==== 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 11-NOV-98 1B4H . 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) . 19702.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 348 66.9 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 . 38 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 23.5 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 2 2 1 2 0 2 3 0 1 0 0 1 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,-0.6 0, 0.0 511,-0.1 0.000 360.0 360.0 360.0 154.7 2.3 7.6 -8.1 2 2 A D - 0 0 132 509,-0.4 511,-0.1 495,-0.0 495,-0.0 -0.939 360.0-158.1-115.8 93.6 1.4 4.0 -9.1 3 3 A V - 0 0 51 -2,-0.6 3,-0.1 1,-0.1 6,-0.0 -0.708 22.2-119.2 -77.4 118.1 -2.0 4.1 -10.9 4 4 A P > - 0 0 67 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 -0.211 36.1 -90.7 -54.8 143.0 -3.7 0.7 -10.8 5 5 A A T 3 S+ 0 0 106 1,-0.3 3,-0.1 3,-0.0 0, 0.0 -0.280 112.1 20.3 -51.2 137.4 -4.5 -1.1 -14.1 6 6 A G T 3 S+ 0 0 85 1,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.300 85.4 128.1 82.7 -11.9 -7.9 -0.1 -15.4 7 7 A V < - 0 0 41 -3,-2.2 2,-0.5 508,-0.0 -1,-0.3 -0.685 54.8-138.1 -78.4 143.5 -8.4 3.2 -13.4 8 8 A Q - 0 0 126 -2,-0.3 508,-2.6 508,-0.1 2,-0.2 -0.883 17.6-138.5 -99.6 123.1 -9.3 6.0 -15.8 9 9 A L B -A 515 0A 65 -2,-0.5 506,-0.3 506,-0.3 2,-0.1 -0.570 17.9-109.9 -82.3 150.3 -7.5 9.2 -15.0 10 10 A A - 0 0 17 504,-3.0 504,-0.2 -2,-0.2 -1,-0.1 -0.389 22.7-125.4 -68.3 149.8 -9.1 12.6 -15.1 11 11 A D S S+ 0 0 159 1,-0.2 2,-0.6 -2,-0.1 -1,-0.1 0.939 101.6 56.5 -59.4 -46.1 -8.0 14.9 -18.0 12 12 A K S S- 0 0 142 2,-0.1 2,-0.9 1,-0.0 -1,-0.2 -0.808 70.1-166.1 -96.1 115.6 -7.1 17.5 -15.4 13 13 A Q + 0 0 13 -2,-0.6 206,-2.7 204,-0.1 207,-1.0 -0.668 38.0 129.6-103.9 74.6 -4.7 16.4 -12.7 14 14 A T E -b 220 0B 35 -2,-0.9 2,-0.4 204,-0.2 207,-0.2 -0.919 34.9-162.7-125.4 153.0 -5.0 19.2 -10.1 15 15 A L E -b 221 0B 1 205,-2.1 207,-2.3 -2,-0.3 2,-0.5 -0.989 9.1-158.5-137.6 143.8 -5.5 18.9 -6.3 16 16 A V E -b 222 0B 28 -2,-0.4 226,-2.1 205,-0.2 227,-1.5 -0.994 17.3-178.1-124.3 122.0 -6.6 21.3 -3.6 17 17 A R E -bc 223 243B 0 205,-3.2 207,-2.0 -2,-0.5 2,-0.3 -0.964 24.7-132.2-117.7 141.5 -5.7 20.5 -0.1 18 18 A N E -b 224 0B 2 225,-2.4 228,-0.1 -2,-0.4 205,-0.0 -0.680 18.5-169.2 -86.4 148.3 -6.5 22.4 3.1 19 19 A N - 0 0 2 205,-2.6 2,-0.9 -2,-0.3 -1,-0.1 0.159 33.1-119.8-129.0 17.6 -3.4 22.8 5.3 20 20 A G S S- 0 0 8 206,-0.3 2,-0.3 204,-0.1 377,-0.1 0.022 77.6 -0.0 79.3 -39.5 -4.8 24.1 8.6 21 21 A S S S- 0 0 12 -2,-0.9 2,-0.3 203,-0.3 205,-0.2 -0.966 89.5 -68.6-166.2 173.6 -3.0 27.4 8.8 22 22 A E - 0 0 28 203,-0.3 376,-0.3 -2,-0.3 14,-0.1 -0.643 64.1-110.0 -72.8 134.6 -0.5 29.7 7.1 23 23 A V - 0 0 3 -2,-0.3 3,-0.1 12,-0.1 -1,-0.1 -0.291 9.3-130.3 -67.4 154.4 2.9 28.1 7.3 24 24 A Q S S- 0 0 25 1,-0.3 2,-0.3 -3,-0.0 -1,-0.1 0.856 81.4 -38.1 -62.3 -41.7 5.7 29.4 9.5 25 25 A S - 0 0 21 1,-0.0 -1,-0.3 3,-0.0 0, 0.0 -0.959 39.6-124.9-170.7 167.8 8.1 29.3 6.5 26 26 A L S S+ 0 0 7 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.251 80.7 106.3-106.9 1.6 9.0 27.2 3.5 27 27 A D > - 0 0 7 1,-0.1 3,-2.6 3,-0.1 4,-0.1 -0.758 69.4-143.5 -84.4 119.1 12.7 27.1 4.7 28 28 A P T 3 S+ 0 0 0 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.713 99.0 53.5 -55.8 -24.6 13.2 23.5 6.0 29 29 A H T 3 S+ 0 0 0 1,-0.2 80,-0.4 135,-0.1 81,-0.1 0.516 106.8 50.6 -88.2 -3.9 15.4 24.8 8.8 30 30 A K S < S+ 0 0 77 -3,-2.6 2,-0.3 77,-0.2 -1,-0.2 0.042 95.8 86.1-114.3 16.1 12.9 27.3 10.1 31 31 A I + 0 0 4 -3,-0.5 78,-0.1 -4,-0.1 132,-0.0 -0.891 32.2 162.5-121.0 155.2 9.8 25.0 10.5 32 32 A E + 0 0 8 -2,-0.3 488,-2.9 488,-0.1 2,-0.2 0.423 50.6 83.5-143.7 -3.9 8.4 22.6 13.1 33 33 A G B > S-g 520 0C 0 486,-0.3 4,-2.4 1,-0.1 488,-0.2 -0.504 77.6-108.4-111.2 174.1 4.7 21.8 12.4 34 34 A V H > S+ 0 0 6 486,-2.4 4,-2.8 2,-0.2 5,-0.2 0.948 115.9 52.3 -61.1 -45.0 2.5 19.6 10.3 35 35 A P H > S+ 0 0 2 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.924 112.6 46.4 -60.4 -42.9 1.3 22.3 8.0 36 36 A E H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.928 114.0 46.9 -64.7 -43.1 4.9 23.3 7.2 37 37 A S H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.815 103.6 63.1 -70.9 -30.6 6.0 19.7 6.7 38 38 A N H X S+ 0 0 1 -4,-2.8 4,-0.5 1,-0.2 -1,-0.2 0.876 112.2 36.3 -55.9 -46.8 3.0 19.0 4.5 39 39 A V H >X S+ 0 0 0 -4,-1.3 3,-1.1 -5,-0.2 4,-1.1 0.910 112.6 60.4 -73.0 -42.4 4.3 21.5 2.0 40 40 A S H >X S+ 0 0 5 -4,-2.5 4,-3.0 1,-0.3 3,-0.7 0.891 96.7 59.6 -57.8 -35.0 8.0 20.7 2.6 41 41 A R H 3< S+ 0 0 14 -4,-2.3 149,-0.4 1,-0.3 -1,-0.3 0.817 106.0 48.4 -63.6 -30.7 7.6 17.0 1.5 42 42 A D H << S+ 0 0 2 -3,-1.1 149,-2.2 -4,-0.5 -1,-0.3 0.764 122.4 32.4 -78.0 -27.4 6.4 18.2 -1.9 43 43 A L H << S+ 0 0 1 -4,-1.1 146,-3.0 -3,-0.7 145,-1.1 0.761 117.2 41.6 -98.9 -40.3 9.3 20.7 -2.4 44 44 A F < - 0 0 4 -4,-3.0 2,-0.5 144,-0.2 -1,-0.2 -0.973 61.7-164.0-118.3 129.5 12.4 19.3 -0.6 45 45 A E - 0 0 7 -2,-0.5 4,-0.1 -3,-0.1 115,-0.1 -0.932 6.9-165.3-118.2 127.3 13.6 15.7 -0.7 46 46 A G - 0 0 3 -2,-0.5 14,-3.0 2,-0.4 15,-0.2 0.079 47.6 -69.1 -90.5-161.0 16.1 14.3 1.8 47 47 A L S S+ 0 0 0 112,-0.3 12,-2.2 117,-0.3 14,-1.9 0.881 118.6 16.8 -61.6 -45.8 18.2 11.1 1.8 48 48 A L E -N 58 0D 1 111,-0.7 -2,-0.4 10,-0.3 2,-0.3 -0.858 68.1-165.1-122.7 162.5 15.2 8.8 2.4 49 49 A I E -N 57 0D 12 8,-2.4 8,-3.0 -2,-0.3 2,-0.4 -0.867 31.2-101.4-136.7 165.0 11.4 9.4 2.0 50 50 A S E -N 56 0D 3 -2,-0.3 5,-0.1 6,-0.2 2,-0.0 -0.776 35.0-133.8 -84.0 144.8 8.4 7.5 3.2 51 51 A D > - 0 0 52 4,-2.5 3,-2.2 -2,-0.4 455,-0.1 -0.201 45.0 -77.9 -80.2-170.9 6.7 5.3 0.6 52 52 A V T 3 S+ 0 0 60 1,-0.3 447,-0.5 2,-0.1 450,-0.3 0.634 135.4 46.1 -64.6 -16.0 2.9 5.4 0.3 53 53 A E T 3 S- 0 0 89 448,-0.1 -1,-0.3 2,-0.1 452,-0.1 0.284 123.4-102.3-105.3 3.2 2.4 3.2 3.4 54 54 A G S < S+ 0 0 17 -3,-2.2 -2,-0.1 1,-0.3 3,-0.0 0.497 71.3 142.7 98.6 -4.5 5.0 5.1 5.4 55 55 A H - 0 0 99 1,-0.1 -4,-2.5 -5,-0.1 -1,-0.3 -0.638 61.5-104.5 -78.5 141.0 8.0 2.9 5.3 56 56 A P E +N 50 0D 46 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.377 56.2 168.6 -58.5 133.1 11.4 4.7 5.0 57 57 A S E -N 49 0D 23 -8,-3.0 -8,-2.4 -2,-0.0 4,-0.1 -0.896 40.7 -60.1-146.8 168.9 12.5 4.3 1.4 58 58 A P E +N 48 0D 58 0, 0.0 -10,-0.3 0, 0.0 4,-0.2 -0.331 54.5 158.1 -59.0 132.6 15.1 5.6 -1.0 59 59 A G S S- 0 0 0 -12,-2.2 -12,-0.2 2,-0.7 -11,-0.2 0.279 79.6 -21.6-117.1-111.7 14.8 9.4 -1.6 60 60 A V S S+ 0 0 0 -14,-3.0 17,-2.7 -12,-0.1 2,-0.4 0.905 133.8 70.2 -67.9 -33.9 17.9 11.2 -2.9 61 61 A A E -O 76 0E 0 -14,-1.9 -2,-0.7 15,-0.3 15,-0.3 -0.688 64.9-170.4 -81.3 122.9 20.0 8.2 -1.6 62 62 A E E S+ 0 0 79 13,-2.6 2,-0.3 -2,-0.4 -1,-0.2 0.706 72.6 2.3 -84.6 -25.7 19.3 5.1 -3.7 63 63 A K E -O 75 0E 118 12,-1.3 12,-3.3 2,-0.0 2,-0.3 -0.990 65.4-174.3-157.1 157.2 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 -0.994 6.8-162.7-151.9 157.7 22.9 2.9 2.0 65 65 A E E -O 73 0E 97 8,-1.9 8,-2.9 -2,-0.3 2,-0.4 -0.924 9.4-148.7-135.9 162.9 25.0 0.9 4.5 66 66 A N E -O 72 0E 64 -2,-0.3 2,-0.6 6,-0.2 6,-0.2 -0.982 7.4-146.3-132.8 151.2 26.0 1.3 8.1 67 67 A K E >> S-O 71 0E 125 4,-2.3 3,-2.5 -2,-0.4 4,-1.9 -0.964 87.6 -28.1-117.4 110.0 29.1 0.2 10.1 68 68 A D T 34 S- 0 0 109 -2,-0.6 -1,-0.1 1,-0.3 4,-0.1 0.674 108.3 -76.2 56.0 26.9 28.1 -0.8 13.6 69 69 A F T 34 S+ 0 0 86 2,-0.2 83,-2.3 82,-0.2 -1,-0.3 0.656 127.3 86.4 58.6 22.9 25.2 1.6 13.4 70 70 A K T <4 S+ 0 0 81 -3,-2.5 78,-3.0 1,-0.3 2,-0.6 0.737 81.0 46.8-121.2 -33.9 27.7 4.5 13.8 71 71 A V E < S-OP 67 147E 41 -4,-1.9 -4,-2.3 76,-0.2 2,-0.5 -0.964 70.0-168.6-117.4 114.8 29.0 5.3 10.4 72 72 A W E -OP 66 146E 5 74,-3.1 74,-3.2 -2,-0.6 2,-0.5 -0.927 3.1-163.0-106.2 125.8 26.2 5.6 7.8 73 73 A T E -OP 65 145E 26 -8,-2.9 -8,-1.9 -2,-0.5 2,-0.5 -0.919 3.8-163.7-114.0 119.1 27.1 5.8 4.1 74 74 A F E -OP 64 144E 0 70,-2.9 70,-2.4 -2,-0.5 2,-0.8 -0.917 9.1-151.6-109.8 122.2 24.5 7.1 1.6 75 75 A H E -OP 63 143E 54 -12,-3.3 -13,-2.6 -2,-0.5 -12,-1.3 -0.828 19.4-147.4 -90.5 106.4 24.8 6.5 -2.1 76 76 A L E -O 61 0E 3 66,-2.8 -15,-0.3 -2,-0.8 -16,-0.1 -0.585 21.0-107.7 -82.0 136.7 23.1 9.3 -3.9 77 77 A R > - 0 0 22 -17,-2.7 3,-1.4 -2,-0.3 11,-0.2 -0.263 23.1-131.0 -61.2 139.5 21.4 8.7 -7.2 78 78 A E T 3 S+ 0 0 150 1,-0.3 -1,-0.1 9,-0.1 10,-0.1 0.823 101.9 51.0 -62.9 -28.9 23.3 10.2 -10.1 79 79 A N T 3 S+ 0 0 81 8,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.304 72.5 127.4 -96.5 13.4 20.3 11.9 -11.7 80 80 A A < + 0 0 2 -3,-1.4 8,-2.4 8,-0.2 2,-0.3 -0.540 39.0 175.4 -68.7 124.2 18.9 13.7 -8.6 81 81 A K B -R 87 0F 84 128,-0.3 130,-0.3 6,-0.3 2,-0.1 -0.981 31.6-122.5-133.4 155.5 18.5 17.4 -9.6 82 82 A W > - 0 0 6 4,-3.1 3,-2.1 -2,-0.3 106,-0.3 -0.360 45.5 -96.5 -80.7 170.8 17.3 20.7 -8.3 83 83 A S T 3 S+ 0 0 26 104,-2.6 105,-0.1 1,-0.3 -1,-0.1 0.654 123.5 61.7 -68.9 -12.1 14.5 22.6 -10.2 84 84 A D T 3 S- 0 0 84 103,-0.2 -1,-0.3 2,-0.1 104,-0.1 0.296 121.7-105.7 -92.9 7.8 17.1 24.8 -11.9 85 85 A G S < S+ 0 0 27 -3,-2.1 -2,-0.1 1,-0.3 0, 0.0 0.258 78.6 129.4 88.5 -7.4 18.6 21.6 -13.5 86 86 A T - 0 0 63 1,-0.1 -4,-3.1 -5,-0.1 -1,-0.3 -0.419 64.3 -94.4 -83.5 151.5 21.7 21.4 -11.4 87 87 A P B -R 81 0F 74 0, 0.0 2,-0.5 0, 0.0 -6,-0.3 -0.328 23.6-130.8 -65.7 141.1 22.7 18.2 -9.6 88 88 A V - 0 0 2 -8,-2.4 2,-0.3 -11,-0.2 -8,-0.2 -0.841 41.9-178.9 -83.7 125.0 21.8 17.5 -6.0 89 89 A T >> - 0 0 20 -2,-0.5 4,-1.0 1,-0.0 3,-0.8 -0.839 46.1-105.1-122.7 176.3 25.1 16.4 -4.5 90 90 A A H 3> S+ 0 0 0 51,-2.1 4,-2.1 -2,-0.3 5,-0.1 0.750 118.8 65.7 -66.4 -28.6 26.5 15.2 -1.1 91 91 A H H 3> S+ 0 0 90 50,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.843 96.2 56.5 -60.3 -35.5 28.0 18.7 -0.8 92 92 A D H <> S+ 0 0 27 -3,-0.8 4,-2.5 1,-0.2 75,-0.5 0.909 108.1 46.4 -60.5 -43.8 24.4 20.0 -0.6 93 93 A F H X S+ 0 0 0 -4,-1.0 4,-2.6 2,-0.2 5,-0.3 0.864 110.3 53.9 -67.8 -38.0 23.7 17.7 2.4 94 94 A V H X S+ 0 0 23 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.967 113.3 42.0 -57.6 -52.6 27.0 18.8 4.1 95 95 A Y H X S+ 0 0 36 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.940 116.0 50.9 -59.1 -49.0 26.1 22.5 3.8 96 96 A S H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.935 110.5 45.0 -61.4 -46.9 22.5 21.8 4.8 97 97 A W H X S+ 0 0 1 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.866 113.6 52.2 -67.0 -32.2 23.1 19.7 8.0 98 98 A Q H X S+ 0 0 35 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.921 108.9 49.6 -67.0 -40.6 25.8 22.3 9.0 99 99 A R H < S+ 0 0 34 -4,-2.3 6,-0.3 1,-0.2 -2,-0.2 0.922 109.6 52.4 -64.8 -40.1 23.3 25.1 8.6 100 100 A L H < S+ 0 0 0 -4,-2.8 7,-0.4 1,-0.2 -1,-0.2 0.907 112.6 44.6 -58.4 -44.1 20.7 23.2 10.6 101 101 A A H < S+ 0 0 0 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.793 89.5 102.5 -70.6 -29.5 23.3 22.7 13.5 102 102 A D >< - 0 0 51 -4,-1.7 3,-2.0 -3,-0.2 4,-0.5 -0.457 67.2-145.3 -64.3 121.3 24.5 26.3 13.4 103 103 A P G > S+ 0 0 60 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.806 96.6 68.5 -61.2 -27.1 23.0 28.3 16.3 104 104 A N G 3 S+ 0 0 150 1,-0.3 -2,-0.1 2,-0.1 -5,-0.1 0.823 95.5 56.4 -61.8 -25.8 22.9 31.5 14.1 105 105 A T G < S- 0 0 11 -3,-2.0 -1,-0.3 -6,-0.3 -5,-0.1 0.711 92.3-156.0 -73.4 -25.7 20.2 29.7 12.1 106 106 A A < - 0 0 79 -3,-1.4 -2,-0.1 -4,-0.5 -6,-0.1 0.880 18.9-175.2 51.8 45.3 18.2 29.2 15.3 107 107 A S > - 0 0 7 -7,-0.4 3,-1.8 -5,-0.4 4,-0.3 -0.544 31.8-141.1 -70.8 139.1 16.3 26.2 13.9 108 108 A P T 3 S+ 0 0 18 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.678 107.3 50.4 -65.2 -18.5 13.5 24.9 16.2 109 109 A Y T > + 0 0 1 -80,-0.4 3,-1.9 1,-0.1 4,-0.4 0.116 69.7 115.1-107.7 21.5 14.8 21.5 14.9 110 110 A A T X S+ 0 0 14 -3,-1.8 3,-1.6 1,-0.3 4,-0.4 0.922 74.5 60.5 -52.8 -41.2 18.5 22.0 15.7 111 111 A S T >> S+ 0 0 1 1,-0.3 4,-2.4 -4,-0.3 3,-0.6 0.579 78.3 85.7 -65.5 -7.1 18.3 19.2 18.2 112 112 A Y H <> S+ 0 0 3 -3,-1.9 4,-1.5 1,-0.3 -1,-0.3 0.889 89.2 54.1 -62.8 -32.3 17.2 16.7 15.5 113 113 A L H <>>S+ 0 0 2 -3,-1.6 5,-2.1 -4,-0.4 4,-0.5 0.797 107.1 49.5 -73.0 -22.4 21.0 16.3 15.0 114 114 A Q H <45S+ 0 0 15 -3,-0.6 3,-0.4 -4,-0.4 -2,-0.2 0.873 106.1 56.4 -75.1 -41.0 21.3 15.5 18.8 115 115 A Y H <5S+ 0 0 3 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.848 113.7 40.0 -59.3 -35.8 18.4 12.9 18.4 116 116 A G H <5S- 0 0 0 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.566 109.0-131.2 -86.2 -10.3 20.5 11.2 15.7 117 117 A H T <5 - 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