==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 11-MAY-01 1IN0 . COMPND 2 MOLECULE: YAJQ PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR A.TEPLYAKOV,G.L.GILLILAND,STRUCTURE 2 FUNCTION PROJECT (S2F) . 324 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18642.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 263 81.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 80 24.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 . 45 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 32.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 0 0 0 0 0 0 0 2 2 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 2 2 4 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 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 2 A P 0 0 33 0, 0.0 132,-2.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 169.4 25.7 28.4 -31.1 2 3 A S E -AB 132 161A 13 159,-2.3 159,-2.3 130,-0.2 2,-0.3 -0.967 360.0-162.2-153.9 175.2 24.2 27.9 -27.7 3 4 A F E -A 131 0A 1 128,-1.5 128,-3.5 -2,-0.3 2,-0.4 -0.976 23.7-120.0-159.6 147.7 24.1 29.1 -24.1 4 5 A D E -AB 130 158A 4 154,-2.9 154,-1.3 -2,-0.3 2,-0.5 -0.731 10.9-146.7 -93.8 137.8 22.8 27.6 -20.8 5 6 A I E +AB 129 157A 0 124,-3.2 124,-1.8 -2,-0.4 2,-0.3 -0.939 32.8 173.9 -97.8 130.1 20.1 29.1 -18.6 6 7 A V E - B 0 156A 8 150,-2.3 150,-2.8 -2,-0.5 2,-0.3 -0.889 31.5-154.2-133.8 166.1 21.0 28.3 -15.0 7 8 A S + 0 0 2 120,-0.4 93,-4.4 -2,-0.3 2,-0.3 -0.762 28.8 171.9-141.7 87.0 19.7 29.1 -11.4 8 9 A E - 0 0 106 -2,-0.3 2,-0.5 91,-0.2 90,-0.1 -0.782 20.4-154.0-104.6 148.6 22.5 28.8 -9.0 9 10 A I - 0 0 24 -2,-0.3 2,-1.3 88,-0.1 3,-0.1 -0.959 12.8-141.2-122.5 125.7 22.5 29.7 -5.3 10 11 A T >> - 0 0 64 -2,-0.5 4,-1.2 1,-0.2 3,-0.9 -0.747 11.6-163.8 -87.3 95.0 25.7 30.6 -3.6 11 12 A L H 3> S+ 0 0 46 -2,-1.3 4,-2.7 1,-0.3 5,-0.3 0.793 86.9 65.2 -39.9 -36.4 25.1 29.0 -0.2 12 13 A H H 3> S+ 0 0 127 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.964 103.8 45.1 -57.1 -50.1 28.1 31.1 1.1 13 14 A E H <> S+ 0 0 82 -3,-0.9 4,-1.8 1,-0.2 -1,-0.3 0.832 112.6 52.7 -66.5 -28.3 26.0 34.2 0.5 14 15 A V H X S+ 0 0 9 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.846 106.4 49.8 -73.4 -38.0 23.0 32.5 2.0 15 16 A R H X S+ 0 0 74 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.932 110.9 53.5 -67.8 -37.0 24.7 31.5 5.3 16 17 A N H X S+ 0 0 49 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.945 107.8 48.4 -63.1 -46.3 25.8 35.1 5.4 17 18 A A H X S+ 0 0 8 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.862 110.7 51.1 -61.4 -42.4 22.3 36.4 5.0 18 19 A V H X S+ 0 0 11 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.896 108.4 52.1 -65.8 -37.9 21.0 34.0 7.8 19 20 A E H X S+ 0 0 93 -4,-2.4 4,-2.3 2,-0.2 3,-0.3 0.977 110.8 47.5 -61.7 -52.6 23.7 35.2 10.2 20 21 A N H X S+ 0 0 10 -4,-2.4 4,-2.1 1,-0.3 5,-0.2 0.887 111.6 51.1 -52.2 -47.0 22.6 38.8 9.5 21 22 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.3 0.875 108.5 51.1 -62.7 -38.2 19.0 37.8 10.0 22 23 A N H X S+ 0 0 60 -4,-2.6 4,-2.1 -3,-0.3 -1,-0.2 0.847 108.3 53.0 -68.9 -31.4 19.8 36.1 13.4 23 24 A R H < S+ 0 0 151 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.896 112.1 44.5 -68.9 -38.1 21.6 39.3 14.5 24 25 A V H >< S+ 0 0 12 -4,-2.1 3,-1.9 -5,-0.2 4,-0.3 0.915 112.2 53.5 -65.4 -43.4 18.5 41.4 13.7 25 26 A L H >< S+ 0 0 13 -4,-2.1 3,-1.1 1,-0.3 -2,-0.2 0.855 101.5 57.9 -60.9 -40.0 16.3 38.9 15.3 26 27 A S T 3< S+ 0 0 95 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.336 108.8 46.3 -74.1 1.3 18.2 38.9 18.6 27 28 A T T < S+ 0 0 37 -3,-1.9 165,-3.9 -5,-0.1 2,-0.7 0.211 79.7 124.0-122.2 5.8 17.7 42.7 19.0 28 29 A R B X -D 191 0B 15 -3,-1.1 3,-1.2 -4,-0.3 4,-0.4 -0.587 50.5-155.3 -76.8 114.2 13.9 42.7 18.2 29 30 A Y G > S+ 0 0 93 161,-3.4 3,-1.4 -2,-0.7 -1,-0.2 0.918 94.0 55.2 -52.8 -41.6 12.0 44.3 21.0 30 31 A D G 3 S+ 0 0 57 160,-0.4 -1,-0.3 1,-0.3 161,-0.1 0.657 105.1 52.1 -76.7 -13.3 8.9 42.4 20.0 31 32 A F G X S+ 0 0 12 -3,-1.2 3,-2.1 159,-0.2 -1,-0.3 0.287 75.6 127.2-100.6 0.6 10.6 39.1 20.2 32 33 A R T < S+ 0 0 143 -3,-1.4 3,-0.1 -4,-0.4 -6,-0.0 -0.489 84.6 10.5 -59.6 127.3 12.0 39.5 23.7 33 34 A G T 3 S+ 0 0 88 1,-0.2 2,-0.4 -2,-0.2 -1,-0.3 0.635 108.8 116.1 81.5 14.6 10.9 36.4 25.7 34 35 A V < - 0 0 31 -3,-2.1 2,-0.2 2,-0.0 -1,-0.2 -0.972 69.8-121.2-122.9 132.4 9.7 34.7 22.5 35 36 A E + 0 0 105 -2,-0.4 17,-0.7 -3,-0.1 2,-0.3 -0.480 45.3 156.8 -67.5 133.1 11.0 31.5 20.9 36 37 A A E -E 51 0C 22 -2,-0.2 2,-0.4 15,-0.2 15,-0.2 -0.897 14.9-177.7-161.6 118.4 12.1 32.4 17.4 37 38 A V E -E 50 0C 52 13,-2.9 13,-3.0 -2,-0.3 2,-0.4 -0.986 13.0-175.2-125.3 136.4 14.7 30.4 15.4 38 39 A I E +E 49 0C 3 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.926 24.2 172.1-126.4 95.7 16.1 31.1 11.8 39 40 A E E -E 48 0C 100 9,-2.9 9,-3.4 -2,-0.4 2,-0.5 -0.888 26.2-145.4-116.4 145.9 18.3 28.1 10.9 40 41 A L E -E 47 0C 29 -2,-0.4 2,-0.9 7,-0.2 7,-0.3 -0.892 2.2-160.0 -99.1 128.1 20.0 27.2 7.7 41 42 A N E >> -E 46 0C 60 5,-3.7 4,-1.9 -2,-0.5 5,-1.5 -0.849 11.8-176.0-105.3 92.3 20.3 23.5 6.8 42 43 A E T 45S+ 0 0 94 -2,-0.9 -1,-0.2 1,-0.2 -31,-0.1 0.832 81.8 50.6 -60.0 -29.7 23.2 23.8 4.3 43 44 A K T 45S+ 0 0 179 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.905 117.1 39.6 -74.0 -38.8 23.0 20.1 3.5 44 45 A N T 45S- 0 0 107 2,-0.1 -2,-0.2 -3,-0.1 -1,-0.2 0.657 102.4-126.9 -88.4 -12.2 19.3 20.2 2.9 45 46 A E T <5 + 0 0 68 -4,-1.9 52,-2.5 1,-0.3 2,-0.3 0.862 69.3 124.8 69.0 37.0 19.2 23.6 1.1 46 47 A T E < -EF 41 96C 8 -5,-1.5 -5,-3.7 50,-0.2 2,-0.5 -0.915 54.3-151.7-132.5 151.6 16.5 24.7 3.5 47 48 A I E -EF 40 95C 4 48,-2.4 48,-3.7 -2,-0.3 2,-0.6 -0.991 19.2-155.7-122.0 113.7 16.0 27.6 6.0 48 49 A K E -EF 39 94C 58 -9,-3.4 -9,-2.9 -2,-0.5 2,-0.5 -0.876 8.6-170.0 -99.8 125.2 13.8 26.6 8.8 49 50 A I E +EF 38 93C 0 44,-2.3 44,-1.4 -2,-0.6 2,-0.4 -0.942 9.3 176.3-108.7 128.8 12.0 29.4 10.6 50 51 A T E +EF 37 92C 17 -13,-3.0 -13,-2.9 -2,-0.5 2,-0.3 -0.986 12.4 129.8-137.2 133.2 10.2 28.7 13.9 51 52 A T E -EF 36 91C 0 40,-2.6 40,-2.4 -2,-0.4 -15,-0.2 -0.888 62.2 -73.5-153.3-158.2 8.3 30.9 16.4 52 53 A E S S+ 0 0 43 -17,-0.7 2,-0.3 -2,-0.3 3,-0.1 0.608 99.3 11.0 -90.9 -4.2 5.1 31.3 18.4 53 54 A S > - 0 0 37 38,-0.2 4,-2.9 1,-0.1 5,-0.2 -0.990 69.7-108.5-167.1 158.8 2.5 32.3 15.8 54 55 A D H > S+ 0 0 72 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.884 120.5 55.2 -55.2 -36.7 1.8 32.6 12.1 55 56 A F H > S+ 0 0 126 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.982 107.2 47.2 -59.0 -51.8 2.0 36.3 12.6 56 57 A Q H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.908 108.7 57.1 -59.3 -38.9 5.5 36.1 14.1 57 58 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 3,-0.4 0.976 105.1 50.1 -53.5 -53.0 6.5 33.8 11.2 58 59 A E H X S+ 0 0 115 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.883 110.1 52.9 -50.5 -41.5 5.5 36.5 8.7 59 60 A Q H X S+ 0 0 25 -4,-2.4 4,-1.2 1,-0.2 -1,-0.3 0.875 107.4 49.0 -64.6 -36.2 7.6 38.8 10.8 60 61 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 -3,-0.4 3,-0.4 0.910 107.3 57.3 -69.1 -35.0 10.6 36.5 10.6 61 62 A I H X S+ 0 0 23 -4,-2.8 4,-2.7 1,-0.3 5,-0.4 0.938 102.3 53.5 -61.2 -41.7 10.0 36.3 6.8 62 63 A E H X S+ 0 0 97 -4,-2.3 4,-1.8 1,-0.2 -1,-0.3 0.845 108.1 51.4 -59.3 -34.0 10.4 40.1 6.5 63 64 A I H X S+ 0 0 10 -4,-1.2 4,-2.3 -3,-0.4 -1,-0.2 0.939 110.0 49.0 -64.3 -51.5 13.7 39.8 8.3 64 65 A L H >X S+ 0 0 7 -4,-2.1 4,-2.1 2,-0.3 3,-1.0 0.977 114.3 43.7 -49.7 -61.3 15.0 37.1 6.0 65 66 A I H 3X S+ 0 0 30 -4,-2.7 4,-2.3 1,-0.3 -1,-0.2 0.845 111.4 56.3 -54.7 -39.0 14.0 39.1 2.9 66 67 A G H 3X S+ 0 0 12 -4,-1.8 4,-1.3 -5,-0.4 -1,-0.3 0.876 108.2 48.0 -65.7 -31.4 15.4 42.1 4.6 67 68 A S H S+ 0 0 5 -4,-2.1 5,-2.7 1,-0.2 4,-0.3 0.965 107.9 52.6 -62.4 -45.7 18.8 39.0 1.2 69 70 A I H ><5S+ 0 0 40 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.901 109.9 47.6 -53.4 -45.1 18.4 42.7 0.2 70 71 A K H 3<5S+ 0 0 60 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.871 117.3 42.5 -65.1 -36.2 21.4 43.7 2.4 71 72 A R T 3<5S- 0 0 83 -4,-2.0 -1,-0.3 2,-0.1 -2,-0.2 0.307 113.9-119.7 -91.7 9.3 23.4 40.8 0.9 72 73 A G T < 5 + 0 0 65 -3,-1.3 2,-0.4 -4,-0.3 -3,-0.2 0.781 65.2 145.5 55.0 29.3 22.1 41.6 -2.6 73 74 A I < - 0 0 25 -5,-2.7 2,-0.6 -6,-0.2 -1,-0.2 -0.878 56.2-115.1 -92.9 135.5 20.6 38.1 -2.8 74 75 A E > - 0 0 125 -2,-0.4 3,-2.5 1,-0.1 4,-0.2 -0.599 16.8-145.4 -77.8 117.1 17.3 38.0 -4.7 75 76 A H G > S+ 0 0 83 -2,-0.6 3,-3.3 1,-0.3 -1,-0.1 0.802 92.5 72.6 -47.7 -39.4 14.5 37.0 -2.3 76 77 A S G 3 S+ 0 0 39 1,-0.3 -1,-0.3 3,-0.1 -2,-0.0 0.683 78.7 77.1 -63.1 -12.9 12.7 35.0 -5.0 77 78 A S G < S+ 0 0 8 -3,-2.5 21,-2.3 76,-0.1 2,-0.5 0.659 82.1 86.2 -70.0 -5.4 15.4 32.4 -4.6 78 79 A L E < -G 97 0C 13 -3,-3.3 2,-0.8 19,-0.2 19,-0.2 -0.829 68.3-156.1 -98.4 131.3 13.5 31.5 -1.5 79 80 A D E -G 96 0C 79 17,-3.4 17,-2.1 -2,-0.5 -3,-0.1 -0.852 20.0-175.0 -99.9 93.9 10.6 29.0 -1.8 80 81 A I - 0 0 43 -2,-0.8 15,-0.1 15,-0.2 -2,-0.0 -0.851 21.4-128.3-101.8 118.8 8.5 29.9 1.2 81 82 A P - 0 0 45 0, 0.0 -1,-0.0 0, 0.0 14,-0.0 -0.245 8.3-135.6 -61.9 150.6 5.4 27.7 1.9 82 83 A A S S+ 0 0 96 2,-0.0 2,-0.3 11,-0.0 -2,-0.0 0.860 86.0 55.5 -76.2 -33.9 2.1 29.4 2.3 83 84 A E S S- 0 0 164 1,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.708 75.9-135.4-100.4 152.5 1.1 27.3 5.3 84 85 A S - 0 0 29 -2,-0.3 2,-0.6 9,-0.1 9,-0.2 -0.702 16.3-125.4-102.8 149.8 2.9 26.7 8.7 85 86 A E E -H 92 0C 60 7,-1.7 7,-1.3 -2,-0.3 2,-0.6 -0.884 27.1-143.7 -89.3 114.4 3.4 23.3 10.4 86 87 A H E +H 91 0C 106 -2,-0.6 2,-0.5 5,-0.2 5,-0.3 -0.668 21.4 178.0 -93.7 119.6 2.0 23.6 14.1 87 88 A H E > -H 90 0C 118 3,-4.1 3,-3.5 -2,-0.6 2,-0.1 -0.951 59.0 -62.2-122.8 106.2 4.0 21.6 16.7 88 89 A G T 3 S- 0 0 69 -2,-0.5 0, 0.0 1,-0.3 0, 0.0 -0.311 123.4 -12.2 57.2-116.4 2.7 22.0 20.2 89 90 A K T 3 S+ 0 0 136 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.3 0.502 125.8 87.2 -85.4 -9.9 3.1 25.7 21.0 90 91 A L E < - H 0 87C 38 -3,-3.5 -3,-4.1 -40,-0.0 2,-0.4 -0.758 52.4-166.0-107.0 153.3 5.2 26.3 17.9 91 92 A Y E +FH 51 86C 61 -40,-2.4 -40,-2.6 -2,-0.3 2,-0.3 -0.952 20.1 165.1-124.8 136.8 4.7 27.1 14.2 92 93 A S E -FH 50 85C 4 -7,-1.3 -7,-1.7 -2,-0.4 2,-0.3 -0.818 24.0-149.8-144.9-179.7 7.3 26.8 11.5 93 94 A K E -F 49 0C 22 -44,-1.4 -44,-2.3 -2,-0.3 2,-0.7 -0.929 17.4-136.3-155.3 134.6 7.9 26.7 7.8 94 95 A E E -F 48 0C 75 -2,-0.3 2,-0.6 -46,-0.2 -46,-0.2 -0.923 24.5-155.9 -92.4 108.5 10.7 24.9 5.9 95 96 A I E -F 47 0C 0 -48,-3.7 -48,-2.4 -2,-0.7 2,-0.2 -0.878 9.4-142.1 -91.8 118.1 11.8 27.5 3.3 96 97 A K E -FG 46 79C 110 -17,-2.1 -17,-3.4 -2,-0.6 2,-0.4 -0.520 6.7-132.3 -84.6 139.0 13.5 25.8 0.2 97 98 A L E - G 0 78C 11 -52,-2.5 2,-1.6 -2,-0.2 -19,-0.2 -0.807 22.2-129.6 -84.4 123.9 16.5 27.3 -1.6 98 99 A K + 0 0 44 -21,-2.3 2,-0.7 -2,-0.4 -20,-0.1 -0.629 38.7 170.2 -82.8 78.9 15.8 27.3 -5.4 99 100 A Q - 0 0 40 -2,-1.6 -91,-0.2 -54,-0.1 -2,-0.0 -0.825 55.2 -14.2 -93.9 108.6 19.0 25.6 -6.5 100 101 A G S S- 0 0 3 -93,-4.4 2,-0.6 -2,-0.7 28,-0.1 -0.066 91.5 -65.7 87.0 173.7 18.7 24.8 -10.2 101 102 A I - 0 0 5 26,-1.6 2,-0.1 -96,-0.1 -1,-0.1 -0.887 42.9-152.7-107.6 112.8 15.7 24.7 -12.5 102 103 A E >> - 0 0 148 -2,-0.6 4,-2.3 25,-0.1 3,-0.8 -0.467 35.1-100.4 -82.6 158.8 13.0 22.1 -12.0 103 104 A T H 3> S+ 0 0 84 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.794 119.8 58.6 -44.2 -40.4 10.9 20.9 -14.8 104 105 A E H 3> S+ 0 0 140 1,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.909 111.5 38.7 -60.7 -47.4 8.1 23.1 -13.9 105 106 A M H <> S+ 0 0 18 -3,-0.8 4,-1.4 2,-0.2 -1,-0.3 0.815 114.1 56.6 -69.8 -36.6 10.1 26.3 -14.2 106 107 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.848 105.0 52.2 -61.4 -41.5 11.9 24.9 -17.3 107 108 A K H X S+ 0 0 125 -4,-2.6 4,-2.4 -5,-0.3 -1,-0.2 0.811 106.8 53.0 -66.1 -30.2 8.6 24.3 -19.0 108 109 A K H X S+ 0 0 82 -4,-1.2 4,-1.2 2,-0.2 -2,-0.2 0.828 112.4 45.5 -74.7 -30.1 7.7 28.0 -18.3 109 110 A I H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.923 113.5 47.8 -70.1 -51.5 10.9 29.0 -19.9 110 111 A T H X S+ 0 0 13 -4,-2.9 4,-2.3 1,-0.3 -2,-0.2 0.926 111.8 51.8 -61.8 -37.5 10.4 26.7 -22.9 111 112 A K H X S+ 0 0 125 -4,-2.4 4,-2.3 1,-0.2 -1,-0.3 0.863 106.5 52.2 -64.0 -40.5 6.9 28.0 -23.3 112 113 A L H X S+ 0 0 38 -4,-1.2 4,-1.2 2,-0.2 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