USER MOD reduce.3.24.130724 H: found=0, std=0, add=557, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 556 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 Set 1.1: A 271 GLN :FLIP amide:sc= -1.06 F(o=-6.4!,f=-2.5) USER MOD Set 1.2: A 289 CYS SG : rot 12:sc= -1.4 USER MOD Set 2.1: A 254 CYS SG : rot 163:sc= -0.253! USER MOD Set 2.2: A 257 SER OG : rot 12:sc= 0.658 USER MOD Set 2.3: A 277 SER OG : rot 135:sc= 1.24 USER MOD Single : A 261 MET CE :methyl -162:sc= -3.97! (180deg=-6.15!) USER MOD Single : A 262 LYS NZ :NH3+ -174:sc= 2.16 (180deg=1.96) USER MOD Single : A 268 SER OG : rot 152:sc= 1.22 USER MOD Single : A 269 THR OG1 : rot -150:sc= -0.0729 USER MOD Single : A 272 THR OG1 : rot 180:sc= 0 USER MOD Single : A 273 TYR OH : rot 120:sc= -1.72! USER MOD Single : A 276 SER OG : rot 180:sc= 0 USER MOD Single : A 279 GLN : amide:sc= -0.175 K(o=-0.18,f=-7!) USER MOD Single : A 280 LYS NZ :NH3+ -170:sc=-0.00347 (180deg=-0.0959) USER MOD Single : A 286 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 287 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 288 THR OG1 : rot 180:sc= 0 USER MOD Single : A 291 LYS NZ :NH3+ 140:sc= 0.0177 (180deg=-0.281) USER MOD Single : A 292 SER OG : rot -43:sc= 0.502 USER MOD Single : A 293 GLN : amide:sc= -0.59 X(o=-0.59,f=-0.32) USER MOD Single : A 295 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 302 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 ASN : amide:sc= -7.28! C(o=-7.3!,f=-13!) USER MOD Single : A 305 TYR OH : rot 180:sc= 0 USER MOD Single : A 308 LYS NZ :NH3+ 152:sc= 1.29 (180deg=1.2) USER MOD Single : A 309 SER OG : rot 180:sc= 0 USER MOD Single : A 315 CYS SG : rot -57:sc= -0.373 USER MOD Single : A 317 SER OG : rot 180:sc= 0 USER MOD Single : A 318 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD ----------------------------------------------------------------- ATOM 120 N PHE A 252 2.353 -7.121 0.746 1.00 0.00 N ATOM 121 CA PHE A 252 1.027 -7.601 1.112 1.00 0.00 C ATOM 122 C PHE A 252 0.265 -6.564 1.925 1.00 0.00 C ATOM 123 O PHE A 252 -0.600 -5.865 1.401 1.00 0.00 O ATOM 124 CB PHE A 252 1.104 -8.919 1.888 1.00 0.00 C ATOM 125 CG PHE A 252 1.360 -10.119 1.022 1.00 0.00 C ATOM 126 CD1 PHE A 252 0.637 -10.311 -0.146 1.00 0.00 C ATOM 127 CD2 PHE A 252 2.312 -11.060 1.380 1.00 0.00 C ATOM 128 CE1 PHE A 252 0.862 -11.417 -0.942 1.00 0.00 C ATOM 129 CE2 PHE A 252 2.540 -12.168 0.587 1.00 0.00 C ATOM 130 CZ PHE A 252 1.815 -12.348 -0.575 1.00 0.00 C ATOM 0 HA PHE A 252 0.486 -7.778 0.183 1.00 0.00 H new ATOM 0 HB2 PHE A 252 1.896 -8.845 2.633 1.00 0.00 H new ATOM 0 HB3 PHE A 252 0.169 -9.066 2.429 1.00 0.00 H new ATOM 0 HD1 PHE A 252 -0.110 -9.587 -0.436 1.00 0.00 H new ATOM 0 HD2 PHE A 252 2.881 -10.926 2.288 1.00 0.00 H new ATOM 0 HE1 PHE A 252 0.294 -11.554 -1.850 1.00 0.00 H new ATOM 0 HE2 PHE A 252 3.286 -12.894 0.876 1.00 0.00 H new ATOM 0 HZ PHE A 252 1.993 -13.214 -1.195 1.00 0.00 H new ATOM 140 N ARG A 253 0.593 -6.451 3.201 1.00 0.00 N ATOM 141 CA ARG A 253 -0.145 -5.564 4.086 1.00 0.00 C ATOM 142 C ARG A 253 0.424 -4.155 4.054 1.00 0.00 C ATOM 143 O ARG A 253 1.611 -3.960 3.789 1.00 0.00 O ATOM 144 CB ARG A 253 -0.156 -6.113 5.526 1.00 0.00 C ATOM 145 CG ARG A 253 1.214 -6.276 6.181 1.00 0.00 C ATOM 146 CD ARG A 253 1.794 -4.948 6.651 1.00 0.00 C ATOM 147 NE ARG A 253 3.169 -5.075 7.131 1.00 0.00 N ATOM 148 CZ ARG A 253 4.245 -4.803 6.385 1.00 0.00 C ATOM 149 NH1 ARG A 253 4.103 -4.450 5.110 1.00 0.00 N ATOM 150 NH2 ARG A 253 5.458 -4.884 6.916 1.00 0.00 N ATOM 0 H ARG A 253 1.359 -6.957 3.645 1.00 0.00 H new ATOM 0 HA ARG A 253 -1.173 -5.518 3.728 1.00 0.00 H new ATOM 0 HB2 ARG A 253 -0.758 -5.447 6.145 1.00 0.00 H new ATOM 0 HB3 ARG A 253 -0.655 -7.082 5.522 1.00 0.00 H new ATOM 0 HG2 ARG A 253 1.129 -6.954 7.031 1.00 0.00 H new ATOM 0 HG3 ARG A 253 1.900 -6.739 5.472 1.00 0.00 H new ATOM 0 HD2 ARG A 253 1.764 -4.232 5.830 1.00 0.00 H new ATOM 0 HD3 ARG A 253 1.170 -4.545 7.449 1.00 0.00 H new ATOM 0 HE ARG A 253 3.316 -5.389 8.090 1.00 0.00 H new ATOM 0 HH11 ARG A 253 3.172 -4.386 4.699 1.00 0.00 H new ATOM 0 HH12 ARG A 253 4.926 -4.243 4.543 1.00 0.00 H new ATOM 0 HH21 ARG A 253 5.570 -5.154 7.893 1.00 0.00 H new ATOM 0 HH22 ARG A 253 6.279 -4.677 6.347 1.00 0.00 H new ATOM 164 N CYS A 254 -0.423 -3.176 4.324 1.00 0.00 N ATOM 165 CA CYS A 254 0.035 -1.813 4.496 1.00 0.00 C ATOM 166 C CYS A 254 0.477 -1.612 5.939 1.00 0.00 C ATOM 167 O CYS A 254 -0.276 -1.902 6.870 1.00 0.00 O ATOM 168 CB CYS A 254 -1.066 -0.816 4.131 1.00 0.00 C ATOM 169 SG CYS A 254 -2.552 -0.954 5.141 1.00 0.00 S ATOM 0 H CYS A 254 -1.430 -3.302 4.428 1.00 0.00 H new ATOM 0 HA CYS A 254 0.878 -1.635 3.829 1.00 0.00 H new ATOM 0 HB2 CYS A 254 -0.670 0.195 4.223 1.00 0.00 H new ATOM 0 HB3 CYS A 254 -1.337 -0.958 3.085 1.00 0.00 H new ATOM 0 HG CYS A 254 -3.265 0.126 5.014 1.00 0.00 H new ATOM 175 N PRO A 255 1.709 -1.136 6.149 1.00 0.00 N ATOM 176 CA PRO A 255 2.269 -0.936 7.494 1.00 0.00 C ATOM 177 C PRO A 255 1.548 0.158 8.285 1.00 0.00 C ATOM 178 O PRO A 255 1.881 0.422 9.437 1.00 0.00 O ATOM 179 CB PRO A 255 3.725 -0.524 7.228 1.00 0.00 C ATOM 180 CG PRO A 255 3.990 -0.889 5.805 1.00 0.00 C ATOM 181 CD PRO A 255 2.672 -0.780 5.098 1.00 0.00 C ATOM 0 HA PRO A 255 2.167 -1.836 8.101 1.00 0.00 H new ATOM 0 HB2 PRO A 255 3.867 0.544 7.392 1.00 0.00 H new ATOM 0 HB3 PRO A 255 4.409 -1.043 7.900 1.00 0.00 H new ATOM 0 HG2 PRO A 255 4.727 -0.220 5.361 1.00 0.00 H new ATOM 0 HG3 PRO A 255 4.391 -1.900 5.730 1.00 0.00 H new ATOM 0 HD2 PRO A 255 2.500 0.226 4.716 1.00 0.00 H new ATOM 0 HD3 PRO A 255 2.612 -1.459 4.247 1.00 0.00 H new ATOM 189 N ILE A 256 0.557 0.786 7.665 1.00 0.00 N ATOM 190 CA ILE A 256 -0.161 1.878 8.300 1.00 0.00 C ATOM 191 C ILE A 256 -1.372 1.368 9.085 1.00 0.00 C ATOM 192 O ILE A 256 -1.632 1.829 10.198 1.00 0.00 O ATOM 193 CB ILE A 256 -0.619 2.934 7.263 1.00 0.00 C ATOM 194 CG1 ILE A 256 0.580 3.405 6.431 1.00 0.00 C ATOM 195 CG2 ILE A 256 -1.279 4.116 7.961 1.00 0.00 C ATOM 196 CD1 ILE A 256 0.230 4.402 5.346 1.00 0.00 C ATOM 0 H ILE A 256 0.234 0.557 6.725 1.00 0.00 H new ATOM 0 HA ILE A 256 0.533 2.350 8.995 1.00 0.00 H new ATOM 0 HB ILE A 256 -1.352 2.477 6.598 1.00 0.00 H new ATOM 0 HG12 ILE A 256 1.316 3.854 7.097 1.00 0.00 H new ATOM 0 HG13 ILE A 256 1.053 2.537 5.972 1.00 0.00 H new ATOM 0 HG21 ILE A 256 -1.594 4.848 7.217 1.00 0.00 H new ATOM 0 HG22 ILE A 256 -2.148 3.769 8.520 1.00 0.00 H new ATOM 0 HG23 ILE A 256 -0.568 4.578 8.646 1.00 0.00 H new ATOM 0 HD11 ILE A 256 1.134 4.683 4.805 1.00 0.00 H new ATOM 0 HD12 ILE A 256 -0.482 3.952 4.654 1.00 0.00 H new ATOM 0 HD13 ILE A 256 -0.214 5.289 5.797 1.00 0.00 H new ATOM 208 N SER A 257 -2.105 0.408 8.530 1.00 0.00 N ATOM 209 CA SER A 257 -3.356 -0.013 9.155 1.00 0.00 C ATOM 210 C SER A 257 -3.648 -1.511 9.007 1.00 0.00 C ATOM 211 O SER A 257 -4.610 -2.002 9.598 1.00 0.00 O ATOM 212 CB SER A 257 -4.506 0.796 8.553 1.00 0.00 C ATOM 213 OG SER A 257 -4.457 0.753 7.137 1.00 0.00 O ATOM 0 H SER A 257 -1.864 -0.084 7.670 1.00 0.00 H new ATOM 0 HA SER A 257 -3.256 0.173 10.224 1.00 0.00 H new ATOM 0 HB2 SER A 257 -5.459 0.399 8.902 1.00 0.00 H new ATOM 0 HB3 SER A 257 -4.448 1.830 8.893 1.00 0.00 H new ATOM 0 HG SER A 257 -3.814 0.070 6.853 1.00 0.00 H new ATOM 219 N LEU A 258 -2.822 -2.238 8.247 1.00 0.00 N ATOM 220 CA LEU A 258 -3.119 -3.628 7.907 1.00 0.00 C ATOM 221 C LEU A 258 -4.488 -3.721 7.222 1.00 0.00 C ATOM 222 O LEU A 258 -5.273 -4.641 7.464 1.00 0.00 O ATOM 223 CB LEU A 258 -3.066 -4.525 9.153 1.00 0.00 C ATOM 224 CG LEU A 258 -3.355 -6.013 8.914 1.00 0.00 C ATOM 225 CD1 LEU A 258 -2.452 -6.584 7.838 1.00 0.00 C ATOM 226 CD2 LEU A 258 -3.208 -6.804 10.203 1.00 0.00 C ATOM 0 H LEU A 258 -1.947 -1.886 7.858 1.00 0.00 H new ATOM 0 HA LEU A 258 -2.358 -3.984 7.213 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -2.077 -4.433 9.602 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -3.783 -4.147 9.881 1.00 0.00 H new ATOM 0 HG LEU A 258 -4.386 -6.098 8.569 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -2.682 -7.640 7.693 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -2.613 -6.045 6.904 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -1.411 -6.478 8.143 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.417 -7.856 10.010 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -2.191 -6.700 10.580 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -3.910 -6.424 10.945 1.00 0.00 H new ATOM 238 N GLU A 259 -4.770 -2.763 6.357 1.00 0.00 N ATOM 239 CA GLU A 259 -5.992 -2.801 5.569 1.00 0.00 C ATOM 240 C GLU A 259 -5.755 -3.692 4.363 1.00 0.00 C ATOM 241 O GLU A 259 -6.694 -4.128 3.708 1.00 0.00 O ATOM 242 CB GLU A 259 -6.404 -1.388 5.133 1.00 0.00 C ATOM 243 CG GLU A 259 -5.608 -0.846 3.953 1.00 0.00 C ATOM 244 CD GLU A 259 -5.444 0.658 3.992 1.00 0.00 C ATOM 245 OE1 GLU A 259 -6.461 1.375 4.077 1.00 0.00 O ATOM 246 OE2 GLU A 259 -4.285 1.127 3.956 1.00 0.00 O ATOM 0 H GLU A 259 -4.175 -1.953 6.182 1.00 0.00 H new ATOM 0 HA GLU A 259 -6.807 -3.204 6.170 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -7.462 -1.394 4.872 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -6.288 -0.710 5.978 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -4.623 -1.313 3.941 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -6.106 -1.128 3.025 1.00 0.00 H new ATOM 253 N LEU A 260 -4.467 -3.962 4.123 1.00 0.00 N ATOM 254 CA LEU A 260 -3.993 -4.778 3.006 1.00 0.00 C ATOM 255 C LEU A 260 -4.668 -4.347 1.715 1.00 0.00 C ATOM 256 O LEU A 260 -5.725 -4.865 1.344 1.00 0.00 O ATOM 257 CB LEU A 260 -4.212 -6.273 3.276 1.00 0.00 C ATOM 258 CG LEU A 260 -3.241 -7.228 2.574 1.00 0.00 C ATOM 259 CD1 LEU A 260 -3.287 -8.591 3.236 1.00 0.00 C ATOM 260 CD2 LEU A 260 -3.572 -7.361 1.095 1.00 0.00 C ATOM 0 H LEU A 260 -3.712 -3.611 4.713 1.00 0.00 H new ATOM 0 HA LEU A 260 -2.919 -4.622 2.900 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -4.145 -6.442 4.351 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -5.227 -6.532 2.976 1.00 0.00 H new ATOM 0 HG LEU A 260 -2.236 -6.814 2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -2.594 -9.264 2.731 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -3.003 -8.496 4.284 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -4.298 -8.994 3.169 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -2.866 -8.045 0.624 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -4.584 -7.750 0.982 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -3.504 -6.384 0.618 1.00 0.00 H new ATOM 272 N MET A 261 -4.040 -3.387 1.058 1.00 0.00 N ATOM 273 CA MET A 261 -4.561 -2.794 -0.161 1.00 0.00 C ATOM 274 C MET A 261 -5.022 -3.842 -1.161 1.00 0.00 C ATOM 275 O MET A 261 -4.423 -4.903 -1.293 1.00 0.00 O ATOM 276 CB MET A 261 -3.503 -1.892 -0.812 1.00 0.00 C ATOM 277 CG MET A 261 -2.077 -2.413 -0.704 1.00 0.00 C ATOM 278 SD MET A 261 -1.348 -2.139 0.927 1.00 0.00 S ATOM 279 CE MET A 261 0.284 -2.838 0.693 1.00 0.00 C ATOM 0 H MET A 261 -3.148 -2.994 1.358 1.00 0.00 H new ATOM 0 HA MET A 261 -5.429 -2.199 0.122 1.00 0.00 H new ATOM 0 HB2 MET A 261 -3.751 -1.765 -1.866 1.00 0.00 H new ATOM 0 HB3 MET A 261 -3.552 -0.905 -0.351 1.00 0.00 H new ATOM 0 HG2 MET A 261 -2.068 -3.480 -0.925 1.00 0.00 H new ATOM 0 HG3 MET A 261 -1.460 -1.926 -1.459 1.00 0.00 H new ATOM 0 HE1 MET A 261 0.737 -3.038 1.664 1.00 0.00 H new ATOM 0 HE2 MET A 261 0.204 -3.769 0.131 1.00 0.00 H new ATOM 0 HE3 MET A 261 0.906 -2.133 0.141 1.00 0.00 H new ATOM 289 N LYS A 262 -6.110 -3.536 -1.841 1.00 0.00 N ATOM 290 CA LYS A 262 -6.594 -4.372 -2.926 1.00 0.00 C ATOM 291 C LYS A 262 -6.186 -3.736 -4.242 1.00 0.00 C ATOM 292 O LYS A 262 -5.915 -4.417 -5.229 1.00 0.00 O ATOM 293 CB LYS A 262 -8.121 -4.535 -2.863 1.00 0.00 C ATOM 294 CG LYS A 262 -8.617 -5.404 -1.711 1.00 0.00 C ATOM 295 CD LYS A 262 -9.356 -4.591 -0.652 1.00 0.00 C ATOM 296 CE LYS A 262 -8.412 -3.680 0.116 1.00 0.00 C ATOM 297 NZ LYS A 262 -9.129 -2.771 1.046 1.00 0.00 N ATOM 0 H LYS A 262 -6.680 -2.709 -1.661 1.00 0.00 H new ATOM 0 HA LYS A 262 -6.156 -5.366 -2.837 1.00 0.00 H new ATOM 0 HB2 LYS A 262 -8.576 -3.548 -2.779 1.00 0.00 H new ATOM 0 HB3 LYS A 262 -8.467 -4.967 -3.802 1.00 0.00 H new ATOM 0 HG2 LYS A 262 -9.279 -6.177 -2.100 1.00 0.00 H new ATOM 0 HG3 LYS A 262 -7.770 -5.912 -1.251 1.00 0.00 H new ATOM 0 HD2 LYS A 262 -10.132 -3.992 -1.129 1.00 0.00 H new ATOM 0 HD3 LYS A 262 -9.856 -5.266 0.043 1.00 0.00 H new ATOM 0 HE2 LYS A 262 -7.705 -4.288 0.680 1.00 0.00 H new ATOM 0 HE3 LYS A 262 -7.830 -3.087 -0.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 262 -8.453 -2.103 1.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 262 -9.856 -2.243 0.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 262 -9.580 -3.330 1.798 1.00 0.00 H new ATOM 311 N ASP A 263 -6.135 -2.413 -4.226 1.00 0.00 N ATOM 312 CA ASP A 263 -5.658 -1.634 -5.356 1.00 0.00 C ATOM 313 C ASP A 263 -4.833 -0.468 -4.822 1.00 0.00 C ATOM 314 O ASP A 263 -5.379 0.494 -4.272 1.00 0.00 O ATOM 315 CB ASP A 263 -6.827 -1.132 -6.208 1.00 0.00 C ATOM 316 CG ASP A 263 -6.369 -0.524 -7.520 1.00 0.00 C ATOM 317 OD1 ASP A 263 -6.207 -1.281 -8.507 1.00 0.00 O ATOM 318 OD2 ASP A 263 -6.168 0.703 -7.576 1.00 0.00 O ATOM 0 H ASP A 263 -6.424 -1.849 -3.427 1.00 0.00 H new ATOM 0 HA ASP A 263 -5.039 -2.260 -5.999 1.00 0.00 H new ATOM 0 HB2 ASP A 263 -7.506 -1.960 -6.412 1.00 0.00 H new ATOM 0 HB3 ASP A 263 -7.391 -0.389 -5.644 1.00 0.00 H new ATOM 323 N PRO A 264 -3.502 -0.565 -4.928 1.00 0.00 N ATOM 324 CA PRO A 264 -2.586 0.372 -4.303 1.00 0.00 C ATOM 325 C PRO A 264 -2.182 1.525 -5.207 1.00 0.00 C ATOM 326 O PRO A 264 -2.241 1.437 -6.437 1.00 0.00 O ATOM 327 CB PRO A 264 -1.385 -0.515 -4.011 1.00 0.00 C ATOM 328 CG PRO A 264 -1.357 -1.490 -5.145 1.00 0.00 C ATOM 329 CD PRO A 264 -2.773 -1.606 -5.666 1.00 0.00 C ATOM 0 HA PRO A 264 -3.028 0.861 -3.435 1.00 0.00 H new ATOM 0 HB2 PRO A 264 -0.464 0.066 -3.964 1.00 0.00 H new ATOM 0 HB3 PRO A 264 -1.490 -1.023 -3.053 1.00 0.00 H new ATOM 0 HG2 PRO A 264 -0.684 -1.148 -5.931 1.00 0.00 H new ATOM 0 HG3 PRO A 264 -0.989 -2.460 -4.810 1.00 0.00 H new ATOM 0 HD2 PRO A 264 -2.819 -1.440 -6.742 1.00 0.00 H new ATOM 0 HD3 PRO A 264 -3.189 -2.596 -5.478 1.00 0.00 H new ATOM 337 N VAL A 265 -1.752 2.604 -4.582 1.00 0.00 N ATOM 338 CA VAL A 265 -1.284 3.763 -5.307 1.00 0.00 C ATOM 339 C VAL A 265 0.150 4.094 -4.925 1.00 0.00 C ATOM 340 O VAL A 265 0.489 4.205 -3.742 1.00 0.00 O ATOM 341 CB VAL A 265 -2.185 4.994 -5.077 1.00 0.00 C ATOM 342 CG1 VAL A 265 -3.499 4.841 -5.831 1.00 0.00 C ATOM 343 CG2 VAL A 265 -2.435 5.213 -3.589 1.00 0.00 C ATOM 0 H VAL A 265 -1.718 2.699 -3.567 1.00 0.00 H new ATOM 0 HA VAL A 265 -1.325 3.512 -6.367 1.00 0.00 H new ATOM 0 HB VAL A 265 -1.669 5.873 -5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 265 -4.122 5.718 -5.658 1.00 0.00 H new ATOM 0 HG12 VAL A 265 -3.297 4.744 -6.898 1.00 0.00 H new ATOM 0 HG13 VAL A 265 -4.019 3.951 -5.478 1.00 0.00 H new ATOM 0 HG21 VAL A 265 -3.073 6.086 -3.452 1.00 0.00 H new ATOM 0 HG22 VAL A 265 -2.927 4.335 -3.170 1.00 0.00 H new ATOM 0 HG23 VAL A 265 -1.485 5.374 -3.080 1.00 0.00 H new ATOM 353 N ILE A 266 0.988 4.214 -5.932 1.00 0.00 N ATOM 354 CA ILE A 266 2.362 4.626 -5.748 1.00 0.00 C ATOM 355 C ILE A 266 2.457 6.140 -5.900 1.00 0.00 C ATOM 356 O ILE A 266 1.736 6.731 -6.694 1.00 0.00 O ATOM 357 CB ILE A 266 3.298 3.925 -6.773 1.00 0.00 C ATOM 358 CG1 ILE A 266 4.087 2.798 -6.112 1.00 0.00 C ATOM 359 CG2 ILE A 266 4.242 4.911 -7.435 1.00 0.00 C ATOM 360 CD1 ILE A 266 5.143 2.191 -7.013 1.00 0.00 C ATOM 0 H ILE A 266 0.735 4.028 -6.903 1.00 0.00 H new ATOM 0 HA ILE A 266 2.685 4.336 -4.748 1.00 0.00 H new ATOM 0 HB ILE A 266 2.663 3.497 -7.548 1.00 0.00 H new ATOM 0 HG12 ILE A 266 4.566 3.180 -5.211 1.00 0.00 H new ATOM 0 HG13 ILE A 266 3.395 2.016 -5.798 1.00 0.00 H new ATOM 0 HG21 ILE A 266 4.880 4.384 -8.144 1.00 0.00 H new ATOM 0 HG22 ILE A 266 3.664 5.671 -7.962 1.00 0.00 H new ATOM 0 HG23 ILE A 266 4.861 5.388 -6.675 1.00 0.00 H new ATOM 0 HD11 ILE A 266 5.665 1.397 -6.479 1.00 0.00 H new ATOM 0 HD12 ILE A 266 4.668 1.778 -7.903 1.00 0.00 H new ATOM 0 HD13 ILE A 266 5.857 2.961 -7.306 1.00 0.00 H new ATOM 372 N VAL A 267 3.309 6.766 -5.118 1.00 0.00 N ATOM 373 CA VAL A 267 3.589 8.183 -5.281 1.00 0.00 C ATOM 374 C VAL A 267 5.087 8.401 -5.162 1.00 0.00 C ATOM 375 O VAL A 267 5.841 7.436 -4.995 1.00 0.00 O ATOM 376 CB VAL A 267 2.845 9.089 -4.262 1.00 0.00 C ATOM 377 CG1 VAL A 267 1.344 8.855 -4.305 1.00 0.00 C ATOM 378 CG2 VAL A 267 3.372 8.889 -2.855 1.00 0.00 C ATOM 0 H VAL A 267 3.823 6.318 -4.360 1.00 0.00 H new ATOM 0 HA VAL A 267 3.223 8.472 -6.266 1.00 0.00 H new ATOM 0 HB VAL A 267 3.036 10.122 -4.552 1.00 0.00 H new ATOM 0 HG11 VAL A 267 0.854 9.505 -3.580 1.00 0.00 H new ATOM 0 HG12 VAL A 267 0.969 9.078 -5.304 1.00 0.00 H new ATOM 0 HG13 VAL A 267 1.131 7.814 -4.062 1.00 0.00 H new ATOM 0 HG21 VAL A 267 2.830 9.538 -2.168 1.00 0.00 H new ATOM 0 HG22 VAL A 267 3.233 7.849 -2.559 1.00 0.00 H new ATOM 0 HG23 VAL A 267 4.433 9.136 -2.826 1.00 0.00 H new ATOM 388 N SER A 268 5.518 9.650 -5.251 1.00 0.00 N ATOM 389 CA SER A 268 6.934 9.970 -5.158 1.00 0.00 C ATOM 390 C SER A 268 7.492 9.480 -3.823 1.00 0.00 C ATOM 391 O SER A 268 6.734 9.238 -2.880 1.00 0.00 O ATOM 392 CB SER A 268 7.136 11.479 -5.301 1.00 0.00 C ATOM 393 OG SER A 268 8.511 11.811 -5.363 1.00 0.00 O ATOM 0 H SER A 268 4.909 10.457 -5.387 1.00 0.00 H new ATOM 0 HA SER A 268 7.470 9.468 -5.964 1.00 0.00 H new ATOM 0 HB2 SER A 268 6.634 11.831 -6.202 1.00 0.00 H new ATOM 0 HB3 SER A 268 6.674 11.991 -4.457 1.00 0.00 H new ATOM 0 HG SER A 268 8.625 12.638 -5.877 1.00 0.00 H new ATOM 399 N THR A 269 8.816 9.322 -3.767 1.00 0.00 N ATOM 400 CA THR A 269 9.510 8.654 -2.659 1.00 0.00 C ATOM 401 C THR A 269 9.505 7.141 -2.877 1.00 0.00 C ATOM 402 O THR A 269 10.411 6.430 -2.436 1.00 0.00 O ATOM 403 CB THR A 269 8.901 8.988 -1.276 1.00 0.00 C ATOM 404 OG1 THR A 269 8.755 10.402 -1.145 1.00 0.00 O ATOM 405 CG2 THR A 269 9.771 8.464 -0.145 1.00 0.00 C ATOM 0 H THR A 269 9.445 9.657 -4.497 1.00 0.00 H new ATOM 0 HA THR A 269 10.533 9.029 -2.655 1.00 0.00 H new ATOM 0 HB THR A 269 7.927 8.503 -1.211 1.00 0.00 H new ATOM 0 HG1 THR A 269 8.839 10.654 -0.202 1.00 0.00 H new ATOM 0 HG21 THR A 269 9.314 8.716 0.812 1.00 0.00 H new ATOM 0 HG22 THR A 269 9.864 7.381 -0.229 1.00 0.00 H new ATOM 0 HG23 THR A 269 10.760 8.919 -0.206 1.00 0.00 H new ATOM 413 N GLY A 270 8.489 6.658 -3.581 1.00 0.00 N ATOM 414 CA GLY A 270 8.435 5.253 -3.936 1.00 0.00 C ATOM 415 C GLY A 270 7.660 4.423 -2.936 1.00 0.00 C ATOM 416 O GLY A 270 8.019 3.280 -2.661 1.00 0.00 O ATOM 0 H GLY A 270 7.701 7.214 -3.913 1.00 0.00 H new ATOM 0 HA2 GLY A 270 7.977 5.149 -4.920 1.00 0.00 H new ATOM 0 HA3 GLY A 270 9.450 4.864 -4.015 1.00 0.00 H new ATOM 420 N GLN A 271 6.604 4.998 -2.383 1.00 0.00 N ATOM 421 CA GLN A 271 5.746 4.268 -1.457 1.00 0.00 C ATOM 422 C GLN A 271 4.665 3.517 -2.225 1.00 0.00 C ATOM 423 O GLN A 271 4.294 3.916 -3.326 1.00 0.00 O ATOM 424 CB GLN A 271 5.071 5.226 -0.481 1.00 0.00 C ATOM 425 CG GLN A 271 4.011 6.082 -1.146 1.00 0.00 C ATOM 426 CD GLN A 271 3.061 6.733 -0.165 1.00 0.00 C ATOM 427 OE1 GLN A 271 1.812 6.897 -0.584 1.00 0.00 O flip ATOM 428 NE2 GLN A 271 3.436 7.068 0.959 1.00 0.00 N flip ATOM 0 H GLN A 271 6.320 5.962 -2.556 1.00 0.00 H new ATOM 0 HA GLN A 271 6.369 3.565 -0.905 1.00 0.00 H new ATOM 0 HB2 GLN A 271 4.617 4.654 0.328 1.00 0.00 H new ATOM 0 HB3 GLN A 271 5.825 5.872 -0.031 1.00 0.00 H new ATOM 0 HG2 GLN A 271 4.499 6.857 -1.737 1.00 0.00 H new ATOM 0 HG3 GLN A 271 3.439 5.465 -1.839 1.00 0.00 H new ATOM 0 HE21 GLN A 271 4.406 6.922 1.237 1.00 0.00 H new ATOM 0 HE22 GLN A 271 2.776 7.491 1.612 1.00 0.00 H new ATOM 437 N THR A 272 4.160 2.435 -1.647 1.00 0.00 N ATOM 438 CA THR A 272 3.012 1.746 -2.211 1.00 0.00 C ATOM 439 C THR A 272 2.082 1.263 -1.094 1.00 0.00 C ATOM 440 O THR A 272 2.327 0.234 -0.463 1.00 0.00 O ATOM 441 CB THR A 272 3.441 0.550 -3.093 1.00 0.00 C ATOM 442 OG1 THR A 272 4.747 0.786 -3.641 1.00 0.00 O ATOM 443 CG2 THR A 272 2.450 0.358 -4.227 1.00 0.00 C ATOM 0 H THR A 272 4.527 2.019 -0.791 1.00 0.00 H new ATOM 0 HA THR A 272 2.480 2.456 -2.844 1.00 0.00 H new ATOM 0 HB THR A 272 3.464 -0.348 -2.475 1.00 0.00 H new ATOM 0 HG1 THR A 272 5.011 0.023 -4.197 1.00 0.00 H new ATOM 0 HG21 THR A 272 2.761 -0.486 -4.843 1.00 0.00 H new ATOM 0 HG22 THR A 272 1.460 0.162 -3.816 1.00 0.00 H new ATOM 0 HG23 THR A 272 2.417 1.260 -4.838 1.00 0.00 H new ATOM 451 N TYR A 273 1.020 2.029 -0.850 1.00 0.00 N ATOM 452 CA TYR A 273 0.049 1.725 0.199 1.00 0.00 C ATOM 453 C TYR A 273 -1.361 1.849 -0.375 1.00 0.00 C ATOM 454 O TYR A 273 -1.521 2.190 -1.552 1.00 0.00 O ATOM 455 CB TYR A 273 0.213 2.689 1.385 1.00 0.00 C ATOM 456 CG TYR A 273 1.615 2.737 1.949 1.00 0.00 C ATOM 457 CD1 TYR A 273 2.239 1.587 2.414 1.00 0.00 C ATOM 458 CD2 TYR A 273 2.316 3.935 2.013 1.00 0.00 C ATOM 459 CE1 TYR A 273 3.521 1.630 2.923 1.00 0.00 C ATOM 460 CE2 TYR A 273 3.600 3.984 2.521 1.00 0.00 C ATOM 461 CZ TYR A 273 4.196 2.828 2.974 1.00 0.00 C ATOM 462 OH TYR A 273 5.474 2.871 3.475 1.00 0.00 O ATOM 0 H TYR A 273 0.809 2.878 -1.374 1.00 0.00 H new ATOM 0 HA TYR A 273 0.218 0.709 0.556 1.00 0.00 H new ATOM 0 HB2 TYR A 273 -0.074 3.691 1.068 1.00 0.00 H new ATOM 0 HB3 TYR A 273 -0.476 2.395 2.177 1.00 0.00 H new ATOM 0 HD1 TYR A 273 1.713 0.644 2.377 1.00 0.00 H new ATOM 0 HD2 TYR A 273 1.850 4.843 1.660 1.00 0.00 H new ATOM 0 HE1 TYR A 273 3.993 0.727 3.280 1.00 0.00 H new ATOM 0 HE2 TYR A 273 4.133 4.923 2.563 1.00 0.00 H new ATOM 0 HH TYR A 273 6.085 3.202 2.784 1.00 0.00 H new ATOM 472 N GLU A 274 -2.385 1.581 0.431 1.00 0.00 N ATOM 473 CA GLU A 274 -3.751 1.747 -0.038 1.00 0.00 C ATOM 474 C GLU A 274 -4.215 3.182 0.153 1.00 0.00 C ATOM 475 O GLU A 274 -3.804 3.876 1.087 1.00 0.00 O ATOM 476 CB GLU A 274 -4.726 0.775 0.637 1.00 0.00 C ATOM 477 CG GLU A 274 -6.156 0.927 0.127 1.00 0.00 C ATOM 478 CD GLU A 274 -6.935 -0.370 0.098 1.00 0.00 C ATOM 479 OE1 GLU A 274 -7.535 -0.731 1.126 1.00 0.00 O ATOM 480 OE2 GLU A 274 -6.964 -1.022 -0.971 1.00 0.00 O ATOM 0 H GLU A 274 -2.295 1.254 1.393 1.00 0.00 H new ATOM 0 HA GLU A 274 -3.749 1.512 -1.102 1.00 0.00 H new ATOM 0 HB2 GLU A 274 -4.390 -0.248 0.466 1.00 0.00 H new ATOM 0 HB3 GLU A 274 -4.709 0.940 1.714 1.00 0.00 H new ATOM 0 HG2 GLU A 274 -6.683 1.642 0.758 1.00 0.00 H new ATOM 0 HG3 GLU A 274 -6.131 1.347 -0.878 1.00 0.00 H new ATOM 487 N ARG A 275 -5.077 3.601 -0.758 1.00 0.00 N ATOM 488 CA ARG A 275 -5.591 4.961 -0.830 1.00 0.00 C ATOM 489 C ARG A 275 -6.231 5.420 0.470 1.00 0.00 C ATOM 490 O ARG A 275 -6.150 6.593 0.816 1.00 0.00 O ATOM 491 CB ARG A 275 -6.616 5.025 -1.953 1.00 0.00 C ATOM 492 CG ARG A 275 -6.028 4.654 -3.297 1.00 0.00 C ATOM 493 CD ARG A 275 -7.090 4.194 -4.278 1.00 0.00 C ATOM 494 NE ARG A 275 -7.646 2.892 -3.914 1.00 0.00 N ATOM 495 CZ ARG A 275 -8.802 2.418 -4.376 1.00 0.00 C ATOM 496 NH1 ARG A 275 -9.516 3.125 -5.242 1.00 0.00 N ATOM 497 NH2 ARG A 275 -9.240 1.228 -3.985 1.00 0.00 N ATOM 0 H ARG A 275 -5.449 2.991 -1.486 1.00 0.00 H new ATOM 0 HA ARG A 275 -4.751 5.630 -1.019 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -7.443 4.353 -1.724 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -7.029 6.032 -2.006 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -5.501 5.513 -3.711 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -5.291 3.862 -3.164 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -7.891 4.932 -4.317 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -6.660 4.138 -5.278 1.00 0.00 H new ATOM 0 HE ARG A 275 -7.116 2.310 -3.266 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -9.180 4.035 -5.557 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -10.401 2.758 -5.593 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -8.691 0.673 -3.329 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -10.126 0.868 -4.341 1.00 0.00 H new ATOM 511 N SER A 276 -6.846 4.503 1.194 1.00 0.00 N ATOM 512 CA SER A 276 -7.606 4.867 2.373 1.00 0.00 C ATOM 513 C SER A 276 -6.687 5.415 3.466 1.00 0.00 C ATOM 514 O SER A 276 -7.109 6.214 4.305 1.00 0.00 O ATOM 515 CB SER A 276 -8.400 3.666 2.892 1.00 0.00 C ATOM 516 OG SER A 276 -9.255 4.041 3.962 1.00 0.00 O ATOM 0 H SER A 276 -6.834 3.504 0.987 1.00 0.00 H new ATOM 0 HA SER A 276 -8.309 5.652 2.095 1.00 0.00 H new ATOM 0 HB2 SER A 276 -8.992 3.240 2.082 1.00 0.00 H new ATOM 0 HB3 SER A 276 -7.713 2.889 3.227 1.00 0.00 H new ATOM 0 HG SER A 276 -9.752 3.256 4.274 1.00 0.00 H new ATOM 522 N SER A 277 -5.430 5.002 3.434 1.00 0.00 N ATOM 523 CA SER A 277 -4.453 5.445 4.419 1.00 0.00 C ATOM 524 C SER A 277 -3.661 6.647 3.907 1.00 0.00 C ATOM 525 O SER A 277 -3.342 7.557 4.668 1.00 0.00 O ATOM 526 CB SER A 277 -3.506 4.295 4.780 1.00 0.00 C ATOM 527 OG SER A 277 -4.204 3.245 5.428 1.00 0.00 O ATOM 0 H SER A 277 -5.060 4.358 2.734 1.00 0.00 H new ATOM 0 HA SER A 277 -4.991 5.754 5.315 1.00 0.00 H new ATOM 0 HB2 SER A 277 -3.028 3.916 3.877 1.00 0.00 H new ATOM 0 HB3 SER A 277 -2.712 4.664 5.430 1.00 0.00 H new ATOM 0 HG SER A 277 -3.923 2.385 5.052 1.00 0.00 H new ATOM 533 N ILE A 278 -3.373 6.664 2.609 1.00 0.00 N ATOM 534 CA ILE A 278 -2.519 7.699 2.038 1.00 0.00 C ATOM 535 C ILE A 278 -3.320 8.865 1.464 1.00 0.00 C ATOM 536 O ILE A 278 -3.059 10.022 1.796 1.00 0.00 O ATOM 537 CB ILE A 278 -1.586 7.115 0.946 1.00 0.00 C ATOM 538 CG1 ILE A 278 -0.805 8.228 0.261 1.00 0.00 C ATOM 539 CG2 ILE A 278 -2.362 6.305 -0.081 1.00 0.00 C ATOM 540 CD1 ILE A 278 0.133 8.954 1.188 1.00 0.00 C ATOM 0 H ILE A 278 -3.716 5.978 1.937 1.00 0.00 H new ATOM 0 HA ILE A 278 -1.913 8.083 2.859 1.00 0.00 H new ATOM 0 HB ILE A 278 -0.885 6.442 1.439 1.00 0.00 H new ATOM 0 HG12 ILE A 278 -0.234 7.806 -0.566 1.00 0.00 H new ATOM 0 HG13 ILE A 278 -1.506 8.943 -0.169 1.00 0.00 H new ATOM 0 HG21 ILE A 278 -1.674 5.912 -0.830 1.00 0.00 H new ATOM 0 HG22 ILE A 278 -2.869 5.478 0.416 1.00 0.00 H new ATOM 0 HG23 ILE A 278 -3.100 6.944 -0.566 1.00 0.00 H new ATOM 0 HD11 ILE A 278 0.658 9.734 0.637 1.00 0.00 H new ATOM 0 HD12 ILE A 278 -0.436 9.405 2.001 1.00 0.00 H new ATOM 0 HD13 ILE A 278 0.857 8.250 1.598 1.00 0.00 H new ATOM 552 N GLN A 279 -4.308 8.565 0.634 1.00 0.00 N ATOM 553 CA GLN A 279 -5.083 9.605 -0.037 1.00 0.00 C ATOM 554 C GLN A 279 -5.868 10.403 0.973 1.00 0.00 C ATOM 555 O GLN A 279 -6.233 11.551 0.737 1.00 0.00 O ATOM 556 CB GLN A 279 -6.034 9.009 -1.062 1.00 0.00 C ATOM 557 CG GLN A 279 -5.349 8.573 -2.333 1.00 0.00 C ATOM 558 CD GLN A 279 -6.303 8.552 -3.512 1.00 0.00 C ATOM 559 OE1 GLN A 279 -6.907 7.531 -3.829 1.00 0.00 O ATOM 560 NE2 GLN A 279 -6.481 9.700 -4.142 1.00 0.00 N ATOM 0 H GLN A 279 -4.594 7.612 0.407 1.00 0.00 H new ATOM 0 HA GLN A 279 -4.382 10.260 -0.555 1.00 0.00 H new ATOM 0 HB2 GLN A 279 -6.542 8.152 -0.620 1.00 0.00 H new ATOM 0 HB3 GLN A 279 -6.801 9.744 -1.305 1.00 0.00 H new ATOM 0 HG2 GLN A 279 -4.521 9.248 -2.549 1.00 0.00 H new ATOM 0 HG3 GLN A 279 -4.923 7.580 -2.193 1.00 0.00 H new ATOM 0 HE21 GLN A 279 -5.961 10.528 -3.850 1.00 0.00 H new ATOM 0 HE22 GLN A 279 -7.138 9.758 -4.920 1.00 0.00 H new ATOM 569 N LYS A 280 -6.121 9.772 2.097 1.00 0.00 N ATOM 570 CA LYS A 280 -6.760 10.415 3.218 1.00 0.00 C ATOM 571 C LYS A 280 -6.048 11.722 3.572 1.00 0.00 C ATOM 572 O LYS A 280 -6.697 12.746 3.801 1.00 0.00 O ATOM 573 CB LYS A 280 -6.757 9.438 4.399 1.00 0.00 C ATOM 574 CG LYS A 280 -6.556 10.087 5.756 1.00 0.00 C ATOM 575 CD LYS A 280 -5.664 9.224 6.634 1.00 0.00 C ATOM 576 CE LYS A 280 -6.338 7.916 7.029 1.00 0.00 C ATOM 577 NZ LYS A 280 -7.495 8.128 7.939 1.00 0.00 N ATOM 0 H LYS A 280 -5.887 8.792 2.258 1.00 0.00 H new ATOM 0 HA LYS A 280 -7.788 10.674 2.965 1.00 0.00 H new ATOM 0 HB2 LYS A 280 -7.702 8.895 4.407 1.00 0.00 H new ATOM 0 HB3 LYS A 280 -5.968 8.702 4.243 1.00 0.00 H new ATOM 0 HG2 LYS A 280 -6.108 11.073 5.631 1.00 0.00 H new ATOM 0 HG3 LYS A 280 -7.521 10.234 6.241 1.00 0.00 H new ATOM 0 HD2 LYS A 280 -4.736 9.007 6.105 1.00 0.00 H new ATOM 0 HD3 LYS A 280 -5.396 9.779 7.533 1.00 0.00 H new ATOM 0 HE2 LYS A 280 -6.675 7.398 6.131 1.00 0.00 H new ATOM 0 HE3 LYS A 280 -5.610 7.268 7.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 280 -7.814 7.212 8.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 280 -7.209 8.744 8.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 280 -8.272 8.577 7.414 1.00 0.00 H new ATOM 591 N TRP A 281 -4.719 11.687 3.614 1.00 0.00 N ATOM 592 CA TRP A 281 -3.959 12.877 3.959 1.00 0.00 C ATOM 593 C TRP A 281 -3.398 13.572 2.711 1.00 0.00 C ATOM 594 O TRP A 281 -3.256 14.794 2.692 1.00 0.00 O ATOM 595 CB TRP A 281 -2.878 12.546 5.005 1.00 0.00 C ATOM 596 CG TRP A 281 -1.500 12.295 4.485 1.00 0.00 C ATOM 597 CD1 TRP A 281 -0.662 13.197 3.907 1.00 0.00 C ATOM 598 CD2 TRP A 281 -0.781 11.067 4.559 1.00 0.00 C ATOM 599 NE1 TRP A 281 0.526 12.599 3.586 1.00 0.00 N ATOM 600 CE2 TRP A 281 0.480 11.290 3.981 1.00 0.00 C ATOM 601 CE3 TRP A 281 -1.086 9.798 5.049 1.00 0.00 C ATOM 602 CZ2 TRP A 281 1.435 10.289 3.883 1.00 0.00 C ATOM 603 CZ3 TRP A 281 -0.137 8.803 4.955 1.00 0.00 C ATOM 604 CH2 TRP A 281 1.112 9.053 4.375 1.00 0.00 C ATOM 0 H TRP A 281 -4.156 10.860 3.416 1.00 0.00 H new ATOM 0 HA TRP A 281 -4.635 13.598 4.420 1.00 0.00 H new ATOM 0 HB2 TRP A 281 -2.829 13.370 5.717 1.00 0.00 H new ATOM 0 HB3 TRP A 281 -3.199 11.664 5.560 1.00 0.00 H new ATOM 0 HD1 TRP A 281 -0.900 14.235 3.727 1.00 0.00 H new ATOM 0 HE1 TRP A 281 1.316 13.054 3.128 1.00 0.00 H new ATOM 0 HE3 TRP A 281 -2.049 9.598 5.495 1.00 0.00 H new ATOM 0 HZ2 TRP A 281 2.399 10.478 3.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 281 -0.360 7.817 5.334 1.00 0.00 H new ATOM 0 HH2 TRP A 281 1.836 8.254 4.314 1.00 0.00 H new ATOM 615 N LEU A 282 -3.075 12.801 1.669 1.00 0.00 N ATOM 616 CA LEU A 282 -2.617 13.387 0.405 1.00 0.00 C ATOM 617 C LEU A 282 -3.671 14.301 -0.193 1.00 0.00 C ATOM 618 O LEU A 282 -3.367 15.421 -0.599 1.00 0.00 O ATOM 619 CB LEU A 282 -2.248 12.320 -0.623 1.00 0.00 C ATOM 620 CG LEU A 282 -0.864 11.697 -0.461 1.00 0.00 C ATOM 621 CD1 LEU A 282 -0.484 10.927 -1.717 1.00 0.00 C ATOM 622 CD2 LEU A 282 0.177 12.763 -0.154 1.00 0.00 C ATOM 0 H LEU A 282 -3.121 11.782 1.674 1.00 0.00 H new ATOM 0 HA LEU A 282 -1.725 13.966 0.644 1.00 0.00 H new ATOM 0 HB2 LEU A 282 -2.992 11.525 -0.577 1.00 0.00 H new ATOM 0 HB3 LEU A 282 -2.314 12.761 -1.617 1.00 0.00 H new ATOM 0 HG LEU A 282 -0.895 11.003 0.379 1.00 0.00 H new ATOM 0 HD11 LEU A 282 0.505 10.487 -1.589 1.00 0.00 H new ATOM 0 HD12 LEU A 282 -1.213 10.136 -1.893 1.00 0.00 H new ATOM 0 HD13 LEU A 282 -0.472 11.605 -2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 282 1.155 12.295 -0.043 1.00 0.00 H new ATOM 0 HD22 LEU A 282 0.211 13.485 -0.970 1.00 0.00 H new ATOM 0 HD23 LEU A 282 -0.088 13.274 0.771 1.00 0.00 H new ATOM 634 N ASP A 283 -4.915 13.835 -0.230 1.00 0.00 N ATOM 635 CA ASP A 283 -5.993 14.623 -0.813 1.00 0.00 C ATOM 636 C ASP A 283 -6.338 15.804 0.084 1.00 0.00 C ATOM 637 O ASP A 283 -7.028 16.731 -0.336 1.00 0.00 O ATOM 638 CB ASP A 283 -7.227 13.760 -1.079 1.00 0.00 C ATOM 639 CG ASP A 283 -7.156 13.045 -2.418 1.00 0.00 C ATOM 640 OD1 ASP A 283 -6.337 12.119 -2.572 1.00 0.00 O ATOM 641 OD2 ASP A 283 -7.934 13.405 -3.327 1.00 0.00 O ATOM 0 H ASP A 283 -5.199 12.925 0.133 1.00 0.00 H new ATOM 0 HA ASP A 283 -5.648 15.010 -1.772 1.00 0.00 H new ATOM 0 HB2 ASP A 283 -7.331 13.024 -0.282 1.00 0.00 H new ATOM 0 HB3 ASP A 283 -8.118 14.387 -1.052 1.00 0.00 H new ATOM 646 N ALA A 284 -5.845 15.767 1.319 1.00 0.00 N ATOM 647 CA ALA A 284 -5.963 16.902 2.223 1.00 0.00 C ATOM 648 C ALA A 284 -5.017 18.026 1.800 1.00 0.00 C ATOM 649 O ALA A 284 -5.150 19.168 2.244 1.00 0.00 O ATOM 650 CB ALA A 284 -5.667 16.474 3.651 1.00 0.00 C ATOM 0 H ALA A 284 -5.360 14.962 1.715 1.00 0.00 H new ATOM 0 HA ALA A 284 -6.986 17.275 2.175 1.00 0.00 H new ATOM 0 HB1 ALA A 284 -5.759 17.333 4.315 1.00 0.00 H new ATOM 0 HB2 ALA A 284 -6.376 15.703 3.954 1.00 0.00 H new ATOM 0 HB3 ALA A 284 -4.653 16.078 3.709 1.00 0.00 H new ATOM 656 N GLY A 285 -4.053 17.692 0.949 1.00 0.00 N ATOM 657 CA GLY A 285 -3.151 18.693 0.416 1.00 0.00 C ATOM 658 C GLY A 285 -1.790 18.693 1.091 1.00 0.00 C ATOM 659 O GLY A 285 -1.284 19.748 1.468 1.00 0.00 O ATOM 0 H GLY A 285 -3.881 16.742 0.619 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -3.019 18.522 -0.652 1.00 0.00 H new ATOM 0 HA3 GLY A 285 -3.605 19.678 0.528 1.00 0.00 H new ATOM 663 N HIS A 286 -1.194 17.517 1.241 1.00 0.00 N ATOM 664 CA HIS A 286 0.135 17.404 1.841 1.00 0.00 C ATOM 665 C HIS A 286 1.050 16.592 0.935 1.00 0.00 C ATOM 666 O HIS A 286 0.583 15.935 0.007 1.00 0.00 O ATOM 667 CB HIS A 286 0.062 16.760 3.230 1.00 0.00 C ATOM 668 CG HIS A 286 -0.825 17.491 4.198 1.00 0.00 C ATOM 669 ND1 HIS A 286 -0.716 18.836 4.483 1.00 0.00 N ATOM 670 CD2 HIS A 286 -1.860 17.035 4.947 1.00 0.00 C ATOM 671 CE1 HIS A 286 -1.661 19.145 5.381 1.00 0.00 C ATOM 672 NE2 HIS A 286 -2.384 18.087 5.693 1.00 0.00 N ATOM 0 H HIS A 286 -1.606 16.628 0.957 1.00 0.00 H new ATOM 0 HA HIS A 286 0.542 18.409 1.955 1.00 0.00 H new ATOM 0 HB2 HIS A 286 -0.298 15.736 3.126 1.00 0.00 H new ATOM 0 HB3 HIS A 286 1.068 16.704 3.646 1.00 0.00 H new ATOM 0 HD2 HIS A 286 -2.220 16.017 4.962 1.00 0.00 H new ATOM 0 HE1 HIS A 286 -1.811 20.131 5.795 1.00 0.00 H new ATOM 0 HE2 HIS A 286 -3.166 18.048 6.346 1.00 0.00 H new ATOM 680 N LYS A 287 2.353 16.631 1.201 1.00 0.00 N ATOM 681 CA LYS A 287 3.318 15.946 0.348 1.00 0.00 C ATOM 682 C LYS A 287 4.493 15.391 1.156 1.00 0.00 C ATOM 683 O LYS A 287 5.650 15.708 0.891 1.00 0.00 O ATOM 684 CB LYS A 287 3.818 16.895 -0.750 1.00 0.00 C ATOM 685 CG LYS A 287 4.399 18.201 -0.226 1.00 0.00 C ATOM 686 CD LYS A 287 4.771 19.145 -1.357 1.00 0.00 C ATOM 687 CE LYS A 287 5.844 18.554 -2.259 1.00 0.00 C ATOM 688 NZ LYS A 287 6.345 19.543 -3.250 1.00 0.00 N ATOM 0 H LYS A 287 2.762 17.126 1.994 1.00 0.00 H new ATOM 0 HA LYS A 287 2.813 15.099 -0.116 1.00 0.00 H new ATOM 0 HB2 LYS A 287 4.578 16.383 -1.340 1.00 0.00 H new ATOM 0 HB3 LYS A 287 2.991 17.122 -1.423 1.00 0.00 H new ATOM 0 HG2 LYS A 287 3.674 18.685 0.428 1.00 0.00 H new ATOM 0 HG3 LYS A 287 5.282 17.990 0.377 1.00 0.00 H new ATOM 0 HD2 LYS A 287 3.884 19.371 -1.948 1.00 0.00 H new ATOM 0 HD3 LYS A 287 5.125 20.088 -0.941 1.00 0.00 H new ATOM 0 HE2 LYS A 287 6.675 18.199 -1.649 1.00 0.00 H new ATOM 0 HE3 LYS A 287 5.440 17.688 -2.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 287 7.074 19.100 -3.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 287 5.558 19.863 -3.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 287 6.754 20.358 -2.750 1.00 0.00 H new ATOM 702 N THR A 288 4.197 14.553 2.135 1.00 0.00 N ATOM 703 CA THR A 288 5.235 13.933 2.953 1.00 0.00 C ATOM 704 C THR A 288 4.883 12.478 3.269 1.00 0.00 C ATOM 705 O THR A 288 3.756 12.189 3.658 1.00 0.00 O ATOM 706 CB THR A 288 5.425 14.702 4.276 1.00 0.00 C ATOM 707 OG1 THR A 288 4.149 15.118 4.784 1.00 0.00 O ATOM 708 CG2 THR A 288 6.329 15.913 4.088 1.00 0.00 C ATOM 0 H THR A 288 3.246 14.284 2.386 1.00 0.00 H new ATOM 0 HA THR A 288 6.163 13.964 2.381 1.00 0.00 H new ATOM 0 HB THR A 288 5.903 14.033 4.992 1.00 0.00 H new ATOM 0 HG1 THR A 288 4.275 15.605 5.625 1.00 0.00 H new ATOM 0 HG21 THR A 288 6.443 16.433 5.039 1.00 0.00 H new ATOM 0 HG22 THR A 288 7.307 15.586 3.734 1.00 0.00 H new ATOM 0 HG23 THR A 288 5.886 16.588 3.356 1.00 0.00 H new ATOM 716 N CYS A 289 5.839 11.567 3.082 1.00 0.00 N ATOM 717 CA CYS A 289 5.632 10.154 3.408 1.00 0.00 C ATOM 718 C CYS A 289 5.575 9.929 4.923 1.00 0.00 C ATOM 719 O CYS A 289 6.123 10.716 5.701 1.00 0.00 O ATOM 720 CB CYS A 289 6.737 9.292 2.791 1.00 0.00 C ATOM 721 SG CYS A 289 6.262 8.442 1.263 1.00 0.00 S ATOM 0 H CYS A 289 6.763 11.781 2.707 1.00 0.00 H new ATOM 0 HA CYS A 289 4.672 9.858 2.986 1.00 0.00 H new ATOM 0 HB2 CYS A 289 7.602 9.924 2.587 1.00 0.00 H new ATOM 0 HB3 CYS A 289 7.051 8.548 3.523 1.00 0.00 H new ATOM 0 HG CYS A 289 5.133 8.922 0.832 1.00 0.00 H new ATOM 727 N PRO A 290 4.924 8.831 5.358 1.00 0.00 N ATOM 728 CA PRO A 290 4.736 8.523 6.778 1.00 0.00 C ATOM 729 C PRO A 290 5.950 7.846 7.412 1.00 0.00 C ATOM 730 O PRO A 290 5.913 7.458 8.579 1.00 0.00 O ATOM 731 CB PRO A 290 3.544 7.570 6.761 1.00 0.00 C ATOM 732 CG PRO A 290 3.661 6.845 5.464 1.00 0.00 C ATOM 733 CD PRO A 290 4.305 7.803 4.493 1.00 0.00 C ATOM 0 HA PRO A 290 4.587 9.424 7.372 1.00 0.00 H new ATOM 0 HB2 PRO A 290 3.575 6.881 7.605 1.00 0.00 H new ATOM 0 HB3 PRO A 290 2.601 8.113 6.828 1.00 0.00 H new ATOM 0 HG2 PRO A 290 4.264 5.944 5.577 1.00 0.00 H new ATOM 0 HG3 PRO A 290 2.681 6.530 5.106 1.00 0.00 H new ATOM 0 HD2 PRO A 290 5.049 7.303 3.873 1.00 0.00 H new ATOM 0 HD3 PRO A 290 3.570 8.240 3.817 1.00 0.00 H new ATOM 741 N LYS A 291 7.022 7.701 6.643 1.00 0.00 N ATOM 742 CA LYS A 291 8.225 7.040 7.137 1.00 0.00 C ATOM 743 C LYS A 291 9.131 8.017 7.878 1.00 0.00 C ATOM 744 O LYS A 291 9.391 7.853 9.068 1.00 0.00 O ATOM 745 CB LYS A 291 9.007 6.377 5.995 1.00 0.00 C ATOM 746 CG LYS A 291 8.482 5.006 5.581 1.00 0.00 C ATOM 747 CD LYS A 291 7.233 5.101 4.720 1.00 0.00 C ATOM 748 CE LYS A 291 7.502 5.832 3.412 1.00 0.00 C ATOM 749 NZ LYS A 291 8.624 5.227 2.643 1.00 0.00 N ATOM 0 H LYS A 291 7.084 8.030 5.680 1.00 0.00 H new ATOM 0 HA LYS A 291 7.899 6.267 7.833 1.00 0.00 H new ATOM 0 HB2 LYS A 291 8.987 7.037 5.127 1.00 0.00 H new ATOM 0 HB3 LYS A 291 10.050 6.277 6.296 1.00 0.00 H new ATOM 0 HG2 LYS A 291 9.259 4.473 5.033 1.00 0.00 H new ATOM 0 HG3 LYS A 291 8.262 4.420 6.473 1.00 0.00 H new ATOM 0 HD2 LYS A 291 6.862 4.099 4.506 1.00 0.00 H new ATOM 0 HD3 LYS A 291 6.450 5.620 5.272 1.00 0.00 H new ATOM 0 HE2 LYS A 291 6.599 5.822 2.801 1.00 0.00 H new ATOM 0 HE3 LYS A 291 7.732 6.876 3.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 291 8.388 5.223 1.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 291 9.489 5.784 2.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 291 8.780 4.251 2.966 1.00 0.00 H new ATOM 763 N SER A 292 9.605 9.032 7.172 1.00 0.00 N ATOM 764 CA SER A 292 10.558 9.974 7.732 1.00 0.00 C ATOM 765 C SER A 292 10.273 11.378 7.201 1.00 0.00 C ATOM 766 O SER A 292 11.095 12.288 7.334 1.00 0.00 O ATOM 767 CB SER A 292 11.984 9.527 7.373 1.00 0.00 C ATOM 768 OG SER A 292 12.970 10.325 8.011 1.00 0.00 O ATOM 0 H SER A 292 9.343 9.224 6.205 1.00 0.00 H new ATOM 0 HA SER A 292 10.462 9.997 8.818 1.00 0.00 H new ATOM 0 HB2 SER A 292 12.120 8.485 7.661 1.00 0.00 H new ATOM 0 HB3 SER A 292 12.119 9.580 6.293 1.00 0.00 H new ATOM 0 HG SER A 292 12.709 11.268 7.963 1.00 0.00 H new ATOM 774 N GLN A 293 9.086 11.544 6.608 1.00 0.00 N ATOM 775 CA GLN A 293 8.680 12.816 6.022 1.00 0.00 C ATOM 776 C GLN A 293 9.627 13.176 4.886 1.00 0.00 C ATOM 777 O GLN A 293 10.039 14.327 4.734 1.00 0.00 O ATOM 778 CB GLN A 293 8.643 13.935 7.074 1.00 0.00 C ATOM 779 CG GLN A 293 7.529 13.793 8.108 1.00 0.00 C ATOM 780 CD GLN A 293 7.790 12.710 9.142 1.00 0.00 C ATOM 781 OE1 GLN A 293 8.429 12.953 10.165 1.00 0.00 O ATOM 782 NE2 GLN A 293 7.266 11.519 8.900 1.00 0.00 N ATOM 0 H GLN A 293 8.388 10.805 6.523 1.00 0.00 H new ATOM 0 HA GLN A 293 7.669 12.709 5.629 1.00 0.00 H new ATOM 0 HB2 GLN A 293 9.602 13.961 7.592 1.00 0.00 H new ATOM 0 HB3 GLN A 293 8.529 14.892 6.565 1.00 0.00 H new ATOM 0 HG2 GLN A 293 7.396 14.747 8.619 1.00 0.00 H new ATOM 0 HG3 GLN A 293 6.593 13.574 7.593 1.00 0.00 H new ATOM 0 HE21 GLN A 293 6.743 11.357 8.040 1.00 0.00 H new ATOM 0 HE22 GLN A 293 7.386 10.763 9.574 1.00 0.00 H new ATOM 791 N GLU A 294 9.929 12.166 4.075 1.00 0.00 N ATOM 792 CA GLU A 294 10.894 12.275 2.983 1.00 0.00 C ATOM 793 C GLU A 294 10.492 13.332 1.954 1.00 0.00 C ATOM 794 O GLU A 294 11.293 13.700 1.096 1.00 0.00 O ATOM 795 CB GLU A 294 11.060 10.918 2.291 1.00 0.00 C ATOM 796 CG GLU A 294 11.309 9.756 3.246 1.00 0.00 C ATOM 797 CD GLU A 294 10.030 9.073 3.700 1.00 0.00 C ATOM 798 OE1 GLU A 294 9.317 9.630 4.563 1.00 0.00 O ATOM 799 OE2 GLU A 294 9.735 7.968 3.202 1.00 0.00 O ATOM 0 H GLU A 294 9.508 11.241 4.157 1.00 0.00 H new ATOM 0 HA GLU A 294 11.842 12.588 3.422 1.00 0.00 H new ATOM 0 HB2 GLU A 294 10.164 10.708 1.707 1.00 0.00 H new ATOM 0 HB3 GLU A 294 11.891 10.980 1.588 1.00 0.00 H new ATOM 0 HG2 GLU A 294 11.951 9.023 2.757 1.00 0.00 H new ATOM 0 HG3 GLU A 294 11.849 10.121 4.120 1.00 0.00 H new ATOM 806 N THR A 295 9.255 13.816 2.065 1.00 0.00 N ATOM 807 CA THR A 295 8.721 14.839 1.174 1.00 0.00 C ATOM 808 C THR A 295 8.503 14.286 -0.229 1.00 0.00 C ATOM 809 O THR A 295 9.446 13.923 -0.928 1.00 0.00 O ATOM 810 CB THR A 295 9.635 16.076 1.103 1.00 0.00 C ATOM 811 OG1 THR A 295 10.012 16.480 2.426 1.00 0.00 O ATOM 812 CG2 THR A 295 8.933 17.229 0.400 1.00 0.00 C ATOM 0 H THR A 295 8.595 13.507 2.779 1.00 0.00 H new ATOM 0 HA THR A 295 7.762 15.146 1.592 1.00 0.00 H new ATOM 0 HB THR A 295 10.525 15.811 0.533 1.00 0.00 H new ATOM 0 HG1 THR A 295 10.595 17.266 2.374 1.00 0.00 H new ATOM 0 HG21 THR A 295 9.599 18.091 0.362 1.00 0.00 H new ATOM 0 HG22 THR A 295 8.669 16.930 -0.614 1.00 0.00 H new ATOM 0 HG23 THR A 295 8.028 17.493 0.948 1.00 0.00 H new ATOM 820 N LEU A 296 7.253 14.234 -0.639 1.00 0.00 N ATOM 821 CA LEU A 296 6.910 13.671 -1.925 1.00 0.00 C ATOM 822 C LEU A 296 7.074 14.727 -3.005 1.00 0.00 C ATOM 823 O LEU A 296 6.115 15.405 -3.374 1.00 0.00 O ATOM 824 CB LEU A 296 5.475 13.129 -1.919 1.00 0.00 C ATOM 825 CG LEU A 296 5.027 12.475 -0.606 1.00 0.00 C ATOM 826 CD1 LEU A 296 3.606 11.949 -0.721 1.00 0.00 C ATOM 827 CD2 LEU A 296 5.976 11.357 -0.206 1.00 0.00 C ATOM 0 H LEU A 296 6.458 14.575 -0.099 1.00 0.00 H new ATOM 0 HA LEU A 296 7.582 12.838 -2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 296 4.794 13.948 -2.149 1.00 0.00 H new ATOM 0 HB3 LEU A 296 5.377 12.398 -2.722 1.00 0.00 H new ATOM 0 HG LEU A 296 5.049 13.238 0.172 1.00 0.00 H new ATOM 0 HD11 LEU A 296 3.311 11.490 0.222 1.00 0.00 H new ATOM 0 HD12 LEU A 296 2.930 12.773 -0.951 1.00 0.00 H new ATOM 0 HD13 LEU A 296 3.556 11.206 -1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 296 5.637 10.909 0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 296 5.993 10.597 -0.988 1.00 0.00 H new ATOM 0 HD23 LEU A 296 6.979 11.762 -0.071 1.00 0.00 H new ATOM 839 N LEU A 297 8.311 14.907 -3.452 1.00 0.00 N ATOM 840 CA LEU A 297 8.601 15.804 -4.560 1.00 0.00 C ATOM 841 C LEU A 297 7.829 15.350 -5.788 1.00 0.00 C ATOM 842 O LEU A 297 8.072 14.259 -6.305 1.00 0.00 O ATOM 843 CB LEU A 297 10.106 15.847 -4.854 1.00 0.00 C ATOM 844 CG LEU A 297 10.926 16.820 -3.995 1.00 0.00 C ATOM 845 CD1 LEU A 297 10.962 16.377 -2.542 1.00 0.00 C ATOM 846 CD2 LEU A 297 12.338 16.943 -4.545 1.00 0.00 C ATOM 0 H LEU A 297 9.130 14.441 -3.062 1.00 0.00 H new ATOM 0 HA LEU A 297 8.290 16.813 -4.289 1.00 0.00 H new ATOM 0 HB2 LEU A 297 10.512 14.844 -4.722 1.00 0.00 H new ATOM 0 HB3 LEU A 297 10.245 16.111 -5.902 1.00 0.00 H new ATOM 0 HG LEU A 297 10.442 17.796 -4.035 1.00 0.00 H new ATOM 0 HD11 LEU A 297 11.550 17.086 -1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 297 9.946 16.338 -2.148 1.00 0.00 H new ATOM 0 HD13 LEU A 297 11.415 15.388 -2.474 1.00 0.00 H new ATOM 0 HD21 LEU A 297 12.910 17.636 -3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 297 12.819 15.965 -4.534 1.00 0.00 H new ATOM 0 HD23 LEU A 297 12.299 17.317 -5.568 1.00 0.00 H new ATOM 858 N HIS A 298 6.910 16.201 -6.240 1.00 0.00 N ATOM 859 CA HIS A 298 5.910 15.836 -7.240 1.00 0.00 C ATOM 860 C HIS A 298 4.889 14.881 -6.627 1.00 0.00 C ATOM 861 O HIS A 298 4.959 13.665 -6.818 1.00 0.00 O ATOM 862 CB HIS A 298 6.536 15.204 -8.494 1.00 0.00 C ATOM 863 CG HIS A 298 7.276 16.165 -9.371 1.00 0.00 C ATOM 864 ND1 HIS A 298 6.843 16.541 -10.620 1.00 0.00 N ATOM 865 CD2 HIS A 298 8.452 16.813 -9.172 1.00 0.00 C ATOM 866 CE1 HIS A 298 7.741 17.385 -11.133 1.00 0.00 C ATOM 867 NE2 HIS A 298 8.741 17.588 -10.295 1.00 0.00 N ATOM 0 H HIS A 298 6.838 17.167 -5.921 1.00 0.00 H new ATOM 0 HA HIS A 298 5.416 16.755 -7.556 1.00 0.00 H new ATOM 0 HB2 HIS A 298 7.220 14.414 -8.184 1.00 0.00 H new ATOM 0 HB3 HIS A 298 5.747 14.731 -9.079 1.00 0.00 H new ATOM 0 HD2 HIS A 298 9.065 16.740 -8.286 1.00 0.00 H new ATOM 0 HE1 HIS A 298 7.660 17.843 -12.108 1.00 0.00 H new ATOM 0 HE2 HIS A 298 9.554 18.186 -10.439 1.00 0.00 H new ATOM 875 N ALA A 299 3.958 15.434 -5.859 1.00 0.00 N ATOM 876 CA ALA A 299 2.923 14.630 -5.231 1.00 0.00 C ATOM 877 C ALA A 299 1.837 14.281 -6.238 1.00 0.00 C ATOM 878 O ALA A 299 0.904 15.053 -6.467 1.00 0.00 O ATOM 879 CB ALA A 299 2.331 15.345 -4.020 1.00 0.00 C ATOM 0 H ALA A 299 3.900 16.432 -5.658 1.00 0.00 H new ATOM 0 HA ALA A 299 3.378 13.704 -4.880 1.00 0.00 H new ATOM 0 HB1 ALA A 299 1.559 14.720 -3.570 1.00 0.00 H new ATOM 0 HB2 ALA A 299 3.117 15.534 -3.289 1.00 0.00 H new ATOM 0 HB3 ALA A 299 1.893 16.292 -4.335 1.00 0.00 H new ATOM 885 N GLY A 300 1.993 13.129 -6.857 1.00 0.00 N ATOM 886 CA GLY A 300 1.009 12.624 -7.784 1.00 0.00 C ATOM 887 C GLY A 300 0.915 11.125 -7.683 1.00 0.00 C ATOM 888 O GLY A 300 1.932 10.454 -7.503 1.00 0.00 O ATOM 0 H GLY A 300 2.802 12.521 -6.731 1.00 0.00 H new ATOM 0 HA2 GLY A 300 0.038 13.071 -7.573 1.00 0.00 H new ATOM 0 HA3 GLY A 300 1.277 12.910 -8.801 1.00 0.00 H new ATOM 892 N LEU A 301 -0.289 10.592 -7.779 1.00 0.00 N ATOM 893 CA LEU A 301 -0.489 9.172 -7.570 1.00 0.00 C ATOM 894 C LEU A 301 -0.387 8.392 -8.872 1.00 0.00 C ATOM 895 O LEU A 301 -1.019 8.719 -9.874 1.00 0.00 O ATOM 896 CB LEU A 301 -1.830 8.894 -6.887 1.00 0.00 C ATOM 897 CG LEU A 301 -1.910 9.295 -5.410 1.00 0.00 C ATOM 898 CD1 LEU A 301 -2.053 10.800 -5.248 1.00 0.00 C ATOM 899 CD2 LEU A 301 -3.055 8.575 -4.728 1.00 0.00 C ATOM 0 H LEU A 301 -1.136 11.116 -7.998 1.00 0.00 H new ATOM 0 HA LEU A 301 0.310 8.832 -6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -2.613 9.422 -7.432 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -2.047 7.829 -6.969 1.00 0.00 H new ATOM 0 HG LEU A 301 -0.976 8.999 -4.933 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -2.107 11.048 -4.188 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -1.192 11.297 -5.694 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -2.963 11.135 -5.746 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.098 8.871 -3.680 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -3.993 8.837 -5.218 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -2.899 7.498 -4.795 1.00 0.00 H new ATOM 911 N THR A 302 0.435 7.365 -8.829 1.00 0.00 N ATOM 912 CA THR A 302 0.641 6.462 -9.940 1.00 0.00 C ATOM 913 C THR A 302 0.273 5.041 -9.519 1.00 0.00 C ATOM 914 O THR A 302 0.928 4.456 -8.658 1.00 0.00 O ATOM 915 CB THR A 302 2.115 6.516 -10.394 1.00 0.00 C ATOM 916 OG1 THR A 302 2.388 7.787 -11.001 1.00 0.00 O ATOM 917 CG2 THR A 302 2.451 5.399 -11.369 1.00 0.00 C ATOM 0 H THR A 302 0.989 7.131 -8.005 1.00 0.00 H new ATOM 0 HA THR A 302 0.006 6.763 -10.773 1.00 0.00 H new ATOM 0 HB THR A 302 2.739 6.383 -9.510 1.00 0.00 H new ATOM 0 HG1 THR A 302 3.325 7.819 -11.287 1.00 0.00 H new ATOM 0 HG21 THR A 302 3.498 5.475 -11.663 1.00 0.00 H new ATOM 0 HG22 THR A 302 2.277 4.435 -10.892 1.00 0.00 H new ATOM 0 HG23 THR A 302 1.819 5.485 -12.253 1.00 0.00 H new ATOM 925 N PRO A 303 -0.804 4.481 -10.086 1.00 0.00 N ATOM 926 CA PRO A 303 -1.265 3.131 -9.743 1.00 0.00 C ATOM 927 C PRO A 303 -0.178 2.076 -9.939 1.00 0.00 C ATOM 928 O PRO A 303 0.466 2.017 -10.986 1.00 0.00 O ATOM 929 CB PRO A 303 -2.433 2.892 -10.705 1.00 0.00 C ATOM 930 CG PRO A 303 -2.892 4.253 -11.101 1.00 0.00 C ATOM 931 CD PRO A 303 -1.664 5.120 -11.096 1.00 0.00 C ATOM 0 HA PRO A 303 -1.545 3.053 -8.692 1.00 0.00 H new ATOM 0 HB2 PRO A 303 -2.117 2.314 -11.573 1.00 0.00 H new ATOM 0 HB3 PRO A 303 -3.233 2.331 -10.222 1.00 0.00 H new ATOM 0 HG2 PRO A 303 -3.355 4.237 -12.088 1.00 0.00 H new ATOM 0 HG3 PRO A 303 -3.640 4.631 -10.404 1.00 0.00 H new ATOM 0 HD2 PRO A 303 -1.185 5.145 -12.075 1.00 0.00 H new ATOM 0 HD3 PRO A 303 -1.900 6.150 -10.830 1.00 0.00 H new ATOM 939 N ASN A 304 0.014 1.243 -8.927 1.00 0.00 N ATOM 940 CA ASN A 304 1.091 0.260 -8.940 1.00 0.00 C ATOM 941 C ASN A 304 0.556 -1.156 -9.109 1.00 0.00 C ATOM 942 O ASN A 304 -0.250 -1.631 -8.309 1.00 0.00 O ATOM 943 CB ASN A 304 1.906 0.357 -7.657 1.00 0.00 C ATOM 944 CG ASN A 304 2.912 -0.766 -7.534 1.00 0.00 C ATOM 945 OD1 ASN A 304 2.612 -1.816 -6.972 1.00 0.00 O ATOM 946 ND2 ASN A 304 4.107 -0.557 -8.065 1.00 0.00 N ATOM 0 H ASN A 304 -0.562 1.227 -8.085 1.00 0.00 H new ATOM 0 HA ASN A 304 1.731 0.481 -9.794 1.00 0.00 H new ATOM 0 HB2 ASN A 304 2.427 1.314 -7.631 1.00 0.00 H new ATOM 0 HB3 ASN A 304 1.234 0.336 -6.799 1.00 0.00 H new ATOM 0 HD21 ASN A 304 4.821 -1.284 -8.016 1.00 0.00 H new ATOM 0 HD22 ASN A 304 4.313 0.331 -8.523 1.00 0.00 H new ATOM 953 N TYR A 305 1.021 -1.828 -10.152 1.00 0.00 N ATOM 954 CA TYR A 305 0.530 -3.156 -10.486 1.00 0.00 C ATOM 955 C TYR A 305 1.333 -4.277 -9.818 1.00 0.00 C ATOM 956 O TYR A 305 0.802 -5.367 -9.616 1.00 0.00 O ATOM 957 CB TYR A 305 0.506 -3.333 -12.002 1.00 0.00 C ATOM 958 CG TYR A 305 -0.342 -2.286 -12.683 1.00 0.00 C ATOM 959 CD1 TYR A 305 -1.717 -2.265 -12.503 1.00 0.00 C ATOM 960 CD2 TYR A 305 0.231 -1.302 -13.475 1.00 0.00 C ATOM 961 CE1 TYR A 305 -2.501 -1.295 -13.094 1.00 0.00 C ATOM 962 CE2 TYR A 305 -0.545 -0.322 -14.066 1.00 0.00 C ATOM 963 CZ TYR A 305 -1.912 -0.325 -13.875 1.00 0.00 C ATOM 964 OH TYR A 305 -2.689 0.654 -14.452 1.00 0.00 O ATOM 0 H TYR A 305 1.740 -1.474 -10.783 1.00 0.00 H new ATOM 0 HA TYR A 305 -0.484 -3.234 -10.093 1.00 0.00 H new ATOM 0 HB2 TYR A 305 1.524 -3.282 -12.389 1.00 0.00 H new ATOM 0 HB3 TYR A 305 0.122 -4.324 -12.245 1.00 0.00 H new ATOM 0 HD1 TYR A 305 -2.183 -3.022 -11.889 1.00 0.00 H new ATOM 0 HD2 TYR A 305 1.299 -1.301 -13.632 1.00 0.00 H new ATOM 0 HE1 TYR A 305 -3.571 -1.296 -12.945 1.00 0.00 H new ATOM 0 HE2 TYR A 305 -0.084 0.442 -14.674 1.00 0.00 H new ATOM 0 HH TYR A 305 -2.120 1.261 -14.970 1.00 0.00 H new ATOM 974 N VAL A 306 2.601 -4.018 -9.467 1.00 0.00 N ATOM 975 CA VAL A 306 3.442 -5.055 -8.853 1.00 0.00 C ATOM 976 C VAL A 306 2.818 -5.537 -7.549 1.00 0.00 C ATOM 977 O VAL A 306 2.875 -6.718 -7.211 1.00 0.00 O ATOM 978 CB VAL A 306 4.901 -4.579 -8.577 1.00 0.00 C ATOM 979 CG1 VAL A 306 4.977 -3.586 -7.421 1.00 0.00 C ATOM 980 CG2 VAL A 306 5.804 -5.772 -8.299 1.00 0.00 C ATOM 0 H VAL A 306 3.060 -3.116 -9.595 1.00 0.00 H new ATOM 0 HA VAL A 306 3.496 -5.870 -9.575 1.00 0.00 H new ATOM 0 HB VAL A 306 5.245 -4.064 -9.474 1.00 0.00 H new ATOM 0 HG11 VAL A 306 6.013 -3.284 -7.268 1.00 0.00 H new ATOM 0 HG12 VAL A 306 4.374 -2.708 -7.655 1.00 0.00 H new ATOM 0 HG13 VAL A 306 4.598 -4.055 -6.513 1.00 0.00 H new ATOM 0 HG21 VAL A 306 6.819 -5.423 -8.108 1.00 0.00 H new ATOM 0 HG22 VAL A 306 5.436 -6.312 -7.426 1.00 0.00 H new ATOM 0 HG23 VAL A 306 5.805 -6.437 -9.163 1.00 0.00 H new ATOM 990 N LEU A 307 2.203 -4.608 -6.839 1.00 0.00 N ATOM 991 CA LEU A 307 1.578 -4.901 -5.572 1.00 0.00 C ATOM 992 C LEU A 307 0.182 -5.468 -5.792 1.00 0.00 C ATOM 993 O LEU A 307 -0.186 -6.473 -5.193 1.00 0.00 O ATOM 994 CB LEU A 307 1.505 -3.620 -4.745 1.00 0.00 C ATOM 995 CG LEU A 307 1.287 -3.811 -3.251 1.00 0.00 C ATOM 996 CD1 LEU A 307 2.452 -4.563 -2.645 1.00 0.00 C ATOM 997 CD2 LEU A 307 1.112 -2.470 -2.566 1.00 0.00 C ATOM 0 H LEU A 307 2.126 -3.633 -7.128 1.00 0.00 H new ATOM 0 HA LEU A 307 2.168 -5.645 -5.038 1.00 0.00 H new ATOM 0 HB2 LEU A 307 2.430 -3.062 -4.890 1.00 0.00 H new ATOM 0 HB3 LEU A 307 0.696 -3.003 -5.136 1.00 0.00 H new ATOM 0 HG LEU A 307 0.379 -4.395 -3.104 1.00 0.00 H new ATOM 0 HD11 LEU A 307 2.284 -4.693 -1.576 1.00 0.00 H new ATOM 0 HD12 LEU A 307 2.541 -5.540 -3.120 1.00 0.00 H new ATOM 0 HD13 LEU A 307 3.371 -3.998 -2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 307 0.957 -2.624 -1.498 1.00 0.00 H new ATOM 0 HD22 LEU A 307 2.005 -1.864 -2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 307 0.248 -1.956 -2.987 1.00 0.00 H new ATOM 1009 N LYS A 308 -0.565 -4.824 -6.690 1.00 0.00 N ATOM 1010 CA LYS A 308 -1.951 -5.143 -6.973 1.00 0.00 C ATOM 1011 C LYS A 308 -2.157 -6.641 -7.193 1.00 0.00 C ATOM 1012 O LYS A 308 -2.973 -7.261 -6.521 1.00 0.00 O ATOM 1013 CB LYS A 308 -2.379 -4.343 -8.209 1.00 0.00 C ATOM 1014 CG LYS A 308 -3.857 -4.018 -8.262 1.00 0.00 C ATOM 1015 CD LYS A 308 -4.685 -5.225 -8.638 1.00 0.00 C ATOM 1016 CE LYS A 308 -6.149 -4.990 -8.342 1.00 0.00 C ATOM 1017 NZ LYS A 308 -6.708 -3.849 -9.118 1.00 0.00 N ATOM 0 H LYS A 308 -0.208 -4.050 -7.250 1.00 0.00 H new ATOM 0 HA LYS A 308 -2.567 -4.872 -6.115 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -1.813 -3.412 -8.238 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -2.111 -4.907 -9.103 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -4.181 -3.643 -7.291 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -4.028 -3.221 -8.985 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -4.555 -5.444 -9.698 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -4.334 -6.097 -8.087 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -6.713 -5.894 -8.572 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -6.275 -4.798 -7.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -7.726 -3.998 -9.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -6.563 -2.965 -8.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -6.226 -3.785 -10.037 1.00 0.00 H new ATOM 1031 N SER A 309 -1.400 -7.223 -8.113 1.00 0.00 N ATOM 1032 CA SER A 309 -1.574 -8.627 -8.471 1.00 0.00 C ATOM 1033 C SER A 309 -1.221 -9.569 -7.312 1.00 0.00 C ATOM 1034 O SER A 309 -1.668 -10.714 -7.279 1.00 0.00 O ATOM 1035 CB SER A 309 -0.720 -8.955 -9.697 1.00 0.00 C ATOM 1036 OG SER A 309 -1.002 -8.061 -10.762 1.00 0.00 O ATOM 0 H SER A 309 -0.659 -6.746 -8.626 1.00 0.00 H new ATOM 0 HA SER A 309 -2.628 -8.782 -8.702 1.00 0.00 H new ATOM 0 HB2 SER A 309 0.337 -8.895 -9.436 1.00 0.00 H new ATOM 0 HB3 SER A 309 -0.912 -9.979 -10.016 1.00 0.00 H new ATOM 0 HG SER A 309 -0.444 -8.287 -11.535 1.00 0.00 H new ATOM 1042 N LEU A 310 -0.435 -9.085 -6.359 1.00 0.00 N ATOM 1043 CA LEU A 310 0.003 -9.913 -5.242 1.00 0.00 C ATOM 1044 C LEU A 310 -0.918 -9.744 -4.036 1.00 0.00 C ATOM 1045 O LEU A 310 -1.282 -10.715 -3.376 1.00 0.00 O ATOM 1046 CB LEU A 310 1.449 -9.574 -4.868 1.00 0.00 C ATOM 1047 CG LEU A 310 2.478 -9.836 -5.972 1.00 0.00 C ATOM 1048 CD1 LEU A 310 3.863 -9.407 -5.524 1.00 0.00 C ATOM 1049 CD2 LEU A 310 2.480 -11.308 -6.356 1.00 0.00 C ATOM 0 H LEU A 310 -0.088 -8.126 -6.337 1.00 0.00 H new ATOM 0 HA LEU A 310 -0.044 -10.957 -5.553 1.00 0.00 H new ATOM 0 HB2 LEU A 310 1.499 -8.522 -4.587 1.00 0.00 H new ATOM 0 HB3 LEU A 310 1.727 -10.153 -3.987 1.00 0.00 H new ATOM 0 HG LEU A 310 2.201 -9.247 -6.846 1.00 0.00 H new ATOM 0 HD11 LEU A 310 4.580 -9.601 -6.322 1.00 0.00 H new ATOM 0 HD12 LEU A 310 3.857 -8.342 -5.293 1.00 0.00 H new ATOM 0 HD13 LEU A 310 4.148 -9.970 -4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 310 3.216 -11.478 -7.142 1.00 0.00 H new ATOM 0 HD22 LEU A 310 2.734 -11.911 -5.484 1.00 0.00 H new ATOM 0 HD23 LEU A 310 1.492 -11.591 -6.718 1.00 0.00 H new ATOM 1061 N ILE A 311 -1.307 -8.512 -3.763 1.00 0.00 N ATOM 1062 CA ILE A 311 -2.180 -8.215 -2.633 1.00 0.00 C ATOM 1063 C ILE A 311 -3.605 -8.686 -2.895 1.00 0.00 C ATOM 1064 O ILE A 311 -4.304 -9.132 -1.981 1.00 0.00 O ATOM 1065 CB ILE A 311 -2.199 -6.704 -2.332 1.00 0.00 C ATOM 1066 CG1 ILE A 311 -2.596 -5.922 -3.589 1.00 0.00 C ATOM 1067 CG2 ILE A 311 -0.846 -6.245 -1.813 1.00 0.00 C ATOM 1068 CD1 ILE A 311 -2.426 -4.427 -3.464 1.00 0.00 C ATOM 0 H ILE A 311 -1.033 -7.695 -4.309 1.00 0.00 H new ATOM 0 HA ILE A 311 -1.780 -8.751 -1.772 1.00 0.00 H new ATOM 0 HB ILE A 311 -2.940 -6.510 -1.556 1.00 0.00 H new ATOM 0 HG12 ILE A 311 -1.997 -6.276 -4.428 1.00 0.00 H new ATOM 0 HG13 ILE A 311 -3.637 -6.140 -3.826 1.00 0.00 H new ATOM 0 HG21 ILE A 311 -0.879 -5.175 -1.606 1.00 0.00 H new ATOM 0 HG22 ILE A 311 -0.606 -6.784 -0.897 1.00 0.00 H new ATOM 0 HG23 ILE A 311 -0.081 -6.446 -2.563 1.00 0.00 H new ATOM 0 HD11 ILE A 311 -2.728 -3.947 -4.395 1.00 0.00 H new ATOM 0 HD12 ILE A 311 -3.046 -4.057 -2.647 1.00 0.00 H new ATOM 0 HD13 ILE A 311 -1.381 -4.196 -3.259 1.00 0.00 H new ATOM 1080 N ALA A 312 -4.018 -8.616 -4.156 1.00 0.00 N ATOM 1081 CA ALA A 312 -5.388 -8.922 -4.539 1.00 0.00 C ATOM 1082 C ALA A 312 -5.707 -10.407 -4.384 1.00 0.00 C ATOM 1083 O ALA A 312 -6.872 -10.801 -4.388 1.00 0.00 O ATOM 1084 CB ALA A 312 -5.642 -8.464 -5.969 1.00 0.00 C ATOM 0 H ALA A 312 -3.416 -8.348 -4.935 1.00 0.00 H new ATOM 0 HA ALA A 312 -6.052 -8.380 -3.865 1.00 0.00 H new ATOM 0 HB1 ALA A 312 -6.670 -8.697 -6.248 1.00 0.00 H new ATOM 0 HB2 ALA A 312 -5.481 -7.388 -6.041 1.00 0.00 H new ATOM 0 HB3 ALA A 312 -4.957 -8.979 -6.643 1.00 0.00 H new ATOM 1090 N LEU A 313 -4.673 -11.230 -4.243 1.00 0.00 N ATOM 1091 CA LEU A 313 -4.879 -12.657 -4.048 1.00 0.00 C ATOM 1092 C LEU A 313 -4.870 -13.009 -2.563 1.00 0.00 C ATOM 1093 O LEU A 313 -5.496 -13.982 -2.147 1.00 0.00 O ATOM 1094 CB LEU A 313 -3.829 -13.480 -4.822 1.00 0.00 C ATOM 1095 CG LEU A 313 -2.353 -13.229 -4.468 1.00 0.00 C ATOM 1096 CD1 LEU A 313 -1.941 -13.992 -3.213 1.00 0.00 C ATOM 1097 CD2 LEU A 313 -1.454 -13.611 -5.636 1.00 0.00 C ATOM 0 H LEU A 313 -3.696 -10.937 -4.260 1.00 0.00 H new ATOM 0 HA LEU A 313 -5.860 -12.914 -4.447 1.00 0.00 H new ATOM 0 HB2 LEU A 313 -4.041 -14.537 -4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 313 -3.961 -13.285 -5.886 1.00 0.00 H new ATOM 0 HG LEU A 313 -2.238 -12.164 -4.265 1.00 0.00 H new ATOM 0 HD11 LEU A 313 -0.893 -13.791 -2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 313 -2.556 -13.670 -2.373 1.00 0.00 H new ATOM 0 HD13 LEU A 313 -2.079 -15.061 -3.375 1.00 0.00 H new ATOM 0 HD21 LEU A 313 -0.413 -13.427 -5.369 1.00 0.00 H new ATOM 0 HD22 LEU A 313 -1.588 -14.668 -5.868 1.00 0.00 H new ATOM 0 HD23 LEU A 313 -1.716 -13.012 -6.508 1.00 0.00 H new ATOM 1109 N TRP A 314 -4.180 -12.204 -1.759 1.00 0.00 N ATOM 1110 CA TRP A 314 -4.039 -12.507 -0.343 1.00 0.00 C ATOM 1111 C TRP A 314 -5.261 -12.030 0.427 1.00 0.00 C ATOM 1112 O TRP A 314 -5.835 -12.776 1.225 1.00 0.00 O ATOM 1113 CB TRP A 314 -2.770 -11.872 0.232 1.00 0.00 C ATOM 1114 CG TRP A 314 -2.236 -12.612 1.425 1.00 0.00 C ATOM 1115 CD1 TRP A 314 -1.168 -13.462 1.443 1.00 0.00 C ATOM 1116 CD2 TRP A 314 -2.749 -12.588 2.764 1.00 0.00 C ATOM 1117 NE1 TRP A 314 -0.983 -13.965 2.708 1.00 0.00 N ATOM 1118 CE2 TRP A 314 -1.941 -13.443 3.536 1.00 0.00 C ATOM 1119 CE3 TRP A 314 -3.810 -11.927 3.384 1.00 0.00 C ATOM 1120 CZ2 TRP A 314 -2.163 -13.652 4.896 1.00 0.00 C ATOM 1121 CZ3 TRP A 314 -4.030 -12.133 4.731 1.00 0.00 C ATOM 1122 CH2 TRP A 314 -3.211 -12.990 5.474 1.00 0.00 C ATOM 0 H TRP A 314 -3.716 -11.348 -2.062 1.00 0.00 H new ATOM 0 HA TRP A 314 -3.956 -13.589 -0.237 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -2.003 -11.839 -0.542 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -2.982 -10.841 0.515 1.00 0.00 H new ATOM 0 HD1 TRP A 314 -0.557 -13.704 0.586 1.00 0.00 H new ATOM 0 HE1 TRP A 314 -0.252 -14.620 2.985 1.00 0.00 H new ATOM 0 HE3 TRP A 314 -4.449 -11.265 2.819 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -1.531 -14.312 5.472 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 -4.848 -11.624 5.219 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -3.410 -13.132 6.526 1.00 0.00 H new ATOM 1133 N CYS A 315 -5.671 -10.791 0.174 1.00 0.00 N ATOM 1134 CA CYS A 315 -6.850 -10.229 0.826 1.00 0.00 C ATOM 1135 C CYS A 315 -8.077 -11.076 0.498 1.00 0.00 C ATOM 1136 O CYS A 315 -8.947 -11.290 1.339 1.00 0.00 O ATOM 1137 CB CYS A 315 -7.062 -8.777 0.382 1.00 0.00 C ATOM 1138 SG CYS A 315 -7.175 -8.567 -1.409 1.00 0.00 S ATOM 0 H CYS A 315 -5.206 -10.158 -0.476 1.00 0.00 H new ATOM 0 HA CYS A 315 -6.698 -10.237 1.905 1.00 0.00 H new ATOM 0 HB2 CYS A 315 -7.975 -8.397 0.841 1.00 0.00 H new ATOM 0 HB3 CYS A 315 -6.239 -8.169 0.758 1.00 0.00 H new ATOM 0 HG CYS A 315 -6.104 -9.045 -1.970 1.00 0.00 H new ATOM 1144 N GLU A 316 -8.109 -11.568 -0.735 1.00 0.00 N ATOM 1145 CA GLU A 316 -9.162 -12.456 -1.210 1.00 0.00 C ATOM 1146 C GLU A 316 -9.107 -13.813 -0.502 1.00 0.00 C ATOM 1147 O GLU A 316 -10.142 -14.394 -0.167 1.00 0.00 O ATOM 1148 CB GLU A 316 -9.008 -12.625 -2.728 1.00 0.00 C ATOM 1149 CG GLU A 316 -9.823 -13.758 -3.326 1.00 0.00 C ATOM 1150 CD GLU A 316 -9.767 -13.773 -4.840 1.00 0.00 C ATOM 1151 OE1 GLU A 316 -8.818 -14.350 -5.406 1.00 0.00 O ATOM 1152 OE2 GLU A 316 -10.675 -13.197 -5.476 1.00 0.00 O ATOM 0 H GLU A 316 -7.400 -11.360 -1.438 1.00 0.00 H new ATOM 0 HA GLU A 316 -10.134 -12.018 -0.983 1.00 0.00 H new ATOM 0 HB2 GLU A 316 -9.295 -11.693 -3.215 1.00 0.00 H new ATOM 0 HB3 GLU A 316 -7.955 -12.793 -2.956 1.00 0.00 H new ATOM 0 HG2 GLU A 316 -9.454 -14.709 -2.942 1.00 0.00 H new ATOM 0 HG3 GLU A 316 -10.860 -13.665 -3.004 1.00 0.00 H new ATOM 1159 N SER A 317 -7.898 -14.298 -0.262 1.00 0.00 N ATOM 1160 CA SER A 317 -7.693 -15.610 0.336 1.00 0.00 C ATOM 1161 C SER A 317 -8.173 -15.640 1.787 1.00 0.00 C ATOM 1162 O SER A 317 -8.712 -16.647 2.254 1.00 0.00 O ATOM 1163 CB SER A 317 -6.206 -15.980 0.263 1.00 0.00 C ATOM 1164 OG SER A 317 -5.983 -17.341 0.593 1.00 0.00 O ATOM 0 H SER A 317 -7.035 -13.797 -0.475 1.00 0.00 H new ATOM 0 HA SER A 317 -8.279 -16.339 -0.223 1.00 0.00 H new ATOM 0 HB2 SER A 317 -5.832 -15.784 -0.742 1.00 0.00 H new ATOM 0 HB3 SER A 317 -5.640 -15.344 0.943 1.00 0.00 H new ATOM 0 HG SER A 317 -5.025 -17.539 0.534 1.00 0.00 H new ATOM 1170 N ASN A 318 -7.986 -14.541 2.503 1.00 0.00 N ATOM 1171 CA ASN A 318 -8.300 -14.511 3.927 1.00 0.00 C ATOM 1172 C ASN A 318 -9.533 -13.662 4.230 1.00 0.00 C ATOM 1173 O ASN A 318 -10.557 -14.174 4.689 1.00 0.00 O ATOM 1174 CB ASN A 318 -7.105 -13.981 4.728 1.00 0.00 C ATOM 1175 CG ASN A 318 -7.340 -14.042 6.229 1.00 0.00 C ATOM 1176 OD1 ASN A 318 -8.035 -14.927 6.727 1.00 0.00 O ATOM 1177 ND2 ASN A 318 -6.759 -13.104 6.962 1.00 0.00 N ATOM 0 H ASN A 318 -7.622 -13.665 2.128 1.00 0.00 H new ATOM 0 HA ASN A 318 -8.518 -15.537 4.224 1.00 0.00 H new ATOM 0 HB2 ASN A 318 -6.217 -14.562 4.478 1.00 0.00 H new ATOM 0 HB3 ASN A 318 -6.904 -12.950 4.436 1.00 0.00 H new ATOM 0 HD21 ASN A 318 -6.881 -13.100 7.975 1.00 0.00 H new ATOM 0 HD22 ASN A 318 -6.190 -12.386 6.514 1.00 0.00 H new ATOM 1184 N GLY A 319 -9.440 -12.373 3.944 1.00 0.00 N ATOM 1185 CA GLY A 319 -10.442 -11.431 4.402 1.00 0.00 C ATOM 1186 C GLY A 319 -9.857 -10.513 5.454 1.00 0.00 C ATOM 1187 O GLY A 319 -9.780 -10.869 6.630 1.00 0.00 O ATOM 0 H GLY A 319 -8.684 -11.959 3.399 1.00 0.00 H new ATOM 0 HA2 GLY A 319 -10.810 -10.844 3.561 1.00 0.00 H new ATOM 0 HA3 GLY A 319 -11.296 -11.969 4.813 1.00 0.00 H new ATOM 1191 N ILE A 320 -9.421 -9.339 5.030 1.00 0.00 N ATOM 1192 CA ILE A 320 -8.671 -8.442 5.897 1.00 0.00 C ATOM 1193 C ILE A 320 -9.520 -7.196 6.231 1.00 0.00 C ATOM 1194 O ILE A 320 -10.746 -7.259 6.155 1.00 0.00 O ATOM 1195 CB ILE A 320 -7.328 -8.077 5.212 1.00 0.00 C ATOM 1196 CG1 ILE A 320 -6.247 -7.668 6.225 1.00 0.00 C ATOM 1197 CG2 ILE A 320 -7.517 -7.009 4.157 1.00 0.00 C ATOM 1198 CD1 ILE A 320 -5.642 -8.851 6.944 1.00 0.00 C ATOM 0 H ILE A 320 -9.574 -8.982 4.087 1.00 0.00 H new ATOM 0 HA ILE A 320 -8.441 -8.933 6.843 1.00 0.00 H new ATOM 0 HB ILE A 320 -6.975 -8.982 4.717 1.00 0.00 H new ATOM 0 HG12 ILE A 320 -5.459 -7.121 5.708 1.00 0.00 H new ATOM 0 HG13 ILE A 320 -6.680 -6.986 6.957 1.00 0.00 H new ATOM 0 HG21 ILE A 320 -6.556 -6.777 3.697 1.00 0.00 H new ATOM 0 HG22 ILE A 320 -8.207 -7.369 3.394 1.00 0.00 H new ATOM 0 HG23 ILE A 320 -7.924 -6.110 4.619 1.00 0.00 H new ATOM 0 HD11 ILE A 320 -4.885 -8.502 7.646 1.00 0.00 H new ATOM 0 HD12 ILE A 320 -6.422 -9.385 7.487 1.00 0.00 H new ATOM 0 HD13 ILE A 320 -5.182 -9.521 6.218 1.00 0.00 H new ATOM 1210 N GLU A 321 -8.869 -6.076 6.574 1.00 0.00 N ATOM 1211 CA GLU A 321 -9.545 -4.879 7.075 1.00 0.00 C ATOM 1212 C GLU A 321 -10.273 -5.179 8.378 1.00 0.00 C ATOM 1213 O GLU A 321 -9.581 -5.453 9.379 1.00 0.00 O ATOM 1214 CB GLU A 321 -10.510 -4.299 6.038 1.00 0.00 C ATOM 1215 CG GLU A 321 -9.815 -3.659 4.848 1.00 0.00 C ATOM 1216 CD GLU A 321 -10.784 -2.941 3.935 1.00 0.00 C ATOM 1217 OE1 GLU A 321 -11.295 -1.872 4.333 1.00 0.00 O ATOM 1218 OE2 GLU A 321 -11.053 -3.446 2.827 1.00 0.00 O ATOM 1219 OXT GLU A 321 -11.523 -5.167 8.395 1.00 0.00 O ATOM 0 H GLU A 321 -7.856 -5.978 6.510 1.00 0.00 H new ATOM 0 HA GLU A 321 -8.780 -4.127 7.269 1.00 0.00 H new ATOM 0 HB2 GLU A 321 -11.166 -5.093 5.681 1.00 0.00 H new ATOM 0 HB3 GLU A 321 -11.144 -3.555 6.521 1.00 0.00 H new ATOM 0 HG2 GLU A 321 -9.065 -2.953 5.205 1.00 0.00 H new ATOM 0 HG3 GLU A 321 -9.287 -4.427 4.282 1.00 0.00 H new