==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-OCT-12 4HSN . COMPND 2 MOLECULE: 3-DEOXY-D-ARABINO-HEPTULOSONATE 7-PHOSPHATE SYNTH . SOURCE 2 ORGANISM_SCIENTIFIC: NEISSERIA MENINGITIDIS; . AUTHOR P.J.CROSS,A.L.PIETERSMA,T.M.ALLISON,S.M.WILSON-COUTTS,F.C.CO . 1364 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46198.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 955 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 160 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 62 4.5 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 . 79 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 123 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 452 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.1 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 2 0 0 4 2 2 3 1 0 4 3 1 0 5 7 0 2 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 8 8 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 4 2 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 10 A I 0 0 204 0, 0.0 513,-0.1 0, 0.0 514,-0.0 0.000 360.0 360.0 360.0 -23.0 -23.3 -56.6 0.7 2 11 A K + 0 0 20 511,-0.3 557,-2.9 556,-0.1 2,-0.6 0.236 360.0 90.6 -81.8 10.7 -21.7 -59.9 2.1 3 12 A I E -A 558 0A 65 555,-0.3 555,-0.3 1,-0.1 3,-0.1 -0.951 58.0-174.1-109.1 109.5 -19.0 -59.2 -0.6 4 13 A K E - 0 0 133 553,-2.1 2,-0.3 -2,-0.6 554,-0.2 0.828 67.0 -10.5 -75.4 -34.2 -16.2 -57.0 0.9 5 14 A E E -A 557 0A 103 552,-1.6 552,-3.0 2,-0.0 2,-0.5 -0.979 49.1-144.9-163.8 149.8 -14.4 -56.6 -2.4 6 15 A V E -A 556 0A 79 -2,-0.3 2,-0.3 550,-0.2 550,-0.2 -0.998 32.7-163.8-117.3 126.3 -14.1 -57.8 -6.1 7 16 A K E -A 555 0A 68 548,-4.0 548,-2.9 -2,-0.5 2,-0.1 -0.777 24.4 -87.2-121.2 157.1 -10.6 -57.9 -7.4 8 17 A E - 0 0 117 -2,-0.3 2,-0.4 546,-0.2 105,-0.2 -0.322 38.7-169.8 -65.3 133.1 -8.8 -58.0 -10.7 9 18 A L - 0 0 12 544,-0.4 544,-0.1 -2,-0.1 688,-0.1 -0.987 18.9-133.8-126.8 122.9 -8.1 -61.5 -12.1 10 19 A L - 0 0 5 -2,-0.4 199,-0.1 687,-0.1 882,-0.0 -0.534 30.6-120.9 -66.6 135.4 -5.8 -62.2 -15.1 11 20 A P >> - 0 0 8 0, 0.0 3,-1.7 0, 0.0 4,-0.8 -0.376 25.9-102.5 -75.2 161.6 -7.5 -64.6 -17.5 12 21 A P H >> S+ 0 0 2 0, 0.0 4,-2.8 0, 0.0 3,-0.6 0.841 117.3 67.0 -49.8 -42.1 -5.8 -67.9 -18.5 13 22 A I H 3> S+ 0 0 18 194,-2.4 4,-1.9 1,-0.2 195,-0.1 0.795 94.8 57.5 -53.1 -30.9 -4.7 -66.5 -21.8 14 23 A A H <> S+ 0 0 3 -3,-1.7 4,-1.3 193,-0.2 -1,-0.2 0.909 112.1 40.2 -64.6 -46.6 -2.3 -64.2 -20.0 15 24 A H H - 0 0 26 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.471 18.2-110.5 -83.7 164.4 6.2 -76.9 -25.0 23 32 A K H > S+ 0 0 82 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.899 120.9 48.7 -54.1 -43.4 6.3 -79.8 -27.6 24 33 A E H > S+ 0 0 131 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.942 113.1 45.7 -73.5 -39.9 8.0 -82.0 -25.0 25 34 A A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.926 112.5 51.4 -63.5 -44.9 5.4 -81.2 -22.2 26 35 A S H X S+ 0 0 55 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.923 111.4 46.8 -61.5 -42.1 2.6 -81.7 -24.6 27 36 A G H X S+ 0 0 38 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.908 112.4 50.2 -65.6 -43.5 3.9 -85.1 -25.7 28 37 A L H X S+ 0 0 12 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.926 112.7 46.3 -59.8 -47.8 4.5 -86.2 -22.2 29 38 A V H X S+ 0 0 3 -4,-2.9 4,-2.4 -5,-0.2 -2,-0.2 0.950 113.0 49.3 -58.3 -52.1 1.0 -85.2 -21.0 30 39 A H H X S+ 0 0 117 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.943 116.1 42.1 -56.1 -47.0 -0.7 -86.9 -24.1 31 40 A R H X S+ 0 0 109 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.898 111.8 52.5 -74.2 -37.8 1.2 -90.2 -23.7 32 41 A T H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 5,-0.2 0.915 108.2 52.9 -63.4 -40.0 0.9 -90.4 -19.9 33 42 A R H X S+ 0 0 43 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.943 111.6 45.8 -61.4 -40.6 -2.9 -89.9 -20.2 34 43 A Q H X S+ 0 0 106 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.931 111.6 52.1 -70.2 -40.3 -3.1 -92.8 -22.7 35 44 A E H X S+ 0 0 35 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.899 112.0 45.8 -61.2 -40.0 -0.9 -95.0 -20.5 36 45 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 3,-0.5 0.916 107.4 57.2 -70.0 -42.3 -3.1 -94.3 -17.5 37 46 A S H X S+ 0 0 13 -4,-2.5 4,-2.0 1,-0.3 6,-0.2 0.917 104.2 54.4 -54.0 -42.8 -6.2 -95.0 -19.6 38 47 A D H <>S+ 0 0 56 -4,-2.3 5,-2.5 2,-0.2 6,-1.3 0.849 108.8 47.6 -58.8 -36.8 -4.7 -98.4 -20.4 39 48 A L H ><5S+ 0 0 2 -4,-1.1 3,-1.4 -3,-0.5 -2,-0.2 0.937 108.7 54.0 -71.2 -42.3 -4.3 -99.1 -16.7 40 49 A V H 3<5S+ 0 0 0 -4,-2.7 214,-0.4 1,-0.3 -2,-0.2 0.858 113.8 42.2 -58.8 -36.1 -7.9 -98.0 -15.9 41 50 A H T 3<5S- 0 0 72 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.301 114.9-112.5-100.0 12.8 -9.3 -100.4 -18.5 42 51 A G T < 5S+ 0 0 29 -3,-1.4 -3,-0.2 2,-0.2 -4,-0.1 0.726 80.9 123.7 72.3 18.8 -7.0 -103.3 -17.6 43 52 A R S - 0 0 43 1,-0.1 4,-2.0 251,-0.0 3,-0.3 -0.777 60.1-163.1-146.0 99.8 7.5 -74.4 -2.1 59 68 A P H > S+ 0 0 24 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.786 90.4 59.5 -52.5 -34.8 8.2 -74.9 -5.8 60 69 A K H > S+ 0 0 160 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.958 107.7 43.1 -65.5 -45.7 12.0 -75.2 -5.2 61 70 A A H > S+ 0 0 1 -3,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.875 111.5 57.2 -64.1 -36.6 11.6 -78.2 -2.9 62 71 A A H X S+ 0 0 3 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.869 107.3 47.1 -60.0 -44.7 9.1 -79.6 -5.3 63 72 A L H X S+ 0 0 56 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.861 111.5 50.6 -64.3 -38.0 11.6 -79.5 -8.2 64 73 A E H X S+ 0 0 74 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.934 112.7 47.2 -64.9 -45.1 14.2 -81.0 -6.0 65 74 A Y H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.937 110.7 52.7 -58.4 -44.5 11.8 -83.9 -5.0 66 75 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.868 104.9 54.1 -62.6 -38.3 10.8 -84.3 -8.7 67 76 A E H X S+ 0 0 103 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.941 112.5 44.2 -63.9 -41.1 14.5 -84.7 -9.8 68 77 A R H X S+ 0 0 85 -4,-1.9 4,-0.9 1,-0.2 3,-0.4 0.931 114.6 48.8 -64.4 -46.8 14.9 -87.5 -7.2 69 78 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 3,-0.3 0.848 100.8 65.5 -64.5 -34.8 11.6 -89.2 -8.2 70 79 A L H X S+ 0 0 40 -4,-2.4 4,-2.2 1,-0.3 -1,-0.2 0.888 97.1 55.2 -57.4 -38.8 12.4 -89.0 -11.9 71 80 A K H X S+ 0 0 154 -4,-1.2 4,-2.5 -3,-0.4 -1,-0.3 0.901 112.0 43.4 -62.2 -37.7 15.3 -91.4 -11.4 72 81 A L H X S+ 0 0 15 -4,-0.9 4,-2.2 -3,-0.3 -2,-0.2 0.862 108.3 57.7 -76.8 -33.4 12.9 -93.9 -9.8 73 82 A R H < S+ 0 0 26 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.921 113.8 41.4 -57.9 -43.9 10.2 -93.3 -12.4 74 83 A K H >< S+ 0 0 129 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.946 113.3 51.4 -68.3 -53.5 12.8 -94.4 -15.0 75 84 A Q H 3< S+ 0 0 118 -4,-2.5 3,-0.3 1,-0.3 -2,-0.2 0.842 119.7 34.8 -53.3 -40.5 14.2 -97.3 -13.0 76 85 A Y T >X S+ 0 0 31 -4,-2.2 4,-3.0 1,-0.2 3,-2.3 0.194 79.7 121.4-100.3 12.7 10.8 -98.9 -12.4 77 86 A E T <4 S+ 0 0 78 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.688 70.9 55.2 -62.0 -21.0 9.2 -98.0 -15.7 78 87 A N T 34 S+ 0 0 107 -3,-0.3 -1,-0.3 -4,-0.2 3,-0.1 0.653 124.0 25.4 -80.3 -15.3 8.4 -101.6 -16.7 79 88 A E T <4 S+ 0 0 24 -3,-2.3 -32,-2.2 1,-0.3 2,-0.3 0.704 124.9 37.1-112.7 -34.7 6.5 -102.2 -13.4 80 89 A L E < -c 47 0B 1 -4,-3.0 2,-0.6 -34,-0.3 -1,-0.3 -0.943 54.9-151.0-125.1 144.1 5.3 -98.7 -12.2 81 90 A L E -c 48 0B 2 -34,-2.5 -32,-2.9 -2,-0.3 2,-0.4 -0.969 30.0-161.0-111.3 102.8 4.0 -95.7 -13.9 82 91 A I E +c 49 0B 0 -2,-0.6 2,-0.4 -34,-0.2 -32,-0.2 -0.774 14.8 175.5 -96.8 127.4 5.1 -93.0 -11.4 83 92 A V E -c 50 0B 0 -34,-2.8 -32,-2.2 -2,-0.4 2,-0.2 -0.998 29.2-119.2-131.7 131.8 3.4 -89.6 -11.5 84 93 A M E -ce 51 133B 0 48,-2.1 50,-1.9 -2,-0.4 2,-0.5 -0.526 18.2-123.3 -75.8 141.4 4.1 -86.8 -9.0 85 94 A R E + e 0 134B 1 -34,-1.6 2,-0.2 -2,-0.2 50,-0.2 -0.703 33.6 172.3 -75.8 120.0 1.4 -85.3 -6.7 86 95 A V + 0 0 0 48,-2.8 2,-0.5 -2,-0.5 -32,-0.1 -0.646 9.5 178.6-131.8 78.9 1.4 -81.6 -7.4 87 96 A Y + 0 0 6 -34,-0.3 -31,-2.2 -2,-0.2 13,-0.3 -0.718 16.8 168.0-100.3 114.7 -1.6 -80.4 -5.3 88 97 A F + 0 0 1 -2,-0.5 13,-1.5 48,-0.3 14,-0.5 0.449 64.8 57.2-100.3 -8.2 -2.3 -76.7 -5.4 89 98 A E - 0 0 13 47,-0.2 10,-0.2 10,-0.2 47,-0.2 -0.997 62.7-169.5-133.9 123.2 -5.8 -76.8 -3.8 90 99 A K - 0 0 16 8,-2.5 2,-0.4 -2,-0.4 -35,-0.0 -0.960 15.6-142.2-120.4 126.6 -6.6 -78.2 -0.4 91 100 A P - 0 0 22 0, 0.0 2,-0.3 0, 0.0 4,-0.1 -0.685 22.4-151.2 -85.1 130.3 -10.1 -78.8 1.0 92 101 A R - 0 0 72 -2,-0.4 4,-0.1 2,-0.3 445,-0.0 -0.722 21.1-126.8-101.9 150.6 -10.2 -78.0 4.8 93 102 A T S S- 0 0 68 -2,-0.3 444,-0.2 2,-0.2 -1,-0.1 0.886 98.7 -24.1 -57.7 -45.0 -12.5 -79.5 7.3 94 103 A T S S- 0 0 54 1,-0.4 2,-0.3 442,-0.1 -2,-0.3 0.298 122.7 -22.3-123.4 -85.6 -13.6 -76.0 8.3 95 104 A V S S+ 0 0 59 -4,-0.1 -1,-0.4 2,-0.0 2,-0.3 -0.836 73.4 109.4-126.1 167.9 -11.0 -73.2 7.6 96 105 A G S S- 0 0 37 -2,-0.3 2,-0.2 -4,-0.1 -4,-0.1 -0.883 73.2 -29.6 148.3 178.6 -7.3 -73.0 7.0 97 106 A W - 0 0 40 -2,-0.3 3,-0.1 1,-0.1 -2,-0.0 -0.446 50.1-158.5 -61.2 126.2 -4.7 -72.4 4.2 98 107 A K - 0 0 17 1,-0.3 -8,-2.5 -2,-0.2 3,-0.2 0.339 48.5 -86.1 -93.3 5.3 -6.3 -73.6 1.0 99 108 A G > - 0 0 0 -10,-0.2 4,-2.0 1,-0.2 -1,-0.3 -0.541 52.8 -53.5 118.1 179.3 -3.1 -74.1 -0.9 100 109 A L T 4 S+ 0 0 1 -44,-0.5 -1,-0.2 -13,-0.3 -11,-0.1 0.821 126.2 50.8 -69.9 -34.4 -0.5 -72.4 -3.0 101 110 A I T 4 S+ 0 0 5 -13,-1.5 14,-0.3 -3,-0.2 15,-0.3 0.956 112.8 44.6 -64.1 -54.8 -2.9 -70.9 -5.6 102 111 A N T 4 S+ 0 0 19 -14,-0.5 10,-0.2 1,-0.2 -2,-0.2 0.786 138.6 4.4 -61.7 -34.8 -5.2 -69.4 -3.1 103 112 A D >< + 0 0 10 -4,-2.0 3,-2.0 7,-0.2 -1,-0.2 -0.481 66.4 171.3-153.1 69.3 -2.4 -67.9 -0.9 104 113 A P T 3 S+ 0 0 9 0, 0.0 -3,-0.1 0, 0.0 -1,-0.1 0.784 78.9 56.5 -59.6 -27.5 1.0 -68.4 -2.4 105 114 A H T 3 S- 0 0 75 -5,-0.1 -5,-0.1 1,-0.0 -48,-0.0 0.458 100.7-133.9 -86.6 4.1 2.8 -66.2 0.1 106 115 A L S < S+ 0 0 56 -3,-2.0 -9,-0.0 -7,-0.2 -6,-0.0 0.791 81.4 93.5 57.9 30.1 1.5 -68.3 3.0 107 116 A D S S- 0 0 97 -4,-0.0 -1,-0.1 0, 0.0 -4,-0.0 0.127 103.6 -91.3-140.8 18.4 0.5 -65.1 5.0 108 117 A G S S+ 0 0 40 -5,-0.2 -5,-0.1 1,-0.1 -2,-0.0 0.816 89.9 117.9 75.0 29.0 -3.1 -64.3 4.2 109 118 A T - 0 0 71 2,-0.0 3,-0.2 3,-0.0 -6,-0.1 0.600 61.2-148.0-103.1 -15.6 -2.5 -62.0 1.3 110 119 A F + 0 0 61 1,-0.2 2,-2.0 2,-0.1 3,-0.2 0.886 23.5 176.6 56.6 47.6 -4.4 -64.1 -1.2 111 120 A D > + 0 0 55 1,-0.2 4,-2.3 2,-0.1 3,-0.4 -0.477 7.7 165.7 -84.6 76.4 -2.3 -63.2 -4.2 112 121 A I H > + 0 0 3 -2,-2.0 4,-2.9 1,-0.3 5,-0.2 0.821 67.6 59.0 -70.1 -32.1 -4.1 -65.5 -6.5 113 122 A N H > S+ 0 0 21 -3,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.922 111.7 41.9 -60.8 -46.3 -2.7 -64.0 -9.7 114 123 A F H > S+ 0 0 71 -3,-0.4 4,-3.0 2,-0.2 -2,-0.2 0.908 112.9 56.0 -65.3 -39.1 0.8 -64.8 -8.5 115 124 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 -14,-0.3 -2,-0.2 0.913 108.0 45.6 -62.2 -42.6 -0.4 -68.2 -7.3 116 125 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 -15,-0.3 -1,-0.2 0.897 113.3 50.9 -66.8 -40.1 -1.7 -69.3 -10.6 117 126 A R H X S+ 0 0 36 -4,-1.7 4,-2.6 -5,-0.2 -2,-0.2 0.942 111.9 46.7 -58.6 -51.9 1.4 -68.1 -12.4 118 127 A Q H X S+ 0 0 51 -4,-3.0 4,-2.3 2,-0.2 5,-0.2 0.868 111.5 51.5 -60.8 -41.4 3.6 -70.0 -10.0 119 128 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.936 112.8 45.5 -58.9 -47.2 1.4 -73.2 -10.3 120 129 A R H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.912 111.6 52.0 -67.6 -40.5 1.6 -73.1 -14.1 121 130 A S H X S+ 0 0 48 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.921 111.1 46.7 -63.0 -45.3 5.3 -72.4 -14.1 122 131 A L H X S+ 0 0 7 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.941 112.6 50.4 -60.5 -47.0 6.1 -75.3 -11.7 123 132 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.892 110.9 48.7 -59.2 -43.1 3.9 -77.7 -13.8 124 133 A L H X S+ 0 0 19 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.932 111.5 48.7 -64.0 -44.3 5.6 -76.7 -17.0 125 134 A S H X S+ 0 0 47 -4,-2.4 4,-1.7 2,-0.2 6,-0.2 0.909 112.4 50.8 -62.6 -39.1 9.1 -77.2 -15.5 126 135 A L H >X>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 4,-0.6 0.970 112.1 43.9 -62.3 -54.2 8.0 -80.6 -14.2 127 136 A N H ><5S+ 0 0 2 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.905 111.2 56.6 -57.0 -41.3 6.7 -81.8 -17.5 128 137 A N H 3<5S+ 0 0 76 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.783 105.6 49.3 -60.4 -33.6 9.7 -80.4 -19.2 129 138 A M H <<5S- 0 0 44 -4,-1.7 -1,-0.3 -3,-0.6 -2,-0.2 0.468 127.3 -97.9 -84.1 -4.5 12.1 -82.4 -17.1 130 139 A G T <<5S+ 0 0 24 -3,-1.2 -3,-0.2 -4,-0.6 -2,-0.1 0.501 85.1 123.3 106.7 5.1 10.1 -85.6 -17.8 131 140 A M < - 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