==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-OCT-09 3K3T . COMPND 2 MOLECULE: PEPTIDOGLYCAN HYDROLASE FLGJ; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS SP. A1; . AUTHOR Y.MARUYAMA,A.OCHIAI,T.ITOH,B.MIKAMI,W.HASHIMOTO,K.MURATA . 152 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8816.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 98 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 . 12 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 5 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 40.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.3 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 2 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 1 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 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 58 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -19.2 5.8 -6.9 10.8 2 154 A Q H > + 0 0 59 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.875 360.0 49.6 -63.1 -39.6 6.1 -5.4 14.3 3 155 A A H > S+ 0 0 80 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.868 109.4 53.2 -68.4 -35.4 6.7 -8.6 16.1 4 156 A F H > S+ 0 0 15 32,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.937 112.1 45.1 -59.6 -48.4 9.4 -9.6 13.6 5 157 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.930 114.6 48.2 -61.5 -47.7 11.1 -6.2 14.3 6 158 A D H < S+ 0 0 73 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.882 113.8 46.5 -60.3 -41.4 10.8 -6.6 18.1 7 159 A A H < S+ 0 0 48 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.883 117.2 41.8 -71.6 -39.7 12.1 -10.2 18.0 8 160 A T H X S+ 0 0 0 -4,-2.2 4,-2.9 -5,-0.2 3,-0.4 0.773 95.4 83.5 -79.3 -25.7 15.1 -9.5 15.8 9 161 A W H X S+ 0 0 98 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.866 90.2 43.8 -50.4 -54.4 16.1 -6.2 17.4 10 162 A P H > S+ 0 0 63 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.869 118.1 46.0 -65.6 -32.7 18.2 -7.4 20.4 11 163 A Q H > S+ 0 0 28 -4,-0.5 4,-2.6 -3,-0.4 -2,-0.2 0.881 112.9 49.8 -72.2 -40.8 20.0 -10.0 18.2 12 164 A A H X S+ 0 0 0 -4,-2.9 4,-3.3 2,-0.2 5,-0.3 0.904 111.1 50.4 -62.1 -42.2 20.5 -7.5 15.5 13 165 A A H X S+ 0 0 11 -4,-2.9 4,-2.4 -5,-0.3 -2,-0.2 0.922 110.7 48.9 -62.2 -44.9 21.9 -5.0 18.0 14 166 A K H X S+ 0 0 108 -4,-2.0 4,-1.4 -5,-0.2 -2,-0.2 0.948 118.0 39.9 -58.9 -50.5 24.3 -7.7 19.4 15 167 A A H X S+ 0 0 5 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.903 115.5 50.1 -68.1 -43.0 25.5 -8.6 16.0 16 168 A A H X>S+ 0 0 1 -4,-3.3 5,-2.3 1,-0.2 4,-0.8 0.878 106.9 55.0 -67.6 -37.3 25.7 -5.0 14.6 17 169 A Q H ><5S+ 0 0 152 -4,-2.4 3,-0.5 -5,-0.3 -1,-0.2 0.887 107.5 50.3 -61.7 -38.7 27.6 -3.8 17.6 18 170 A S H 3<5S+ 0 0 86 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.786 115.6 43.6 -67.4 -27.8 30.2 -6.5 17.0 19 171 A L H 3<5S- 0 0 7 -4,-1.2 88,-1.5 2,-0.2 89,-0.3 0.449 109.7-124.2 -94.7 -5.4 30.4 -5.3 13.3 20 172 A G T <<5S+ 0 0 43 -4,-0.8 -3,-0.2 -3,-0.5 -4,-0.1 0.784 72.2 119.4 62.7 29.0 30.4 -1.6 14.2 21 173 A V S > - 0 0 36 0, 0.0 3,-1.2 0, 0.0 4,-0.7 -0.379 34.1-125.8 -63.1 142.7 23.9 0.4 13.2 23 175 A A H >> S+ 0 0 16 1,-0.2 4,-1.6 2,-0.2 3,-0.9 0.857 106.9 61.7 -57.0 -39.5 21.5 -2.2 14.5 24 176 A H H 3> S+ 0 0 54 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.726 91.3 68.0 -65.2 -20.5 18.7 -1.2 12.0 25 177 A F H <> S+ 0 0 4 -3,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.911 105.0 42.2 -60.8 -43.3 21.0 -2.0 9.1 26 178 A L H S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 4,-1.1 0.907 110.7 45.8 -60.2 -44.3 13.2 -7.6 6.4 32 184 A L H <5S+ 0 0 61 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.901 112.7 50.8 -64.9 -41.9 14.2 -7.4 2.8 33 185 A A H <5S+ 0 0 26 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.802 125.0 25.9 -66.1 -30.0 15.3 -11.1 2.8 34 186 A T H <>S- 0 0 1 -4,-1.8 5,-3.2 -5,-0.1 4,-0.3 0.308 107.0-108.2-119.6 5.2 12.0 -12.3 4.3 35 187 A G T ><5S- 0 0 28 -4,-1.1 3,-1.5 -3,-0.3 -3,-0.2 0.959 86.3 -47.4 59.7 51.4 9.4 -9.7 3.4 36 188 A W T 3 - 0 0 36 4,-3.2 3,-1.5 -2,-0.4 23,-0.1 -0.250 34.9-104.6 -67.1 164.6 11.4 -27.0 8.3 44 196 A K T 3 S+ 0 0 196 1,-0.3 -1,-0.1 2,-0.1 22,-0.0 0.817 121.6 58.7 -61.7 -31.9 9.3 -30.0 7.1 45 197 A D T 3 S- 0 0 123 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.468 122.8-106.0 -77.6 -1.7 7.9 -30.5 10.6 46 198 A G S < S+ 0 0 41 -3,-1.5 -2,-0.1 1,-0.3 -1,-0.1 0.385 79.6 128.1 93.4 -2.0 6.5 -26.9 10.5 47 199 A T - 0 0 63 1,-0.1 -4,-3.2 -5,-0.1 -1,-0.3 -0.517 65.5 -98.5 -82.9 153.7 9.1 -25.3 12.8 48 200 A P B -A 42 0A 56 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.439 13.0-150.8 -70.8 146.6 11.0 -22.2 11.7 49 201 A S - 0 0 1 -8,-2.3 33,-3.0 -2,-0.1 35,-0.2 0.670 26.8-144.7 -77.9 -21.5 14.5 -22.5 10.4 50 202 A Y + 0 0 71 -9,-0.5 2,-2.1 1,-0.2 3,-0.1 0.539 52.9 141.5 63.3 9.7 15.1 -19.0 11.8 51 203 A N > + 0 0 3 -10,-0.4 3,-1.6 1,-0.2 -10,-0.4 -0.472 16.4 163.3 -80.7 72.6 17.3 -18.5 8.8 52 204 A L T 3 S+ 0 0 0 -2,-2.1 -1,-0.2 1,-0.3 -19,-0.1 0.584 71.3 51.6 -77.1 -9.2 16.2 -14.9 8.3 53 205 A F T 3 S- 0 0 3 -3,-0.1 -1,-0.3 -20,-0.1 -2,-0.1 0.370 106.1-126.4-102.1 2.5 19.1 -14.0 6.0 54 206 A N < - 0 0 51 -3,-1.6 2,-0.3 1,-0.2 -2,-0.1 0.850 40.1-176.8 57.0 41.7 18.4 -17.0 3.7 55 207 A I - 0 0 19 1,-0.1 25,-2.5 25,-0.1 -1,-0.2 -0.539 21.9-123.3 -76.8 128.6 22.0 -18.3 4.0 56 208 A K B -B 79 0B 124 -2,-0.3 2,-0.8 23,-0.2 23,-0.3 -0.356 14.1-124.9 -70.0 148.1 22.9 -21.3 2.0 57 209 A A + 0 0 12 21,-2.4 21,-0.2 9,-0.2 2,-0.1 -0.869 42.2 170.9 -94.6 108.8 24.2 -24.5 3.6 58 210 A G > - 0 0 42 -2,-0.8 3,-1.4 0, 0.0 21,-0.0 -0.160 51.5 -68.8-104.5-160.7 27.5 -25.4 1.8 59 211 A S T 3 S+ 0 0 135 1,-0.3 -2,-0.0 -2,-0.1 0, 0.0 0.760 128.9 53.6 -67.8 -25.0 30.3 -27.8 2.3 60 212 A N T 3 S+ 0 0 126 2,-0.0 2,-0.6 0, 0.0 -1,-0.3 0.401 86.2 100.2 -90.8 2.4 31.6 -26.1 5.4 61 213 A W < + 0 0 46 -3,-1.4 -4,-0.0 1,-0.1 4,-0.0 -0.825 36.4 167.1 -96.1 120.1 28.2 -26.2 7.2 62 214 A T + 0 0 141 -2,-0.6 -1,-0.1 2,-0.0 3,-0.1 0.303 50.7 90.3-111.5 2.5 27.8 -29.0 9.7 63 215 A G S S- 0 0 37 1,-0.2 19,-0.1 0, 0.0 2,-0.1 0.034 91.2 -44.7 -86.3-163.8 24.6 -27.8 11.4 64 216 A K E -C 81 0B 140 17,-0.6 17,-1.9 -15,-0.1 2,-0.4 -0.362 58.0-152.0 -65.3 143.0 20.9 -28.4 10.7 65 217 A V E -C 80 0B 52 15,-0.2 2,-0.4 -3,-0.1 15,-0.2 -0.959 11.7-170.3-123.9 138.4 19.9 -28.2 7.1 66 218 A V E -C 79 0B 8 13,-2.8 13,-3.0 -2,-0.4 2,-0.4 -0.992 15.3-141.0-126.6 134.7 16.6 -27.3 5.5 67 219 A E E +C 78 0B 106 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.769 25.0 175.3 -92.7 140.1 15.6 -27.7 1.9 68 220 A A E -C 77 0B 23 9,-2.1 9,-2.6 -2,-0.4 2,-0.3 -0.996 31.2-109.1-146.4 147.2 13.6 -25.0 0.2 69 221 A R E -C 76 0B 185 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.589 31.1-165.5 -83.2 130.2 12.3 -24.3 -3.4 70 222 A T E C 75 0B 42 5,-3.4 5,-2.9 -2,-0.3 -1,-0.0 -0.807 360.0 360.0-111.4 155.4 13.9 -21.5 -5.4 71 223 A V 0 0 161 -2,-0.3 3,-0.3 3,-0.2 5,-0.0 -0.805 360.0 360.0 -94.0 360.0 12.6 -19.9 -8.6 72 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 73 231 A K 0 0 193 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 154.2 12.3 -23.2 -13.4 74 232 A V - 0 0 86 -3,-0.3 2,-0.3 -5,-0.0 -3,-0.2 -0.897 360.0-174.7-105.5 128.4 11.9 -24.4 -9.7 75 233 A R E - C 0 70B 137 -5,-2.9 -5,-3.4 -2,-0.5 2,-0.6 -0.846 25.6-123.4-123.7 155.0 15.0 -25.7 -7.9 76 234 A V E - C 0 69B 86 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.897 31.7-173.4-101.9 116.7 15.7 -27.2 -4.5 77 235 A E E - C 0 68B 65 -9,-2.6 -9,-2.1 -2,-0.6 2,-0.5 -0.801 22.0-126.1-108.4 149.2 18.4 -25.3 -2.6 78 236 A R E - C 0 67B 131 -2,-0.3 -21,-2.4 -11,-0.2 2,-0.3 -0.852 32.4-176.1 -97.9 126.2 20.0 -26.3 0.7 79 237 A F E -BC 56 66B 16 -13,-3.0 -13,-2.8 -2,-0.5 -23,-0.2 -0.845 28.1-103.7-121.8 155.4 19.8 -23.7 3.5 80 238 A R E - C 0 65B 21 -25,-2.5 2,-0.3 -2,-0.3 -15,-0.2 -0.406 32.9-158.0 -70.8 150.6 21.1 -23.4 7.0 81 239 A A E - C 0 64B 3 -17,-1.9 -17,-0.6 -31,-0.1 2,-0.2 -0.990 8.8-171.3-132.7 146.2 18.7 -24.0 9.9 82 240 A Y - 0 0 11 -33,-3.0 -31,-0.1 -2,-0.3 3,-0.1 -0.719 33.6-120.7-129.8 174.5 19.0 -22.8 13.5 83 241 A D S S- 0 0 100 -2,-0.2 2,-0.3 1,-0.2 -33,-0.1 0.581 91.2 -9.8 -94.3 -10.9 17.3 -23.2 16.9 84 242 A S S > S- 0 0 31 -35,-0.2 4,-1.9 1,-0.1 -1,-0.2 -0.966 72.4 -95.7-169.6 167.9 16.5 -19.5 17.3 85 243 A Y H > S+ 0 0 37 -2,-0.3 4,-2.8 2,-0.2 5,-0.3 0.867 122.4 62.9 -63.2 -36.1 17.0 -16.0 15.8 86 244 A E H > S+ 0 0 89 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.943 106.8 41.2 -51.0 -51.5 19.7 -15.7 18.5 87 245 A Q H > S+ 0 0 70 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.886 112.3 55.8 -67.8 -39.1 21.7 -18.5 16.9 88 246 A A H X S+ 0 0 2 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.917 109.9 45.2 -56.9 -46.1 20.9 -17.2 13.4 89 247 A F H X S+ 0 0 4 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.821 108.7 56.6 -70.9 -31.4 22.4 -13.8 14.2 90 248 A Q H X S+ 0 0 108 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.918 109.7 46.1 -61.8 -44.1 25.5 -15.4 15.9 91 249 A D H X S+ 0 0 24 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.913 112.1 51.1 -65.3 -42.8 26.1 -17.3 12.6 92 250 A Y H X S+ 0 0 4 -4,-2.2 4,-3.1 2,-0.2 5,-0.5 0.921 109.3 50.4 -57.0 -47.1 25.6 -14.1 10.6 93 251 A A H X S+ 0 0 20 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.884 111.7 48.6 -62.2 -39.7 28.1 -12.2 12.9 94 252 A D H X S+ 0 0 91 -4,-2.0 4,-1.9 3,-0.2 5,-0.4 0.962 116.3 42.6 -61.9 -52.4 30.7 -15.0 12.4 95 253 A L H X S+ 0 0 43 -4,-2.8 4,-1.9 1,-0.2 7,-0.2 0.951 124.0 33.4 -60.5 -55.4 30.2 -15.0 8.6 96 254 A V H < S+ 0 0 6 -4,-3.1 10,-0.2 1,-0.2 9,-0.2 0.851 121.0 49.6 -74.9 -34.9 30.1 -11.3 8.0 97 255 A G H < S+ 0 0 40 -4,-1.9 -1,-0.2 -5,-0.5 -2,-0.2 0.782 122.9 27.3 -74.1 -29.5 32.5 -10.3 10.8 98 256 A N H < S+ 0 0 114 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.744 91.1 96.7-109.3 -30.3 35.3 -12.8 9.9 99 257 A S >< - 0 0 32 -4,-1.9 3,-1.5 -5,-0.4 4,-0.1 -0.490 66.9-140.8 -67.8 124.6 35.2 -13.6 6.2 100 258 A P G > S+ 0 0 112 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.822 99.0 61.0 -59.4 -32.3 37.7 -11.4 4.4 101 259 A R G 3 S+ 0 0 161 1,-0.3 3,-0.4 2,-0.1 21,-0.1 0.778 105.5 50.1 -65.2 -22.8 35.4 -10.8 1.4 102 260 A Y G X S+ 0 0 18 -3,-1.5 3,-2.2 -7,-0.2 4,-0.5 0.304 77.4 112.1 -91.5 8.0 33.0 -9.1 3.8 103 261 A A T < + 0 0 62 -3,-1.8 3,-0.3 1,-0.3 -1,-0.2 0.712 66.2 63.9 -59.3 -23.4 35.7 -6.9 5.3 104 262 A K T 3 S+ 0 0 105 -3,-0.4 -1,-0.3 13,-0.2 13,-0.2 0.612 87.4 73.3 -77.2 -11.5 34.2 -3.7 3.9 105 263 A V S X S+ 0 0 0 -3,-2.2 3,-1.8 12,-0.2 -1,-0.2 0.934 73.6 92.9 -66.7 -48.2 31.0 -4.1 6.0 106 264 A A T 3 S+ 0 0 59 -4,-0.5 -86,-0.2 -3,-0.3 3,-0.1 -0.143 94.0 12.1 -55.8 136.3 32.5 -3.2 9.4 107 265 A G T 3 S+ 0 0 51 -88,-1.5 -1,-0.2 1,-0.3 2,-0.2 0.349 85.8 142.9 83.0 -5.8 32.2 0.5 10.4 108 266 A K < + 0 0 61 -3,-1.8 -1,-0.3 -89,-0.3 -3,-0.0 -0.502 21.5 173.2 -71.1 131.6 29.8 1.5 7.7 109 267 A T + 0 0 115 -2,-0.2 2,-0.5 -88,-0.1 -1,-0.1 0.313 55.9 83.9-120.5 4.8 27.2 4.0 8.9 110 268 A D S > S- 0 0 83 1,-0.1 4,-2.5 -88,-0.0 5,-0.2 -0.943 73.3-139.0-109.1 131.8 25.5 4.7 5.5 111 269 A G H > S+ 0 0 1 -2,-0.5 4,-2.3 1,-0.2 5,-0.1 0.900 102.2 44.3 -52.9 -50.6 22.8 2.3 4.3 112 270 A H H > S+ 0 0 50 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.903 112.9 51.2 -66.2 -41.4 23.9 2.2 0.7 113 271 A A H > S+ 0 0 11 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.894 110.7 49.7 -61.7 -41.1 27.6 1.8 1.6 114 272 A F H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.921 111.8 48.2 -60.3 -47.0 26.7 -1.1 3.9 115 273 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.890 109.8 51.6 -63.6 -42.5 24.6 -2.7 1.1 116 274 A R H X S+ 0 0 133 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.876 109.2 51.8 -59.8 -38.7 27.5 -2.2 -1.4 117 275 A A H X S+ 0 0 4 -4,-1.9 4,-1.9 2,-0.2 -12,-0.2 0.885 108.1 50.5 -67.4 -40.1 29.8 -3.9 1.1 118 276 A L H X>S+ 0 0 0 -4,-2.1 5,-2.5 2,-0.2 4,-0.6 0.901 111.4 49.3 -61.7 -41.5 27.4 -6.9 1.5 119 277 A Q H ><5S+ 0 0 59 -4,-2.2 3,-1.1 3,-0.2 -2,-0.2 0.916 106.9 54.3 -65.2 -43.9 27.3 -7.2 -2.3 120 278 A E H 3<5S+ 0 0 127 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.892 107.7 51.8 -53.1 -42.7 31.2 -7.1 -2.6 121 279 A G H 3<5S- 0 0 2 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.644 121.5-111.1 -69.8 -17.0 31.2 -10.0 -0.1 122 280 A G T <<5S+ 0 0 37 -3,-1.1 -3,-0.2 -4,-0.6 3,-0.2 0.688 72.6 138.5 93.7 22.7 28.8 -11.9 -2.3 123 281 A Y S - 0 0 61 1,-0.1 3,-1.9 2,-0.1 4,-0.3 -0.321 64.2-133.8 -51.5 127.1 21.4 -8.9 -8.1 127 285 A P T 3 S+ 0 0 118 0, 0.0 3,-0.3 0, 0.0 4,-0.3 0.758 103.7 52.7 -60.7 -23.9 22.5 -5.5 -9.5 128 286 A S T 3> S+ 0 0 39 1,-0.2 4,-2.5 2,-0.1 5,-0.2 0.399 79.7 101.5 -90.2 4.1 19.6 -3.7 -7.8 129 287 A Y H <> S+ 0 0 19 -3,-1.9 4,-2.9 1,-0.2 5,-0.2 0.901 79.1 48.1 -58.9 -49.1 20.4 -5.1 -4.3 130 288 A A H > S+ 0 0 7 -4,-0.3 4,-2.5 -3,-0.3 -1,-0.2 0.905 114.3 46.7 -59.9 -44.6 22.2 -2.0 -2.9 131 289 A D H > S+ 0 0 112 -4,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.908 114.0 48.6 -61.8 -43.7 19.4 0.3 -4.0 132 290 A K H X S+ 0 0 110 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.920 114.6 43.9 -64.5 -45.9 16.7 -2.0 -2.7 133 291 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 3,-0.2 0.908 111.2 53.1 -69.1 -42.5 18.3 -2.5 0.7 134 292 A A H X S+ 0 0 8 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.866 104.9 56.9 -58.4 -38.0 19.2 1.2 1.2 135 293 A R H X S+ 0 0 211 -4,-1.7 4,-0.5 2,-0.2 -1,-0.2 0.885 110.9 42.9 -61.7 -40.0 15.5 2.0 0.5 136 294 A V H >< S+ 0 0 27 -4,-1.3 3,-0.7 -3,-0.2 6,-0.4 0.935 114.1 50.9 -68.9 -47.7 14.5 -0.2 3.4 137 295 A I H 3< S+ 0 0 6 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.878 121.7 32.9 -56.1 -42.0 17.3 1.1 5.7 138 296 A N H 3< S+ 0 0 111 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.427 99.9 115.6 -96.2 -1.3 16.3 4.7 5.0 139 297 A G S S+ 0 0 95 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.815 106.7 62.4 -69.5 -33.4 9.6 5.3 6.7 141 299 A A H > S+ 0 0 45 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.938 109.3 40.5 -59.1 -48.3 8.2 1.8 7.2 142 300 A L H > S+ 0 0 1 -6,-0.4 4,-2.5 2,-0.2 5,-0.2 0.933 114.3 52.8 -65.1 -47.2 11.4 0.8 9.1 143 301 A R H X S+ 0 0 144 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.901 109.9 48.4 -54.9 -46.6 11.6 4.1 11.0 144 302 A Q H X S+ 0 0 126 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.895 113.1 47.4 -62.1 -43.2 8.0 3.8 12.2 145 303 A R H X S+ 0 0 72 -4,-1.8 4,-1.6 -5,-0.2 -1,-0.2 0.844 110.9 51.5 -70.1 -34.0 8.5 0.2 13.4 146 304 A L H X S+ 0 0 39 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.910 110.6 48.5 -67.2 -42.4 11.8 1.1 15.1 147 305 A M H < S+ 0 0 125 -4,-2.3 3,-0.3 1,-0.2 -2,-0.2 0.928 112.0 49.3 -61.9 -44.3 10.0 4.0 17.0 148 306 A A H < S+ 0 0 68 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.831 108.8 54.6 -61.0 -34.4 7.2 1.6 17.9 149 307 A S H < S+ 0 0 33 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.821 88.5 97.2 -70.9 -33.9 9.7 -1.0 19.2 150 308 A A < - 0 0 55 -4,-1.5 -144,-0.0 -3,-0.3 -3,-0.0 -0.252 69.2-141.6 -65.4 141.9 11.5 1.4 21.6 151 309 A A S S+ 0 0 117 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 0.712 84.5 39.5 -71.2 -23.6 10.6 1.5 25.3 152 310 A S 0 0 103 -5,-0.0 -2,-0.1 0, 0.0 0, 0.0 -0.824 360.0 360.0-127.8 162.6 11.0 5.3 25.4 153 311 A A 0 0 151 -2,-0.3 -6,-0.0 0, 0.0 -2,-0.0 -0.978 360.0 360.0-137.6 360.0 10.2 8.4 23.3