 -2,-0.5 2,-0.5 -0.788 8.8-167.0 -89.3 130.6 -9.5 15.9 3.3 111 129 A I E -Gh 104 147D 1 -7,-2.2 -7,-2.8 -2,-0.5 2,-0.5 -0.980 5.5-163.6-113.1 127.4 -7.3 16.4 0.4 112 130 A I E -Gh 103 148D 1 35,-2.8 37,-3.4 -2,-0.5 2,-0.6 -0.959 4.9-155.6-112.8 123.7 -4.0 18.1 1.2 113 131 A V E -Gh 102 149D 7 -11,-3.5 -11,-2.2 -2,-0.5 2,-0.4 -0.900 13.9-173.7 -95.9 120.0 -1.9 19.5 -1.6 114 132 A L - 0 0 0 35,-2.5 2,-0.7 -2,-0.6 37,-0.3 -0.928 19.4-136.8-114.2 141.1 1.8 19.8 -0.8 115 133 A D + 0 0 0 -2,-0.4 -37,-0.1 1,-0.1 -14,-0.1 -0.852 27.2 168.1-100.0 106.6 4.3 21.5 -3.1 116 134 A T + 0 0 0 -2,-0.7 9,-2.1 -39,-0.5 -1,-0.1 0.425 41.7 118.0 -95.5 1.1 7.6 19.5 -3.3 117 135 A S - 0 0 2 7,-0.2 7,-0.1 -40,-0.2 5,-0.1 -0.258 52.1-154.0 -66.5 151.8 8.9 21.6 -6.2 118 136 A V B > -L 121 0E 11 3,-0.7 3,-2.2 5,-0.4 5,-0.1 -0.981 33.0-111.1-125.8 113.3 12.1 23.6 -5.9 119 137 A P T 3 S+ 0 0 56 0, 0.0 -37,-0.1 0, 0.0 3,-0.1 -0.170 99.2 4.4 -51.8 133.9 12.0 26.6 -8.3 120 138 A G T 3 S+ 0 0 81 -41,-0.2 2,-0.3 1,-0.2 -40,-0.1 0.645 117.2 94.8 62.8 18.5 14.5 26.1 -11.2 121 139 A H B < -L 118 0E 100 -3,-2.2 -3,-0.7 -42,-0.2 -1,-0.2 -0.990 64.1-149.5-140.2 147.5 15.4 22.6 -9.9 122 140 A H S S+ 0 0 103 -2,-0.3 -43,-0.2 -5,-0.1 -42,-0.1 0.671 73.9 85.3 -90.8 -19.9 14.2 19.2 -10.9 123 141 A H S S- 0 0 16 41,-0.1 -5,-0.4 -44,-0.1 2,-0.4 -0.144 76.5-115.6 -74.5 175.9 14.8 17.6 -7.5 124 142 A G B +m 167 0F 0 42,-2.3 44,-3.4 -7,-0.1 2,-0.3 -0.922 33.2 163.3-122.6 144.6 12.2 17.7 -4.6 125 143 A E - 0 0 54 -9,-2.1 2,-0.5 -2,-0.4 44,-0.1 -0.988 26.6-144.1-150.2 154.7 12.2 19.2 -1.1 126 144 A I - 0 0 20 -2,-0.3 -10,-0.1 42,-0.3 2,-0.1 -0.992 27.6-137.4-123.2 121.3 9.8 20.1 1.6 127 145 A R >> - 0 0 98 -2,-0.5 4,-1.4 1,-0.1 3,-1.2 -0.355 22.1-108.5 -80.6 159.3 10.7 23.3 3.5 128 146 A A H 3> S+ 0 0 82 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.838 117.2 54.6 -53.6 -41.9 10.4 23.7 7.3 129 147 A S H 3> S+ 0 0 90 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.741 106.5 53.0 -67.0 -24.4 7.4 26.0 7.2 130 148 A Q H <> S+ 0 0 3 -3,-1.2 4,-2.6 2,-0.2 -1,-0.2 0.834 106.6 50.8 -80.2 -35.9 5.5 23.5 5.1 131 149 A L H X S+ 0 0 31 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.838 112.3 48.3 -67.3 -36.6 6.1 20.7 7.6 132 150 A G H X S+ 0 0 32 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.944 113.2 46.7 -65.5 -50.1 4.9 23.0 10.4 133 151 A W H X S+ 0 0 78 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.922 115.5 46.8 -55.0 -49.6 1.8 23.9 8.3 134 152 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.916 111.8 49.8 -63.0 -46.9 1.2 20.2 7.5 135 153 A A H X S+ 0 0 44 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.907 112.0 48.5 -55.0 -48.8 1.6 19.1 11.1 136 154 A E H >< S+ 0 0 158 -4,-2.6 3,-0.8 1,-0.2 4,-0.4 0.914 112.4 48.8 -59.8 -46.6 -0.8 21.8 12.4 137 155 A E H >< S+ 0 0 57 -4,-2.2 3,-1.3 1,-0.2 -2,-0.2 0.901 109.8 50.0 -59.1 -48.1 -3.4 20.8 9.8 138 156 A L H 3< S+ 0 0 9 -4,-2.4 43,-0.3 1,-0.3 -1,-0.2 0.540 88.0 83.4 -74.0 -7.7 -3.2 17.1 10.5 139 157 A A T << S+ 0 0 77 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.791 87.7 62.2 -64.9 -26.8 -3.6 17.7 14.2 140 158 A T S < S- 0 0 98 -3,-1.3 2,-0.2 -4,-0.4 -1,-0.1 -0.905 90.5-137.9 -98.8 115.8 -7.3 17.8 13.4 141 159 A P - 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