==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 07-DEC-06 2O6A . COMPND 2 MOLECULE: IRON-UTILIZATION PERIPLASMIC PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR S.R.SHOULDICE,L.W.TARI . 307 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13187.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 13 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 33.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 1 0 0 1 1 1 2 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 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 PARALLEL BRIDGES PER LADDER . 1 1 0 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 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 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 D 0 0 124 0, 0.0 2,-0.3 0, 0.0 27,-0.2 0.000 360.0 360.0 360.0 149.2 57.5 15.3 10.9 2 2 A I E -a 28 0A 0 25,-2.4 27,-2.3 239,-0.1 2,-0.5 -0.873 360.0-135.7-127.5 155.6 54.4 17.3 10.2 3 3 A T E -a 29 0A 41 -2,-0.3 49,-2.5 47,-0.3 50,-1.6 -0.943 20.8-164.5-108.4 128.8 51.7 19.2 12.1 4 4 A V E -ab 30 53A 1 25,-3.0 27,-2.5 -2,-0.5 2,-0.6 -0.959 15.1-144.9-119.6 115.6 48.1 18.7 11.0 5 5 A Y E -ab 31 54A 7 48,-2.5 50,-2.7 -2,-0.5 2,-0.6 -0.715 29.5-152.3 -74.5 120.2 45.3 21.0 12.1 6 6 A N E +ab 32 55A 1 25,-2.7 27,-2.2 -2,-0.6 50,-0.2 -0.875 37.8 160.3-113.0 108.3 42.4 18.5 12.4 7 7 A G + 0 0 13 48,-3.2 28,-0.5 -2,-0.6 49,-0.2 0.458 59.2 89.8 -92.5 -6.1 38.8 19.3 11.9 8 8 A Q S S- 0 0 11 47,-0.8 25,-0.2 1,-0.2 49,-0.1 -0.419 96.6 -70.4 -89.3 167.2 37.7 15.7 11.3 9 9 A H >> - 0 0 108 1,-0.1 4,-2.4 -2,-0.1 3,-0.6 -0.283 46.6-123.1 -53.6 136.6 36.6 13.0 13.7 10 10 A K H 3> S+ 0 0 57 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.753 110.7 55.5 -62.6 -26.1 39.7 12.0 15.8 11 11 A E H 3> S+ 0 0 45 2,-0.2 4,-1.6 3,-0.2 -1,-0.3 0.856 109.2 46.9 -72.5 -36.4 39.3 8.3 14.7 12 12 A A H <> S+ 0 0 0 -3,-0.6 4,-2.1 2,-0.2 5,-0.3 0.976 117.9 42.5 -62.5 -55.2 39.4 9.3 11.1 13 13 A A H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.909 114.9 48.4 -58.9 -48.9 42.5 11.5 11.7 14 14 A T H X S+ 0 0 79 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.882 111.2 52.4 -61.8 -36.4 44.3 9.1 14.0 15 15 A A H X S+ 0 0 28 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.937 113.8 39.3 -66.7 -50.6 43.7 6.2 11.5 16 16 A V H X S+ 0 0 2 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.843 114.6 56.3 -67.3 -34.0 45.1 8.0 8.4 17 17 A A H X S+ 0 0 8 -4,-2.2 4,-1.7 -5,-0.3 -2,-0.2 0.878 110.1 44.0 -66.3 -39.4 47.9 9.5 10.5 18 18 A K H X S+ 0 0 52 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.867 112.9 50.9 -73.7 -38.4 49.0 6.0 11.8 19 19 A A H X S+ 0 0 22 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.801 110.2 51.5 -67.7 -28.5 48.8 4.5 8.3 20 20 A F H X>S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 5,-0.6 0.921 105.9 53.7 -72.3 -45.3 50.9 7.4 7.0 21 21 A E H X5S+ 0 0 77 -4,-1.7 4,-0.9 1,-0.2 -2,-0.2 0.775 110.9 47.9 -58.4 -29.4 53.6 6.9 9.6 22 22 A Q H <5S+ 0 0 142 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.844 113.5 44.5 -81.7 -37.2 53.8 3.2 8.5 23 23 A E H <5S+ 0 0 125 -4,-1.5 -2,-0.2 -5,-0.1 -3,-0.1 0.829 133.7 14.6 -75.4 -33.4 54.1 3.8 4.8 24 24 A T H <5S- 0 0 46 -4,-2.1 -3,-0.2 2,-0.2 -2,-0.2 0.656 90.3-123.7-118.2 -28.3 56.6 6.6 4.9 25 25 A G << + 0 0 62 -4,-0.9 2,-0.4 -5,-0.6 -4,-0.2 0.404 65.0 135.5 89.2 1.9 58.1 6.8 8.4 26 26 A I - 0 0 12 -6,-0.5 -1,-0.3 215,-0.1 -2,-0.2 -0.713 52.3-127.8 -91.9 128.5 57.0 10.4 8.9 27 27 A K - 0 0 35 -2,-0.4 -25,-2.4 -3,-0.1 2,-0.4 -0.410 17.8-154.8 -75.8 146.7 55.5 11.4 12.2 28 28 A V E -a 2 0A 16 -27,-0.2 2,-0.5 -2,-0.1 -25,-0.2 -0.988 5.9-166.6-123.9 127.1 52.2 13.2 12.4 29 29 A T E -a 3 0A 85 -27,-2.3 -25,-3.0 -2,-0.4 2,-0.3 -0.975 15.7-147.6-109.2 126.6 51.1 15.5 15.3 30 30 A L E -a 4 0A 55 -2,-0.5 2,-0.4 -27,-0.2 -25,-0.2 -0.703 14.0-168.6 -92.4 140.8 47.4 16.5 15.3 31 31 A N E -a 5 0A 61 -27,-2.5 -25,-2.7 -2,-0.3 2,-0.2 -0.920 27.0-160.0-120.7 103.1 46.0 19.8 16.6 32 32 A S E +a 6 0A 68 -2,-0.4 2,-0.3 -27,-0.2 -25,-0.2 -0.509 27.9 118.0 -94.1 154.0 42.3 19.1 16.8 33 33 A G - 0 0 35 -27,-2.2 2,-0.2 -2,-0.2 -2,-0.0 -0.968 65.7 -46.9 175.1-179.9 39.4 21.5 16.8 34 34 A K > - 0 0 169 -2,-0.3 4,-2.4 1,-0.1 3,-0.5 -0.554 52.2-125.4 -72.6 137.0 36.2 22.6 15.0 35 35 A S H > S+ 0 0 15 -28,-0.5 4,-2.1 1,-0.3 5,-0.2 0.876 109.7 50.4 -52.0 -46.8 36.9 23.1 11.4 36 36 A E H > S+ 0 0 130 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.864 111.6 48.1 -61.5 -39.5 35.6 26.7 11.4 37 37 A Q H > S+ 0 0 64 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.904 111.5 49.5 -67.3 -41.8 37.7 27.6 14.5 38 38 A L H X S+ 0 0 5 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.871 107.9 54.0 -66.7 -38.1 40.9 26.1 13.0 39 39 A A H X S+ 0 0 15 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.920 109.3 48.9 -61.5 -43.2 40.3 28.0 9.7 40 40 A G H X S+ 0 0 41 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.914 111.4 49.6 -60.0 -43.3 40.1 31.2 11.6 41 41 A Q H X S+ 0 0 68 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.873 108.6 52.1 -66.7 -39.4 43.3 30.4 13.5 42 42 A L H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.862 110.8 48.5 -63.3 -36.8 45.1 29.6 10.3 43 43 A K H < S+ 0 0 44 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.904 113.8 45.3 -72.0 -41.4 44.1 33.0 8.8 44 44 A E H < S+ 0 0 172 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.915 114.8 48.5 -63.9 -44.4 45.2 34.9 12.0 45 45 A E H >< S+ 0 0 51 -4,-2.6 3,-2.0 -5,-0.2 -2,-0.2 0.848 84.8 158.9 -67.9 -36.5 48.5 32.9 12.1 46 46 A G G >< + 0 0 14 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 -0.189 67.8 2.0 54.9-129.6 49.1 33.6 8.4 47 47 A D G 3 S+ 0 0 151 1,-0.3 -1,-0.3 -4,-0.1 -2,-0.1 0.525 134.1 55.9 -70.3 -6.6 52.8 33.2 7.4 48 48 A K G < S+ 0 0 77 -3,-2.0 -1,-0.3 188,-0.0 -2,-0.2 0.149 75.9 131.5-109.7 16.5 53.8 32.2 10.9 49 49 A T < - 0 0 13 -3,-1.6 -7,-0.1 -7,-0.2 -8,-0.0 -0.439 51.7-149.3 -67.7 139.1 51.4 29.2 11.3 50 50 A P + 0 0 75 0, 0.0 -47,-0.3 0, 0.0 2,-0.2 0.504 65.8 112.1 -80.2 -6.3 53.0 26.0 12.6 51 51 A A + 0 0 0 1,-0.2 -47,-0.2 -49,-0.1 3,-0.1 -0.481 39.8 177.4 -70.0 134.4 50.4 24.0 10.5 52 52 A D S S+ 0 0 16 -49,-2.5 181,-2.0 1,-0.3 2,-0.3 0.739 72.9 19.2 -96.0 -38.7 51.6 22.0 7.6 53 53 A V E -bC 4 232A 0 -50,-1.6 -48,-2.5 179,-0.2 2,-0.6 -0.987 60.2-148.7-136.3 143.3 48.2 20.5 6.6 54 54 A F E -bC 5 231A 0 177,-2.7 177,-1.6 -2,-0.3 2,-0.7 -0.972 14.0-171.8-112.7 114.4 44.6 21.4 7.3 55 55 A Y E -bC 6 230A 4 -50,-2.7 -48,-3.2 -2,-0.6 -47,-0.8 -0.937 19.5-174.0-110.7 102.8 42.5 18.2 7.3 56 56 A T E - C 0 229A 0 173,-1.8 173,-2.4 -2,-0.7 3,-0.1 -0.785 37.0-144.0-115.3 146.5 38.9 19.5 7.5 57 57 A A S S+ 0 0 24 -2,-0.3 2,-0.4 171,-0.2 -1,-0.1 0.643 95.9 43.7 -78.0 -15.8 35.4 17.9 7.9 58 58 A Q > - 0 0 31 171,-0.1 3,-2.0 1,-0.1 4,-0.3 -0.942 66.1-154.4-137.9 114.3 34.0 20.4 5.5 59 59 A T T >> S+ 0 0 13 168,-2.2 3,-1.6 -2,-0.4 4,-0.6 0.704 89.2 79.2 -59.7 -19.4 35.5 21.6 2.2 60 60 A A H >> S+ 0 0 13 167,-0.3 3,-0.6 1,-0.3 4,-0.6 0.787 81.7 64.5 -59.0 -27.7 33.6 24.9 2.6 61 61 A T H <> S+ 0 0 21 -3,-2.0 4,-0.9 1,-0.2 -1,-0.3 0.702 93.5 63.8 -70.4 -18.1 36.2 26.1 5.1 62 62 A F H <> S+ 0 0 0 -3,-1.6 4,-3.0 -4,-0.3 5,-0.2 0.817 86.1 71.0 -72.7 -33.2 38.8 26.0 2.3 63 63 A A H S+ 0 0 1 -4,-0.9 5,-2.3 2,-0.2 6,-0.4 0.880 111.9 49.3 -63.3 -38.2 41.6 30.2 3.1 66 66 A S H ><5S+ 0 0 10 -4,-3.0 3,-1.6 1,-0.2 5,-0.2 0.927 111.0 48.2 -66.8 -47.0 42.1 29.8 -0.7 67 67 A E H 3<5S+ 0 0 151 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.763 107.2 58.0 -66.3 -25.4 40.9 33.4 -1.4 68 68 A A T 3<5S- 0 0 59 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.412 115.3-117.6 -82.4 0.8 43.1 34.7 1.3 69 69 A G T < 5S+ 0 0 34 -3,-1.6 -3,-0.2 -5,-0.1 -2,-0.1 0.735 78.8 123.9 73.0 25.0 46.2 33.2 -0.5 70 70 A L < + 0 0 32 -5,-2.3 164,-2.3 -6,-0.1 165,-0.5 0.449 48.9 80.5-100.4 -4.0 47.0 30.8 2.4 71 71 A L B -F 233 0B 11 -6,-0.4 162,-0.2 162,-0.3 24,-0.1 -0.865 68.4-135.3-111.2 140.5 46.9 27.4 0.6 72 72 A A - 0 0 3 160,-2.8 160,-0.5 -2,-0.4 162,-0.1 -0.557 33.5 -98.0 -84.2 152.4 49.5 25.8 -1.6 73 73 A P - 0 0 91 0, 0.0 2,-0.3 0, 0.0 21,-0.3 -0.375 36.9-142.0 -64.0 148.3 48.8 24.1 -4.9 74 74 A I - 0 0 11 19,-2.8 21,-0.1 21,-0.1 169,-0.0 -0.818 32.2 -83.3-109.0 154.2 48.4 20.4 -4.9 75 75 A S > - 0 0 54 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.290 29.6-135.9 -54.6 135.2 49.6 17.9 -7.6 76 76 A E H > S+ 0 0 110 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.879 106.8 55.5 -62.7 -36.4 47.1 17.6 -10.4 77 77 A Q H > S+ 0 0 146 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.889 108.1 49.5 -61.9 -39.0 47.7 13.8 -10.4 78 78 A T H >4 S+ 0 0 11 2,-0.2 3,-1.0 1,-0.2 4,-0.5 0.932 110.3 48.5 -66.0 -46.9 46.6 13.8 -6.7 79 79 A I H >< S+ 0 0 12 -4,-2.2 3,-1.3 1,-0.2 4,-0.4 0.894 105.0 60.5 -59.5 -40.1 43.5 15.9 -7.3 80 80 A Q H >< S+ 0 0 54 -4,-2.2 3,-0.8 1,-0.2 -1,-0.2 0.743 89.4 72.8 -61.7 -24.6 42.5 13.6 -10.2 81 81 A Q T << S+ 0 0 67 -3,-1.0 188,-0.4 -4,-0.7 -1,-0.2 0.800 111.5 25.3 -62.4 -32.7 42.4 10.5 -7.8 82 82 A T T < S+ 0 0 3 -3,-1.3 2,-1.8 -4,-0.5 -1,-0.2 0.254 87.9 116.8-113.9 12.4 39.2 11.7 -6.1 83 83 A A < + 0 0 45 -3,-0.8 -1,-0.1 -4,-0.4 3,-0.1 -0.289 36.3 156.8 -88.8 56.1 37.7 13.8 -9.0 84 84 A Q > - 0 0 48 -2,-1.8 3,-2.1 183,-0.3 2,-0.1 -0.380 59.4 -79.7 -68.4 153.9 34.5 11.8 -9.6 85 85 A K T 3 S+ 0 0 98 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 -0.406 122.5 26.1 -55.5 130.1 31.7 13.7 -11.3 86 86 A G T 3 S+ 0 0 32 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.1 0.062 89.0 124.7 101.3 -21.6 29.9 15.7 -8.6 87 87 A V < - 0 0 10 -3,-2.1 -1,-0.3 1,-0.1 2,-0.1 -0.543 69.4-109.7 -75.0 129.5 33.0 16.0 -6.3 88 88 A P - 0 0 37 0, 0.0 9,-0.5 0, 0.0 2,-0.4 -0.382 35.1-157.5 -58.7 134.7 33.8 19.6 -5.4 89 89 A L - 0 0 104 7,-0.1 7,-0.1 -2,-0.1 3,-0.0 -0.955 20.0-117.2-117.6 136.7 37.0 20.9 -7.1 90 90 A A > - 0 0 9 5,-0.6 3,-1.6 -2,-0.4 5,-0.1 -0.556 18.2-145.0 -66.1 120.5 39.2 23.7 -6.0 91 91 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.851 103.5 41.0 -54.2 -34.7 39.2 26.3 -8.8 92 92 A K T 3 S- 0 0 120 -3,-0.0 -2,-0.1 -19,-0.0 0, 0.0 0.232 112.1-119.3-100.6 12.7 42.9 27.1 -7.9 93 93 A K S < S+ 0 0 95 -3,-1.6 -19,-2.8 -20,-0.1 -14,-0.1 0.859 77.7 124.6 55.2 43.0 43.9 23.4 -7.4 94 94 A D + 0 0 6 -21,-0.3 2,-0.3 1,-0.1 138,-0.2 0.066 64.8 29.6-127.0 19.8 44.8 24.2 -3.8 95 95 A W - 0 0 23 136,-0.1 -5,-0.6 -5,-0.1 2,-0.4 -0.947 66.4-142.5-163.0 165.8 42.7 21.7 -1.8 96 96 A I E -D 230 0A 3 134,-2.4 134,-2.1 -2,-0.3 2,-0.3 -0.998 11.8-132.9-138.2 136.7 41.2 18.3 -2.4 97 97 A A E +D 229 0A 2 -9,-0.5 132,-0.3 -2,-0.4 3,-0.1 -0.696 27.7 171.8 -81.2 137.7 38.0 16.5 -1.4 98 98 A L E + 0 0 7 130,-2.8 169,-1.3 1,-0.4 2,-0.3 0.681 54.2 4.0-120.9 -35.8 38.7 13.1 0.1 99 99 A S E -DE 228 266A 1 129,-1.3 129,-2.4 167,-0.2 -1,-0.4 -0.976 58.1-139.5-154.1 164.9 35.5 11.6 1.5 100 100 A G E -DE 227 265A 0 165,-1.8 165,-2.8 -2,-0.3 2,-0.4 -0.938 2.8-156.1-132.7 151.7 31.7 12.2 1.8 101 101 A R E -D 226 0A 34 125,-2.2 125,-2.5 -2,-0.3 2,-0.4 -0.987 24.3-145.3-121.7 138.6 28.9 11.8 4.3 102 102 A S E -D 225 0A 1 -2,-0.4 92,-2.6 123,-0.2 123,-0.2 -0.830 11.9-128.0-112.9 140.8 25.3 11.5 3.1 103 103 A R E +G 193 0C 12 121,-2.5 2,-0.3 -2,-0.4 90,-0.2 -0.511 42.4 171.9 -64.0 147.6 21.8 12.6 4.2 104 104 A V E -G 192 0C 6 88,-2.3 88,-2.0 -2,-0.2 2,-0.5 -0.978 36.9-120.7-154.2 161.7 19.5 9.7 4.3 105 105 A V E -GH 191 214C 6 109,-2.2 109,-3.1 -2,-0.3 2,-0.4 -0.970 26.5-160.3-104.4 120.2 16.0 8.5 5.3 106 106 A V E -GH 190 213C 0 84,-2.5 84,-2.1 -2,-0.5 2,-0.3 -0.828 16.4-179.7 -94.4 138.3 16.1 5.7 7.8 107 107 A Y E -GH 189 212C 23 105,-2.6 105,-2.3 -2,-0.4 2,-0.9 -0.996 36.9-112.5-142.7 150.3 12.9 3.7 8.1 108 108 A D E >> - 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0 0 1 -2,-0.3 3,-1.6 55,-0.3 6,-0.2 -0.830 15.0-178.2-131.0 89.2 17.1 16.7 14.4 137 137 A S T 3 S+ 0 0 33 -2,-0.5 -1,-0.1 1,-0.3 36,-0.1 0.687 80.8 55.7 -68.9 -18.7 17.0 20.4 14.2 138 138 A T T 3 S+ 0 0 112 34,-0.4 -1,-0.3 35,-0.1 2,-0.2 0.480 83.7 110.0 -89.3 -4.2 20.2 21.0 16.2 139 139 A S <> - 0 0 18 -3,-1.6 4,-1.8 1,-0.1 5,-0.1 -0.454 69.8-134.7 -79.1 143.1 22.4 18.8 14.0 140 140 A G H > S+ 0 0 55 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.886 107.7 52.1 -60.6 -41.8 25.0 20.4 11.8 141 141 A A H > S+ 0 0 17 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.827 106.0 55.3 -65.5 -32.0 24.0 18.3 8.8 142 142 A F H > S+ 0 0 2 -6,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.915 107.4 49.3 -63.9 -43.0 20.4 19.4 9.3 143 143 A L H X S+ 0 0 26 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.925 109.8 51.5 -62.9 -41.6 21.6 23.0 9.1 144 144 A E H X S+ 0 0 43 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.889 106.9 54.2 -61.4 -39.2 23.5 22.1 5.9 145 145 A Q H X S+ 0 0 2 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.890 108.1 49.1 -61.6 -40.5 20.3 20.6 4.5 146 146 A V H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.923 110.1 51.1 -65.7 -43.3 18.4 23.9 5.1 147 147 A V H X S+ 0 0 6 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.912 110.1 49.9 -60.3 -43.7 21.2 25.8 3.4 148 148 A A H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.878 109.9 50.3 -62.3 -41.1 21.0 23.5 0.4 149 149 A L H X>S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.9 0.903 110.4 49.9 -63.3 -42.8 17.2 23.9 0.2 150 150 A S H X5S+ 0 0 25 -4,-2.4 4,-0.9 3,-0.2 -2,-0.2 0.931 116.1 42.4 -61.9 -44.3 17.5 27.7 0.3 151 151 A K H <5S+ 0 0 72 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.881 123.8 35.1 -68.6 -40.6 20.1 27.7 -2.5 152 152 A M H <5S+ 0 0 67 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.839 136.5 15.1 -87.2 -37.1 18.4 25.1 -4.7 153 153 A K H <5S- 0 0 110 -4,-2.6 4,-0.3 -5,-0.3 -3,-0.2 0.494 109.0-107.1-119.3 -10.4 14.7 25.8 -4.2 154 154 A G X< - 0 0 29 -4,-0.9 4,-1.9 -5,-0.9 -1,-0.2 -0.099 34.8 -73.3 98.4 164.4 14.7 29.3 -2.6 155 155 A D H > S+ 0 0 76 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.815 123.2 55.5 -67.1 -37.8 14.0 30.7 0.8 156 156 A K H > S+ 0 0 81 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.895 109.5 48.2 -65.9 -38.5 10.2 30.3 0.8 157 157 A V H > S+ 0 0 50 -4,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.908 111.4 50.5 -65.8 -43.8 10.5 26.5 0.1 158 158 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.948 112.9 45.4 -60.3 -48.5 13.2 26.1 2.8 159 159 A L H X S+ 0 0 32 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.888 111.3 53.1 -60.7 -41.8 11.0 27.9 5.4 160 160 A N H X S+ 0 0 115 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.861 108.2 51.3 -60.9 -38.4 7.9 25.9 4.3 161 161 A W H X S+ 0 0 3 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.925 111.6 46.3 -64.8 -46.1 9.9 22.7 4.8 162 162 A L H X S+ 0 0 11 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.908 113.2 48.8 -64.0 -42.7 10.9 23.7 8.3 163 163 A K H X S+ 0 0 104 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.879 109.5 54.3 -64.0 -37.9 7.3 24.8 9.2 164 164 A G H X S+ 0 0 8 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.869 108.6 47.4 -62.2 -39.5 6.2 21.4 7.8 165 165 A L H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.879 109.2 54.1 -71.8 -37.9 8.5 19.6 10.1 166 166 A K H < S+ 0 0 125 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.944 116.8 38.6 -54.7 -48.0 7.4 21.7 13.1 167 167 A E H < S+ 0 0 144 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.869 134.3 18.9 -71.0 -39.2 3.8 20.7 12.3 168 168 A N H < S+ 0 0 5 -4,-2.4 -37,-0.6 -5,-0.2 -35,-0.5 0.644 103.8 85.5-114.6 -21.7 4.3 17.0 11.3 169 169 A G E < -i 133 0C 18 -4,-2.4 2,-0.5 -5,-0.3 -35,-0.2 -0.384 65.8-128.2 -89.1 163.6 7.7 15.8 12.6 170 170 A K E -i 134 0C 84 -37,-2.4 -35,-1.9 -2,-0.1 2,-0.4 -0.961 30.2-135.8-105.5 120.8 8.9 14.3 15.9 171 171 A L E -i 135 0C 101 -2,-0.5 2,-0.3 -37,-0.2 -35,-0.2 -0.643 21.7-172.7 -83.0 130.6 11.9 16.2 17.2 172 172 A Y - 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