==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-SEP-10 3ANJ . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN GBS1889; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS AGALACTIAE; . AUTHOR Y.NAKAMICHI,Y.MARUYAMA,B.MIKAMI,W.HASHIMOTO,K.MURATA . 376 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15410.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 68.9 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 . 23 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 16 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 46.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 0 0 1 0 1 0 0 0 1 2 2 0 2 2 0 0 1 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 . 7 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 163 0, 0.0 2,-0.3 0, 0.0 179,-0.0 0.000 360.0 360.0 360.0 0.2 14.0 -8.4 -18.1 2 3 A K - 0 0 170 244,-0.0 2,-0.4 185,-0.0 185,-0.1 -0.636 360.0-146.8 -96.5 138.5 14.5 -5.0 -19.5 3 4 A I - 0 0 16 -2,-0.3 3,-0.1 1,-0.0 180,-0.0 -0.840 33.7-108.7 -95.4 132.8 11.9 -2.3 -20.5 4 5 A K - 0 0 64 -2,-0.4 2,-0.1 1,-0.1 -1,-0.0 -0.279 42.6 -94.5 -60.7 144.9 12.9 -0.2 -23.5 5 6 A P - 0 0 117 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.373 45.6-171.8 -63.6 136.4 13.8 3.5 -22.6 6 7 A V - 0 0 27 187,-0.1 2,-0.5 -3,-0.1 187,-0.2 -0.917 30.4-102.6-124.6 154.5 10.9 5.9 -23.0 7 8 A K - 0 0 135 185,-2.7 2,-0.8 -2,-0.3 0, 0.0 -0.684 29.7-154.5 -75.9 121.2 10.9 9.7 -22.8 8 9 A V - 0 0 60 -2,-0.5 2,-0.1 248,-0.1 245,-0.1 -0.867 11.2-151.7 -98.2 101.6 9.5 10.8 -19.4 9 10 A E - 0 0 30 -2,-0.8 2,-0.1 244,-0.3 247,-0.1 -0.458 20.2-115.8 -65.1 140.6 8.0 14.3 -19.9 10 11 A S - 0 0 92 -2,-0.1 2,-0.6 1,-0.1 -1,-0.1 -0.475 40.6 -94.8 -69.7 153.7 8.1 16.5 -16.8 11 12 A I - 0 0 14 -2,-0.1 2,-0.2 1,-0.0 -1,-0.1 -0.651 43.8-138.8 -76.0 119.7 4.6 17.4 -15.6 12 13 A E S S- 0 0 106 -2,-0.6 4,-0.1 1,-0.2 -1,-0.0 -0.529 74.4 -2.6 -82.8 143.7 3.7 20.8 -17.1 13 14 A N S > S- 0 0 125 -2,-0.2 3,-2.0 1,-0.1 -1,-0.2 0.902 72.3-179.4 43.1 58.0 1.9 23.4 -15.1 14 15 A P T >> S+ 0 0 47 0, 0.0 4,-2.6 0, 0.0 3,-1.9 0.727 70.9 73.8 -63.4 -20.0 1.6 21.1 -12.0 15 16 A K H 3> S+ 0 0 145 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.710 79.0 73.5 -65.0 -20.7 -0.2 23.8 -10.1 16 17 A R H <4 S+ 0 0 56 -3,-2.0 -1,-0.3 2,-0.2 -3,-0.1 0.633 114.0 26.6 -63.9 -15.6 -3.3 23.1 -12.2 17 18 A F H X4 S+ 0 0 0 -3,-1.9 3,-1.9 -4,-0.2 -2,-0.2 0.721 118.0 57.0-107.4 -48.1 -3.4 20.0 -10.0 18 19 A L H 3< S+ 0 0 49 -4,-2.6 -3,-0.2 1,-0.3 -2,-0.2 0.709 104.2 54.5 -62.8 -23.1 -1.7 21.1 -6.8 19 20 A N T 3< S+ 0 0 131 -4,-1.9 -1,-0.3 -5,-0.2 -3,-0.1 0.437 86.1 107.0 -91.7 0.4 -4.1 24.0 -6.3 20 21 A S S < S- 0 0 30 -3,-1.9 2,-0.5 -5,-0.1 297,-0.1 -0.393 77.9-110.6 -70.8 154.3 -7.2 21.7 -6.5 21 22 A R - 0 0 147 -2,-0.1 299,-0.1 295,-0.1 -1,-0.1 -0.760 35.0-114.7 -84.1 130.6 -9.2 21.0 -3.3 22 23 A L - 0 0 54 -2,-0.5 2,-0.3 1,-0.1 291,-0.1 -0.361 37.3 -99.6 -60.0 142.9 -8.8 17.3 -2.2 23 24 A L - 0 0 17 1,-0.1 2,-0.1 4,-0.1 -1,-0.1 -0.528 41.4-139.8 -68.5 128.8 -12.1 15.3 -2.4 24 25 A T > - 0 0 61 -2,-0.3 4,-2.5 1,-0.1 5,-0.3 -0.418 21.4-108.1 -86.8 164.6 -13.7 15.1 1.1 25 26 A K H > S+ 0 0 133 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.907 121.6 50.3 -53.7 -47.3 -15.4 12.1 2.7 26 27 A I H > S+ 0 0 120 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.915 110.2 50.4 -61.0 -43.9 -18.8 13.8 2.2 27 28 A E H > S+ 0 0 40 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.927 115.5 40.7 -61.6 -47.1 -18.1 14.5 -1.4 28 29 A V H X S+ 0 0 4 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.911 113.7 54.6 -69.4 -40.8 -17.1 10.9 -2.3 29 30 A E H X S+ 0 0 51 -4,-2.9 4,-2.6 -5,-0.3 -2,-0.2 0.924 110.3 45.8 -56.5 -48.2 -19.9 9.5 -0.1 30 31 A E H X S+ 0 0 116 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.846 110.9 52.8 -66.6 -35.7 -22.5 11.5 -2.0 31 32 A A H X S+ 0 0 5 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.897 111.6 46.9 -63.6 -41.1 -21.0 10.6 -5.4 32 33 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.921 111.3 51.4 -64.4 -45.7 -21.3 6.9 -4.3 33 34 A E H X S+ 0 0 67 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.905 110.2 48.9 -56.7 -46.2 -24.9 7.4 -3.1 34 35 A K H X S+ 0 0 57 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.868 112.6 47.9 -64.9 -39.8 -25.9 9.0 -6.4 35 36 A A H X S+ 0 0 7 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.912 110.8 51.2 -63.9 -44.8 -24.2 6.1 -8.4 36 37 A L H X S+ 0 0 11 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.832 103.2 58.5 -67.0 -32.8 -25.9 3.5 -6.2 37 38 A K H X S+ 0 0 121 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.930 110.2 43.5 -59.7 -45.6 -29.4 5.0 -6.7 38 39 A Q H X S+ 0 0 1 -4,-1.3 4,-2.4 2,-0.2 296,-0.2 0.878 112.4 54.2 -64.5 -39.8 -28.9 4.6 -10.5 39 40 A L H X S+ 0 0 3 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.919 107.9 48.3 -60.5 -48.0 -27.5 1.0 -9.9 40 41 A Y H X S+ 0 0 53 -4,-2.7 4,-0.9 2,-0.2 -1,-0.2 0.848 111.9 50.2 -63.9 -36.1 -30.6 -0.0 -7.8 41 42 A I H X S+ 0 0 57 -4,-1.6 4,-0.6 -5,-0.2 3,-0.5 0.909 110.7 50.2 -63.7 -43.2 -32.9 1.4 -10.5 42 43 A N H X S+ 0 0 3 -4,-2.4 4,-3.3 1,-0.2 5,-0.4 0.704 96.8 68.8 -71.7 -21.3 -30.9 -0.6 -13.2 43 44 A I H X S+ 0 0 7 -4,-1.4 4,-1.9 1,-0.2 -1,-0.2 0.912 103.9 43.8 -61.0 -42.2 -31.2 -3.8 -11.1 44 45 A D H < S+ 0 0 132 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.652 116.0 50.6 -76.1 -16.4 -34.9 -3.8 -12.0 45 46 A Y H < S+ 0 0 83 -4,-0.6 -2,-0.2 2,-0.1 -1,-0.2 0.899 120.9 28.6 -85.9 -47.8 -34.1 -2.9 -15.6 46 47 A F H >< S+ 0 0 6 -4,-3.3 3,-2.3 1,-0.2 2,-0.2 0.778 81.9 177.1 -84.5 -28.7 -31.5 -5.6 -16.3 47 48 A G T 3< S- 0 0 37 -4,-1.9 -1,-0.2 -5,-0.4 -2,-0.1 -0.418 75.2 -16.4 59.3-124.7 -32.7 -8.3 -14.0 48 49 A E T 3 S+ 0 0 135 -2,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.430 130.0 77.1 -87.3 -1.3 -30.5 -11.4 -14.4 49 50 A E S < S- 0 0 98 -3,-2.3 15,-0.2 1,-0.1 -3,-0.1 -0.292 76.9-110.7-102.3-171.1 -29.2 -10.0 -17.8 50 51 A Y E -A 63 0A 4 13,-2.9 13,-3.0 -2,-0.1 2,-0.1 -0.771 18.4-104.1-126.2 158.0 -26.6 -7.3 -18.6 51 52 A P E -A 62 0A 1 0, 0.0 11,-0.2 0, 0.0 22,-0.1 -0.474 43.5-107.1 -71.0 153.9 -26.2 -3.8 -20.1 52 53 A T - 0 0 21 9,-1.5 304,-0.2 2,-0.2 11,-0.0 -0.351 41.9 -96.5 -65.8 161.1 -24.8 -3.5 -23.6 53 54 A P S S+ 0 0 10 0, 0.0 303,-2.6 0, 0.0 304,-0.3 0.902 105.7 15.0 -48.2 -46.3 -21.2 -2.2 -23.7 54 55 A A B S-B 355 0B 7 301,-0.2 7,-0.5 302,-0.1 301,-0.3 -0.837 82.9-106.8-128.6 164.6 -22.4 1.3 -24.3 55 56 A T - 0 0 1 299,-2.9 2,-0.4 -2,-0.3 5,-0.3 -0.346 20.0-134.9 -81.5 167.4 -25.6 3.3 -24.0 56 57 A F B > S-C 59 0C 102 3,-2.5 3,-1.2 1,-0.1 297,-0.0 -0.980 93.0 -14.9-126.3 115.0 -27.8 4.6 -26.9 57 58 A N T 3 S- 0 0 145 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.876 132.7 -55.1 49.5 41.5 -28.8 8.2 -26.3 58 59 A N T 3 S+ 0 0 33 1,-0.2 2,-0.4 296,-0.1 -1,-0.2 0.610 119.7 108.5 68.1 19.2 -27.6 7.6 -22.7 59 60 A I B < -C 56 0C 56 -3,-1.2 -3,-2.5 276,-0.2 276,-0.2 -0.990 63.7-134.8-123.8 123.3 -29.9 4.5 -22.2 60 61 A Y - 0 0 2 274,-3.0 2,-0.2 -2,-0.4 -5,-0.2 -0.388 13.1-138.5 -66.6 148.2 -28.4 1.0 -22.0 61 62 A K - 0 0 125 -7,-0.5 -9,-1.5 -2,-0.1 2,-0.4 -0.652 24.7-110.0 -96.1 167.4 -30.0 -1.8 -23.9 62 63 A V E +A 51 0A 57 -2,-0.2 2,-0.3 -11,-0.2 -16,-0.0 -0.858 43.5 164.2-105.2 132.2 -30.4 -5.3 -22.3 63 64 A M E -A 50 0A 32 -13,-3.0 -13,-2.9 -2,-0.4 2,-0.0 -0.887 32.6-105.2-140.2 169.4 -28.3 -8.2 -23.5 64 65 A D - 0 0 83 -2,-0.3 2,-1.5 -15,-0.2 3,-0.4 -0.101 54.5 -76.4 -85.3-172.2 -27.2 -11.8 -22.5 65 66 A N S S+ 0 0 15 1,-0.2 -1,-0.1 4,-0.0 43,-0.1 -0.485 97.0 101.9 -90.2 67.7 -23.7 -12.9 -21.3 66 67 A T + 0 0 51 -2,-1.5 -1,-0.2 44,-0.0 2,-0.2 0.275 58.2 81.1-134.4 7.9 -22.0 -12.8 -24.7 67 68 A E S S- 0 0 65 -3,-0.4 3,-0.3 1,-0.0 -15,-0.0 -0.467 81.6-112.2-107.8-178.1 -19.9 -9.6 -24.8 68 69 A W S S+ 0 0 30 1,-0.2 3,-0.2 -2,-0.2 -3,-0.0 0.532 110.9 57.6 -86.2 -6.4 -16.4 -8.6 -23.5 69 70 A T >> + 0 0 1 1,-0.1 3,-1.4 2,-0.1 4,-0.6 0.442 69.1 98.5-108.1 -6.0 -18.1 -6.1 -21.1 70 71 A N H >> S+ 0 0 1 -3,-0.3 4,-1.3 1,-0.3 3,-0.8 0.794 77.7 62.2 -60.8 -32.3 -20.5 -8.2 -18.9 71 72 A G H 3> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.768 93.2 64.1 -63.6 -28.9 -18.1 -8.5 -16.0 72 73 A F H <> S+ 0 0 0 -3,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.798 99.5 52.6 -68.4 -30.1 -18.1 -4.7 -15.5 73 74 A W H > - 0 0 39 -6,-0.2 3,-1.7 1,-0.2 4,-1.2 -0.573 30.6-153.2 -75.6 108.3 -26.5 -5.2 1.0 87 88 A K H 3> S+ 0 0 138 -2,-0.8 4,-2.5 1,-0.3 -1,-0.2 0.679 91.9 71.2 -54.8 -21.1 -27.0 -9.0 0.6 88 89 A K H 3> S+ 0 0 84 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.925 100.0 45.9 -57.1 -46.4 -29.4 -8.1 -2.3 89 90 A L H <> S+ 0 0 0 -3,-1.7 4,-2.7 1,-0.2 5,-0.2 0.899 111.5 51.5 -63.9 -43.8 -26.3 -7.0 -4.3 90 91 A K H X S+ 0 0 85 -4,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.887 109.8 51.2 -58.2 -43.5 -24.4 -10.2 -3.3 91 92 A N H X S+ 0 0 81 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.954 114.3 40.6 -60.1 -53.1 -27.4 -12.3 -4.4 92 93 A I H X S+ 0 0 24 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.918 116.2 49.7 -65.8 -45.4 -27.7 -10.8 -7.9 93 94 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.885 108.2 53.3 -62.5 -41.0 -23.9 -10.6 -8.5 94 95 A H H X S+ 0 0 41 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.843 104.9 55.5 -62.2 -34.2 -23.4 -14.2 -7.4 95 96 A K H X S+ 0 0 88 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.868 106.4 50.9 -64.3 -37.1 -26.1 -15.2 -10.0 96 97 A N H X S+ 0 0 2 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.917 106.8 55.0 -61.5 -44.7 -23.9 -13.4 -12.6 97 98 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.893 106.4 50.1 -54.8 -44.0 -21.0 -15.5 -11.3 98 99 A L H X S+ 0 0 74 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.866 109.8 51.3 -63.6 -36.8 -23.0 -18.7 -12.0 99 100 A S H X S+ 0 0 38 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.832 109.6 50.0 -67.4 -35.9 -23.7 -17.4 -15.5 100 101 A F H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.870 108.7 51.5 -68.9 -38.7 -20.0 -16.7 -16.0 101 102 A L H X S+ 0 0 12 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.895 111.4 48.2 -63.4 -40.4 -19.1 -20.3 -14.8 102 103 A N H X S+ 0 0 85 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.884 110.2 53.2 -61.4 -41.2 -21.7 -21.6 -17.3 103 104 A R H <>S+ 0 0 4 -4,-1.9 5,-2.1 1,-0.2 4,-0.5 0.887 112.7 41.9 -63.6 -43.5 -20.1 -19.3 -20.0 104 105 A I H <5S+ 0 0 13 -4,-2.3 3,-0.3 3,-0.2 -1,-0.2 0.853 112.7 54.6 -73.6 -34.8 -16.6 -20.7 -19.4 105 106 A N H <5S+ 0 0 79 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.847 118.5 33.6 -64.9 -36.2 -17.8 -24.3 -19.1 106 107 A N T <5S- 0 0 98 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.388 105.3-125.2-101.9 -0.2 -19.6 -24.2 -22.5 107 108 A R T 5 - 0 0 144 -4,-0.5 2,-0.6 -3,-0.3 3,-0.5 0.894 40.8-178.1 55.3 46.3 -17.0 -21.8 -24.1 108 109 A I < - 0 0 65 -5,-2.1 -1,-0.2 1,-0.2 -2,-0.1 -0.684 61.8 -29.0 -82.6 118.8 -19.7 -19.4 -25.1 109 110 A A S S+ 0 0 56 -2,-0.6 2,-0.6 1,-0.2 -1,-0.2 0.842 87.4 169.0 45.7 53.3 -18.4 -16.4 -27.1 110 111 A L + 0 0 30 -3,-0.5 2,-0.5 -7,-0.1 -1,-0.2 -0.857 19.7 179.3-107.2 120.4 -14.9 -16.4 -25.6 111 112 A D > - 0 0 75 -2,-0.6 3,-2.4 1,-0.1 4,-0.5 -0.973 29.9-135.3-111.9 128.2 -12.0 -14.3 -26.9 112 113 A H G > S+ 0 0 64 -2,-0.5 3,-0.7 1,-0.3 4,-0.3 0.742 101.9 64.6 -60.4 -25.1 -8.8 -14.7 -24.9 113 114 A H G 3 S+ 0 0 52 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.633 105.0 46.7 -67.2 -15.8 -8.2 -10.9 -25.0 114 115 A D G <> S+ 0 0 32 -3,-2.4 4,-2.2 1,-0.1 -1,-0.2 0.520 81.4 95.2-106.0 -9.5 -11.3 -10.4 -22.9 115 116 A L H <> S+ 0 0 0 -3,-0.7 4,-2.5 -4,-0.5 5,-0.3 0.830 86.7 46.7 -61.0 -40.6 -11.0 -13.1 -20.2 116 117 A G H > S+ 0 0 0 -4,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.934 114.6 48.1 -63.3 -47.5 -9.4 -10.8 -17.5 117 118 A F H 4 S+ 0 0 0 -4,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.804 117.7 43.0 -62.1 -32.8 -12.0 -8.1 -18.2 118 119 A L H < S+ 0 0 0 -4,-2.2 -2,-0.2 -47,-0.1 4,-0.2 0.915 123.3 29.7 -80.3 -44.9 -14.8 -10.7 -18.0 119 120 A Y H X>S+ 0 0 0 -4,-2.5 5,-2.5 -5,-0.2 4,-1.2 0.675 108.6 63.5 -99.3 -20.8 -13.9 -12.8 -15.0 120 121 A T T <>S+ 0 0 1 -4,-2.0 5,-1.7 -5,-0.3 -3,-0.1 0.963 106.9 39.7 -70.8 -53.7 -11.9 -10.5 -12.6 121 122 A P T 45S+ 0 0 0 0, 0.0 -43,-0.3 0, 0.0 -1,-0.2 0.616 129.9 33.1 -73.7 -8.9 -14.6 -7.9 -11.7 122 123 A S T >5S+ 0 0 0 -4,-0.2 4,-1.2 3,-0.1 -2,-0.2 0.825 132.5 14.1-106.1 -66.1 -17.2 -10.7 -11.5 123 124 A C H X5S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -3,-0.2 0.931 129.0 44.7 -86.4 -51.5 -15.8 -14.0 -10.3 124 125 A T H >S+ 0 0 0 -4,-1.2 4,-3.2 1,-0.2 5,-0.9 0.907 110.2 55.1 -63.8 -40.5 -16.6 -12.5 -5.3 127 128 A Y H X5S+ 0 0 63 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.919 108.3 49.4 -56.4 -44.0 -13.6 -14.7 -4.3 128 129 A R H <5S+ 0 0 54 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.833 117.0 43.3 -58.2 -36.0 -11.9 -11.6 -2.8 129 130 A I H <5S- 0 0 47 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.942 139.5 -6.8 -82.5 -51.3 -15.1 -10.8 -0.9 130 131 A N H <5S- 0 0 70 -4,-3.2 -3,-0.2 -5,-0.1 -2,-0.2 0.395 86.5-113.2-132.5 1.2 -16.4 -14.1 0.5 131 132 A G << - 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