==== 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 16-NOV-98 1B7H . 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) . 19821.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 352 67.7 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 . 2 0.4 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 . 68 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 23.8 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 4 0 2 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 12 0, 0.0 2,-0.7 0, 0.0 511,-0.1 0.000 360.0 360.0 360.0 148.4 32.2 30.3 0.1 2 2 A D - 0 0 126 509,-0.4 495,-0.1 495,-0.0 511,-0.1 -0.879 360.0-160.7-118.3 88.3 29.7 27.7 -0.9 3 3 A V - 0 0 46 -2,-0.7 2,-0.2 1,-0.1 3,-0.0 -0.564 26.0-109.9 -74.8 134.7 26.6 29.6 -2.0 4 4 A P > - 0 0 60 0, 0.0 3,-2.6 0, 0.0 -1,-0.1 -0.453 33.0-110.1 -64.3 124.1 23.4 27.4 -2.0 5 5 A A T 3 S+ 0 0 111 1,-0.3 3,-0.1 -2,-0.2 -3,-0.0 -0.428 109.0 37.9 -55.0 125.8 22.2 26.7 -5.6 6 6 A G T 3 S+ 0 0 75 1,-0.4 2,-0.3 -3,-0.0 -1,-0.3 -0.137 88.1 109.8 119.9 -35.7 19.0 28.8 -5.7 7 7 A V < - 0 0 45 -3,-2.6 -1,-0.4 1,-0.0 2,-0.4 -0.546 59.3-143.1 -77.6 142.2 20.1 31.8 -3.7 8 8 A Q - 0 0 134 -2,-0.3 508,-2.6 508,-0.1 2,-0.3 -0.841 17.0-132.5 -96.9 132.5 20.6 35.0 -5.6 9 9 A L B -A 515 0A 68 -2,-0.4 506,-0.3 506,-0.2 4,-0.1 -0.622 18.6-112.0 -92.3 150.5 23.5 37.3 -4.6 10 10 A A - 0 0 17 504,-2.4 504,-0.1 -2,-0.3 506,-0.1 -0.217 24.1-120.1 -66.3 164.8 23.4 41.0 -3.9 11 11 A D S S+ 0 0 157 504,-0.1 2,-0.5 1,-0.1 -1,-0.1 0.900 101.2 51.9 -74.2 -49.8 25.1 43.4 -6.3 12 12 A K S S- 0 0 143 2,-0.1 2,-0.8 206,-0.0 -2,-0.1 -0.818 71.8-161.7 -92.4 116.5 27.4 45.0 -3.7 13 13 A Q + 0 0 13 -2,-0.5 206,-2.4 204,-0.1 207,-1.3 -0.749 40.8 134.0-105.6 77.0 29.3 42.3 -1.8 14 14 A T E -b 220 0B 39 -2,-0.8 2,-0.4 205,-0.2 207,-0.2 -0.959 33.6-166.8-126.1 145.7 30.4 44.3 1.2 15 15 A L E -b 221 0B 1 205,-2.0 207,-2.2 -2,-0.3 2,-0.5 -0.986 8.6-157.1-138.8 142.8 30.1 43.4 4.8 16 16 A V E +b 222 0B 29 -2,-0.4 226,-2.3 205,-0.2 227,-1.5 -0.996 16.9 179.2-126.7 122.8 30.5 45.4 8.0 17 17 A R E -bc 223 243B 0 205,-3.5 207,-2.4 -2,-0.5 2,-0.3 -0.981 25.9-132.1-123.4 138.3 31.4 43.7 11.3 18 18 A N E -b 224 0B 2 225,-2.7 228,-0.1 -2,-0.4 205,-0.0 -0.670 16.7-166.3 -80.4 147.6 32.0 45.0 14.7 19 19 A N - 0 0 3 205,-3.2 2,-1.1 -2,-0.3 -1,-0.1 0.122 32.5-119.6-125.1 17.4 35.2 43.6 16.3 20 20 A G S S- 0 0 9 206,-0.3 2,-0.3 204,-0.1 377,-0.1 -0.065 79.1 -0.8 78.6 -43.7 34.9 44.5 20.0 21 21 A S S S- 0 0 14 -2,-1.1 2,-0.3 203,-0.3 205,-0.2 -0.934 90.5 -69.1-165.4 174.4 38.0 46.7 20.3 22 22 A E - 0 0 31 203,-0.3 376,-0.2 -2,-0.3 14,-0.1 -0.621 63.6-109.5 -76.3 126.5 41.0 48.1 18.5 23 23 A V - 0 0 5 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 -0.272 10.7-131.6 -60.7 155.4 43.4 45.2 17.7 24 24 A Q S S- 0 0 28 1,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.781 80.4 -36.4 -66.3 -41.1 46.6 44.9 19.5 25 25 A S - 0 0 21 1,-0.1 -1,-0.3 155,-0.0 0, 0.0 -0.955 40.7-126.9-170.7 170.8 48.4 44.4 16.2 26 26 A L S S+ 0 0 7 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.1 0.225 77.6 108.6-115.5 -2.1 48.0 42.7 12.8 27 27 A D > - 0 0 8 1,-0.2 3,-2.3 150,-0.1 4,-0.4 -0.752 68.9-142.5 -80.6 116.8 51.3 40.8 13.1 28 28 A P T 3 S+ 0 0 0 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.741 99.5 55.5 -48.3 -31.0 50.4 37.2 13.7 29 29 A H T 3 S+ 0 0 0 1,-0.2 80,-0.4 135,-0.1 81,-0.1 0.578 107.8 47.8 -81.5 -7.4 53.3 36.8 16.1 30 30 A K S < S+ 0 0 76 -3,-2.3 2,-0.3 77,-0.2 -1,-0.2 0.301 94.2 91.0-113.6 5.2 52.2 39.7 18.4 31 31 A I + 0 0 3 -3,-0.5 78,-0.1 -4,-0.4 -5,-0.0 -0.706 30.4 160.8-106.3 159.0 48.5 38.9 18.8 32 32 A E + 0 0 8 -2,-0.3 488,-2.5 488,-0.1 2,-0.2 0.480 48.9 83.0-142.3 -9.1 46.5 36.9 21.4 33 33 A G B > S-g 520 0C 0 486,-0.3 4,-2.4 1,-0.1 488,-0.2 -0.563 77.5-109.3-109.1-179.7 42.8 37.8 21.3 34 34 A V H > S+ 0 0 3 486,-2.8 4,-2.4 2,-0.2 5,-0.2 0.928 116.3 50.3 -65.8 -46.7 39.6 37.2 19.6 35 35 A P H > S+ 0 0 2 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.946 113.5 46.9 -58.0 -51.9 39.4 40.7 17.9 36 36 A E H > S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.909 113.2 48.1 -57.1 -42.7 43.0 40.2 16.6 37 37 A S H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.834 102.9 62.0 -78.1 -22.7 42.3 36.6 15.4 38 38 A N H X S+ 0 0 2 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.953 112.9 37.5 -64.4 -41.3 39.0 37.7 13.6 39 39 A V H >X S+ 0 0 0 -4,-1.7 4,-1.3 1,-0.2 3,-0.8 0.870 112.0 59.3 -70.4 -46.1 41.1 40.0 11.4 40 40 A S H 3X S+ 0 0 5 -4,-1.9 4,-3.1 1,-0.2 3,-0.4 0.894 97.4 59.0 -54.8 -41.1 44.0 37.6 11.2 41 41 A R H 3< S+ 0 0 11 -4,-2.3 149,-0.4 1,-0.2 -1,-0.2 0.787 107.0 47.5 -62.6 -27.1 42.0 34.7 9.6 42 42 A D H << S+ 0 0 1 -3,-0.8 149,-2.4 -4,-0.6 -1,-0.2 0.771 122.6 35.1 -82.6 -24.3 41.0 37.0 6.6 43 43 A L H < S+ 0 0 0 -4,-1.3 146,-2.5 -3,-0.4 145,-1.5 0.793 116.7 37.8 -96.6 -39.8 44.6 38.1 6.1 44 44 A F < - 0 0 4 -4,-3.1 2,-0.5 144,-0.2 -1,-0.2 -0.974 61.6-162.2-122.0 137.7 47.1 35.3 6.9 45 45 A E - 0 0 9 -2,-0.4 4,-0.1 121,-0.1 115,-0.1 -0.992 6.7-168.0-123.0 123.6 46.6 31.6 6.1 46 46 A G - 0 0 4 -2,-0.5 14,-2.7 2,-0.4 15,-0.3 0.079 49.4 -69.3 -89.1-163.6 48.6 28.8 7.8 47 47 A L S S+ 0 0 1 117,-0.3 12,-1.9 112,-0.3 14,-1.8 0.859 117.0 22.7 -59.4 -46.1 48.8 25.1 6.8 48 48 A L E -N 58 0D 1 111,-0.6 -2,-0.4 10,-0.2 2,-0.3 -0.864 65.9-168.2-124.8 155.9 45.2 24.3 7.8 49 49 A I E -N 57 0D 10 8,-2.3 8,-2.8 -2,-0.3 2,-0.4 -0.909 29.7-102.6-131.9 165.6 42.1 26.3 8.2 50 50 A S E -N 56 0D 4 -2,-0.3 2,-0.1 6,-0.2 452,-0.0 -0.758 28.7-138.3 -87.5 143.3 38.6 25.6 9.7 51 51 A D > - 0 0 52 4,-2.4 3,-2.8 -2,-0.4 455,-0.1 -0.390 45.1 -81.7 -87.3 179.6 35.7 24.8 7.4 52 52 A V T 3 S+ 0 0 63 1,-0.3 449,-0.3 2,-0.1 450,-0.3 0.602 132.8 50.4 -60.8 -12.9 32.3 26.3 8.2 53 53 A E T 3 S- 0 0 90 2,-0.1 -1,-0.3 448,-0.1 -3,-0.0 0.253 122.4-103.4-104.7 11.7 31.6 23.5 10.8 54 54 A G S < S+ 0 0 21 -3,-2.8 -2,-0.1 1,-0.2 448,-0.0 0.559 72.7 140.9 86.0 6.1 34.9 24.0 12.6 55 55 A H - 0 0 99 1,-0.1 -4,-2.4 -4,-0.0 -1,-0.2 -0.650 61.4-101.7 -88.0 146.1 36.8 21.0 11.2 56 56 A P E +N 50 0D 37 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.390 54.3 167.9 -61.8 134.7 40.4 21.2 10.2 57 57 A S E -N 49 0D 22 -8,-2.8 -8,-2.3 -2,-0.1 4,-0.1 -0.890 41.6 -60.4-141.7 173.1 40.6 21.5 6.4 58 58 A P E +N 48 0D 55 0, 0.0 -10,-0.2 0, 0.0 4,-0.2 -0.271 53.8 158.3 -65.7 129.9 43.2 22.3 3.8 59 59 A G S S- 0 0 0 -12,-1.9 -12,-0.2 2,-0.9 -11,-0.2 0.210 81.0 -25.1-117.7-111.9 44.8 25.8 4.0 60 60 A V S S+ 0 0 0 -14,-2.7 17,-2.4 -12,-0.1 2,-0.6 0.887 134.6 73.2 -69.5 -30.9 48.2 26.4 2.3 61 61 A A E -O 76 0E 0 -14,-1.8 -2,-0.9 -15,-0.3 15,-0.3 -0.714 62.8-174.8 -85.1 116.5 48.6 22.6 2.8 62 62 A E E S+ 0 0 101 13,-2.1 2,-0.3 -2,-0.6 -1,-0.2 0.749 73.4 4.6 -86.4 -25.4 46.4 20.8 0.3 63 63 A K E -O 75 0E 116 12,-1.2 12,-3.2 2,-0.0 2,-0.3 -0.975 68.0-179.4-155.1 150.6 47.3 17.4 1.9 64 64 A W E -O 74 0E 67 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.965 7.5-166.2-144.5 165.2 49.3 16.0 4.8 65 65 A E E -O 73 0E 79 8,-2.1 8,-2.9 -2,-0.3 2,-0.3 -0.953 10.1-144.7-139.3 171.5 50.5 12.8 6.6 66 66 A N E -O 72 0E 63 -2,-0.3 2,-0.6 6,-0.2 6,-0.2 -0.984 8.9-143.3-140.2 151.3 52.1 11.8 10.0 67 67 A K E >> S-O 71 0E 129 4,-2.4 3,-2.1 -2,-0.3 4,-1.3 -0.958 89.2 -29.3-112.2 108.4 54.5 9.2 11.2 68 68 A D T 34 S- 0 0 103 -2,-0.6 -1,-0.1 1,-0.3 4,-0.1 0.699 107.9 -76.0 60.1 18.1 53.5 7.9 14.7 69 69 A F T 34 S+ 0 0 88 2,-0.2 83,-2.6 82,-0.2 -1,-0.3 0.676 128.6 88.8 69.1 17.2 51.9 11.3 15.3 70 70 A K T <4 S+ 0 0 87 -3,-2.1 78,-3.3 1,-0.3 2,-0.4 0.641 81.3 44.2-114.1 -25.6 55.5 12.5 15.8 71 71 A V E < -OP 67 147E 38 -4,-1.3 -4,-2.4 76,-0.2 2,-0.4 -0.934 69.3-167.2-128.9 113.2 56.6 13.6 12.3 72 72 A W E -OP 66 146E 4 74,-2.1 74,-2.9 -2,-0.4 2,-0.5 -0.843 3.4-162.3-107.0 130.4 54.1 15.6 10.2 73 73 A T E -OP 65 145E 25 -8,-2.9 -8,-2.1 -2,-0.4 2,-0.5 -0.946 5.0-164.5-119.9 120.0 54.6 16.2 6.5 74 74 A F E -OP 64 144E 0 70,-3.1 70,-2.7 -2,-0.5 2,-0.9 -0.896 9.0-151.9-108.2 122.5 52.6 19.0 4.8 75 75 A H E -OP 63 143E 53 -12,-3.2 -13,-2.1 -2,-0.5 -12,-1.2 -0.855 17.8-147.9 -98.3 106.1 52.3 19.2 1.1 76 76 A L E -O 61 0E 6 66,-2.3 -15,-0.2 -2,-0.9 -16,-0.1 -0.545 21.6-108.0 -75.7 135.8 51.9 22.8 0.1 77 77 A R > - 0 0 21 -17,-2.4 3,-1.4 -2,-0.3 11,-0.2 -0.335 22.9-128.2 -63.8 138.0 49.8 23.6 -2.9 78 78 A E T 3 S+ 0 0 151 1,-0.3 -1,-0.1 -2,-0.1 10,-0.1 0.813 102.9 51.8 -65.2 -22.2 51.8 24.7 -5.9 79 79 A N T 3 S+ 0 0 87 8,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.415 72.0 128.9 -98.5 11.9 49.7 27.9 -6.5 80 80 A A < + 0 0 4 -3,-1.4 8,-2.4 8,-0.2 2,-0.3 -0.337 36.9 174.8 -66.8 131.9 49.8 29.5 -2.9 81 81 A K B -R 87 0F 87 128,-0.3 130,-0.2 6,-0.3 2,-0.2 -0.930 32.5-117.2-138.0 164.8 50.9 33.1 -3.1 82 82 A W > - 0 0 5 4,-2.8 3,-2.4 -2,-0.3 106,-0.2 -0.565 46.1 -99.1 -89.6 162.4 51.4 36.3 -1.2 83 83 A S T 3 S+ 0 0 23 104,-3.0 126,-0.1 1,-0.3 105,-0.1 0.655 124.2 61.3 -62.6 -14.7 49.3 39.4 -2.0 84 84 A D T 3 S- 0 0 78 103,-0.1 -1,-0.3 2,-0.1 104,-0.1 0.169 121.8-105.7 -90.9 6.6 52.4 40.7 -4.0 85 85 A G S < S+ 0 0 29 -3,-2.4 -2,-0.1 1,-0.3 0, 0.0 0.321 77.4 134.9 84.0 -8.1 52.2 37.7 -6.4 86 86 A T - 0 0 62 1,-0.1 -4,-2.8 -5,-0.1 -1,-0.3 -0.307 61.4 -98.7 -74.0 154.5 55.2 35.9 -4.8 87 87 A P B -R 81 0F 82 0, 0.0 2,-0.6 0, 0.0 -6,-0.3 -0.414 23.9-133.6 -73.2 142.9 55.1 32.2 -4.1 88 88 A V - 0 0 2 -8,-2.4 2,-0.2 -11,-0.2 -8,-0.2 -0.946 37.0-178.5 -97.5 120.5 54.3 30.9 -0.5 89 89 A T >> - 0 0 20 -2,-0.6 3,-1.3 1,-0.1 4,-0.9 -0.679 47.2-103.4-116.2 175.6 56.8 28.2 0.2 90 90 A A H 3> S+ 0 0 0 51,-2.5 4,-2.2 1,-0.3 3,-0.3 0.828 120.2 66.4 -66.1 -23.1 57.7 25.7 2.9 91 91 A H H 3> S+ 0 0 94 50,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.774 93.3 57.2 -64.2 -32.1 60.6 28.2 3.6 92 92 A D H <> S+ 0 0 26 -3,-1.3 4,-2.3 2,-0.2 75,-0.4 0.890 108.0 47.3 -68.1 -33.3 58.0 30.9 4.7 93 93 A F H X S+ 0 0 0 -4,-0.9 4,-2.7 -3,-0.3 5,-0.3 0.894 110.9 52.6 -71.2 -41.8 56.7 28.4 7.4 94 94 A V H X S+ 0 0 23 -4,-2.2 4,-1.9 1,-0.2 5,-0.2 0.961 113.7 41.4 -57.5 -56.0 60.2 27.6 8.5 95 95 A Y H X S+ 0 0 41 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.932 115.6 51.5 -58.8 -44.2 61.1 31.3 8.9 96 96 A S H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.920 110.3 45.0 -65.8 -45.0 57.8 32.1 10.5 97 97 A W H X S+ 0 0 2 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.858 112.8 53.2 -67.9 -34.9 57.7 29.4 13.2 98 98 A Q H X S+ 0 0 40 -4,-1.9 4,-2.4 -5,-0.3 -1,-0.2 0.892 110.0 47.8 -61.9 -42.7 61.4 30.3 14.0 99 99 A R H < S+ 0 0 39 -4,-2.2 6,-0.3 -5,-0.2 -2,-0.2 0.944 111.8 50.2 -63.8 -38.8 60.3 34.0 14.5 100 100 A L H < S+ 0 0 0 -4,-2.6 7,-0.4 1,-0.2 -2,-0.2 0.948 113.8 45.8 -62.5 -44.3 57.4 32.8 16.7 101 101 A A H < S+ 0 0 0 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.857 89.6 102.3 -67.9 -35.8 59.8 30.7 18.7 102 102 A D >X - 0 0 49 -4,-2.4 3,-1.9 -5,-0.2 4,-0.6 -0.280 67.7-144.3 -53.0 124.5 62.5 33.4 19.1 103 103 A P G >4 S+ 0 0 69 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.778 98.0 68.5 -58.9 -22.8 62.4 35.1 22.5 104 104 A N G 34 S+ 0 0 148 1,-0.3 -2,-0.1 2,-0.1 -5,-0.1 0.848 93.9 56.8 -71.6 -28.1 63.4 38.4 20.7 105 105 A T G <4 S- 0 0 11 -3,-1.9 -1,-0.3 -6,-0.3 -3,-0.1 0.733 91.1-155.5 -69.6 -24.0 59.9 38.4 19.1 106 106 A A << - 0 0 78 -3,-0.9 -2,-0.1 -4,-0.6 -6,-0.1 0.861 20.7-177.1 55.3 38.6 58.3 38.3 22.6 107 107 A S > - 0 0 6 -5,-0.4 3,-1.7 -7,-0.4 4,-0.3 -0.491 33.6-139.8 -69.8 141.6 55.1 36.7 21.2 108 108 A P T 3 S+ 0 0 15 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.681 108.3 49.3 -64.0 -24.0 52.4 36.1 23.7 109 109 A Y T > + 0 0 1 -80,-0.4 3,-2.6 1,-0.1 4,-0.4 0.125 70.0 115.9-103.8 24.4 51.9 32.8 21.8 110 110 A A T X S+ 0 0 14 -3,-1.7 3,-1.3 1,-0.3 4,-0.4 0.898 75.3 60.3 -54.9 -40.3 55.6 31.7 21.7 111 111 A S T >> S+ 0 0 2 -4,-0.3 4,-2.3 1,-0.2 3,-0.5 0.600 78.2 85.7 -67.7 -0.8 54.4 28.7 23.8 112 112 A Y H <> S+ 0 0 3 -3,-2.6 4,-1.0 1,-0.3 -1,-0.2 0.817 89.6 52.7 -67.3 -32.6 52.0 27.6 21.1 113 113 A L H <4>S+ 0 0 2 -3,-1.3 5,-2.1 -4,-0.4 -1,-0.3 0.827 107.0 52.6 -69.8 -23.7 55.1 25.7 19.7 114 114 A Q H X45S+ 0 0 30 -3,-0.5 3,-0.9 -4,-0.4 -2,-0.2 0.850 105.9 53.6 -71.4 -42.1 55.5 24.1 23.2 115 115 A Y H 3<5S+ 0 0 2 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.849 110.1 47.4 -61.7 -30.3 51.8 23.0 23.1 116 116 A G T 3<5S- 0 0 0 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.591 107.4-134.4 -89.9 -7.0 52.6 21.4 19.8 117 117 A H T < 5 - 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