==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RNA BINDING PROTEIN 06-MAY-09 3HCW . COMPND 2 MOLECULE: MALTOSE OPERON TRANSCRIPTIONAL REPRESSOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS MU . AUTHOR Y.PATSKOVSKY,R.TORO,C.MORANO,J.FREEMAN,S.CHANG,J.M.SAUDER,S. . 565 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24672.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 404 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.4 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 . 36 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 199 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.1 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 4 0 0 0 2 0 0 0 0 4 1 3 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 8 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 56 A T 0 0 143 0, 0.0 66,-0.1 0, 0.0 67,-0.1 0.000 360.0 360.0 360.0 156.1 8.2 33.4 -17.2 2 57 A N - 0 0 33 65,-0.3 3,-0.1 64,-0.3 65,-0.1 -0.087 360.0-133.3 -75.2 177.1 7.4 34.1 -20.9 3 58 A Q + 0 0 156 61,-0.2 64,-0.1 1,-0.1 -1,-0.1 -0.284 69.0 110.1-129.9 47.6 4.5 36.1 -22.2 4 59 A T S S- 0 0 53 2,-0.2 37,-0.1 37,-0.0 -1,-0.1 0.588 70.9-136.6 -95.7 -14.1 3.1 33.9 -25.0 5 60 A Y + 0 0 124 1,-0.2 36,-2.9 -3,-0.1 2,-0.3 0.859 66.0 122.2 49.2 41.8 -0.2 32.9 -23.4 6 61 A K E -a 41 0A 80 34,-0.2 61,-3.1 37,-0.0 62,-1.0 -0.981 52.7-150.7-132.9 143.5 0.5 29.4 -24.7 7 62 A I E -ab 42 68A 0 34,-2.2 36,-2.4 -2,-0.3 2,-0.5 -0.963 13.3-141.3-115.8 124.7 0.9 26.0 -23.0 8 63 A G E -ab 43 69A 0 60,-3.1 62,-2.0 -2,-0.5 2,-0.7 -0.724 12.6-156.8 -82.8 127.4 3.2 23.2 -24.4 9 64 A L E -ab 44 70A 0 34,-2.2 36,-2.3 -2,-0.5 2,-0.6 -0.892 7.0-150.2-109.1 105.7 1.7 19.8 -24.0 10 65 A V E - b 0 71A 0 60,-1.5 62,-2.6 -2,-0.7 2,-0.2 -0.653 14.9-167.1 -82.0 115.1 4.3 17.0 -24.0 11 66 A L - 0 0 8 -2,-0.6 3,-0.1 60,-0.1 62,-0.1 -0.555 28.0-127.8 -94.2 160.5 3.1 13.6 -25.4 12 67 A K S S- 0 0 71 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.888 83.5 -25.2 -71.9 -44.8 4.7 10.2 -25.2 13 68 A G - 0 0 3 2,-0.1 -1,-0.2 32,-0.1 35,-0.2 -0.949 44.4-125.1-159.7 177.4 4.5 9.6 -29.0 14 69 A S + 0 0 26 -2,-0.3 5,-0.2 32,-0.1 34,-0.1 0.370 60.4 141.7-109.0 -0.4 2.7 10.5 -32.3 15 70 A E >> - 0 0 85 3,-0.1 4,-2.8 33,-0.1 3,-2.1 0.094 65.1-109.7 -51.0 151.2 2.0 6.8 -33.2 16 71 A E H 3> S+ 0 0 60 1,-0.3 4,-1.0 2,-0.2 497,-0.1 0.887 120.5 45.3 -50.8 -47.6 -1.3 5.7 -34.8 17 72 A P H 34 S+ 0 0 23 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.456 117.2 48.4 -79.5 7.4 -2.5 3.9 -31.6 18 73 A I H <4 S+ 0 0 27 -3,-2.1 3,-0.4 2,-0.1 6,-0.3 0.788 113.2 39.8-106.6 -48.6 -1.4 7.0 -29.5 19 74 A R H < S+ 0 0 69 -4,-2.8 -3,-0.2 1,-0.2 -4,-0.1 0.661 122.8 46.0 -74.1 -16.2 -2.9 10.0 -31.3 20 75 A L S < S+ 0 0 6 -4,-1.0 -1,-0.2 -5,-0.4 -2,-0.1 0.419 86.3 115.6 -99.0 -5.1 -6.0 7.8 -31.9 21 76 A N >> - 0 0 13 -3,-0.4 4,-2.3 1,-0.2 3,-0.5 -0.575 66.2-142.6 -69.3 119.1 -6.0 6.7 -28.2 22 77 A P H 3> S+ 0 0 2 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.579 97.2 66.7 -59.5 -14.5 -9.2 8.0 -26.6 23 78 A F H 3> S+ 0 0 31 2,-0.2 4,-2.6 3,-0.1 5,-0.1 0.967 108.3 35.0 -66.6 -57.3 -7.2 8.7 -23.5 24 79 A Y H <> S+ 0 0 19 -3,-0.5 4,-2.9 -6,-0.3 5,-0.3 0.896 114.8 57.5 -68.4 -39.9 -5.1 11.4 -25.1 25 80 A I H X S+ 0 0 26 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.947 114.9 38.3 -54.0 -47.4 -7.9 12.6 -27.3 26 81 A N H X S+ 0 0 5 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.870 115.8 51.1 -73.6 -36.0 -10.0 13.3 -24.1 27 82 A V H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.968 113.5 45.3 -64.6 -50.6 -7.1 14.5 -22.0 28 83 A L H X S+ 0 0 35 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.872 113.1 50.6 -59.2 -41.8 -6.0 17.0 -24.7 29 84 A L H X S+ 0 0 28 -4,-2.0 4,-2.3 -5,-0.3 5,-0.3 0.920 111.1 49.8 -59.1 -45.3 -9.7 18.1 -25.1 30 85 A G H X S+ 0 0 0 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.936 115.6 42.5 -57.3 -49.4 -9.9 18.6 -21.4 31 86 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.952 116.0 47.5 -61.7 -50.2 -6.7 20.7 -21.3 32 87 A S H X S+ 0 0 26 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.888 109.2 49.6 -66.8 -45.2 -7.5 22.7 -24.4 33 88 A E H X S+ 0 0 23 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.886 114.4 46.8 -63.3 -37.1 -11.1 23.8 -23.7 34 89 A T H >< S+ 0 0 9 -4,-1.3 3,-0.8 -5,-0.3 4,-0.3 0.955 115.0 45.8 -66.3 -52.4 -10.1 24.9 -20.2 35 90 A C H ><>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 3,-1.4 0.886 111.7 52.9 -53.4 -44.1 -7.0 26.8 -21.5 36 91 A N H ><5S+ 0 0 101 -4,-3.0 3,-0.6 1,-0.3 -1,-0.2 0.663 100.6 61.1 -72.2 -17.5 -9.1 28.3 -24.3 37 92 A Q T <<5S+ 0 0 135 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.2 0.497 109.4 43.2 -84.3 -4.2 -11.7 29.6 -21.8 38 93 A H T < 5S- 0 0 112 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.073 124.1 -94.9-128.0 21.0 -9.0 31.8 -20.2 39 94 A G T < 5S+ 0 0 58 -3,-0.6 2,-0.4 1,-0.2 -3,-0.2 0.594 82.7 131.4 77.7 13.1 -7.2 33.2 -23.3 40 95 A Y < - 0 0 43 -5,-2.6 -1,-0.2 -6,-0.2 -34,-0.2 -0.814 42.4-152.7-102.2 136.7 -4.5 30.5 -23.4 41 96 A G E -a 6 0A 22 -36,-2.9 -34,-2.2 -2,-0.4 2,-0.3 -0.527 11.8-138.0 -95.3 169.3 -3.5 28.5 -26.5 42 97 A T E -a 7 0A 39 -36,-0.2 2,-0.3 -2,-0.2 -34,-0.2 -0.948 10.0-162.8-130.2 152.3 -2.0 25.0 -26.5 43 98 A Q E -a 8 0A 53 -36,-2.4 -34,-2.2 -2,-0.3 2,-0.4 -0.848 11.5-155.2-141.5 101.6 0.8 23.4 -28.5 44 99 A T E -a 9 0A 63 -2,-0.3 -34,-0.2 -36,-0.2 -36,-0.1 -0.601 23.4-118.0 -77.3 125.7 0.9 19.6 -28.6 45 100 A T - 0 0 8 -36,-2.3 -32,-0.1 -2,-0.4 -1,-0.1 -0.323 20.1-164.1 -61.2 146.5 4.4 18.0 -29.3 46 101 A V + 0 0 94 -36,-0.0 -1,-0.1 -35,-0.0 -32,-0.1 0.333 44.2 124.8-117.7 1.8 4.5 15.9 -32.5 47 102 A S - 0 0 14 -34,-0.1 -36,-0.1 1,-0.1 3,-0.0 -0.275 43.6-161.3 -72.0 151.3 7.7 14.0 -31.8 48 103 A N + 0 0 94 -35,-0.2 2,-0.3 -34,-0.1 -1,-0.1 0.428 66.5 39.8-118.1 -4.0 7.8 10.1 -31.9 49 104 A N S > S- 0 0 59 1,-0.1 4,-2.0 -36,-0.1 5,-0.2 -0.953 81.0-107.5-144.2 166.5 11.0 9.2 -30.0 50 105 A M H > S+ 0 0 69 -2,-0.3 4,-1.9 2,-0.2 5,-0.1 0.846 113.9 47.6 -65.1 -42.2 13.0 10.3 -26.9 51 106 A N H > S+ 0 0 116 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.893 116.8 44.6 -67.7 -38.9 16.0 12.0 -28.6 52 107 A D H > S+ 0 0 72 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.802 111.9 52.6 -71.5 -33.0 13.7 13.9 -30.9 53 108 A L H X S+ 0 0 4 -4,-2.0 4,-1.5 2,-0.2 5,-0.2 0.806 108.0 51.4 -74.9 -31.0 11.3 14.8 -28.1 54 109 A M H X S+ 0 0 54 -4,-1.9 4,-1.4 -5,-0.2 -2,-0.2 0.857 113.2 47.2 -67.8 -35.9 14.2 16.1 -26.1 55 110 A D H X S+ 0 0 105 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.954 113.7 44.4 -67.9 -51.1 15.1 18.2 -29.1 56 111 A E H X S+ 0 0 30 -4,-2.7 4,-1.4 1,-0.2 -2,-0.2 0.752 113.9 48.3 -74.6 -25.8 11.7 19.6 -29.8 57 112 A V H X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.885 110.5 52.7 -76.1 -39.5 10.8 20.5 -26.2 58 113 A Y H X S+ 0 0 88 -4,-1.4 4,-2.9 2,-0.2 5,-0.2 0.851 105.9 54.5 -61.7 -36.7 14.2 22.2 -25.9 59 114 A K H X S+ 0 0 111 -4,-1.9 4,-3.0 1,-0.2 6,-0.3 0.945 106.1 51.8 -58.4 -49.9 13.4 24.2 -29.0 60 115 A M H <>S+ 0 0 3 -4,-1.4 5,-1.7 1,-0.2 6,-0.8 0.796 113.9 44.7 -56.6 -33.2 10.1 25.3 -27.3 61 116 A I H ><5S+ 0 0 12 -4,-1.6 3,-1.5 3,-0.2 -2,-0.2 0.973 117.6 41.3 -70.5 -59.2 12.2 26.4 -24.2 62 117 A K H 3<5S+ 0 0 134 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.845 115.4 48.4 -63.0 -42.0 15.0 28.2 -26.1 63 118 A Q T 3<5S- 0 0 119 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.1 0.320 107.7-128.5 -80.2 7.0 12.8 29.9 -28.7 64 119 A R T < 5 + 0 0 168 -3,-1.5 -61,-0.2 -5,-0.2 -3,-0.2 0.819 55.2 152.7 50.3 42.4 10.6 31.0 -25.7 65 120 A M < + 0 0 82 -5,-1.7 2,-0.3 -6,-0.3 -4,-0.1 0.706 54.8 28.7 -79.4 -23.9 7.5 29.6 -27.5 66 121 A V - 0 0 0 -6,-0.8 -64,-0.3 1,-0.1 -59,-0.2 -0.871 60.9-138.1-134.7 166.1 5.3 28.8 -24.4 67 122 A D S S- 0 0 3 -61,-3.1 2,-0.3 -2,-0.3 -65,-0.3 0.750 83.9 -9.7 -92.0 -30.6 4.7 30.0 -20.9 68 123 A A E -b 7 0A 0 -62,-1.0 -60,-3.1 21,-0.1 2,-0.3 -0.953 62.0-124.2-161.7 173.4 4.4 26.5 -19.3 69 124 A F E -bc 8 91A 0 21,-1.8 23,-1.6 -2,-0.3 2,-0.4 -0.875 1.6-156.5-129.2 156.3 4.2 22.8 -19.9 70 125 A I E -bc 9 92A 0 -62,-2.0 -60,-1.5 -2,-0.3 2,-0.6 -0.946 18.9-148.1-130.2 111.1 2.0 19.8 -19.0 71 126 A L E -bc 10 93A 0 21,-3.0 23,-3.5 -2,-0.4 -60,-0.1 -0.735 4.6-155.7 -77.0 120.1 3.8 16.5 -19.2 72 127 A L S S+ 0 0 4 -62,-2.6 2,-0.3 -2,-0.6 -60,-0.2 0.129 71.3 39.1 -88.2 21.3 1.1 13.9 -20.3 73 128 A Y - 0 0 21 -62,-0.1 2,-0.4 -63,-0.1 21,-0.2 -0.970 70.0-133.6-155.9 164.7 3.0 11.0 -18.7 74 129 A S + 0 0 10 -2,-0.3 67,-1.2 19,-0.1 2,-0.3 -0.995 28.7 161.6-126.4 129.9 5.0 10.0 -15.6 75 130 A K > - 0 0 55 -2,-0.4 3,-0.9 65,-0.2 2,-0.2 -0.993 41.5-108.3-145.6 142.4 8.3 8.1 -15.7 76 131 A E T 3 S+ 0 0 104 63,-0.5 63,-0.1 -2,-0.3 23,-0.0 -0.509 105.6 9.1 -67.2 135.5 11.2 7.6 -13.2 77 132 A N T 3 S- 0 0 134 1,-0.2 -1,-0.3 -2,-0.2 3,-0.0 0.912 82.7-178.7 52.9 49.9 14.3 9.5 -14.3 78 133 A D <> - 0 0 9 -3,-0.9 4,-1.7 1,-0.1 -1,-0.2 -0.727 16.2-158.4 -77.1 115.8 12.4 11.3 -17.1 79 134 A P H > S+ 0 0 55 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.706 91.9 52.6 -72.5 -23.5 15.2 13.5 -18.8 80 135 A I H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.776 108.0 50.7 -82.4 -28.8 12.6 15.9 -20.4 81 136 A K H > S+ 0 0 16 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.859 111.3 50.3 -66.4 -37.5 11.1 16.4 -16.9 82 137 A Q H X S+ 0 0 77 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.839 105.4 57.0 -64.4 -36.5 14.8 17.0 -15.9 83 138 A M H X S+ 0 0 22 -4,-1.3 4,-2.7 2,-0.2 -2,-0.2 0.953 107.4 46.0 -58.8 -52.8 15.0 19.5 -18.8 84 139 A L H <>S+ 0 0 1 -4,-1.8 5,-1.6 1,-0.2 -1,-0.2 0.738 114.4 49.7 -64.2 -26.0 12.1 21.6 -17.5 85 140 A I H ><5S+ 0 0 45 -4,-1.1 3,-1.0 3,-0.2 -2,-0.2 0.908 113.0 45.5 -75.9 -46.1 13.6 21.4 -14.0 86 141 A D H 3<5S+ 0 0 114 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.892 117.2 44.0 -59.9 -43.2 17.1 22.5 -15.2 87 142 A E T 3<5S- 0 0 79 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.060 110.2-118.8-100.8 23.5 15.7 25.3 -17.4 88 143 A S T < 5 + 0 0 106 -3,-1.0 -3,-0.2 1,-0.2 -4,-0.1 0.623 53.8 160.4 53.8 27.2 13.3 26.6 -14.7 89 144 A M < - 0 0 21 -5,-1.6 -1,-0.2 -6,-0.2 2,-0.1 -0.637 41.3-121.8 -82.0 129.6 10.1 26.1 -16.7 90 145 A P + 0 0 29 0, 0.0 -21,-1.8 0, 0.0 2,-0.3 -0.468 45.9 166.3 -65.0 138.4 6.7 25.9 -14.8 91 146 A F E -c 69 0A 3 -23,-0.2 15,-0.4 -2,-0.1 2,-0.3 -0.987 35.8-144.4-152.8 163.2 4.9 22.6 -15.3 92 147 A I E -c 70 0A 0 -23,-1.6 -21,-3.0 -2,-0.3 2,-0.4 -0.898 19.4-147.3-117.8 152.3 2.2 20.1 -14.4 93 148 A V E -cd 71 107A 0 13,-1.8 15,-2.5 -2,-0.3 2,-0.9 -0.993 5.5-148.5-119.6 128.7 2.6 16.3 -14.7 94 149 A I E S+ d 0 108A 9 -23,-3.5 2,-0.3 -2,-0.4 15,-0.2 -0.873 72.8 37.2 -90.0 107.4 -0.3 14.0 -15.5 95 150 A G S S- 0 0 8 13,-1.5 -2,-0.1 -2,-0.9 13,-0.1 -0.943 98.2 -29.2 147.3-163.5 0.7 10.9 -13.5 96 151 A K - 0 0 68 -2,-0.3 2,-0.1 -22,-0.1 45,-0.1 -0.720 50.2-120.9 -94.9 131.3 2.3 9.7 -10.3 97 152 A P + 0 0 39 0, 0.0 -21,-0.1 0, 0.0 -23,-0.0 -0.459 33.3 173.8 -60.9 134.6 4.9 11.6 -8.2 98 153 A T + 0 0 49 -2,-0.1 2,-0.3 -23,-0.1 3,-0.0 0.318 49.1 38.2-129.9 3.8 8.0 9.3 -7.9 99 154 A S S S- 0 0 71 1,-0.1 4,-0.2 -23,-0.0 -23,-0.0 -0.863 81.0 -97.0-151.3 174.1 10.7 11.3 -6.2 100 155 A D S > S+ 0 0 128 -2,-0.3 3,-1.4 1,-0.2 4,-0.2 0.904 119.8 50.9 -66.5 -45.0 11.7 13.9 -3.5 101 156 A I G > S+ 0 0 76 1,-0.3 3,-2.1 2,-0.2 4,-0.4 0.746 92.2 77.9 -67.0 -22.5 11.7 16.9 -6.0 102 157 A D G > S+ 0 0 1 1,-0.3 3,-0.5 2,-0.2 -1,-0.3 0.641 76.1 75.8 -61.9 -16.9 8.2 15.9 -7.1 103 158 A H G < S+ 0 0 84 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.769 93.4 53.0 -59.7 -29.3 7.0 17.5 -3.9 104 159 A Q G < S+ 0 0 126 -3,-2.1 2,-0.5 -4,-0.2 -1,-0.2 0.717 102.8 67.9 -77.5 -24.2 7.6 20.8 -5.6 105 160 A F S < S- 0 0 45 -3,-0.5 2,-0.1 -4,-0.4 -13,-0.1 -0.878 83.4-119.5-115.1 126.2 5.6 20.0 -8.7 106 161 A T - 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0 0 13 -4,-0.4 63,-0.2 1,-0.1 3,-0.1 -0.972 26.9-167.1-135.2 154.4 -12.6 -17.2 -11.2 129 184 A D S S+ 0 0 74 61,-3.1 31,-1.0 -2,-0.3 2,-0.3 0.808 79.2 25.3-100.6 -43.8 -9.8 -19.6 -10.6 130 185 A E E -fg 160 191B 19 60,-2.0 62,-1.3 29,-0.2 2,-0.3 -0.947 65.1-155.6-131.5 142.6 -7.0 -18.1 -12.5 131 186 A L E -fg 161 192B 0 29,-2.4 31,-1.7 -2,-0.3 2,-0.4 -0.922 2.4-164.9-121.7 144.1 -6.1 -14.5 -13.6 132 187 A I E -fg 162 193B 1 60,-2.1 62,-3.3 -2,-0.3 2,-0.5 -0.996 2.8-163.8-127.1 125.8 -4.0 -13.0 -16.4 133 188 A F E -fg 163 194B 0 29,-2.4 31,-2.8 -2,-0.4 2,-0.5 -0.958 8.2-160.5-106.9 127.9 -2.8 -9.4 -16.6 134 189 A I E +fg 164 195B 2 60,-3.4 62,-2.5 -2,-0.5 2,-0.3 -0.924 16.4 174.2-111.4 125.4 -1.5 -8.2 -20.0 135 190 A T E -f 165 0B 2 29,-3.1 31,-2.7 -2,-0.5 2,-0.3 -0.788 26.2-117.3-127.4 168.1 0.7 -5.1 -20.1 136 191 A E E -f 166 0B 60 -2,-0.3 4,-0.2 29,-0.2 31,-0.2 -0.750 38.4 -95.9-102.4 154.3 2.8 -3.1 -22.6 137 192 A K S S+ 0 0 101 29,-0.6 -1,-0.1 -2,-0.3 2,-0.1 -0.129 77.1 78.8 -66.7 163.8 6.5 -2.5 -22.6 138 193 A G S S- 0 0 27 1,-0.1 2,-1.1 2,-0.0 -2,-0.1 -0.029 85.9 -96.8 105.8 143.5 8.1 0.6 -21.0 139 194 A N + 0 0 109 -2,-0.1 -63,-0.5 -63,-0.1 2,-0.2 -0.279 63.6 164.2 -87.2 50.6 8.8 1.3 -17.3 140 195 A F > - 0 0 35 -2,-1.1 4,-2.0 -4,-0.2 3,-0.2 -0.500 41.3-140.1 -77.5 135.1 5.6 3.3 -17.0 141 196 A E H > S+ 0 0 8 -67,-1.2 4,-2.7 -2,-0.2 5,-0.2 0.784 102.3 59.7 -65.5 -28.4 4.3 4.1 -13.6 142 197 A V H > S+ 0 0 54 -68,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.926 107.3 47.7 -64.4 -43.5 0.6 3.5 -14.7 143 198 A S H > S+ 0 0 8 -3,-0.2 4,-2.7 2,-0.2 5,-0.2 0.940 112.7 48.2 -57.8 -51.4 1.7 -0.1 -15.6 144 199 A K H X S+ 0 0 90 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.884 113.5 47.7 -58.9 -44.6 3.5 -0.6 -12.3 145 200 A D H X S+ 0 0 13 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.898 114.0 45.1 -63.6 -44.3 0.5 0.8 -10.3 146 201 A R H X S+ 0 0 11 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.868 113.6 50.0 -72.7 -38.1 -2.1 -1.4 -12.2 147 202 A I H X S+ 0 0 30 -4,-2.7 4,-2.8 -5,-0.2 5,-0.3 0.946 110.3 51.8 -58.5 -49.9 0.0 -4.5 -11.9 148 203 A Q H X S+ 0 0 90 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.893 110.2 47.2 -55.8 -43.9 0.5 -3.9 -8.2 149 204 A G H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.849 113.9 49.1 -66.4 -33.9 -3.3 -3.5 -7.6 150 205 A F H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.938 111.7 46.9 -68.9 -51.5 -3.9 -6.7 -9.6 151 206 A E H X S+ 0 0 58 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.790 110.7 54.5 -60.7 -35.2 -1.3 -8.8 -7.8 152 207 A T H X S+ 0 0 48 -4,-1.8 4,-2.6 -5,-0.3 -1,-0.2 0.931 111.4 41.2 -69.8 -45.7 -2.6 -7.6 -4.4 153 208 A V H X S+ 0 0 10 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.907 115.9 52.0 -69.7 -38.5 -6.2 -8.6 -4.9 154 209 A A H <>S+ 0 0 0 -4,-2.3 5,-3.1 2,-0.2 -1,-0.2 0.883 114.2 42.0 -61.8 -40.9 -5.2 -11.9 -6.5 155 210 A S H ><5S+ 0 0 68 -4,-1.9 3,-1.6 3,-0.2 -2,-0.2 0.893 109.4 59.3 -74.5 -38.1 -2.8 -12.7 -3.6 156 211 A Q H 3<5S+ 0 0 147 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.816 113.2 37.9 -56.6 -34.5 -5.5 -11.5 -1.1 157 212 A F T 3<5S- 0 0 87 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.274 114.2-120.4-101.9 11.8 -7.9 -14.1 -2.4 158 213 A N T < 5 + 0 0 152 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.887 57.4 157.6 50.5 49.0 -5.0 -16.7 -2.9 159 214 A L < - 0 0 33 -5,-3.1 2,-0.3 -6,-0.1 -1,-0.2 -0.732 45.8-111.0-101.6 150.8 -5.6 -17.0 -6.6 160 215 A D E +f 130 0B 121 -31,-1.0 -29,-2.4 -2,-0.3 2,-0.3 -0.625 46.9 166.7 -77.9 137.5 -3.2 -18.2 -9.3 161 216 A Y E -f 131 0B 82 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.984 22.4-160.3-148.9 158.8 -2.1 -15.4 -11.7 162 217 A Q E -f 132 0B 64 -31,-1.7 -29,-2.4 -2,-0.3 2,-0.4 -0.965 13.0-140.1-137.3 155.1 0.4 -14.5 -14.4 163 218 A I E -f 133 0B 62 -2,-0.3 2,-0.5 -31,-0.2 -29,-0.2 -0.958 15.5-167.3-113.0 131.5 1.7 -11.3 -15.9 164 219 A I E -f 134 0B 13 -31,-2.8 -29,-3.1 -2,-0.4 2,-0.5 -0.990 4.1-161.9-119.6 124.2 2.4 -11.1 -19.7 165 220 A E E +f 135 0B 91 -2,-0.5 2,-0.3 -31,-0.2 -29,-0.2 -0.924 26.2 161.4-103.0 128.2 4.3 -8.2 -21.1 166 221 A T E -f 136 0B 1 -31,-2.7 -29,-0.6 -2,-0.5 2,-0.2 -0.953 39.1-120.3-144.2 156.0 3.8 -7.8 -24.9 167 222 A S - 0 0 20 -2,-0.3 6,-0.1 -31,-0.2 -32,-0.0 -0.612 41.5-106.8 -85.0 162.9 4.1 -5.5 -27.8 168 223 A N S S+ 0 0 62 -2,-0.2 2,-0.3 4,-0.1 -1,-0.0 0.360 76.7 129.9 -69.2 3.7 0.9 -4.6 -29.8 169 224 A E > - 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