==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/RNA 23-MAY-09 3A2K . COMPND 2 MOLECULE: TRNA(ILE)-LYSIDINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS KAUSTOPHILUS; . AUTHOR K.NAKANISHI,L.BONNEFOND,R.ISHITANI,O.NUREKI . 924 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48152.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 650 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 13.4 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 . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 2 0.2 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 . 61 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 287 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.5 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 3 0 4 4 4 0 2 0 0 2 4 2 2 2 0 0 0 0 0 1 0 0 0 0 1 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 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 PARALLEL BRIDGES PER LADDER . 2 6 4 4 8 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 4 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 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 M 0 0 29 0, 0.0 2,-1.4 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 128.0 -59.8 16.4 5.6 2 2 A I + 0 0 87 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.051 360.0 19.6 64.8 -33.6 -63.0 14.7 4.5 3 3 A D S > S+ 0 0 106 -2,-1.4 4,-5.3 3,-0.2 5,-0.4 0.603 120.1 56.8-129.8 -42.2 -60.7 12.9 2.1 4 4 A K H > S+ 0 0 96 -3,-0.5 4,-2.6 1,-0.2 5,-0.1 0.988 123.0 35.7 -51.9 -51.8 -57.2 13.2 3.6 5 5 A V H > S+ 0 0 10 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.785 117.4 52.1 -73.5 -26.1 -58.9 11.6 6.5 6 6 A R H > S+ 0 0 86 2,-0.2 4,-1.9 1,-0.1 -2,-0.2 0.892 109.8 49.3 -73.4 -38.8 -61.2 9.5 4.2 7 7 A A H >X S+ 0 0 58 -4,-5.3 4,-4.4 1,-0.2 3,-0.5 0.974 109.5 53.1 -57.2 -53.8 -58.1 8.2 2.4 8 8 A F H 3X S+ 0 0 17 -4,-2.6 4,-2.3 -5,-0.4 -1,-0.2 0.871 105.7 52.9 -46.9 -44.5 -56.6 7.5 5.7 9 9 A I H 3< S+ 0 0 26 -4,-1.6 6,-0.7 2,-0.2 7,-0.3 0.909 117.0 39.3 -60.3 -40.2 -59.8 5.5 6.6 10 10 A H H X< S+ 0 0 101 -4,-1.9 3,-2.1 -3,-0.5 -2,-0.2 0.930 109.0 58.9 -77.3 -50.7 -59.2 3.6 3.4 11 11 A R H 3< S+ 0 0 136 -4,-4.4 -2,-0.2 1,-0.3 -3,-0.2 0.940 119.1 32.6 -37.6 -58.7 -55.4 3.3 3.6 12 12 A H T 3< S- 0 0 34 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.215 101.3-169.7 -95.2 15.1 -55.9 1.5 7.0 13 13 A Q < + 0 0 64 -3,-2.1 -1,-0.1 1,-0.2 4,-0.1 0.367 59.2 73.5 34.0-161.6 -59.1 -0.1 5.9 14 14 A L S S+ 0 0 56 1,-0.2 3,-0.4 2,-0.1 -1,-0.2 0.456 82.4 92.0 33.3 5.9 -61.5 -2.0 8.3 15 15 A L S S+ 0 0 15 -6,-0.7 2,-0.4 1,-0.2 -1,-0.2 0.837 89.4 33.7 -89.5 -36.0 -62.4 1.6 9.5 16 16 A S S S+ 0 0 23 -7,-0.3 -1,-0.2 -10,-0.1 2,-0.2 -0.629 91.9 109.9-118.8 67.2 -65.3 2.2 7.1 17 17 A E + 0 0 92 -2,-0.4 2,-0.3 -3,-0.4 29,-0.1 -0.664 68.4 4.6-149.2 89.5 -66.9 -1.2 6.8 18 18 A G S S- 0 0 34 27,-0.4 -2,-0.0 -2,-0.2 -3,-0.0 -0.789 84.1 -78.9 152.4-105.7 -70.2 -2.2 8.3 19 19 A A S S+ 0 0 59 -2,-0.3 29,-2.3 1,-0.1 2,-0.5 0.423 84.7 79.9-171.9 -17.8 -72.9 -0.2 10.2 20 20 A A B +a 48 0A 29 27,-0.2 102,-2.3 99,-0.1 101,-2.1 -0.906 41.3 161.3-129.6 112.9 -72.2 0.5 13.9 21 21 A V E -b 122 0B 2 27,-1.7 2,-0.5 -2,-0.5 29,-0.3 -0.931 24.5-162.0-126.8 150.8 -70.0 3.2 15.6 22 22 A I E -b 123 0B 0 100,-1.3 102,-0.8 -2,-0.3 2,-0.8 -0.919 18.8-167.2-125.0 99.8 -69.6 4.8 19.0 23 23 A V E -bc 124 51B 0 27,-1.2 29,-1.6 -2,-0.5 102,-0.2 -0.808 10.6-148.6 -96.4 109.1 -67.7 8.0 18.6 24 24 A G E - c 0 52B 1 100,-1.6 102,-0.4 -2,-0.8 2,-0.3 -0.294 13.4-170.1 -76.8 159.7 -66.5 9.5 21.9 25 25 A V + 0 0 7 27,-1.5 29,-0.5 100,-0.1 45,-0.0 -0.997 14.2 158.6-153.2 136.2 -66.0 13.1 22.7 26 26 A S + 0 0 30 -2,-0.3 -1,-0.0 27,-0.1 6,-0.0 0.273 56.4 23.4-124.3-106.4 -64.4 15.2 25.4 27 27 A G S S- 0 0 32 4,-0.1 -2,-0.0 5,-0.0 0, 0.0 0.830 87.2 -98.3 -36.5-107.4 -63.2 18.7 25.6 28 28 A G S > S+ 0 0 19 159,-0.0 4,-2.2 42,-0.0 5,-0.3 0.012 97.1 37.5-141.5 -96.9 -64.6 21.1 23.0 29 29 A P H > S+ 0 0 15 0, 0.0 4,-1.4 0, 0.0 159,-0.1 0.743 121.2 40.4 -33.4 -59.9 -62.9 22.1 19.7 30 30 A D H > S+ 0 0 58 1,-0.2 4,-1.5 2,-0.2 3,-0.1 0.969 115.2 47.6 -62.0 -58.8 -61.3 18.7 18.9 31 31 A S H > S+ 0 0 14 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.816 110.1 51.1 -61.8 -37.2 -64.2 16.4 19.9 32 32 A L H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.943 104.8 57.2 -65.1 -46.5 -67.0 18.3 18.1 33 33 A A H X S+ 0 0 0 -4,-1.4 4,-2.1 -5,-0.3 5,-0.2 0.881 102.9 56.1 -52.2 -44.1 -65.1 18.4 14.8 34 34 A L H X S+ 0 0 4 -4,-1.5 4,-2.8 2,-0.2 3,-0.2 0.975 104.9 49.0 -49.2 -73.6 -64.8 14.6 14.8 35 35 A L H X S+ 0 0 6 -4,-1.3 4,-3.5 1,-0.2 -1,-0.2 0.863 109.9 54.8 -26.6 -62.0 -68.6 13.9 15.1 36 36 A H H X S+ 0 0 16 -4,-2.0 4,-2.0 1,-0.3 -1,-0.2 0.928 111.4 40.8 -43.1 -64.3 -69.1 16.3 12.3 37 37 A V H X S+ 0 0 7 -4,-2.1 4,-1.8 1,-0.2 -1,-0.3 0.797 115.3 54.9 -59.7 -32.1 -66.8 14.6 9.8 38 38 A F H X S+ 0 0 35 -4,-2.8 4,-1.8 -5,-0.2 3,-0.4 0.992 104.3 51.6 -64.4 -61.2 -68.1 11.3 11.0 39 39 A L H >X S+ 0 0 23 -4,-3.5 4,-1.7 1,-0.2 3,-0.9 0.890 112.3 46.6 -38.6 -58.7 -71.7 12.2 10.3 40 40 A S H 3X S+ 0 0 42 -4,-2.0 4,-1.8 1,-0.3 -1,-0.2 0.863 115.6 43.3 -57.6 -42.5 -70.9 13.2 6.7 41 41 A L H 3< S+ 0 0 21 -4,-1.8 4,-0.4 -3,-0.4 -1,-0.3 0.596 108.1 61.1 -82.9 -9.4 -68.8 10.2 5.9 42 42 A R H <<>S+ 0 0 13 -4,-1.8 5,-1.7 -3,-0.9 -2,-0.2 0.815 106.7 43.9 -85.3 -35.6 -71.3 7.8 7.6 43 43 A D H ><5S+ 0 0 123 -4,-1.7 3,-1.4 -5,-0.3 -2,-0.2 0.965 115.4 51.5 -60.6 -53.7 -74.0 8.8 5.2 44 44 A E T 3<5S+ 0 0 82 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.671 119.7 34.9 -54.8 -22.6 -71.4 8.5 2.5 45 45 A W T 3 5S- 0 0 86 -4,-0.4 -27,-0.4 2,-0.1 -1,-0.3 0.003 117.0 -90.9-135.5 30.4 -70.4 5.0 3.7 46 46 A K T < 5S+ 0 0 120 -3,-1.4 2,-0.4 1,-0.2 -3,-0.2 0.959 74.5 145.5 77.9 58.2 -73.4 3.1 5.0 47 47 A L < - 0 0 35 -5,-1.7 2,-0.6 -8,-0.1 -1,-0.2 -0.972 51.5-145.7-156.4 136.2 -73.5 3.9 8.6 48 48 A Q B -a 20 0A 121 -29,-2.3 -27,-1.7 -2,-0.4 2,-0.2 -0.855 29.9-154.4-100.5 108.9 -75.2 4.6 12.0 49 49 A V - 0 0 14 -2,-0.6 31,-0.5 -29,-0.1 2,-0.3 -0.526 12.6-175.7 -86.2 144.8 -73.4 7.2 14.3 50 50 A I E - d 0 80B 5 -29,-0.3 -27,-1.2 -2,-0.2 31,-0.2 -0.824 14.9-147.8-143.9 101.7 -73.7 7.4 18.1 51 51 A A E -cd 23 81B 8 29,-0.9 31,-0.7 -2,-0.3 2,-0.3 -0.359 17.3-175.6 -65.5 146.5 -72.0 10.2 20.1 52 52 A A E +cd 24 82B 1 -29,-1.6 -27,-1.5 29,-0.1 2,-0.4 -0.894 5.3 174.0-151.4 112.5 -70.7 9.3 23.6 53 53 A H E - d 0 83B 5 29,-1.0 31,-1.3 -2,-0.3 2,-0.4 -0.983 10.8-162.9-129.9 132.3 -69.2 11.8 26.0 54 54 A V E - d 0 84B 15 -29,-0.5 2,-0.6 -2,-0.4 31,-0.2 -0.867 11.7-142.3-111.4 140.6 -68.2 11.2 29.6 55 55 A D E - d 0 85B 1 29,-0.9 31,-2.4 -2,-0.4 2,-0.1 -0.933 16.5-164.2-107.4 125.4 -67.5 13.9 32.2 56 56 A H > - 0 0 50 -2,-0.6 3,-0.6 29,-0.2 2,-0.5 -0.287 34.5 -80.0 -90.9 175.6 -64.7 13.3 34.6 57 57 A M T 3 S+ 0 0 68 29,-0.4 -1,-0.1 1,-0.2 30,-0.0 -0.757 98.7 77.4 -93.1 128.4 -64.1 15.2 37.8 58 58 A F T 3 S+ 0 0 112 -2,-0.5 -1,-0.2 2,-0.0 4,-0.1 -0.142 71.4 162.7 167.7 -25.6 -62.5 18.7 37.9 59 59 A R X + 0 0 125 -3,-0.6 3,-0.9 1,-0.1 2,-0.2 0.290 17.3 120.5 48.5-143.9 -65.8 20.1 36.7 60 60 A G T 3> S- 0 0 40 1,-0.2 4,-1.4 2,-0.2 5,-0.2 -0.557 98.5 -15.6 76.7-142.4 -66.9 23.8 36.9 61 61 A R H 3>>S+ 0 0 170 -2,-0.2 4,-1.7 1,-0.2 5,-0.6 0.768 138.0 61.9 -63.9 -26.2 -67.7 25.4 33.6 62 62 A E H <>>S+ 0 0 42 -3,-0.9 4,-1.6 3,-0.2 5,-0.6 0.987 101.6 46.3 -64.2 -60.9 -65.9 22.5 31.8 63 63 A S H >5S+ 0 0 5 3,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.921 123.7 34.3 -48.2 -53.1 -68.2 19.6 33.0 64 64 A E H X5S+ 0 0 81 -4,-1.4 4,-3.4 2,-0.2 5,-0.4 0.989 120.2 42.6 -71.2 -63.9 -71.4 21.5 32.2 65 65 A E H X5S+ 0 0 86 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.944 118.7 46.6 -51.1 -56.3 -70.6 23.6 29.1 66 66 A E H XX S+ 0 0 12 -4,-1.1 4,-2.5 -3,-0.4 3,-1.5 0.858 108.7 56.1 -78.5 -47.4 -72.6 18.2 22.8 71 71 A K H 3X S+ 0 0 94 -4,-1.7 4,-1.8 1,-0.3 -2,-0.2 0.928 106.9 48.2 -46.4 -54.7 -76.2 17.5 23.9 72 72 A R H 3X S+ 0 0 99 -4,-2.4 4,-1.4 1,-0.2 -1,-0.3 0.636 111.5 52.6 -68.3 -12.3 -77.5 20.3 21.8 73 73 A F H <> S+ 0 0 29 -3,-1.5 4,-0.8 2,-0.2 -1,-0.2 0.864 101.6 55.7 -87.8 -40.9 -75.5 19.0 18.9 74 74 A a H ><>S+ 0 0 6 -4,-2.5 5,-2.9 1,-0.2 3,-0.6 0.921 116.0 40.7 -53.5 -45.2 -76.7 15.4 19.0 75 75 A V H ><5S+ 0 0 109 -4,-1.8 3,-2.6 3,-0.2 -1,-0.2 0.954 105.4 64.0 -66.7 -50.4 -80.2 16.9 18.7 76 76 A E H 3<5S+ 0 0 135 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.583 120.2 25.8 -53.3 -11.3 -79.1 19.5 16.1 77 77 A R T <<5S- 0 0 104 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 -0.012 112.9-107.2-142.7 36.7 -78.3 16.5 13.8 78 78 A R T < 5 + 0 0 243 -3,-2.6 2,-0.4 1,-0.2 -3,-0.2 0.893 65.4 151.1 43.3 65.3 -80.6 13.7 15.0 79 79 A I < - 0 0 18 -5,-2.9 -1,-0.2 -6,-0.1 2,-0.1 -0.986 55.5-112.9-133.1 128.6 -78.0 11.6 16.8 80 80 A L E -d 50 0B 99 -31,-0.5 -29,-0.9 -2,-0.4 2,-0.5 -0.404 33.7-159.0 -56.5 122.4 -78.3 9.3 19.7 81 81 A a E -d 51 0B 24 -31,-0.2 2,-0.2 -2,-0.1 -29,-0.1 -0.448 3.1-163.5-112.2 57.5 -76.2 11.2 22.3 82 82 A E E -d 52 0B 63 -31,-0.7 -29,-1.0 -2,-0.5 2,-0.2 -0.176 19.2-174.1 -47.0 103.4 -75.3 8.6 24.8 83 83 A T E +d 53 0B 33 -2,-0.2 2,-0.3 -31,-0.2 -29,-0.2 -0.583 14.6 152.5-103.7 160.7 -74.2 10.6 27.8 84 84 A A E -d 54 0B 30 -31,-1.3 -29,-0.9 -2,-0.2 2,-0.3 -0.965 19.5-153.2-167.2-179.5 -72.6 9.8 31.2 85 85 A Q E -d 55 0B 92 -2,-0.3 2,-0.4 -31,-0.2 -29,-0.2 -0.896 5.0-171.3-166.4 135.7 -70.4 11.2 34.0 86 86 A I + 0 0 53 -31,-2.4 -29,-0.4 -2,-0.3 21,-0.1 -0.952 11.2 173.3-134.5 120.0 -68.1 9.9 36.7 87 87 A D + 0 0 50 -2,-0.4 3,-0.5 -31,-0.2 -31,-0.1 -0.094 58.5 102.9-109.1 28.1 -66.6 12.0 39.5 88 88 A V > + 0 0 59 1,-0.2 4,-2.7 2,-0.2 6,-0.3 0.030 37.9 108.2 -97.2 21.6 -65.1 9.0 41.2 89 89 A P H > S+ 0 0 18 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.968 84.6 51.2 -44.9 -48.1 -61.8 9.8 39.9 90 90 A A H 4 S+ 0 0 74 -3,-0.5 -2,-0.2 1,-0.2 -3,-0.0 0.773 117.8 35.8 -60.9 -28.7 -61.4 10.7 43.6 91 91 A F H 4 S+ 0 0 160 2,-0.2 -1,-0.2 3,-0.1 -3,-0.1 0.556 113.5 59.1-100.7 -15.1 -62.8 7.2 44.6 92 92 A Q H >X>S+ 0 0 39 -4,-2.7 3,-2.1 2,-0.2 5,-0.6 0.931 108.5 43.5 -73.5 -50.9 -61.1 5.5 41.7 93 93 A R T 3<5S+ 0 0 116 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.579 105.9 64.1 -69.7 -10.8 -57.7 6.6 42.9 94 94 A S T 345S+ 0 0 95 -5,-0.3 -1,-0.3 -6,-0.3 -2,-0.2 0.353 102.8 51.0 -89.4 3.3 -59.0 5.6 46.3 95 95 A A T <45S- 0 0 79 -3,-2.1 -2,-0.2 2,-0.1 -1,-0.2 0.498 136.3 -63.4-114.3 -11.0 -59.0 2.1 44.7 96 96 A G T <5S+ 0 0 63 -4,-0.5 -3,-0.2 1,-0.3 -4,-0.1 0.168 92.4 79.7 166.4 -38.2 -55.5 2.0 43.3 97 97 A L < - 0 0 88 -5,-0.6 -1,-0.3 1,-0.1 -2,-0.1 -0.129 58.5-116.0-105.1-174.5 -54.2 4.5 40.6 98 98 A G - 0 0 35 -2,-0.0 -1,-0.1 1,-0.0 -2,-0.1 0.734 52.3 -79.0 -86.7-113.4 -53.0 8.0 39.7 99 99 A A S > S+ 0 0 31 -7,-0.1 4,-1.2 3,-0.0 3,-0.4 0.555 112.4 36.4-123.2 -85.4 -54.8 10.4 37.5 100 100 A Q H > S+ 0 0 95 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.669 112.6 65.1 -53.6 -19.8 -54.8 10.2 33.7 101 101 A E H > S+ 0 0 64 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.992 98.6 49.2 -60.7 -64.9 -54.9 6.4 34.1 102 102 A A H >>S+ 0 0 7 -3,-0.4 4,-1.9 1,-0.2 5,-0.5 0.777 106.4 65.9 -44.6 -28.9 -58.3 6.5 35.7 103 103 A A H X5S+ 0 0 21 -4,-1.2 4,-3.1 3,-0.2 5,-0.3 0.996 109.8 28.4 -54.6 -76.3 -59.1 8.6 32.7 104 104 A R H X5S+ 0 0 123 -4,-1.6 4,-3.0 1,-0.2 5,-0.3 0.866 120.7 54.5 -61.9 -37.8 -58.7 6.1 30.0 105 105 A I H X5S+ 0 0 71 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.943 119.0 33.7 -62.7 -46.0 -59.6 3.0 32.2 106 106 A C H X5S+ 0 0 24 -4,-1.9 4,-2.2 -5,-0.3 5,-0.2 0.985 118.4 51.4 -73.7 -57.1 -62.9 4.5 33.2 107 107 A R H X<>S+ 0 0 5 -4,-2.6 5,-0.9 -5,-0.2 3,-0.8 0.957 120.8 34.1 -70.9 -49.3 -70.1 -1.2 22.3 116 116 A E H ><5S+ 0 0 131 -4,-2.7 3,-0.7 1,-0.2 -2,-0.2 0.897 121.9 48.3 -68.6 -41.8 -71.3 -4.5 23.8 117 117 A K T 3<5S+ 0 0 168 -4,-3.4 -1,-0.2 -5,-0.4 -2,-0.2 0.244 118.8 39.6 -86.7 14.9 -74.6 -3.0 24.9 118 118 A H T < 5S- 0 0 52 -3,-0.8 -1,-0.2 2,-0.1 -2,-0.2 0.289 103.5-119.7-144.0 4.0 -75.3 -1.4 21.5 119 119 A Q T < 5 + 0 0 183 -3,-0.7 -3,-0.2 -4,-0.4 -4,-0.1 0.593 58.0 159.3 61.0 13.3 -74.0 -4.1 19.1 120 120 A A < - 0 0 12 -5,-0.9 41,-0.3 -6,-0.5 -99,-0.2 -0.212 32.2-162.8 -61.0 157.1 -71.5 -1.6 17.7 121 121 A G + 0 0 27 -101,-2.1 41,-1.4 1,-0.2 2,-0.3 0.733 69.9 38.3-110.0 -41.1 -68.5 -2.8 15.9 122 122 A Y E -be 21 162B 25 -102,-2.3 -100,-1.3 39,-0.2 2,-0.4 -0.819 56.0-164.9-110.5 153.4 -66.2 0.2 15.9 123 123 A V E -be 22 163B 0 39,-1.2 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