==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JAN-06 2CDN . COMPND 2 MOLECULE: ADENYLATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR M.BELLINZONI,A.HAOUZ,M.GRANA,H.MUNIER-LEHMANN,P.M.ALZARI . 186 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9700.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 139 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 10.8 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 . 12 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 43.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.8 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 0 0 0 0 0 1 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 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 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 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 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 -4 A P 0 0 164 0, 0.0 185,-0.1 0, 0.0 184,-0.0 0.000 360.0 360.0 360.0 134.1 -6.6 -20.0 -2.6 2 -3 A R - 0 0 106 1,-0.3 3,-0.2 0, 0.0 2,-0.1 0.383 360.0 -91.2-118.5 -3.4 -6.8 -16.5 -4.1 3 -2 A G - 0 0 48 1,-0.1 -1,-0.3 3,-0.0 0, 0.0 -0.256 28.6-100.9 102.5 164.6 -3.4 -14.6 -4.0 4 -1 A S S S+ 0 0 37 -2,-0.1 2,-2.4 1,-0.1 -1,-0.1 0.336 77.0 115.1-109.9 3.8 -1.5 -12.4 -1.6 5 0 A H + 0 0 122 -3,-0.2 2,-0.2 80,-0.1 80,-0.1 -0.410 50.3 146.8 -80.3 69.9 -2.1 -8.9 -3.1 6 1 A M - 0 0 24 -2,-2.4 80,-1.6 23,-0.1 2,-0.6 -0.681 50.4-137.6-114.2 162.0 -4.2 -7.6 -0.2 7 2 A R E -a 86 0A 34 78,-0.2 106,-3.1 -2,-0.2 107,-1.6 -0.958 33.1-178.2-119.6 111.9 -4.9 -4.3 1.7 8 3 A V E -ab 87 114A 0 78,-2.2 80,-3.0 -2,-0.6 2,-0.4 -0.918 18.9-155.1-119.8 130.7 -4.9 -5.0 5.5 9 4 A L E -ab 88 115A 0 105,-2.4 107,-2.8 -2,-0.4 2,-0.6 -0.903 7.6-156.2 -98.6 134.9 -5.6 -2.7 8.5 10 5 A L E -ab 89 116A 2 78,-2.2 80,-1.0 -2,-0.4 2,-0.4 -0.972 16.9-176.3-106.6 121.8 -4.2 -3.6 11.9 11 6 A L E + b 0 117A 6 105,-3.2 107,-2.9 -2,-0.6 82,-0.1 -0.894 22.1 111.4-117.3 146.5 -6.2 -2.0 14.7 12 7 A G - 0 0 4 -2,-0.4 107,-0.1 105,-0.2 3,-0.1 -0.816 61.7 -72.1 159.5 156.8 -5.3 -2.2 18.4 13 8 A P > - 0 0 13 0, 0.0 3,-2.1 0, 0.0 5,-0.3 -0.227 68.7 -73.5 -67.3 160.3 -4.2 -0.4 21.5 14 9 A P T 3 S+ 0 0 8 0, 0.0 115,-0.2 0, 0.0 135,-0.0 -0.308 124.4 24.4 -51.9 130.0 -0.6 0.8 21.9 15 10 A G T 3 S+ 0 0 10 -3,-0.1 113,-0.1 113,-0.1 112,-0.0 0.413 81.2 124.2 92.1 -2.0 1.6 -2.2 22.7 16 11 A A S < S- 0 0 2 -3,-2.1 -5,-0.0 1,-0.1 105,-0.0 0.671 86.9-104.4 -69.8 -11.7 -0.8 -4.7 21.0 17 12 A G S > S+ 0 0 18 -4,-0.2 4,-2.5 -5,-0.1 5,-0.2 0.626 76.6 138.2 97.4 19.4 2.1 -6.0 18.7 18 13 A K H > S+ 0 0 12 -5,-0.3 4,-2.4 2,-0.2 5,-0.2 0.926 73.8 44.5 -62.9 -49.9 0.9 -4.2 15.5 19 14 A G H > S+ 0 0 33 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.926 114.1 53.3 -59.1 -43.9 4.4 -3.0 14.4 20 15 A T H > S+ 0 0 63 1,-0.2 4,-1.2 2,-0.2 -2,-0.2 0.910 115.1 36.7 -57.4 -51.5 5.7 -6.5 15.2 21 16 A Q H X S+ 0 0 5 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.788 109.0 63.6 -75.9 -29.9 3.2 -8.4 13.2 22 17 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.883 104.5 48.1 -61.8 -39.3 3.1 -5.9 10.3 23 18 A V H X S+ 0 0 81 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.923 114.5 45.7 -65.1 -43.4 6.8 -6.6 9.6 24 19 A K H X S+ 0 0 54 -4,-1.2 4,-2.1 1,-0.2 -2,-0.2 0.878 115.5 45.9 -67.6 -40.3 6.2 -10.3 9.6 25 20 A L H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.869 109.2 55.7 -71.9 -36.2 3.0 -10.1 7.5 26 21 A A H X>S+ 0 0 14 -4,-2.2 4,-1.7 -5,-0.2 5,-1.3 0.930 110.9 45.0 -60.8 -44.6 4.7 -7.7 5.0 27 22 A E H <5S+ 0 0 83 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.939 116.0 45.2 -65.4 -45.5 7.5 -10.3 4.5 28 23 A K H <5S+ 0 0 136 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.909 121.0 38.1 -65.5 -42.4 5.2 -13.2 4.2 29 24 A L H <5S- 0 0 7 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.617 102.4-125.9 -89.4 -14.6 2.7 -11.5 1.8 30 25 A G T <5S+ 0 0 68 -4,-1.7 -3,-0.2 1,-0.3 -4,-0.1 0.881 71.2 114.9 71.9 35.8 5.3 -9.5 -0.3 31 26 A I < - 0 0 10 -5,-1.3 -1,-0.3 -6,-0.2 55,-0.2 -0.949 69.4 -99.4-131.1 155.0 3.6 -6.1 0.4 32 27 A P - 0 0 27 0, 0.0 55,-2.3 0, 0.0 2,-0.4 -0.417 24.7-135.1 -76.2 148.6 4.9 -3.1 2.2 33 28 A Q E -c 87 0A 70 53,-0.2 2,-0.5 -2,-0.1 55,-0.2 -0.826 18.1-160.2 -94.8 144.3 4.0 -2.2 5.8 34 29 A I E -c 88 0A 3 53,-2.8 55,-3.0 -2,-0.4 2,-0.5 -0.984 7.1-173.1-128.7 112.9 3.2 1.4 6.4 35 30 A S E > -c 89 0A 17 -2,-0.5 4,-2.1 53,-0.2 55,-0.2 -0.960 15.8-160.8-110.9 119.5 3.3 2.9 9.9 36 31 A T H > S+ 0 0 6 53,-1.1 4,-2.4 -2,-0.5 5,-0.2 0.877 96.5 55.6 -62.5 -41.2 2.1 6.4 10.5 37 32 A G H > S+ 0 0 12 52,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.943 108.6 48.8 -52.6 -49.9 4.1 6.5 13.8 38 33 A E H > S+ 0 0 73 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.908 110.9 49.9 -57.1 -43.0 7.2 5.6 11.8 39 34 A L H X S+ 0 0 36 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.872 111.8 47.2 -66.6 -38.9 6.6 8.3 9.2 40 35 A F H X S+ 0 0 12 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.924 110.7 52.7 -66.2 -43.4 6.0 11.0 11.8 41 36 A R H X S+ 0 0 71 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.868 108.9 49.7 -61.8 -35.6 9.2 9.9 13.6 42 37 A R H X S+ 0 0 128 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.870 110.2 50.5 -66.6 -39.2 11.2 10.2 10.3 43 38 A N H <>S+ 0 0 33 -4,-1.7 5,-2.3 2,-0.2 4,-0.5 0.901 110.6 50.5 -63.0 -41.5 9.8 13.7 9.7 44 39 A I H ><5S+ 0 0 46 -4,-2.5 3,-1.3 7,-0.2 -2,-0.2 0.952 111.2 47.3 -60.2 -51.1 10.8 14.6 13.3 45 40 A E H 3<5S+ 0 0 129 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.686 113.3 46.9 -72.6 -20.3 14.4 13.3 12.8 46 41 A E T 3<5S- 0 0 146 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.458 110.4-127.0 -91.8 -4.1 14.9 15.0 9.4 47 42 A G T < 5 + 0 0 53 -3,-1.3 -3,-0.2 -4,-0.5 -2,-0.1 0.875 45.3 169.3 60.5 43.8 13.5 18.2 11.0 48 43 A T >< - 0 0 51 -5,-2.3 4,-2.5 -6,-0.1 5,-0.1 -0.324 51.1-106.9 -73.2 164.2 10.8 18.9 8.4 49 44 A K H > S+ 0 0 196 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.862 125.3 50.3 -59.8 -38.4 8.1 21.5 9.0 50 45 A L H > S+ 0 0 34 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.930 109.0 52.2 -62.1 -47.2 5.6 18.5 9.5 51 46 A G H > S+ 0 0 2 -8,-0.3 4,-2.2 2,-0.2 -7,-0.2 0.928 107.7 51.3 -52.9 -49.7 8.0 17.0 12.0 52 47 A V H X S+ 0 0 108 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.946 116.4 39.6 -57.2 -47.8 8.2 20.2 14.0 53 48 A E H X S+ 0 0 98 -4,-2.0 4,-0.6 1,-0.2 3,-0.4 0.885 115.6 51.7 -72.1 -34.5 4.4 20.5 14.2 54 49 A A H >X S+ 0 0 0 -4,-3.4 4,-2.3 1,-0.2 3,-0.6 0.825 93.6 73.8 -70.7 -29.7 3.8 16.7 14.8 55 50 A K H 3X S+ 0 0 96 -4,-2.2 4,-2.7 1,-0.3 5,-0.2 0.825 88.5 57.4 -58.9 -39.2 6.3 16.4 17.7 56 51 A R H 3X S+ 0 0 71 -4,-0.6 4,-1.1 -3,-0.4 -1,-0.3 0.915 112.2 44.1 -56.0 -43.6 4.1 18.2 20.3 57 52 A Y H S+ 0 0 73 -3,-0.6 5,-1.7 -4,-0.6 4,-1.0 0.961 114.2 47.0 -69.8 -49.2 1.4 15.6 19.6 58 53 A L H ><5S+ 0 0 28 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.903 109.2 54.7 -58.1 -43.1 3.7 12.5 19.6 59 54 A D H 3<5S+ 0 0 81 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.830 113.2 42.5 -60.7 -33.0 5.5 13.5 22.7 60 55 A A H 3<5S- 0 0 40 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.536 112.7-113.2 -90.6 -11.8 2.2 13.8 24.6 61 56 A G T <<5S+ 0 0 8 -4,-1.0 -3,-0.2 -3,-0.8 2,-0.2 0.577 73.3 135.3 87.1 6.6 0.5 10.7 23.3 62 57 A D < - 0 0 72 -5,-1.7 -1,-0.3 -6,-0.3 2,-0.2 -0.521 62.7-102.1 -80.8 156.7 -2.1 12.7 21.4 63 58 A L - 0 0 48 -2,-0.2 3,-0.1 -3,-0.1 -1,-0.1 -0.589 35.7-114.2 -73.1 138.3 -3.1 12.1 17.8 64 59 A V - 0 0 7 -2,-0.2 5,-0.1 1,-0.1 -10,-0.1 -0.542 52.8 -83.6 -61.7 138.2 -1.6 14.4 15.2 65 60 A P >> - 0 0 38 0, 0.0 4,-1.8 0, 0.0 3,-0.6 -0.154 39.8-120.6 -49.8 145.4 -4.4 16.5 13.7 66 61 A S H 3> S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.735 105.9 63.0 -66.3 -29.2 -6.2 14.6 10.9 67 62 A D H 3> S+ 0 0 114 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.925 110.5 41.5 -62.8 -39.3 -5.6 17.1 8.1 68 63 A L H <> S+ 0 0 32 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.893 117.7 46.3 -74.4 -41.8 -1.8 16.5 8.5 69 64 A T H X S+ 0 0 5 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.926 111.4 50.4 -69.1 -44.7 -2.1 12.8 8.9 70 65 A N H X S+ 0 0 21 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.917 112.1 48.2 -58.8 -42.5 -4.6 12.2 6.0 71 66 A E H X S+ 0 0 108 -4,-1.6 4,-2.4 -5,-0.3 -1,-0.2 0.930 110.7 51.2 -65.6 -46.4 -2.3 14.2 3.6 72 67 A L H X S+ 0 0 16 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.857 112.7 44.6 -58.1 -43.5 0.8 12.2 4.8 73 68 A V H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.915 110.9 54.4 -69.5 -42.0 -0.9 8.8 4.2 74 69 A D H < S+ 0 0 44 -4,-2.7 4,-0.4 -5,-0.2 -2,-0.2 0.914 111.4 46.5 -54.8 -42.3 -2.3 10.0 0.8 75 70 A D H >< S+ 0 0 106 -4,-2.4 3,-1.1 1,-0.2 -1,-0.2 0.918 111.3 50.2 -68.4 -44.5 1.3 10.9 -0.2 76 71 A R H >< S+ 0 0 54 -4,-2.0 3,-1.5 1,-0.3 -1,-0.2 0.850 105.7 56.4 -60.2 -40.5 2.8 7.6 1.0 77 72 A L T 3< S+ 0 0 13 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.579 92.9 71.5 -72.5 -9.7 0.2 5.7 -0.9 78 73 A N T < S+ 0 0 112 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.545 73.3 104.2 -76.9 -10.9 1.3 7.5 -4.0 79 74 A N S X S- 0 0 75 -3,-1.5 3,-1.9 -4,-0.2 4,-0.1 -0.582 78.4-133.4 -69.8 128.0 4.6 5.4 -3.9 80 75 A P G > S+ 0 0 112 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.713 99.5 78.6 -57.7 -17.7 4.3 2.7 -6.6 81 76 A D G 3 S+ 0 0 72 1,-0.3 3,-0.4 2,-0.1 -4,-0.1 0.755 93.6 49.8 -57.8 -22.5 5.6 0.2 -3.9 82 77 A A G X S+ 0 0 5 -3,-1.9 3,-1.3 -6,-0.2 -1,-0.3 0.307 79.9 103.1-100.3 8.9 2.0 0.2 -2.5 83 78 A A T < S+ 0 0 59 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.779 85.7 38.3 -68.7 -29.6 0.3 -0.5 -5.9 84 79 A N T 3 S- 0 0 98 1,-0.4 -1,-0.3 -3,-0.4 2,-0.2 -0.030 128.7 -58.9-108.2 29.6 -0.4 -4.2 -5.2 85 80 A G < - 0 0 0 -3,-1.3 -1,-0.4 -80,-0.1 2,-0.3 -0.485 49.1-156.4 119.3 168.3 -1.3 -4.0 -1.6 86 81 A F E -a 7 0A 2 -80,-1.6 -78,-2.2 -55,-0.2 2,-0.5 -0.972 20.8-120.4-168.9 164.9 -0.1 -3.0 1.8 87 82 A I E -ac 8 33A 0 -55,-2.3 -53,-2.8 -2,-0.3 2,-0.5 -0.998 27.4-151.4-117.4 122.2 -0.4 -3.5 5.6 88 83 A L E -ac 9 34A 0 -80,-3.0 -78,-2.2 -2,-0.5 2,-0.5 -0.844 9.6-168.7 -97.4 130.9 -1.3 -0.3 7.5 89 84 A D E S-ac 10 35A 16 -55,-3.0 -53,-1.1 -2,-0.5 -52,-0.4 -0.956 73.1 -1.5-124.4 105.7 -0.1 -0.1 11.1 90 85 A G S S+ 0 0 5 -80,-1.0 -1,-0.1 -2,-0.5 -55,-0.1 0.532 100.7 123.8 90.3 5.7 -1.6 2.8 13.2 91 86 A Y + 0 0 1 -81,-0.2 -81,-0.3 -57,-0.2 -1,-0.1 -0.973 57.0 34.9-141.3 136.2 -3.8 4.4 10.5 92 87 A P + 0 0 1 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.607 64.3 160.5 -77.8 154.2 -6.7 4.9 10.5 93 88 A R + 0 0 61 -2,-0.1 2,-0.3 1,-0.1 61,-0.1 0.169 64.6 36.5-124.2 11.1 -7.1 5.8 14.2 94 89 A S S > S- 0 0 6 59,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.965 85.8-109.3-154.0 160.3 -10.5 7.7 14.0 95 90 A V H > S+ 0 0 40 57,-0.4 4,-2.3 -2,-0.3 5,-0.2 0.884 119.6 57.2 -61.7 -38.0 -13.7 7.4 12.0 96 91 A E H > S+ 0 0 97 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.928 107.3 47.1 -55.4 -48.8 -12.7 10.6 10.1 97 92 A Q H > S+ 0 0 5 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.889 109.8 54.1 -60.8 -38.7 -9.4 8.9 9.1 98 93 A A H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.888 111.2 45.2 -61.3 -38.8 -11.3 5.8 8.0 99 94 A K H X S+ 0 0 112 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.894 113.1 50.4 -74.0 -37.4 -13.5 7.9 5.8 100 95 A A H X S+ 0 0 11 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.909 110.1 50.7 -61.8 -41.1 -10.5 9.7 4.4 101 96 A L H X S+ 0 0 1 -4,-2.9 4,-2.2 2,-0.2 5,-0.3 0.917 105.7 55.0 -62.1 -45.0 -8.8 6.4 3.7 102 97 A H H X S+ 0 0 71 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.931 109.8 47.7 -53.8 -48.5 -11.9 5.1 1.8 103 98 A E H X S+ 0 0 122 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.905 109.8 52.1 -57.2 -47.7 -11.7 8.2 -0.4 104 99 A M H X S+ 0 0 6 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.844 114.6 42.1 -56.9 -40.9 -8.0 7.9 -1.1 105 100 A L H <>S+ 0 0 2 -4,-2.2 5,-2.4 2,-0.2 -2,-0.2 0.869 110.0 55.8 -79.5 -40.1 -8.3 4.2 -2.1 106 101 A E H ><5S+ 0 0 117 -4,-2.7 3,-2.1 -5,-0.3 -2,-0.2 0.922 103.5 56.0 -54.8 -49.8 -11.5 4.8 -4.2 107 102 A R H 3<5S+ 0 0 157 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.852 111.0 45.7 -44.2 -41.5 -9.6 7.5 -6.2 108 103 A R T 3<5S- 0 0 78 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.364 121.6-110.5 -89.3 5.6 -7.0 4.7 -6.9 109 104 A G T < 5S+ 0 0 70 -3,-2.1 -3,-0.2 1,-0.2 2,-0.2 0.802 83.5 85.6 73.1 34.2 -9.8 2.1 -7.8 110 105 A T < - 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