==== 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 MEMBRANE PROTEIN 17-JAN-01 1HXU . COMPND 2 MOLECULE: OUTER MEMBRANE PROTEIN F; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR P.S.PHALE,A.PHILIPPSEN,C.WIDMER,V.P.PHALE,J.P.ROSENBUSCH,T.S . 340 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17195.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 257 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 187 55.0 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 . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.8 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 . 24 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 1 0 2 0 0 3 3 1 4 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 A 0 0 47 0, 0.0 12,-2.5 0, 0.0 2,-1.1 0.000 360.0 360.0 360.0 140.9 -2.1 60.8 17.9 2 2 A E E +A 12 0A 100 10,-0.3 10,-0.2 1,-0.2 3,-0.1 -0.842 360.0 165.7 -81.3 98.6 1.0 61.5 15.8 3 3 A I E + 0 0 109 -2,-1.1 2,-0.3 8,-0.6 9,-0.2 0.297 59.1 41.7 -98.4 1.6 1.0 65.3 15.7 4 4 A Y E +A 11 0A 96 7,-1.3 7,-2.5 -3,-0.1 -1,-0.2 -0.934 45.9 156.8-154.1 129.5 4.6 65.7 14.4 5 5 A N E +A 10 0A 89 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.497 28.2 137.6-148.6 77.3 6.8 64.1 11.9 6 6 A K E > -A 9 0A 120 3,-1.2 3,-1.4 1,-0.1 -2,-0.0 -0.962 64.8 -14.8-135.1 131.3 9.7 66.2 10.6 7 7 A D T 3 S- 0 0 162 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.933 128.9 -38.3 59.3 46.7 13.4 65.8 9.8 8 8 A G T 3 S+ 0 0 28 1,-0.2 42,-1.6 -3,-0.1 2,-0.3 -0.050 118.0 102.7 94.7 -32.3 13.9 62.5 11.6 9 9 A N E < -AB 6 49A 58 -3,-1.4 -3,-1.2 40,-0.2 2,-0.4 -0.706 43.6-176.3 -94.7 133.9 11.7 63.2 14.6 10 10 A K E -AB 5 48A 92 38,-2.1 38,-1.9 -2,-0.3 2,-0.4 -1.000 8.8-166.7-122.7 126.1 8.2 61.8 15.1 11 11 A V E -AB 4 47A 40 -7,-2.5 -7,-1.3 -2,-0.4 -8,-0.6 -0.947 3.6-160.7-112.0 140.1 6.2 63.0 18.3 12 12 A D E -AB 2 46A 46 34,-1.6 34,-2.1 -2,-0.4 2,-0.5 -0.995 0.9-165.0-121.3 122.7 3.0 61.3 19.5 13 13 A L E + B 0 45A 61 -12,-2.5 2,-0.3 -2,-0.5 32,-0.2 -0.929 21.7 171.3-109.6 118.1 0.7 63.3 21.8 14 14 A Y E + B 0 44A 38 30,-2.5 30,-2.9 -2,-0.5 2,-0.3 -0.907 8.3 140.1-131.2 158.7 -1.8 60.9 23.5 15 15 A G E - B 0 43A 5 325,-1.5 325,-2.2 -2,-0.3 2,-0.3 -0.967 25.1-140.4-179.5 168.1 -4.4 61.0 26.2 16 16 A K E -CB 339 42A 64 26,-1.1 26,-1.8 -2,-0.3 2,-0.4 -0.973 7.7-149.9-144.6 160.4 -7.9 59.9 27.4 17 17 A A E -CB 338 41A 58 321,-2.8 321,-2.8 -2,-0.3 2,-0.5 -0.988 24.1-173.7-131.8 109.9 -11.0 61.2 29.2 18 18 A K E -CB 337 40A 18 22,-2.3 22,-1.4 -2,-0.4 2,-0.5 -0.934 16.0-158.5-117.0 107.1 -12.7 58.3 31.1 19 19 A G E +C 336 0A 33 317,-2.1 317,-2.4 -2,-0.5 2,-0.3 -0.726 31.5 169.4 -79.8 123.7 -16.1 58.8 32.8 20 20 A L E +C 335 0A 5 -2,-0.5 18,-3.0 315,-0.2 19,-0.5 -0.998 19.3 178.0-148.2 146.5 -16.2 56.0 35.4 21 21 A H E -CD 334 37A 76 313,-1.7 313,-2.0 -2,-0.3 2,-0.4 -0.997 15.7-146.9-150.2 135.4 -18.3 55.0 38.3 22 22 A Y E -CD 333 36A 32 14,-2.6 14,-2.3 -2,-0.3 2,-0.6 -0.954 4.7-155.9-113.6 135.6 -18.2 52.0 40.7 23 23 A F E +C 332 0A 106 309,-2.9 309,-1.5 -2,-0.4 2,-0.3 -0.906 29.8 147.8-109.7 105.8 -21.3 50.3 42.2 24 24 A S - 0 0 19 -2,-0.6 2,-0.2 307,-0.2 307,-0.1 -0.777 42.5-111.0-117.4 174.7 -20.6 48.4 45.5 25 25 A K S > S+ 0 0 166 305,-0.4 3,-1.3 -2,-0.3 5,-0.3 -0.601 75.8 13.0-103.6 170.6 -22.9 48.0 48.4 26 26 A G T 3 S- 0 0 69 -2,-0.2 -2,-0.1 1,-0.2 0, 0.0 -0.409 126.7 -31.5 68.5-134.2 -22.7 49.4 51.8 27 27 A N T 3 S- 0 0 134 -2,-0.1 2,-0.9 1,-0.0 -1,-0.2 0.028 84.3-111.2 -96.8 10.8 -20.1 52.1 52.4 28 28 A G S X S+ 0 0 6 -3,-1.3 3,-1.4 6,-0.2 6,-0.5 -0.029 97.3 101.6 82.3 -37.0 -17.8 50.7 49.7 29 29 A E T 3 S+ 0 0 158 -2,-0.9 298,-0.2 1,-0.3 -1,-0.1 0.665 80.7 43.5 -51.6 -35.2 -15.3 49.6 52.5 30 30 A N T 3 S+ 0 0 71 -5,-0.3 299,-3.6 297,-0.1 298,-0.7 0.244 103.3 91.7 -98.7 22.8 -16.1 45.9 52.6 31 31 A S B < S-s 329 0B 11 -3,-1.4 296,-0.3 297,-0.3 299,-0.2 -0.500 83.2-114.5-112.7 154.0 -16.3 45.7 48.8 32 32 A Y S S+ 0 0 62 297,-1.8 299,-0.1 298,-0.4 298,-0.1 0.964 105.5 13.6 -64.0 -61.8 -13.7 44.8 46.2 33 33 A G S S- 0 0 21 1,-0.3 -1,-0.1 297,-0.2 2,-0.1 0.454 101.0-119.5-100.7 -7.0 -13.3 48.0 44.3 34 34 A G - 0 0 18 -6,-0.5 -1,-0.3 -9,-0.1 2,-0.3 -0.460 33.8 -85.2 95.3-169.7 -15.0 50.7 46.5 35 35 A N + 0 0 78 -8,-0.2 2,-0.3 -2,-0.1 -12,-0.2 -0.913 67.6 22.3-151.7 129.4 -18.0 52.9 45.4 36 36 A G E S-D 22 0A 17 -14,-2.3 -14,-2.6 -2,-0.3 2,-0.2 -0.897 91.3 -1.1 128.4-162.7 -18.8 56.1 43.6 37 37 A D E +D 21 0A 80 -2,-0.3 -16,-0.3 -16,-0.2 -2,-0.1 -0.427 48.4 165.1 -70.1 134.2 -17.3 58.4 41.0 38 38 A M + 0 0 52 -18,-3.0 -17,-0.2 -2,-0.2 30,-0.1 0.043 18.5 154.9-140.0 26.0 -13.8 57.4 39.8 39 39 A T + 0 0 37 -19,-0.5 28,-3.3 28,-0.2 29,-0.4 -0.284 11.5 163.5 -57.9 143.3 -13.3 59.6 36.6 40 40 A Y E -BE 18 66A 28 -22,-1.4 -22,-2.3 26,-0.3 2,-0.3 -0.964 25.3-144.3-151.7 167.5 -9.9 60.5 35.4 41 41 A A E -BE 17 65A 33 24,-2.4 24,-2.1 -2,-0.3 2,-0.3 -0.847 12.8-155.3-127.5 166.6 -8.0 61.8 32.4 42 42 A R E -BE 16 64A 48 -26,-1.8 -26,-1.1 -2,-0.3 2,-0.3 -0.932 10.0-179.6-137.3 154.9 -4.5 60.9 31.1 43 43 A L E +BE 15 63A 63 20,-1.8 20,-2.9 -2,-0.3 2,-0.3 -0.915 13.8 148.9-156.8 130.5 -2.0 62.8 29.0 44 44 A G E -BE 14 62A 0 -30,-2.9 -30,-2.5 -2,-0.3 2,-0.4 -0.989 30.6-132.2-152.4 170.7 1.5 61.8 27.7 45 45 A F E -BE 13 61A 89 16,-2.3 16,-1.9 -2,-0.3 2,-0.4 -0.936 8.4-167.2-127.6 155.5 4.0 62.2 25.0 46 46 A K E -BE 12 60A 111 -34,-2.1 -34,-1.6 -2,-0.4 2,-0.3 -0.909 15.5-175.5-138.4 106.9 6.1 59.6 23.1 47 47 A G E -BE 11 59A 18 12,-1.8 12,-1.7 -2,-0.4 2,-0.3 -0.771 6.8-177.4-107.9 151.4 9.0 60.9 20.9 48 48 A E E -BE 10 58A 103 -38,-1.9 -38,-2.1 -2,-0.3 2,-0.5 -0.963 4.3-167.6-150.4 128.7 11.4 59.1 18.6 49 49 A T E -BE 9 57A 52 8,-2.2 8,-1.9 -2,-0.3 2,-1.0 -0.958 19.9-138.8-125.8 131.6 14.4 60.3 16.6 50 50 A Q E + E 0 56A 127 -42,-1.6 6,-0.2 -2,-0.5 3,-0.1 -0.710 22.1 177.8 -79.9 98.6 16.3 58.6 13.8 51 51 A I E S- 0 0 89 4,-2.4 2,-0.3 -2,-1.0 -1,-0.2 0.895 71.5 -35.4 -76.1 -36.0 19.9 59.5 14.6 52 52 A N E > S- E 0 55A 82 3,-1.5 3,-1.6 -3,-0.2 -1,-0.3 -0.915 83.5 -69.5-161.4-168.0 21.0 57.4 11.6 53 53 A S T 3 S+ 0 0 114 1,-0.3 3,-0.1 -2,-0.3 38,-0.1 0.734 131.8 31.1 -70.5 -24.5 19.9 54.2 10.1 54 54 A D T 3 S+ 0 0 92 1,-0.1 37,-2.0 36,-0.1 2,-0.5 0.288 112.0 79.1-103.1 0.3 20.9 51.8 12.9 55 55 A L E < +EF 52 90A 44 -3,-1.6 -4,-2.4 35,-0.2 -3,-1.5 -0.911 48.4 171.7-129.8 118.3 20.4 54.3 15.7 56 56 A T E -EF 50 89A 32 33,-2.6 33,-3.6 -2,-0.5 2,-0.3 -0.907 11.7-164.9-116.5 138.5 17.3 55.6 17.5 57 57 A G E +EF 49 88A 8 -8,-1.9 -8,-2.2 -2,-0.4 2,-0.3 -0.754 19.4 174.2-107.1 157.2 16.7 57.8 20.6 58 58 A Y E -EF 48 87A 47 29,-1.8 29,-2.6 -2,-0.3 2,-0.3 -0.990 12.8-169.1-161.1 159.4 13.4 57.9 22.3 59 59 A G E -EF 47 86A 22 -12,-1.7 -12,-1.8 -2,-0.3 2,-0.3 -0.984 2.7-163.8-153.3 159.2 11.6 59.4 25.3 60 60 A Q E +EF 46 85A 37 25,-2.0 25,-2.2 -2,-0.3 2,-0.3 -0.992 11.2 171.3-152.9 140.9 8.4 59.1 27.3 61 61 A W E +EF 45 84A 76 -16,-1.9 -16,-2.3 -2,-0.3 2,-0.3 -0.989 8.9 177.5-144.7 138.3 6.3 60.9 29.8 62 62 A E E -EF 44 83A 23 21,-2.0 20,-2.4 -2,-0.3 21,-1.0 -0.995 6.9-165.4-143.5 138.4 2.8 60.1 31.0 63 63 A Y E -EF 43 81A 54 -20,-2.9 -20,-1.8 -2,-0.3 2,-0.5 -0.931 12.5-141.8-130.2 160.0 0.6 61.7 33.6 64 64 A N E -EF 42 80A 1 16,-2.6 16,-1.6 -2,-0.3 2,-0.6 -0.964 10.4-171.0-123.7 121.0 -2.6 61.0 35.5 65 65 A F E -E 41 0A 87 -24,-2.1 -24,-2.4 -2,-0.5 14,-0.1 -0.908 21.7-136.9-108.1 99.2 -5.1 63.6 36.4 66 66 A Q E -E 40 0A 45 -2,-0.6 -26,-0.3 11,-0.3 3,-0.2 -0.184 10.7-162.7 -51.2 137.7 -7.8 62.4 38.8 67 67 A G S S+ 0 0 41 -28,-3.3 -27,-0.2 1,-0.1 -28,-0.2 0.281 75.5 71.3-106.6 10.2 -11.3 63.6 37.6 68 68 A N S S+ 0 0 51 -29,-0.4 2,-0.2 9,-0.2 -1,-0.1 0.054 72.7 93.7-117.8 33.6 -13.1 63.0 41.0 69 69 A N S S- 0 0 45 -3,-0.2 2,-0.1 6,-0.1 6,-0.1 -0.654 73.6-112.6-112.9 163.5 -11.7 65.7 43.4 70 70 A S - 0 0 68 -2,-0.2 -2,-0.1 1,-0.1 -1,-0.0 -0.530 31.8-105.8 -83.6 178.2 -13.3 69.1 44.1 71 71 A E S S+ 0 0 206 -2,-0.1 -1,-0.1 3,-0.1 2,-0.0 0.374 98.6 73.6 -89.4 11.4 -11.7 72.4 43.0 72 72 A G S > S- 0 0 40 3,-0.0 3,-2.6 0, 0.0 -2,-0.0 0.039 111.4 -38.2 -95.2-153.0 -10.7 73.1 46.6 73 73 A A T 3 S+ 0 0 113 1,-0.3 3,-0.5 2,-0.1 -2,-0.0 0.748 130.7 57.0 -39.9 -43.1 -8.0 71.7 48.9 74 74 A D T > S+ 0 0 68 1,-0.2 3,-2.5 2,-0.1 -1,-0.3 0.437 73.3 118.6 -78.1 0.2 -8.4 68.0 47.8 75 75 A A T < S+ 0 0 36 -3,-2.6 -1,-0.2 1,-0.3 -6,-0.1 0.692 71.8 43.9 -34.9 -51.3 -7.6 69.0 44.2 76 76 A Q T > S+ 0 0 129 -3,-0.5 3,-2.4 2,-0.1 -1,-0.3 0.410 74.5 144.6 -81.2 -4.0 -4.4 67.0 43.6 77 77 A T T < S- 0 0 82 -3,-2.5 -11,-0.3 1,-0.3 -9,-0.2 -0.099 79.6 -2.6 -48.0 127.4 -5.6 63.7 45.2 78 78 A G T 3 S+ 0 0 37 1,-0.2 2,-0.4 -13,-0.1 -1,-0.3 0.655 91.8 143.0 62.6 24.5 -4.1 60.9 43.3 79 79 A N < + 0 0 36 -3,-2.4 2,-0.3 -14,-0.1 -1,-0.2 -0.716 23.4 138.1 -91.3 140.1 -2.3 62.9 40.6 80 80 A K E -F 64 0A 96 -16,-1.6 -16,-2.6 -2,-0.4 2,-0.5 -0.997 55.8 -97.0-171.6 166.4 1.1 61.6 39.5 81 81 A T E -F 63 0A 51 -2,-0.3 -18,-0.2 -18,-0.2 3,-0.1 -0.830 29.0-177.3 -88.1 128.5 3.6 60.8 36.8 82 82 A R E + 0 0 32 -20,-2.4 2,-0.4 -2,-0.5 -1,-0.2 0.836 69.2 19.6 -93.5 -39.6 3.4 57.2 35.8 83 83 A L E +F 62 0A 8 -21,-1.0 -21,-2.0 49,-0.1 -1,-0.3 -0.986 54.1 156.5-133.8 139.9 6.3 57.2 33.3 84 84 A A E +FG 61 100A 40 16,-1.3 16,-2.1 -2,-0.4 2,-0.3 -0.723 29.0 127.5-160.3 97.3 9.3 59.4 32.6 85 85 A F E -FG 60 99A 25 -25,-2.2 -25,-2.0 14,-0.3 2,-0.3 -0.994 34.5-154.0-149.9 160.6 12.3 57.9 30.8 86 86 A A E +FG 59 98A 65 12,-1.8 12,-2.1 -2,-0.3 2,-0.3 -0.961 24.9 154.5-133.5 151.7 14.8 58.4 27.9 87 87 A G E -FG 58 97A 13 -29,-2.6 -29,-1.8 -2,-0.3 2,-0.4 -0.973 33.0-113.7-161.3 179.0 16.8 55.8 26.0 88 88 A L E -FG 57 96A 95 8,-2.3 8,-2.3 -2,-0.3 2,-0.5 -0.945 14.3-159.1-125.6 140.2 18.7 54.6 22.8 89 89 A K E -FG 56 95A 112 -33,-3.6 -33,-2.6 -2,-0.4 2,-0.6 -0.975 11.4-166.8-119.7 121.1 18.0 51.7 20.4 90 90 A Y E >> -FG 55 94A 116 4,-2.1 3,-1.8 -2,-0.5 4,-0.9 -0.796 37.6 -88.7-121.2 106.5 20.8 50.3 18.3 91 91 A A T 34 S- 0 0 48 -37,-2.0 3,-0.5 -2,-0.6 -1,-0.1 -0.069 99.3 -26.0 35.0-131.4 20.4 48.0 15.4 92 92 A D T 34 S+ 0 0 102 1,-0.2 -1,-0.3 53,-0.1 53,-0.2 0.492 122.3 85.0 -95.6 12.4 20.4 44.4 16.6 93 93 A V T <4 S- 0 0 75 -3,-1.8 2,-0.2 1,-0.2 -1,-0.2 0.795 96.9-103.7 -76.1 -32.5 22.5 45.1 19.7 94 94 A G E < -G 90 0A 15 -4,-0.9 -4,-2.1 -3,-0.5 2,-0.3 -0.690 26.7 -85.0 135.8 172.6 19.6 46.1 22.0 95 95 A S E -GH 89 140A 16 45,-2.4 45,-1.8 -6,-0.2 2,-0.3 -0.838 31.1-165.9-109.2 156.5 18.0 49.1 23.6 96 96 A F E +GH 88 139A 106 -8,-2.3 -8,-2.3 -2,-0.3 2,-0.3 -0.986 13.6 167.0-138.9 133.6 19.0 50.8 26.9 97 97 A D E -GH 87 138A 15 41,-1.8 41,-2.4 -2,-0.3 2,-0.3 -0.930 17.1-156.5-145.2 161.4 16.9 53.3 28.9 98 98 A Y E +GH 86 137A 136 -12,-2.1 -12,-1.8 -2,-0.3 2,-0.3 -0.978 45.2 59.5-136.0 150.0 16.8 55.0 32.3 99 99 A G E S-GH 85 136A 12 37,-0.9 37,-2.0 -2,-0.3 2,-0.4 -0.914 92.2 -22.2 137.4-163.1 14.0 56.6 34.4 100 100 A R E S+G 84 0A 47 -16,-2.1 -16,-1.3 -2,-0.3 2,-0.3 -0.799 83.8 133.6 -82.6 123.3 10.7 55.8 36.0 101 101 A N E - H 0 133A 24 32,-1.8 32,-2.8 -2,-0.4 2,-0.3 -0.921 59.2 -57.9-161.3 176.6 9.4 52.7 34.0 102 102 A Y E - H 0 132A 55 -2,-0.3 30,-0.2 30,-0.3 28,-0.1 -0.576 55.8-123.2 -66.8 131.9 7.9 49.2 34.2 103 103 A G > - 0 0 0 28,-2.7 3,-1.1 -2,-0.3 4,-0.3 -0.397 25.5-104.7 -72.7 159.9 9.9 46.8 36.3 104 104 A V T > S+ 0 0 0 1,-0.2 3,-2.2 2,-0.2 4,-0.2 0.828 113.1 61.7 -57.9 -42.4 11.1 43.5 34.8 105 105 A V T >> S+ 0 0 1 24,-0.3 3,-1.9 1,-0.3 4,-1.6 0.775 91.7 69.2 -60.9 -14.2 8.7 41.0 36.5 106 106 A Y H <> S+ 0 0 45 23,-1.1 4,-2.1 -3,-1.1 -1,-0.3 0.691 78.1 80.6 -74.8 -9.5 5.8 42.9 34.7 107 107 A D H <4 S+ 0 0 41 -3,-2.2 -1,-0.3 -4,-0.3 -2,-0.2 0.791 107.5 28.4 -62.1 -29.4 7.2 41.3 31.5 108 108 A A H X4 S+ 0 0 0 -3,-1.9 3,-1.4 -4,-0.2 4,-0.4 0.709 116.2 58.7 -95.1 -44.0 5.3 38.3 32.8 109 109 A L H >X S+ 0 0 11 -4,-1.6 3,-0.6 1,-0.3 4,-0.5 0.782 91.3 69.9 -67.8 -21.7 2.4 39.8 34.8 110 110 A G T 3< S+ 0 0 20 -4,-2.1 -1,-0.3 1,-0.2 3,-0.2 0.669 79.5 79.5 -69.5 -19.3 1.1 41.8 31.8 111 111 A Y T <4 S+ 0 0 17 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.960 108.6 26.4 -50.8 -53.6 -0.1 38.6 30.2 112 112 A T T <4 S+ 0 0 3 -3,-0.6 2,-2.0 -4,-0.4 8,-0.3 0.494 95.6 100.2 -91.2 1.5 -3.1 38.5 32.5 113 113 A D < + 0 0 38 -4,-0.5 -1,-0.1 -3,-0.2 6,-0.1 -0.430 56.4 100.7 -86.0 66.1 -3.2 42.3 33.0 114 114 A M + 0 0 67 -2,-2.0 -1,-0.2 0, 0.0 5,-0.1 0.089 37.0 127.9-140.9 18.8 -6.0 42.7 30.5 115 115 A L - 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