USER MOD reduce.3.24.130724 H: found=0, std=0, add=507, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 508 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 178:sc= 0.812 (180deg=0.804) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -69:sc= 0.484 USER MOD Single : A 25 TYR OH : rot 180:sc=-0.00666 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 162:sc= -0.0401 (180deg=-0.277) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 96:sc= 0.633 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= -0.268 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 123 N MET A 9 19.668 -9.644 2.308 1.00 0.00 N ATOM 124 CA MET A 9 19.617 -11.077 1.950 1.00 0.00 C ATOM 125 C MET A 9 20.756 -11.903 2.609 1.00 0.00 C ATOM 126 O MET A 9 21.842 -11.383 2.902 1.00 0.00 O ATOM 127 CB MET A 9 19.661 -11.245 0.407 1.00 0.00 C ATOM 128 CG MET A 9 18.433 -10.734 -0.370 1.00 0.00 C ATOM 129 SD MET A 9 18.314 -8.934 -0.438 1.00 0.00 S ATOM 130 CE MET A 9 16.816 -8.718 -1.411 1.00 0.00 C ATOM 0 HA MET A 9 18.676 -11.467 2.337 1.00 0.00 H new ATOM 0 HB2 MET A 9 20.543 -10.727 0.031 1.00 0.00 H new ATOM 0 HB3 MET A 9 19.793 -12.303 0.182 1.00 0.00 H new ATOM 0 HG2 MET A 9 18.469 -11.125 -1.387 1.00 0.00 H new ATOM 0 HG3 MET A 9 17.530 -11.132 0.093 1.00 0.00 H new ATOM 0 HE1 MET A 9 16.614 -7.654 -1.537 1.00 0.00 H new ATOM 0 HE2 MET A 9 16.948 -9.181 -2.389 1.00 0.00 H new ATOM 0 HE3 MET A 9 15.977 -9.188 -0.897 1.00 0.00 H new ATOM 140 N TYR A 10 20.481 -13.205 2.798 1.00 0.00 N ATOM 141 CA TYR A 10 21.390 -14.160 3.466 1.00 0.00 C ATOM 142 C TYR A 10 22.549 -14.530 2.520 1.00 0.00 C ATOM 143 O TYR A 10 22.335 -15.203 1.512 1.00 0.00 O ATOM 144 CB TYR A 10 20.595 -15.436 3.884 1.00 0.00 C ATOM 145 CG TYR A 10 19.427 -15.166 4.856 1.00 0.00 C ATOM 146 CD1 TYR A 10 18.217 -14.618 4.407 1.00 0.00 C ATOM 147 CD2 TYR A 10 19.528 -15.456 6.221 1.00 0.00 C ATOM 148 CE1 TYR A 10 17.170 -14.370 5.268 1.00 0.00 C ATOM 149 CE2 TYR A 10 18.476 -15.208 7.087 1.00 0.00 C ATOM 150 CZ TYR A 10 17.304 -14.667 6.604 1.00 0.00 C ATOM 151 OH TYR A 10 16.256 -14.421 7.467 1.00 0.00 O ATOM 0 H TYR A 10 19.609 -13.633 2.487 1.00 0.00 H new ATOM 0 HA TYR A 10 21.808 -13.698 4.361 1.00 0.00 H new ATOM 0 HB2 TYR A 10 20.203 -15.915 2.987 1.00 0.00 H new ATOM 0 HB3 TYR A 10 21.283 -16.143 4.348 1.00 0.00 H new ATOM 0 HD1 TYR A 10 18.103 -14.384 3.359 1.00 0.00 H new ATOM 0 HD2 TYR A 10 20.443 -15.881 6.606 1.00 0.00 H new ATOM 0 HE1 TYR A 10 16.250 -13.945 4.896 1.00 0.00 H new ATOM 0 HE2 TYR A 10 18.574 -15.438 8.138 1.00 0.00 H new ATOM 0 HH TYR A 10 16.511 -14.687 8.375 1.00 0.00 H new ATOM 161 N VAL A 11 23.763 -14.074 2.842 1.00 0.00 N ATOM 162 CA VAL A 11 24.937 -14.238 1.967 1.00 0.00 C ATOM 163 C VAL A 11 25.519 -15.663 2.091 1.00 0.00 C ATOM 164 O VAL A 11 25.755 -16.143 3.194 1.00 0.00 O ATOM 165 CB VAL A 11 26.030 -13.168 2.312 1.00 0.00 C ATOM 166 CG1 VAL A 11 27.298 -13.310 1.428 1.00 0.00 C ATOM 167 CG2 VAL A 11 25.435 -11.741 2.220 1.00 0.00 C ATOM 0 H VAL A 11 23.964 -13.582 3.713 1.00 0.00 H new ATOM 0 HA VAL A 11 24.617 -14.089 0.936 1.00 0.00 H new ATOM 0 HB VAL A 11 26.350 -13.346 3.339 1.00 0.00 H new ATOM 0 HG11 VAL A 11 28.023 -12.546 1.707 1.00 0.00 H new ATOM 0 HG12 VAL A 11 27.736 -14.297 1.576 1.00 0.00 H new ATOM 0 HG13 VAL A 11 27.026 -13.187 0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 11 26.206 -11.009 2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 11 25.071 -11.563 1.208 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.609 -11.645 2.925 1.00 0.00 H new ATOM 177 N PHE A 12 25.693 -16.334 0.943 1.00 0.00 N ATOM 178 CA PHE A 12 26.312 -17.666 0.838 1.00 0.00 C ATOM 179 C PHE A 12 27.682 -17.558 0.144 1.00 0.00 C ATOM 180 O PHE A 12 27.800 -16.949 -0.925 1.00 0.00 O ATOM 181 CB PHE A 12 25.384 -18.649 0.052 1.00 0.00 C ATOM 182 CG PHE A 12 24.188 -19.178 0.857 1.00 0.00 C ATOM 183 CD1 PHE A 12 23.233 -18.312 1.382 1.00 0.00 C ATOM 184 CD2 PHE A 12 24.031 -20.547 1.101 1.00 0.00 C ATOM 185 CE1 PHE A 12 22.159 -18.788 2.109 1.00 0.00 C ATOM 186 CE2 PHE A 12 22.953 -21.022 1.827 1.00 0.00 C ATOM 187 CZ PHE A 12 22.022 -20.140 2.338 1.00 0.00 C ATOM 0 H PHE A 12 25.401 -15.958 0.041 1.00 0.00 H new ATOM 0 HA PHE A 12 26.453 -18.061 1.844 1.00 0.00 H new ATOM 0 HB2 PHE A 12 25.011 -18.143 -0.838 1.00 0.00 H new ATOM 0 HB3 PHE A 12 25.979 -19.496 -0.289 1.00 0.00 H new ATOM 0 HD1 PHE A 12 23.333 -17.249 1.218 1.00 0.00 H new ATOM 0 HD2 PHE A 12 24.762 -21.243 0.717 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.425 -18.099 2.499 1.00 0.00 H new ATOM 0 HE2 PHE A 12 22.840 -22.083 1.994 1.00 0.00 H new ATOM 0 HZ PHE A 12 21.188 -20.509 2.916 1.00 0.00 H new ATOM 197 N LYS A 13 28.704 -18.156 0.776 1.00 0.00 N ATOM 198 CA LYS A 13 30.053 -18.311 0.217 1.00 0.00 C ATOM 199 C LYS A 13 30.020 -19.481 -0.795 1.00 0.00 C ATOM 200 O LYS A 13 30.268 -20.645 -0.440 1.00 0.00 O ATOM 201 CB LYS A 13 31.064 -18.575 1.378 1.00 0.00 C ATOM 202 CG LYS A 13 32.553 -18.657 0.977 1.00 0.00 C ATOM 203 CD LYS A 13 33.127 -17.312 0.467 1.00 0.00 C ATOM 204 CE LYS A 13 34.629 -17.400 0.143 1.00 0.00 C ATOM 205 NZ LYS A 13 34.919 -18.421 -0.905 1.00 0.00 N ATOM 0 H LYS A 13 28.612 -18.554 1.711 1.00 0.00 H new ATOM 0 HA LYS A 13 30.376 -17.408 -0.301 1.00 0.00 H new ATOM 0 HB2 LYS A 13 30.951 -17.783 2.118 1.00 0.00 H new ATOM 0 HB3 LYS A 13 30.788 -19.509 1.867 1.00 0.00 H new ATOM 0 HG2 LYS A 13 33.135 -18.990 1.836 1.00 0.00 H new ATOM 0 HG3 LYS A 13 32.671 -19.412 0.200 1.00 0.00 H new ATOM 0 HD2 LYS A 13 32.583 -17.003 -0.426 1.00 0.00 H new ATOM 0 HD3 LYS A 13 32.965 -16.542 1.221 1.00 0.00 H new ATOM 0 HE2 LYS A 13 34.984 -16.426 -0.193 1.00 0.00 H new ATOM 0 HE3 LYS A 13 35.181 -17.646 1.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 35.937 -18.422 -1.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 34.635 -19.361 -0.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 34.387 -18.193 -1.769 1.00 0.00 H new ATOM 219 N GLY A 14 29.626 -19.156 -2.041 1.00 0.00 N ATOM 220 CA GLY A 14 29.428 -20.154 -3.090 1.00 0.00 C ATOM 221 C GLY A 14 28.241 -21.069 -2.781 1.00 0.00 C ATOM 222 O GLY A 14 27.094 -20.692 -3.023 1.00 0.00 O ATOM 0 H GLY A 14 29.439 -18.199 -2.340 1.00 0.00 H new ATOM 0 HA2 GLY A 14 29.263 -19.652 -4.044 1.00 0.00 H new ATOM 0 HA3 GLY A 14 30.332 -20.754 -3.198 1.00 0.00 H new ATOM 226 N GLU A 15 28.523 -22.252 -2.200 1.00 0.00 N ATOM 227 CA GLU A 15 27.492 -23.241 -1.821 1.00 0.00 C ATOM 228 C GLU A 15 27.095 -23.066 -0.343 1.00 0.00 C ATOM 229 O GLU A 15 25.918 -23.151 0.017 1.00 0.00 O ATOM 230 CB GLU A 15 28.013 -24.693 -2.046 1.00 0.00 C ATOM 231 CG GLU A 15 28.581 -24.972 -3.450 1.00 0.00 C ATOM 232 CD GLU A 15 27.574 -24.720 -4.586 1.00 0.00 C ATOM 233 OE1 GLU A 15 26.737 -25.606 -4.858 1.00 0.00 O ATOM 234 OE2 GLU A 15 27.635 -23.647 -5.225 1.00 0.00 O ATOM 0 H GLU A 15 29.473 -22.550 -1.980 1.00 0.00 H new ATOM 0 HA GLU A 15 26.619 -23.073 -2.451 1.00 0.00 H new ATOM 0 HB2 GLU A 15 28.788 -24.903 -1.309 1.00 0.00 H new ATOM 0 HB3 GLU A 15 27.196 -25.389 -1.856 1.00 0.00 H new ATOM 0 HG2 GLU A 15 29.458 -24.345 -3.608 1.00 0.00 H new ATOM 0 HG3 GLU A 15 28.917 -26.008 -3.497 1.00 0.00 H new ATOM 241 N GLU A 16 28.107 -22.814 0.504 1.00 0.00 N ATOM 242 CA GLU A 16 27.947 -22.814 1.974 1.00 0.00 C ATOM 243 C GLU A 16 27.417 -21.452 2.443 1.00 0.00 C ATOM 244 O GLU A 16 27.660 -20.442 1.793 1.00 0.00 O ATOM 245 CB GLU A 16 29.305 -23.148 2.666 1.00 0.00 C ATOM 246 CG GLU A 16 30.395 -22.065 2.513 1.00 0.00 C ATOM 247 CD GLU A 16 31.790 -22.519 2.966 1.00 0.00 C ATOM 248 OE1 GLU A 16 32.048 -22.558 4.190 1.00 0.00 O ATOM 249 OE2 GLU A 16 32.627 -22.864 2.097 1.00 0.00 O ATOM 0 H GLU A 16 29.056 -22.605 0.194 1.00 0.00 H new ATOM 0 HA GLU A 16 27.225 -23.581 2.253 1.00 0.00 H new ATOM 0 HB2 GLU A 16 29.124 -23.314 3.728 1.00 0.00 H new ATOM 0 HB3 GLU A 16 29.684 -24.085 2.257 1.00 0.00 H new ATOM 0 HG2 GLU A 16 30.445 -21.758 1.468 1.00 0.00 H new ATOM 0 HG3 GLU A 16 30.104 -21.187 3.089 1.00 0.00 H new ATOM 256 N SER A 17 26.687 -21.438 3.563 1.00 0.00 N ATOM 257 CA SER A 17 26.136 -20.205 4.140 1.00 0.00 C ATOM 258 C SER A 17 27.261 -19.417 4.837 1.00 0.00 C ATOM 259 O SER A 17 27.903 -19.927 5.763 1.00 0.00 O ATOM 260 CB SER A 17 24.991 -20.547 5.119 1.00 0.00 C ATOM 261 OG SER A 17 24.270 -19.385 5.496 1.00 0.00 O ATOM 0 H SER A 17 26.461 -22.278 4.095 1.00 0.00 H new ATOM 0 HA SER A 17 25.721 -19.579 3.350 1.00 0.00 H new ATOM 0 HB2 SER A 17 24.313 -21.263 4.653 1.00 0.00 H new ATOM 0 HB3 SER A 17 25.401 -21.027 6.007 1.00 0.00 H new ATOM 0 HG SER A 17 23.551 -19.632 6.114 1.00 0.00 H new ATOM 267 N PHE A 18 27.508 -18.187 4.354 1.00 0.00 N ATOM 268 CA PHE A 18 28.597 -17.324 4.844 1.00 0.00 C ATOM 269 C PHE A 18 28.122 -16.489 6.046 1.00 0.00 C ATOM 270 O PHE A 18 28.784 -16.436 7.084 1.00 0.00 O ATOM 271 CB PHE A 18 29.091 -16.403 3.692 1.00 0.00 C ATOM 272 CG PHE A 18 30.361 -15.608 4.001 1.00 0.00 C ATOM 273 CD1 PHE A 18 31.486 -16.248 4.526 1.00 0.00 C ATOM 274 CD2 PHE A 18 30.429 -14.230 3.789 1.00 0.00 C ATOM 275 CE1 PHE A 18 32.638 -15.543 4.812 1.00 0.00 C ATOM 276 CE2 PHE A 18 31.584 -13.528 4.077 1.00 0.00 C ATOM 277 CZ PHE A 18 32.683 -14.185 4.600 1.00 0.00 C ATOM 0 H PHE A 18 26.955 -17.762 3.610 1.00 0.00 H new ATOM 0 HA PHE A 18 29.427 -17.948 5.176 1.00 0.00 H new ATOM 0 HB2 PHE A 18 29.270 -17.015 2.808 1.00 0.00 H new ATOM 0 HB3 PHE A 18 28.294 -15.703 3.439 1.00 0.00 H new ATOM 0 HD1 PHE A 18 31.454 -17.312 4.711 1.00 0.00 H new ATOM 0 HD2 PHE A 18 29.570 -13.707 3.396 1.00 0.00 H new ATOM 0 HE1 PHE A 18 33.504 -16.058 5.202 1.00 0.00 H new ATOM 0 HE2 PHE A 18 31.629 -12.465 3.893 1.00 0.00 H new ATOM 0 HZ PHE A 18 33.578 -13.631 4.842 1.00 0.00 H new ATOM 287 N GLY A 19 26.958 -15.854 5.876 1.00 0.00 N ATOM 288 CA GLY A 19 26.371 -14.948 6.862 1.00 0.00 C ATOM 289 C GLY A 19 25.136 -14.276 6.297 1.00 0.00 C ATOM 290 O GLY A 19 24.417 -14.869 5.487 1.00 0.00 O ATOM 0 H GLY A 19 26.390 -15.958 5.035 1.00 0.00 H new ATOM 0 HA2 GLY A 19 26.110 -15.502 7.764 1.00 0.00 H new ATOM 0 HA3 GLY A 19 27.102 -14.193 7.152 1.00 0.00 H new ATOM 294 N GLU A 20 24.852 -13.054 6.764 1.00 0.00 N ATOM 295 CA GLU A 20 23.796 -12.186 6.208 1.00 0.00 C ATOM 296 C GLU A 20 24.424 -10.833 5.893 1.00 0.00 C ATOM 297 O GLU A 20 25.317 -10.403 6.625 1.00 0.00 O ATOM 298 CB GLU A 20 22.616 -11.948 7.210 1.00 0.00 C ATOM 299 CG GLU A 20 21.895 -13.202 7.748 1.00 0.00 C ATOM 300 CD GLU A 20 22.713 -14.011 8.762 1.00 0.00 C ATOM 301 OE1 GLU A 20 23.201 -13.431 9.752 1.00 0.00 O ATOM 302 OE2 GLU A 20 22.873 -15.229 8.584 1.00 0.00 O ATOM 0 H GLU A 20 25.352 -12.632 7.547 1.00 0.00 H new ATOM 0 HA GLU A 20 23.388 -12.678 5.325 1.00 0.00 H new ATOM 0 HB2 GLU A 20 23.001 -11.387 8.061 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.876 -11.315 6.719 1.00 0.00 H new ATOM 0 HG2 GLU A 20 20.958 -12.897 8.215 1.00 0.00 H new ATOM 0 HG3 GLU A 20 21.637 -13.847 6.908 1.00 0.00 H new ATOM 309 N SER A 21 23.961 -10.155 4.835 1.00 0.00 N ATOM 310 CA SER A 21 24.322 -8.743 4.610 1.00 0.00 C ATOM 311 C SER A 21 23.615 -7.881 5.675 1.00 0.00 C ATOM 312 O SER A 21 22.668 -8.349 6.328 1.00 0.00 O ATOM 313 CB SER A 21 23.952 -8.301 3.169 1.00 0.00 C ATOM 314 OG SER A 21 22.579 -8.483 2.890 1.00 0.00 O ATOM 0 H SER A 21 23.343 -10.552 4.127 1.00 0.00 H new ATOM 0 HA SER A 21 25.400 -8.613 4.707 1.00 0.00 H new ATOM 0 HB2 SER A 21 24.212 -7.251 3.035 1.00 0.00 H new ATOM 0 HB3 SER A 21 24.545 -8.870 2.453 1.00 0.00 H new ATOM 0 HG SER A 21 22.380 -9.441 2.836 1.00 0.00 H new ATOM 320 N ILE A 22 24.072 -6.644 5.871 1.00 0.00 N ATOM 321 CA ILE A 22 23.510 -5.744 6.897 1.00 0.00 C ATOM 322 C ILE A 22 23.417 -4.326 6.306 1.00 0.00 C ATOM 323 O ILE A 22 22.425 -3.615 6.517 1.00 0.00 O ATOM 324 CB ILE A 22 24.368 -5.807 8.239 1.00 0.00 C ATOM 325 CG1 ILE A 22 23.631 -5.181 9.485 1.00 0.00 C ATOM 326 CG2 ILE A 22 25.777 -5.206 8.052 1.00 0.00 C ATOM 327 CD1 ILE A 22 23.570 -3.654 9.568 1.00 0.00 C ATOM 0 H ILE A 22 24.835 -6.234 5.332 1.00 0.00 H new ATOM 0 HA ILE A 22 22.505 -6.062 7.175 1.00 0.00 H new ATOM 0 HB ILE A 22 24.487 -6.867 8.461 1.00 0.00 H new ATOM 0 HG12 ILE A 22 22.609 -5.561 9.499 1.00 0.00 H new ATOM 0 HG13 ILE A 22 24.120 -5.549 10.387 1.00 0.00 H new ATOM 0 HG21 ILE A 22 26.327 -5.269 8.991 1.00 0.00 H new ATOM 0 HG22 ILE A 22 26.310 -5.762 7.281 1.00 0.00 H new ATOM 0 HG23 ILE A 22 25.690 -4.162 7.752 1.00 0.00 H new ATOM 0 HD11 ILE A 22 23.037 -3.360 10.472 1.00 0.00 H new ATOM 0 HD12 ILE A 22 24.582 -3.250 9.596 1.00 0.00 H new ATOM 0 HD13 ILE A 22 23.048 -3.263 8.695 1.00 0.00 H new ATOM 339 N ASP A 23 24.447 -3.943 5.532 1.00 0.00 N ATOM 340 CA ASP A 23 24.517 -2.619 4.894 1.00 0.00 C ATOM 341 C ASP A 23 25.372 -2.704 3.626 1.00 0.00 C ATOM 342 O ASP A 23 25.939 -3.758 3.322 1.00 0.00 O ATOM 343 CB ASP A 23 25.057 -1.554 5.905 1.00 0.00 C ATOM 344 CG ASP A 23 24.981 -0.102 5.394 1.00 0.00 C ATOM 345 OD1 ASP A 23 23.857 0.401 5.172 1.00 0.00 O ATOM 346 OD2 ASP A 23 26.036 0.532 5.179 1.00 0.00 O ATOM 0 H ASP A 23 25.250 -4.540 5.332 1.00 0.00 H new ATOM 0 HA ASP A 23 23.518 -2.298 4.600 1.00 0.00 H new ATOM 0 HB2 ASP A 23 24.491 -1.631 6.833 1.00 0.00 H new ATOM 0 HB3 ASP A 23 26.094 -1.789 6.144 1.00 0.00 H new ATOM 351 N VAL A 24 25.386 -1.618 2.855 1.00 0.00 N ATOM 352 CA VAL A 24 26.260 -1.451 1.694 1.00 0.00 C ATOM 353 C VAL A 24 26.530 0.053 1.509 1.00 0.00 C ATOM 354 O VAL A 24 25.610 0.872 1.625 1.00 0.00 O ATOM 355 CB VAL A 24 25.643 -2.105 0.391 1.00 0.00 C ATOM 356 CG1 VAL A 24 24.169 -1.699 0.203 1.00 0.00 C ATOM 357 CG2 VAL A 24 26.490 -1.787 -0.874 1.00 0.00 C ATOM 0 H VAL A 24 24.780 -0.815 3.022 1.00 0.00 H new ATOM 0 HA VAL A 24 27.201 -1.973 1.867 1.00 0.00 H new ATOM 0 HB VAL A 24 25.671 -3.186 0.529 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.776 -2.165 -0.701 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.588 -2.029 1.064 1.00 0.00 H new ATOM 0 HG13 VAL A 24 24.099 -0.615 0.112 1.00 0.00 H new ATOM 0 HG21 VAL A 24 26.032 -2.254 -1.746 1.00 0.00 H new ATOM 0 HG22 VAL A 24 26.533 -0.708 -1.021 1.00 0.00 H new ATOM 0 HG23 VAL A 24 27.500 -2.176 -0.743 1.00 0.00 H new ATOM 367 N TYR A 25 27.804 0.410 1.291 1.00 0.00 N ATOM 368 CA TYR A 25 28.216 1.778 0.939 1.00 0.00 C ATOM 369 C TYR A 25 29.244 1.704 -0.202 1.00 0.00 C ATOM 370 O TYR A 25 30.160 0.865 -0.163 1.00 0.00 O ATOM 371 CB TYR A 25 28.771 2.554 2.176 1.00 0.00 C ATOM 372 CG TYR A 25 30.092 2.034 2.784 1.00 0.00 C ATOM 373 CD1 TYR A 25 31.335 2.498 2.333 1.00 0.00 C ATOM 374 CD2 TYR A 25 30.103 1.095 3.813 1.00 0.00 C ATOM 375 CE1 TYR A 25 32.517 2.046 2.880 1.00 0.00 C ATOM 376 CE2 TYR A 25 31.287 0.647 4.360 1.00 0.00 C ATOM 377 CZ TYR A 25 32.491 1.119 3.893 1.00 0.00 C ATOM 378 OH TYR A 25 33.674 0.665 4.446 1.00 0.00 O ATOM 0 H TYR A 25 28.583 -0.246 1.354 1.00 0.00 H new ATOM 0 HA TYR A 25 27.346 2.341 0.601 1.00 0.00 H new ATOM 0 HB2 TYR A 25 28.915 3.595 1.888 1.00 0.00 H new ATOM 0 HB3 TYR A 25 28.009 2.542 2.956 1.00 0.00 H new ATOM 0 HD1 TYR A 25 31.368 3.228 1.537 1.00 0.00 H new ATOM 0 HD2 TYR A 25 29.167 0.711 4.189 1.00 0.00 H new ATOM 0 HE1 TYR A 25 33.461 2.420 2.513 1.00 0.00 H new ATOM 0 HE2 TYR A 25 31.268 -0.079 5.160 1.00 0.00 H new ATOM 0 HH TYR A 25 33.477 0.014 5.151 1.00 0.00 H new ATOM 388 N GLY A 26 29.068 2.572 -1.208 1.00 0.00 N ATOM 389 CA GLY A 26 29.948 2.625 -2.369 1.00 0.00 C ATOM 390 C GLY A 26 29.970 1.313 -3.153 1.00 0.00 C ATOM 391 O GLY A 26 28.988 0.949 -3.800 1.00 0.00 O ATOM 0 H GLY A 26 28.310 3.254 -1.234 1.00 0.00 H new ATOM 0 HA2 GLY A 26 29.626 3.432 -3.028 1.00 0.00 H new ATOM 0 HA3 GLY A 26 30.960 2.865 -2.042 1.00 0.00 H new ATOM 395 N ASP A 27 31.086 0.577 -3.040 1.00 0.00 N ATOM 396 CA ASP A 27 31.320 -0.683 -3.783 1.00 0.00 C ATOM 397 C ASP A 27 31.435 -1.879 -2.819 1.00 0.00 C ATOM 398 O ASP A 27 31.835 -2.970 -3.228 1.00 0.00 O ATOM 399 CB ASP A 27 32.621 -0.568 -4.634 1.00 0.00 C ATOM 400 CG ASP A 27 32.584 0.590 -5.645 1.00 0.00 C ATOM 401 OD1 ASP A 27 32.109 0.391 -6.784 1.00 0.00 O ATOM 402 OD2 ASP A 27 33.025 1.712 -5.303 1.00 0.00 O ATOM 0 H ASP A 27 31.860 0.836 -2.428 1.00 0.00 H new ATOM 0 HA ASP A 27 30.468 -0.851 -4.442 1.00 0.00 H new ATOM 0 HB2 ASP A 27 33.473 -0.432 -3.967 1.00 0.00 H new ATOM 0 HB3 ASP A 27 32.781 -1.504 -5.169 1.00 0.00 H new ATOM 407 N TYR A 28 31.054 -1.680 -1.542 1.00 0.00 N ATOM 408 CA TYR A 28 31.251 -2.682 -0.473 1.00 0.00 C ATOM 409 C TYR A 28 29.923 -3.050 0.202 1.00 0.00 C ATOM 410 O TYR A 28 29.335 -2.232 0.921 1.00 0.00 O ATOM 411 CB TYR A 28 32.249 -2.143 0.586 1.00 0.00 C ATOM 412 CG TYR A 28 33.665 -1.920 0.041 1.00 0.00 C ATOM 413 CD1 TYR A 28 34.526 -3.002 -0.184 1.00 0.00 C ATOM 414 CD2 TYR A 28 34.132 -0.640 -0.252 1.00 0.00 C ATOM 415 CE1 TYR A 28 35.802 -2.803 -0.669 1.00 0.00 C ATOM 416 CE2 TYR A 28 35.406 -0.442 -0.734 1.00 0.00 C ATOM 417 CZ TYR A 28 36.236 -1.522 -0.941 1.00 0.00 C ATOM 418 OH TYR A 28 37.514 -1.314 -1.412 1.00 0.00 O ATOM 0 H TYR A 28 30.602 -0.823 -1.222 1.00 0.00 H new ATOM 0 HA TYR A 28 31.659 -3.583 -0.931 1.00 0.00 H new ATOM 0 HB2 TYR A 28 31.870 -1.202 0.984 1.00 0.00 H new ATOM 0 HB3 TYR A 28 32.296 -2.845 1.419 1.00 0.00 H new ATOM 0 HD1 TYR A 28 34.186 -4.006 0.025 1.00 0.00 H new ATOM 0 HD2 TYR A 28 33.484 0.210 -0.098 1.00 0.00 H new ATOM 0 HE1 TYR A 28 36.457 -3.645 -0.835 1.00 0.00 H new ATOM 0 HE2 TYR A 28 35.754 0.557 -0.949 1.00 0.00 H new ATOM 0 HH TYR A 28 37.659 -0.355 -1.553 1.00 0.00 H new ATOM 428 N LEU A 29 29.455 -4.282 -0.055 1.00 0.00 N ATOM 429 CA LEU A 29 28.334 -4.894 0.666 1.00 0.00 C ATOM 430 C LEU A 29 28.852 -5.450 2.010 1.00 0.00 C ATOM 431 O LEU A 29 29.580 -6.452 2.040 1.00 0.00 O ATOM 432 CB LEU A 29 27.693 -6.029 -0.185 1.00 0.00 C ATOM 433 CG LEU A 29 26.453 -6.735 0.457 1.00 0.00 C ATOM 434 CD1 LEU A 29 25.235 -5.786 0.538 1.00 0.00 C ATOM 435 CD2 LEU A 29 26.102 -8.045 -0.288 1.00 0.00 C ATOM 0 H LEU A 29 29.850 -4.885 -0.777 1.00 0.00 H new ATOM 0 HA LEU A 29 27.566 -4.144 0.853 1.00 0.00 H new ATOM 0 HB2 LEU A 29 27.394 -5.613 -1.147 1.00 0.00 H new ATOM 0 HB3 LEU A 29 28.454 -6.783 -0.386 1.00 0.00 H new ATOM 0 HG LEU A 29 26.723 -7.001 1.479 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.394 -6.312 0.989 1.00 0.00 H new ATOM 0 HD12 LEU A 29 25.490 -4.918 1.147 1.00 0.00 H new ATOM 0 HD13 LEU A 29 24.962 -5.458 -0.465 1.00 0.00 H new ATOM 0 HD21 LEU A 29 25.236 -8.511 0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.872 -7.821 -1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.951 -8.728 -0.243 1.00 0.00 H new ATOM 447 N ILE A 30 28.500 -4.762 3.102 1.00 0.00 N ATOM 448 CA ILE A 30 28.865 -5.159 4.468 1.00 0.00 C ATOM 449 C ILE A 30 28.072 -6.406 4.883 1.00 0.00 C ATOM 450 O ILE A 30 26.846 -6.334 5.092 1.00 0.00 O ATOM 451 CB ILE A 30 28.591 -3.999 5.495 1.00 0.00 C ATOM 452 CG1 ILE A 30 29.250 -2.674 5.015 1.00 0.00 C ATOM 453 CG2 ILE A 30 29.084 -4.382 6.917 1.00 0.00 C ATOM 454 CD1 ILE A 30 30.763 -2.715 4.982 1.00 0.00 C ATOM 0 H ILE A 30 27.948 -3.905 3.063 1.00 0.00 H new ATOM 0 HA ILE A 30 29.932 -5.381 4.476 1.00 0.00 H new ATOM 0 HB ILE A 30 27.514 -3.843 5.549 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.881 -2.438 4.017 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.933 -1.864 5.672 1.00 0.00 H new ATOM 0 HG21 ILE A 30 28.882 -3.562 7.606 1.00 0.00 H new ATOM 0 HG22 ILE A 30 28.561 -5.277 7.255 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.156 -4.577 6.890 1.00 0.00 H new ATOM 0 HD11 ILE A 30 31.146 -1.754 4.637 1.00 0.00 H new ATOM 0 HD12 ILE A 30 31.143 -2.919 5.983 1.00 0.00 H new ATOM 0 HD13 ILE A 30 31.091 -3.501 4.302 1.00 0.00 H new ATOM 466 N VAL A 31 28.788 -7.538 4.969 1.00 0.00 N ATOM 467 CA VAL A 31 28.233 -8.829 5.369 1.00 0.00 C ATOM 468 C VAL A 31 28.621 -9.127 6.823 1.00 0.00 C ATOM 469 O VAL A 31 29.812 -9.207 7.159 1.00 0.00 O ATOM 470 CB VAL A 31 28.740 -9.984 4.428 1.00 0.00 C ATOM 471 CG1 VAL A 31 28.166 -11.364 4.842 1.00 0.00 C ATOM 472 CG2 VAL A 31 28.430 -9.651 2.949 1.00 0.00 C ATOM 0 H VAL A 31 29.785 -7.576 4.758 1.00 0.00 H new ATOM 0 HA VAL A 31 27.148 -8.778 5.283 1.00 0.00 H new ATOM 0 HB VAL A 31 29.822 -10.056 4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 31 28.542 -12.132 4.166 1.00 0.00 H new ATOM 0 HG12 VAL A 31 28.475 -11.595 5.861 1.00 0.00 H new ATOM 0 HG13 VAL A 31 27.078 -11.336 4.790 1.00 0.00 H new ATOM 0 HG21 VAL A 31 28.787 -10.460 2.311 1.00 0.00 H new ATOM 0 HG22 VAL A 31 27.354 -9.535 2.820 1.00 0.00 H new ATOM 0 HG23 VAL A 31 28.930 -8.723 2.672 1.00 0.00 H new ATOM 482 N LYS A 32 27.602 -9.275 7.671 1.00 0.00 N ATOM 483 CA LYS A 32 27.754 -9.712 9.060 1.00 0.00 C ATOM 484 C LYS A 32 28.022 -11.225 9.047 1.00 0.00 C ATOM 485 O LYS A 32 27.194 -11.999 8.557 1.00 0.00 O ATOM 486 CB LYS A 32 26.453 -9.373 9.867 1.00 0.00 C ATOM 487 CG LYS A 32 26.528 -9.461 11.427 1.00 0.00 C ATOM 488 CD LYS A 32 26.783 -10.880 11.995 1.00 0.00 C ATOM 489 CE LYS A 32 26.446 -10.999 13.492 1.00 0.00 C ATOM 490 NZ LYS A 32 24.991 -10.822 13.744 1.00 0.00 N ATOM 0 H LYS A 32 26.634 -9.092 7.408 1.00 0.00 H new ATOM 0 HA LYS A 32 28.584 -9.198 9.544 1.00 0.00 H new ATOM 0 HB2 LYS A 32 26.146 -8.361 9.601 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.663 -10.044 9.530 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.322 -8.800 11.775 1.00 0.00 H new ATOM 0 HG3 LYS A 32 25.593 -9.083 11.842 1.00 0.00 H new ATOM 0 HD2 LYS A 32 26.187 -11.601 11.436 1.00 0.00 H new ATOM 0 HD3 LYS A 32 27.829 -11.144 11.842 1.00 0.00 H new ATOM 0 HE2 LYS A 32 26.763 -11.975 13.860 1.00 0.00 H new ATOM 0 HE3 LYS A 32 27.006 -10.250 14.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 24.753 -11.201 14.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 24.753 -9.810 13.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 24.448 -11.331 13.017 1.00 0.00 H new ATOM 504 N VAL A 33 29.191 -11.624 9.561 1.00 0.00 N ATOM 505 CA VAL A 33 29.546 -13.032 9.781 1.00 0.00 C ATOM 506 C VAL A 33 29.979 -13.216 11.245 1.00 0.00 C ATOM 507 O VAL A 33 30.850 -12.491 11.732 1.00 0.00 O ATOM 508 CB VAL A 33 30.667 -13.526 8.779 1.00 0.00 C ATOM 509 CG1 VAL A 33 30.148 -13.488 7.327 1.00 0.00 C ATOM 510 CG2 VAL A 33 31.977 -12.705 8.904 1.00 0.00 C ATOM 0 H VAL A 33 29.925 -10.973 9.839 1.00 0.00 H new ATOM 0 HA VAL A 33 28.670 -13.649 9.583 1.00 0.00 H new ATOM 0 HB VAL A 33 30.905 -14.555 9.049 1.00 0.00 H new ATOM 0 HG11 VAL A 33 30.932 -13.831 6.651 1.00 0.00 H new ATOM 0 HG12 VAL A 33 29.279 -14.139 7.234 1.00 0.00 H new ATOM 0 HG13 VAL A 33 29.866 -12.467 7.068 1.00 0.00 H new ATOM 0 HG21 VAL A 33 32.713 -13.084 8.195 1.00 0.00 H new ATOM 0 HG22 VAL A 33 31.771 -11.657 8.688 1.00 0.00 H new ATOM 0 HG23 VAL A 33 32.368 -12.796 9.917 1.00 0.00 H new ATOM 520 N GLY A 34 29.307 -14.141 11.948 1.00 0.00 N ATOM 521 CA GLY A 34 29.656 -14.518 13.321 1.00 0.00 C ATOM 522 C GLY A 34 29.576 -13.371 14.329 1.00 0.00 C ATOM 523 O GLY A 34 28.521 -13.126 14.918 1.00 0.00 O ATOM 0 H GLY A 34 28.504 -14.648 11.576 1.00 0.00 H new ATOM 0 HA2 GLY A 34 28.991 -15.318 13.646 1.00 0.00 H new ATOM 0 HA3 GLY A 34 30.668 -14.922 13.328 1.00 0.00 H new ATOM 527 N THR A 35 30.706 -12.660 14.506 1.00 0.00 N ATOM 528 CA THR A 35 30.841 -11.538 15.460 1.00 0.00 C ATOM 529 C THR A 35 31.300 -10.242 14.750 1.00 0.00 C ATOM 530 O THR A 35 31.078 -9.130 15.257 1.00 0.00 O ATOM 531 CB THR A 35 31.862 -11.911 16.587 1.00 0.00 C ATOM 532 OG1 THR A 35 33.108 -12.332 15.993 1.00 0.00 O ATOM 533 CG2 THR A 35 31.331 -13.029 17.507 1.00 0.00 C ATOM 0 H THR A 35 31.562 -12.849 13.985 1.00 0.00 H new ATOM 0 HA THR A 35 29.860 -11.356 15.899 1.00 0.00 H new ATOM 0 HB THR A 35 32.014 -11.021 17.198 1.00 0.00 H new ATOM 0 HG1 THR A 35 33.746 -12.563 16.700 1.00 0.00 H new ATOM 0 HG21 THR A 35 32.074 -13.253 18.273 1.00 0.00 H new ATOM 0 HG22 THR A 35 30.407 -12.701 17.983 1.00 0.00 H new ATOM 0 HG23 THR A 35 31.137 -13.924 16.917 1.00 0.00 H new ATOM 541 N GLU A 36 31.924 -10.391 13.569 1.00 0.00 N ATOM 542 CA GLU A 36 32.533 -9.271 12.816 1.00 0.00 C ATOM 543 C GLU A 36 31.745 -8.957 11.530 1.00 0.00 C ATOM 544 O GLU A 36 30.810 -9.676 11.152 1.00 0.00 O ATOM 545 CB GLU A 36 34.011 -9.609 12.473 1.00 0.00 C ATOM 546 CG GLU A 36 34.961 -9.671 13.690 1.00 0.00 C ATOM 547 CD GLU A 36 36.399 -10.074 13.315 1.00 0.00 C ATOM 548 OE1 GLU A 36 36.959 -9.505 12.349 1.00 0.00 O ATOM 549 OE2 GLU A 36 36.976 -10.960 13.982 1.00 0.00 O ATOM 0 H GLU A 36 32.023 -11.294 13.104 1.00 0.00 H new ATOM 0 HA GLU A 36 32.501 -8.383 13.447 1.00 0.00 H new ATOM 0 HB2 GLU A 36 34.039 -10.570 11.959 1.00 0.00 H new ATOM 0 HB3 GLU A 36 34.387 -8.862 11.774 1.00 0.00 H new ATOM 0 HG2 GLU A 36 34.979 -8.697 14.179 1.00 0.00 H new ATOM 0 HG3 GLU A 36 34.568 -10.384 14.414 1.00 0.00 H new ATOM 556 N PHE A 37 32.130 -7.843 10.884 1.00 0.00 N ATOM 557 CA PHE A 37 31.532 -7.366 9.629 1.00 0.00 C ATOM 558 C PHE A 37 32.623 -7.305 8.548 1.00 0.00 C ATOM 559 O PHE A 37 33.542 -6.480 8.625 1.00 0.00 O ATOM 560 CB PHE A 37 30.900 -5.966 9.843 1.00 0.00 C ATOM 561 CG PHE A 37 29.755 -5.945 10.860 1.00 0.00 C ATOM 562 CD1 PHE A 37 30.006 -5.801 12.228 1.00 0.00 C ATOM 563 CD2 PHE A 37 28.432 -6.078 10.451 1.00 0.00 C ATOM 564 CE1 PHE A 37 28.969 -5.779 13.143 1.00 0.00 C ATOM 565 CE2 PHE A 37 27.397 -6.053 11.368 1.00 0.00 C ATOM 566 CZ PHE A 37 27.667 -5.909 12.712 1.00 0.00 C ATOM 0 H PHE A 37 32.878 -7.240 11.226 1.00 0.00 H new ATOM 0 HA PHE A 37 30.746 -8.051 9.309 1.00 0.00 H new ATOM 0 HB2 PHE A 37 31.676 -5.275 10.172 1.00 0.00 H new ATOM 0 HB3 PHE A 37 30.529 -5.597 8.887 1.00 0.00 H new ATOM 0 HD1 PHE A 37 31.024 -5.706 12.575 1.00 0.00 H new ATOM 0 HD2 PHE A 37 28.210 -6.203 9.401 1.00 0.00 H new ATOM 0 HE1 PHE A 37 29.180 -5.660 14.195 1.00 0.00 H new ATOM 0 HE2 PHE A 37 26.375 -6.146 11.030 1.00 0.00 H new ATOM 0 HZ PHE A 37 26.858 -5.898 13.427 1.00 0.00 H new ATOM 576 N LEU A 38 32.522 -8.216 7.566 1.00 0.00 N ATOM 577 CA LEU A 38 33.460 -8.328 6.436 1.00 0.00 C ATOM 578 C LEU A 38 32.762 -7.804 5.174 1.00 0.00 C ATOM 579 O LEU A 38 31.754 -8.369 4.728 1.00 0.00 O ATOM 580 CB LEU A 38 33.922 -9.813 6.239 1.00 0.00 C ATOM 581 CG LEU A 38 35.058 -10.325 7.193 1.00 0.00 C ATOM 582 CD1 LEU A 38 34.682 -10.206 8.687 1.00 0.00 C ATOM 583 CD2 LEU A 38 35.466 -11.775 6.834 1.00 0.00 C ATOM 0 H LEU A 38 31.773 -8.908 7.534 1.00 0.00 H new ATOM 0 HA LEU A 38 34.352 -7.735 6.638 1.00 0.00 H new ATOM 0 HB2 LEU A 38 33.054 -10.460 6.364 1.00 0.00 H new ATOM 0 HB3 LEU A 38 34.262 -9.931 5.210 1.00 0.00 H new ATOM 0 HG LEU A 38 35.918 -9.674 7.038 1.00 0.00 H new ATOM 0 HD11 LEU A 38 35.505 -10.575 9.300 1.00 0.00 H new ATOM 0 HD12 LEU A 38 34.487 -9.162 8.931 1.00 0.00 H new ATOM 0 HD13 LEU A 38 33.788 -10.798 8.886 1.00 0.00 H new ATOM 0 HD21 LEU A 38 36.255 -12.109 7.508 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.602 -12.431 6.934 1.00 0.00 H new ATOM 0 HD23 LEU A 38 35.829 -11.807 5.807 1.00 0.00 H new ATOM 595 N ALA A 39 33.295 -6.701 4.634 1.00 0.00 N ATOM 596 CA ALA A 39 32.756 -6.039 3.445 1.00 0.00 C ATOM 597 C ALA A 39 33.196 -6.760 2.168 1.00 0.00 C ATOM 598 O ALA A 39 34.360 -6.645 1.757 1.00 0.00 O ATOM 599 CB ALA A 39 33.221 -4.584 3.408 1.00 0.00 C ATOM 0 H ALA A 39 34.121 -6.240 5.016 1.00 0.00 H new ATOM 0 HA ALA A 39 31.668 -6.072 3.497 1.00 0.00 H new ATOM 0 HB1 ALA A 39 32.817 -4.095 2.521 1.00 0.00 H new ATOM 0 HB2 ALA A 39 32.868 -4.066 4.300 1.00 0.00 H new ATOM 0 HB3 ALA A 39 34.310 -4.551 3.376 1.00 0.00 H new ATOM 605 N VAL A 40 32.279 -7.524 1.566 1.00 0.00 N ATOM 606 CA VAL A 40 32.509 -8.130 0.252 1.00 0.00 C ATOM 607 C VAL A 40 32.307 -7.043 -0.839 1.00 0.00 C ATOM 608 O VAL A 40 31.339 -6.270 -0.764 1.00 0.00 O ATOM 609 CB VAL A 40 31.571 -9.384 -0.002 1.00 0.00 C ATOM 610 CG1 VAL A 40 31.711 -10.408 1.146 1.00 0.00 C ATOM 611 CG2 VAL A 40 30.083 -8.998 -0.208 1.00 0.00 C ATOM 0 H VAL A 40 31.367 -7.738 1.970 1.00 0.00 H new ATOM 0 HA VAL A 40 33.531 -8.506 0.212 1.00 0.00 H new ATOM 0 HB VAL A 40 31.907 -9.839 -0.934 1.00 0.00 H new ATOM 0 HG11 VAL A 40 31.060 -11.261 0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 40 32.745 -10.747 1.207 1.00 0.00 H new ATOM 0 HG13 VAL A 40 31.427 -9.939 2.088 1.00 0.00 H new ATOM 0 HG21 VAL A 40 29.493 -9.899 -0.377 1.00 0.00 H new ATOM 0 HG22 VAL A 40 29.714 -8.484 0.680 1.00 0.00 H new ATOM 0 HG23 VAL A 40 29.994 -8.339 -1.072 1.00 0.00 H new ATOM 621 N PRO A 41 33.241 -6.906 -1.832 1.00 0.00 N ATOM 622 CA PRO A 41 33.028 -5.999 -2.979 1.00 0.00 C ATOM 623 C PRO A 41 31.848 -6.497 -3.844 1.00 0.00 C ATOM 624 O PRO A 41 31.578 -7.700 -3.884 1.00 0.00 O ATOM 625 CB PRO A 41 34.384 -6.036 -3.734 1.00 0.00 C ATOM 626 CG PRO A 41 35.018 -7.334 -3.325 1.00 0.00 C ATOM 627 CD PRO A 41 34.559 -7.591 -1.901 1.00 0.00 C ATOM 0 HA PRO A 41 32.759 -4.982 -2.693 1.00 0.00 H new ATOM 0 HB2 PRO A 41 34.237 -5.991 -4.813 1.00 0.00 H new ATOM 0 HB3 PRO A 41 35.011 -5.187 -3.462 1.00 0.00 H new ATOM 0 HG2 PRO A 41 34.711 -8.144 -3.986 1.00 0.00 H new ATOM 0 HG3 PRO A 41 36.105 -7.272 -3.380 1.00 0.00 H new ATOM 0 HD2 PRO A 41 34.468 -8.657 -1.695 1.00 0.00 H new ATOM 0 HD3 PRO A 41 35.261 -7.184 -1.173 1.00 0.00 H new ATOM 635 N LYS A 42 31.139 -5.568 -4.504 1.00 0.00 N ATOM 636 CA LYS A 42 29.937 -5.890 -5.318 1.00 0.00 C ATOM 637 C LYS A 42 30.284 -6.850 -6.484 1.00 0.00 C ATOM 638 O LYS A 42 29.455 -7.671 -6.889 1.00 0.00 O ATOM 639 CB LYS A 42 29.282 -4.583 -5.846 1.00 0.00 C ATOM 640 CG LYS A 42 28.797 -3.610 -4.737 1.00 0.00 C ATOM 641 CD LYS A 42 27.608 -4.153 -3.904 1.00 0.00 C ATOM 642 CE LYS A 42 26.319 -4.309 -4.738 1.00 0.00 C ATOM 643 NZ LYS A 42 25.146 -4.638 -3.893 1.00 0.00 N ATOM 0 H LYS A 42 31.374 -4.575 -4.494 1.00 0.00 H new ATOM 0 HA LYS A 42 29.220 -6.404 -4.678 1.00 0.00 H new ATOM 0 HB2 LYS A 42 30.000 -4.062 -6.479 1.00 0.00 H new ATOM 0 HB3 LYS A 42 28.433 -4.847 -6.477 1.00 0.00 H new ATOM 0 HG2 LYS A 42 29.629 -3.394 -4.067 1.00 0.00 H new ATOM 0 HG3 LYS A 42 28.505 -2.666 -5.197 1.00 0.00 H new ATOM 0 HD2 LYS A 42 27.879 -5.119 -3.478 1.00 0.00 H new ATOM 0 HD3 LYS A 42 27.416 -3.479 -3.069 1.00 0.00 H new ATOM 0 HE2 LYS A 42 26.126 -3.385 -5.282 1.00 0.00 H new ATOM 0 HE3 LYS A 42 26.461 -5.093 -5.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 24.302 -4.734 -4.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 25.319 -5.533 -3.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 24.993 -3.878 -3.200 1.00 0.00 H new ATOM 657 N LYS A 43 31.533 -6.747 -6.973 1.00 0.00 N ATOM 658 CA LYS A 43 32.076 -7.608 -8.048 1.00 0.00 C ATOM 659 C LYS A 43 32.270 -9.069 -7.575 1.00 0.00 C ATOM 660 O LYS A 43 32.298 -9.984 -8.403 1.00 0.00 O ATOM 661 CB LYS A 43 33.422 -7.026 -8.562 1.00 0.00 C ATOM 662 CG LYS A 43 34.519 -6.916 -7.477 1.00 0.00 C ATOM 663 CD LYS A 43 35.785 -6.195 -7.978 1.00 0.00 C ATOM 664 CE LYS A 43 36.823 -5.991 -6.863 1.00 0.00 C ATOM 665 NZ LYS A 43 37.993 -5.216 -7.332 1.00 0.00 N ATOM 0 H LYS A 43 32.203 -6.058 -6.632 1.00 0.00 H new ATOM 0 HA LYS A 43 31.351 -7.622 -8.862 1.00 0.00 H new ATOM 0 HB2 LYS A 43 33.790 -7.654 -9.373 1.00 0.00 H new ATOM 0 HB3 LYS A 43 33.241 -6.036 -8.982 1.00 0.00 H new ATOM 0 HG2 LYS A 43 34.119 -6.381 -6.615 1.00 0.00 H new ATOM 0 HG3 LYS A 43 34.787 -7.916 -7.135 1.00 0.00 H new ATOM 0 HD2 LYS A 43 36.233 -6.773 -8.786 1.00 0.00 H new ATOM 0 HD3 LYS A 43 35.508 -5.226 -8.394 1.00 0.00 H new ATOM 0 HE2 LYS A 43 36.358 -5.473 -6.024 1.00 0.00 H new ATOM 0 HE3 LYS A 43 37.155 -6.962 -6.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 38.669 -5.101 -6.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 38.453 -5.722 -8.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 37.680 -4.280 -7.660 1.00 0.00 H new ATOM 679 N SER A 44 32.405 -9.276 -6.242 1.00 0.00 N ATOM 680 CA SER A 44 32.542 -10.626 -5.651 1.00 0.00 C ATOM 681 C SER A 44 31.226 -11.415 -5.784 1.00 0.00 C ATOM 682 O SER A 44 31.253 -12.642 -5.901 1.00 0.00 O ATOM 683 CB SER A 44 32.978 -10.551 -4.163 1.00 0.00 C ATOM 684 OG SER A 44 33.178 -11.847 -3.605 1.00 0.00 O ATOM 0 H SER A 44 32.422 -8.521 -5.556 1.00 0.00 H new ATOM 0 HA SER A 44 33.321 -11.150 -6.204 1.00 0.00 H new ATOM 0 HB2 SER A 44 33.899 -9.974 -4.083 1.00 0.00 H new ATOM 0 HB3 SER A 44 32.219 -10.021 -3.588 1.00 0.00 H new ATOM 0 HG SER A 44 34.128 -12.083 -3.658 1.00 0.00 H new ATOM 690 N ILE A 45 30.082 -10.690 -5.789 1.00 0.00 N ATOM 691 CA ILE A 45 28.749 -11.308 -5.904 1.00 0.00 C ATOM 692 C ILE A 45 28.631 -12.001 -7.283 1.00 0.00 C ATOM 693 O ILE A 45 28.678 -11.343 -8.330 1.00 0.00 O ATOM 694 CB ILE A 45 27.563 -10.258 -5.692 1.00 0.00 C ATOM 695 CG1 ILE A 45 27.459 -9.764 -4.203 1.00 0.00 C ATOM 696 CG2 ILE A 45 26.192 -10.844 -6.135 1.00 0.00 C ATOM 697 CD1 ILE A 45 28.615 -8.947 -3.669 1.00 0.00 C ATOM 0 H ILE A 45 30.061 -9.673 -5.714 1.00 0.00 H new ATOM 0 HA ILE A 45 28.648 -12.045 -5.107 1.00 0.00 H new ATOM 0 HB ILE A 45 27.807 -9.402 -6.322 1.00 0.00 H new ATOM 0 HG12 ILE A 45 26.550 -9.170 -4.106 1.00 0.00 H new ATOM 0 HG13 ILE A 45 27.338 -10.638 -3.563 1.00 0.00 H new ATOM 0 HG21 ILE A 45 25.410 -10.101 -5.976 1.00 0.00 H new ATOM 0 HG22 ILE A 45 26.233 -11.107 -7.192 1.00 0.00 H new ATOM 0 HG23 ILE A 45 25.970 -11.735 -5.548 1.00 0.00 H new ATOM 0 HD11 ILE A 45 28.417 -8.671 -2.633 1.00 0.00 H new ATOM 0 HD12 ILE A 45 29.531 -9.536 -3.719 1.00 0.00 H new ATOM 0 HD13 ILE A 45 28.731 -8.045 -4.270 1.00 0.00 H new ATOM 709 N LYS A 46 28.513 -13.337 -7.246 1.00 0.00 N ATOM 710 CA LYS A 46 28.320 -14.186 -8.429 1.00 0.00 C ATOM 711 C LYS A 46 26.899 -13.998 -8.985 1.00 0.00 C ATOM 712 O LYS A 46 26.716 -13.810 -10.192 1.00 0.00 O ATOM 713 CB LYS A 46 28.561 -15.675 -8.055 1.00 0.00 C ATOM 714 CG LYS A 46 30.014 -16.017 -7.649 1.00 0.00 C ATOM 715 CD LYS A 46 31.029 -15.794 -8.801 1.00 0.00 C ATOM 716 CE LYS A 46 32.450 -16.268 -8.441 1.00 0.00 C ATOM 717 NZ LYS A 46 33.417 -16.080 -9.554 1.00 0.00 N ATOM 0 H LYS A 46 28.550 -13.867 -6.375 1.00 0.00 H new ATOM 0 HA LYS A 46 29.036 -13.896 -9.198 1.00 0.00 H new ATOM 0 HB2 LYS A 46 27.897 -15.940 -7.232 1.00 0.00 H new ATOM 0 HB3 LYS A 46 28.280 -16.298 -8.904 1.00 0.00 H new ATOM 0 HG2 LYS A 46 30.301 -15.405 -6.794 1.00 0.00 H new ATOM 0 HG3 LYS A 46 30.061 -17.057 -7.326 1.00 0.00 H new ATOM 0 HD2 LYS A 46 30.687 -16.326 -9.689 1.00 0.00 H new ATOM 0 HD3 LYS A 46 31.057 -14.734 -9.055 1.00 0.00 H new ATOM 0 HE2 LYS A 46 32.800 -15.722 -7.565 1.00 0.00 H new ATOM 0 HE3 LYS A 46 32.418 -17.323 -8.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 34.356 -16.415 -9.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 33.101 -16.622 -10.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 33.471 -15.071 -9.800 1.00 0.00 H new ATOM 731 N SER A 47 25.910 -14.018 -8.070 1.00 0.00 N ATOM 732 CA SER A 47 24.486 -13.906 -8.417 1.00 0.00 C ATOM 733 C SER A 47 23.663 -13.397 -7.214 1.00 0.00 C ATOM 734 O SER A 47 24.072 -13.543 -6.051 1.00 0.00 O ATOM 735 CB SER A 47 23.970 -15.279 -8.910 1.00 0.00 C ATOM 736 OG SER A 47 24.240 -16.302 -7.963 1.00 0.00 O ATOM 0 H SER A 47 26.080 -14.113 -7.069 1.00 0.00 H new ATOM 0 HA SER A 47 24.368 -13.177 -9.219 1.00 0.00 H new ATOM 0 HB2 SER A 47 22.897 -15.223 -9.092 1.00 0.00 H new ATOM 0 HB3 SER A 47 24.442 -15.527 -9.861 1.00 0.00 H new ATOM 0 HG SER A 47 23.901 -17.158 -8.300 1.00 0.00 H new ATOM 742 N VAL A 48 22.510 -12.773 -7.516 1.00 0.00 N ATOM 743 CA VAL A 48 21.585 -12.216 -6.507 1.00 0.00 C ATOM 744 C VAL A 48 20.254 -13.010 -6.506 1.00 0.00 C ATOM 745 O VAL A 48 19.506 -13.023 -7.492 1.00 0.00 O ATOM 746 CB VAL A 48 21.331 -10.665 -6.737 1.00 0.00 C ATOM 747 CG1 VAL A 48 20.880 -10.353 -8.194 1.00 0.00 C ATOM 748 CG2 VAL A 48 20.324 -10.092 -5.694 1.00 0.00 C ATOM 0 H VAL A 48 22.190 -12.639 -8.475 1.00 0.00 H new ATOM 0 HA VAL A 48 22.051 -12.319 -5.527 1.00 0.00 H new ATOM 0 HB VAL A 48 22.286 -10.162 -6.587 1.00 0.00 H new ATOM 0 HG11 VAL A 48 20.718 -9.281 -8.303 1.00 0.00 H new ATOM 0 HG12 VAL A 48 21.653 -10.676 -8.891 1.00 0.00 H new ATOM 0 HG13 VAL A 48 19.952 -10.883 -8.409 1.00 0.00 H new ATOM 0 HG21 VAL A 48 20.173 -9.029 -5.880 1.00 0.00 H new ATOM 0 HG22 VAL A 48 19.372 -10.615 -5.782 1.00 0.00 H new ATOM 0 HG23 VAL A 48 20.722 -10.231 -4.689 1.00 0.00 H new ATOM 758 N GLU A 49 19.992 -13.702 -5.392 1.00 0.00 N ATOM 759 CA GLU A 49 18.759 -14.485 -5.184 1.00 0.00 C ATOM 760 C GLU A 49 17.757 -13.642 -4.362 1.00 0.00 C ATOM 761 O GLU A 49 18.156 -12.662 -3.708 1.00 0.00 O ATOM 762 CB GLU A 49 19.100 -15.810 -4.454 1.00 0.00 C ATOM 763 CG GLU A 49 20.324 -16.576 -5.018 1.00 0.00 C ATOM 764 CD GLU A 49 20.120 -17.123 -6.443 1.00 0.00 C ATOM 765 OE1 GLU A 49 19.576 -18.244 -6.588 1.00 0.00 O ATOM 766 OE2 GLU A 49 20.504 -16.442 -7.425 1.00 0.00 O ATOM 0 H GLU A 49 20.633 -13.738 -4.599 1.00 0.00 H new ATOM 0 HA GLU A 49 18.305 -14.732 -6.144 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.282 -15.591 -3.402 1.00 0.00 H new ATOM 0 HB3 GLU A 49 18.230 -16.465 -4.497 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.188 -15.911 -5.016 1.00 0.00 H new ATOM 0 HG3 GLU A 49 20.558 -17.406 -4.352 1.00 0.00 H new ATOM 773 N ASP A 50 16.474 -14.055 -4.369 1.00 0.00 N ATOM 774 CA ASP A 50 15.350 -13.268 -3.794 1.00 0.00 C ATOM 775 C ASP A 50 15.563 -13.004 -2.288 1.00 0.00 C ATOM 776 O ASP A 50 15.206 -11.936 -1.770 1.00 0.00 O ATOM 777 CB ASP A 50 13.998 -14.003 -4.005 1.00 0.00 C ATOM 778 CG ASP A 50 13.789 -14.504 -5.440 1.00 0.00 C ATOM 779 OD1 ASP A 50 13.258 -13.753 -6.288 1.00 0.00 O ATOM 780 OD2 ASP A 50 14.165 -15.659 -5.724 1.00 0.00 O ATOM 0 H ASP A 50 16.181 -14.945 -4.773 1.00 0.00 H new ATOM 0 HA ASP A 50 15.323 -12.311 -4.316 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.944 -14.851 -3.322 1.00 0.00 H new ATOM 0 HB3 ASP A 50 13.183 -13.329 -3.742 1.00 0.00 H new ATOM 785 N GLY A 51 16.160 -14.001 -1.613 1.00 0.00 N ATOM 786 CA GLY A 51 16.473 -13.935 -0.186 1.00 0.00 C ATOM 787 C GLY A 51 17.892 -14.390 0.120 1.00 0.00 C ATOM 788 O GLY A 51 18.199 -14.714 1.265 1.00 0.00 O ATOM 0 H GLY A 51 16.439 -14.879 -2.051 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.339 -12.912 0.165 1.00 0.00 H new ATOM 0 HA3 GLY A 51 15.768 -14.556 0.367 1.00 0.00 H new ATOM 792 N ARG A 52 18.780 -14.399 -0.903 1.00 0.00 N ATOM 793 CA ARG A 52 20.195 -14.839 -0.749 1.00 0.00 C ATOM 794 C ARG A 52 21.132 -13.987 -1.624 1.00 0.00 C ATOM 795 O ARG A 52 20.703 -13.392 -2.612 1.00 0.00 O ATOM 796 CB ARG A 52 20.361 -16.345 -1.110 1.00 0.00 C ATOM 797 CG ARG A 52 19.679 -17.344 -0.148 1.00 0.00 C ATOM 798 CD ARG A 52 19.518 -18.735 -0.777 1.00 0.00 C ATOM 799 NE ARG A 52 18.617 -18.678 -1.951 1.00 0.00 N ATOM 800 CZ ARG A 52 18.798 -19.281 -3.133 1.00 0.00 C ATOM 801 NH1 ARG A 52 19.876 -20.005 -3.372 1.00 0.00 N ATOM 802 NH2 ARG A 52 17.896 -19.116 -4.090 1.00 0.00 N ATOM 0 H ARG A 52 18.543 -14.105 -1.851 1.00 0.00 H new ATOM 0 HA ARG A 52 20.467 -14.702 0.298 1.00 0.00 H new ATOM 0 HB2 ARG A 52 19.964 -16.505 -2.112 1.00 0.00 H new ATOM 0 HB3 ARG A 52 21.426 -16.575 -1.149 1.00 0.00 H new ATOM 0 HG2 ARG A 52 20.268 -17.426 0.766 1.00 0.00 H new ATOM 0 HG3 ARG A 52 18.699 -16.960 0.137 1.00 0.00 H new ATOM 0 HD2 ARG A 52 20.493 -19.118 -1.079 1.00 0.00 H new ATOM 0 HD3 ARG A 52 19.117 -19.429 -0.038 1.00 0.00 H new ATOM 0 HE ARG A 52 17.769 -18.121 -1.848 1.00 0.00 H new ATOM 0 HH11 ARG A 52 20.588 -20.113 -2.650 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.996 -20.457 -4.279 1.00 0.00 H new ATOM 0 HH21 ARG A 52 17.075 -18.535 -3.922 1.00 0.00 H new ATOM 0 HH22 ARG A 52 18.023 -19.570 -4.994 1.00 0.00 H new ATOM 816 N ILE A 53 22.419 -13.923 -1.232 1.00 0.00 N ATOM 817 CA ILE A 53 23.486 -13.267 -2.011 1.00 0.00 C ATOM 818 C ILE A 53 24.627 -14.272 -2.206 1.00 0.00 C ATOM 819 O ILE A 53 25.377 -14.549 -1.266 1.00 0.00 O ATOM 820 CB ILE A 53 24.033 -11.963 -1.290 1.00 0.00 C ATOM 821 CG1 ILE A 53 22.940 -10.854 -1.169 1.00 0.00 C ATOM 822 CG2 ILE A 53 25.297 -11.403 -1.984 1.00 0.00 C ATOM 823 CD1 ILE A 53 22.408 -10.326 -2.499 1.00 0.00 C ATOM 0 H ILE A 53 22.750 -14.329 -0.357 1.00 0.00 H new ATOM 0 HA ILE A 53 23.076 -12.954 -2.971 1.00 0.00 H new ATOM 0 HB ILE A 53 24.311 -12.269 -0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.104 -11.250 -0.592 1.00 0.00 H new ATOM 0 HG13 ILE A 53 23.352 -10.019 -0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 53 25.636 -10.511 -1.457 1.00 0.00 H new ATOM 0 HG22 ILE A 53 26.085 -12.156 -1.968 1.00 0.00 H new ATOM 0 HG23 ILE A 53 25.062 -11.147 -3.017 1.00 0.00 H new ATOM 0 HD11 ILE A 53 21.655 -9.561 -2.312 1.00 0.00 H new ATOM 0 HD12 ILE A 53 23.228 -9.895 -3.074 1.00 0.00 H new ATOM 0 HD13 ILE A 53 21.961 -11.145 -3.063 1.00 0.00 H new ATOM 835 N VAL A 54 24.748 -14.838 -3.413 1.00 0.00 N ATOM 836 CA VAL A 54 25.819 -15.785 -3.732 1.00 0.00 C ATOM 837 C VAL A 54 27.070 -14.986 -4.106 1.00 0.00 C ATOM 838 O VAL A 54 27.052 -14.245 -5.088 1.00 0.00 O ATOM 839 CB VAL A 54 25.416 -16.756 -4.905 1.00 0.00 C ATOM 840 CG1 VAL A 54 26.554 -17.768 -5.219 1.00 0.00 C ATOM 841 CG2 VAL A 54 24.080 -17.480 -4.586 1.00 0.00 C ATOM 0 H VAL A 54 24.112 -14.654 -4.189 1.00 0.00 H new ATOM 0 HA VAL A 54 26.011 -16.410 -2.860 1.00 0.00 H new ATOM 0 HB VAL A 54 25.263 -16.156 -5.802 1.00 0.00 H new ATOM 0 HG11 VAL A 54 26.244 -18.423 -6.033 1.00 0.00 H new ATOM 0 HG12 VAL A 54 27.453 -17.225 -5.512 1.00 0.00 H new ATOM 0 HG13 VAL A 54 26.764 -18.366 -4.332 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.821 -18.145 -5.410 1.00 0.00 H new ATOM 0 HG22 VAL A 54 24.191 -18.062 -3.671 1.00 0.00 H new ATOM 0 HG23 VAL A 54 23.289 -16.742 -4.453 1.00 0.00 H new ATOM 851 N ILE A 55 28.122 -15.103 -3.286 1.00 0.00 N ATOM 852 CA ILE A 55 29.432 -14.478 -3.547 1.00 0.00 C ATOM 853 C ILE A 55 30.449 -15.561 -3.929 1.00 0.00 C ATOM 854 O ILE A 55 30.219 -16.760 -3.709 1.00 0.00 O ATOM 855 CB ILE A 55 29.978 -13.669 -2.298 1.00 0.00 C ATOM 856 CG1 ILE A 55 30.230 -14.618 -1.073 1.00 0.00 C ATOM 857 CG2 ILE A 55 29.016 -12.508 -1.920 1.00 0.00 C ATOM 858 CD1 ILE A 55 30.915 -13.970 0.119 1.00 0.00 C ATOM 0 H ILE A 55 28.092 -15.636 -2.417 1.00 0.00 H new ATOM 0 HA ILE A 55 29.296 -13.770 -4.365 1.00 0.00 H new ATOM 0 HB ILE A 55 30.935 -13.230 -2.579 1.00 0.00 H new ATOM 0 HG12 ILE A 55 29.273 -15.023 -0.745 1.00 0.00 H new ATOM 0 HG13 ILE A 55 30.836 -15.461 -1.406 1.00 0.00 H new ATOM 0 HG21 ILE A 55 29.415 -11.970 -1.060 1.00 0.00 H new ATOM 0 HG22 ILE A 55 28.921 -11.824 -2.764 1.00 0.00 H new ATOM 0 HG23 ILE A 55 28.036 -12.914 -1.671 1.00 0.00 H new ATOM 0 HD11 ILE A 55 31.043 -14.708 0.911 1.00 0.00 H new ATOM 0 HD12 ILE A 55 31.891 -13.590 -0.184 1.00 0.00 H new ATOM 0 HD13 ILE A 55 30.303 -13.146 0.487 1.00 0.00 H new ATOM 870 N GLY A 56 31.571 -15.118 -4.509 1.00 0.00 N ATOM 871 CA GLY A 56 32.675 -15.997 -4.847 1.00 0.00 C ATOM 872 C GLY A 56 33.667 -16.026 -3.721 1.00 0.00 C ATOM 873 O GLY A 56 33.558 -16.861 -2.824 1.00 0.00 O ATOM 0 H GLY A 56 31.730 -14.140 -4.753 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.304 -17.003 -5.042 1.00 0.00 H new ATOM 0 HA3 GLY A 56 33.159 -15.653 -5.761 1.00 0.00 H new ATOM 877 N GLU A 57 34.597 -15.065 -3.738 1.00 0.00 N ATOM 878 CA GLU A 57 35.627 -14.914 -2.703 1.00 0.00 C ATOM 879 C GLU A 57 36.212 -13.493 -2.730 1.00 0.00 C ATOM 880 O GLU A 57 35.986 -12.721 -3.677 1.00 0.00 O ATOM 881 CB GLU A 57 36.748 -15.975 -2.871 1.00 0.00 C ATOM 882 CG GLU A 57 37.489 -15.912 -4.218 1.00 0.00 C ATOM 883 CD GLU A 57 38.499 -17.057 -4.381 1.00 0.00 C ATOM 884 OE1 GLU A 57 39.598 -16.974 -3.796 1.00 0.00 O ATOM 885 OE2 GLU A 57 38.177 -18.060 -5.052 1.00 0.00 O ATOM 0 H GLU A 57 34.657 -14.364 -4.476 1.00 0.00 H new ATOM 0 HA GLU A 57 35.158 -15.076 -1.732 1.00 0.00 H new ATOM 0 HB2 GLU A 57 37.472 -15.851 -2.066 1.00 0.00 H new ATOM 0 HB3 GLU A 57 36.312 -16.967 -2.757 1.00 0.00 H new ATOM 0 HG2 GLU A 57 36.764 -15.951 -5.031 1.00 0.00 H new ATOM 0 HG3 GLU A 57 38.009 -14.957 -4.300 1.00 0.00 H new ATOM 892 N PHE A 58 36.975 -13.190 -1.677 1.00 0.00 N ATOM 893 CA PHE A 58 37.537 -11.859 -1.400 1.00 0.00 C ATOM 894 C PHE A 58 38.645 -11.996 -0.336 1.00 0.00 C ATOM 895 O PHE A 58 38.932 -13.112 0.134 1.00 0.00 O ATOM 896 CB PHE A 58 36.409 -10.889 -0.918 1.00 0.00 C ATOM 897 CG PHE A 58 35.763 -11.289 0.416 1.00 0.00 C ATOM 898 CD1 PHE A 58 34.919 -12.399 0.506 1.00 0.00 C ATOM 899 CD2 PHE A 58 36.028 -10.576 1.580 1.00 0.00 C ATOM 900 CE1 PHE A 58 34.373 -12.774 1.711 1.00 0.00 C ATOM 901 CE2 PHE A 58 35.471 -10.952 2.784 1.00 0.00 C ATOM 902 CZ PHE A 58 34.652 -12.046 2.850 1.00 0.00 C ATOM 0 H PHE A 58 37.228 -13.881 -0.971 1.00 0.00 H new ATOM 0 HA PHE A 58 37.969 -11.440 -2.309 1.00 0.00 H new ATOM 0 HB2 PHE A 58 36.825 -9.886 -0.821 1.00 0.00 H new ATOM 0 HB3 PHE A 58 35.635 -10.841 -1.684 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.693 -12.970 -0.382 1.00 0.00 H new ATOM 0 HD2 PHE A 58 36.679 -9.715 1.540 1.00 0.00 H new ATOM 0 HE1 PHE A 58 33.726 -13.637 1.766 1.00 0.00 H new ATOM 0 HE2 PHE A 58 35.682 -10.382 3.677 1.00 0.00 H new ATOM 0 HZ PHE A 58 34.223 -12.341 3.796 1.00 0.00 H new ATOM 912 N ASP A 59 39.253 -10.867 0.050 1.00 0.00 N ATOM 913 CA ASP A 59 40.264 -10.820 1.114 1.00 0.00 C ATOM 914 C ASP A 59 39.582 -10.491 2.445 1.00 0.00 C ATOM 915 O ASP A 59 39.100 -9.372 2.642 1.00 0.00 O ATOM 916 CB ASP A 59 41.372 -9.790 0.784 1.00 0.00 C ATOM 917 CG ASP A 59 42.257 -10.244 -0.387 1.00 0.00 C ATOM 918 OD1 ASP A 59 43.179 -11.066 -0.161 1.00 0.00 O ATOM 919 OD2 ASP A 59 42.022 -9.811 -1.535 1.00 0.00 O ATOM 0 H ASP A 59 39.057 -9.958 -0.368 1.00 0.00 H new ATOM 0 HA ASP A 59 40.745 -11.795 1.193 1.00 0.00 H new ATOM 0 HB2 ASP A 59 40.914 -8.832 0.540 1.00 0.00 H new ATOM 0 HB3 ASP A 59 41.993 -9.632 1.666 1.00 0.00 H new ATOM 924 N GLU A 60 39.545 -11.497 3.340 1.00 0.00 N ATOM 925 CA GLU A 60 38.847 -11.425 4.637 1.00 0.00 C ATOM 926 C GLU A 60 39.477 -10.366 5.562 1.00 0.00 C ATOM 927 O GLU A 60 38.757 -9.662 6.275 1.00 0.00 O ATOM 928 CB GLU A 60 38.849 -12.829 5.320 1.00 0.00 C ATOM 929 CG GLU A 60 40.263 -13.375 5.637 1.00 0.00 C ATOM 930 CD GLU A 60 40.276 -14.773 6.273 1.00 0.00 C ATOM 931 OE1 GLU A 60 39.783 -14.918 7.413 1.00 0.00 O ATOM 932 OE2 GLU A 60 40.809 -15.722 5.656 1.00 0.00 O ATOM 0 H GLU A 60 40.005 -12.393 3.180 1.00 0.00 H new ATOM 0 HA GLU A 60 37.817 -11.121 4.452 1.00 0.00 H new ATOM 0 HB2 GLU A 60 38.277 -12.772 6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 60 38.334 -13.538 4.671 1.00 0.00 H new ATOM 0 HG2 GLU A 60 40.843 -13.403 4.715 1.00 0.00 H new ATOM 0 HG3 GLU A 60 40.766 -12.679 6.309 1.00 0.00 H new ATOM 939 N GLU A 61 40.820 -10.257 5.504 1.00 0.00 N ATOM 940 CA GLU A 61 41.604 -9.332 6.344 1.00 0.00 C ATOM 941 C GLU A 61 41.301 -7.882 5.957 1.00 0.00 C ATOM 942 O GLU A 61 40.970 -7.054 6.813 1.00 0.00 O ATOM 943 CB GLU A 61 43.120 -9.624 6.183 1.00 0.00 C ATOM 944 CG GLU A 61 43.518 -11.085 6.459 1.00 0.00 C ATOM 945 CD GLU A 61 44.985 -11.377 6.107 1.00 0.00 C ATOM 946 OE1 GLU A 61 45.313 -11.421 4.900 1.00 0.00 O ATOM 947 OE2 GLU A 61 45.816 -11.580 7.021 1.00 0.00 O ATOM 0 H GLU A 61 41.393 -10.812 4.869 1.00 0.00 H new ATOM 0 HA GLU A 61 41.325 -9.481 7.387 1.00 0.00 H new ATOM 0 HB2 GLU A 61 43.422 -9.363 5.169 1.00 0.00 H new ATOM 0 HB3 GLU A 61 43.677 -8.975 6.859 1.00 0.00 H new ATOM 0 HG2 GLU A 61 43.350 -11.310 7.512 1.00 0.00 H new ATOM 0 HG3 GLU A 61 42.872 -11.748 5.884 1.00 0.00 H new ATOM 954 N GLU A 62 41.387 -7.605 4.649 1.00 0.00 N ATOM 955 CA GLU A 62 41.129 -6.270 4.103 1.00 0.00 C ATOM 956 C GLU A 62 39.661 -5.853 4.328 1.00 0.00 C ATOM 957 O GLU A 62 39.393 -4.706 4.691 1.00 0.00 O ATOM 958 CB GLU A 62 41.501 -6.216 2.604 1.00 0.00 C ATOM 959 CG GLU A 62 42.999 -6.477 2.328 1.00 0.00 C ATOM 960 CD GLU A 62 43.423 -6.182 0.882 1.00 0.00 C ATOM 961 OE1 GLU A 62 43.661 -4.993 0.553 1.00 0.00 O ATOM 962 OE2 GLU A 62 43.545 -7.125 0.074 1.00 0.00 O ATOM 0 H GLU A 62 41.636 -8.298 3.944 1.00 0.00 H new ATOM 0 HA GLU A 62 41.759 -5.557 4.635 1.00 0.00 H new ATOM 0 HB2 GLU A 62 40.907 -6.953 2.064 1.00 0.00 H new ATOM 0 HB3 GLU A 62 41.232 -5.237 2.207 1.00 0.00 H new ATOM 0 HG2 GLU A 62 43.596 -5.864 3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 62 43.225 -7.518 2.558 1.00 0.00 H new ATOM 969 N ALA A 63 38.740 -6.818 4.178 1.00 0.00 N ATOM 970 CA ALA A 63 37.292 -6.580 4.286 1.00 0.00 C ATOM 971 C ALA A 63 36.877 -6.205 5.718 1.00 0.00 C ATOM 972 O ALA A 63 36.016 -5.342 5.909 1.00 0.00 O ATOM 973 CB ALA A 63 36.531 -7.824 3.842 1.00 0.00 C ATOM 0 H ALA A 63 38.980 -7.789 3.978 1.00 0.00 H new ATOM 0 HA ALA A 63 37.046 -5.740 3.637 1.00 0.00 H new ATOM 0 HB1 ALA A 63 35.459 -7.643 3.924 1.00 0.00 H new ATOM 0 HB2 ALA A 63 36.782 -8.054 2.807 1.00 0.00 H new ATOM 0 HB3 ALA A 63 36.807 -8.665 4.478 1.00 0.00 H new ATOM 979 N ARG A 64 37.474 -6.894 6.717 1.00 0.00 N ATOM 980 CA ARG A 64 37.127 -6.688 8.142 1.00 0.00 C ATOM 981 C ARG A 64 37.715 -5.382 8.702 1.00 0.00 C ATOM 982 O ARG A 64 37.114 -4.795 9.591 1.00 0.00 O ATOM 983 CB ARG A 64 37.564 -7.882 9.032 1.00 0.00 C ATOM 984 CG ARG A 64 39.079 -8.116 9.106 1.00 0.00 C ATOM 985 CD ARG A 64 39.462 -9.274 10.028 1.00 0.00 C ATOM 986 NE ARG A 64 38.748 -10.520 9.676 1.00 0.00 N ATOM 987 CZ ARG A 64 39.293 -11.593 9.092 1.00 0.00 C ATOM 988 NH1 ARG A 64 40.584 -11.629 8.795 1.00 0.00 N ATOM 989 NH2 ARG A 64 38.536 -12.641 8.825 1.00 0.00 N ATOM 0 H ARG A 64 38.197 -7.596 6.563 1.00 0.00 H new ATOM 0 HA ARG A 64 36.040 -6.616 8.172 1.00 0.00 H new ATOM 0 HB2 ARG A 64 37.187 -7.720 10.042 1.00 0.00 H new ATOM 0 HB3 ARG A 64 37.090 -8.788 8.656 1.00 0.00 H new ATOM 0 HG2 ARG A 64 39.459 -8.316 8.104 1.00 0.00 H new ATOM 0 HG3 ARG A 64 39.565 -7.205 9.455 1.00 0.00 H new ATOM 0 HD2 ARG A 64 40.537 -9.443 9.970 1.00 0.00 H new ATOM 0 HD3 ARG A 64 39.236 -9.006 11.060 1.00 0.00 H new ATOM 0 HE ARG A 64 37.753 -10.565 9.898 1.00 0.00 H new ATOM 0 HH11 ARG A 64 41.180 -10.830 9.012 1.00 0.00 H new ATOM 0 HH12 ARG A 64 40.982 -12.456 8.350 1.00 0.00 H new ATOM 0 HH21 ARG A 64 37.544 -12.628 9.064 1.00 0.00 H new ATOM 0 HH22 ARG A 64 38.943 -13.464 8.380 1.00 0.00 H new ATOM 1003 N GLU A 65 38.894 -4.939 8.201 1.00 0.00 N ATOM 1004 CA GLU A 65 39.562 -3.711 8.724 1.00 0.00 C ATOM 1005 C GLU A 65 38.867 -2.434 8.214 1.00 0.00 C ATOM 1006 O GLU A 65 38.708 -1.465 8.972 1.00 0.00 O ATOM 1007 CB GLU A 65 41.086 -3.688 8.422 1.00 0.00 C ATOM 1008 CG GLU A 65 41.460 -3.865 6.949 1.00 0.00 C ATOM 1009 CD GLU A 65 42.975 -3.937 6.707 1.00 0.00 C ATOM 1010 OE1 GLU A 65 43.620 -2.876 6.595 1.00 0.00 O ATOM 1011 OE2 GLU A 65 43.528 -5.055 6.636 1.00 0.00 O ATOM 0 H GLU A 65 39.400 -5.403 7.446 1.00 0.00 H new ATOM 0 HA GLU A 65 39.460 -3.737 9.809 1.00 0.00 H new ATOM 0 HB2 GLU A 65 41.496 -2.741 8.773 1.00 0.00 H new ATOM 0 HB3 GLU A 65 41.567 -4.477 9.000 1.00 0.00 H new ATOM 0 HG2 GLU A 65 40.996 -4.776 6.571 1.00 0.00 H new ATOM 0 HG3 GLU A 65 41.047 -3.035 6.375 1.00 0.00 H new ATOM 1018 N LEU A 66 38.428 -2.436 6.938 1.00 0.00 N ATOM 1019 CA LEU A 66 37.568 -1.354 6.409 1.00 0.00 C ATOM 1020 C LEU A 66 36.098 -1.609 6.811 1.00 0.00 C ATOM 1021 O LEU A 66 35.233 -0.737 6.667 1.00 0.00 O ATOM 1022 CB LEU A 66 37.794 -1.148 4.882 1.00 0.00 C ATOM 1023 CG LEU A 66 37.512 -2.352 3.918 1.00 0.00 C ATOM 1024 CD1 LEU A 66 36.016 -2.556 3.627 1.00 0.00 C ATOM 1025 CD2 LEU A 66 38.314 -2.219 2.602 1.00 0.00 C ATOM 0 H LEU A 66 38.651 -3.165 6.261 1.00 0.00 H new ATOM 0 HA LEU A 66 37.848 -0.403 6.861 1.00 0.00 H new ATOM 0 HB2 LEU A 66 37.169 -0.314 4.563 1.00 0.00 H new ATOM 0 HB3 LEU A 66 38.830 -0.843 4.738 1.00 0.00 H new ATOM 0 HG LEU A 66 37.852 -3.244 4.444 1.00 0.00 H new ATOM 0 HD11 LEU A 66 35.889 -3.404 2.954 1.00 0.00 H new ATOM 0 HD12 LEU A 66 35.487 -2.750 4.560 1.00 0.00 H new ATOM 0 HD13 LEU A 66 35.610 -1.658 3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 66 38.096 -3.069 1.956 1.00 0.00 H new ATOM 0 HD22 LEU A 66 38.031 -1.296 2.095 1.00 0.00 H new ATOM 0 HD23 LEU A 66 39.380 -2.198 2.826 1.00 0.00 H new ATOM 1037 N GLY A 67 35.839 -2.842 7.287 1.00 0.00 N ATOM 1038 CA GLY A 67 34.604 -3.181 7.988 1.00 0.00 C ATOM 1039 C GLY A 67 34.561 -2.536 9.375 1.00 0.00 C ATOM 1040 O GLY A 67 33.495 -2.158 9.836 1.00 0.00 O ATOM 0 H GLY A 67 36.486 -3.625 7.192 1.00 0.00 H new ATOM 0 HA2 GLY A 67 33.747 -2.848 7.402 1.00 0.00 H new ATOM 0 HA3 GLY A 67 34.523 -4.264 8.085 1.00 0.00 H new ATOM 1044 N ARG A 68 35.747 -2.409 10.031 1.00 0.00 N ATOM 1045 CA ARG A 68 35.900 -1.654 11.312 1.00 0.00 C ATOM 1046 C ARG A 68 35.610 -0.167 11.073 1.00 0.00 C ATOM 1047 O ARG A 68 34.988 0.516 11.910 1.00 0.00 O ATOM 1048 CB ARG A 68 37.330 -1.784 11.912 1.00 0.00 C ATOM 1049 CG ARG A 68 37.777 -3.213 12.264 1.00 0.00 C ATOM 1050 CD ARG A 68 39.210 -3.252 12.830 1.00 0.00 C ATOM 1051 NE ARG A 68 40.194 -2.587 11.945 1.00 0.00 N ATOM 1052 CZ ARG A 68 41.510 -2.467 12.201 1.00 0.00 C ATOM 1053 NH1 ARG A 68 42.039 -2.969 13.306 1.00 0.00 N ATOM 1054 NH2 ARG A 68 42.286 -1.828 11.344 1.00 0.00 N ATOM 0 H ARG A 68 36.617 -2.821 9.693 1.00 0.00 H new ATOM 0 HA ARG A 68 35.192 -2.084 12.020 1.00 0.00 H new ATOM 0 HB2 ARG A 68 38.042 -1.365 11.201 1.00 0.00 H new ATOM 0 HB3 ARG A 68 37.383 -1.174 12.814 1.00 0.00 H new ATOM 0 HG2 ARG A 68 37.088 -3.638 12.994 1.00 0.00 H new ATOM 0 HG3 ARG A 68 37.723 -3.839 11.373 1.00 0.00 H new ATOM 0 HD2 ARG A 68 39.223 -2.770 13.808 1.00 0.00 H new ATOM 0 HD3 ARG A 68 39.508 -4.289 12.982 1.00 0.00 H new ATOM 0 HE ARG A 68 39.847 -2.188 11.073 1.00 0.00 H new ATOM 0 HH11 ARG A 68 41.447 -3.456 13.979 1.00 0.00 H new ATOM 0 HH12 ARG A 68 43.038 -2.869 13.484 1.00 0.00 H new ATOM 0 HH21 ARG A 68 41.887 -1.429 10.494 1.00 0.00 H new ATOM 0 HH22 ARG A 68 43.284 -1.734 11.532 1.00 0.00 H new ATOM 1068 N LYS A 69 36.101 0.333 9.922 1.00 0.00 N ATOM 1069 CA LYS A 69 35.747 1.670 9.435 1.00 0.00 C ATOM 1070 C LYS A 69 34.218 1.799 9.333 1.00 0.00 C ATOM 1071 O LYS A 69 33.678 2.824 9.712 1.00 0.00 O ATOM 1072 CB LYS A 69 36.412 1.968 8.069 1.00 0.00 C ATOM 1073 CG LYS A 69 36.034 3.339 7.453 1.00 0.00 C ATOM 1074 CD LYS A 69 36.748 3.632 6.111 1.00 0.00 C ATOM 1075 CE LYS A 69 36.445 2.588 5.025 1.00 0.00 C ATOM 1076 NZ LYS A 69 37.088 2.936 3.732 1.00 0.00 N ATOM 0 H LYS A 69 36.745 -0.174 9.315 1.00 0.00 H new ATOM 0 HA LYS A 69 36.121 2.405 10.148 1.00 0.00 H new ATOM 0 HB2 LYS A 69 37.494 1.925 8.190 1.00 0.00 H new ATOM 0 HB3 LYS A 69 36.138 1.181 7.367 1.00 0.00 H new ATOM 0 HG2 LYS A 69 34.956 3.373 7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 69 36.278 4.128 8.165 1.00 0.00 H new ATOM 0 HD2 LYS A 69 36.447 4.617 5.754 1.00 0.00 H new ATOM 0 HD3 LYS A 69 37.824 3.670 6.280 1.00 0.00 H new ATOM 0 HE2 LYS A 69 36.795 1.609 5.354 1.00 0.00 H new ATOM 0 HE3 LYS A 69 35.367 2.511 4.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 36.861 2.209 3.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 36.735 3.858 3.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 38.119 2.985 3.859 1.00 0.00 H new ATOM 1090 N TRP A 70 33.528 0.721 8.869 1.00 0.00 N ATOM 1091 CA TRP A 70 32.055 0.677 8.832 1.00 0.00 C ATOM 1092 C TRP A 70 31.448 0.700 10.251 1.00 0.00 C ATOM 1093 O TRP A 70 30.374 1.268 10.437 1.00 0.00 O ATOM 1094 CB TRP A 70 31.503 -0.534 8.044 1.00 0.00 C ATOM 1095 CG TRP A 70 29.985 -0.567 8.022 1.00 0.00 C ATOM 1096 CD1 TRP A 70 29.162 0.116 7.176 1.00 0.00 C ATOM 1097 CD2 TRP A 70 29.119 -1.254 8.943 1.00 0.00 C ATOM 1098 NE1 TRP A 70 27.854 -0.145 7.477 1.00 0.00 N ATOM 1099 CE2 TRP A 70 27.803 -0.971 8.558 1.00 0.00 C ATOM 1100 CE3 TRP A 70 29.342 -2.092 10.045 1.00 0.00 C ATOM 1101 CZ2 TRP A 70 26.711 -1.490 9.237 1.00 0.00 C ATOM 1102 CZ3 TRP A 70 28.255 -2.599 10.720 1.00 0.00 C ATOM 1103 CH2 TRP A 70 26.953 -2.301 10.313 1.00 0.00 C ATOM 0 H TRP A 70 33.977 -0.125 8.517 1.00 0.00 H new ATOM 0 HA TRP A 70 31.751 1.579 8.301 1.00 0.00 H new ATOM 0 HB2 TRP A 70 31.878 -0.500 7.021 1.00 0.00 H new ATOM 0 HB3 TRP A 70 31.877 -1.455 8.490 1.00 0.00 H new ATOM 0 HD1 TRP A 70 29.495 0.769 6.383 1.00 0.00 H new ATOM 0 HE1 TRP A 70 27.046 0.220 6.973 1.00 0.00 H new ATOM 0 HE3 TRP A 70 30.347 -2.335 10.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 25.702 -1.262 8.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 28.411 -3.237 11.577 1.00 0.00 H new ATOM 0 HH2 TRP A 70 26.120 -2.719 10.858 1.00 0.00 H new ATOM 1114 N LEU A 71 32.103 0.070 11.250 1.00 0.00 N ATOM 1115 CA LEU A 71 31.645 0.166 12.666 1.00 0.00 C ATOM 1116 C LEU A 71 31.584 1.649 13.122 1.00 0.00 C ATOM 1117 O LEU A 71 30.894 1.975 14.085 1.00 0.00 O ATOM 1118 CB LEU A 71 32.521 -0.690 13.644 1.00 0.00 C ATOM 1119 CG LEU A 71 32.150 -2.209 13.802 1.00 0.00 C ATOM 1120 CD1 LEU A 71 30.691 -2.388 14.255 1.00 0.00 C ATOM 1121 CD2 LEU A 71 32.440 -3.024 12.530 1.00 0.00 C ATOM 0 H LEU A 71 32.936 -0.502 11.114 1.00 0.00 H new ATOM 0 HA LEU A 71 30.640 -0.253 12.705 1.00 0.00 H new ATOM 0 HB2 LEU A 71 33.557 -0.629 13.310 1.00 0.00 H new ATOM 0 HB3 LEU A 71 32.476 -0.227 14.630 1.00 0.00 H new ATOM 0 HG LEU A 71 32.798 -2.605 14.584 1.00 0.00 H new ATOM 0 HD11 LEU A 71 30.469 -3.450 14.354 1.00 0.00 H new ATOM 0 HD12 LEU A 71 30.546 -1.896 15.216 1.00 0.00 H new ATOM 0 HD13 LEU A 71 30.024 -1.945 13.516 1.00 0.00 H new ATOM 0 HD21 LEU A 71 32.165 -4.066 12.695 1.00 0.00 H new ATOM 0 HD22 LEU A 71 31.859 -2.622 11.700 1.00 0.00 H new ATOM 0 HD23 LEU A 71 33.502 -2.962 12.292 1.00 0.00 H new ATOM 1133 N GLU A 72 32.339 2.522 12.433 1.00 0.00 N ATOM 1134 CA GLU A 72 32.160 3.991 12.507 1.00 0.00 C ATOM 1135 C GLU A 72 31.064 4.501 11.499 1.00 0.00 C ATOM 1136 O GLU A 72 30.169 5.263 11.889 1.00 0.00 O ATOM 1137 CB GLU A 72 33.526 4.680 12.253 1.00 0.00 C ATOM 1138 CG GLU A 72 33.526 6.215 12.383 1.00 0.00 C ATOM 1139 CD GLU A 72 34.915 6.829 12.137 1.00 0.00 C ATOM 1140 OE1 GLU A 72 35.761 6.802 13.055 1.00 0.00 O ATOM 1141 OE2 GLU A 72 35.173 7.315 11.018 1.00 0.00 O ATOM 0 H GLU A 72 33.092 2.234 11.808 1.00 0.00 H new ATOM 0 HA GLU A 72 31.804 4.251 13.504 1.00 0.00 H new ATOM 0 HB2 GLU A 72 34.255 4.273 12.954 1.00 0.00 H new ATOM 0 HB3 GLU A 72 33.866 4.417 11.251 1.00 0.00 H new ATOM 0 HG2 GLU A 72 32.815 6.636 11.672 1.00 0.00 H new ATOM 0 HG3 GLU A 72 33.182 6.492 13.380 1.00 0.00 H new