==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-AUG-12 3VWO . COMPND 2 MOLECULE: PEPTIDOGLYCAN HYDROLASE FLGJ; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS SP. A1; . AUTHOR Y.MARUYAMA,B.MIKAMI,W.HASHIMOTO,K.MURATA . 155 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 100 64.5 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 . 15 9.7 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 4 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 60 38.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 0 0 0 2 0 1 1 0 1 0 0 0 1 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 . 2 0 0 0 0 0 0 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 . 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 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 1 153 A A > 0 0 29 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 145.3 -33.4 3.8 -15.5 2 154 A Q H > + 0 0 44 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.856 360.0 58.4 -74.4 -36.9 -36.8 3.4 -13.9 3 155 A A H > S+ 0 0 72 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.811 103.0 55.0 -59.8 -31.7 -37.1 -0.0 -15.6 4 156 A F H > S+ 0 0 13 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.924 110.3 43.1 -68.4 -47.4 -33.9 -1.1 -13.8 5 157 A V H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.2 -2,-0.2 0.901 114.3 52.0 -64.6 -40.3 -35.3 -0.2 -10.3 6 158 A D H < S+ 0 0 66 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.874 112.5 45.0 -64.7 -36.8 -38.6 -1.8 -11.2 7 159 A A H < S+ 0 0 42 -4,-1.9 4,-0.3 -5,-0.2 -1,-0.2 0.748 122.6 34.6 -77.9 -24.2 -37.0 -5.0 -12.3 8 160 A T H X S+ 0 0 0 -4,-1.4 4,-2.5 -3,-0.1 5,-0.2 0.796 95.6 77.2-105.3 -32.1 -34.6 -5.4 -9.4 9 161 A W H X S+ 0 0 91 -4,-2.6 4,-2.5 1,-0.2 -3,-0.1 0.873 94.3 50.6 -53.4 -48.2 -36.3 -4.0 -6.3 10 162 A P H > S+ 0 0 58 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.939 116.8 40.8 -55.7 -47.9 -38.6 -7.0 -5.6 11 163 A Q H > S+ 0 0 49 -4,-0.3 4,-1.4 1,-0.2 -2,-0.2 0.795 112.3 56.5 -69.9 -28.6 -35.6 -9.5 -5.8 12 164 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.899 100.8 60.2 -67.2 -38.4 -33.4 -7.0 -3.9 13 165 A A H X S+ 0 0 33 -4,-2.5 4,-1.7 -5,-0.2 -2,-0.2 0.900 103.9 47.5 -55.4 -48.5 -36.0 -7.1 -1.1 14 166 A K H X S+ 0 0 63 -4,-1.2 4,-1.1 1,-0.2 -1,-0.2 0.923 116.9 41.7 -61.6 -48.2 -35.7 -10.8 -0.4 15 167 A A H X S+ 0 0 1 -4,-1.4 4,-1.1 1,-0.2 -1,-0.2 0.852 109.7 60.2 -69.2 -34.2 -31.9 -10.8 -0.4 16 168 A A H X>S+ 0 0 3 -4,-2.7 5,-2.0 1,-0.2 4,-1.0 0.889 102.7 50.9 -62.8 -37.6 -31.7 -7.6 1.6 17 169 A Q H <5S+ 0 0 166 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.852 104.4 57.5 -70.9 -29.4 -33.6 -9.2 4.5 18 170 A S H <5S+ 0 0 81 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.789 116.1 37.4 -64.9 -27.9 -31.2 -12.1 4.5 19 171 A L H <5S- 0 0 5 -4,-1.1 94,-2.5 -3,-0.4 95,-0.2 0.484 108.0-122.5-103.6 -8.4 -28.4 -9.5 5.1 20 172 A G T <5S+ 0 0 40 -4,-1.0 -3,-0.2 1,-0.3 -4,-0.1 0.789 71.9 120.4 70.1 27.9 -30.3 -7.1 7.3 21 173 A V S > - 0 0 39 0, 0.0 3,-1.5 0, 0.0 4,-0.8 -0.380 35.2-123.1 -62.6 143.5 -32.3 -1.9 3.2 23 175 A A H >> S+ 0 0 14 1,-0.3 4,-1.9 2,-0.2 3,-0.8 0.850 108.4 62.3 -56.4 -37.7 -33.3 -3.2 -0.2 24 176 A H H 3> S+ 0 0 53 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.711 92.5 65.0 -70.1 -15.5 -32.3 -0.0 -2.0 25 177 A F H <> S+ 0 0 4 -3,-1.5 4,-1.9 2,-0.2 -1,-0.3 0.901 106.7 42.8 -66.6 -41.8 -28.7 -0.6 -0.8 26 178 A L H S+ 0 0 1 -4,-2.4 5,-2.4 2,-0.2 4,-0.9 0.907 112.2 45.8 -67.2 -41.4 -26.9 0.1 -10.4 32 184 A L H ><5S+ 0 0 50 -4,-2.5 3,-0.5 3,-0.2 -2,-0.2 0.935 113.7 49.6 -62.7 -47.9 -23.3 1.1 -9.7 33 185 A E H 3<5S+ 0 0 42 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.838 125.3 26.0 -61.3 -36.0 -22.0 -2.2 -10.9 34 186 A T H 3<>S- 0 0 0 -4,-2.1 5,-3.3 -5,-0.2 6,-0.3 0.268 107.3-108.2-116.9 10.5 -23.9 -2.2 -14.2 35 187 A G T X<5S- 0 0 34 -4,-0.9 3,-1.6 -3,-0.5 -3,-0.2 0.948 85.2 -47.8 59.4 49.8 -24.5 1.5 -14.9 36 188 A W T 3 5S+ 0 0 14 -7,-0.4 3,-1.0 -6,-0.2 -1,-0.3 0.231 118.0 107.9 91.5 -11.8 -28.4 -1.9 -16.2 38 190 A K T < 5S+ 0 0 163 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.706 88.2 34.6 -71.6 -20.3 -26.8 -0.4 -19.3 39 191 A S T 3 - 0 0 46 4,-4.1 3,-1.2 -2,-0.3 -1,-0.1 0.016 47.6 -91.4 -59.2 177.8 -24.1 -13.8 -23.3 44 196 A K T 3 S+ 0 0 144 1,-0.3 -1,-0.1 2,-0.1 22,-0.0 0.856 130.4 52.8 -64.9 -33.5 -22.6 -14.0 -26.8 45 197 A D T 3 S- 0 0 127 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.581 125.5-102.5 -76.0 -11.6 -26.2 -13.8 -28.2 46 198 A G S < S+ 0 0 36 -3,-1.2 -2,-0.1 1,-0.3 -1,-0.1 0.450 73.6 149.6 96.9 3.4 -26.9 -10.7 -26.1 47 199 A T - 0 0 61 1,-0.1 -4,-4.1 -5,-0.1 -1,-0.3 -0.513 53.2-107.0 -69.8 135.0 -28.9 -12.8 -23.6 48 200 A P B -A 42 0A 31 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.375 17.9-157.9 -67.7 141.1 -28.7 -11.3 -20.1 49 201 A S - 0 0 0 -8,-2.2 39,-2.9 38,-0.1 41,-0.2 0.667 26.4-140.8 -82.4 -21.3 -26.5 -13.0 -17.5 50 202 A Y + 0 0 65 -9,-0.4 2,-2.0 1,-0.2 3,-0.1 0.493 56.6 140.0 67.0 8.0 -28.5 -11.3 -14.8 51 203 A N > + 0 0 1 -10,-0.4 3,-1.2 1,-0.2 -10,-0.5 -0.510 16.4 162.2 -83.2 76.1 -25.2 -11.0 -13.0 52 204 A L T 3 S+ 0 0 0 -2,-2.0 -1,-0.2 1,-0.3 -19,-0.1 0.610 70.6 52.2 -76.1 -12.1 -25.8 -7.5 -11.7 53 205 A F T 3 S- 0 0 3 -3,-0.1 -1,-0.3 -20,-0.1 -2,-0.1 0.365 105.6-123.4-104.7 3.8 -23.1 -7.7 -9.0 54 206 A N < + 0 0 43 -3,-1.2 2,-0.6 1,-0.2 -2,-0.1 0.890 43.5 177.8 56.8 45.0 -20.3 -8.8 -11.5 55 207 A I - 0 0 13 31,-0.1 31,-2.2 1,-0.0 -1,-0.2 -0.693 19.6-140.4 -84.7 119.1 -19.6 -12.0 -9.5 56 208 A K B -B 85 0B 76 -2,-0.6 29,-0.3 29,-0.2 2,-0.2 -0.313 28.9 -93.0 -72.2 159.5 -16.9 -14.1 -11.1 57 209 A A - 0 0 28 27,-2.8 27,-0.1 4,-0.1 -1,-0.1 -0.505 37.8-130.5 -67.6 139.3 -17.1 -17.9 -11.2 58 210 A G > - 0 0 36 -2,-0.2 3,-1.4 1,-0.1 -1,-0.1 -0.363 34.3 -96.8 -74.2 172.9 -15.4 -19.6 -8.3 59 211 A S T 3 S+ 0 0 120 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.855 125.6 38.8 -62.1 -34.4 -13.0 -22.4 -9.2 60 212 A N T 3 S+ 0 0 149 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.032 81.5 139.1-107.3 26.3 -15.7 -25.0 -8.5 61 213 A W < - 0 0 70 -3,-1.4 2,-0.4 2,-0.0 -4,-0.1 -0.559 31.7-169.2 -68.0 127.9 -18.7 -23.1 -9.9 62 214 A T + 0 0 126 -2,-0.3 2,-0.3 2,-0.0 -2,-0.1 -0.982 47.1 46.9-120.7 135.8 -20.9 -25.5 -11.9 63 215 A G S S- 0 0 59 -2,-0.4 25,-0.1 23,-0.0 -2,-0.0 -0.841 96.4 -5.8 126.7-169.6 -23.7 -24.0 -14.0 64 216 A K + 0 0 118 23,-0.3 23,-2.0 -2,-0.3 2,-0.3 -0.262 60.4 175.9 -68.5 141.9 -23.9 -21.2 -16.5 65 217 A V E -C 86 0B 60 21,-0.2 2,-0.4 -8,-0.0 21,-0.2 -0.940 18.0-156.7-138.4 160.6 -21.0 -18.9 -17.2 66 218 A V E -C 85 0B 1 19,-2.2 19,-3.0 -2,-0.3 2,-0.5 -0.986 18.7-134.3-138.0 127.7 -20.1 -16.1 -19.6 67 219 A E E +C 84 0B 87 -2,-0.4 2,-0.3 17,-0.2 17,-0.2 -0.718 39.9 170.9 -76.1 128.8 -16.6 -15.0 -20.5 68 220 A A E -C 83 0B 15 15,-2.6 15,-2.5 -2,-0.5 2,-0.1 -0.994 38.4-105.6-144.4 148.5 -16.5 -11.3 -20.2 69 221 A R E -C 82 0B 157 -2,-0.3 2,-0.3 13,-0.2 13,-0.3 -0.455 43.7-177.2 -65.4 140.3 -14.0 -8.4 -20.4 70 222 A T E -C 81 0B 23 11,-3.0 11,-2.3 -2,-0.1 2,-0.5 -0.999 21.8-140.1-146.2 147.2 -13.3 -7.0 -16.9 71 223 A V E +C 80 0B 38 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.901 25.5 172.9-108.8 129.5 -11.2 -4.2 -15.5 72 224 A E E -C 79 0B 19 7,-2.4 7,-3.1 -2,-0.5 2,-0.5 -0.953 22.7-136.3-134.7 153.4 -9.3 -4.6 -12.2 73 225 A Y E +C 78 0B 76 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.941 17.7 177.2-115.6 130.6 -6.8 -2.5 -10.3 74 226 A E E > S-C 77 0B 82 3,-2.1 3,-1.3 -2,-0.5 2,-0.1 -0.967 70.7 -38.5-130.3 114.6 -3.6 -3.9 -8.7 75 227 A N T 3 S- 0 0 168 -2,-0.4 0, 0.0 1,-0.2 0, 0.0 -0.405 122.3 -31.1 59.8-144.4 -1.5 -1.2 -7.1 76 228 A G T 3 S+ 0 0 75 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.2 0.120 119.0 108.7 -86.2 23.4 -1.6 1.9 -9.3 77 229 A Q E < - C 0 74B 117 -3,-1.3 -3,-2.1 2,-0.0 2,-0.4 -0.845 62.4-142.1-110.0 135.0 -1.9 -0.3 -12.3 78 230 A R E - C 0 73B 135 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.792 19.0-162.3 -93.8 133.5 -5.0 -0.9 -14.4 79 231 A K E - C 0 72B 72 -7,-3.1 -7,-2.4 -2,-0.4 2,-0.5 -0.950 9.3-170.4-120.0 135.6 -5.7 -4.4 -15.7 80 232 A V E + C 0 71B 80 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.969 25.3 140.0-124.7 117.7 -7.9 -5.6 -18.5 81 233 A R E - C 0 70B 82 -11,-2.3 -11,-3.0 -2,-0.5 2,-0.5 -0.918 49.4-107.3-144.3 173.9 -8.7 -9.2 -19.0 82 234 A V E + C 0 69B 84 -2,-0.3 2,-0.3 -13,-0.3 -13,-0.2 -0.925 42.8 171.2-105.3 125.8 -11.4 -11.7 -19.9 83 235 A E E - C 0 68B 62 -15,-2.5 -15,-2.6 -2,-0.5 2,-0.6 -0.849 38.4 -98.2-129.1 166.1 -12.6 -13.8 -17.0 84 236 A R E - C 0 67B 146 -2,-0.3 -27,-2.8 -17,-0.2 2,-0.3 -0.778 40.5-169.5 -87.1 121.1 -15.5 -16.3 -16.4 85 237 A F E -BC 56 66B 1 -19,-3.0 -19,-2.2 -2,-0.6 -29,-0.2 -0.781 26.7-103.8-106.2 153.1 -18.5 -14.7 -14.7 86 238 A R E - C 0 65B 34 -31,-2.2 2,-0.3 -2,-0.3 -21,-0.2 -0.384 32.1-157.6 -66.8 150.4 -21.5 -16.5 -13.3 87 239 A A - 0 0 5 -23,-2.0 -23,-0.3 -37,-0.1 2,-0.2 -0.979 9.6-162.1-129.7 147.2 -24.7 -16.5 -15.2 88 240 A Y - 0 0 9 -39,-2.9 -37,-0.1 -2,-0.3 3,-0.1 -0.741 30.3-123.5-126.1 171.6 -28.1 -17.0 -13.8 89 241 A D S S- 0 0 91 -2,-0.2 2,-0.3 1,-0.2 -39,-0.1 0.619 91.7 -5.4 -85.0 -18.1 -31.7 -17.9 -14.7 90 242 A S S > S- 0 0 35 -41,-0.2 4,-1.9 1,-0.1 -1,-0.2 -0.985 71.7 -98.9-167.3 161.8 -33.2 -14.8 -13.2 91 243 A Y H > S+ 0 0 47 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.868 121.5 59.9 -57.9 -36.4 -32.5 -11.6 -11.2 92 244 A E H > S+ 0 0 94 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.939 105.2 46.3 -56.3 -49.5 -33.9 -13.6 -8.2 93 245 A Q H > S+ 0 0 82 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.877 112.3 52.2 -61.5 -39.1 -31.2 -16.2 -8.6 94 246 A A H X S+ 0 0 3 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.935 111.2 45.2 -62.6 -49.2 -28.6 -13.5 -8.9 95 247 A F H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.899 112.6 51.5 -63.5 -40.5 -29.6 -11.6 -5.8 96 248 A Q H X S+ 0 0 87 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.868 109.5 50.0 -64.2 -38.4 -29.8 -14.9 -3.8 97 249 A D H X S+ 0 0 24 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.910 109.9 51.4 -66.5 -39.7 -26.3 -15.8 -4.9 98 250 A Y H X S+ 0 0 1 -4,-2.2 4,-2.9 1,-0.2 5,-0.4 0.924 110.4 47.7 -61.3 -46.3 -25.1 -12.4 -3.8 99 251 A A H X S+ 0 0 9 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.857 111.3 52.3 -64.1 -35.0 -26.6 -12.8 -0.4 100 252 A D H X S+ 0 0 95 -4,-1.9 4,-1.3 -5,-0.2 -2,-0.2 0.947 113.8 42.8 -64.2 -48.0 -25.1 -16.2 -0.1 101 253 A L H X S+ 0 0 45 -4,-2.6 4,-1.9 2,-0.2 3,-0.3 0.955 122.0 36.7 -62.2 -55.6 -21.7 -14.9 -1.0 102 254 A V H < S+ 0 0 4 -4,-2.9 10,-0.2 1,-0.2 9,-0.2 0.883 117.7 52.6 -68.4 -38.0 -21.7 -11.8 1.2 103 255 A G H < S+ 0 0 42 -4,-2.1 -1,-0.2 -5,-0.4 -2,-0.2 0.740 119.9 31.1 -70.2 -23.5 -23.7 -13.4 4.0 104 256 A N H < S+ 0 0 119 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.634 90.9 96.9-115.4 -16.3 -21.3 -16.4 4.4 105 257 A S >< - 0 0 32 -4,-1.9 3,-1.8 -5,-0.2 4,-0.0 -0.651 67.8-140.8 -77.1 125.4 -17.8 -15.2 3.5 106 258 A P G > S+ 0 0 119 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.836 96.9 64.2 -56.5 -36.3 -15.9 -14.3 6.7 107 259 A R G 3 S+ 0 0 167 1,-0.3 3,-0.3 2,-0.1 -5,-0.1 0.685 103.9 47.7 -64.3 -17.9 -14.3 -11.2 5.1 108 260 A Y G X> S+ 0 0 24 -3,-1.8 3,-2.2 -7,-0.2 4,-0.7 0.164 73.3 118.2-105.8 18.1 -17.7 -9.5 4.7 109 261 A A T <4 S+ 0 0 73 -3,-1.9 3,-0.2 1,-0.3 -1,-0.2 0.778 72.9 55.8 -56.2 -28.9 -18.9 -10.3 8.2 110 262 A K T 34 S+ 0 0 151 -3,-0.3 -1,-0.3 -4,-0.2 13,-0.1 0.546 93.2 72.1 -83.7 -6.5 -19.2 -6.5 8.9 111 263 A V T X4 S+ 0 0 0 -3,-2.2 3,-1.9 12,-0.2 -1,-0.2 0.936 75.2 87.2 -74.2 -48.0 -21.5 -5.9 6.0 112 264 A A T 3< S+ 0 0 49 -4,-0.7 -92,-0.2 1,-0.3 3,-0.1 -0.225 95.9 18.5 -58.3 139.1 -24.7 -7.6 7.3 113 265 A G T 3 S+ 0 0 46 -94,-2.5 2,-0.5 1,-0.3 -1,-0.3 0.320 83.7 138.4 85.3 -8.4 -26.9 -5.3 9.4 114 266 A K < + 0 0 72 -3,-1.9 -1,-0.3 -95,-0.2 -95,-0.0 -0.593 21.4 172.0 -73.8 123.3 -25.4 -2.1 8.1 115 267 A T + 0 0 101 -2,-0.5 2,-0.4 -94,-0.1 -1,-0.1 0.239 53.4 85.1-119.7 8.4 -28.2 0.4 7.5 116 268 A D S > S- 0 0 84 1,-0.1 4,-2.7 -94,-0.0 5,-0.2 -0.960 75.5-137.6-107.9 133.8 -26.2 3.5 6.8 117 269 A G H > S+ 0 0 1 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.876 101.9 45.4 -60.6 -45.8 -25.0 3.8 3.2 118 270 A H H > S+ 0 0 93 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.898 114.8 48.2 -62.9 -43.6 -21.5 4.9 3.9 119 271 A A H > S+ 0 0 35 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.896 113.4 47.9 -66.9 -38.5 -21.0 2.3 6.6 120 272 A F H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.942 114.7 45.3 -62.2 -48.9 -22.4 -0.4 4.3 121 273 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.907 113.2 49.9 -66.2 -42.7 -20.2 0.7 1.4 122 274 A R H X S+ 0 0 147 -4,-2.7 4,-3.2 1,-0.2 5,-0.3 0.897 108.0 53.1 -62.6 -42.6 -17.1 1.0 3.6 123 275 A A H X S+ 0 0 12 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.891 111.2 47.3 -60.7 -39.0 -17.6 -2.5 5.0 124 276 A L H X>S+ 0 0 0 -4,-1.9 5,-2.5 2,-0.2 4,-0.5 0.941 115.1 45.1 -64.7 -48.5 -17.8 -3.9 1.5 125 277 A Q H ><5S+ 0 0 47 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.926 113.6 48.5 -62.8 -46.7 -14.7 -2.0 0.4 126 278 A E H 3<5S+ 0 0 129 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.736 108.6 56.4 -65.8 -22.3 -12.7 -2.9 3.5 127 279 A G H 3<5S- 0 0 5 -4,-1.1 -1,-0.3 -5,-0.3 -2,-0.2 0.575 122.0-108.6 -84.3 -11.1 -13.8 -6.5 2.9 128 280 A G T <<5 + 0 0 40 -3,-1.3 -3,-0.2 -4,-0.5 -2,-0.1 0.738 68.5 146.0 93.1 27.4 -12.3 -6.4 -0.5 129 281 A Y S - 0 0 35 1,-0.1 3,-1.6 2,-0.1 4,-0.2 -0.535 68.8-144.4 -62.0 121.2 -11.4 0.3 -7.4 133 285 A P T 3 S+ 0 0 105 0, 0.0 3,-0.2 0, 0.0 4,-0.2 0.687 97.4 44.6 -65.1 -22.3 -10.0 2.6 -4.6 134 286 A S T 3> S+ 0 0 45 1,-0.1 4,-2.5 2,-0.1 5,-0.2 0.117 77.1 115.4-110.1 20.0 -13.0 4.9 -4.6 135 287 A Y H <> S+ 0 0 12 -3,-1.6 4,-2.7 1,-0.2 5,-0.2 0.906 77.1 47.8 -54.7 -49.2 -15.7 2.1 -4.7 136 288 A A H > S+ 0 0 7 -4,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.899 111.4 50.2 -61.9 -43.9 -17.1 2.9 -1.3 137 289 A D H > S+ 0 0 90 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.938 113.9 45.3 -60.0 -46.7 -17.3 6.7 -2.0 138 290 A K H X S+ 0 0 64 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.912 112.9 49.5 -64.8 -44.5 -19.1 6.1 -5.3 139 291 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 3,-0.2 0.916 108.6 53.4 -61.6 -44.8 -21.5 3.5 -3.9 140 292 A A H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.877 106.3 53.4 -57.9 -39.1 -22.5 5.8 -1.0 141 293 A R H < S+ 0 0 151 -4,-1.7 4,-0.4 2,-0.2 -1,-0.2 0.852 110.4 46.6 -66.8 -35.5 -23.3 8.6 -3.4 142 294 A V H >< S+ 0 0 28 -4,-1.5 3,-0.8 -3,-0.2 6,-0.4 0.941 111.6 51.4 -68.4 -47.4 -25.7 6.3 -5.4 143 295 A I H 3< S+ 0 0 6 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.905 122.2 30.9 -55.9 -45.1 -27.3 5.0 -2.2 144 296 A N T 3< S+ 0 0 73 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.357 99.1 118.4 -96.8 4.6 -28.0 8.5 -0.8 145 297 A G S <> S- 0 0 19 -3,-0.8 4,-1.8 -4,-0.4 5,-0.1 -0.298 70.3-126.5 -76.8 155.8 -28.4 10.2 -4.3 146 298 A N H > S+ 0 0 108 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.797 105.7 63.7 -68.6 -28.8 -31.5 11.9 -5.6 147 299 A A H > S+ 0 0 54 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.942 109.1 37.6 -62.5 -49.7 -31.5 9.7 -8.7 148 300 A L H > S+ 0 0 1 -6,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.904 115.1 56.1 -67.5 -41.1 -32.1 6.5 -6.8 149 301 A R H X S+ 0 0 106 -4,-1.8 4,-2.1 1,-0.2 5,-0.2 0.929 108.6 45.4 -59.0 -50.0 -34.4 8.2 -4.3 150 302 A Q H X S+ 0 0 105 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.881 113.4 50.7 -60.4 -39.9 -36.8 9.5 -7.0 151 303 A R H X S+ 0 0 71 -4,-1.5 4,-1.1 -5,-0.2 -1,-0.2 0.786 108.5 52.8 -71.7 -27.8 -36.8 6.1 -8.8 152 304 A L H < S+ 0 0 40 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.929 109.2 46.5 -70.8 -47.9 -37.6 4.3 -5.6 153 305 A M H < S+ 0 0 137 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.825 111.3 54.3 -63.4 -31.7 -40.6 6.5 -4.8 154 306 A H H < 0 0 138 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.820 360.0 360.0 -69.2 -33.1 -41.7 6.0 -8.4 155 307 A H < 0 0 89 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.927 360.0 360.0 -70.7 360.0 -41.4 2.2 -7.8