==== 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 TRANSMEMBRANE PROTEIN 08-MAY-96 1GFQ . COMPND 2 MOLECULE: MATRIX PORIN OUTER MEMBRANE PROTEIN F; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.-L.LOU,T.SCHIRMER . 340 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16648.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 268 78.8 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 . 186 54.7 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 . 5 1.5 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 . 31 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 2.6 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 1 2 3 1 4 4 0 1 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 44 0, 0.0 12,-1.9 0, 0.0 2,-1.2 0.000 360.0 360.0 360.0 132.5 -2.1 60.4 17.5 2 2 A E E +A 12 0A 107 10,-0.3 10,-0.2 1,-0.2 3,-0.1 -0.583 360.0 167.2 -71.1 99.0 1.0 61.0 15.5 3 3 A I E + 0 0 103 -2,-1.2 2,-0.3 8,-0.7 -1,-0.2 0.491 60.8 36.0 -90.6 -9.0 1.0 64.8 15.5 4 4 A Y E +A 11 0A 107 7,-1.6 7,-1.9 -3,-0.1 -1,-0.2 -0.989 49.9 152.8-148.9 141.8 4.5 65.2 14.2 5 5 A N E +A 10 0A 75 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.485 27.0 122.2-169.5 88.1 6.8 63.5 11.7 6 6 A K E > +A 9 0A 137 3,-1.8 3,-0.9 -2,-0.1 -2,-0.0 -0.982 69.2 15.1-151.2 144.5 9.6 65.3 9.9 7 7 A D T 3 S- 0 0 159 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.873 130.9 -56.2 59.1 40.7 13.4 64.9 9.6 8 8 A G T 3 S+ 0 0 30 1,-0.2 42,-2.1 41,-0.1 2,-0.5 0.655 114.5 113.5 68.9 14.7 13.3 61.4 11.0 9 9 A N E < -AB 6 49A 56 -3,-0.9 -3,-1.8 40,-0.2 2,-0.5 -0.970 40.4-179.5-122.6 116.4 11.5 62.5 14.2 10 10 A K E -AB 5 48A 69 38,-2.1 38,-1.7 -2,-0.5 2,-0.4 -0.974 7.0-165.2-115.9 129.8 8.0 61.4 14.8 11 11 A V E -AB 4 47A 38 -7,-1.9 -7,-1.6 -2,-0.5 -8,-0.7 -0.928 3.4-161.0-111.1 134.9 6.1 62.5 17.9 12 12 A D E -AB 2 46A 46 34,-1.9 34,-1.9 -2,-0.4 2,-0.6 -0.959 3.7-165.8-118.2 111.0 3.0 60.8 19.0 13 13 A L E + B 0 45A 60 -12,-1.9 2,-0.3 -2,-0.6 32,-0.2 -0.861 21.0 174.3 -94.5 122.6 0.8 62.8 21.4 14 14 A Y E + B 0 44A 27 30,-2.2 30,-2.4 -2,-0.6 2,-0.3 -0.890 9.7 144.2-131.0 162.2 -1.8 60.5 23.0 15 15 A G E - B 0 43A 3 325,-1.5 325,-2.5 -2,-0.3 2,-0.3 -0.982 23.1-144.7-178.3 171.4 -4.5 60.6 25.6 16 16 A K E -CB 339 42A 63 26,-1.3 26,-2.1 -2,-0.3 2,-0.6 -0.994 9.7-146.9-155.3 148.0 -7.9 59.6 26.8 17 17 A A E -CB 338 41A 56 321,-2.3 321,-1.9 -2,-0.3 2,-0.7 -0.978 22.9-166.5-118.0 113.1 -10.9 60.9 28.7 18 18 A V E -CB 337 40A 1 22,-3.0 22,-1.8 -2,-0.6 2,-0.7 -0.851 12.6-160.2-107.3 101.8 -12.5 58.1 30.7 19 19 A G E +C 336 0A 30 317,-2.2 317,-2.2 -2,-0.7 2,-0.3 -0.696 32.8 174.7 -76.0 119.5 -16.0 58.6 32.2 20 20 A L E +C 335 0A 5 -2,-0.7 18,-3.0 315,-0.2 19,-0.7 -0.977 21.0 178.7-136.6 146.1 -16.0 55.9 34.8 21 21 A H E -CD 334 37A 71 313,-1.9 313,-2.1 -2,-0.3 2,-0.4 -0.992 13.0-152.2-146.9 134.8 -18.3 54.6 37.6 22 22 A Y E -CD 333 36A 20 14,-2.9 14,-3.5 -2,-0.3 2,-0.5 -0.881 5.8-159.0-108.7 140.6 -18.2 51.8 40.1 23 23 A F E +C 332 0A 106 309,-2.9 309,-1.6 -2,-0.4 2,-0.3 -0.956 27.6 146.4-120.8 114.0 -21.2 50.2 41.7 24 24 A S - 0 0 14 -2,-0.5 307,-0.1 307,-0.2 4,-0.1 -0.979 47.6-104.9-142.9 145.1 -20.7 48.3 44.9 25 25 A K S > S+ 0 0 135 305,-0.4 3,-0.7 -2,-0.3 5,-0.3 -0.427 84.8 7.4 -75.3 152.0 -23.1 47.9 47.9 26 26 A G T 3 S- 0 0 71 1,-0.2 -2,-0.2 2,-0.1 0, 0.0 -0.599 128.6 -35.7 82.3-144.6 -22.6 49.8 51.1 27 27 A N T 3 S- 0 0 138 -2,-0.3 8,-0.3 7,-0.0 -1,-0.2 -0.040 82.0-113.8-100.3 25.7 -19.9 52.5 51.2 28 28 A G S < S+ 0 0 7 -3,-0.7 3,-0.5 6,-0.2 6,-0.2 0.563 89.5 119.4 54.8 7.4 -17.9 50.2 48.9 29 29 A E S S+ 0 0 157 1,-0.2 -1,-0.1 5,-0.1 298,-0.1 0.871 81.2 36.9 -68.2 -35.6 -15.5 49.8 51.9 30 30 A N S S+ 0 0 76 -5,-0.3 299,-2.7 297,-0.1 298,-0.9 0.304 103.6 94.9 -96.8 3.6 -16.1 46.1 52.0 31 31 A S B S-s 329 0B 9 -3,-0.5 296,-0.3 297,-0.2 299,-0.2 -0.492 83.0-111.6 -93.4 170.7 -16.4 45.7 48.2 32 32 A Y S S+ 0 0 59 297,-1.7 295,-0.1 1,-0.2 298,-0.1 0.932 107.5 12.9 -64.1 -54.9 -13.7 44.6 45.8 33 33 A G S S- 0 0 24 1,-0.3 -1,-0.2 296,-0.1 2,-0.1 0.489 101.7-118.8-108.7 3.9 -13.2 47.9 43.8 34 34 A G - 0 0 18 -6,-0.2 2,-0.3 -9,-0.1 -1,-0.3 -0.468 34.7 -83.8 92.0-164.9 -15.0 50.6 45.9 35 35 A N + 0 0 73 -8,-0.3 -12,-0.2 -2,-0.1 2,-0.2 -0.991 66.8 19.0-150.8 145.6 -17.9 52.7 44.7 36 36 A G E S+D 22 0A 15 -14,-3.5 -14,-2.9 -2,-0.3 2,-0.0 -0.525 91.0 4.5 104.0-171.5 -18.8 55.8 42.8 37 37 A D E +D 21 0A 73 -16,-0.2 -16,-0.3 -2,-0.2 -2,-0.1 -0.280 46.8 163.9 -55.8 130.2 -17.3 58.2 40.3 38 38 A M + 0 0 55 -18,-3.0 -17,-0.2 29,-0.1 -1,-0.1 0.040 18.8 155.1-137.3 21.5 -13.9 57.1 39.1 39 39 A T + 0 0 42 -19,-0.7 28,-2.6 28,-0.2 29,-0.4 -0.198 14.3 157.7 -49.0 137.5 -13.6 59.3 36.0 40 40 A Y E -BE 18 66A 35 -22,-1.8 -22,-3.0 26,-0.3 2,-0.3 -0.956 25.9-146.0-155.3 175.5 -10.0 60.1 34.9 41 41 A A E -BE 17 65A 31 24,-1.7 24,-2.3 -2,-0.3 2,-0.3 -0.945 6.2-149.7-145.7 159.8 -7.9 61.2 31.9 42 42 A R E -BE 16 64A 57 -26,-2.1 -26,-1.3 -2,-0.3 2,-0.3 -0.946 9.1-177.5-133.2 151.1 -4.4 60.5 30.5 43 43 A L E +BE 15 63A 62 20,-1.5 20,-3.5 -2,-0.3 2,-0.3 -0.965 20.9 145.2-146.6 134.4 -1.9 62.5 28.5 44 44 A G E -BE 14 62A 0 -30,-2.4 -30,-2.2 -2,-0.3 2,-0.3 -0.966 31.5-136.2-160.0 169.1 1.4 61.3 27.3 45 45 A F E -BE 13 61A 87 16,-2.7 16,-1.8 -2,-0.3 2,-0.4 -0.980 3.9-163.3-135.4 149.3 3.9 61.4 24.5 46 46 A K E -BE 12 60A 87 -34,-1.9 -34,-1.9 -2,-0.3 2,-0.4 -0.964 17.3-174.3-129.2 112.8 6.0 58.8 22.6 47 47 A G E +BE 11 59A 17 12,-3.1 12,-2.1 -2,-0.4 2,-0.3 -0.868 7.4 177.8-111.4 151.3 8.9 60.1 20.6 48 48 A E E -BE 10 58A 66 -38,-1.7 -38,-2.1 -2,-0.4 2,-0.4 -0.943 4.7-171.3-153.6 122.6 11.3 58.2 18.3 49 49 A T E -BE 9 57A 51 8,-2.8 8,-2.5 -2,-0.3 2,-1.1 -0.951 21.8-134.9-122.5 136.0 14.1 59.6 16.2 50 50 A Q E + E 0 56A 116 -42,-2.1 6,-0.2 -2,-0.4 3,-0.1 -0.776 20.5 179.5 -88.0 100.0 16.2 57.8 13.5 51 51 A I S S- 0 0 90 4,-1.6 2,-0.3 -2,-1.1 5,-0.2 0.764 71.9 -41.2 -70.4 -24.2 19.7 58.8 14.2 52 52 A N S S- 0 0 76 3,-1.3 -1,-0.3 -3,-0.1 -3,-0.0 -0.919 83.8 -61.5 177.0-179.7 20.7 56.6 11.3 53 53 A S S S+ 0 0 116 -2,-0.3 3,-0.0 1,-0.2 -2,-0.0 0.845 132.1 26.8 -50.6 -44.8 19.7 53.2 9.8 54 54 A D S S+ 0 0 82 1,-0.1 37,-3.7 36,-0.1 2,-0.5 0.713 112.0 73.7 -91.5 -27.0 20.7 51.1 12.8 55 55 A L E + F 0 90A 44 35,-0.2 -4,-1.6 33,-0.0 -3,-1.3 -0.869 51.2 172.5-104.1 124.0 20.3 53.6 15.6 56 56 A T E -EF 50 89A 22 33,-2.4 33,-3.1 -2,-0.5 2,-0.3 -0.962 12.4-161.5-127.2 132.2 17.0 54.9 17.0 57 57 A G E +EF 49 88A 6 -8,-2.5 -8,-2.8 -2,-0.4 2,-0.3 -0.802 19.0 170.4-106.3 157.4 16.5 57.1 20.1 58 58 A Y E -EF 48 87A 40 29,-2.2 29,-2.5 -2,-0.3 2,-0.3 -0.994 15.1-169.2-162.3 161.4 13.2 57.4 21.8 59 59 A G E -EF 47 86A 17 -12,-2.1 -12,-3.1 -2,-0.3 2,-0.3 -0.989 2.7-166.4-153.9 159.9 11.4 58.7 24.8 60 60 A Q E +EF 46 85A 37 25,-2.3 25,-1.9 -2,-0.3 2,-0.4 -0.975 8.6 175.0-156.3 137.1 8.1 58.4 26.6 61 61 A W E -EF 45 84A 75 -16,-1.8 -16,-2.7 -2,-0.3 2,-0.3 -0.986 6.9-179.3-139.7 140.0 6.1 60.2 29.3 62 62 A E E -EF 44 83A 31 21,-1.9 20,-2.6 -2,-0.4 21,-1.1 -0.983 7.7-162.7-143.3 134.9 2.5 59.5 30.4 63 63 A Y E -EF 43 81A 53 -20,-3.5 -20,-1.5 -2,-0.3 2,-0.6 -0.929 12.3-140.8-124.6 149.5 0.6 61.2 33.1 64 64 A N E -EF 42 80A 3 16,-3.4 16,-1.5 -2,-0.3 2,-0.7 -0.923 14.1-172.2-114.0 113.6 -2.6 60.4 35.1 65 65 A F E -E 41 0A 84 -24,-2.3 -24,-1.7 -2,-0.6 14,-0.1 -0.896 20.9-137.5-104.0 102.4 -5.1 63.2 35.8 66 66 A Q E -E 40 0A 48 -2,-0.7 -26,-0.3 -26,-0.2 3,-0.2 -0.268 14.3-168.2 -59.3 138.7 -7.9 62.1 38.2 67 67 A G S S+ 0 0 41 -28,-2.6 -27,-0.2 -49,-0.1 -28,-0.2 0.240 74.8 70.0-112.3 8.0 -11.3 63.4 37.1 68 68 A N S S+ 0 0 52 -29,-0.4 2,-0.2 9,-0.2 -1,-0.1 0.094 77.9 94.0-111.1 18.5 -13.2 62.6 40.3 69 69 A N S S- 0 0 42 6,-0.2 6,-0.1 -3,-0.2 2,-0.1 -0.593 74.5-112.1-102.9 166.9 -11.6 65.2 42.6 70 70 A S - 0 0 59 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.310 26.8-110.7 -88.8-179.1 -13.0 68.6 43.4 71 71 A E S S+ 0 0 199 -2,-0.1 -1,-0.1 3,-0.1 5,-0.0 0.359 97.9 84.6 -92.4 7.2 -11.4 71.9 42.4 72 72 A G S > S- 0 0 42 3,-0.0 3,-1.8 1,-0.0 -3,-0.0 0.249 109.6 -49.7 -85.5-151.1 -10.7 72.3 46.1 73 73 A A T 3 S+ 0 0 111 1,-0.3 3,-0.4 2,-0.1 -2,-0.0 0.792 133.6 55.5 -56.4 -34.6 -7.9 71.0 48.4 74 74 A D T > S+ 0 0 66 1,-0.2 3,-2.1 2,-0.1 -1,-0.3 0.361 71.8 114.7 -81.5 1.3 -8.2 67.4 47.1 75 75 A A T < S+ 0 0 31 -3,-1.8 -1,-0.2 1,-0.3 -6,-0.2 0.780 76.4 45.9 -42.5 -38.9 -7.7 68.4 43.4 76 76 A Q T > S+ 0 0 133 -3,-0.4 3,-2.7 2,-0.1 -1,-0.3 0.438 76.6 135.5 -89.5 -4.3 -4.4 66.5 43.0 77 77 A T T < S+ 0 0 86 -3,-2.1 -11,-0.2 1,-0.3 -9,-0.2 -0.243 80.2 6.2 -50.8 122.3 -5.5 63.3 44.6 78 78 A G T 3 S+ 0 0 42 1,-0.3 -1,-0.3 -13,-0.1 2,-0.2 0.374 92.4 139.3 86.0 -4.3 -4.3 60.4 42.5 79 79 A N < + 0 0 34 -3,-2.7 2,-0.3 -14,-0.1 -1,-0.3 -0.539 23.7 140.3 -77.2 136.8 -2.3 62.5 40.0 80 80 A K E -F 64 0A 75 -16,-1.5 -16,-3.4 -2,-0.2 2,-0.5 -0.988 55.9-102.5-168.2 162.5 1.0 61.0 39.0 81 81 A T E -F 63 0A 50 -2,-0.3 -18,-0.2 -18,-0.2 3,-0.1 -0.854 30.1-172.1 -92.6 124.4 3.5 60.4 36.2 82 82 A C E + 0 0 0 -20,-2.6 2,-0.3 -2,-0.5 -1,-0.2 0.891 67.6 9.7 -83.7 -45.1 3.1 56.8 35.2 83 83 A L E +F 62 0A 12 -21,-1.1 -21,-1.9 49,-0.1 -1,-0.3 -0.952 55.4 163.4-137.8 152.5 6.1 56.5 32.9 84 84 A A E +FG 61 100A 38 16,-2.1 16,-2.5 -2,-0.3 2,-0.3 -0.603 26.8 129.3-171.1 97.5 9.1 58.7 32.0 85 85 A F E -FG 60 99A 26 -25,-1.9 -25,-2.3 14,-0.3 2,-0.3 -0.990 34.6-153.0-154.2 161.8 12.2 57.3 30.2 86 86 A A E +FG 59 98A 64 12,-1.4 12,-2.2 -2,-0.3 2,-0.3 -0.920 26.2 157.6-132.8 155.0 14.5 57.8 27.3 87 87 A G E -FG 58 97A 13 -29,-2.5 -29,-2.2 -2,-0.3 2,-0.3 -0.967 31.6-122.0-167.4 176.0 16.5 55.1 25.4 88 88 A L E -FG 57 96A 91 8,-2.5 8,-2.2 -2,-0.3 2,-0.4 -0.971 12.4-158.1-133.1 141.7 18.4 53.9 22.3 89 89 A K E -FG 56 95A 79 -33,-3.1 -33,-2.4 -2,-0.3 2,-0.5 -0.991 12.5-161.6-118.4 135.1 17.8 50.9 20.1 90 90 A Y E >> -FG 55 94A 113 4,-2.5 3,-2.1 -2,-0.4 4,-1.2 -0.924 38.7 -81.3-127.0 119.3 20.7 49.7 18.0 91 91 A A T 34 S- 0 0 52 -37,-3.7 3,-0.1 -2,-0.5 -1,-0.1 -0.042 101.0 -31.1 34.0-121.2 20.4 47.4 15.0 92 92 A D T 34 S+ 0 0 102 53,-0.1 -1,-0.3 1,-0.1 55,-0.1 0.168 122.7 89.6-107.8 11.6 20.1 43.8 16.3 93 93 A V T <4 S- 0 0 73 -3,-2.1 2,-0.2 1,-0.3 -2,-0.2 0.771 93.5-112.1 -80.7 -28.1 22.2 44.4 19.3 94 94 A G E < -G 90 0A 19 -4,-1.2 -4,-2.5 -3,-0.1 2,-0.3 -0.700 25.8 -77.3 125.7 178.4 19.3 45.5 21.6 95 95 A S E -GH 89 140A 22 45,-2.5 45,-2.2 -6,-0.2 2,-0.3 -0.872 27.4-167.2-121.9 156.5 17.8 48.4 23.4 96 96 A F E +GH 88 139A 105 -8,-2.2 -8,-2.5 -2,-0.3 2,-0.3 -0.979 13.1 165.6-143.7 133.1 18.6 50.2 26.5 97 97 A D E -GH 87 138A 9 41,-1.6 41,-2.3 -2,-0.3 2,-0.3 -0.947 14.5-158.9-145.3 154.9 16.5 52.7 28.4 98 98 A Y E +GH 86 137A 137 -12,-2.2 -12,-1.4 -2,-0.3 2,-0.3 -1.000 44.4 58.1-139.9 144.2 16.4 54.4 31.9 99 99 A G E S-GH 85 136A 12 37,-1.4 37,-2.3 -2,-0.3 2,-0.7 -0.982 94.5 -16.4 143.1-154.0 13.8 56.1 34.0 100 100 A R E S+G 84 0A 44 -16,-2.5 -16,-2.1 -2,-0.3 34,-0.2 -0.809 85.1 129.4 -87.7 121.1 10.4 55.2 35.5 101 101 A N E - H 0 133A 21 32,-1.9 32,-2.9 -2,-0.7 2,-0.4 -0.762 58.8 -55.0-154.1-170.4 9.2 52.1 33.6 102 102 A Y E - H 0 132A 65 30,-0.2 30,-0.2 -2,-0.2 27,-0.1 -0.712 50.2-121.0 -86.1 128.8 7.9 48.6 34.0 103 103 A G > - 0 0 0 28,-2.9 3,-1.4 -2,-0.4 4,-0.2 -0.307 30.2-110.2 -59.6 155.6 9.8 46.1 36.1 104 104 A V T > S+ 0 0 0 1,-0.3 3,-2.2 2,-0.2 4,-0.2 0.762 112.2 66.6 -61.4 -36.3 10.8 43.0 34.2 105 105 A V T >> S+ 0 0 2 24,-0.9 4,-2.0 1,-0.3 3,-1.6 0.707 88.6 68.6 -58.9 -20.6 8.5 40.6 35.9 106 106 A Y H <> S+ 0 0 43 -3,-1.4 4,-2.1 23,-0.9 -1,-0.3 0.648 80.2 76.6 -72.8 -12.9 5.6 42.5 34.3 107 107 A D H <4 S+ 0 0 41 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.670 107.6 34.5 -65.6 -21.6 6.9 41.0 31.0 108 108 A A H X4 S+ 0 0 0 -3,-1.6 3,-2.2 -4,-0.2 4,-0.3 0.831 117.4 48.3 -94.6 -58.6 5.2 38.0 32.4 109 109 A L H >X S+ 0 0 11 -4,-2.0 3,-0.8 1,-0.3 4,-0.6 0.686 93.0 79.8 -59.8 -17.5 2.2 39.4 34.3 110 110 A G G >< S+ 0 0 21 -4,-2.1 3,-0.8 1,-0.2 -1,-0.3 0.823 78.7 74.2 -58.9 -28.0 1.4 41.5 31.2 111 111 A Y G <4 S+ 0 0 17 -3,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.861 106.1 28.7 -49.9 -50.2 -0.2 38.3 29.8 112 112 A T G <4 S+ 0 0 3 -3,-0.8 2,-1.8 -4,-0.3 8,-0.5 0.374 89.8 100.6 -99.1 5.5 -3.3 38.4 31.9 113 113 A D << + 0 0 57 -3,-0.8 -1,-0.1 -4,-0.6 6,-0.1 -0.570 54.5 103.5 -89.1 69.6 -3.6 42.2 32.5 114 114 A M + 0 0 74 -2,-1.8 -1,-0.2 4,-0.0 5,-0.1 0.301 37.5 127.6-133.0 4.7 -6.3 42.4 29.8 115 115 A L - 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