==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 04-AUG-00 1GG1 . COMPND 2 MOLECULE: 3-DEOXY-D-ARABINO-HEPTULOSONATE-7-PHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.WAGNER,I.A.SHUMILIN,R.BAUERLE,R.H.KRETSINGER . 1361 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45055.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 969 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 166 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 4.7 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 . 8 0.6 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 . 4 0.3 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 . 83 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 134 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 438 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.5 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 4 0 0 4 3 1 4 0 1 4 3 0 0 8 5 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 4 12 8 8 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 . 6 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 4 0 0 0 0 0 4 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 7 A D > 0 0 88 0, 0.0 3,-1.0 0, 0.0 512,-0.1 0.000 360.0 360.0 360.0 39.9 53.5 3.8 48.1 2 8 A L T 3 + 0 0 117 1,-0.2 511,-0.1 510,-0.0 512,-0.0 0.868 360.0 30.4 -59.2 -42.2 52.0 0.7 49.7 3 9 A R T 3 S+ 0 0 28 509,-0.5 555,-1.9 554,-0.1 2,-0.7 0.147 95.7 101.1-106.7 18.7 49.4 0.1 47.0 4 10 A I E < +A 557 0A 55 -3,-1.0 553,-0.3 553,-0.2 3,-0.1 -0.916 45.5 179.9-103.3 110.2 51.4 1.6 44.1 5 11 A K E - 0 0 153 551,-2.6 2,-0.3 -2,-0.7 552,-0.2 0.908 62.5 -9.0 -77.3 -43.1 52.9 -1.4 42.2 6 12 A E E -A 556 0A 102 550,-1.5 550,-2.6 2,-0.0 2,-0.4 -0.994 48.4-149.6-157.0 157.7 54.7 0.6 39.5 7 13 A I E -A 555 0A 85 -2,-0.3 2,-0.3 548,-0.2 548,-0.2 -0.992 22.2-173.1-132.1 123.4 55.3 4.0 38.0 8 14 A K E -A 554 0A 76 546,-3.3 546,-3.0 -2,-0.4 2,-0.1 -0.853 30.4 -94.2-120.2 154.8 56.1 4.4 34.3 9 15 A E - 0 0 52 -2,-0.3 2,-0.4 544,-0.2 105,-0.2 -0.368 35.3-160.1 -67.9 140.8 57.1 7.3 32.1 10 16 A L - 0 0 8 542,-0.5 542,-0.1 -2,-0.1 -1,-0.0 -0.974 21.4-116.5-125.2 132.8 54.5 9.2 30.1 11 17 A L - 0 0 8 -2,-0.4 199,-0.1 1,-0.1 5,-0.1 -0.383 34.3-118.2 -65.2 134.8 55.0 11.4 27.1 12 18 A P >> - 0 0 8 0, 0.0 3,-1.4 0, 0.0 4,-1.0 -0.361 25.7-109.4 -70.0 157.5 54.1 15.0 27.8 13 19 A P H >> S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 3,-1.0 0.901 117.4 62.3 -54.3 -41.1 51.3 16.5 25.6 14 20 A V H 3> S+ 0 0 14 194,-2.7 4,-1.6 1,-0.3 5,-0.2 0.792 96.7 59.9 -56.3 -27.5 53.8 18.7 23.7 15 21 A A H <> S+ 0 0 0 -3,-1.4 4,-1.8 193,-0.3 -1,-0.3 0.893 110.0 40.4 -66.9 -40.1 55.5 15.5 22.5 16 22 A L H - 0 0 52 -2,-0.3 4,-2.3 102,-0.1 5,-0.2 -0.200 27.5-104.6 -69.7 167.5 46.9 20.5 9.7 24 30 A E H > S+ 0 0 75 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.888 125.2 46.4 -61.8 -36.3 45.5 23.7 8.4 25 31 A N H > S+ 0 0 95 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.923 107.6 54.4 -72.6 -44.0 42.4 21.8 7.4 26 32 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.943 110.5 47.9 -53.8 -47.4 42.1 19.9 10.8 27 33 A A H X S+ 0 0 51 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.831 112.2 49.3 -62.7 -34.3 42.1 23.2 12.6 28 34 A N H X S+ 0 0 76 -4,-1.3 4,-2.4 -5,-0.2 5,-0.3 0.888 107.6 54.1 -72.5 -40.7 39.5 24.6 10.2 29 35 A T H X S+ 0 0 12 -4,-3.0 4,-2.4 2,-0.2 5,-0.2 0.965 113.5 42.4 -55.8 -53.9 37.3 21.6 10.7 30 36 A V H X S+ 0 0 4 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.935 113.4 50.7 -60.3 -50.4 37.3 22.0 14.5 31 37 A A H X S+ 0 0 57 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.926 114.2 44.1 -56.0 -47.5 36.9 25.8 14.5 32 38 A H H X S+ 0 0 117 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.906 113.3 49.8 -64.4 -47.6 33.9 25.7 12.1 33 39 A A H X S+ 0 0 0 -4,-2.4 4,-3.1 -5,-0.3 5,-0.3 0.953 112.3 46.8 -59.4 -49.6 32.1 22.8 13.9 34 40 A R H X S+ 0 0 50 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.936 114.0 48.7 -58.1 -45.3 32.5 24.4 17.3 35 41 A K H X S+ 0 0 60 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.892 112.3 50.1 -59.9 -40.0 31.2 27.7 15.9 36 42 A A H X S+ 0 0 17 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.925 111.1 46.2 -65.1 -48.0 28.3 25.8 14.3 37 43 A I H X S+ 0 0 1 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.927 111.9 52.8 -63.3 -41.2 27.3 24.0 17.4 38 44 A H H X S+ 0 0 90 -4,-2.9 4,-2.3 -5,-0.3 -2,-0.2 0.928 108.2 51.1 -58.1 -43.5 27.6 27.3 19.3 39 45 A K H <>S+ 0 0 32 -4,-2.3 5,-2.7 1,-0.2 6,-0.4 0.905 111.0 48.2 -60.6 -42.3 25.3 28.8 16.7 40 46 A I H ><5S+ 0 0 2 -4,-2.3 3,-1.1 1,-0.2 5,-0.3 0.911 112.8 46.9 -65.0 -43.6 22.8 26.0 17.2 41 47 A L H 3<5S+ 0 0 15 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.813 108.3 56.0 -68.3 -31.3 22.9 26.3 21.0 42 48 A K T 3<5S- 0 0 51 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.476 116.9-117.9 -79.2 -0.7 22.5 30.1 20.8 43 49 A G T < 5S+ 0 0 55 -3,-1.1 -3,-0.2 2,-0.2 -2,-0.1 0.791 83.2 116.9 71.2 29.2 19.3 29.4 18.7 44 50 A N < + 0 0 137 -5,-2.7 2,-0.3 1,-0.2 -4,-0.2 0.201 69.0 50.8-112.0 15.2 20.6 31.1 15.6 45 51 A D - 0 0 50 -6,-0.4 -1,-0.2 -5,-0.3 -2,-0.2 -0.930 64.9-152.6-151.8 124.2 20.5 28.0 13.4 46 52 A D + 0 0 63 -2,-0.3 294,-0.1 -3,-0.1 293,-0.1 0.470 61.6 114.0 -78.5 1.5 17.6 25.7 13.0 47 53 A R - 0 0 36 1,-0.1 2,-0.5 34,-0.1 34,-0.2 -0.217 65.9-118.4 -71.0 166.6 19.8 22.7 12.2 48 54 A L E -c 81 0B 0 32,-1.9 34,-2.5 244,-0.0 2,-0.3 -0.901 14.3-134.7-109.2 122.4 20.3 19.6 14.4 49 55 A L E -cd 82 292B 2 242,-2.0 244,-2.1 -2,-0.5 2,-0.5 -0.564 23.6-165.2 -71.3 133.6 23.6 18.6 15.9 50 56 A V E -cd 83 293B 0 32,-2.8 34,-2.7 -2,-0.3 2,-0.9 -0.892 10.7-170.5-128.4 105.1 24.1 14.8 15.3 51 57 A V E +cd 84 294B 0 242,-2.7 244,-2.3 -2,-0.5 2,-0.4 -0.798 28.1 157.2 -92.5 105.8 26.7 13.0 17.3 52 58 A I E +cd 85 295B 0 32,-2.2 34,-2.1 -2,-0.9 244,-0.2 -0.969 9.7 85.0-137.3 146.8 26.9 9.6 15.8 53 59 A G E S- d 0 296B 0 242,-1.8 244,-1.7 -2,-0.4 34,-0.1 -0.966 71.7 -23.7 158.6-169.9 29.4 6.7 15.6 54 60 A P - 0 0 2 0, 0.0 34,-0.3 0, 0.0 3,-0.2 -0.150 52.2-118.5 -66.3 162.0 30.7 3.7 17.5 55 61 A C S S- 0 0 1 262,-0.4 2,-0.3 1,-0.3 263,-0.1 0.867 99.8 -2.2 -65.7 -36.0 30.4 3.2 21.2 56 62 A S S S- 0 0 0 261,-0.2 2,-0.4 33,-0.1 -1,-0.3 -0.974 72.3-119.5-158.0 141.2 34.2 3.1 21.2 57 63 A I + 0 0 3 31,-2.4 44,-0.5 -2,-0.3 30,-0.0 -0.682 42.2 152.4 -80.8 129.2 37.0 3.3 18.6 58 64 A H + 0 0 14 -2,-0.4 -1,-0.1 1,-0.3 31,-0.0 0.324 64.0 41.0-138.2 3.7 39.1 0.1 18.8 59 65 A D > - 0 0 39 1,-0.1 4,-2.3 2,-0.0 -1,-0.3 -0.774 59.0-157.2-159.0 106.0 40.5 -0.2 15.2 60 66 A P H > S+ 0 0 42 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.792 93.4 60.9 -52.8 -34.4 41.8 2.8 13.2 61 67 A V H > S+ 0 0 91 2,-0.2 4,-1.4 1,-0.2 3,-0.5 0.980 110.1 36.7 -60.4 -61.2 41.1 0.9 10.0 62 68 A A H > S+ 0 0 2 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.881 116.1 56.6 -59.6 -36.8 37.4 0.5 10.4 63 69 A A H X S+ 0 0 6 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.809 103.2 53.2 -66.2 -32.2 37.2 3.9 12.0 64 70 A K H X S+ 0 0 76 -4,-1.8 4,-1.3 -3,-0.5 -1,-0.2 0.846 112.5 44.5 -71.5 -35.2 38.7 5.6 9.0 65 71 A E H >X S+ 0 0 66 -4,-1.4 4,-2.9 2,-0.2 3,-1.1 0.977 110.9 52.0 -70.8 -55.4 36.2 4.0 6.6 66 72 A Y H 3X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.3 5,-0.2 0.915 110.3 52.1 -44.4 -46.1 33.3 4.7 8.9 67 73 A A H 3X S+ 0 0 4 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.3 0.842 108.4 49.1 -61.6 -34.4 34.6 8.3 8.8 68 74 A T H X S+ 0 0 13 -4,-3.6 4,-2.4 1,-0.2 3,-2.0 0.219 83.4 123.3 -88.6 17.0 22.5 16.5 4.7 78 84 A K T 34 + 0 0 32 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.600 64.9 58.2 -55.3 -18.3 24.6 19.6 5.6 79 85 A D T 34 S+ 0 0 121 -3,-0.4 -1,-0.3 1,-0.1 -2,-0.1 0.644 121.2 24.2 -91.2 -11.6 21.6 22.0 5.4 80 86 A E T <4 S+ 0 0 45 -3,-2.0 -32,-1.9 1,-0.2 2,-0.4 0.523 123.5 47.5-121.4 -17.4 19.5 20.2 8.0 81 87 A L E < -c 48 0B 1 -4,-2.4 2,-0.7 -34,-0.2 -1,-0.2 -0.972 53.5-155.5-135.2 144.8 22.2 18.4 10.0 82 88 A E E -c 49 0B 9 -34,-2.5 -32,-2.8 -2,-0.4 2,-0.5 -0.903 31.5-161.2-114.5 92.0 25.5 19.2 11.7 83 89 A I E +c 50 0B 0 -2,-0.7 2,-0.4 -34,-0.2 -32,-0.2 -0.689 13.6 179.0 -85.9 126.2 27.0 15.7 11.7 84 90 A V E -c 51 0B 0 -34,-2.7 -32,-2.2 -2,-0.5 2,-0.3 -0.979 26.8-120.9-125.9 133.5 29.9 15.0 14.1 85 91 A M E -ce 52 134B 0 48,-2.5 50,-2.6 -2,-0.4 2,-0.8 -0.593 16.9-125.0 -82.5 136.1 31.5 11.6 14.5 86 92 A R E + e 0 135B 2 -34,-2.1 2,-0.4 -2,-0.3 50,-0.2 -0.682 34.9 171.2 -75.5 111.9 31.7 9.8 17.8 87 93 A V + 0 0 0 48,-3.3 2,-0.6 -2,-0.8 -1,-0.1 -0.710 9.7 177.1-124.3 75.3 35.4 9.1 18.3 88 94 A Y + 0 0 5 -2,-0.4 -31,-2.4 -34,-0.3 13,-0.3 -0.737 17.4 167.6 -89.2 117.3 35.5 7.8 21.9 89 95 A F + 0 0 7 -2,-0.6 13,-1.3 48,-0.2 14,-0.5 0.542 64.8 58.6-102.9 -12.6 38.8 6.6 23.2 90 96 A E - 0 0 21 47,-0.2 10,-0.3 10,-0.2 47,-0.2 -0.981 61.0-170.1-125.9 129.2 37.9 6.3 26.9 91 97 A K - 0 0 16 8,-3.3 2,-0.3 -2,-0.4 -35,-0.0 -0.956 15.2-143.1-119.5 120.9 35.2 4.1 28.3 92 98 A P - 0 0 18 0, 0.0 2,-0.3 0, 0.0 4,-0.1 -0.634 23.9-146.1 -80.2 134.4 33.9 4.2 31.9 93 99 A R - 0 0 73 -2,-0.3 4,-0.1 2,-0.2 6,-0.0 -0.725 19.9-128.5-104.6 154.0 33.1 0.8 33.3 94 100 A T S S- 0 0 67 -2,-0.3 442,-0.2 2,-0.2 -1,-0.1 0.827 98.4 -30.0 -63.8 -33.6 30.4 -0.4 35.8 95 101 A T S S- 0 0 53 1,-0.4 -2,-0.2 440,-0.1 2,-0.2 0.102 120.1 -18.4-144.0 -89.1 33.2 -2.1 37.7 96 102 A V S S+ 0 0 58 -4,-0.1 -1,-0.4 445,-0.0 2,-0.3 -0.733 74.9 95.6-126.1 173.8 36.1 -3.4 35.7 97 103 A G S S- 0 0 44 -2,-0.2 2,-0.3 -4,-0.1 -4,-0.1 -0.825 76.0 -16.3 137.4-175.6 36.9 -4.2 32.0 98 104 A W - 0 0 21 -2,-0.3 3,-0.1 1,-0.1 208,-0.0 -0.427 48.5-163.5 -63.2 122.5 38.5 -2.6 29.0 99 105 A K - 0 0 20 1,-0.3 -8,-3.3 -2,-0.3 2,-0.2 0.425 49.3 -88.9 -89.4 -0.2 38.8 1.2 29.4 100 106 A G > - 0 0 0 -10,-0.3 4,-1.9 4,-0.2 -1,-0.3 -0.584 51.8 -51.9 121.8 176.2 39.3 2.0 25.8 101 107 A L T 4 S+ 0 0 6 -44,-0.5 -1,-0.1 -13,-0.3 6,-0.1 0.843 126.3 49.4 -62.6 -37.9 42.0 2.5 23.1 102 108 A I T 4 S+ 0 0 6 -13,-1.3 14,-0.4 2,-0.2 15,-0.3 0.947 114.0 44.8 -69.0 -44.6 44.2 5.0 24.9 103 109 A N T 4 S+ 0 0 22 -14,-0.5 10,-0.2 1,-0.2 -2,-0.2 0.793 140.1 1.2 -68.8 -33.0 44.3 2.9 28.1 104 110 A D >< + 0 0 1 -4,-1.9 3,-2.2 7,-0.2 -1,-0.2 -0.396 66.3 170.7-158.7 71.3 45.0 -0.4 26.4 105 111 A P T 3 S+ 0 0 11 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.839 82.7 55.9 -52.3 -40.0 45.2 -0.1 22.5 106 112 A H T 3 S- 0 0 93 -5,-0.1 -5,-0.1 1,-0.1 -48,-0.0 0.334 100.9-138.7 -79.2 9.6 46.4 -3.6 22.1 107 113 A M S < S+ 0 0 49 -3,-2.2 -1,-0.1 1,-0.2 -9,-0.1 0.711 78.2 102.2 39.7 30.1 43.3 -4.7 23.9 108 114 A D S S- 0 0 97 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 -0.023 100.3-101.3-128.9 28.5 45.4 -7.3 25.8 109 115 A N S S+ 0 0 109 -5,-0.2 -5,-0.1 1,-0.1 -2,-0.0 0.877 89.0 121.3 52.1 44.9 45.9 -5.6 29.2 110 116 A S - 0 0 35 2,-0.0 3,-0.2 3,-0.0 -1,-0.1 0.369 61.8-148.8-109.8 -4.3 49.4 -4.4 28.3 111 117 A F + 0 0 46 1,-0.2 2,-2.7 2,-0.1 3,-0.2 0.788 23.2 177.9 35.6 51.5 48.3 -0.8 28.8 112 118 A Q > + 0 0 72 1,-0.2 4,-2.4 2,-0.1 3,-0.4 -0.457 10.1 166.7 -79.3 70.8 50.7 0.7 26.3 113 119 A I H > + 0 0 2 -2,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.834 68.1 57.8 -57.6 -39.2 49.2 4.1 27.0 114 120 A N H > S+ 0 0 36 -3,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.912 111.3 43.7 -61.2 -39.7 52.0 6.0 25.2 115 121 A D H > S+ 0 0 47 -3,-0.4 4,-3.1 2,-0.2 5,-0.3 0.899 110.0 56.7 -68.1 -41.9 51.1 4.0 22.0 116 122 A G H X S+ 0 0 0 -4,-2.4 4,-2.9 -14,-0.4 -2,-0.2 0.889 107.6 48.8 -57.0 -40.8 47.4 4.5 22.7 117 123 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 -15,-0.3 -1,-0.2 0.868 111.4 48.4 -67.7 -38.8 48.0 8.3 22.7 118 124 A R H X S+ 0 0 69 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.939 115.8 44.1 -66.3 -47.7 50.0 8.2 19.5 119 125 A I H X S+ 0 0 54 -4,-3.1 4,-2.6 2,-0.2 5,-0.3 0.935 114.2 50.1 -60.8 -49.0 47.3 6.1 17.8 120 126 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 -5,-0.3 -2,-0.2 0.931 113.5 42.6 -59.5 -50.2 44.5 8.2 19.1 121 127 A R H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.880 114.4 51.7 -66.5 -34.9 45.8 11.6 18.1 122 128 A K H X S+ 0 0 97 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.930 113.2 44.1 -65.7 -46.3 46.9 10.3 14.7 123 129 A L H X S+ 0 0 3 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.851 115.7 48.8 -65.1 -37.0 43.5 8.8 14.0 124 130 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.841 111.2 49.3 -72.8 -35.8 41.8 12.0 15.3 125 131 A L H X S+ 0 0 16 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.920 111.4 50.6 -67.6 -44.1 44.1 14.2 13.2 126 132 A D H X S+ 0 0 50 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.974 111.1 46.7 -57.5 -57.9 43.3 12.1 10.1 127 133 A I H ><>S+ 0 0 4 -4,-2.3 5,-1.5 1,-0.2 3,-0.6 0.932 116.0 45.8 -52.0 -50.4 39.5 12.3 10.6 128 134 A N H ><5S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.2 -1,-0.2 0.901 105.8 58.7 -61.9 -41.5 39.6 16.0 11.3 129 135 A D H 3<5S+ 0 0 63 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.792 101.1 58.0 -58.7 -29.7 41.9 16.8 8.3 130 136 A S T <<5S- 0 0 61 -4,-1.5 -1,-0.3 -3,-0.6 -2,-0.2 0.564 124.7-101.2 -76.8 -12.7 39.3 15.2 6.0 131 137 A G T < 5S+ 0 0 26 -3,-1.9 -3,-0.2 -4,-0.4 -2,-0.1 0.457 82.6 126.3 106.2 1.3 36.7 17.7 7.1 132 138 A L < - 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