==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 08-AUG-06 2HZ7 . COMPND 2 MOLECULE: GLUTAMINYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: DEINOCOCCUS RADIODURANS; . AUTHOR M.DENIZIAK,C.SAUTER,H.D.BECKER,C.PAULUS,R.GIEGE,D.KERN . 556 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25920.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 359 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 14.2 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 . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 34 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 22.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.6 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 1 1 1 2 1 2 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 3 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 . 4 3 2 4 1 1 1 1 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 . 4 1 1 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 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 43 A A 0 0 157 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 116.0 31.8 42.1 95.4 2 44 A A - 0 0 94 1,-0.1 2,-0.1 2,-0.1 4,-0.0 -0.148 360.0 -85.7 -56.4 151.0 33.7 44.4 93.0 3 45 A P - 0 0 86 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.328 23.9-136.0 -64.1 136.3 32.0 47.7 92.0 4 46 A L S S+ 0 0 87 1,-0.3 2,-0.5 -3,-0.1 48,-0.1 0.904 100.1 29.3 -56.7 -42.7 29.5 47.7 89.1 5 47 A V S S- 0 0 11 46,-0.2 -1,-0.3 47,-0.1 3,-0.1 -0.942 86.9-135.7-124.8 110.8 31.2 50.9 87.8 6 48 A A - 0 0 65 -2,-0.5 5,-0.2 304,-0.2 308,-0.1 -0.284 49.5 -75.5 -59.3 147.8 34.9 51.5 88.6 7 49 A P + 0 0 104 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.206 69.4 158.6 -48.5 120.3 35.6 55.1 89.7 8 50 A N > - 0 0 14 -3,-0.1 4,-2.3 305,-0.1 5,-0.2 -0.829 57.4 -89.5-136.3 177.0 35.4 57.4 86.7 9 51 A F H > S+ 0 0 29 305,-0.4 4,-1.7 -2,-0.3 5,-0.1 0.851 127.1 47.3 -60.8 -33.2 34.9 61.1 86.2 10 52 A I H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.916 109.3 53.9 -72.3 -42.4 31.1 60.7 85.9 11 53 A T H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.909 110.0 48.1 -55.6 -44.8 31.0 58.5 89.0 12 54 A E H X S+ 0 0 77 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.864 107.5 55.2 -66.6 -38.6 32.8 61.2 90.9 13 55 A I H X S+ 0 0 20 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.928 110.6 46.8 -60.6 -41.7 30.4 63.9 89.6 14 56 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.933 110.7 48.5 -67.0 -47.5 27.5 61.9 91.0 15 57 A E H X S+ 0 0 94 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.900 111.6 53.2 -60.7 -36.0 29.0 61.1 94.4 16 58 A R H X S+ 0 0 146 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.895 111.7 44.9 -64.4 -40.3 29.8 64.9 94.6 17 59 A D H <>S+ 0 0 22 -4,-1.9 5,-2.3 2,-0.2 6,-0.5 0.863 112.7 49.1 -72.2 -39.1 26.1 65.7 93.8 18 60 A L H ><5S+ 0 0 66 -4,-2.8 3,-1.3 3,-0.2 -2,-0.2 0.931 109.8 54.4 -65.5 -40.8 24.6 63.2 96.2 19 61 A E H 3<5S+ 0 0 156 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.918 112.3 41.6 -59.2 -46.1 26.9 64.5 98.8 20 62 A A T 3<5S- 0 0 74 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.403 111.5-119.7 -83.7 5.5 25.7 68.1 98.4 21 63 A G T < 5 + 0 0 57 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.772 61.5 149.3 63.8 26.0 22.1 67.0 98.1 22 64 A K S > -C 291 0B 27 252,-0.3 3,-2.8 253,-0.1 4,-0.6 -0.860 44.0 -82.8-140.5 176.5 24.9 46.6 67.9 40 82 A L H >> S+ 0 0 13 250,-2.8 3,-0.8 1,-0.3 4,-0.5 0.760 120.9 65.8 -51.8 -27.7 28.1 46.1 69.7 41 83 A G H 34 S+ 0 0 47 1,-0.2 4,-0.4 2,-0.1 -1,-0.3 0.616 98.3 52.7 -71.0 -13.8 28.8 49.8 69.5 42 84 A H H <> S+ 0 0 54 -3,-2.8 4,-2.1 2,-0.1 5,-0.3 0.557 88.9 81.9 -95.2 -13.7 25.8 50.6 71.7 43 85 A V H S+ 0 0 24 -4,-0.4 4,-2.6 2,-0.2 5,-0.2 0.930 117.1 49.4 -63.0 -48.1 27.1 53.6 76.5 46 88 A S H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.931 114.9 44.1 -60.0 -46.4 23.9 51.8 77.4 47 89 A L H X S+ 0 0 2 -4,-2.6 4,-3.0 -5,-0.3 5,-0.4 0.883 110.6 55.7 -67.3 -34.5 25.5 49.7 80.1 48 90 A L H X S+ 0 0 12 -4,-2.2 4,-1.6 -5,-0.3 -2,-0.2 0.949 111.7 43.7 -61.3 -46.6 27.3 52.8 81.4 49 91 A D H X S+ 0 0 2 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.919 119.5 42.7 -62.0 -47.1 24.0 54.6 81.8 50 92 A F H X S+ 0 0 13 -4,-2.6 4,-2.7 -5,-0.2 -2,-0.2 0.968 115.4 46.0 -66.5 -56.0 22.2 51.5 83.3 51 93 A N H X S+ 0 0 22 -4,-3.0 4,-3.1 1,-0.2 -1,-0.2 0.808 110.9 55.3 -58.5 -30.0 25.0 50.4 85.7 52 94 A T H X S+ 0 0 0 -4,-1.6 4,-1.7 -5,-0.4 -1,-0.2 0.948 109.8 44.7 -69.2 -45.8 25.5 54.0 86.9 53 95 A A H <>S+ 0 0 2 -4,-1.7 5,-4.0 2,-0.2 -2,-0.2 0.938 116.9 47.6 -59.1 -48.5 21.8 54.3 87.8 54 96 A R H ><5S+ 0 0 114 -4,-2.7 3,-2.2 3,-0.2 -2,-0.2 0.947 106.8 55.1 -58.9 -51.5 22.0 50.8 89.4 55 97 A Q H 3<5S+ 0 0 56 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.841 117.4 37.1 -53.2 -36.3 25.2 51.5 91.4 56 98 A Y T 3<5S- 0 0 41 -4,-1.7 -30,-0.4 -3,-0.2 -1,-0.3 0.097 114.5-110.8-105.9 22.1 23.6 54.6 93.0 57 99 A G T < 5S+ 0 0 47 -3,-2.2 -3,-0.2 1,-0.1 -4,-0.1 0.837 73.4 137.9 55.2 35.8 20.1 53.2 93.4 58 100 A G < - 0 0 14 -5,-4.0 2,-0.4 -6,-0.2 -31,-0.2 -0.051 56.9 -88.4 -95.2-160.6 18.8 55.5 90.8 59 101 A Q E -a 27 0A 41 -33,-2.6 -31,-2.6 -3,-0.1 2,-0.5 -0.923 28.9-154.5-115.0 136.8 16.3 55.2 87.9 60 102 A F E -a 28 0A 10 -2,-0.4 2,-0.4 30,-0.2 34,-0.2 -0.964 9.7-160.2-113.2 127.2 17.3 54.1 84.4 61 103 A N E -a 29 0A 0 -33,-2.3 -31,-2.2 -2,-0.5 2,-0.6 -0.867 8.0-153.6-106.2 137.7 15.2 55.2 81.4 62 104 A L E -ab 30 95A 0 32,-2.3 34,-2.7 -2,-0.4 2,-0.4 -0.948 23.2-173.1-107.3 120.7 15.2 53.6 77.9 63 105 A R E - b 0 96A 0 -33,-2.5 2,-0.8 -2,-0.6 34,-0.2 -0.952 24.2-147.5-122.9 132.5 14.1 56.1 75.3 64 106 A M E - b 0 97A 0 32,-3.4 34,-2.5 -2,-0.4 2,-1.8 -0.867 14.3-153.5 -92.6 113.9 13.3 55.8 71.7 65 107 A D + 0 0 15 -33,-3.3 3,-0.4 -2,-0.8 32,-0.1 -0.619 33.4 157.0 -88.5 79.6 14.4 59.0 70.1 66 108 A D + 0 0 0 -2,-1.8 -1,-0.1 1,-0.2 6,-0.1 -0.150 24.5 122.1 -97.6 38.9 12.0 58.7 67.3 67 109 A T + 0 0 12 1,-0.1 -1,-0.2 140,-0.1 -2,-0.0 0.614 55.1 78.8 -76.5 -12.7 11.8 62.4 66.5 68 110 A N >> - 0 0 59 -3,-0.4 4,-2.1 1,-0.1 3,-1.5 -0.849 66.1-161.8-100.7 105.4 13.0 62.0 62.8 69 111 A P T 34 S+ 0 0 11 0, 0.0 129,-0.3 0, 0.0 -1,-0.1 0.726 85.8 54.5 -55.2 -30.3 10.0 60.7 60.8 70 112 A E T 34 S+ 0 0 96 1,-0.1 127,-0.0 127,-0.1 -2,-0.0 0.626 116.9 34.4 -83.3 -13.8 12.0 59.4 57.8 71 113 A L T <4 S+ 0 0 84 -3,-1.5 -1,-0.1 -5,-0.0 2,-0.1 0.771 88.8 97.9-109.3 -35.6 14.2 57.1 60.0 72 114 A A < + 0 0 2 -4,-2.1 2,-0.4 -6,-0.1 126,-0.3 -0.342 48.9 178.5 -62.6 130.3 12.1 55.8 62.9 73 115 A R >> - 0 0 118 -39,-1.8 4,-1.7 1,-0.1 3,-0.8 -0.993 37.6-132.6-135.9 140.7 10.7 52.3 62.3 74 116 A Q H 3> S+ 0 0 77 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.869 106.1 62.5 -57.3 -37.4 8.7 50.0 64.4 75 117 A E H 3> S+ 0 0 90 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.833 104.8 45.5 -61.7 -32.0 11.0 47.1 63.6 76 118 A Y H <> S+ 0 0 14 -3,-0.8 4,-2.8 -42,-0.3 5,-0.3 0.860 110.6 53.1 -79.4 -35.4 14.0 48.9 65.2 77 119 A V H X S+ 0 0 2 -4,-1.7 4,-2.4 -43,-0.3 5,-0.3 0.971 112.2 46.7 -60.0 -50.6 12.0 49.8 68.3 78 120 A D H X S+ 0 0 91 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.907 116.3 43.0 -57.1 -47.5 10.9 46.2 68.7 79 121 A S H X S+ 0 0 2 -4,-1.9 4,-3.5 -5,-0.2 5,-0.2 0.897 113.0 51.8 -68.4 -41.4 14.5 44.8 68.2 80 122 A I H X S+ 0 0 4 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.929 111.5 45.5 -63.3 -46.5 16.2 47.4 70.4 81 123 A A H X S+ 0 0 22 -4,-2.4 4,-2.0 -5,-0.3 5,-0.2 0.957 117.6 45.9 -61.1 -47.8 13.8 46.8 73.4 82 124 A D H X S+ 0 0 62 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.928 115.2 45.8 -61.2 -45.9 14.2 43.1 72.9 83 125 A D H X S+ 0 0 0 -4,-3.5 4,-2.3 1,-0.2 -2,-0.2 0.904 112.6 48.9 -65.2 -43.0 18.0 43.2 72.5 84 126 A L H X>S+ 0 0 0 -4,-2.7 5,-2.2 -5,-0.2 4,-1.0 0.864 110.3 51.4 -68.3 -33.6 18.7 45.5 75.4 85 127 A K H ><5S+ 0 0 119 -4,-2.0 3,-1.0 -5,-0.3 -1,-0.2 0.950 109.1 51.6 -65.9 -44.9 16.5 43.4 77.7 86 128 A W H 3<5S+ 0 0 48 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.895 105.1 56.6 -55.5 -41.1 18.5 40.4 76.6 87 129 A L H 3<5S- 0 0 0 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.768 125.0-103.7 -64.5 -23.8 21.7 42.3 77.5 88 130 A G T <<5 + 0 0 28 -3,-1.0 -3,-0.2 -4,-1.0 -2,-0.1 0.462 68.7 147.4 115.2 2.0 20.4 42.7 81.0 89 131 A L < - 0 0 7 -5,-2.2 2,-0.4 2,-0.0 -1,-0.3 -0.404 29.0-161.2 -69.2 150.4 19.3 46.4 81.1 90 132 A D + 0 0 81 1,-0.1 -30,-0.2 -2,-0.1 -5,-0.0 -0.946 27.7 157.5-139.7 112.1 16.3 47.0 83.3 91 133 A W > - 0 0 27 -2,-0.4 3,-2.8 1,-0.3 -29,-0.1 0.311 29.4-164.6-112.4 -0.6 14.2 50.1 82.9 92 134 A G T 3 S- 0 0 51 1,-0.3 -1,-0.3 2,-0.1 3,-0.0 -0.298 71.4 -13.6 54.3-118.3 11.1 48.7 84.5 93 135 A E T 3 S+ 0 0 171 1,-0.1 2,-1.5 -2,-0.1 -1,-0.3 0.453 113.0 98.4 -94.1 -3.6 8.2 51.0 83.6 94 136 A H < + 0 0 60 -3,-2.8 -32,-2.3 -34,-0.2 2,-0.5 -0.434 42.8 136.5 -89.8 66.3 10.3 53.8 82.3 95 137 A F E -b 62 0A 57 -2,-1.5 2,-0.4 -34,-0.2 -32,-0.2 -0.950 33.6-169.2-109.5 123.7 10.2 53.2 78.5 96 138 A Y E -b 63 0A 39 -34,-2.7 -32,-3.4 -2,-0.5 2,-0.5 -0.911 25.4-157.5-125.6 147.6 9.7 56.4 76.5 97 139 A Y E > -b 64 0A 38 -2,-0.4 3,-1.4 -34,-0.2 4,-0.3 -0.976 15.0-150.8-113.5 119.8 8.8 57.4 73.0 98 140 A A G > S+ 0 0 0 -34,-2.5 3,-2.4 -2,-0.5 -1,-0.1 0.875 96.7 64.3 -59.3 -34.4 10.0 60.9 72.3 99 141 A S G > S+ 0 0 4 -35,-0.3 3,-1.8 1,-0.3 -1,-0.3 0.800 86.8 70.8 -60.6 -26.0 7.2 61.2 69.8 100 142 A D G < S+ 0 0 89 -3,-1.4 -1,-0.3 1,-0.3 3,-0.2 0.644 100.7 49.1 -65.2 -11.0 4.7 60.8 72.7 101 143 A Y G <> + 0 0 58 -3,-2.4 4,-2.2 -4,-0.3 3,-0.3 0.182 67.6 115.1-113.7 16.5 5.8 64.3 73.7 102 144 A F H <> S+ 0 0 3 -3,-1.8 4,-2.1 1,-0.2 5,-0.1 0.884 81.5 53.4 -52.0 -38.7 5.6 66.3 70.5 103 145 A D H > S+ 0 0 102 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.901 106.1 51.2 -62.8 -43.4 2.8 68.3 72.2 104 146 A R H > S+ 0 0 111 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.911 110.3 48.7 -63.1 -41.2 5.1 69.1 75.1 105 147 A Y H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.895 109.8 53.3 -65.0 -40.3 7.9 70.4 72.8 106 148 A Y H X S+ 0 0 21 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.923 107.6 49.5 -60.6 -46.2 5.5 72.5 70.9 107 149 A A H X S+ 0 0 53 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.846 111.1 50.2 -63.2 -33.7 4.2 74.2 74.0 108 150 A Y H X S+ 0 0 31 -4,-1.7 4,-2.8 2,-0.2 -1,-0.2 0.869 108.2 53.2 -71.7 -35.2 7.8 74.9 75.1 109 151 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.892 108.9 49.4 -63.9 -40.4 8.4 76.3 71.7 110 152 A E H X S+ 0 0 36 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.901 110.0 51.0 -66.3 -39.7 5.4 78.6 72.1 111 153 A Q H X S+ 0 0 62 -4,-2.0 4,-1.7 2,-0.2 6,-0.2 0.953 109.9 49.4 -62.2 -47.7 6.7 79.7 75.5 112 154 A L H <>S+ 0 0 0 -4,-2.8 5,-3.0 1,-0.2 6,-0.6 0.923 111.4 50.5 -57.4 -43.3 10.1 80.5 74.0 113 155 A I H ><5S+ 0 0 1 -4,-2.5 3,-2.0 4,-0.2 5,-0.3 0.958 109.2 50.2 -58.5 -50.4 8.3 82.5 71.3 114 156 A R H 3<5S+ 0 0 140 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.757 108.4 53.0 -60.4 -26.4 6.3 84.4 73.9 115 157 A Q T 3<5S- 0 0 79 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.457 117.2-114.6 -87.6 -1.1 9.5 85.2 75.8 116 158 A G T < 5S+ 0 0 34 -3,-2.0 -3,-0.2 -4,-0.3 -2,-0.1 0.793 87.3 117.9 72.4 26.3 11.0 86.6 72.6 117 159 A D S - 0 0 53 1,-0.1 4,-2.9 -2,-0.1 5,-0.2 -0.297 37.3-117.9 -61.7 149.9 16.2 80.6 52.1 125 167 A P H > S+ 0 0 86 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.849 118.8 50.4 -58.1 -34.4 18.2 77.7 53.6 126 168 A E H > S+ 0 0 166 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.856 110.9 49.5 -71.3 -35.3 21.3 78.9 51.6 127 169 A E H > S+ 0 0 58 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.919 104.2 58.3 -68.7 -44.2 20.7 82.4 53.0 128 170 A L H X S+ 0 0 26 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.904 110.0 43.9 -53.5 -42.9 20.4 81.1 56.5 129 171 A S H X S+ 0 0 83 -4,-1.5 4,-0.9 2,-0.2 -1,-0.2 0.873 114.0 50.6 -71.3 -35.2 23.9 79.6 56.3 130 172 A R H >< S+ 0 0 159 -4,-1.7 3,-0.5 1,-0.2 -2,-0.2 0.927 113.5 43.9 -67.2 -44.6 25.3 82.8 54.6 131 173 A L H 3< S+ 0 0 18 -4,-3.4 9,-2.3 1,-0.2 -1,-0.2 0.795 101.8 70.3 -69.6 -29.7 23.8 85.1 57.3 132 174 A R H 3< S- 0 0 50 -4,-1.6 7,-0.3 -5,-0.3 -1,-0.2 0.832 89.1-165.2 -57.2 -36.6 25.0 82.7 60.0 133 175 A G << - 0 0 11 -4,-0.9 2,-0.2 -3,-0.5 -1,-0.2 -0.379 11.3 -91.3 85.3-163.6 28.6 83.6 59.4 134 176 A N B > -G 137 0D 96 3,-2.4 3,-0.7 -2,-0.1 5,-0.1 -0.754 44.1 -83.4-140.1-175.1 31.8 81.9 60.5 135 177 A A T 3 S+ 0 0 82 1,-0.2 -2,-0.0 -2,-0.2 46,-0.0 0.526 133.5 41.6 -74.8 -4.9 34.3 82.1 63.3 136 178 A T T 3 S+ 0 0 130 1,-0.2 -1,-0.2 2,-0.0 -3,-0.0 0.380 117.7 45.4-120.0 -1.5 35.9 85.0 61.4 137 179 A T B < S-G 134 0D 61 -3,-0.7 -3,-2.4 -5,-0.1 -1,-0.2 -0.833 83.8-133.3-146.5 102.3 32.7 86.8 60.2 138 180 A P - 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P 0 548H 17 -12,-0.5 12,-0.3 -14,-0.4 5,-0.1 -0.425 52.9-110.1 -61.8 127.3 22.7 24.7 68.2 537 606 A D > - 0 0 3 10,-2.1 4,-1.0 1,-0.2 10,-0.2 -0.484 29.7-149.5 -57.4 116.3 22.0 27.6 65.8 538 607 A P H > S+ 0 0 40 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.818 91.9 53.9 -62.4 -31.3 18.8 28.9 67.5 539 608 A V H > S+ 0 0 54 1,-0.2 4,-0.7 2,-0.2 3,-0.2 0.921 106.1 49.9 -69.7 -45.2 17.4 30.2 64.2 540 609 A E H 4 S+ 0 0 54 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.708 105.2 60.4 -67.7 -18.5 17.8 26.9 62.3 541 610 A L H < S+ 0 0 81 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.920 103.7 49.5 -71.0 -44.9 16.0 25.2 65.2 542 611 A E H < S+ 0 0 172 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.2 0.589 94.6 99.6 -69.6 -16.5 12.9 27.3 64.6 543 612 A R < 0 0 168 -4,-0.7 -3,-0.0 1,-0.1 0, 0.0 -0.017 360.0 360.0 -68.4 176.5 12.8 26.6 60.9 544 613 A V 0 0 187 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.445 360.0 360.0 -71.1 360.0 10.6 24.1 59.0 545 ! 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 0.0 546 620 A L 0 0 87 0, 0.0 -69,-2.7 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 104.1 21.1 19.2 63.5 547 621 A V E -n 477 0H 25 -71,-0.2 -10,-2.1 -10,-0.2 2,-0.4 -0.868 360.0-174.9-105.8 119.9 23.0 22.5 63.1 548 622 A F E -nP 478 536H 0 -71,-3.2 -69,-2.3 -2,-0.6 2,-0.4 -0.911 9.9-155.2-109.5 134.7 25.7 23.7 65.5 549 623 A G E -nP 479 535H 5 -14,-3.3 -14,-1.7 -2,-0.4 2,-0.6 -0.870 21.6-121.2-106.9 144.8 27.3 27.0 65.2 550 624 A R E - P 0 534H 25 -71,-2.9 -69,-0.4 -2,-0.4 -16,-0.3 -0.754 20.6-166.9 -83.6 120.1 30.7 27.6 66.6 551 625 A I E - 0 0 8 -18,-2.7 2,-0.3 -2,-0.6 -17,-0.2 0.914 66.8 -29.7 -72.9 -45.3 30.5 30.4 69.1 552 626 A I E - P 0 533H 22 -19,-1.2 -19,-2.8 -222,-0.1 -1,-0.3 -0.959 66.8 -95.7-170.9 153.1 34.3 30.9 69.3 553 627 A T - 0 0 32 -2,-0.3 -21,-0.2 -21,-0.2 3,-0.1 -0.288 39.0-111.2 -69.6 161.4 37.6 29.1 68.9 554 628 A L S S+ 0 0 55 -23,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.791 97.5 14.9 -64.9 -29.0 39.4 27.7 71.9 555 629 A K S S- 0 0 162 -224,-0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.991 94.5 -80.9-147.3 153.5 42.2 30.2 71.5 556 630 A D - 0 0 67 -2,-0.3 -2,-0.0 1,-0.1 -232,-0.0 -0.237 34.5-172.6 -53.2 134.4 43.0 33.5 69.7 557 631 A T 0 0 109 1,-0.1 -1,-0.1 -4,-0.0 0, 0.0 0.145 360.0 360.0-117.3 17.6 44.1 32.9 66.1 558 632 A W 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.903 360.0 360.0-121.7 360.0 45.2 36.4 65.1