==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PEPTIDE BINDING PROTEIN 13-NOV-98 1B6H . COMPND 2 MOLECULE: PERIPLASMIC OLIGO-PEPTIDE BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR T.G.DAVIES,J.R.H.TAME . 520 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19543.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 14.2 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 . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 46 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 3 1 1 2 0 2 3 0 1 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 0 0 1 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 PARALLEL BRIDGES PER LADDER . 5 2 1 2 1 2 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 1 0 1 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 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 14 0, 0.0 2,-0.7 0, 0.0 511,-0.1 0.000 360.0 360.0 360.0 147.9 2.2 7.7 -8.1 2 2 A D - 0 0 134 509,-0.5 511,-0.1 511,-0.0 495,-0.1 -0.902 360.0-157.8-113.6 92.1 1.3 4.1 -9.0 3 3 A V - 0 0 49 -2,-0.7 3,-0.1 1,-0.1 6,-0.0 -0.646 22.8-119.1 -74.7 116.9 -2.0 4.2 -10.9 4 4 A P > - 0 0 65 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.165 36.5 -92.9 -52.5 141.2 -3.7 0.8 -10.7 5 5 A A T 3 S+ 0 0 107 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.313 112.3 24.2 -54.5 139.3 -4.4 -0.9 -14.1 6 6 A G T 3 S+ 0 0 73 1,-0.3 -1,-0.2 -3,-0.1 2,-0.2 0.211 85.8 129.8 90.4 -20.1 -7.9 0.0 -15.3 7 7 A V < - 0 0 45 -3,-1.9 2,-0.6 1,-0.0 -1,-0.3 -0.564 53.7-137.6 -70.3 135.7 -8.3 3.3 -13.4 8 8 A Q - 0 0 124 -2,-0.2 508,-3.1 508,-0.1 2,-0.2 -0.855 18.1-140.2 -95.1 123.7 -9.4 6.1 -15.7 9 9 A L B -A 515 0A 67 -2,-0.6 506,-0.3 506,-0.3 4,-0.1 -0.571 17.2-112.5 -85.0 145.1 -7.5 9.4 -15.0 10 10 A A - 0 0 17 504,-2.9 504,-0.2 -2,-0.2 506,-0.1 -0.368 23.2-124.5 -64.0 153.7 -9.2 12.7 -15.0 11 11 A D S S+ 0 0 175 1,-0.2 2,-0.7 504,-0.1 -1,-0.1 0.911 101.8 54.7 -66.1 -43.7 -8.0 15.0 -17.8 12 12 A K S S- 0 0 157 2,-0.1 2,-1.2 206,-0.0 -1,-0.2 -0.847 72.0-163.4 -96.0 113.7 -7.1 17.7 -15.3 13 13 A Q + 0 0 12 -2,-0.7 206,-3.0 204,-0.1 207,-1.0 -0.674 39.6 131.5-100.1 77.2 -4.7 16.5 -12.7 14 14 A T E -b 220 0B 44 -2,-1.2 2,-0.3 204,-0.2 207,-0.2 -0.940 34.2-164.2-127.6 153.7 -5.0 19.2 -10.0 15 15 A L E -b 221 0B 1 205,-2.0 207,-2.0 -2,-0.3 2,-0.5 -0.985 9.8-158.4-140.0 145.7 -5.5 19.0 -6.3 16 16 A V E -b 222 0B 27 -2,-0.3 226,-2.1 205,-0.2 227,-1.4 -0.998 17.0-177.9-126.1 120.4 -6.6 21.4 -3.6 17 17 A R E -bc 223 243B 0 205,-3.2 207,-2.2 -2,-0.5 2,-0.3 -0.961 24.5-132.8-116.5 139.2 -5.6 20.5 -0.0 18 18 A N E -b 224 0B 2 225,-2.8 228,-0.1 -2,-0.4 209,-0.0 -0.695 18.2-169.5 -85.9 148.0 -6.5 22.5 3.1 19 19 A N - 0 0 3 205,-2.4 2,-1.0 -2,-0.3 -1,-0.1 0.153 32.9-121.1-128.2 16.0 -3.4 22.8 5.3 20 20 A G S S+ 0 0 10 206,-0.4 2,-0.3 204,-0.1 377,-0.1 -0.044 77.4 3.9 77.9 -34.3 -4.8 24.2 8.6 21 21 A S S S- 0 0 12 -2,-1.0 2,-0.3 203,-0.3 205,-0.2 -0.966 89.1 -70.9-169.2 169.1 -2.8 27.5 8.8 22 22 A E - 0 0 12 203,-0.3 376,-0.3 -2,-0.3 14,-0.1 -0.588 64.0-108.7 -73.0 135.1 -0.4 29.8 7.1 23 23 A V - 0 0 3 -2,-0.3 3,-0.1 1,-0.1 -1,-0.1 -0.308 9.2-130.8 -67.8 152.3 3.0 28.1 7.2 24 24 A Q S S- 0 0 35 1,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.895 81.0 -40.8 -61.6 -44.9 5.8 29.3 9.5 25 25 A S - 0 0 21 1,-0.0 -1,-0.3 3,-0.0 0, 0.0 -0.950 39.3-123.9-170.0 169.9 8.2 29.2 6.5 26 26 A L S S+ 0 0 7 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.264 80.5 106.9-108.6 1.4 9.1 27.2 3.5 27 27 A D > - 0 0 7 1,-0.1 3,-2.7 3,-0.1 4,-0.2 -0.731 69.9-142.1 -83.5 117.1 12.8 27.0 4.7 28 28 A P T 3 S+ 0 0 0 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.704 98.8 52.3 -50.3 -28.5 13.4 23.4 5.9 29 29 A H T 3 S+ 0 0 0 1,-0.2 80,-0.4 135,-0.1 81,-0.1 0.491 107.1 51.7 -92.0 -1.3 15.5 24.7 8.8 30 30 A K S < S+ 0 0 78 -3,-2.7 2,-0.3 77,-0.2 -1,-0.2 0.120 95.4 85.7-113.7 13.2 13.0 27.2 10.1 31 31 A I + 0 0 4 -3,-0.5 78,-0.1 -4,-0.2 132,-0.1 -0.869 31.9 161.5-118.5 156.5 9.9 24.9 10.4 32 32 A E + 0 0 7 -2,-0.3 488,-2.8 488,-0.1 2,-0.2 0.459 49.7 86.6-146.6 0.4 8.5 22.6 13.0 33 33 A G B > S-g 520 0C 0 486,-0.3 4,-2.5 1,-0.1 488,-0.2 -0.483 76.7-110.0-111.3 174.3 4.9 21.9 12.4 34 34 A V H > S+ 0 0 6 486,-2.8 4,-2.3 2,-0.2 5,-0.2 0.951 115.8 50.2 -63.2 -46.5 2.5 19.6 10.4 35 35 A P H > S+ 0 0 2 0, 0.0 4,-1.4 0, 0.0 5,-0.2 0.915 113.6 47.8 -61.5 -37.9 1.3 22.3 8.0 36 36 A E H > S+ 0 0 2 1,-0.2 4,-2.7 2,-0.2 3,-0.2 0.941 112.6 47.2 -67.5 -44.6 4.9 23.3 7.3 37 37 A S H X S+ 0 0 1 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.811 103.6 63.4 -69.4 -27.9 6.0 19.7 6.8 38 38 A N H < S+ 0 0 1 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.911 112.1 35.3 -61.5 -43.8 3.1 19.0 4.5 39 39 A V H >X S+ 0 0 0 -4,-1.4 3,-1.4 -3,-0.2 4,-1.2 0.906 112.7 61.3 -76.5 -41.2 4.3 21.5 2.0 40 40 A S H 3X S+ 0 0 6 -4,-2.7 4,-2.9 1,-0.3 3,-0.5 0.865 96.5 59.2 -55.1 -40.0 8.0 20.7 2.6 41 41 A R H 3< S+ 0 0 12 -4,-2.2 149,-0.4 1,-0.2 -1,-0.3 0.790 106.2 48.2 -61.3 -30.1 7.6 17.1 1.5 42 42 A D H <4 S+ 0 0 2 -3,-1.4 149,-2.4 -4,-0.5 -1,-0.2 0.736 122.4 33.8 -78.9 -26.4 6.4 18.2 -2.0 43 43 A L H < S+ 0 0 1 -4,-1.2 146,-2.9 -3,-0.5 145,-1.2 0.769 116.3 40.4 -97.3 -39.5 9.3 20.6 -2.4 44 44 A F < - 0 0 4 -4,-2.9 2,-0.5 144,-0.2 -1,-0.2 -0.980 62.7-162.1-121.7 128.8 12.5 19.3 -0.6 45 45 A E - 0 0 6 -2,-0.5 4,-0.1 -3,-0.1 -4,-0.1 -0.923 7.7-165.2-117.0 128.8 13.6 15.7 -0.7 46 46 A G - 0 0 4 -2,-0.5 14,-3.1 2,-0.4 15,-0.3 0.079 46.0 -70.4 -91.9-160.9 16.1 14.2 1.7 47 47 A L S S+ 0 0 0 117,-0.4 12,-2.1 112,-0.4 14,-1.7 0.912 117.7 16.6 -61.8 -47.6 18.1 11.1 1.8 48 48 A L E -N 58 0D 1 111,-0.6 -2,-0.4 10,-0.2 2,-0.3 -0.827 68.6-163.6-120.2 163.1 15.1 8.8 2.4 49 49 A I E -N 57 0D 10 8,-2.7 8,-3.0 -2,-0.3 2,-0.4 -0.860 29.6-103.1-137.0 164.8 11.3 9.4 1.9 50 50 A S E -N 56 0D 3 -2,-0.3 5,-0.1 6,-0.2 452,-0.0 -0.789 34.5-133.0 -85.9 143.8 8.3 7.5 3.2 51 51 A D > - 0 0 56 4,-2.3 3,-2.0 -2,-0.4 455,-0.1 -0.187 44.8 -77.9 -77.1-170.4 6.6 5.3 0.7 52 52 A V T 3 S+ 0 0 58 1,-0.3 447,-0.5 2,-0.1 450,-0.3 0.639 135.7 44.8 -67.1 -13.9 2.8 5.4 0.3 53 53 A E T 3 S- 0 0 84 448,-0.1 -1,-0.3 2,-0.1 452,-0.1 0.315 123.5-100.8-109.2 3.9 2.4 3.3 3.5 54 54 A G S < S+ 0 0 17 -3,-2.0 -2,-0.1 1,-0.3 3,-0.0 0.448 71.0 144.2 96.7 -3.1 5.0 5.2 5.5 55 55 A H - 0 0 99 1,-0.1 -4,-2.3 -5,-0.1 -1,-0.3 -0.578 60.6-106.7 -73.8 136.9 8.0 2.8 5.3 56 56 A P E +N 50 0D 47 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.367 56.7 166.1 -58.3 132.7 11.3 4.6 5.1 57 57 A S E -N 49 0D 22 -8,-3.0 -8,-2.7 -3,-0.0 4,-0.1 -0.926 40.9 -56.4-150.2 169.6 12.4 4.2 1.4 58 58 A P E +N 48 0D 54 0, 0.0 -10,-0.2 0, 0.0 4,-0.2 -0.277 53.6 159.0 -56.8 131.4 15.0 5.6 -1.0 59 59 A G S S- 0 0 0 -12,-2.1 -12,-0.2 2,-0.8 -11,-0.2 0.201 80.0 -24.5-115.4-116.4 14.8 9.4 -1.5 60 60 A V S S+ 0 0 0 -14,-3.1 17,-2.9 -12,-0.1 2,-0.5 0.890 133.7 73.0 -66.2 -36.2 17.9 11.1 -2.9 61 61 A A E -O 76 0E 0 -14,-1.7 -2,-0.8 -15,-0.3 15,-0.3 -0.663 63.9-172.7 -76.6 122.4 19.9 8.2 -1.5 62 62 A E E S+ 0 0 84 13,-2.6 2,-0.3 -2,-0.5 -1,-0.2 0.756 72.6 1.5 -87.6 -23.8 19.2 5.1 -3.7 63 63 A K E -O 75 0E 101 12,-1.2 12,-3.2 2,-0.0 2,-0.3 -0.983 65.9-175.4-156.5 157.1 21.1 2.8 -1.3 64 64 A W E -O 74 0E 68 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.987 6.3-162.6-153.6 157.7 22.9 3.0 2.0 65 65 A E E -O 73 0E 90 8,-1.9 8,-2.7 -2,-0.3 2,-0.3 -0.918 9.3-147.9-134.3 165.3 24.9 0.9 4.4 66 66 A N E -O 72 0E 66 -2,-0.3 2,-0.5 6,-0.2 6,-0.2 -0.986 7.1-146.5-136.7 150.8 26.0 1.2 8.1 67 67 A K E >> S-O 71 0E 129 4,-2.0 3,-2.6 -2,-0.3 4,-2.0 -0.982 87.4 -27.1-115.0 113.7 29.0 0.1 10.1 68 68 A D T 34 S- 0 0 98 -2,-0.5 -1,-0.1 1,-0.3 4,-0.1 0.660 108.6 -75.8 54.9 25.6 28.1 -0.8 13.6 69 69 A F T 34 S+ 0 0 89 2,-0.2 83,-2.1 82,-0.2 -1,-0.3 0.646 127.9 86.5 61.6 19.0 25.1 1.5 13.4 70 70 A K T <4 S+ 0 0 81 -3,-2.6 78,-3.2 1,-0.3 2,-0.6 0.741 80.4 47.2-119.1 -33.3 27.6 4.4 13.8 71 71 A V E < -OP 67 147E 40 -4,-2.0 -4,-2.0 76,-0.2 2,-0.5 -0.956 69.3-169.8-117.6 114.3 28.9 5.2 10.3 72 72 A W E -OP 66 146E 5 74,-2.9 74,-3.1 -2,-0.6 2,-0.6 -0.881 3.0-164.1-108.3 125.8 26.1 5.5 7.7 73 73 A T E -OP 65 145E 26 -8,-2.7 -8,-1.9 -2,-0.5 2,-0.5 -0.929 2.9-164.4-114.9 119.1 27.0 5.8 4.0 74 74 A F E -OP 64 144E 0 70,-3.2 70,-2.5 -2,-0.6 2,-0.8 -0.903 9.3-151.6-109.1 124.6 24.4 7.0 1.6 75 75 A H E -OP 63 143E 42 -12,-3.2 -13,-2.6 -2,-0.5 -12,-1.2 -0.842 19.8-146.2 -93.5 108.8 24.8 6.5 -2.1 76 76 A L E -O 61 0E 2 66,-2.8 -15,-0.3 -2,-0.8 -16,-0.1 -0.563 21.2-106.9 -82.5 134.8 23.0 9.3 -3.9 77 77 A R > - 0 0 22 -17,-2.9 3,-1.5 -2,-0.3 11,-0.2 -0.240 23.8-130.5 -57.9 139.5 21.3 8.6 -7.2 78 78 A E T 3 S+ 0 0 142 1,-0.3 -1,-0.1 -3,-0.1 10,-0.1 0.835 102.3 51.2 -67.1 -22.4 23.2 10.1 -10.1 79 79 A N T 3 S+ 0 0 79 8,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.249 72.9 128.3-101.2 18.5 20.2 11.9 -11.7 80 80 A A < + 0 0 2 -3,-1.5 8,-2.2 8,-0.2 2,-0.3 -0.545 39.3 175.0 -71.9 127.5 19.0 13.7 -8.5 81 81 A K B -R 87 0F 67 128,-0.3 130,-0.2 6,-0.3 2,-0.1 -0.988 32.5-121.8-135.6 155.9 18.5 17.3 -9.6 82 82 A W > - 0 0 5 4,-3.3 3,-1.9 -2,-0.3 106,-0.2 -0.349 45.2 -97.7 -80.7 168.6 17.3 20.6 -8.3 83 83 A S T 3 S+ 0 0 23 104,-2.1 105,-0.1 1,-0.3 126,-0.1 0.689 123.5 60.7 -68.9 -17.1 14.5 22.5 -10.1 84 84 A D T 3 S- 0 0 85 103,-0.1 -1,-0.3 2,-0.1 104,-0.1 0.259 122.6-104.5 -88.4 8.6 17.1 24.7 -12.0 85 85 A G S < S+ 0 0 28 -3,-1.9 -2,-0.1 1,-0.3 -1,-0.0 0.318 78.6 130.1 89.3 -9.1 18.6 21.5 -13.5 86 86 A T - 0 0 66 1,-0.1 -4,-3.3 -5,-0.1 -1,-0.3 -0.441 63.6 -96.9 -83.4 151.8 21.7 21.3 -11.3 87 87 A P B -R 81 0F 68 0, 0.0 2,-0.5 0, 0.0 -6,-0.3 -0.381 23.6-129.9 -65.1 144.8 22.7 18.1 -9.6 88 88 A V - 0 0 1 -8,-2.2 2,-0.3 -11,-0.2 -8,-0.2 -0.843 41.3-178.4 -89.9 126.6 21.8 17.4 -6.0 89 89 A T >> - 0 0 21 -2,-0.5 4,-1.1 1,-0.0 3,-0.7 -0.807 45.8-104.2-123.6 172.5 25.1 16.3 -4.5 90 90 A A H 3> S+ 0 0 0 51,-2.4 4,-2.3 -2,-0.3 5,-0.1 0.797 118.8 66.1 -62.5 -29.2 26.5 15.1 -1.1 91 91 A H H 3> S+ 0 0 89 1,-0.2 4,-2.5 50,-0.2 -1,-0.2 0.860 96.1 55.8 -63.6 -34.4 28.0 18.6 -0.8 92 92 A D H <> S+ 0 0 26 -3,-0.7 4,-2.5 2,-0.2 75,-0.5 0.905 108.4 47.1 -62.0 -39.8 24.4 19.9 -0.6 93 93 A F H X S+ 0 0 0 -4,-1.1 4,-2.9 2,-0.2 5,-0.3 0.896 110.2 53.0 -69.2 -38.9 23.7 17.6 2.3 94 94 A V H X S+ 0 0 23 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.960 113.5 42.1 -59.9 -51.7 27.0 18.6 4.1 95 95 A Y H X S+ 0 0 36 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.915 115.4 51.5 -59.1 -47.0 26.1 22.3 3.8 96 96 A S H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.939 110.1 45.3 -60.4 -49.4 22.5 21.7 4.8 97 97 A W H X S+ 0 0 1 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.855 113.3 52.1 -67.2 -31.4 23.2 19.6 7.9 98 98 A Q H X S+ 0 0 35 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.912 108.9 49.7 -67.7 -39.6 25.8 22.1 9.0 99 99 A R H < S+ 0 0 35 -4,-2.4 6,-0.3 1,-0.2 -2,-0.2 0.898 109.9 51.9 -64.8 -40.1 23.3 25.0 8.6 100 100 A L H < S+ 0 0 0 -4,-2.5 7,-0.4 1,-0.2 -1,-0.2 0.914 112.9 44.8 -60.2 -41.7 20.8 23.1 10.6 101 101 A A H < S+ 0 0 1 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.803 89.3 103.1 -71.2 -30.2 23.4 22.6 13.4 102 102 A D >X - 0 0 51 -4,-2.0 3,-2.3 1,-0.2 4,-0.6 -0.391 67.5-144.2 -63.9 122.9 24.6 26.2 13.4 103 103 A P G >4 S+ 0 0 61 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.810 97.6 68.0 -57.7 -29.4 23.2 28.2 16.3 104 104 A N G 34 S+ 0 0 147 1,-0.3 -2,-0.1 2,-0.1 -5,-0.1 0.788 95.2 55.7 -63.7 -25.3 23.1 31.2 14.1 105 105 A T G <4 S- 0 0 11 -3,-2.3 -1,-0.3 -6,-0.3 -5,-0.1 0.716 91.4-156.4 -75.0 -24.8 20.3 29.5 12.1 106 106 A A << - 0 0 79 -3,-1.1 -2,-0.1 -4,-0.6 -6,-0.1 0.894 19.0-175.3 51.2 46.1 18.3 29.1 15.3 107 107 A S > - 0 0 7 -7,-0.4 3,-1.7 -5,-0.4 4,-0.3 -0.525 32.8-139.5 -72.2 143.2 16.3 26.2 13.9 108 108 A P T 3 S+ 0 0 19 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.722 108.5 50.7 -68.3 -19.9 13.6 24.8 16.1 109 109 A Y T > + 0 0 0 -80,-0.4 3,-1.9 1,-0.1 4,-0.4 0.166 69.8 115.1-107.1 22.2 14.9 21.4 14.9 110 110 A A T X S+ 0 0 15 -3,-1.7 3,-1.6 1,-0.3 4,-0.4 0.927 75.1 59.4 -53.5 -41.2 18.6 22.0 15.7 111 111 A S T >> S+ 0 0 2 -4,-0.3 4,-2.4 1,-0.3 3,-0.6 0.629 79.0 85.6 -68.0 -8.1 18.3 19.1 18.2 112 112 A Y H <> S+ 0 0 2 -3,-1.9 4,-1.4 1,-0.3 -1,-0.3 0.887 88.8 54.2 -58.6 -32.4 17.2 16.6 15.5 113 113 A L H <4>S+ 0 0 1 -3,-1.6 5,-2.3 -4,-0.4 4,-0.4 0.785 107.2 49.9 -74.3 -22.5 21.0 16.1 15.0 114 114 A Q H <45S+ 0 0 16 -3,-0.6 3,-0.4 -4,-0.4 -2,-0.2 0.847 105.2 57.2 -75.8 -38.2 21.3 15.4 18.7 115 115 A Y H <5S+ 0 0 3 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.856 113.8 39.0 -60.5 -36.0 18.4 12.8 18.4 116 116 A G T <5S- 0 0 0 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.514 109.9-130.3 -90.3 -4.8 20.5 11.0 15.8 117 117 A H T 5 - 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