USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 545 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 309 HIS : no HD1:sc= -18.2! C(o=-22!,f=-22!) USER MOD Set 1.2: A 312 CYS SG : rot 180:sc= -3.9 USER MOD Single : A 249 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 251 GLN : amide:sc= -6.64! C(o=-6.6!,f=-5.5!) USER MOD Single : A 252 CYS SG : rot 169:sc= -4.75! USER MOD Single : A 254 SER OG : rot 94:sc= 0.662 USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 263 THR OG1 : rot 101:sc= 1.29 USER MOD Single : A 267 GLN : amide:sc= -0.0482 K(o=-0.048,f=-1.3!) USER MOD Single : A 275 SER OG : rot 6:sc= -5.8! USER MOD Single : A 276 LYS NZ :NH3+ -167:sc=-0.00621 (180deg=-0.143) USER MOD Single : A 278 THR OG1 : rot 180:sc=-0.00172 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0.0492 USER MOD Single : A 280 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 281 ASN : amide:sc= -0.968 X(o=-0.97,f=-0.51) USER MOD Single : A 284 ASN : amide:sc= -2.27! C(o=-2.3!,f=-3.8!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 ASN : amide:sc= -0.318 X(o=-0.32,f=-0.12) USER MOD Single : A 299 SER OG : rot 180:sc= 0 USER MOD Single : A 300 THR OG1 : rot 71:sc= 0.028 USER MOD Single : A 302 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.06) USER MOD Single : A 305 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 MET CE :methyl -145:sc= -0.671 (180deg=-2.06) USER MOD Single : A 310 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 ASN : amide:sc= -1.14 K(o=-1.1,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -4.879 -15.742 2.948 1.00 0.00 N ATOM 76 CA ARG A 247 -4.314 -14.882 1.915 1.00 0.00 C ATOM 77 C ARG A 247 -4.837 -13.472 2.028 1.00 0.00 C ATOM 78 O ARG A 247 -5.696 -13.171 2.856 1.00 0.00 O ATOM 79 CB ARG A 247 -4.598 -15.446 0.523 1.00 0.00 C ATOM 80 CG ARG A 247 -6.058 -15.803 0.299 1.00 0.00 C ATOM 81 CD ARG A 247 -6.201 -17.091 -0.497 1.00 0.00 C ATOM 82 NE ARG A 247 -7.598 -17.503 -0.624 1.00 0.00 N ATOM 83 CZ ARG A 247 -8.449 -16.976 -1.501 1.00 0.00 C ATOM 84 NH1 ARG A 247 -8.052 -16.016 -2.328 1.00 0.00 N ATOM 85 NH2 ARG A 247 -9.701 -17.410 -1.551 1.00 0.00 N ATOM 0 HA ARG A 247 -3.235 -14.854 2.064 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -4.292 -14.715 -0.226 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -3.987 -16.335 0.369 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -6.559 -15.911 1.261 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -6.555 -14.990 -0.230 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -5.772 -16.954 -1.489 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -5.632 -17.883 -0.010 1.00 0.00 H new ATOM 0 HE ARG A 247 -7.940 -18.237 -0.004 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -7.090 -15.679 -2.293 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -8.709 -15.616 -2.998 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -10.011 -18.147 -0.918 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -10.354 -17.007 -2.223 1.00 0.00 H new ATOM 99 N TRP A 248 -4.261 -12.599 1.222 1.00 0.00 N ATOM 100 CA TRP A 248 -4.617 -11.197 1.267 1.00 0.00 C ATOM 101 C TRP A 248 -4.658 -10.521 -0.095 1.00 0.00 C ATOM 102 O TRP A 248 -4.239 -11.071 -1.111 1.00 0.00 O ATOM 103 CB TRP A 248 -3.589 -10.473 2.112 1.00 0.00 C ATOM 104 CG TRP A 248 -3.867 -10.472 3.570 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.255 -11.229 4.520 1.00 0.00 C ATOM 106 CD2 TRP A 248 -4.822 -9.660 4.238 1.00 0.00 C ATOM 107 NE1 TRP A 248 -3.735 -10.887 5.766 1.00 0.00 N ATOM 108 CE2 TRP A 248 -4.713 -9.924 5.611 1.00 0.00 C ATOM 109 CE3 TRP A 248 -5.749 -8.719 3.800 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -5.507 -9.263 6.550 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -6.540 -8.080 4.727 1.00 0.00 C ATOM 112 CH2 TRP A 248 -6.411 -8.348 6.089 1.00 0.00 C ATOM 0 H TRP A 248 -3.548 -12.837 0.532 1.00 0.00 H new ATOM 0 HA TRP A 248 -5.624 -11.145 1.681 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -2.614 -10.930 1.943 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -3.520 -9.441 1.769 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -2.507 -11.983 4.327 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -3.421 -11.279 6.654 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -5.846 -8.494 2.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -5.410 -9.468 7.606 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.272 -7.359 4.394 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -7.038 -7.822 6.794 1.00 0.00 H new ATOM 123 N MET A 249 -5.136 -9.284 -0.045 1.00 0.00 N ATOM 124 CA MET A 249 -5.239 -8.385 -1.188 1.00 0.00 C ATOM 125 C MET A 249 -5.206 -6.963 -0.643 1.00 0.00 C ATOM 126 O MET A 249 -6.238 -6.318 -0.479 1.00 0.00 O ATOM 127 CB MET A 249 -6.533 -8.588 -1.952 1.00 0.00 C ATOM 128 CG MET A 249 -6.631 -9.916 -2.685 1.00 0.00 C ATOM 129 SD MET A 249 -6.019 -9.821 -4.378 1.00 0.00 S ATOM 130 CE MET A 249 -7.535 -9.473 -5.263 1.00 0.00 C ATOM 0 H MET A 249 -5.474 -8.865 0.821 1.00 0.00 H new ATOM 0 HA MET A 249 -4.418 -8.583 -1.877 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.368 -8.510 -1.255 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.644 -7.780 -2.675 1.00 0.00 H new ATOM 0 HG2 MET A 249 -6.064 -10.670 -2.140 1.00 0.00 H new ATOM 0 HG3 MET A 249 -7.670 -10.245 -2.696 1.00 0.00 H new ATOM 0 HE1 MET A 249 -7.322 -9.385 -6.328 1.00 0.00 H new ATOM 0 HE2 MET A 249 -8.245 -10.283 -5.100 1.00 0.00 H new ATOM 0 HE3 MET A 249 -7.962 -8.538 -4.900 1.00 0.00 H new ATOM 140 N VAL A 250 -4.016 -6.521 -0.306 1.00 0.00 N ATOM 141 CA VAL A 250 -3.805 -5.210 0.302 1.00 0.00 C ATOM 142 C VAL A 250 -4.471 -4.072 -0.450 1.00 0.00 C ATOM 143 O VAL A 250 -4.532 -4.069 -1.678 1.00 0.00 O ATOM 144 CB VAL A 250 -2.308 -4.887 0.442 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.123 -3.525 1.103 1.00 0.00 C ATOM 146 CG2 VAL A 250 -1.593 -5.984 1.220 1.00 0.00 C ATOM 0 H VAL A 250 -3.159 -7.056 -0.443 1.00 0.00 H new ATOM 0 HA VAL A 250 -4.272 -5.284 1.284 1.00 0.00 H new ATOM 0 HB VAL A 250 -1.862 -4.844 -0.552 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.059 -3.308 1.197 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -2.598 -2.757 0.493 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.580 -3.536 2.093 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -0.535 -5.737 1.308 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.030 -6.069 2.215 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -1.701 -6.933 0.694 1.00 0.00 H new ATOM 156 N GLN A 251 -4.950 -3.087 0.312 1.00 0.00 N ATOM 157 CA GLN A 251 -5.583 -1.925 -0.258 1.00 0.00 C ATOM 158 C GLN A 251 -5.191 -0.691 0.536 1.00 0.00 C ATOM 159 O GLN A 251 -5.922 -0.249 1.421 1.00 0.00 O ATOM 160 CB GLN A 251 -7.087 -2.110 -0.233 1.00 0.00 C ATOM 161 CG GLN A 251 -7.826 -1.311 -1.293 1.00 0.00 C ATOM 162 CD GLN A 251 -9.197 -0.857 -0.831 1.00 0.00 C ATOM 163 OE1 GLN A 251 -10.219 -1.305 -1.348 1.00 0.00 O ATOM 164 NE2 GLN A 251 -9.225 0.039 0.149 1.00 0.00 N ATOM 0 H GLN A 251 -4.905 -3.083 1.331 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.257 -1.797 -1.290 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.315 -3.168 -0.365 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.462 -1.824 0.750 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -7.231 -0.439 -1.566 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.932 -1.918 -2.192 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -8.353 0.384 0.550 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -10.119 0.382 0.501 1.00 0.00 H new ATOM 173 N CYS A 252 -4.023 -0.147 0.229 1.00 0.00 N ATOM 174 CA CYS A 252 -3.533 1.027 0.940 1.00 0.00 C ATOM 175 C CYS A 252 -4.190 2.300 0.416 1.00 0.00 C ATOM 176 O CYS A 252 -3.514 3.217 -0.048 1.00 0.00 O ATOM 177 CB CYS A 252 -2.001 1.147 0.870 1.00 0.00 C ATOM 178 SG CYS A 252 -1.144 -0.245 0.085 1.00 0.00 S ATOM 0 H CYS A 252 -3.401 -0.495 -0.501 1.00 0.00 H new ATOM 0 HA CYS A 252 -3.806 0.899 1.987 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -1.750 2.058 0.327 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -1.616 1.263 1.883 1.00 0.00 H new ATOM 0 HG CYS A 252 0.099 0.073 -0.125 1.00 0.00 H new ATOM 184 N GLY A 253 -5.519 2.345 0.511 1.00 0.00 N ATOM 185 CA GLY A 253 -6.281 3.503 0.067 1.00 0.00 C ATOM 186 C GLY A 253 -5.671 4.229 -1.118 1.00 0.00 C ATOM 187 O GLY A 253 -5.021 3.623 -1.971 1.00 0.00 O ATOM 0 H GLY A 253 -6.087 1.589 0.893 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -7.289 3.182 -0.197 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -6.376 4.202 0.898 1.00 0.00 H new ATOM 191 N SER A 254 -5.886 5.537 -1.152 1.00 0.00 N ATOM 192 CA SER A 254 -5.366 6.386 -2.214 1.00 0.00 C ATOM 193 C SER A 254 -5.010 7.752 -1.640 1.00 0.00 C ATOM 194 O SER A 254 -5.769 8.307 -0.844 1.00 0.00 O ATOM 195 CB SER A 254 -6.402 6.530 -3.326 1.00 0.00 C ATOM 196 OG SER A 254 -7.687 6.793 -2.790 1.00 0.00 O ATOM 0 H SER A 254 -6.425 6.038 -0.446 1.00 0.00 H new ATOM 0 HA SER A 254 -4.470 5.931 -2.636 1.00 0.00 H new ATOM 0 HB2 SER A 254 -6.111 7.338 -3.997 1.00 0.00 H new ATOM 0 HB3 SER A 254 -6.432 5.617 -3.921 1.00 0.00 H new ATOM 0 HG SER A 254 -7.840 7.761 -2.766 1.00 0.00 H new ATOM 202 N PHE A 255 -3.843 8.278 -1.999 1.00 0.00 N ATOM 203 CA PHE A 255 -3.408 9.560 -1.451 1.00 0.00 C ATOM 204 C PHE A 255 -3.138 10.616 -2.515 1.00 0.00 C ATOM 205 O PHE A 255 -2.559 10.334 -3.563 1.00 0.00 O ATOM 206 CB PHE A 255 -2.143 9.363 -0.600 1.00 0.00 C ATOM 207 CG PHE A 255 -1.720 7.923 -0.482 1.00 0.00 C ATOM 208 CD1 PHE A 255 -2.523 7.022 0.194 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.533 7.464 -1.051 1.00 0.00 C ATOM 210 CE1 PHE A 255 -2.163 5.697 0.309 1.00 0.00 C ATOM 211 CE2 PHE A 255 -0.171 6.137 -0.939 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.985 5.253 -0.257 1.00 0.00 C ATOM 0 H PHE A 255 -3.191 7.847 -2.655 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.233 9.927 -0.840 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.327 9.939 -1.037 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -2.319 9.765 0.398 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -3.447 7.362 0.639 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.108 8.152 -1.583 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -2.801 5.007 0.841 1.00 0.00 H new ATOM 0 HE2 PHE A 255 0.749 5.789 -1.385 1.00 0.00 H new ATOM 0 HZ PHE A 255 -0.700 4.215 -0.167 1.00 0.00 H new ATOM 222 N ARG A 256 -3.533 11.854 -2.203 1.00 0.00 N ATOM 223 CA ARG A 256 -3.303 12.982 -3.097 1.00 0.00 C ATOM 224 C ARG A 256 -1.810 13.277 -3.166 1.00 0.00 C ATOM 225 O ARG A 256 -1.358 14.059 -4.001 1.00 0.00 O ATOM 226 CB ARG A 256 -4.055 14.224 -2.607 1.00 0.00 C ATOM 227 CG ARG A 256 -5.020 14.795 -3.632 1.00 0.00 C ATOM 228 CD ARG A 256 -5.255 16.279 -3.408 1.00 0.00 C ATOM 229 NE ARG A 256 -4.176 17.095 -3.963 1.00 0.00 N ATOM 230 CZ ARG A 256 -4.261 18.410 -4.149 1.00 0.00 C ATOM 231 NH1 ARG A 256 -5.370 19.062 -3.824 1.00 0.00 N ATOM 232 NH2 ARG A 256 -3.234 19.074 -4.659 1.00 0.00 N ATOM 0 H ARG A 256 -4.014 12.096 -1.336 1.00 0.00 H new ATOM 0 HA ARG A 256 -3.673 12.725 -4.089 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -4.607 13.970 -1.702 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.332 14.992 -2.334 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.624 14.635 -4.635 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -5.969 14.262 -3.576 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -6.201 16.569 -3.865 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -5.344 16.475 -2.339 1.00 0.00 H new ATOM 0 HE ARG A 256 -3.307 16.629 -4.223 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -6.163 18.555 -3.430 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -5.430 20.070 -3.969 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -2.379 18.577 -4.909 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -3.299 20.082 -4.802 1.00 0.00 H new ATOM 246 N GLY A 257 -1.055 12.631 -2.278 1.00 0.00 N ATOM 247 CA GLY A 257 0.376 12.798 -2.232 1.00 0.00 C ATOM 248 C GLY A 257 1.039 12.213 -3.457 1.00 0.00 C ATOM 249 O GLY A 257 1.856 11.312 -3.351 1.00 0.00 O ATOM 0 H GLY A 257 -1.425 11.985 -1.581 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.618 13.858 -2.157 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.771 12.317 -1.338 1.00 0.00 H new ATOM 253 N ALA A 258 0.665 12.720 -4.627 1.00 0.00 N ATOM 254 CA ALA A 258 1.206 12.243 -5.900 1.00 0.00 C ATOM 255 C ALA A 258 2.685 11.906 -5.791 1.00 0.00 C ATOM 256 O ALA A 258 3.165 10.957 -6.411 1.00 0.00 O ATOM 257 CB ALA A 258 0.977 13.278 -6.991 1.00 0.00 C ATOM 0 H ALA A 258 -0.019 13.471 -4.722 1.00 0.00 H new ATOM 0 HA ALA A 258 0.678 11.326 -6.162 1.00 0.00 H new ATOM 0 HB1 ALA A 258 1.384 12.910 -7.933 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -0.092 13.457 -7.104 1.00 0.00 H new ATOM 0 HB3 ALA A 258 1.475 14.209 -6.719 1.00 0.00 H new ATOM 263 N GLU A 259 3.399 12.676 -4.983 1.00 0.00 N ATOM 264 CA GLU A 259 4.821 12.441 -4.779 1.00 0.00 C ATOM 265 C GLU A 259 5.015 11.330 -3.759 1.00 0.00 C ATOM 266 O GLU A 259 5.851 10.443 -3.938 1.00 0.00 O ATOM 267 CB GLU A 259 5.521 13.720 -4.313 1.00 0.00 C ATOM 268 CG GLU A 259 6.994 13.777 -4.682 1.00 0.00 C ATOM 269 CD GLU A 259 7.336 14.980 -5.540 1.00 0.00 C ATOM 270 OE1 GLU A 259 6.620 15.998 -5.446 1.00 0.00 O ATOM 271 OE2 GLU A 259 8.320 14.902 -6.305 1.00 0.00 O ATOM 0 H GLU A 259 3.019 13.465 -4.460 1.00 0.00 H new ATOM 0 HA GLU A 259 5.266 12.139 -5.727 1.00 0.00 H new ATOM 0 HB2 GLU A 259 5.013 14.581 -4.747 1.00 0.00 H new ATOM 0 HB3 GLU A 259 5.423 13.804 -3.231 1.00 0.00 H new ATOM 0 HG2 GLU A 259 7.592 13.804 -3.771 1.00 0.00 H new ATOM 0 HG3 GLU A 259 7.266 12.866 -5.215 1.00 0.00 H new ATOM 278 N GLN A 260 4.214 11.373 -2.703 1.00 0.00 N ATOM 279 CA GLN A 260 4.267 10.359 -1.664 1.00 0.00 C ATOM 280 C GLN A 260 3.679 9.051 -2.184 1.00 0.00 C ATOM 281 O GLN A 260 4.076 7.973 -1.754 1.00 0.00 O ATOM 282 CB GLN A 260 3.499 10.823 -0.424 1.00 0.00 C ATOM 283 CG GLN A 260 4.398 11.317 0.698 1.00 0.00 C ATOM 284 CD GLN A 260 5.103 12.614 0.352 1.00 0.00 C ATOM 285 OE1 GLN A 260 4.518 13.508 -0.260 1.00 0.00 O ATOM 286 NE2 GLN A 260 6.367 12.723 0.741 1.00 0.00 N ATOM 0 H GLN A 260 3.519 12.102 -2.545 1.00 0.00 H new ATOM 0 HA GLN A 260 5.309 10.197 -1.387 1.00 0.00 H new ATOM 0 HB2 GLN A 260 2.814 11.622 -0.709 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.890 9.998 -0.054 1.00 0.00 H new ATOM 0 HG2 GLN A 260 3.802 11.461 1.599 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.141 10.553 0.926 1.00 0.00 H new ATOM 0 HE21 GLN A 260 6.813 11.957 1.246 1.00 0.00 H new ATOM 0 HE22 GLN A 260 6.893 13.573 0.535 1.00 0.00 H new ATOM 295 N ALA A 261 2.739 9.163 -3.121 1.00 0.00 N ATOM 296 CA ALA A 261 2.098 8.002 -3.719 1.00 0.00 C ATOM 297 C ALA A 261 3.064 7.283 -4.649 1.00 0.00 C ATOM 298 O ALA A 261 3.245 6.069 -4.554 1.00 0.00 O ATOM 299 CB ALA A 261 0.843 8.420 -4.463 1.00 0.00 C ATOM 0 H ALA A 261 2.405 10.056 -3.482 1.00 0.00 H new ATOM 0 HA ALA A 261 1.812 7.311 -2.926 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.373 7.542 -4.906 1.00 0.00 H new ATOM 0 HB2 ALA A 261 0.148 8.892 -3.768 1.00 0.00 H new ATOM 0 HB3 ALA A 261 1.105 9.127 -5.250 1.00 0.00 H new ATOM 305 N GLU A 262 3.707 8.043 -5.535 1.00 0.00 N ATOM 306 CA GLU A 262 4.679 7.468 -6.456 1.00 0.00 C ATOM 307 C GLU A 262 5.852 6.929 -5.658 1.00 0.00 C ATOM 308 O GLU A 262 6.375 5.852 -5.942 1.00 0.00 O ATOM 309 CB GLU A 262 5.156 8.516 -7.465 1.00 0.00 C ATOM 310 CG GLU A 262 4.468 8.415 -8.817 1.00 0.00 C ATOM 311 CD GLU A 262 4.980 7.253 -9.646 1.00 0.00 C ATOM 312 OE1 GLU A 262 4.905 6.103 -9.166 1.00 0.00 O ATOM 313 OE2 GLU A 262 5.456 7.494 -10.776 1.00 0.00 O ATOM 0 H GLU A 262 3.572 9.049 -5.632 1.00 0.00 H new ATOM 0 HA GLU A 262 4.211 6.657 -7.015 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.984 9.510 -7.052 1.00 0.00 H new ATOM 0 HB3 GLU A 262 6.232 8.410 -7.605 1.00 0.00 H new ATOM 0 HG2 GLU A 262 3.394 8.304 -8.667 1.00 0.00 H new ATOM 0 HG3 GLU A 262 4.619 9.344 -9.368 1.00 0.00 H new ATOM 320 N THR A 263 6.233 7.676 -4.629 1.00 0.00 N ATOM 321 CA THR A 263 7.313 7.267 -3.751 1.00 0.00 C ATOM 322 C THR A 263 6.826 6.133 -2.858 1.00 0.00 C ATOM 323 O THR A 263 7.607 5.282 -2.430 1.00 0.00 O ATOM 324 CB THR A 263 7.791 8.445 -2.900 1.00 0.00 C ATOM 325 OG1 THR A 263 8.170 9.535 -3.720 1.00 0.00 O ATOM 326 CG2 THR A 263 8.970 8.105 -2.014 1.00 0.00 C ATOM 0 H THR A 263 5.806 8.570 -4.385 1.00 0.00 H new ATOM 0 HA THR A 263 8.154 6.923 -4.352 1.00 0.00 H new ATOM 0 HB THR A 263 6.944 8.704 -2.265 1.00 0.00 H new ATOM 0 HG1 THR A 263 7.447 10.197 -3.739 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.258 8.984 -1.438 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.693 7.300 -1.333 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.809 7.785 -2.632 1.00 0.00 H new ATOM 334 N VAL A 264 5.517 6.123 -2.594 1.00 0.00 N ATOM 335 CA VAL A 264 4.913 5.089 -1.772 1.00 0.00 C ATOM 336 C VAL A 264 5.072 3.732 -2.450 1.00 0.00 C ATOM 337 O VAL A 264 5.207 2.705 -1.784 1.00 0.00 O ATOM 338 CB VAL A 264 3.409 5.387 -1.480 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.554 4.125 -1.550 1.00 0.00 C ATOM 340 CG2 VAL A 264 3.267 6.038 -0.115 1.00 0.00 C ATOM 0 H VAL A 264 4.861 6.823 -2.941 1.00 0.00 H new ATOM 0 HA VAL A 264 5.430 5.074 -0.812 1.00 0.00 H new ATOM 0 HB VAL A 264 3.050 6.069 -2.251 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.515 4.378 -1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.628 3.690 -2.547 1.00 0.00 H new ATOM 0 HG13 VAL A 264 2.908 3.404 -0.813 1.00 0.00 H new ATOM 0 HG21 VAL A 264 2.215 6.243 0.082 1.00 0.00 H new ATOM 0 HG22 VAL A 264 3.656 5.366 0.651 1.00 0.00 H new ATOM 0 HG23 VAL A 264 3.829 6.972 -0.097 1.00 0.00 H new ATOM 350 N ARG A 265 5.070 3.739 -3.778 1.00 0.00 N ATOM 351 CA ARG A 265 5.226 2.513 -4.546 1.00 0.00 C ATOM 352 C ARG A 265 6.638 1.957 -4.385 1.00 0.00 C ATOM 353 O ARG A 265 6.831 0.748 -4.263 1.00 0.00 O ATOM 354 CB ARG A 265 4.927 2.769 -6.027 1.00 0.00 C ATOM 355 CG ARG A 265 3.903 1.808 -6.609 1.00 0.00 C ATOM 356 CD ARG A 265 4.547 0.788 -7.533 1.00 0.00 C ATOM 357 NE ARG A 265 5.736 0.180 -6.939 1.00 0.00 N ATOM 358 CZ ARG A 265 6.694 -0.419 -7.642 1.00 0.00 C ATOM 359 NH1 ARG A 265 6.607 -0.499 -8.964 1.00 0.00 N ATOM 360 NH2 ARG A 265 7.743 -0.943 -7.021 1.00 0.00 N ATOM 0 H ARG A 265 4.962 4.581 -4.344 1.00 0.00 H new ATOM 0 HA ARG A 265 4.516 1.778 -4.166 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.565 3.790 -6.146 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.853 2.691 -6.596 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.389 1.291 -5.799 1.00 0.00 H new ATOM 0 HG3 ARG A 265 3.148 2.370 -7.158 1.00 0.00 H new ATOM 0 HD2 ARG A 265 3.823 0.009 -7.772 1.00 0.00 H new ATOM 0 HD3 ARG A 265 4.818 1.271 -8.472 1.00 0.00 H new ATOM 0 HE ARG A 265 5.838 0.217 -5.925 1.00 0.00 H new ATOM 0 HH11 ARG A 265 5.802 -0.100 -9.447 1.00 0.00 H new ATOM 0 HH12 ARG A 265 7.345 -0.960 -9.497 1.00 0.00 H new ATOM 0 HH21 ARG A 265 7.815 -0.887 -6.005 1.00 0.00 H new ATOM 0 HH22 ARG A 265 8.477 -1.402 -7.560 1.00 0.00 H new ATOM 374 N ALA A 266 7.622 2.852 -4.384 1.00 0.00 N ATOM 375 CA ALA A 266 9.018 2.455 -4.234 1.00 0.00 C ATOM 376 C ALA A 266 9.337 2.117 -2.783 1.00 0.00 C ATOM 377 O ALA A 266 9.948 1.089 -2.496 1.00 0.00 O ATOM 378 CB ALA A 266 9.936 3.558 -4.738 1.00 0.00 C ATOM 0 H ALA A 266 7.478 3.857 -4.485 1.00 0.00 H new ATOM 0 HA ALA A 266 9.184 1.559 -4.833 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.975 3.249 -4.620 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.731 3.749 -5.791 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.761 4.468 -4.164 1.00 0.00 H new ATOM 384 N GLN A 267 8.914 2.987 -1.868 1.00 0.00 N ATOM 385 CA GLN A 267 9.151 2.771 -0.444 1.00 0.00 C ATOM 386 C GLN A 267 8.643 1.397 -0.024 1.00 0.00 C ATOM 387 O GLN A 267 9.306 0.678 0.719 1.00 0.00 O ATOM 388 CB GLN A 267 8.466 3.863 0.380 1.00 0.00 C ATOM 389 CG GLN A 267 9.189 5.200 0.338 1.00 0.00 C ATOM 390 CD GLN A 267 10.461 5.202 1.165 1.00 0.00 C ATOM 391 OE1 GLN A 267 10.614 4.405 2.091 1.00 0.00 O ATOM 392 NE2 GLN A 267 11.381 6.099 0.831 1.00 0.00 N ATOM 0 H GLN A 267 8.407 3.845 -2.087 1.00 0.00 H new ATOM 0 HA GLN A 267 10.224 2.816 -0.260 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.448 3.998 0.014 1.00 0.00 H new ATOM 0 HB3 GLN A 267 8.391 3.532 1.416 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.432 5.445 -0.696 1.00 0.00 H new ATOM 0 HG3 GLN A 267 8.522 5.981 0.702 1.00 0.00 H new ATOM 0 HE21 GLN A 267 11.211 6.740 0.056 1.00 0.00 H new ATOM 0 HE22 GLN A 267 12.258 6.147 1.349 1.00 0.00 H new ATOM 401 N LEU A 268 7.464 1.039 -0.521 1.00 0.00 N ATOM 402 CA LEU A 268 6.856 -0.248 -0.221 1.00 0.00 C ATOM 403 C LEU A 268 7.787 -1.389 -0.617 1.00 0.00 C ATOM 404 O LEU A 268 8.082 -2.268 0.190 1.00 0.00 O ATOM 405 CB LEU A 268 5.511 -0.362 -0.958 1.00 0.00 C ATOM 406 CG LEU A 268 4.270 -0.172 -0.077 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.462 1.031 -0.526 1.00 0.00 C ATOM 408 CD2 LEU A 268 3.396 -1.421 -0.082 1.00 0.00 C ATOM 0 H LEU A 268 6.908 1.630 -1.139 1.00 0.00 H new ATOM 0 HA LEU A 268 6.681 -0.319 0.853 1.00 0.00 H new ATOM 0 HB2 LEU A 268 5.488 0.379 -1.757 1.00 0.00 H new ATOM 0 HB3 LEU A 268 5.455 -1.342 -1.431 1.00 0.00 H new ATOM 0 HG LEU A 268 4.616 0.003 0.942 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.588 1.142 0.116 1.00 0.00 H new ATOM 0 HD12 LEU A 268 4.078 1.928 -0.460 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.139 0.888 -1.557 1.00 0.00 H new ATOM 0 HD21 LEU A 268 2.524 -1.257 0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 268 3.071 -1.633 -1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 268 3.968 -2.267 0.300 1.00 0.00 H new ATOM 420 N ALA A 269 8.250 -1.366 -1.855 1.00 0.00 N ATOM 421 CA ALA A 269 9.149 -2.402 -2.348 1.00 0.00 C ATOM 422 C ALA A 269 10.541 -2.264 -1.738 1.00 0.00 C ATOM 423 O ALA A 269 11.295 -3.235 -1.670 1.00 0.00 O ATOM 424 CB ALA A 269 9.228 -2.352 -3.867 1.00 0.00 C ATOM 0 H ALA A 269 8.020 -0.644 -2.538 1.00 0.00 H new ATOM 0 HA ALA A 269 8.746 -3.369 -2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.903 -3.131 -4.222 1.00 0.00 H new ATOM 0 HB2 ALA A 269 8.236 -2.512 -4.288 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.602 -1.377 -4.180 1.00 0.00 H new ATOM 430 N PHE A 270 10.877 -1.058 -1.297 1.00 0.00 N ATOM 431 CA PHE A 270 12.179 -0.803 -0.694 1.00 0.00 C ATOM 432 C PHE A 270 12.174 -1.156 0.790 1.00 0.00 C ATOM 433 O PHE A 270 13.212 -1.496 1.359 1.00 0.00 O ATOM 434 CB PHE A 270 12.572 0.665 -0.878 1.00 0.00 C ATOM 435 CG PHE A 270 13.932 0.997 -0.333 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.151 1.054 1.034 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.992 1.255 -1.188 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.400 1.360 1.539 1.00 0.00 C ATOM 439 CE2 PHE A 270 16.244 1.561 -0.689 1.00 0.00 C ATOM 440 CZ PHE A 270 16.448 1.614 0.676 1.00 0.00 C ATOM 0 H PHE A 270 10.267 -0.242 -1.346 1.00 0.00 H new ATOM 0 HA PHE A 270 12.911 -1.435 -1.196 1.00 0.00 H new ATOM 0 HB2 PHE A 270 12.546 0.909 -1.940 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.830 1.295 -0.388 1.00 0.00 H new ATOM 0 HD1 PHE A 270 13.335 0.857 1.713 1.00 0.00 H new ATOM 0 HD2 PHE A 270 14.838 1.216 -2.256 1.00 0.00 H new ATOM 0 HE1 PHE A 270 15.557 1.401 2.607 1.00 0.00 H new ATOM 0 HE2 PHE A 270 17.062 1.759 -1.366 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.425 1.854 1.068 1.00 0.00 H new ATOM 450 N GLU A 271 11.004 -1.069 1.414 1.00 0.00 N ATOM 451 CA GLU A 271 10.872 -1.375 2.833 1.00 0.00 C ATOM 452 C GLU A 271 10.672 -2.872 3.063 1.00 0.00 C ATOM 453 O GLU A 271 10.826 -3.361 4.182 1.00 0.00 O ATOM 454 CB GLU A 271 9.700 -0.592 3.429 1.00 0.00 C ATOM 455 CG GLU A 271 9.413 -0.924 4.885 1.00 0.00 C ATOM 456 CD GLU A 271 10.566 -0.574 5.807 1.00 0.00 C ATOM 457 OE1 GLU A 271 11.597 -0.075 5.309 1.00 0.00 O ATOM 458 OE2 GLU A 271 10.437 -0.799 7.029 1.00 0.00 O ATOM 0 H GLU A 271 10.135 -0.789 0.960 1.00 0.00 H new ATOM 0 HA GLU A 271 11.796 -1.079 3.330 1.00 0.00 H new ATOM 0 HB2 GLU A 271 9.908 0.475 3.344 1.00 0.00 H new ATOM 0 HB3 GLU A 271 8.806 -0.790 2.838 1.00 0.00 H new ATOM 0 HG2 GLU A 271 8.521 -0.386 5.206 1.00 0.00 H new ATOM 0 HG3 GLU A 271 9.193 -1.988 4.974 1.00 0.00 H new ATOM 465 N GLY A 272 10.324 -3.595 2.002 1.00 0.00 N ATOM 466 CA GLY A 272 10.107 -5.024 2.123 1.00 0.00 C ATOM 467 C GLY A 272 8.648 -5.399 1.958 1.00 0.00 C ATOM 468 O GLY A 272 8.193 -6.410 2.493 1.00 0.00 O ATOM 0 H GLY A 272 10.189 -3.217 1.064 1.00 0.00 H new ATOM 0 HA2 GLY A 272 10.701 -5.545 1.372 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.459 -5.362 3.098 1.00 0.00 H new ATOM 472 N PHE A 273 7.916 -4.580 1.210 1.00 0.00 N ATOM 473 CA PHE A 273 6.501 -4.823 0.965 1.00 0.00 C ATOM 474 C PHE A 273 6.024 -4.003 -0.226 1.00 0.00 C ATOM 475 O PHE A 273 5.626 -2.857 -0.078 1.00 0.00 O ATOM 476 CB PHE A 273 5.674 -4.514 2.221 1.00 0.00 C ATOM 477 CG PHE A 273 5.458 -3.048 2.531 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.525 -2.189 2.798 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.171 -2.539 2.600 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.300 -0.858 3.127 1.00 0.00 C ATOM 481 CE2 PHE A 273 3.949 -1.216 2.917 1.00 0.00 C ATOM 482 CZ PHE A 273 5.013 -0.376 3.184 1.00 0.00 C ATOM 0 H PHE A 273 8.282 -3.740 0.762 1.00 0.00 H new ATOM 0 HA PHE A 273 6.362 -5.878 0.728 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.699 -4.990 2.116 1.00 0.00 H new ATOM 0 HB3 PHE A 273 6.164 -4.977 3.077 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.537 -2.563 2.748 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.330 -3.188 2.403 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.133 -0.204 3.337 1.00 0.00 H new ATOM 0 HE2 PHE A 273 2.939 -0.835 2.957 1.00 0.00 H new ATOM 0 HZ PHE A 273 4.834 0.659 3.437 1.00 0.00 H new ATOM 492 N ASP A 274 6.098 -4.598 -1.414 1.00 0.00 N ATOM 493 CA ASP A 274 5.705 -3.915 -2.642 1.00 0.00 C ATOM 494 C ASP A 274 4.202 -3.996 -2.905 1.00 0.00 C ATOM 495 O ASP A 274 3.631 -5.080 -2.990 1.00 0.00 O ATOM 496 CB ASP A 274 6.464 -4.503 -3.832 1.00 0.00 C ATOM 497 CG ASP A 274 6.123 -5.960 -4.072 1.00 0.00 C ATOM 498 OD1 ASP A 274 6.526 -6.808 -3.249 1.00 0.00 O ATOM 499 OD2 ASP A 274 5.451 -6.253 -5.084 1.00 0.00 O ATOM 0 H ASP A 274 6.427 -5.554 -1.552 1.00 0.00 H new ATOM 0 HA ASP A 274 5.958 -2.862 -2.516 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.233 -3.926 -4.728 1.00 0.00 H new ATOM 0 HB3 ASP A 274 7.536 -4.407 -3.659 1.00 0.00 H new ATOM 504 N SER A 275 3.586 -2.829 -3.069 1.00 0.00 N ATOM 505 CA SER A 275 2.157 -2.723 -3.365 1.00 0.00 C ATOM 506 C SER A 275 1.986 -2.225 -4.803 1.00 0.00 C ATOM 507 O SER A 275 2.787 -1.421 -5.279 1.00 0.00 O ATOM 508 CB SER A 275 1.481 -1.722 -2.423 1.00 0.00 C ATOM 509 OG SER A 275 2.091 -0.445 -2.515 1.00 0.00 O ATOM 0 H SER A 275 4.061 -1.929 -3.001 1.00 0.00 H new ATOM 0 HA SER A 275 1.699 -3.703 -3.233 1.00 0.00 H new ATOM 0 HB2 SER A 275 0.423 -1.642 -2.671 1.00 0.00 H new ATOM 0 HB3 SER A 275 1.542 -2.085 -1.397 1.00 0.00 H new ATOM 0 HG SER A 275 2.758 -0.452 -3.233 1.00 0.00 H new ATOM 515 N LYS A 276 0.939 -2.667 -5.479 1.00 0.00 N ATOM 516 CA LYS A 276 0.674 -2.223 -6.845 1.00 0.00 C ATOM 517 C LYS A 276 -0.322 -1.064 -6.830 1.00 0.00 C ATOM 518 O LYS A 276 -1.487 -1.242 -6.479 1.00 0.00 O ATOM 519 CB LYS A 276 0.126 -3.373 -7.689 1.00 0.00 C ATOM 520 CG LYS A 276 1.207 -4.272 -8.265 1.00 0.00 C ATOM 521 CD LYS A 276 1.628 -3.816 -9.652 1.00 0.00 C ATOM 522 CE LYS A 276 0.554 -4.116 -10.685 1.00 0.00 C ATOM 523 NZ LYS A 276 0.442 -5.574 -10.961 1.00 0.00 N ATOM 0 H LYS A 276 0.258 -3.331 -5.109 1.00 0.00 H new ATOM 0 HA LYS A 276 1.611 -1.886 -7.289 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.547 -3.974 -7.077 1.00 0.00 H new ATOM 0 HB3 LYS A 276 -0.467 -2.963 -8.506 1.00 0.00 H new ATOM 0 HG2 LYS A 276 2.073 -4.273 -7.603 1.00 0.00 H new ATOM 0 HG3 LYS A 276 0.842 -5.298 -8.313 1.00 0.00 H new ATOM 0 HD2 LYS A 276 1.832 -2.745 -9.638 1.00 0.00 H new ATOM 0 HD3 LYS A 276 2.556 -4.314 -9.934 1.00 0.00 H new ATOM 0 HE2 LYS A 276 -0.405 -3.739 -10.331 1.00 0.00 H new ATOM 0 HE3 LYS A 276 0.783 -3.588 -11.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 -0.133 -5.723 -11.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 1.391 -5.973 -11.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 -0.010 -6.047 -10.153 1.00 0.00 H new ATOM 537 N ILE A 277 0.150 0.125 -7.188 1.00 0.00 N ATOM 538 CA ILE A 277 -0.685 1.315 -7.188 1.00 0.00 C ATOM 539 C ILE A 277 -1.548 1.433 -8.438 1.00 0.00 C ATOM 540 O ILE A 277 -1.312 0.770 -9.448 1.00 0.00 O ATOM 541 CB ILE A 277 0.177 2.581 -7.048 1.00 0.00 C ATOM 542 CG1 ILE A 277 1.003 2.822 -8.316 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.082 2.465 -5.832 1.00 0.00 C ATOM 544 CD1 ILE A 277 1.737 4.147 -8.312 1.00 0.00 C ATOM 0 H ILE A 277 1.113 0.288 -7.483 1.00 0.00 H new ATOM 0 HA ILE A 277 -1.352 1.219 -6.332 1.00 0.00 H new ATOM 0 HB ILE A 277 -0.484 3.436 -6.911 1.00 0.00 H new ATOM 0 HG12 ILE A 277 1.726 2.014 -8.429 1.00 0.00 H new ATOM 0 HG13 ILE A 277 0.344 2.783 -9.183 1.00 0.00 H new ATOM 0 HG21 ILE A 277 1.688 3.367 -5.742 1.00 0.00 H new ATOM 0 HG22 ILE A 277 0.473 2.346 -4.936 1.00 0.00 H new ATOM 0 HG23 ILE A 277 1.734 1.599 -5.945 1.00 0.00 H new ATOM 0 HD11 ILE A 277 2.302 4.253 -9.238 1.00 0.00 H new ATOM 0 HD12 ILE A 277 1.017 4.961 -8.231 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.421 4.181 -7.464 1.00 0.00 H new ATOM 556 N THR A 278 -2.547 2.303 -8.346 1.00 0.00 N ATOM 557 CA THR A 278 -3.471 2.557 -9.445 1.00 0.00 C ATOM 558 C THR A 278 -4.395 3.721 -9.095 1.00 0.00 C ATOM 559 O THR A 278 -5.116 3.673 -8.101 1.00 0.00 O ATOM 560 CB THR A 278 -4.297 1.309 -9.754 1.00 0.00 C ATOM 561 OG1 THR A 278 -4.483 0.528 -8.586 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.671 0.421 -10.807 1.00 0.00 C ATOM 0 H THR A 278 -2.739 2.852 -7.508 1.00 0.00 H new ATOM 0 HA THR A 278 -2.890 2.816 -10.330 1.00 0.00 H new ATOM 0 HB THR A 278 -5.248 1.680 -10.136 1.00 0.00 H new ATOM 0 HG1 THR A 278 -5.015 -0.265 -8.804 1.00 0.00 H new ATOM 0 HG21 THR A 278 -4.309 -0.446 -10.978 1.00 0.00 H new ATOM 0 HG22 THR A 278 -3.562 0.980 -11.736 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.690 0.089 -10.466 1.00 0.00 H new ATOM 570 N THR A 279 -4.363 4.768 -9.914 1.00 0.00 N ATOM 571 CA THR A 279 -5.195 5.952 -9.685 1.00 0.00 C ATOM 572 C THR A 279 -6.635 5.562 -9.357 1.00 0.00 C ATOM 573 O THR A 279 -7.153 4.575 -9.878 1.00 0.00 O ATOM 574 CB THR A 279 -5.169 6.867 -10.912 1.00 0.00 C ATOM 575 OG1 THR A 279 -4.830 6.135 -12.079 1.00 0.00 O ATOM 576 CG2 THR A 279 -4.188 8.014 -10.781 1.00 0.00 C ATOM 0 H THR A 279 -3.771 4.824 -10.743 1.00 0.00 H new ATOM 0 HA THR A 279 -4.783 6.488 -8.830 1.00 0.00 H new ATOM 0 HB THR A 279 -6.175 7.280 -10.988 1.00 0.00 H new ATOM 0 HG1 THR A 279 -4.821 6.738 -12.852 1.00 0.00 H new ATOM 0 HG21 THR A 279 -4.219 8.624 -11.684 1.00 0.00 H new ATOM 0 HG22 THR A 279 -4.457 8.626 -9.920 1.00 0.00 H new ATOM 0 HG23 THR A 279 -3.182 7.618 -10.645 1.00 0.00 H new ATOM 584 N ASN A 280 -7.277 6.343 -8.490 1.00 0.00 N ATOM 585 CA ASN A 280 -8.655 6.070 -8.099 1.00 0.00 C ATOM 586 C ASN A 280 -9.183 7.150 -7.159 1.00 0.00 C ATOM 587 O ASN A 280 -8.564 7.457 -6.142 1.00 0.00 O ATOM 588 CB ASN A 280 -8.755 4.701 -7.425 1.00 0.00 C ATOM 589 CG ASN A 280 -10.148 4.113 -7.517 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.943 4.217 -6.582 1.00 0.00 O ATOM 591 ND2 ASN A 280 -10.454 3.489 -8.649 1.00 0.00 N ATOM 0 H ASN A 280 -6.866 7.165 -8.048 1.00 0.00 H new ATOM 0 HA ASN A 280 -9.266 6.070 -9.002 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -8.044 4.018 -7.889 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -8.471 4.793 -6.377 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -11.378 3.073 -8.769 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -9.765 3.426 -9.399 1.00 0.00 H new ATOM 598 N ASN A 281 -10.333 7.718 -7.509 1.00 0.00 N ATOM 599 CA ASN A 281 -10.955 8.764 -6.699 1.00 0.00 C ATOM 600 C ASN A 281 -10.196 10.087 -6.808 1.00 0.00 C ATOM 601 O ASN A 281 -10.527 11.055 -6.122 1.00 0.00 O ATOM 602 CB ASN A 281 -11.032 8.333 -5.232 1.00 0.00 C ATOM 603 CG ASN A 281 -12.025 9.159 -4.438 1.00 0.00 C ATOM 604 OD1 ASN A 281 -13.200 8.808 -4.334 1.00 0.00 O ATOM 605 ND2 ASN A 281 -11.555 10.266 -3.873 1.00 0.00 N ATOM 0 H ASN A 281 -10.855 7.472 -8.350 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.963 8.917 -7.084 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -11.314 7.281 -5.179 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -10.045 8.421 -4.778 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -12.176 10.863 -3.327 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -10.573 10.519 -3.985 1.00 0.00 H new ATOM 612 N GLY A 282 -9.185 10.132 -7.672 1.00 0.00 N ATOM 613 CA GLY A 282 -8.415 11.350 -7.843 1.00 0.00 C ATOM 614 C GLY A 282 -6.985 11.217 -7.355 1.00 0.00 C ATOM 615 O GLY A 282 -6.085 11.881 -7.871 1.00 0.00 O ATOM 0 H GLY A 282 -8.887 9.349 -8.254 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.410 11.626 -8.898 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -8.904 12.162 -7.304 1.00 0.00 H new ATOM 619 N TRP A 283 -6.771 10.364 -6.357 1.00 0.00 N ATOM 620 CA TRP A 283 -5.444 10.158 -5.806 1.00 0.00 C ATOM 621 C TRP A 283 -4.909 8.770 -6.137 1.00 0.00 C ATOM 622 O TRP A 283 -5.662 7.865 -6.498 1.00 0.00 O ATOM 623 CB TRP A 283 -5.438 10.366 -4.289 1.00 0.00 C ATOM 624 CG TRP A 283 -6.769 10.232 -3.609 1.00 0.00 C ATOM 625 CD1 TRP A 283 -7.672 9.231 -3.767 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.325 11.121 -2.635 1.00 0.00 C ATOM 627 NE1 TRP A 283 -8.770 9.447 -2.970 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.579 10.603 -2.262 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.886 12.306 -2.049 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -9.396 11.231 -1.326 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.694 12.929 -1.120 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.938 12.391 -0.765 1.00 0.00 C ATOM 0 H TRP A 283 -7.503 9.806 -5.916 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.790 10.898 -6.267 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.750 9.647 -3.845 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.041 11.359 -4.078 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -7.545 8.385 -4.426 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -9.592 8.845 -2.915 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -5.930 12.730 -2.317 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -10.356 10.818 -1.053 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.362 13.847 -0.659 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.547 12.902 -0.034 1.00 0.00 H new ATOM 643 N ASN A 284 -3.597 8.622 -6.007 1.00 0.00 N ATOM 644 CA ASN A 284 -2.925 7.357 -6.285 1.00 0.00 C ATOM 645 C ASN A 284 -3.388 6.265 -5.325 1.00 0.00 C ATOM 646 O ASN A 284 -2.988 6.240 -4.162 1.00 0.00 O ATOM 647 CB ASN A 284 -1.407 7.539 -6.176 1.00 0.00 C ATOM 648 CG ASN A 284 -0.700 7.312 -7.497 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.607 6.182 -7.979 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.196 8.387 -8.091 1.00 0.00 N ATOM 0 H ASN A 284 -2.971 9.370 -5.708 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.183 7.050 -7.299 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.190 8.546 -5.819 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -1.013 6.846 -5.433 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.291 8.296 -8.982 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.296 9.304 -7.656 1.00 0.00 H new ATOM 657 N ARG A 285 -4.229 5.361 -5.819 1.00 0.00 N ATOM 658 CA ARG A 285 -4.740 4.267 -5.000 1.00 0.00 C ATOM 659 C ARG A 285 -3.735 3.126 -4.927 1.00 0.00 C ATOM 660 O ARG A 285 -3.456 2.464 -5.926 1.00 0.00 O ATOM 661 CB ARG A 285 -6.069 3.752 -5.555 1.00 0.00 C ATOM 662 CG ARG A 285 -7.050 3.312 -4.480 1.00 0.00 C ATOM 663 CD ARG A 285 -7.835 2.084 -4.910 1.00 0.00 C ATOM 664 NE ARG A 285 -8.981 1.834 -4.039 1.00 0.00 N ATOM 665 CZ ARG A 285 -9.609 0.663 -3.961 1.00 0.00 C ATOM 666 NH1 ARG A 285 -9.210 -0.364 -4.699 1.00 0.00 N ATOM 667 NH2 ARG A 285 -10.641 0.519 -3.141 1.00 0.00 N ATOM 0 H ARG A 285 -4.570 5.364 -6.780 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.903 4.653 -3.994 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.530 4.536 -6.156 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -5.873 2.912 -6.222 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.509 3.095 -3.559 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -7.740 4.127 -4.260 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -8.181 2.216 -5.935 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -7.179 1.214 -4.904 1.00 0.00 H new ATOM 0 HE ARG A 285 -9.319 2.601 -3.457 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -8.417 -0.260 -5.332 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -9.696 -1.258 -4.634 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -10.953 1.305 -2.571 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -11.123 -0.378 -3.080 1.00 0.00 H new ATOM 681 N VAL A 286 -3.197 2.903 -3.735 1.00 0.00 N ATOM 682 CA VAL A 286 -2.224 1.840 -3.527 1.00 0.00 C ATOM 683 C VAL A 286 -2.906 0.557 -3.079 1.00 0.00 C ATOM 684 O VAL A 286 -3.898 0.581 -2.353 1.00 0.00 O ATOM 685 CB VAL A 286 -1.170 2.231 -2.480 1.00 0.00 C ATOM 686 CG1 VAL A 286 0.025 1.290 -2.510 1.00 0.00 C ATOM 687 CG2 VAL A 286 -0.727 3.671 -2.679 1.00 0.00 C ATOM 0 H VAL A 286 -3.418 3.444 -2.899 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.729 1.678 -4.485 1.00 0.00 H new ATOM 0 HB VAL A 286 -1.632 2.143 -1.497 1.00 0.00 H new ATOM 0 HG11 VAL A 286 0.749 1.598 -1.756 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -0.307 0.273 -2.300 1.00 0.00 H new ATOM 0 HG13 VAL A 286 0.490 1.324 -3.495 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.020 3.929 -1.928 1.00 0.00 H new ATOM 0 HG22 VAL A 286 -0.296 3.785 -3.674 1.00 0.00 H new ATOM 0 HG23 VAL A 286 -1.587 4.333 -2.578 1.00 0.00 H new ATOM 697 N VAL A 287 -2.338 -0.550 -3.516 1.00 0.00 N ATOM 698 CA VAL A 287 -2.828 -1.887 -3.197 1.00 0.00 C ATOM 699 C VAL A 287 -1.744 -2.899 -3.542 1.00 0.00 C ATOM 700 O VAL A 287 -1.075 -2.744 -4.555 1.00 0.00 O ATOM 701 CB VAL A 287 -4.102 -2.251 -3.997 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.235 -1.276 -3.713 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.813 -2.300 -5.491 1.00 0.00 C ATOM 0 H VAL A 287 -1.510 -0.551 -4.112 1.00 0.00 H new ATOM 0 HA VAL A 287 -3.076 -1.905 -2.136 1.00 0.00 H new ATOM 0 HB VAL A 287 -4.417 -3.242 -3.671 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -6.114 -1.561 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.477 -1.298 -2.650 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.927 -0.269 -3.994 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.725 -2.558 -6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.458 -1.325 -5.825 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -3.049 -3.052 -5.689 1.00 0.00 H new ATOM 713 N ILE A 288 -1.575 -3.938 -2.736 1.00 0.00 N ATOM 714 CA ILE A 288 -0.558 -4.945 -3.039 1.00 0.00 C ATOM 715 C ILE A 288 -1.203 -6.173 -3.658 1.00 0.00 C ATOM 716 O ILE A 288 -2.317 -6.545 -3.291 1.00 0.00 O ATOM 717 CB ILE A 288 0.245 -5.407 -1.801 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.769 -4.238 -0.966 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.397 -6.305 -2.222 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.944 -4.586 0.492 1.00 0.00 C ATOM 0 H ILE A 288 -2.113 -4.108 -1.886 1.00 0.00 H new ATOM 0 HA ILE A 288 0.133 -4.463 -3.730 1.00 0.00 H new ATOM 0 HB ILE A 288 -0.445 -5.968 -1.170 1.00 0.00 H new ATOM 0 HG12 ILE A 288 1.725 -3.908 -1.372 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.079 -3.399 -1.053 1.00 0.00 H new ATOM 0 HG21 ILE A 288 1.953 -6.622 -1.339 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.005 -7.181 -2.738 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.060 -5.756 -2.891 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.318 -3.716 1.031 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.016 -4.888 0.912 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.656 -5.406 0.587 1.00 0.00 H new ATOM 732 N GLY A 289 -0.494 -6.814 -4.582 1.00 0.00 N ATOM 733 CA GLY A 289 -1.026 -8.009 -5.206 1.00 0.00 C ATOM 734 C GLY A 289 -1.517 -8.991 -4.165 1.00 0.00 C ATOM 735 O GLY A 289 -1.140 -8.887 -2.998 1.00 0.00 O ATOM 0 H GLY A 289 0.430 -6.530 -4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -1.845 -7.741 -5.874 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -0.256 -8.478 -5.819 1.00 0.00 H new ATOM 739 N PRO A 290 -2.364 -9.959 -4.538 1.00 0.00 N ATOM 740 CA PRO A 290 -2.888 -10.939 -3.593 1.00 0.00 C ATOM 741 C PRO A 290 -1.787 -11.515 -2.704 1.00 0.00 C ATOM 742 O PRO A 290 -1.092 -12.455 -3.089 1.00 0.00 O ATOM 743 CB PRO A 290 -3.496 -12.033 -4.489 1.00 0.00 C ATOM 744 CG PRO A 290 -3.153 -11.655 -5.897 1.00 0.00 C ATOM 745 CD PRO A 290 -2.882 -10.178 -5.890 1.00 0.00 C ATOM 0 HA PRO A 290 -3.612 -10.499 -2.908 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.089 -13.013 -4.238 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.576 -12.092 -4.353 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -2.280 -12.208 -6.245 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -3.973 -11.895 -6.574 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -2.157 -9.894 -6.653 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.786 -9.598 -6.077 1.00 0.00 H new ATOM 753 N VAL A 291 -1.632 -10.939 -1.514 1.00 0.00 N ATOM 754 CA VAL A 291 -0.608 -11.394 -0.573 1.00 0.00 C ATOM 755 C VAL A 291 -1.058 -12.668 0.133 1.00 0.00 C ATOM 756 O VAL A 291 -2.135 -13.192 -0.146 1.00 0.00 O ATOM 757 CB VAL A 291 -0.237 -10.323 0.492 1.00 0.00 C ATOM 758 CG1 VAL A 291 1.088 -9.661 0.146 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.325 -9.268 0.647 1.00 0.00 C ATOM 0 H VAL A 291 -2.199 -10.160 -1.178 1.00 0.00 H new ATOM 0 HA VAL A 291 0.284 -11.587 -1.168 1.00 0.00 H new ATOM 0 HB VAL A 291 -0.141 -10.840 1.447 1.00 0.00 H new ATOM 0 HG11 VAL A 291 1.330 -8.915 0.903 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.874 -10.415 0.115 1.00 0.00 H new ATOM 0 HG13 VAL A 291 1.010 -9.178 -0.828 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.022 -8.541 1.401 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.478 -8.760 -0.305 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -2.254 -9.746 0.957 1.00 0.00 H new ATOM 769 N LYS A 292 -0.227 -13.169 1.041 1.00 0.00 N ATOM 770 CA LYS A 292 -0.553 -14.387 1.769 1.00 0.00 C ATOM 771 C LYS A 292 0.136 -14.425 3.127 1.00 0.00 C ATOM 772 O LYS A 292 1.301 -14.052 3.256 1.00 0.00 O ATOM 773 CB LYS A 292 -0.154 -15.616 0.950 1.00 0.00 C ATOM 774 CG LYS A 292 -1.089 -16.801 1.129 1.00 0.00 C ATOM 775 CD LYS A 292 -0.722 -17.947 0.199 1.00 0.00 C ATOM 776 CE LYS A 292 -1.956 -18.577 -0.425 1.00 0.00 C ATOM 777 NZ LYS A 292 -2.448 -19.739 0.365 1.00 0.00 N ATOM 0 H LYS A 292 0.671 -12.753 1.288 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.630 -14.397 1.934 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -0.125 -15.344 -0.105 1.00 0.00 H new ATOM 0 HB3 LYS A 292 0.856 -15.916 1.230 1.00 0.00 H new ATOM 0 HG2 LYS A 292 -1.050 -17.144 2.163 1.00 0.00 H new ATOM 0 HG3 LYS A 292 -2.115 -16.488 0.935 1.00 0.00 H new ATOM 0 HD2 LYS A 292 -0.062 -17.581 -0.588 1.00 0.00 H new ATOM 0 HD3 LYS A 292 -0.167 -18.704 0.754 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -2.746 -17.830 -0.501 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -1.724 -18.900 -1.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 -3.290 -20.140 -0.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 -1.704 -20.464 0.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 -2.694 -19.426 1.326 1.00 0.00 H new ATOM 791 N GLY A 293 -0.593 -14.887 4.140 1.00 0.00 N ATOM 792 CA GLY A 293 -0.032 -14.972 5.473 1.00 0.00 C ATOM 793 C GLY A 293 -1.038 -14.663 6.566 1.00 0.00 C ATOM 794 O GLY A 293 -1.882 -15.496 6.898 1.00 0.00 O ATOM 0 H GLY A 293 -1.560 -15.203 4.060 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.368 -15.974 5.629 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.806 -14.279 5.553 1.00 0.00 H new ATOM 798 N LYS A 294 -0.935 -13.461 7.130 1.00 0.00 N ATOM 799 CA LYS A 294 -1.817 -13.012 8.206 1.00 0.00 C ATOM 800 C LYS A 294 -1.203 -11.800 8.895 1.00 0.00 C ATOM 801 O LYS A 294 -1.896 -10.839 9.229 1.00 0.00 O ATOM 802 CB LYS A 294 -2.046 -14.128 9.235 1.00 0.00 C ATOM 803 CG LYS A 294 -3.491 -14.592 9.321 1.00 0.00 C ATOM 804 CD LYS A 294 -4.118 -14.228 10.659 1.00 0.00 C ATOM 805 CE LYS A 294 -3.359 -14.855 11.818 1.00 0.00 C ATOM 806 NZ LYS A 294 -4.199 -14.951 13.044 1.00 0.00 N ATOM 0 H LYS A 294 -0.237 -12.770 6.854 1.00 0.00 H new ATOM 0 HA LYS A 294 -2.780 -12.744 7.772 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -1.415 -14.979 8.981 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -1.727 -13.776 10.216 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -4.067 -14.140 8.514 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -3.536 -15.672 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -4.130 -13.144 10.774 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -5.155 -14.562 10.679 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -3.018 -15.850 11.533 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -2.470 -14.262 12.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -3.646 -15.384 13.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -4.504 -13.999 13.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -5.035 -15.537 12.847 1.00 0.00 H new ATOM 820 N GLU A 295 0.109 -11.860 9.100 1.00 0.00 N ATOM 821 CA GLU A 295 0.841 -10.779 9.743 1.00 0.00 C ATOM 822 C GLU A 295 1.587 -9.936 8.712 1.00 0.00 C ATOM 823 O GLU A 295 1.890 -8.769 8.957 1.00 0.00 O ATOM 824 CB GLU A 295 1.829 -11.342 10.767 1.00 0.00 C ATOM 825 CG GLU A 295 2.279 -10.323 11.801 1.00 0.00 C ATOM 826 CD GLU A 295 3.692 -9.829 11.555 1.00 0.00 C ATOM 827 OE1 GLU A 295 4.096 -9.747 10.376 1.00 0.00 O ATOM 828 OE2 GLU A 295 4.395 -9.526 12.543 1.00 0.00 O ATOM 0 H GLU A 295 0.689 -12.653 8.827 1.00 0.00 H new ATOM 0 HA GLU A 295 0.120 -10.141 10.255 1.00 0.00 H new ATOM 0 HB2 GLU A 295 1.368 -12.187 11.278 1.00 0.00 H new ATOM 0 HB3 GLU A 295 2.704 -11.726 10.242 1.00 0.00 H new ATOM 0 HG2 GLU A 295 1.595 -9.475 11.792 1.00 0.00 H new ATOM 0 HG3 GLU A 295 2.221 -10.768 12.794 1.00 0.00 H new ATOM 835 N ASN A 296 1.878 -10.532 7.556 1.00 0.00 N ATOM 836 CA ASN A 296 2.584 -9.827 6.492 1.00 0.00 C ATOM 837 C ASN A 296 1.776 -8.622 6.027 1.00 0.00 C ATOM 838 O ASN A 296 2.210 -7.478 6.171 1.00 0.00 O ATOM 839 CB ASN A 296 2.853 -10.768 5.316 1.00 0.00 C ATOM 840 CG ASN A 296 4.303 -11.206 5.246 1.00 0.00 C ATOM 841 OD1 ASN A 296 4.600 -12.393 5.123 1.00 0.00 O ATOM 842 ND2 ASN A 296 5.215 -10.244 5.327 1.00 0.00 N ATOM 0 H ASN A 296 1.636 -11.498 7.335 1.00 0.00 H new ATOM 0 HA ASN A 296 3.539 -9.477 6.884 1.00 0.00 H new ATOM 0 HB2 ASN A 296 2.215 -11.647 5.404 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.582 -10.269 4.386 1.00 0.00 H new ATOM 0 HD21 ASN A 296 6.207 -10.477 5.288 1.00 0.00 H new ATOM 0 HD22 ASN A 296 4.923 -9.272 5.428 1.00 0.00 H new ATOM 849 N ALA A 297 0.590 -8.884 5.485 1.00 0.00 N ATOM 850 CA ALA A 297 -0.287 -7.817 5.019 1.00 0.00 C ATOM 851 C ALA A 297 -0.521 -6.803 6.138 1.00 0.00 C ATOM 852 O ALA A 297 -0.634 -5.608 5.893 1.00 0.00 O ATOM 853 CB ALA A 297 -1.610 -8.394 4.539 1.00 0.00 C ATOM 0 H ALA A 297 0.216 -9.824 5.358 1.00 0.00 H new ATOM 0 HA ALA A 297 0.192 -7.308 4.182 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.255 -7.586 4.194 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.428 -9.089 3.719 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -2.096 -8.921 5.360 1.00 0.00 H new ATOM 859 N ASP A 298 -0.579 -7.293 7.376 1.00 0.00 N ATOM 860 CA ASP A 298 -0.782 -6.427 8.537 1.00 0.00 C ATOM 861 C ASP A 298 0.451 -5.567 8.771 1.00 0.00 C ATOM 862 O ASP A 298 0.355 -4.347 8.869 1.00 0.00 O ATOM 863 CB ASP A 298 -1.086 -7.261 9.782 1.00 0.00 C ATOM 864 CG ASP A 298 -2.383 -8.035 9.657 1.00 0.00 C ATOM 865 OD1 ASP A 298 -2.764 -8.376 8.517 1.00 0.00 O ATOM 866 OD2 ASP A 298 -3.019 -8.300 10.699 1.00 0.00 O ATOM 0 H ASP A 298 -0.488 -8.284 7.601 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.634 -5.777 8.339 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -0.266 -7.957 9.958 1.00 0.00 H new ATOM 0 HB3 ASP A 298 -1.140 -6.605 10.651 1.00 0.00 H new ATOM 871 N SER A 299 1.617 -6.202 8.836 1.00 0.00 N ATOM 872 CA SER A 299 2.860 -5.466 9.028 1.00 0.00 C ATOM 873 C SER A 299 2.962 -4.367 7.978 1.00 0.00 C ATOM 874 O SER A 299 3.569 -3.323 8.211 1.00 0.00 O ATOM 875 CB SER A 299 4.065 -6.404 8.931 1.00 0.00 C ATOM 876 OG SER A 299 5.066 -6.047 9.868 1.00 0.00 O ATOM 0 H SER A 299 1.727 -7.213 8.759 1.00 0.00 H new ATOM 0 HA SER A 299 2.858 -5.020 10.023 1.00 0.00 H new ATOM 0 HB2 SER A 299 3.746 -7.431 9.109 1.00 0.00 H new ATOM 0 HB3 SER A 299 4.477 -6.368 7.923 1.00 0.00 H new ATOM 0 HG SER A 299 5.824 -6.662 9.787 1.00 0.00 H new ATOM 882 N THR A 300 2.334 -4.608 6.827 1.00 0.00 N ATOM 883 CA THR A 300 2.324 -3.635 5.748 1.00 0.00 C ATOM 884 C THR A 300 1.655 -2.346 6.216 1.00 0.00 C ATOM 885 O THR A 300 1.994 -1.259 5.758 1.00 0.00 O ATOM 886 CB THR A 300 1.592 -4.202 4.533 1.00 0.00 C ATOM 887 OG1 THR A 300 2.386 -5.172 3.874 1.00 0.00 O ATOM 888 CG2 THR A 300 1.212 -3.152 3.518 1.00 0.00 C ATOM 0 H THR A 300 1.828 -5.470 6.623 1.00 0.00 H new ATOM 0 HA THR A 300 3.352 -3.414 5.461 1.00 0.00 H new ATOM 0 HB THR A 300 0.679 -4.645 4.930 1.00 0.00 H new ATOM 0 HG1 THR A 300 2.441 -5.980 4.426 1.00 0.00 H new ATOM 0 HG21 THR A 300 0.696 -3.624 2.682 1.00 0.00 H new ATOM 0 HG22 THR A 300 0.554 -2.418 3.983 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.111 -2.655 3.155 1.00 0.00 H new ATOM 896 N LEU A 301 0.707 -2.479 7.141 1.00 0.00 N ATOM 897 CA LEU A 301 0.002 -1.321 7.682 1.00 0.00 C ATOM 898 C LEU A 301 0.997 -0.404 8.372 1.00 0.00 C ATOM 899 O LEU A 301 1.012 0.806 8.149 1.00 0.00 O ATOM 900 CB LEU A 301 -1.087 -1.769 8.670 1.00 0.00 C ATOM 901 CG LEU A 301 -2.513 -1.330 8.327 1.00 0.00 C ATOM 902 CD1 LEU A 301 -3.464 -1.712 9.450 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.570 0.169 8.058 1.00 0.00 C ATOM 0 H LEU A 301 0.411 -3.374 7.530 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.480 -0.781 6.867 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.067 -2.857 8.736 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.836 -1.385 9.659 1.00 0.00 H new ATOM 0 HG LEU A 301 -2.823 -1.845 7.418 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -4.475 -1.395 9.194 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -3.447 -2.793 9.589 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -3.152 -1.223 10.373 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.593 0.457 7.817 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -2.240 0.711 8.945 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -1.917 0.413 7.220 1.00 0.00 H new ATOM 915 N ASN A 302 1.848 -1.008 9.190 1.00 0.00 N ATOM 916 CA ASN A 302 2.881 -0.273 9.898 1.00 0.00 C ATOM 917 C ASN A 302 4.009 0.074 8.938 1.00 0.00 C ATOM 918 O ASN A 302 4.726 1.058 9.127 1.00 0.00 O ATOM 919 CB ASN A 302 3.417 -1.113 11.059 1.00 0.00 C ATOM 920 CG ASN A 302 2.662 -0.866 12.350 1.00 0.00 C ATOM 921 OD1 ASN A 302 2.200 -1.803 13.003 1.00 0.00 O ATOM 922 ND2 ASN A 302 2.531 0.401 12.727 1.00 0.00 N ATOM 0 H ASN A 302 1.841 -2.010 9.379 1.00 0.00 H new ATOM 0 HA ASN A 302 2.457 0.648 10.299 1.00 0.00 H new ATOM 0 HB2 ASN A 302 3.351 -2.170 10.800 1.00 0.00 H new ATOM 0 HB3 ASN A 302 4.473 -0.887 11.210 1.00 0.00 H new ATOM 0 HD21 ASN A 302 2.032 0.628 13.587 1.00 0.00 H new ATOM 0 HD22 ASN A 302 2.929 1.147 12.156 1.00 0.00 H new ATOM 929 N ARG A 303 4.151 -0.745 7.901 1.00 0.00 N ATOM 930 CA ARG A 303 5.178 -0.540 6.895 1.00 0.00 C ATOM 931 C ARG A 303 4.792 0.607 5.958 1.00 0.00 C ATOM 932 O ARG A 303 5.635 1.424 5.592 1.00 0.00 O ATOM 933 CB ARG A 303 5.404 -1.837 6.115 1.00 0.00 C ATOM 934 CG ARG A 303 6.834 -2.346 6.183 1.00 0.00 C ATOM 935 CD ARG A 303 6.999 -3.395 7.271 1.00 0.00 C ATOM 936 NE ARG A 303 8.066 -4.344 6.964 1.00 0.00 N ATOM 937 CZ ARG A 303 7.960 -5.309 6.053 1.00 0.00 C ATOM 938 NH1 ARG A 303 6.840 -5.451 5.354 1.00 0.00 N ATOM 939 NH2 ARG A 303 8.976 -6.133 5.840 1.00 0.00 N ATOM 0 H ARG A 303 3.562 -1.561 7.738 1.00 0.00 H new ATOM 0 HA ARG A 303 6.110 -0.265 7.388 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.735 -2.605 6.502 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.134 -1.675 5.071 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.117 -2.771 5.220 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.510 -1.512 6.374 1.00 0.00 H new ATOM 0 HD2 ARG A 303 7.215 -2.902 8.219 1.00 0.00 H new ATOM 0 HD3 ARG A 303 6.061 -3.935 7.399 1.00 0.00 H new ATOM 0 HE ARG A 303 8.944 -4.263 7.478 1.00 0.00 H new ATOM 0 HH11 ARG A 303 6.056 -4.819 5.514 1.00 0.00 H new ATOM 0 HH12 ARG A 303 6.764 -6.192 4.657 1.00 0.00 H new ATOM 0 HH21 ARG A 303 9.839 -6.028 6.374 1.00 0.00 H new ATOM 0 HH22 ARG A 303 8.895 -6.873 5.142 1.00 0.00 H new ATOM 953 N LEU A 304 3.511 0.684 5.594 1.00 0.00 N ATOM 954 CA LEU A 304 3.028 1.755 4.727 1.00 0.00 C ATOM 955 C LEU A 304 3.260 3.102 5.388 1.00 0.00 C ATOM 956 O LEU A 304 3.438 4.113 4.709 1.00 0.00 O ATOM 957 CB LEU A 304 1.564 1.536 4.367 1.00 0.00 C ATOM 958 CG LEU A 304 1.354 0.987 2.950 1.00 0.00 C ATOM 959 CD1 LEU A 304 0.549 -0.302 2.980 1.00 0.00 C ATOM 960 CD2 LEU A 304 0.692 2.022 2.049 1.00 0.00 C ATOM 0 H LEU A 304 2.794 0.020 5.885 1.00 0.00 H new ATOM 0 HA LEU A 304 3.590 1.743 3.793 1.00 0.00 H new ATOM 0 HB2 LEU A 304 1.122 0.845 5.084 1.00 0.00 H new ATOM 0 HB3 LEU A 304 1.030 2.481 4.464 1.00 0.00 H new ATOM 0 HG LEU A 304 2.335 0.763 2.532 1.00 0.00 H new ATOM 0 HD11 LEU A 304 0.414 -0.670 1.963 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.080 -1.049 3.569 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -0.426 -0.112 3.429 1.00 0.00 H new ATOM 0 HD21 LEU A 304 0.557 1.603 1.052 1.00 0.00 H new ATOM 0 HD22 LEU A 304 -0.279 2.296 2.462 1.00 0.00 H new ATOM 0 HD23 LEU A 304 1.324 2.908 1.988 1.00 0.00 H new ATOM 972 N LYS A 305 3.327 3.108 6.717 1.00 0.00 N ATOM 973 CA LYS A 305 3.616 4.336 7.437 1.00 0.00 C ATOM 974 C LYS A 305 5.056 4.750 7.131 1.00 0.00 C ATOM 975 O LYS A 305 5.429 5.915 7.277 1.00 0.00 O ATOM 976 CB LYS A 305 3.422 4.140 8.942 1.00 0.00 C ATOM 977 CG LYS A 305 2.658 5.274 9.607 1.00 0.00 C ATOM 978 CD LYS A 305 1.998 4.821 10.900 1.00 0.00 C ATOM 979 CE LYS A 305 0.554 5.291 10.984 1.00 0.00 C ATOM 980 NZ LYS A 305 -0.280 4.378 11.814 1.00 0.00 N ATOM 0 H LYS A 305 3.187 2.287 7.306 1.00 0.00 H new ATOM 0 HA LYS A 305 2.929 5.119 7.116 1.00 0.00 H new ATOM 0 HB2 LYS A 305 2.890 3.204 9.113 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.398 4.043 9.417 1.00 0.00 H new ATOM 0 HG2 LYS A 305 3.339 6.099 9.815 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.898 5.652 8.923 1.00 0.00 H new ATOM 0 HD2 LYS A 305 2.032 3.733 10.965 1.00 0.00 H new ATOM 0 HD3 LYS A 305 2.558 5.209 11.751 1.00 0.00 H new ATOM 0 HE2 LYS A 305 0.523 6.295 11.406 1.00 0.00 H new ATOM 0 HE3 LYS A 305 0.134 5.354 9.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -1.257 4.733 11.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -0.272 3.425 11.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 0.105 4.337 12.779 1.00 0.00 H new ATOM 994 N MET A 306 5.852 3.772 6.685 1.00 0.00 N ATOM 995 CA MET A 306 7.248 3.996 6.326 1.00 0.00 C ATOM 996 C MET A 306 7.336 4.718 4.990 1.00 0.00 C ATOM 997 O MET A 306 8.233 5.531 4.763 1.00 0.00 O ATOM 998 CB MET A 306 7.991 2.656 6.233 1.00 0.00 C ATOM 999 CG MET A 306 9.504 2.804 6.201 1.00 0.00 C ATOM 1000 SD MET A 306 10.149 3.656 7.653 1.00 0.00 S ATOM 1001 CE MET A 306 10.312 5.324 7.023 1.00 0.00 C ATOM 0 H MET A 306 5.543 2.807 6.565 1.00 0.00 H new ATOM 0 HA MET A 306 7.711 4.611 7.098 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.712 2.035 7.084 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.666 2.131 5.335 1.00 0.00 H new ATOM 0 HG2 MET A 306 9.960 1.817 6.131 1.00 0.00 H new ATOM 0 HG3 MET A 306 9.793 3.353 5.304 1.00 0.00 H new ATOM 0 HE1 MET A 306 11.187 5.797 7.468 1.00 0.00 H new ATOM 0 HE2 MET A 306 10.427 5.294 5.940 1.00 0.00 H new ATOM 0 HE3 MET A 306 9.421 5.898 7.277 1.00 0.00 H new ATOM 1011 N ALA A 307 6.396 4.404 4.108 1.00 0.00 N ATOM 1012 CA ALA A 307 6.349 5.002 2.783 1.00 0.00 C ATOM 1013 C ALA A 307 5.864 6.449 2.837 1.00 0.00 C ATOM 1014 O ALA A 307 6.095 7.222 1.906 1.00 0.00 O ATOM 1015 CB ALA A 307 5.454 4.171 1.877 1.00 0.00 C ATOM 0 H ALA A 307 5.650 3.732 4.290 1.00 0.00 H new ATOM 0 HA ALA A 307 7.361 5.014 2.377 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.421 4.622 0.885 1.00 0.00 H new ATOM 0 HB2 ALA A 307 5.851 3.159 1.802 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.447 4.136 2.293 1.00 0.00 H new ATOM 1021 N GLY A 308 5.188 6.813 3.924 1.00 0.00 N ATOM 1022 CA GLY A 308 4.682 8.167 4.060 1.00 0.00 C ATOM 1023 C GLY A 308 3.475 8.409 3.180 1.00 0.00 C ATOM 1024 O GLY A 308 3.566 9.089 2.157 1.00 0.00 O ATOM 0 H GLY A 308 4.983 6.196 4.710 1.00 0.00 H new ATOM 0 HA2 GLY A 308 4.416 8.352 5.101 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.468 8.876 3.801 1.00 0.00 H new ATOM 1028 N HIS A 309 2.343 7.833 3.569 1.00 0.00 N ATOM 1029 CA HIS A 309 1.112 7.968 2.799 1.00 0.00 C ATOM 1030 C HIS A 309 -0.079 8.295 3.697 1.00 0.00 C ATOM 1031 O HIS A 309 0.009 8.195 4.921 1.00 0.00 O ATOM 1032 CB HIS A 309 0.834 6.662 2.054 1.00 0.00 C ATOM 1033 CG HIS A 309 0.154 5.642 2.911 1.00 0.00 C ATOM 1034 ND1 HIS A 309 -1.170 5.752 3.267 1.00 0.00 N ATOM 1035 CD2 HIS A 309 0.620 4.528 3.534 1.00 0.00 C ATOM 1036 CE1 HIS A 309 -1.492 4.765 4.072 1.00 0.00 C ATOM 1037 NE2 HIS A 309 -0.431 4.006 4.252 1.00 0.00 N ATOM 0 H HIS A 309 2.252 7.268 4.413 1.00 0.00 H new ATOM 0 HA HIS A 309 1.244 8.789 2.094 1.00 0.00 H new ATOM 0 HB2 HIS A 309 0.213 6.871 1.183 1.00 0.00 H new ATOM 0 HB3 HIS A 309 1.774 6.252 1.685 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.622 4.129 3.477 1.00 0.00 H new ATOM 0 HE1 HIS A 309 -2.465 4.603 4.513 1.00 0.00 H new ATOM 0 HE2 HIS A 309 -0.394 3.167 4.830 1.00 0.00 H new ATOM 1046 N THR A 310 -1.201 8.670 3.080 1.00 0.00 N ATOM 1047 CA THR A 310 -2.413 8.987 3.836 1.00 0.00 C ATOM 1048 C THR A 310 -3.594 8.085 3.442 1.00 0.00 C ATOM 1049 O THR A 310 -4.229 8.312 2.414 1.00 0.00 O ATOM 1050 CB THR A 310 -2.792 10.455 3.629 1.00 0.00 C ATOM 1051 OG1 THR A 310 -1.646 11.285 3.699 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.791 10.964 4.646 1.00 0.00 C ATOM 0 H THR A 310 -1.295 8.761 2.068 1.00 0.00 H new ATOM 0 HA THR A 310 -2.196 8.806 4.889 1.00 0.00 H new ATOM 0 HB THR A 310 -3.250 10.498 2.641 1.00 0.00 H new ATOM 0 HG1 THR A 310 -1.910 12.219 3.562 1.00 0.00 H new ATOM 0 HG21 THR A 310 -4.016 12.011 4.442 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.707 10.376 4.582 1.00 0.00 H new ATOM 0 HG23 THR A 310 -3.370 10.872 5.647 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.893 7.080 4.290 1.00 0.00 N ATOM 1061 CA ASN A 311 -5.019 6.141 4.074 1.00 0.00 C ATOM 1062 C ASN A 311 -4.552 4.763 3.590 1.00 0.00 C ATOM 1063 O ASN A 311 -4.056 4.618 2.475 1.00 0.00 O ATOM 1064 CB ASN A 311 -6.048 6.712 3.089 1.00 0.00 C ATOM 1065 CG ASN A 311 -7.393 6.018 3.190 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.688 5.095 2.430 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -8.219 6.460 4.132 1.00 0.00 N ATOM 0 H ASN A 311 -3.364 6.895 5.142 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.491 6.013 5.048 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -6.177 7.777 3.280 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -5.667 6.614 2.072 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -9.138 6.032 4.247 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -7.935 7.228 4.741 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.732 3.750 4.445 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.347 2.367 4.122 1.00 0.00 C ATOM 1076 C CYS A 312 -5.339 1.373 4.725 1.00 0.00 C ATOM 1077 O CYS A 312 -5.942 1.653 5.761 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.942 2.056 4.651 1.00 0.00 C ATOM 1079 SG CYS A 312 -2.578 2.781 6.270 1.00 0.00 S ATOM 0 H CYS A 312 -5.144 3.861 5.371 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.353 2.269 3.036 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.822 0.975 4.715 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.207 2.417 3.931 1.00 0.00 H new ATOM 0 HG CYS A 312 -1.370 2.459 6.628 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.498 0.205 4.090 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.415 -0.807 4.605 1.00 0.00 C ATOM 1087 C ILE A 313 -6.183 -2.150 3.930 1.00 0.00 C ATOM 1088 O ILE A 313 -6.392 -2.295 2.725 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.892 -0.405 4.418 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -8.100 0.275 3.062 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.347 0.500 5.555 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.492 0.840 2.868 1.00 0.00 C ATOM 0 H ILE A 313 -5.010 -0.056 3.233 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.209 -0.890 5.672 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.500 -1.309 4.439 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.373 1.080 2.955 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.897 -0.446 2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.392 0.774 5.406 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.241 -0.026 6.504 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.734 1.401 5.570 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.562 1.305 1.885 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -10.225 0.036 2.942 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -9.693 1.586 3.637 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.760 -3.133 4.713 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.511 -4.464 4.183 1.00 0.00 C ATOM 1106 C ARG A 314 -6.817 -5.124 3.794 1.00 0.00 C ATOM 1107 O ARG A 314 -7.707 -5.312 4.623 1.00 0.00 O ATOM 1108 CB ARG A 314 -4.746 -5.325 5.207 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.368 -5.797 4.738 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.720 -4.860 3.714 1.00 0.00 C ATOM 1111 NE ARG A 314 -3.004 -3.447 3.958 1.00 0.00 N ATOM 1112 CZ ARG A 314 -2.521 -2.764 4.981 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -1.780 -3.370 5.892 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -2.786 -1.470 5.097 1.00 0.00 N ATOM 0 H ARG A 314 -5.583 -3.034 5.713 1.00 0.00 H new ATOM 0 HA ARG A 314 -4.890 -4.372 3.292 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.626 -4.752 6.126 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.351 -6.198 5.452 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -2.710 -5.889 5.602 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.462 -6.791 4.301 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.641 -5.013 3.725 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -3.070 -5.126 2.717 1.00 0.00 H new ATOM 0 HE ARG A 314 -3.611 -2.959 3.299 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -1.580 -4.367 5.806 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -1.408 -2.841 6.681 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -3.362 -1.003 4.397 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -2.414 -0.942 5.886 1.00 0.00 H new ATOM 1128 N LEU A 315 -6.921 -5.474 2.521 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.115 -6.122 2.010 1.00 0.00 C ATOM 1130 C LEU A 315 -7.873 -7.614 1.866 1.00 0.00 C ATOM 1131 O LEU A 315 -7.096 -8.049 1.018 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.531 -5.533 0.667 1.00 0.00 C ATOM 1133 CG LEU A 315 -9.819 -4.710 0.688 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.593 -3.379 1.390 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.326 -4.493 -0.730 1.00 0.00 C ATOM 0 H LEU A 315 -6.192 -5.319 1.824 1.00 0.00 H new ATOM 0 HA LEU A 315 -8.923 -5.951 2.721 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.722 -4.902 0.299 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.651 -6.347 -0.047 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.576 -5.261 1.246 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -10.521 -2.808 1.395 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -9.272 -3.559 2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -8.823 -2.816 0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.244 -3.906 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -9.571 -3.960 -1.309 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -10.526 -5.458 -1.196 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.527 -8.391 2.707 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.363 -9.837 2.686 1.00 0.00 C ATOM 1149 C ALA A 316 -9.350 -10.505 1.739 1.00 0.00 C ATOM 1150 O ALA A 316 -10.520 -10.127 1.670 1.00 0.00 O ATOM 1151 CB ALA A 316 -8.496 -10.400 4.089 1.00 0.00 C ATOM 0 H ALA A 316 -9.177 -8.049 3.414 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.362 -10.054 2.312 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -8.371 -11.482 4.060 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -7.730 -9.964 4.730 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -9.482 -10.159 4.486 1.00 0.00 H new ATOM 1157 N ALA A 317 -8.863 -11.503 1.013 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.684 -12.239 0.063 1.00 0.00 C ATOM 1159 C ALA A 317 -10.804 -12.994 0.773 1.00 0.00 C ATOM 1160 O ALA A 317 -11.874 -13.214 0.206 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.814 -13.197 -0.736 1.00 0.00 C ATOM 0 H ALA A 317 -7.896 -11.822 1.066 1.00 0.00 H new ATOM 0 HA ALA A 317 -10.147 -11.526 -0.619 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.434 -13.745 -1.446 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -8.054 -12.633 -1.278 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.330 -13.900 -0.058 1.00 0.00 H new