==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 30-APR-03 1P6Q . COMPND 2 MOLECULE: CHEY2; . SOURCE 2 ORGANISM_SCIENTIFIC: SINORHIZOBIUM MELILOTI; . AUTHOR H.RIEPL,B.SCHARF,T.MAURER,R.SCHMITT,H.R.KALBITZER, . 129 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7869.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 81 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 9 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 0 0 0 1 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 0 236 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-100.9 13.3 17.5 8.5 2 2 A S + 0 0 117 1,-0.3 2,-0.3 2,-0.0 3,-0.1 0.692 360.0 19.8-105.5 -30.7 11.1 17.8 5.4 3 3 A L - 0 0 79 1,-0.1 -1,-0.3 2,-0.1 0, 0.0 -0.869 57.4-161.7-146.8 107.2 8.0 16.2 6.9 4 4 A A S S+ 0 0 111 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.835 105.2 28.5 -54.4 -34.1 7.4 16.0 10.6 5 5 A E S S+ 0 0 117 -3,-0.1 -1,-0.2 2,-0.0 -2,-0.1 0.857 73.8 173.3 -92.7 -46.1 4.9 13.3 9.8 6 6 A K + 0 0 108 1,-0.2 2,-0.6 45,-0.1 46,-0.5 0.758 44.3 122.2 40.2 27.2 6.4 12.0 6.6 7 7 A I + 0 0 33 44,-0.2 2,-0.4 46,-0.1 -1,-0.2 -0.852 31.6 155.2-122.5 93.3 3.6 9.5 7.0 8 8 A K - 0 0 48 -2,-0.6 45,-4.8 24,-0.1 46,-1.0 -0.940 34.4-137.3-121.3 142.5 1.3 9.4 4.0 9 9 A V E -ab 34 54A 0 24,-1.3 26,-1.8 -2,-0.4 2,-0.6 -0.867 13.1-157.4-101.9 127.5 -0.9 6.6 2.7 10 10 A L E +ab 35 55A 0 44,-3.0 46,-3.3 -2,-0.5 2,-0.4 -0.921 19.1 166.2-108.4 117.3 -1.0 6.0 -1.0 11 11 A I E + b 0 56A 6 24,-1.5 2,-0.4 -2,-0.6 46,-0.2 -0.931 3.7 160.9-135.1 108.9 -4.1 4.2 -2.3 12 12 A V E + b 0 57A 4 44,-2.0 46,-0.7 -2,-0.4 2,-0.3 -0.997 6.1 171.0-132.4 130.1 -4.8 4.1 -6.0 13 13 A D - 0 0 12 -2,-0.4 6,-0.1 44,-0.2 -2,-0.0 -0.993 38.2-131.4-139.4 144.3 -7.0 1.6 -7.8 14 14 A D S S+ 0 0 60 -2,-0.3 2,-0.3 4,-0.0 -1,-0.1 0.914 98.0 58.2 -57.5 -45.6 -8.4 1.4 -11.3 15 15 A Q S > S- 0 0 100 1,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.668 75.3-145.9 -90.0 142.8 -11.8 0.9 -10.0 16 16 A V H > S+ 0 0 85 -2,-0.3 4,-3.5 2,-0.2 5,-0.3 0.898 101.9 55.6 -71.2 -42.4 -13.5 3.4 -7.7 17 17 A T H > S+ 0 0 78 2,-0.2 4,-2.0 3,-0.2 -1,-0.2 0.854 112.8 43.7 -57.6 -37.0 -15.3 0.7 -5.8 18 18 A S H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.968 119.1 39.6 -72.3 -56.9 -11.9 -0.9 -5.1 19 19 A R H X S+ 0 0 97 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.798 117.4 53.2 -62.5 -29.5 -10.0 2.2 -4.3 20 20 A L H X S+ 0 0 84 -4,-3.5 4,-2.4 -5,-0.2 -1,-0.2 0.907 108.3 48.8 -71.5 -43.8 -13.1 3.3 -2.4 21 21 A L H X S+ 0 0 61 -4,-2.0 4,-4.2 -5,-0.3 5,-0.3 0.968 116.0 42.0 -59.2 -56.7 -13.3 0.1 -0.4 22 22 A L H X S+ 0 0 0 -4,-2.6 4,-3.3 1,-0.3 5,-0.3 0.930 118.3 46.6 -55.6 -49.2 -9.6 0.3 0.6 23 23 A G H X S+ 0 0 7 -4,-2.4 4,-0.9 -5,-0.2 -1,-0.3 0.796 115.8 47.5 -63.3 -29.6 -9.9 4.0 1.2 24 24 A D H X S+ 0 0 87 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.927 113.5 45.4 -76.5 -48.6 -13.0 3.3 3.2 25 25 A A H < S+ 0 0 34 -4,-4.2 4,-0.4 1,-0.2 -2,-0.2 0.929 120.3 40.6 -59.6 -47.7 -11.6 0.5 5.2 26 26 A L H X>S+ 0 0 1 -4,-3.3 5,-2.1 -5,-0.3 4,-0.6 0.776 108.8 64.4 -70.9 -27.3 -8.5 2.5 5.9 27 27 A Q H ><5S+ 0 0 97 -4,-0.9 3,-1.4 -5,-0.3 -2,-0.2 0.928 101.1 47.6 -60.7 -47.9 -10.7 5.5 6.3 28 28 A Q T 3<5S+ 0 0 173 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.624 110.2 55.7 -68.3 -13.0 -12.3 4.0 9.4 29 29 A L T 345S- 0 0 58 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.2 0.558 106.4-131.5 -93.3 -12.6 -8.8 3.2 10.5 30 30 A G T <<5 - 0 0 48 -3,-1.4 -3,-0.2 -4,-0.6 -2,-0.1 0.792 34.8-176.9 65.3 29.2 -7.8 6.9 10.2 31 31 A F < - 0 0 17 -5,-2.1 -4,-0.1 1,-0.1 3,-0.0 0.722 38.7-101.7 -19.1-100.6 -4.7 5.8 8.3 32 32 A K S S- 0 0 103 -23,-0.1 2,-0.3 0, 0.0 -1,-0.1 0.177 83.1 -3.7-162.2 -56.5 -3.0 9.1 7.7 33 33 A Q - 0 0 84 2,-0.0 -24,-1.3 0, 0.0 2,-0.7 -0.911 55.0-141.5-158.8 127.0 -3.5 10.4 4.2 34 34 A I E +a 9 0A 74 -2,-0.3 2,-0.5 -26,-0.1 -24,-0.2 -0.822 26.3 175.4 -94.3 112.4 -5.3 8.9 1.2 35 35 A T E +a 10 0A 23 -26,-1.8 -24,-1.5 -2,-0.7 2,-0.4 -0.965 1.1 171.6-123.0 115.8 -3.4 9.7 -2.0 36 36 A A + 0 0 58 -2,-0.5 2,-0.3 -26,-0.2 -24,-0.2 -0.964 2.8 172.7-125.2 140.8 -4.5 8.3 -5.3 37 37 A A - 0 0 14 -2,-0.4 6,-0.9 2,-0.1 7,-0.2 -0.967 59.3 -62.0-150.3 129.7 -3.2 9.1 -8.8 38 38 A G S S- 0 0 44 -2,-0.3 2,-0.2 4,-0.3 -25,-0.1 -0.005 105.1 -41.4 34.1 -89.1 -4.0 7.5 -12.1 39 39 A D S >>S- 0 0 17 -2,-0.1 4,-5.5 -27,-0.1 5,-0.5 -0.784 83.1 -56.6-147.5-171.2 -2.7 4.1 -11.2 40 40 A G H >5S+ 0 0 1 -2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.846 137.9 44.2 -41.7 -43.5 0.2 2.4 -9.4 41 41 A E H >5S+ 0 0 94 2,-0.2 4,-2.2 3,-0.2 5,-0.3 0.969 118.8 40.2 -67.7 -56.1 2.5 4.2 -11.7 42 42 A Q H >5S+ 0 0 104 1,-0.2 4,-2.3 2,-0.2 -4,-0.3 0.894 120.6 45.7 -59.6 -42.5 0.7 7.6 -11.5 43 43 A G H X5S+ 0 0 0 -4,-5.5 4,-1.8 -6,-0.9 -1,-0.2 0.738 108.7 59.2 -72.3 -24.2 0.2 7.1 -7.8 44 44 A M H X< S+ 0 0 0 -4,-1.8 3,-0.9 2,-0.2 -2,-0.2 0.914 117.4 43.7 -77.4 -46.7 3.3 9.3 -3.9 48 48 A A H 3< S+ 0 0 26 -4,-3.3 -2,-0.2 1,-0.3 -3,-0.2 0.920 103.5 65.1 -64.1 -45.5 7.1 9.4 -4.2 49 49 A Q T 3< S+ 0 0 161 -4,-3.3 -1,-0.3 -5,-0.2 -2,-0.2 0.714 118.9 23.8 -49.8 -20.8 7.0 13.0 -5.2 50 50 A N S < S- 0 0 60 -3,-0.9 2,-0.1 -4,-0.2 -42,-0.1 -0.695 106.9 -62.9-133.5-175.0 5.7 13.4 -1.7 51 51 A P + 0 0 31 0, 0.0 2,-0.3 0, 0.0 -44,-0.2 -0.420 56.2 158.1 -74.9 149.7 5.8 11.7 1.7 52 52 A H + 0 0 9 -46,-0.5 -43,-0.2 26,-0.2 29,-0.1 -0.966 30.9 179.3-167.0 155.6 4.2 8.2 2.1 53 53 A H S S+ 0 0 48 -45,-4.8 30,-1.3 -2,-0.3 2,-0.3 0.139 74.7 54.3-147.2 14.3 4.3 5.2 4.3 54 54 A L E -bc 9 83A 0 -46,-1.0 -44,-3.0 28,-0.2 2,-0.4 -0.959 51.6-172.7-156.1 134.9 1.7 3.0 2.6 55 55 A V E +bc 10 84A 0 28,-3.3 30,-3.6 -2,-0.3 2,-0.4 -0.851 17.6 165.2-134.2 96.3 1.2 1.8 -1.0 56 56 A I E +bc 11 85A 2 -46,-3.3 -44,-2.0 -2,-0.4 2,-0.3 -0.939 6.2 160.8-115.9 134.8 -2.0 -0.0 -1.7 57 57 A S E -bc 12 86A 1 28,-2.1 30,-0.9 -2,-0.4 -44,-0.2 -0.896 30.6-115.8-143.6 170.8 -3.4 -0.8 -5.1 58 58 A D - 0 0 0 -46,-0.7 8,-0.2 -2,-0.3 -18,-0.1 -0.290 23.0-119.5 -98.9-173.8 -5.9 -3.0 -6.9 59 59 A F S S+ 0 0 108 -2,-0.1 -46,-0.1 2,-0.1 6,-0.0 0.120 80.5 106.3-114.3 17.0 -5.4 -5.7 -9.5 60 60 A N S S- 0 0 65 1,-0.1 -1,-0.1 -45,-0.1 -47,-0.0 0.986 105.9 -51.9 -57.3 -81.7 -7.5 -4.0 -12.2 61 61 A M S S+ 0 0 125 3,-0.0 2,-0.2 0, 0.0 -1,-0.1 -0.149 74.7 165.9-160.0 49.8 -4.8 -2.7 -14.6 62 62 A P - 0 0 26 0, 0.0 3,-0.4 0, 0.0 6,-0.1 -0.498 34.7-145.4 -75.0 140.3 -2.2 -0.7 -12.6 63 63 A K S S+ 0 0 156 1,-0.3 2,-0.3 -2,-0.2 -24,-0.0 0.692 98.9 34.5 -75.7 -19.8 1.0 0.1 -14.3 64 64 A M S S+ 0 0 43 4,-0.0 -1,-0.3 7,-0.0 5,-0.1 -0.706 80.0 178.6-139.0 84.0 2.7 -0.3 -10.9 65 65 A D > - 0 0 44 -3,-0.4 4,-3.0 -2,-0.3 5,-0.3 -0.146 55.1 -73.2 -76.0 176.5 1.1 -3.0 -8.8 66 66 A G H > S+ 0 0 0 1,-0.3 4,-2.3 2,-0.2 3,-0.1 0.863 140.4 41.8 -33.9 -60.4 2.4 -3.9 -5.3 67 67 A L H > S+ 0 0 77 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.909 112.4 56.0 -56.7 -44.9 5.4 -5.7 -6.8 68 68 A G H > S+ 0 0 15 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.885 108.0 47.8 -54.4 -43.0 5.7 -2.8 -9.2 69 69 A L H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.899 109.0 54.0 -65.2 -42.0 5.9 -0.4 -6.3 70 70 A L H X S+ 0 0 3 -4,-2.3 4,-1.9 -5,-0.3 -2,-0.2 0.913 107.2 50.9 -57.9 -45.1 8.5 -2.6 -4.6 71 71 A Q H < S+ 0 0 133 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.847 110.9 49.5 -60.9 -35.6 10.6 -2.5 -7.7 72 72 A A H >X S+ 0 0 15 -4,-1.6 3,-2.3 1,-0.2 4,-1.5 0.918 106.0 54.8 -69.2 -45.4 10.3 1.2 -7.7 73 73 A V H 3< S+ 0 0 5 -4,-2.9 7,-0.2 1,-0.3 -2,-0.2 0.852 98.1 64.6 -55.6 -36.3 11.3 1.4 -4.0 74 74 A R T 3< S+ 0 0 189 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.710 109.5 39.4 -59.9 -20.1 14.4 -0.5 -5.0 75 75 A A T <4 S+ 0 0 86 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.653 122.1 45.1-100.4 -23.7 15.3 2.5 -7.0 76 76 A N >< - 0 0 63 -4,-1.5 3,-0.9 1,-0.1 -1,-0.3 -0.963 58.6-169.0-128.0 113.5 14.1 5.0 -4.4 77 77 A P T 3 S+ 0 0 85 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.518 84.7 75.7 -75.1 -5.4 15.0 4.5 -0.8 78 78 A A T 3 S+ 0 0 49 1,-0.2 3,-0.3 2,-0.1 -26,-0.2 0.834 105.8 31.9 -73.0 -34.2 12.5 7.2 0.0 79 79 A T S X S+ 0 0 0 -3,-0.9 3,-1.4 -6,-0.2 -1,-0.2 0.270 94.2 94.2-104.1 7.3 9.6 4.7 -0.6 80 80 A K T 3 S+ 0 0 116 1,-0.3 -1,-0.2 -7,-0.2 -2,-0.1 0.595 87.2 50.9 -73.4 -11.0 11.7 1.8 0.6 81 81 A K T 3 S+ 0 0 86 -3,-0.3 2,-0.5 -4,-0.2 -1,-0.3 0.253 90.0 102.8-106.9 7.5 10.1 2.4 4.0 82 82 A A < - 0 0 0 -3,-1.4 2,-0.6 -28,-0.1 23,-0.4 -0.827 67.3-139.8 -97.1 127.4 6.6 2.5 2.5 83 83 A A E -c 54 0A 1 -30,-1.3 -28,-3.3 -2,-0.5 2,-0.3 -0.770 18.5-155.7 -89.5 121.8 4.5 -0.6 3.0 84 84 A F E -cd 55 107A 0 22,-1.9 24,-1.5 -2,-0.6 2,-0.4 -0.700 0.6-149.5 -98.4 149.9 2.5 -1.6 -0.1 85 85 A I E -cd 56 108A 2 -30,-3.6 -28,-2.1 -2,-0.3 2,-0.4 -0.962 10.5-174.1-121.7 136.6 -0.7 -3.6 -0.2 86 86 A I E -c 57 0A 27 22,-2.0 2,-0.5 -2,-0.4 5,-0.1 -0.950 8.0-160.1-134.2 112.0 -1.8 -5.9 -2.9 87 87 A L + 0 0 25 -30,-0.9 2,-0.3 -2,-0.4 -21,-0.1 -0.798 26.0 151.3 -94.6 129.0 -5.2 -7.6 -2.8 88 88 A T - 0 0 39 -2,-0.5 2,-1.0 -30,-0.1 3,-0.2 -0.969 60.1-101.9-151.6 162.4 -5.7 -10.6 -5.0 89 89 A A S S+ 0 0 101 -2,-0.3 -2,-0.0 1,-0.2 0, 0.0 -0.100 114.2 61.7 -78.7 38.6 -7.7 -13.9 -5.2 90 90 A Q + 0 0 120 -2,-1.0 -1,-0.2 2,-0.0 -3,-0.1 0.626 63.3 178.9-125.1 -59.2 -4.5 -15.6 -4.0 91 91 A G + 0 0 57 1,-0.2 2,-0.5 -3,-0.2 -4,-0.1 0.950 20.6 163.6 44.8 73.7 -3.5 -14.3 -0.5 92 92 A D >> - 0 0 87 1,-0.1 4,-1.9 0, 0.0 3,-1.0 -0.977 40.6-150.4-126.7 118.2 -0.5 -16.5 -0.1 93 93 A R H 3> S+ 0 0 196 -2,-0.5 4,-2.9 1,-0.3 5,-0.2 0.727 99.0 67.7 -55.1 -21.9 2.1 -15.7 2.6 94 94 A A H 3> S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.938 103.0 40.9 -63.8 -48.7 4.5 -17.4 0.2 95 95 A L H <> S+ 0 0 102 -3,-1.0 4,-2.9 2,-0.2 5,-0.4 0.852 113.8 55.4 -67.1 -35.6 4.1 -14.6 -2.4 96 96 A V H X S+ 0 0 39 -4,-1.9 4,-3.1 1,-0.2 -2,-0.2 0.928 113.8 39.2 -62.1 -47.1 4.2 -12.1 0.5 97 97 A Q H X S+ 0 0 129 -4,-2.9 4,-1.4 3,-0.2 -2,-0.2 0.801 113.0 58.8 -72.2 -30.4 7.5 -13.4 1.7 98 98 A K H X S+ 0 0 162 -4,-2.2 4,-1.0 -5,-0.2 -2,-0.2 0.967 119.7 26.3 -62.2 -55.3 8.6 -13.9 -1.9 99 99 A A H X>S+ 0 0 6 -4,-2.9 5,-2.2 2,-0.2 4,-1.5 0.930 120.5 55.9 -73.3 -48.3 8.2 -10.2 -2.7 100 100 A A H <5S+ 0 0 35 -4,-3.1 -1,-0.2 -5,-0.4 -3,-0.2 0.785 117.9 37.8 -53.9 -27.8 8.7 -9.0 0.8 101 101 A A H <5S+ 0 0 72 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.651 103.6 70.0 -95.4 -21.6 12.0 -10.9 0.6 102 102 A L H <5S- 0 0 103 -4,-1.0 -2,-0.2 -5,-0.1 -3,-0.2 0.727 135.9 -77.0 -66.9 -21.8 12.5 -9.9 -3.0 103 103 A G T <5S+ 0 0 39 -4,-1.5 -3,-0.2 1,-0.3 -2,-0.1 0.103 87.7 141.0 146.0 -19.7 13.1 -6.4 -1.6 104 104 A A < - 0 0 7 -5,-2.2 -1,-0.3 1,-0.1 3,-0.2 -0.122 48.7-141.1 -49.6 145.8 9.6 -5.2 -0.9 105 105 A N S S- 0 0 59 -23,-0.4 2,-0.2 1,-0.3 -22,-0.2 0.882 79.3 -19.8 -77.9 -41.7 9.4 -3.2 2.3 106 106 A N - 0 0 48 -24,-0.4 -22,-1.9 2,-0.0 2,-0.5 -0.810 57.1-164.8-171.2 126.5 6.0 -4.7 3.3 107 107 A V E +d 84 0A 5 -2,-0.2 2,-0.3 -24,-0.2 -22,-0.2 -0.959 19.1 168.4-122.4 112.9 3.3 -6.5 1.3 108 108 A L E -d 85 0A 28 -24,-1.5 -22,-2.0 -2,-0.5 2,-0.2 -0.880 29.2-121.8-122.7 154.6 -0.0 -7.0 3.0 109 109 A A - 0 0 41 -2,-0.3 -22,-0.2 -24,-0.2 11,-0.1 -0.605 15.0-131.9 -93.8 155.6 -3.4 -8.1 1.6 110 110 A K - 0 0 30 -2,-0.2 7,-0.1 10,-0.1 2,-0.1 -0.770 31.4-172.8-110.3 84.1 -6.6 -6.0 1.7 111 111 A P - 0 0 31 0, 0.0 6,-0.1 0, 0.0 9,-0.0 -0.353 32.8-125.4 -75.0 156.7 -9.2 -8.4 3.0 112 112 A F S S+ 0 0 178 -2,-0.1 2,-0.3 4,-0.1 -2,-0.0 0.637 89.3 88.7 -74.8 -15.2 -12.9 -7.4 3.1 113 113 A T S > S- 0 0 70 1,-0.1 4,-2.9 4,-0.0 5,-0.2 -0.644 73.3-144.2 -87.3 141.8 -12.9 -8.3 6.8 114 114 A I H > S+ 0 0 129 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.775 101.4 60.2 -72.4 -27.3 -12.0 -5.7 9.4 115 115 A E H > S+ 0 0 156 2,-0.2 4,-1.2 3,-0.2 -1,-0.2 0.930 115.1 31.8 -65.0 -47.8 -10.3 -8.4 11.4 116 116 A K H > S+ 0 0 131 2,-0.2 4,-3.2 3,-0.2 -2,-0.2 0.902 123.9 47.4 -75.8 -44.0 -7.8 -9.2 8.6 117 117 A M H X S+ 0 0 9 -4,-2.9 4,-2.6 1,-0.2 5,-0.2 0.893 114.1 46.9 -63.4 -42.1 -7.7 -5.7 7.3 118 118 A K H X S+ 0 0 116 -4,-3.1 4,-2.5 2,-0.2 -1,-0.2 0.822 113.9 49.7 -68.7 -32.0 -7.2 -4.3 10.8 119 119 A A H X S+ 0 0 53 -4,-1.2 4,-1.5 -5,-0.2 -2,-0.2 0.923 110.6 48.5 -71.5 -46.4 -4.6 -6.9 11.4 120 120 A A H >X S+ 0 0 12 -4,-3.2 4,-3.1 2,-0.2 3,-0.5 0.949 117.7 40.9 -57.7 -52.3 -2.8 -6.1 8.1 121 121 A I H 3X S+ 0 0 8 -4,-2.6 4,-3.0 1,-0.3 5,-0.3 0.916 110.8 57.5 -61.9 -45.0 -2.8 -2.4 8.9 122 122 A E H 3X S+ 0 0 117 -4,-2.5 4,-1.9 1,-0.2 5,-0.3 0.771 113.8 41.2 -56.4 -26.6 -2.0 -3.1 12.5 123 123 A A H