==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-FEB-06 2FYW . COMPND 2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR B.NOCEK,C.HATZOS,J.ABDULLAH,A.JOACHIMIAK,MIDWEST CENTER FOR . 800 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37255.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 565 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 96 12.0 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 . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 47 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 213 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 1 2 3 0 0 8 1 8 1 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 11 1 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 . 2 2 8 1 0 5 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 . 2 0 0 3 1 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 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 N 0 0 217 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -58.2 -28.1 42.1 36.7 2 0 A A - 0 0 55 1,-0.1 2,-0.1 35,-0.1 37,-0.1 -0.339 360.0-108.0 -65.8 135.0 -25.4 41.3 39.3 3 1 A X - 0 0 9 248,-0.4 35,-2.9 35,-0.4 2,-0.2 -0.372 32.8-120.0 -52.6 124.9 -22.6 38.9 38.4 4 2 A L B >> -A 37 0A 73 33,-0.3 3,-1.6 -2,-0.1 4,-0.8 -0.581 13.8-129.5 -69.4 136.1 -23.0 35.5 40.1 5 3 A A H >> S+ 0 0 2 31,-1.9 4,-1.7 1,-0.3 3,-0.6 0.813 108.0 65.0 -48.1 -38.4 -19.9 34.6 42.3 6 4 A S H 3> S+ 0 0 29 28,-1.9 4,-2.2 1,-0.2 -1,-0.3 0.707 94.6 56.0 -64.3 -27.1 -19.9 31.3 40.4 7 5 A E H <> S+ 0 0 81 -3,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.773 106.0 51.2 -77.6 -26.3 -19.0 33.0 37.1 8 6 A V H - 0 0 18 0, 0.0 3,-1.2 0, 0.0 4,-0.3 -0.093 16.2-133.7 -56.6 145.6 -8.4 23.8 38.0 18 16 A Q G > S+ 0 0 62 1,-0.2 3,-1.6 2,-0.2 85,-0.1 0.889 106.9 59.8 -57.1 -37.9 -9.5 22.5 41.4 19 17 A E G 3 S+ 0 0 127 1,-0.3 -1,-0.2 84,-0.0 4,-0.0 0.519 84.9 75.2 -81.3 -6.3 -8.2 19.1 40.4 20 18 A F G < S+ 0 0 52 -3,-1.2 -1,-0.3 2,-0.0 -2,-0.2 0.567 75.7 106.7 -72.5 -15.6 -4.6 20.3 39.9 21 19 A S S < S- 0 0 9 -3,-1.6 3,-0.1 -4,-0.3 4,-0.1 -0.427 85.2 -99.5 -60.8 139.4 -4.4 20.4 43.7 22 20 A X > - 0 0 49 1,-0.1 3,-1.8 -2,-0.1 80,-0.1 -0.203 53.9 -81.6 -58.1 150.7 -2.3 17.6 45.3 23 21 A E T 3 S+ 0 0 198 1,-0.2 -1,-0.1 107,-0.1 3,-0.1 -0.315 116.5 22.1 -61.1 135.4 -4.3 14.7 46.7 24 22 A G T 3 S+ 0 0 85 1,-0.3 -1,-0.2 -3,-0.1 2,-0.2 0.305 95.4 132.3 92.4 -6.1 -5.8 15.2 50.1 25 23 A D < - 0 0 32 -3,-1.8 -1,-0.3 1,-0.1 2,-0.1 -0.520 62.4-111.7 -81.1 141.6 -5.7 19.0 49.7 26 24 A S + 0 0 31 -2,-0.2 75,-0.5 -3,-0.1 76,-0.4 -0.424 47.1 166.1 -56.2 143.2 -8.5 21.4 50.5 27 25 A R + 0 0 75 2,-0.1 73,-0.2 -2,-0.1 -9,-0.1 -0.984 31.3 4.5-160.3 150.5 -9.8 23.1 47.3 28 26 A G E S+B 99 0B 0 71,-2.5 71,-2.4 -2,-0.3 2,-0.1 -0.138 103.0 1.0 76.6-165.6 -12.8 25.1 46.1 29 27 A L E +B 98 0B 64 69,-0.2 69,-0.2 1,-0.2 -2,-0.1 -0.388 55.4 162.0 -65.1 134.0 -15.7 26.6 48.1 30 28 A Q E + 0 0 50 67,-2.7 2,-0.4 1,-0.4 -1,-0.2 0.612 65.0 33.3-120.3 -32.3 -15.5 25.8 51.8 31 29 A I E S-B 97 0B 17 66,-1.5 66,-2.2 2,-0.0 -1,-0.4 -0.999 107.9 -14.7-135.3 127.8 -17.9 28.4 53.3 32 30 A G S S- 0 0 60 -2,-0.4 2,-0.3 64,-0.2 64,-0.1 -0.500 82.6 -59.2 93.7-148.9 -21.1 29.9 51.9 33 31 A T - 0 0 62 -2,-0.2 63,-0.1 61,-0.1 -3,-0.1 -0.922 14.8-159.5-132.6 160.6 -22.5 29.8 48.4 34 32 A L S S+ 0 0 23 -2,-0.3 -28,-1.9 -29,-0.1 -27,-0.2 0.239 75.5 92.7-112.0 8.8 -21.5 30.9 44.9 35 33 A D S S+ 0 0 114 -30,-0.2 2,-0.2 -31,-0.1 -1,-0.1 0.499 72.5 77.6 -82.8 -6.2 -25.1 30.9 43.6 36 34 A K S S- 0 0 141 1,-0.1 -31,-1.9 -3,-0.1 -30,-0.2 -0.549 87.2 -92.4-109.6 167.8 -25.9 34.6 44.3 37 35 A G B -A 4 0A 41 -33,-0.2 2,-0.3 -2,-0.2 -33,-0.3 -0.524 46.3-167.9 -76.9 141.9 -25.1 37.9 42.7 38 36 A I - 0 0 14 -35,-2.9 -35,-0.4 -2,-0.2 3,-0.1 -0.898 29.7-171.7-131.3 161.4 -22.1 39.6 44.1 39 37 A Q S S+ 0 0 123 -2,-0.3 214,-3.0 1,-0.2 2,-0.4 0.624 72.3 46.0-111.1 -35.2 -20.3 43.0 44.1 40 38 A R E -c 253 0B 62 212,-0.2 21,-1.9 19,-0.2 22,-1.8 -0.961 48.9-177.4-132.2 132.2 -17.0 42.4 45.8 41 39 A V E -cd 254 62B 0 212,-2.1 214,-3.0 -2,-0.4 2,-0.3 -0.983 10.2-164.0-124.9 128.8 -14.2 39.9 45.8 42 40 A X E -cd 255 63B 0 20,-2.5 22,-2.9 -2,-0.4 2,-0.4 -0.843 9.3-148.9-108.8 144.7 -11.2 39.9 48.0 43 41 A V E +cd 256 64B 0 212,-2.0 214,-3.1 -2,-0.3 2,-0.3 -0.959 28.3 167.5-108.4 125.3 -7.9 38.0 47.5 44 42 A A E - d 0 65B 1 20,-2.2 22,-1.0 -2,-0.4 3,-0.1 -0.931 40.2-142.0-137.4 156.9 -6.2 36.9 50.8 45 43 A L S S- 0 0 5 1,-0.3 22,-2.2 -2,-0.3 2,-0.3 0.860 89.4 -3.5 -79.2 -45.4 -3.3 34.7 51.9 46 44 A D - 0 0 8 20,-0.2 2,-0.6 19,-0.1 -1,-0.3 -0.914 69.1-123.0-144.5 154.4 -5.0 33.5 55.2 47 45 A I + 0 0 4 -2,-0.3 2,-0.2 20,-0.3 39,-0.1 -0.893 44.5 152.7-112.0 107.7 -8.2 34.4 56.9 48 46 A R > - 0 0 10 -2,-0.6 4,-1.9 211,-0.1 3,-0.2 -0.554 62.6 -80.1-112.2-177.9 -7.6 35.6 60.4 49 47 A E H > S+ 0 0 71 1,-0.2 4,-2.2 2,-0.2 3,-0.2 0.899 130.6 50.0 -46.8 -48.5 -9.6 38.0 62.7 50 48 A E H > S+ 0 0 105 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.851 108.8 52.6 -65.9 -36.1 -8.1 41.1 60.9 51 49 A T H > S+ 0 0 0 -3,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.828 109.1 50.4 -63.6 -37.7 -9.0 39.6 57.5 52 50 A V H X S+ 0 0 3 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.963 110.8 47.1 -66.1 -52.8 -12.6 39.1 58.6 53 51 A A H X S+ 0 0 59 -4,-2.2 4,-3.1 1,-0.2 -2,-0.2 0.914 113.1 50.9 -54.6 -46.6 -13.1 42.7 60.0 54 52 A E H X S+ 0 0 17 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.885 110.0 48.4 -60.1 -41.2 -11.6 44.0 56.8 55 53 A A H <>S+ 0 0 0 -4,-1.8 5,-3.3 2,-0.2 4,-0.3 0.867 114.7 46.1 -66.3 -37.6 -14.0 41.9 54.6 56 54 A I H ><5S+ 0 0 63 -4,-2.5 3,-1.2 3,-0.2 -2,-0.2 0.959 113.9 48.9 -65.9 -52.0 -16.9 43.1 56.7 57 55 A E H 3<5S+ 0 0 154 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.852 114.8 43.3 -55.3 -44.6 -15.7 46.7 56.6 58 56 A K T 3<5S- 0 0 72 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.417 112.6-116.0 -86.4 2.4 -15.2 46.7 52.8 59 57 A G T < 5 - 0 0 33 -3,-1.2 2,-0.3 -4,-0.3 -3,-0.2 0.913 47.3-179.6 66.8 42.5 -18.4 44.9 52.0 60 58 A V < - 0 0 5 -5,-3.3 -1,-0.2 1,-0.1 -19,-0.2 -0.589 20.9-176.5 -81.5 135.0 -16.8 41.8 50.6 61 59 A D S S+ 0 0 45 -21,-1.9 35,-2.9 1,-0.3 2,-0.4 0.703 72.2 25.0 -94.3 -34.3 -19.1 38.9 49.3 62 60 A L E -de 41 96B 0 -22,-1.8 -20,-2.5 33,-0.2 2,-0.4 -0.997 61.0-161.4-135.4 139.9 -16.4 36.4 48.3 63 61 A I E -de 42 97B 0 33,-2.2 35,-2.8 -2,-0.4 2,-0.6 -0.990 8.1-155.3-117.4 129.4 -12.8 35.8 49.5 64 62 A I E -de 43 98B 0 -22,-2.9 -20,-2.2 -2,-0.4 2,-0.3 -0.953 26.6-175.2-100.8 121.4 -10.5 33.8 47.4 65 63 A V E -de 44 99B 0 33,-3.7 35,-2.9 -2,-0.6 -20,-0.2 -0.908 33.8-153.9-129.4 144.9 -7.9 32.4 49.7 66 64 A K S S+ 0 0 0 -22,-1.0 2,-0.5 -2,-0.3 -20,-0.2 0.859 87.1 52.2 -78.2 -43.7 -4.6 30.3 49.5 67 65 A H S S- 0 0 31 -22,-2.2 -20,-0.3 -23,-0.1 -1,-0.1 -0.865 93.5-117.4-103.8 128.6 -4.6 28.7 53.0 68 66 A A - 0 0 18 -2,-0.5 3,-0.2 1,-0.1 -2,-0.1 -0.403 10.8-154.6 -69.3 131.3 -7.8 27.0 53.9 69 67 A P S S+ 0 0 5 0, 0.0 2,-0.8 0, 0.0 3,-0.1 0.776 97.7 51.3 -66.4 -33.0 -9.8 28.2 56.9 70 68 A I + 0 0 36 1,-0.1 -2,-0.1 4,-0.0 4,-0.0 -0.826 66.7 156.7-102.1 93.5 -11.2 24.7 57.2 71 69 A F + 0 0 89 -2,-0.8 -1,-0.1 -3,-0.2 -45,-0.1 0.635 69.0 12.3 -98.0 -10.9 -8.0 22.7 57.3 72 70 A R S S- 0 0 172 -3,-0.1 -1,-0.2 -46,-0.0 0, 0.0 -0.965 103.3 -68.7-152.4 165.2 -9.5 19.6 59.1 73 71 A P - 0 0 99 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.258 52.9-116.1 -64.9 150.2 -13.0 18.6 60.0 74 72 A I - 0 0 72 1,-0.1 3,-0.1 -4,-0.0 -4,-0.0 -0.713 20.2-163.2 -90.6 123.4 -14.7 20.8 62.6 75 73 A K - 0 0 181 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.889 68.0 -18.2 -78.2 -36.6 -15.6 19.0 65.8 76 74 A D - 0 0 48 2,-0.1 -1,-0.2 0, 0.0 0, 0.0 -0.959 55.7-116.4-156.2 174.0 -18.1 21.5 67.2 77 75 A L + 0 0 121 -2,-0.3 2,-0.2 -3,-0.1 -3,-0.0 -0.150 47.0 157.9-113.7 38.1 -19.3 25.1 66.7 78 76 A L > - 0 0 85 1,-0.2 3,-1.3 2,-0.1 6,-0.2 -0.465 37.8-146.3 -57.0 125.4 -18.5 26.5 70.2 79 77 A A T 3 S+ 0 0 57 1,-0.3 -1,-0.2 -2,-0.2 6,-0.1 0.522 93.8 73.1 -72.8 -9.7 -18.2 30.3 69.9 80 78 A S T 3 S+ 0 0 101 4,-0.1 -1,-0.3 5,-0.0 -2,-0.1 0.558 77.7 86.2 -81.0 -11.1 -15.5 30.1 72.5 81 79 A R S X> S- 0 0 118 -3,-1.3 4,-1.6 1,-0.1 3,-0.9 -0.844 77.7-140.6 -92.5 122.0 -13.0 28.6 70.1 82 80 A P H 3> S+ 0 0 39 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.802 102.2 54.1 -48.6 -38.0 -11.2 31.4 68.1 83 81 A Q H 3> S+ 0 0 31 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.855 107.9 52.1 -67.6 -33.1 -11.3 29.5 64.8 84 82 A N H <> S+ 0 0 7 -3,-0.9 4,-2.8 -6,-0.2 -1,-0.2 0.851 101.8 58.6 -71.3 -34.4 -15.1 29.1 65.3 85 83 A Q H X S+ 0 0 73 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.886 103.9 53.7 -62.6 -37.5 -15.5 32.9 65.8 86 84 A I H X S+ 0 0 2 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.952 111.2 44.0 -55.3 -52.5 -14.0 33.4 62.4 87 85 A Y H X S+ 0 0 14 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.881 113.0 52.6 -57.6 -48.4 -16.5 31.0 60.8 88 86 A I H X S+ 0 0 38 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.911 110.7 47.2 -56.1 -47.4 -19.4 32.6 62.8 89 87 A D H X S+ 0 0 47 -4,-2.6 4,-1.3 -5,-0.2 -2,-0.2 0.917 112.6 48.1 -62.6 -43.8 -18.4 36.0 61.5 90 88 A L H <>S+ 0 0 0 -4,-2.4 5,-3.0 2,-0.2 3,-0.3 0.943 114.2 47.2 -57.9 -49.9 -18.1 34.9 57.9 91 89 A I H ><5S+ 0 0 107 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.867 109.8 51.8 -60.8 -45.4 -21.5 33.1 58.0 92 90 A K H 3<5S+ 0 0 153 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.794 116.3 40.9 -61.0 -32.9 -23.3 36.1 59.7 93 91 A H T 3<5S- 0 0 91 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.175 112.2-118.7-102.1 14.5 -22.0 38.5 57.0 94 92 A D T < 5 + 0 0 134 -3,-1.1 2,-0.7 1,-0.2 -3,-0.2 0.901 53.0 164.3 40.1 54.9 -22.6 36.1 54.2 95 93 A I < - 0 0 2 -5,-3.0 2,-0.3 -6,-0.1 -33,-0.2 -0.903 24.9-152.0 -98.6 115.3 -18.9 36.0 53.2 96 94 A A E - e 0 62B 5 -35,-2.9 -33,-2.2 -2,-0.7 2,-0.4 -0.644 7.1-151.8 -83.0 148.1 -18.2 33.0 51.0 97 95 A V E -Be 31 63B 0 -66,-2.2 -67,-2.7 -2,-0.3 -66,-1.5 -0.990 10.3-171.7-128.9 127.2 -14.7 31.6 51.1 98 96 A Y E -Be 29 64B 0 -35,-2.8 -33,-3.7 -2,-0.4 2,-0.4 -0.963 14.0-140.4-122.9 134.4 -13.0 29.8 48.2 99 97 A V E +Be 28 65B 0 -71,-2.4 -71,-2.5 -2,-0.4 2,-0.3 -0.804 24.9 168.5-107.3 129.3 -9.6 27.9 48.4 100 98 A S + 0 0 0 -35,-2.9 -73,-0.1 -2,-0.4 -82,-0.0 -0.829 27.6 141.8-132.1 92.9 -6.8 27.8 46.0 101 99 A H S > S+ 0 0 42 -75,-0.5 4,-0.5 -2,-0.3 3,-0.5 0.853 70.1 3.3-104.5 -89.9 -3.9 26.2 47.8 102 100 A T H > S+ 0 0 14 -76,-0.4 4,-0.5 1,-0.2 5,-0.1 0.672 118.7 70.5 -79.9 -19.0 -1.5 23.7 46.1 103 101 A N H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 3,-0.4 0.833 96.3 52.5 -64.6 -29.3 -3.1 24.0 42.7 104 102 A I H 4 S+ 0 0 0 -3,-0.5 7,-1.6 1,-0.2 8,-0.4 0.786 108.4 52.1 -75.9 -28.8 -1.8 27.6 42.3 105 103 A D H < S+ 0 0 6 -4,-0.5 32,-0.7 5,-0.2 -1,-0.2 0.576 116.8 39.7 -72.8 -19.7 1.7 26.3 43.1 106 104 A I H < S+ 0 0 3 -4,-0.5 29,-0.5 -3,-0.4 -2,-0.2 0.832 93.0 95.1-102.4 -41.9 1.4 23.6 40.4 107 105 A V S >< S- 0 0 8 -4,-2.6 3,-1.3 1,-0.1 6,-0.3 0.003 84.9 -98.1 -57.4 151.4 -0.3 25.4 37.5 108 106 A E T 3 S+ 0 0 131 1,-0.3 -1,-0.1 -93,-0.2 -2,-0.1 -0.553 113.7 18.6 -62.2 133.7 1.6 26.9 34.6 109 107 A N T 3 S+ 0 0 100 -2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.768 104.4 129.2 66.1 28.1 1.9 30.6 35.2 110 108 A G S X> S- 0 0 0 -3,-1.3 4,-2.1 -4,-0.1 3,-0.7 -0.186 76.6 -63.9 -99.1-164.5 1.2 30.1 38.9 111 109 A L H 3> S+ 0 0 0 -7,-1.6 4,-2.0 1,-0.3 -6,-0.2 0.850 131.0 48.9 -56.2 -46.8 2.9 31.2 42.1 112 110 A N H 3> S+ 0 0 0 -8,-0.4 4,-1.8 1,-0.2 -1,-0.3 0.814 109.9 53.6 -64.9 -32.5 6.1 29.3 41.6 113 111 A D H <> S+ 0 0 11 -3,-0.7 4,-2.8 -6,-0.3 -2,-0.2 0.893 105.4 54.3 -66.0 -37.0 6.4 30.6 38.1 114 112 A W H X S+ 0 0 17 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.922 107.7 50.8 -57.4 -47.7 6.1 34.1 39.5 115 113 A F H X S+ 0 0 0 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.876 109.6 49.6 -50.4 -50.9 9.0 33.3 41.8 116 114 A C H >X>S+ 0 0 3 -4,-1.8 5,-2.7 2,-0.2 4,-1.1 0.945 112.7 47.4 -57.6 -47.3 11.1 32.1 38.8 117 115 A Q H ><5S+ 0 0 108 -4,-2.8 3,-0.5 1,-0.2 -2,-0.2 0.913 110.1 51.5 -62.2 -44.7 10.3 35.3 36.9 118 116 A X H 3<5S+ 0 0 56 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.716 120.1 35.7 -66.7 -21.0 11.1 37.6 39.8 119 117 A L H <<5S- 0 0 6 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.412 111.0-115.8-113.9 -5.0 14.5 35.9 40.3 120 118 A G T <<5 + 0 0 31 -4,-1.1 2,-0.5 -3,-0.5 23,-0.3 0.855 53.8 161.9 73.6 32.3 15.3 35.3 36.6 121 119 A I < - 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