==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION,TRANSLATION,HYDROLASE 17-JUN-05 2A11 . COMPND 2 MOLECULE: RIBONUCLEASE III; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR D.L.AKEY,J.M.BERGER,MYCOBACTERIUM TUBERCULOSIS STRUCTURAL PR . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8163.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 117 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 4 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 56.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.2 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 1 2 2 0 0 0 2 1 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A I 0 0 127 0, 0.0 2,-0.6 0, 0.0 97,-0.1 0.000 360.0 360.0 360.0-133.3 62.1 19.6 40.7 2 3 A R + 0 0 221 95,-0.2 2,-0.2 2,-0.1 0, 0.0 0.084 360.0 81.2 24.6 -70.6 62.9 23.4 41.4 3 4 A S - 0 0 76 -2,-0.6 4,-0.2 1,-0.1 95,-0.0 -0.391 59.6-166.3 -63.2 127.2 59.4 24.6 42.4 4 5 A R > + 0 0 64 -2,-0.2 4,-2.7 1,-0.2 3,-0.3 0.321 64.7 95.2 -96.3 9.0 58.7 23.7 46.0 5 6 A Q H > S+ 0 0 98 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.933 79.4 55.5 -67.3 -45.2 55.0 24.4 45.9 6 7 A P H > S+ 0 0 46 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.806 113.2 46.0 -57.9 -23.4 54.0 20.8 45.2 7 8 A L H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 5,-0.3 0.933 109.8 49.3 -81.4 -52.3 56.0 20.1 48.4 8 9 A L H X>S+ 0 0 16 -4,-2.7 4,-1.1 1,-0.2 5,-0.6 0.757 113.9 52.4 -58.3 -21.3 54.5 22.9 50.5 9 10 A D H <5S+ 0 0 98 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.940 105.8 48.8 -79.3 -53.1 51.2 21.5 49.2 10 11 A A H <5S+ 0 0 23 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.1 0.950 113.0 50.5 -50.3 -50.2 51.8 17.9 50.2 11 12 A L H <5S- 0 0 3 -4,-2.7 -1,-0.2 1,-0.1 -2,-0.2 0.866 102.2-140.7 -55.7 -40.8 52.8 19.2 53.7 12 13 A G T <5 + 0 0 46 -4,-1.1 2,-0.2 1,-0.4 -3,-0.2 0.504 68.3 76.2 91.1 3.7 49.6 21.3 53.9 13 14 A V S - 0 0 38 0, 0.0 4,-2.4 0, 0.0 3,-0.3 -0.221 36.4-113.4 -53.4 144.9 59.2 30.8 54.7 17 18 A D H > S+ 0 0 121 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.864 112.8 50.6 -49.8 -49.2 61.8 30.2 51.9 18 19 A E H > S+ 0 0 129 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.891 112.4 45.3 -61.1 -42.3 64.8 30.4 54.2 19 20 A L H > S+ 0 0 22 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.892 113.7 48.8 -70.1 -39.9 63.5 27.8 56.7 20 21 A L H X S+ 0 0 3 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.879 111.4 50.9 -67.4 -35.5 62.3 25.4 54.0 21 22 A S H < S+ 0 0 38 -4,-2.2 4,-0.5 -5,-0.3 3,-0.4 0.952 110.7 47.7 -66.0 -48.9 65.7 25.7 52.3 22 23 A L H >< S+ 0 0 53 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.940 108.9 55.2 -55.9 -48.5 67.6 25.0 55.5 23 24 A A H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.848 110.3 46.1 -54.1 -35.8 65.3 22.0 56.1 24 25 A L T 3< S+ 0 0 4 -4,-1.6 76,-2.6 -3,-0.4 2,-1.1 0.450 86.7 110.3 -88.4 1.1 66.2 20.7 52.7 25 26 A T B < -a 100 0A 10 -3,-2.0 14,-2.5 -4,-0.5 15,-0.2 -0.616 52.9-161.5 -84.5 96.7 70.0 21.2 53.2 26 27 A H > - 0 0 18 74,-1.5 4,-2.2 -2,-1.1 3,-0.3 -0.429 31.2-112.7 -70.8 149.9 71.8 17.9 53.6 27 28 A R H > S+ 0 0 93 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.818 113.6 61.2 -53.2 -35.9 75.2 18.2 55.2 28 29 A S H > S+ 0 0 19 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.961 108.0 42.6 -56.2 -54.5 77.0 17.2 51.9 29 30 A Y H > S+ 0 0 66 71,-0.5 4,-1.6 -3,-0.3 -1,-0.2 0.938 112.9 56.3 -55.7 -47.6 75.6 20.2 50.0 30 31 A A H <>S+ 0 0 0 -4,-2.2 6,-1.7 70,-0.3 5,-1.7 0.897 111.3 40.1 -53.4 -48.8 76.4 22.3 53.1 31 32 A Y H ><5S+ 0 0 131 -4,-2.8 3,-1.9 4,-0.2 4,-0.3 0.953 111.9 55.5 -67.1 -50.8 80.1 21.4 53.2 32 33 A E H 3<5S+ 0 0 81 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.741 108.2 51.7 -54.1 -25.7 80.6 21.5 49.4 33 34 A N T 3<5S- 0 0 70 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.058 132.5 -76.2-106.6 28.9 79.2 25.1 49.4 34 35 A G T < 5S- 0 0 74 -3,-1.9 -3,-0.2 2,-0.1 -2,-0.1 0.680 85.5 -53.9 96.0 17.7 81.4 26.6 52.1 35 36 A G S - 0 0 25 -3,-0.1 3,-0.6 1,-0.1 4,-0.3 -0.652 19.5-113.5-109.3 169.6 72.5 22.0 57.7 39 40 A N T 3> S+ 0 0 5 -14,-2.5 4,-2.2 -2,-0.2 5,-0.1 0.358 89.6 101.7 -79.2 8.2 69.1 20.5 58.3 40 41 A E H 3> S+ 0 0 75 -15,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.849 78.4 47.6 -63.1 -38.6 70.5 18.4 61.2 41 42 A R H <> S+ 0 0 216 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.929 113.6 49.5 -67.4 -43.2 69.2 20.6 64.1 42 43 A L H > S+ 0 0 11 -4,-0.3 4,-3.5 1,-0.2 -2,-0.2 0.881 108.9 52.8 -60.6 -41.0 65.8 20.6 62.5 43 44 A E H X S+ 0 0 47 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.929 107.9 51.3 -59.9 -46.7 66.0 16.8 62.1 44 45 A F H X S+ 0 0 168 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.899 114.6 43.4 -57.1 -45.6 66.8 16.4 65.8 45 46 A L H X S+ 0 0 52 -4,-2.3 4,-2.1 1,-0.2 3,-0.3 0.958 112.4 51.2 -68.2 -48.7 63.8 18.6 66.6 46 47 A G H X S+ 0 0 0 -4,-3.5 4,-3.0 1,-0.2 5,-0.2 0.818 104.8 59.0 -58.7 -32.0 61.5 16.9 64.2 47 48 A D H X S+ 0 0 81 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.920 108.0 43.9 -64.6 -44.9 62.5 13.5 65.6 48 49 A A H X S+ 0 0 64 -4,-1.4 4,-2.5 -3,-0.3 5,-0.2 0.889 114.4 50.5 -67.7 -37.6 61.2 14.4 69.1 49 50 A V H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.945 114.5 43.3 -64.4 -48.5 58.0 16.0 67.6 50 51 A L H X S+ 0 0 1 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.917 112.2 55.7 -62.2 -43.1 57.3 12.9 65.6 51 52 A G H X S+ 0 0 21 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.931 110.8 42.2 -57.3 -48.4 58.2 10.7 68.5 52 53 A L H X S+ 0 0 92 -4,-2.5 4,-3.4 2,-0.2 5,-0.2 0.954 114.0 52.0 -65.6 -47.6 55.7 12.4 70.9 53 54 A T H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.919 114.2 41.4 -55.8 -47.9 52.9 12.5 68.3 54 55 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.875 115.8 51.2 -69.1 -33.8 53.1 8.8 67.4 55 56 A T H X S+ 0 0 51 -4,-2.0 4,-2.3 -5,-0.3 -2,-0.2 0.943 110.9 48.5 -65.5 -47.7 53.5 7.9 71.1 56 57 A D H X S+ 0 0 48 -4,-3.4 4,-1.8 2,-0.2 -2,-0.2 0.895 113.1 47.6 -58.6 -46.6 50.5 10.0 72.0 57 58 A A H X S+ 0 0 13 -4,-2.2 4,-3.1 -5,-0.2 5,-0.2 0.956 112.6 45.9 -62.7 -54.2 48.4 8.4 69.2 58 59 A L H X S+ 0 0 4 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.890 109.1 58.8 -57.1 -39.2 49.3 4.8 69.9 59 60 A F H < S+ 0 0 135 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.920 113.7 36.8 -55.5 -47.9 48.7 5.5 73.6 60 61 A H H < S+ 0 0 124 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.893 115.3 52.9 -74.3 -40.6 45.1 6.5 72.9 61 62 A R H < S+ 0 0 123 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.666 117.8 35.9 -70.9 -17.9 44.3 4.0 70.2 62 63 A H >< + 0 0 28 -4,-1.5 3,-1.5 -5,-0.2 -1,-0.3 -0.547 63.8 163.2-137.6 71.0 45.4 1.0 72.3 63 64 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.711 78.6 51.3 -59.7 -25.2 44.4 1.7 75.9 64 65 A D T 3 S+ 0 0 160 -3,-0.1 2,-0.3 2,-0.1 -5,-0.1 0.432 87.9 98.9 -98.1 0.8 44.8 -2.0 76.8 65 66 A R S < S- 0 0 88 -3,-1.5 -3,-0.1 -6,-0.2 2,-0.0 -0.694 72.0-115.8 -93.8 143.5 48.3 -2.6 75.4 66 67 A S > - 0 0 67 -2,-0.3 4,-3.2 1,-0.1 5,-0.2 -0.207 27.1-105.5 -71.2 161.2 51.4 -2.6 77.6 67 68 A E H > S+ 0 0 170 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.942 122.3 53.0 -49.8 -51.9 54.3 -0.1 77.4 68 69 A G H > S+ 0 0 36 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.891 111.1 44.8 -51.4 -47.5 56.4 -2.8 75.7 69 70 A D H > S+ 0 0 59 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.932 112.3 52.3 -64.1 -45.0 53.8 -3.4 73.1 70 71 A L H X S+ 0 0 33 -4,-3.2 4,-2.3 1,-0.3 -2,-0.2 0.924 107.9 52.0 -57.3 -43.6 53.3 0.3 72.6 71 72 A A H X S+ 0 0 43 -4,-3.3 4,-1.8 -5,-0.2 -1,-0.3 0.869 111.5 47.8 -61.1 -34.7 57.1 0.6 72.1 72 73 A K H X S+ 0 0 138 -4,-1.7 4,-0.8 -5,-0.2 -2,-0.2 0.919 110.6 50.0 -72.4 -43.0 56.9 -2.2 69.5 73 74 A L H X S+ 0 0 11 -4,-3.1 4,-1.0 1,-0.2 3,-0.3 0.844 111.1 50.8 -63.0 -34.5 54.0 -0.5 67.7 74 75 A R H >X S+ 0 0 99 -4,-2.3 4,-2.0 -5,-0.2 3,-0.7 0.937 102.3 58.5 -69.1 -46.3 55.8 2.8 67.6 75 76 A A H 3X S+ 0 0 57 -4,-1.8 4,-0.6 1,-0.3 -1,-0.2 0.738 101.6 58.5 -55.1 -23.0 59.0 1.3 66.1 76 77 A S H 3< S+ 0 0 46 -4,-0.8 -1,-0.3 -3,-0.3 3,-0.2 0.914 110.3 41.1 -72.6 -43.2 56.9 0.1 63.2 77 78 A V H << S+ 0 0 0 -4,-1.0 -2,-0.2 -3,-0.7 -1,-0.2 0.768 120.4 37.7 -78.3 -29.8 55.8 3.6 62.4 78 79 A V H < S+ 0 0 38 -4,-2.0 -1,-0.2 4,-0.1 -2,-0.1 0.329 79.2 123.7-112.7 14.5 59.0 5.6 62.8 79 80 A N S X S- 0 0 64 -4,-0.6 4,-2.4 -3,-0.2 5,-0.2 -0.257 76.6-102.1 -69.2 159.0 61.8 3.4 61.6 80 81 A T H > S+ 0 0 77 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.900 122.0 50.9 -45.6 -50.7 64.2 4.7 58.8 81 82 A Q H > S+ 0 0 103 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.906 110.4 47.4 -55.6 -48.7 62.4 2.6 56.2 82 83 A A H > S+ 0 0 9 -3,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.875 113.1 49.0 -63.8 -38.7 58.9 3.8 57.1 83 84 A L H X S+ 0 0 4 -4,-2.4 4,-1.8 2,-0.2 3,-0.5 0.939 109.0 51.8 -66.1 -47.7 60.0 7.5 57.1 84 85 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.3 11,-0.2 0.911 106.4 54.0 -56.6 -44.9 61.8 7.3 53.8 85 86 A D H X S+ 0 0 50 -4,-2.0 4,-1.5 1,-0.2 -1,-0.3 0.833 105.9 53.1 -61.1 -31.9 58.7 5.8 52.1 86 87 A V H X S+ 0 0 22 -4,-1.1 4,-0.6 -3,-0.5 -1,-0.2 0.875 111.2 47.0 -70.4 -35.0 56.6 8.7 53.4 87 88 A A H >X S+ 0 0 0 -4,-1.8 8,-1.9 2,-0.2 3,-0.6 0.914 108.3 55.0 -70.8 -42.9 59.2 11.1 51.8 88 89 A R H 3< S+ 0 0 71 -4,-2.9 -1,-0.2 6,-0.3 -2,-0.2 0.830 121.1 29.9 -60.1 -33.6 59.2 9.2 48.5 89 90 A R H 3< S+ 0 0 179 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.350 87.0 104.8-109.1 5.6 55.4 9.5 48.2 90 91 A L H << S- 0 0 23 -3,-0.6 2,-0.3 -4,-0.6 -1,-0.1 0.888 99.0 -3.8 -51.6 -41.5 55.0 12.8 50.0 91 92 A C S < S- 0 0 15 -4,-0.5 3,-0.4 -3,-0.2 -1,-0.1 -0.953 87.9 -86.8-148.7 164.4 54.5 14.4 46.6 92 93 A A S S+ 0 0 107 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.880 128.2 36.3 -35.9 -66.0 54.6 13.4 42.9 93 94 A E S S- 0 0 63 1,-0.2 -1,-0.3 -92,-0.1 4,-0.3 0.809 113.0-131.0 -62.0 -30.3 58.3 14.0 42.4 94 95 A G - 0 0 3 -3,-0.4 4,-0.4 1,-0.1 -6,-0.3 -0.263 25.4 -81.1 96.4 169.9 58.9 12.7 45.9 95 96 A L S >> S+ 0 0 0 -8,-1.9 3,-2.2 -11,-0.2 4,-0.9 0.898 118.7 73.1 -77.2 -38.9 61.1 14.4 48.5 96 97 A G G >4 S+ 0 0 8 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.815 90.6 60.8 -42.3 -39.2 64.4 13.1 47.2 97 98 A V G 34 S+ 0 0 48 -4,-0.3 -1,-0.3 1,-0.2 -95,-0.2 0.824 105.7 45.5 -61.1 -33.3 64.1 15.5 44.3 98 99 A H G <4 S+ 0 0 9 -3,-2.2 -1,-0.2 -4,-0.4 2,-0.2 0.561 85.1 108.8 -90.7 -9.1 64.0 18.6 46.5 99 100 A V << - 0 0 15 -4,-0.9 2,-0.7 -3,-0.7 -74,-0.2 -0.489 69.1-129.6 -71.8 135.2 66.9 17.7 48.8 100 101 A L B +a 25 0A 40 -76,-2.6 -74,-1.5 -2,-0.2 -71,-0.5 -0.775 37.8 176.5 -86.7 116.7 70.1 19.8 48.3 101 102 A L - 0 0 25 -2,-0.7 -74,-0.0 -73,-0.2 2,-0.0 -0.879 29.5-108.9-124.3 154.8 73.0 17.3 48.0 102 103 A G > - 0 0 2 -2,-0.3 4,-3.1 1,-0.1 -73,-0.2 -0.309 39.1-102.6 -74.4 163.0 76.8 17.6 47.3 103 104 A R H > S+ 0 0 185 2,-0.2 4,-1.9 -75,-0.2 5,-0.2 0.949 121.3 44.6 -49.4 -58.6 78.3 16.5 44.0 104 105 A G H > S+ 0 0 45 1,-0.2 4,-0.9 2,-0.2 3,-0.5 0.967 117.0 41.4 -47.9 -75.1 79.6 13.3 45.5 105 106 A E H >4>S+ 0 0 60 1,-0.2 5,-1.9 2,-0.2 3,-0.7 0.826 111.1 63.9 -43.1 -39.8 76.5 12.3 47.4 106 107 A A H ><>S+ 0 0 46 -4,-3.1 3,-1.0 1,-0.2 5,-0.6 0.948 106.9 35.2 -53.5 -61.7 74.4 13.4 44.4 107 108 A N H 3<5S+ 0 0 133 -4,-1.9 -1,-0.2 -3,-0.5 -2,-0.2 0.425 104.9 72.9 -78.7 2.0 75.6 10.9 41.8 108 109 A T T <<5S- 0 0 107 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.1 0.187 126.7 -90.3 -97.7 14.9 76.0 8.0 44.3 109 110 A G T X>5S+ 0 0 41 -3,-1.0 3,-3.4 4,-0.0 4,-0.7 0.374 79.4 148.4 93.0 -3.7 72.3 7.7 44.5 110 111 A G G >4< + 0 0 0 -5,-1.9 3,-1.3 1,-0.3 6,-0.2 0.747 63.6 63.5 -28.9 -50.4 72.0 10.2 47.4 111 112 A A G 34 S+ 0 0 29 -2,-0.6 4,-3.3 1,-0.3 5,-0.3 0.855 97.7 61.1 -44.6 -41.0 66.4 6.1 52.5 115 116 A S H 3> S+ 0 0 44 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.923 108.5 40.4 -52.8 -50.7 68.7 7.3 55.2 116 117 A I H <> S+ 0 0 8 -3,-0.9 4,-2.5 -6,-0.2 -2,-0.2 0.903 115.1 52.3 -68.8 -40.7 68.8 10.8 53.7 117 118 A L H X S+ 0 0 3 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.884 109.6 49.1 -63.4 -39.6 65.1 10.7 52.9 118 119 A A H X S+ 0 0 2 -4,-3.3 4,-2.3 -5,-0.2 -1,-0.2 0.953 112.6 46.9 -65.1 -48.8 64.2 9.7 56.5 119 120 A D H X S+ 0 0 43 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.913 112.6 51.3 -57.9 -43.9 66.4 12.5 57.9 120 121 A G H X S+ 0 0 6 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.914 107.2 51.9 -60.2 -46.6 64.9 15.0 55.4 121 122 A M H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.930 110.5 49.1 -56.7 -45.8 61.3 14.0 56.4 122 123 A E H X S+ 0 0 11 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.873 106.8 55.9 -63.6 -36.6 62.1 14.6 60.0 123 124 A S H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.899 106.5 50.2 -61.7 -41.8 63.7 18.0 59.2 124 125 A L H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.933 109.4 49.8 -63.1 -44.0 60.5 19.2 57.6 125 126 A L H X S+ 0 0 1 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.907 111.1 52.5 -60.8 -38.5 58.4 18.1 60.6 126 127 A G H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.927 109.9 46.4 -63.0 -44.9 60.9 20.0 62.6 127 128 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.930 111.6 51.5 -65.0 -43.6 60.5 23.1 60.5 128 129 A I H X>S+ 0 0 0 -4,-3.2 4,-3.3 1,-0.2 5,-0.7 0.937 111.6 46.7 -57.7 -46.8 56.7 22.9 60.6 129 130 A Y H X5S+ 0 0 81 -4,-2.5 4,-0.8 3,-0.2 -1,-0.2 0.867 113.2 50.0 -63.5 -37.3 56.7 22.6 64.3 130 131 A L H <5S+ 0 0 104 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.928 117.8 38.5 -68.4 -41.9 59.1 25.5 64.6 131 132 A Q H <5S+ 0 0 91 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.896 134.9 15.6 -76.5 -40.4 57.0 27.7 62.4 132 133 A H H <5S- 0 0 83 -4,-3.3 -3,-0.2 -5,-0.3 -2,-0.1 0.783 99.9-116.1-109.9 -32.4 53.5 26.8 63.5 133 134 A G X< - 0 0 26 -4,-0.8 4,-2.1 -5,-0.7 3,-0.3 -0.403 41.6 -56.5 114.7 166.3 53.6 24.9 66.8 134 135 A M H > S+ 0 0 37 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.859 122.8 52.0 -51.2 -50.7 52.7 21.5 68.2 135 136 A E H > S+ 0 0 116 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.906 112.3 44.8 -62.0 -40.1 49.0 21.1 67.2 136 137 A K H > S+ 0 0 73 -3,-0.3 4,-2.6 2,-0.2 5,-0.2 0.944 115.0 48.7 -67.5 -44.8 49.5 22.0 63.5 137 138 A A H X S+ 0 0 1 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.926 110.1 54.1 -59.1 -41.2 52.6 19.7 63.4 138 139 A R H X S+ 0 0 52 -4,-3.2 4,-3.5 -5,-0.2 5,-0.3 0.957 108.7 48.0 -56.3 -52.5 50.4 17.1 65.1 139 140 A E H X S+ 0 0 110 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.961 112.3 47.7 -50.2 -61.3 47.7 17.4 62.3 140 141 A V H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.915 115.5 45.9 -48.9 -49.5 50.2 17.2 59.5 141 142 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.2 0.907 107.8 54.5 -64.6 -43.5 51.8 14.1 61.1 142 143 A L H < S+ 0 0 59 -4,-3.5 4,-0.3 -5,-0.2 -1,-0.2 0.909 113.5 47.0 -58.9 -33.1 48.5 12.4 61.9 143 144 A R H >< S+ 0 0 127 -4,-2.4 3,-0.8 -5,-0.3 -2,-0.2 0.974 115.3 40.0 -71.3 -57.2 47.8 12.8 58.2 144 145 A L H 3< S+ 0 0 26 -4,-2.7 4,-0.3 1,-0.2 -2,-0.2 0.851 127.3 35.8 -62.6 -33.8 51.0 11.6 56.7 145 146 A F T 3X S+ 0 0 0 -4,-2.7 4,-1.9 -5,-0.3 -1,-0.2 0.357 85.5 106.2-101.3 6.0 51.4 8.8 59.2 146 147 A G H <> S+ 0 0 14 -3,-0.8 4,-1.3 -4,-0.3 -1,-0.2 0.843 86.8 38.8 -51.5 -40.1 47.7 8.0 59.4 147 148 A P H > S+ 0 0 83 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.961 110.5 54.2 -75.6 -58.1 48.1 4.8 57.3 148 149 A L H > S+ 0 0 52 -4,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.809 108.5 56.8 -47.1 -31.5 51.4 3.5 58.7 149 150 A L H < S+ 0 0 2 -4,-1.9 3,-0.4 2,-0.2 -1,-0.2 0.981 104.9 46.2 -64.8 -59.1 49.6 3.8 62.1 150 151 A D H < S+ 0 0 105 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.772 113.8 53.4 -55.6 -26.3 46.7 1.6 61.2 151 152 A A H >< S+ 0 0 53 -4,-2.1 3,-2.9 1,-0.2 -1,-0.3 0.886 89.6 75.8 -76.0 -41.0 49.2 -0.8 59.8 152 153 A A T 3< S+ 0 0 13 -4,-1.9 -1,-0.2 -3,-0.4 -2,-0.2 0.800 81.4 68.8 -39.8 -45.6 51.3 -1.0 63.0 153 154 A P T 3 0 0 56 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.631 360.0 360.0 -53.9 -13.5 48.8 -3.3 64.7 154 155 A T < 0 0 168 -3,-2.9 -2,-0.0 -4,-0.1 -4,-0.0 -0.710 360.0 360.0-120.9 360.0 49.8 -6.0 62.3