USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 887 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 335 LYS NZ :NH3+ -165:sc= 0.445! (180deg=-1.01!) USER MOD Set 1.2: A 338 GLN : amide:sc= 0.762 K(o=1.2,f=-3.5) USER MOD Set 2.1: A 313 TYR OH : rot 174:sc= 0.104 USER MOD Set 2.2: A 326 ASN : amide:sc= 0.0597 K(o=0.16,f=-1.7) USER MOD Single : A 283 THR OG1 : rot -30:sc= 0.249 USER MOD Single : A 284 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 297 THR OG1 : rot 180:sc= 0.0124 USER MOD Single : A 299 LYS NZ :NH3+ 161:sc= -0.0169 (180deg=-0.241) USER MOD Single : A 302 HIS : no HD1:sc= -0.818 X(o=-0.82,f=-0.84) USER MOD Single : A 304 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 305 LYS NZ :NH3+ -120:sc= -0.949 (180deg=-3.35!) USER MOD Single : A 307 THR OG1 : rot -160:sc= 0 USER MOD Single : A 311 MET CE :methyl -156:sc= -1.75! (180deg=-2.54!) USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 318 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0955) USER MOD Single : A 319 ASN :FLIP amide:sc=-0.00531 F(o=-2!,f=-0.0053) USER MOD Single : A 321 LYS NZ :NH3+ -173:sc= -0.013 (180deg=-0.098) USER MOD Single : A 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 327 THR OG1 : rot 180:sc= 0 USER MOD Single : A 328 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 330 LYS NZ :NH3+ 162:sc= -0.0496 (180deg=-0.374) USER MOD Single : A 343 LYS NZ :NH3+ 180:sc= 1.59 (180deg=1.59) USER MOD Single : A 352 MET CE :methyl -148:sc= -0.2 (180deg=-0.822) USER MOD Single : A 366 TYR OH : rot 180:sc= -2.33! USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 370 LYS NZ :NH3+ 164:sc= -0.0129 (180deg=-0.196) USER MOD Single : A 371 GLN :FLIP amide:sc= -0.101 F(o=-1,f=-0.1) USER MOD Single : A 379 ASN :FLIP amide:sc= -0.0245 F(o=-0.99,f=-0.025) USER MOD Single : A 380 SER OG : rot 96:sc= 0.223 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 LYS NZ :NH3+ -169:sc= 1.27 (180deg=1.1) USER MOD Single : A 390 SER OG : rot -5:sc= 1.05 USER MOD Single : A 391 MET CE :methyl 172:sc= -3.52! (180deg=-3.72) USER MOD Single : A 392 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.054) USER MOD ----------------------------------------------------------------- ATOM 105 N THR A 283 -3.940 -14.201 0.669 1.00 0.54 N ATOM 106 CA THR A 283 -2.812 -13.651 -0.046 1.00 0.50 C ATOM 107 C THR A 283 -2.857 -14.037 -1.525 1.00 0.56 C ATOM 108 O THR A 283 -3.097 -15.196 -1.872 1.00 0.71 O ATOM 109 CB THR A 283 -1.490 -14.126 0.583 1.00 0.64 C ATOM 110 OG1 THR A 283 -1.537 -15.542 0.802 1.00 0.76 O ATOM 111 CG2 THR A 283 -1.222 -13.413 1.901 1.00 0.71 C ATOM 0 HA THR A 283 -2.868 -12.565 0.027 1.00 0.50 H new ATOM 0 HB THR A 283 -0.680 -13.888 -0.107 1.00 0.64 H new ATOM 0 HG1 THR A 283 -2.462 -15.816 0.971 1.00 0.76 H new ATOM 0 HG21 THR A 283 -0.282 -13.769 2.322 1.00 0.71 H new ATOM 0 HG22 THR A 283 -1.159 -12.339 1.727 1.00 0.71 H new ATOM 0 HG23 THR A 283 -2.034 -13.620 2.598 1.00 0.71 H new ATOM 119 N LYS A 284 -2.656 -13.058 -2.390 1.00 0.52 N ATOM 120 CA LYS A 284 -2.600 -13.311 -3.825 1.00 0.58 C ATOM 121 C LYS A 284 -1.520 -12.466 -4.485 1.00 0.51 C ATOM 122 O LYS A 284 -1.246 -11.342 -4.056 1.00 0.47 O ATOM 123 CB LYS A 284 -3.962 -13.080 -4.491 1.00 0.73 C ATOM 124 CG LYS A 284 -4.468 -11.648 -4.447 1.00 0.87 C ATOM 125 CD LYS A 284 -5.754 -11.505 -5.248 1.00 1.49 C ATOM 126 CE LYS A 284 -6.893 -12.295 -4.624 1.00 1.78 C ATOM 127 NZ LYS A 284 -7.973 -12.588 -5.603 1.00 2.06 N ATOM 0 H LYS A 284 -2.529 -12.081 -2.127 1.00 0.52 H new ATOM 0 HA LYS A 284 -2.341 -14.361 -3.964 1.00 0.58 H new ATOM 0 HB2 LYS A 284 -3.897 -13.394 -5.533 1.00 0.73 H new ATOM 0 HB3 LYS A 284 -4.698 -13.724 -4.009 1.00 0.73 H new ATOM 0 HG2 LYS A 284 -4.643 -11.351 -3.413 1.00 0.87 H new ATOM 0 HG3 LYS A 284 -3.708 -10.977 -4.847 1.00 0.87 H new ATOM 0 HD2 LYS A 284 -6.031 -10.452 -5.308 1.00 1.49 H new ATOM 0 HD3 LYS A 284 -5.588 -11.850 -6.269 1.00 1.49 H new ATOM 0 HE2 LYS A 284 -6.506 -13.231 -4.221 1.00 1.78 H new ATOM 0 HE3 LYS A 284 -7.306 -11.734 -3.786 1.00 1.78 H new ATOM 0 HZ1 LYS A 284 -8.729 -13.128 -5.135 1.00 2.06 H new ATOM 0 HZ2 LYS A 284 -8.361 -11.695 -5.969 1.00 2.06 H new ATOM 0 HZ3 LYS A 284 -7.586 -13.146 -6.390 1.00 2.06 H new ATOM 141 N LEU A 285 -0.904 -13.035 -5.511 1.00 0.61 N ATOM 142 CA LEU A 285 0.212 -12.404 -6.199 1.00 0.63 C ATOM 143 C LEU A 285 -0.272 -11.523 -7.349 1.00 0.67 C ATOM 144 O LEU A 285 -1.068 -11.956 -8.182 1.00 0.75 O ATOM 145 CB LEU A 285 1.158 -13.480 -6.735 1.00 0.76 C ATOM 146 CG LEU A 285 2.503 -12.969 -7.250 1.00 0.84 C ATOM 147 CD1 LEU A 285 3.354 -12.486 -6.089 1.00 0.78 C ATOM 148 CD2 LEU A 285 3.230 -14.053 -8.031 1.00 0.98 C ATOM 0 H LEU A 285 -1.164 -13.946 -5.889 1.00 0.61 H new ATOM 0 HA LEU A 285 0.739 -11.770 -5.486 1.00 0.63 H new ATOM 0 HB2 LEU A 285 1.343 -14.205 -5.943 1.00 0.76 H new ATOM 0 HB3 LEU A 285 0.656 -14.012 -7.543 1.00 0.76 H new ATOM 0 HG LEU A 285 2.321 -12.133 -7.925 1.00 0.84 H new ATOM 0 HD11 LEU A 285 4.311 -12.124 -6.465 1.00 0.78 H new ATOM 0 HD12 LEU A 285 2.838 -11.678 -5.571 1.00 0.78 H new ATOM 0 HD13 LEU A 285 3.525 -13.310 -5.396 1.00 0.78 H new ATOM 0 HD21 LEU A 285 4.185 -13.666 -8.388 1.00 0.98 H new ATOM 0 HD22 LEU A 285 3.406 -14.912 -7.384 1.00 0.98 H new ATOM 0 HD23 LEU A 285 2.621 -14.358 -8.882 1.00 0.98 H new ATOM 160 N LEU A 286 0.206 -10.290 -7.375 1.00 0.65 N ATOM 161 CA LEU A 286 -0.097 -9.366 -8.460 1.00 0.71 C ATOM 162 C LEU A 286 1.116 -9.204 -9.371 1.00 0.77 C ATOM 163 O LEU A 286 2.071 -9.977 -9.281 1.00 0.80 O ATOM 164 CB LEU A 286 -0.502 -7.998 -7.909 1.00 0.64 C ATOM 165 CG LEU A 286 -1.799 -7.971 -7.098 1.00 0.64 C ATOM 166 CD1 LEU A 286 -2.099 -6.557 -6.626 1.00 0.63 C ATOM 167 CD2 LEU A 286 -2.962 -8.507 -7.921 1.00 0.76 C ATOM 0 H LEU A 286 0.811 -9.902 -6.651 1.00 0.65 H new ATOM 0 HA LEU A 286 -0.928 -9.779 -9.032 1.00 0.71 H new ATOM 0 HB2 LEU A 286 0.307 -7.625 -7.280 1.00 0.64 H new ATOM 0 HB3 LEU A 286 -0.602 -7.305 -8.744 1.00 0.64 H new ATOM 0 HG LEU A 286 -1.669 -8.613 -6.227 1.00 0.64 H new ATOM 0 HD11 LEU A 286 -3.025 -6.554 -6.051 1.00 0.63 H new ATOM 0 HD12 LEU A 286 -1.281 -6.201 -5.999 1.00 0.63 H new ATOM 0 HD13 LEU A 286 -2.207 -5.900 -7.489 1.00 0.63 H new ATOM 0 HD21 LEU A 286 -3.874 -8.478 -7.324 1.00 0.76 H new ATOM 0 HD22 LEU A 286 -3.092 -7.892 -8.811 1.00 0.76 H new ATOM 0 HD23 LEU A 286 -2.755 -9.535 -8.217 1.00 0.76 H new ATOM 179 N GLU A 287 1.065 -8.187 -10.234 1.00 0.84 N ATOM 180 CA GLU A 287 2.144 -7.896 -11.179 1.00 0.92 C ATOM 181 C GLU A 287 3.502 -7.819 -10.476 1.00 0.77 C ATOM 182 O GLU A 287 3.618 -7.296 -9.364 1.00 0.64 O ATOM 183 CB GLU A 287 1.856 -6.582 -11.914 1.00 1.05 C ATOM 184 CG GLU A 287 2.873 -6.224 -12.974 1.00 1.39 C ATOM 185 CD GLU A 287 3.045 -7.299 -14.030 1.00 1.96 C ATOM 186 OE1 GLU A 287 3.743 -8.297 -13.761 1.00 2.48 O ATOM 187 OE2 GLU A 287 2.455 -7.166 -15.125 1.00 2.64 O ATOM 0 H GLU A 287 0.276 -7.544 -10.297 1.00 0.84 H new ATOM 0 HA GLU A 287 2.188 -8.713 -11.900 1.00 0.92 H new ATOM 0 HB2 GLU A 287 0.872 -6.648 -12.379 1.00 1.05 H new ATOM 0 HB3 GLU A 287 1.810 -5.774 -11.184 1.00 1.05 H new ATOM 0 HG2 GLU A 287 2.571 -5.295 -13.458 1.00 1.39 H new ATOM 0 HG3 GLU A 287 3.835 -6.037 -12.496 1.00 1.39 H new ATOM 194 N GLY A 288 4.524 -8.329 -11.149 1.00 0.88 N ATOM 195 CA GLY A 288 5.840 -8.418 -10.557 1.00 0.87 C ATOM 196 C GLY A 288 5.898 -9.500 -9.504 1.00 0.98 C ATOM 197 O GLY A 288 6.039 -10.684 -9.823 1.00 1.84 O ATOM 0 H GLY A 288 4.462 -8.685 -12.103 1.00 0.88 H new ATOM 0 HA2 GLY A 288 6.577 -8.624 -11.333 1.00 0.87 H new ATOM 0 HA3 GLY A 288 6.106 -7.460 -10.111 1.00 0.87 H new ATOM 201 N GLY A 289 5.797 -9.098 -8.249 1.00 0.64 N ATOM 202 CA GLY A 289 5.713 -10.044 -7.162 1.00 0.58 C ATOM 203 C GLY A 289 4.990 -9.432 -5.985 1.00 0.48 C ATOM 204 O GLY A 289 5.297 -9.724 -4.832 1.00 0.48 O ATOM 0 H GLY A 289 5.772 -8.119 -7.962 1.00 0.64 H new ATOM 0 HA2 GLY A 289 5.189 -10.941 -7.492 1.00 0.58 H new ATOM 0 HA3 GLY A 289 6.714 -10.352 -6.861 1.00 0.58 H new ATOM 208 N ILE A 290 4.033 -8.564 -6.289 1.00 0.42 N ATOM 209 CA ILE A 290 3.305 -7.831 -5.263 1.00 0.36 C ATOM 210 C ILE A 290 2.308 -8.744 -4.566 1.00 0.36 C ATOM 211 O ILE A 290 1.472 -9.370 -5.212 1.00 0.40 O ATOM 212 CB ILE A 290 2.562 -6.613 -5.859 1.00 0.34 C ATOM 213 CG1 ILE A 290 3.556 -5.665 -6.537 1.00 0.36 C ATOM 214 CG2 ILE A 290 1.777 -5.880 -4.777 1.00 0.32 C ATOM 215 CD1 ILE A 290 2.893 -4.508 -7.253 1.00 0.37 C ATOM 0 H ILE A 290 3.743 -8.350 -7.243 1.00 0.42 H new ATOM 0 HA ILE A 290 4.034 -7.469 -4.538 1.00 0.36 H new ATOM 0 HB ILE A 290 1.856 -6.971 -6.608 1.00 0.34 H new ATOM 0 HG12 ILE A 290 4.242 -5.273 -5.786 1.00 0.36 H new ATOM 0 HG13 ILE A 290 4.155 -6.229 -7.252 1.00 0.36 H new ATOM 0 HG21 ILE A 290 1.261 -5.026 -5.217 1.00 0.32 H new ATOM 0 HG22 ILE A 290 1.046 -6.557 -4.336 1.00 0.32 H new ATOM 0 HG23 ILE A 290 2.462 -5.531 -4.004 1.00 0.32 H new ATOM 0 HD11 ILE A 290 3.656 -3.878 -7.710 1.00 0.37 H new ATOM 0 HD12 ILE A 290 2.228 -4.892 -8.027 1.00 0.37 H new ATOM 0 HD13 ILE A 290 2.317 -3.920 -6.539 1.00 0.37 H new ATOM 227 N ILE A 291 2.413 -8.828 -3.254 1.00 0.35 N ATOM 228 CA ILE A 291 1.527 -9.672 -2.472 1.00 0.37 C ATOM 229 C ILE A 291 0.492 -8.809 -1.762 1.00 0.34 C ATOM 230 O ILE A 291 0.830 -7.767 -1.205 1.00 0.36 O ATOM 231 CB ILE A 291 2.308 -10.485 -1.419 1.00 0.46 C ATOM 232 CG1 ILE A 291 3.608 -11.026 -2.025 1.00 0.60 C ATOM 233 CG2 ILE A 291 1.446 -11.624 -0.885 1.00 0.60 C ATOM 234 CD1 ILE A 291 4.429 -11.859 -1.062 1.00 0.93 C ATOM 0 H ILE A 291 3.106 -8.320 -2.704 1.00 0.35 H new ATOM 0 HA ILE A 291 1.038 -10.367 -3.155 1.00 0.37 H new ATOM 0 HB ILE A 291 2.564 -9.830 -0.586 1.00 0.46 H new ATOM 0 HG12 ILE A 291 3.367 -11.630 -2.900 1.00 0.60 H new ATOM 0 HG13 ILE A 291 4.212 -10.188 -2.373 1.00 0.60 H new ATOM 0 HG21 ILE A 291 2.009 -12.190 -0.143 1.00 0.60 H new ATOM 0 HG22 ILE A 291 0.547 -11.215 -0.424 1.00 0.60 H new ATOM 0 HG23 ILE A 291 1.164 -12.283 -1.706 1.00 0.60 H new ATOM 0 HD11 ILE A 291 5.333 -12.207 -1.561 1.00 0.93 H new ATOM 0 HD12 ILE A 291 4.702 -11.253 -0.198 1.00 0.93 H new ATOM 0 HD13 ILE A 291 3.843 -12.717 -0.733 1.00 0.93 H new ATOM 246 N ILE A 292 -0.762 -9.231 -1.769 1.00 0.34 N ATOM 247 CA ILE A 292 -1.806 -8.468 -1.103 1.00 0.36 C ATOM 248 C ILE A 292 -2.687 -9.373 -0.251 1.00 0.41 C ATOM 249 O ILE A 292 -3.055 -10.470 -0.668 1.00 0.43 O ATOM 250 CB ILE A 292 -2.690 -7.676 -2.098 1.00 0.38 C ATOM 251 CG1 ILE A 292 -3.271 -8.599 -3.172 1.00 0.41 C ATOM 252 CG2 ILE A 292 -1.896 -6.544 -2.734 1.00 0.39 C ATOM 253 CD1 ILE A 292 -4.301 -7.926 -4.056 1.00 0.48 C ATOM 0 H ILE A 292 -1.080 -10.087 -2.223 1.00 0.34 H new ATOM 0 HA ILE A 292 -1.295 -7.749 -0.462 1.00 0.36 H new ATOM 0 HB ILE A 292 -3.522 -7.244 -1.541 1.00 0.38 H new ATOM 0 HG12 ILE A 292 -2.459 -8.974 -3.795 1.00 0.41 H new ATOM 0 HG13 ILE A 292 -3.728 -9.463 -2.689 1.00 0.41 H new ATOM 0 HG21 ILE A 292 -2.533 -5.999 -3.430 1.00 0.39 H new ATOM 0 HG22 ILE A 292 -1.544 -5.866 -1.957 1.00 0.39 H new ATOM 0 HG23 ILE A 292 -1.042 -6.956 -3.271 1.00 0.39 H new ATOM 0 HD11 ILE A 292 -4.669 -8.639 -4.793 1.00 0.48 H new ATOM 0 HD12 ILE A 292 -5.132 -7.575 -3.444 1.00 0.48 H new ATOM 0 HD13 ILE A 292 -3.844 -7.079 -4.567 1.00 0.48 H new ATOM 265 N GLU A 293 -3.002 -8.893 0.943 1.00 0.46 N ATOM 266 CA GLU A 293 -3.865 -9.611 1.872 1.00 0.51 C ATOM 267 C GLU A 293 -4.808 -8.630 2.561 1.00 0.43 C ATOM 268 O GLU A 293 -4.430 -7.493 2.829 1.00 0.43 O ATOM 269 CB GLU A 293 -3.027 -10.363 2.910 1.00 0.60 C ATOM 270 CG GLU A 293 -2.115 -9.461 3.720 1.00 1.21 C ATOM 271 CD GLU A 293 -1.424 -10.190 4.850 1.00 1.53 C ATOM 272 OE1 GLU A 293 -2.109 -10.558 5.821 1.00 2.31 O ATOM 273 OE2 GLU A 293 -0.191 -10.362 4.789 1.00 1.58 O ATOM 0 H GLU A 293 -2.668 -7.996 1.296 1.00 0.46 H new ATOM 0 HA GLU A 293 -4.454 -10.340 1.316 1.00 0.51 H new ATOM 0 HB2 GLU A 293 -3.695 -10.895 3.588 1.00 0.60 H new ATOM 0 HB3 GLU A 293 -2.423 -11.115 2.402 1.00 0.60 H new ATOM 0 HG2 GLU A 293 -1.364 -9.026 3.061 1.00 1.21 H new ATOM 0 HG3 GLU A 293 -2.698 -8.635 4.129 1.00 1.21 H new ATOM 280 N ASP A 294 -6.035 -9.044 2.808 1.00 0.46 N ATOM 281 CA ASP A 294 -7.009 -8.186 3.471 1.00 0.49 C ATOM 282 C ASP A 294 -7.021 -8.432 4.972 1.00 0.47 C ATOM 283 O ASP A 294 -6.904 -9.569 5.429 1.00 0.71 O ATOM 284 CB ASP A 294 -8.410 -8.373 2.880 1.00 0.65 C ATOM 285 CG ASP A 294 -8.798 -9.827 2.711 1.00 1.60 C ATOM 286 OD1 ASP A 294 -9.642 -10.317 3.489 1.00 2.25 O ATOM 287 OD2 ASP A 294 -8.271 -10.476 1.777 1.00 2.36 O ATOM 0 H ASP A 294 -6.386 -9.969 2.561 1.00 0.46 H new ATOM 0 HA ASP A 294 -6.708 -7.153 3.298 1.00 0.49 H new ATOM 0 HB2 ASP A 294 -9.138 -7.882 3.526 1.00 0.65 H new ATOM 0 HB3 ASP A 294 -8.458 -7.876 1.911 1.00 0.65 H new ATOM 292 N ARG A 295 -7.137 -7.347 5.730 1.00 0.35 N ATOM 293 CA ARG A 295 -7.048 -7.399 7.185 1.00 0.35 C ATOM 294 C ARG A 295 -8.377 -7.017 7.840 1.00 0.40 C ATOM 295 O ARG A 295 -8.855 -7.698 8.749 1.00 0.47 O ATOM 296 CB ARG A 295 -5.928 -6.467 7.657 1.00 0.39 C ATOM 297 CG ARG A 295 -4.538 -6.976 7.314 1.00 1.19 C ATOM 298 CD ARG A 295 -4.156 -8.151 8.191 1.00 1.47 C ATOM 299 NE ARG A 295 -2.926 -8.799 7.745 1.00 2.06 N ATOM 300 CZ ARG A 295 -1.798 -8.833 8.452 1.00 2.62 C ATOM 301 NH1 ARG A 295 -1.696 -8.147 9.587 1.00 2.77 N ATOM 302 NH2 ARG A 295 -0.767 -9.538 8.004 1.00 3.50 N ATOM 0 H ARG A 295 -7.295 -6.411 5.356 1.00 0.35 H new ATOM 0 HA ARG A 295 -6.821 -8.422 7.484 1.00 0.35 H new ATOM 0 HB2 ARG A 295 -6.069 -5.484 7.207 1.00 0.39 H new ATOM 0 HB3 ARG A 295 -6.004 -6.337 8.737 1.00 0.39 H new ATOM 0 HG2 ARG A 295 -4.505 -7.274 6.266 1.00 1.19 H new ATOM 0 HG3 ARG A 295 -3.812 -6.173 7.440 1.00 1.19 H new ATOM 0 HD2 ARG A 295 -4.032 -7.809 9.219 1.00 1.47 H new ATOM 0 HD3 ARG A 295 -4.967 -8.879 8.193 1.00 1.47 H new ATOM 0 HE ARG A 295 -2.931 -9.255 6.833 1.00 2.06 H new ATOM 0 HH11 ARG A 295 -2.484 -7.591 9.920 1.00 2.77 H new ATOM 0 HH12 ARG A 295 -0.830 -8.177 10.125 1.00 2.77 H new ATOM 0 HH21 ARG A 295 -0.842 -10.049 7.124 1.00 3.50 H new ATOM 0 HH22 ARG A 295 0.101 -9.569 8.539 1.00 3.50 H new ATOM 316 N VAL A 296 -8.971 -5.924 7.376 1.00 0.41 N ATOM 317 CA VAL A 296 -10.241 -5.458 7.919 1.00 0.50 C ATOM 318 C VAL A 296 -11.298 -5.401 6.824 1.00 0.53 C ATOM 319 O VAL A 296 -11.052 -4.870 5.739 1.00 0.51 O ATOM 320 CB VAL A 296 -10.105 -4.068 8.582 1.00 0.56 C ATOM 321 CG1 VAL A 296 -11.445 -3.575 9.109 1.00 0.70 C ATOM 322 CG2 VAL A 296 -9.085 -4.117 9.709 1.00 0.68 C ATOM 0 H VAL A 296 -8.594 -5.345 6.626 1.00 0.41 H new ATOM 0 HA VAL A 296 -10.547 -6.171 8.685 1.00 0.50 H new ATOM 0 HB VAL A 296 -9.761 -3.367 7.822 1.00 0.56 H new ATOM 0 HG11 VAL A 296 -11.317 -2.595 9.569 1.00 0.70 H new ATOM 0 HG12 VAL A 296 -12.154 -3.499 8.285 1.00 0.70 H new ATOM 0 HG13 VAL A 296 -11.825 -4.278 9.851 1.00 0.70 H new ATOM 0 HG21 VAL A 296 -9.000 -3.131 10.166 1.00 0.68 H new ATOM 0 HG22 VAL A 296 -9.407 -4.839 10.460 1.00 0.68 H new ATOM 0 HG23 VAL A 296 -8.116 -4.416 9.310 1.00 0.68 H new ATOM 332 N THR A 297 -12.471 -5.946 7.123 1.00 0.77 N ATOM 333 CA THR A 297 -13.560 -6.030 6.163 1.00 0.88 C ATOM 334 C THR A 297 -14.055 -4.651 5.736 1.00 0.77 C ATOM 335 O THR A 297 -14.197 -3.741 6.555 1.00 0.98 O ATOM 336 CB THR A 297 -14.735 -6.844 6.743 1.00 1.21 C ATOM 337 OG1 THR A 297 -14.993 -6.450 8.103 1.00 1.89 O ATOM 338 CG2 THR A 297 -14.439 -8.336 6.686 1.00 1.93 C ATOM 0 H THR A 297 -12.692 -6.341 8.037 1.00 0.77 H new ATOM 0 HA THR A 297 -13.167 -6.536 5.281 1.00 0.88 H new ATOM 0 HB THR A 297 -15.619 -6.641 6.138 1.00 1.21 H new ATOM 0 HG1 THR A 297 -15.742 -6.973 8.459 1.00 1.89 H new ATOM 0 HG21 THR A 297 -15.281 -8.890 7.100 1.00 1.93 H new ATOM 0 HG22 THR A 297 -14.281 -8.636 5.650 1.00 1.93 H new ATOM 0 HG23 THR A 297 -13.542 -8.551 7.267 1.00 1.93 H new ATOM 346 N GLY A 298 -14.310 -4.505 4.445 1.00 0.77 N ATOM 347 CA GLY A 298 -14.799 -3.249 3.921 1.00 0.83 C ATOM 348 C GLY A 298 -15.352 -3.401 2.524 1.00 0.90 C ATOM 349 O GLY A 298 -14.728 -4.031 1.674 1.00 1.04 O ATOM 0 H GLY A 298 -14.186 -5.239 3.748 1.00 0.77 H new ATOM 0 HA2 GLY A 298 -15.576 -2.859 4.579 1.00 0.83 H new ATOM 0 HA3 GLY A 298 -13.990 -2.518 3.914 1.00 0.83 H new ATOM 353 N LYS A 299 -16.530 -2.844 2.292 1.00 0.96 N ATOM 354 CA LYS A 299 -17.136 -2.864 0.973 1.00 1.08 C ATOM 355 C LYS A 299 -17.659 -1.476 0.621 1.00 0.82 C ATOM 356 O LYS A 299 -18.535 -0.932 1.297 1.00 1.36 O ATOM 357 CB LYS A 299 -18.254 -3.917 0.891 1.00 1.88 C ATOM 358 CG LYS A 299 -19.455 -3.648 1.788 1.00 2.40 C ATOM 359 CD LYS A 299 -20.476 -4.772 1.699 1.00 3.13 C ATOM 360 CE LYS A 299 -20.054 -5.980 2.526 1.00 4.13 C ATOM 361 NZ LYS A 299 -20.145 -5.698 3.982 1.00 4.49 N ATOM 0 H LYS A 299 -17.086 -2.371 3.004 1.00 0.96 H new ATOM 0 HA LYS A 299 -16.375 -3.144 0.245 1.00 1.08 H new ATOM 0 HB2 LYS A 299 -18.597 -3.982 -0.142 1.00 1.88 H new ATOM 0 HB3 LYS A 299 -17.836 -4.890 1.150 1.00 1.88 H new ATOM 0 HG2 LYS A 299 -19.123 -3.537 2.820 1.00 2.40 H new ATOM 0 HG3 LYS A 299 -19.922 -2.706 1.500 1.00 2.40 H new ATOM 0 HD2 LYS A 299 -21.445 -4.413 2.047 1.00 3.13 H new ATOM 0 HD3 LYS A 299 -20.601 -5.069 0.658 1.00 3.13 H new ATOM 0 HE2 LYS A 299 -20.688 -6.832 2.278 1.00 4.13 H new ATOM 0 HE3 LYS A 299 -19.032 -6.258 2.271 1.00 4.13 H new ATOM 0 HZ1 LYS A 299 -20.170 -6.595 4.508 1.00 4.49 H new ATOM 0 HZ2 LYS A 299 -19.317 -5.144 4.281 1.00 4.49 H new ATOM 0 HZ3 LYS A 299 -21.012 -5.158 4.177 1.00 4.49 H new ATOM 375 N GLY A 300 -17.087 -0.893 -0.413 1.00 0.58 N ATOM 376 CA GLY A 300 -17.457 0.445 -0.804 1.00 1.04 C ATOM 377 C GLY A 300 -16.827 0.822 -2.123 1.00 0.73 C ATOM 378 O GLY A 300 -16.522 -0.057 -2.928 1.00 0.67 O ATOM 0 H GLY A 300 -16.368 -1.325 -0.993 1.00 0.58 H new ATOM 0 HA2 GLY A 300 -18.542 0.517 -0.882 1.00 1.04 H new ATOM 0 HA3 GLY A 300 -17.145 1.151 -0.034 1.00 1.04 H new ATOM 382 N PRO A 301 -16.617 2.122 -2.373 1.00 0.68 N ATOM 383 CA PRO A 301 -15.978 2.597 -3.604 1.00 0.52 C ATOM 384 C PRO A 301 -14.553 2.067 -3.734 1.00 0.51 C ATOM 385 O PRO A 301 -13.770 2.120 -2.778 1.00 0.57 O ATOM 386 CB PRO A 301 -15.982 4.125 -3.452 1.00 0.53 C ATOM 387 CG PRO A 301 -16.993 4.414 -2.396 1.00 0.77 C ATOM 388 CD PRO A 301 -16.978 3.228 -1.477 1.00 0.88 C ATOM 0 HA PRO A 301 -16.498 2.257 -4.500 1.00 0.52 H new ATOM 0 HB2 PRO A 301 -14.997 4.494 -3.165 1.00 0.53 H new ATOM 0 HB3 PRO A 301 -16.244 4.613 -4.391 1.00 0.53 H new ATOM 0 HG2 PRO A 301 -16.745 5.329 -1.857 1.00 0.77 H new ATOM 0 HG3 PRO A 301 -17.982 4.559 -2.831 1.00 0.77 H new ATOM 0 HD2 PRO A 301 -16.252 3.349 -0.673 1.00 0.88 H new ATOM 0 HD3 PRO A 301 -17.949 3.068 -1.009 1.00 0.88 H new ATOM 396 N HIS A 302 -14.222 1.559 -4.912 1.00 0.53 N ATOM 397 CA HIS A 302 -12.910 0.971 -5.153 1.00 0.60 C ATOM 398 C HIS A 302 -12.004 1.932 -5.910 1.00 0.50 C ATOM 399 O HIS A 302 -12.414 2.546 -6.899 1.00 0.57 O ATOM 400 CB HIS A 302 -13.038 -0.349 -5.922 1.00 0.78 C ATOM 401 CG HIS A 302 -13.493 -1.503 -5.076 1.00 0.99 C ATOM 402 ND1 HIS A 302 -14.664 -2.177 -5.341 1.00 1.42 N ATOM 403 CD2 HIS A 302 -12.889 -2.071 -4.006 1.00 1.16 C ATOM 404 CE1 HIS A 302 -14.739 -3.136 -4.430 1.00 1.49 C ATOM 405 NE2 HIS A 302 -13.688 -3.108 -3.602 1.00 1.33 N ATOM 0 H HIS A 302 -14.845 1.542 -5.719 1.00 0.53 H new ATOM 0 HA HIS A 302 -12.458 0.769 -4.182 1.00 0.60 H new ATOM 0 HB2 HIS A 302 -13.742 -0.213 -6.743 1.00 0.78 H new ATOM 0 HB3 HIS A 302 -12.073 -0.595 -6.366 1.00 0.78 H new ATOM 0 HD2 HIS A 302 -11.956 -1.765 -3.557 1.00 1.16 H new ATOM 0 HE1 HIS A 302 -15.546 -3.850 -4.364 1.00 1.49 H new ATOM 0 HE2 HIS A 302 -13.515 -3.739 -2.819 1.00 1.33 H new ATOM 413 N ALA A 303 -10.773 2.059 -5.426 1.00 0.40 N ATOM 414 CA ALA A 303 -9.782 2.940 -6.031 1.00 0.36 C ATOM 415 C ALA A 303 -9.415 2.474 -7.435 1.00 0.39 C ATOM 416 O ALA A 303 -9.033 1.320 -7.638 1.00 0.54 O ATOM 417 CB ALA A 303 -8.542 3.018 -5.153 1.00 0.38 C ATOM 0 H ALA A 303 -10.435 1.556 -4.606 1.00 0.40 H new ATOM 0 HA ALA A 303 -10.218 3.936 -6.113 1.00 0.36 H new ATOM 0 HB1 ALA A 303 -7.809 3.679 -5.616 1.00 0.38 H new ATOM 0 HB2 ALA A 303 -8.814 3.408 -4.172 1.00 0.38 H new ATOM 0 HB3 ALA A 303 -8.112 2.023 -5.041 1.00 0.38 H new ATOM 423 N LYS A 304 -9.528 3.382 -8.391 1.00 0.39 N ATOM 424 CA LYS A 304 -9.272 3.076 -9.790 1.00 0.45 C ATOM 425 C LYS A 304 -8.448 4.207 -10.410 1.00 0.44 C ATOM 426 O LYS A 304 -8.247 5.246 -9.782 1.00 0.43 O ATOM 427 CB LYS A 304 -10.616 2.899 -10.515 1.00 0.60 C ATOM 428 CG LYS A 304 -10.510 2.446 -11.962 1.00 1.03 C ATOM 429 CD LYS A 304 -11.883 2.230 -12.579 1.00 1.17 C ATOM 430 CE LYS A 304 -12.724 3.496 -12.533 1.00 2.23 C ATOM 431 NZ LYS A 304 -14.074 3.282 -13.118 1.00 2.84 N ATOM 0 H LYS A 304 -9.799 4.350 -8.220 1.00 0.39 H new ATOM 0 HA LYS A 304 -8.704 2.150 -9.884 1.00 0.45 H new ATOM 0 HB2 LYS A 304 -11.215 2.173 -9.966 1.00 0.60 H new ATOM 0 HB3 LYS A 304 -11.155 3.846 -10.485 1.00 0.60 H new ATOM 0 HG2 LYS A 304 -9.964 3.192 -12.539 1.00 1.03 H new ATOM 0 HG3 LYS A 304 -9.937 1.520 -12.014 1.00 1.03 H new ATOM 0 HD2 LYS A 304 -11.770 1.905 -13.613 1.00 1.17 H new ATOM 0 HD3 LYS A 304 -12.399 1.430 -12.048 1.00 1.17 H new ATOM 0 HE2 LYS A 304 -12.824 3.829 -11.500 1.00 2.23 H new ATOM 0 HE3 LYS A 304 -12.214 4.291 -13.076 1.00 2.23 H new ATOM 0 HZ1 LYS A 304 -14.618 4.167 -13.069 1.00 2.84 H new ATOM 0 HZ2 LYS A 304 -13.979 2.988 -14.111 1.00 2.84 H new ATOM 0 HZ3 LYS A 304 -14.570 2.541 -12.584 1.00 2.84 H new ATOM 445 N LYS A 305 -7.950 3.994 -11.617 1.00 0.51 N ATOM 446 CA LYS A 305 -7.205 5.021 -12.329 1.00 0.55 C ATOM 447 C LYS A 305 -8.103 6.224 -12.610 1.00 0.56 C ATOM 448 O LYS A 305 -9.204 6.081 -13.146 1.00 0.63 O ATOM 449 CB LYS A 305 -6.655 4.444 -13.633 1.00 0.67 C ATOM 450 CG LYS A 305 -5.647 5.337 -14.340 1.00 1.35 C ATOM 451 CD LYS A 305 -5.083 4.647 -15.574 1.00 1.42 C ATOM 452 CE LYS A 305 -3.992 5.466 -16.241 1.00 2.35 C ATOM 453 NZ LYS A 305 -2.848 5.729 -15.329 1.00 2.84 N ATOM 0 H LYS A 305 -8.048 3.116 -12.126 1.00 0.51 H new ATOM 0 HA LYS A 305 -6.371 5.354 -11.712 1.00 0.55 H new ATOM 0 HB2 LYS A 305 -6.185 3.483 -13.421 1.00 0.67 H new ATOM 0 HB3 LYS A 305 -7.487 4.250 -14.310 1.00 0.67 H new ATOM 0 HG2 LYS A 305 -6.124 6.274 -14.628 1.00 1.35 H new ATOM 0 HG3 LYS A 305 -4.836 5.589 -13.657 1.00 1.35 H new ATOM 0 HD2 LYS A 305 -4.683 3.673 -15.293 1.00 1.42 H new ATOM 0 HD3 LYS A 305 -5.887 4.467 -16.287 1.00 1.42 H new ATOM 0 HE2 LYS A 305 -3.635 4.939 -17.126 1.00 2.35 H new ATOM 0 HE3 LYS A 305 -4.409 6.414 -16.581 1.00 2.35 H new ATOM 0 HZ1 LYS A 305 -2.730 6.755 -15.208 1.00 2.84 H new ATOM 0 HZ2 LYS A 305 -3.033 5.290 -14.405 1.00 2.84 H new ATOM 0 HZ3 LYS A 305 -1.980 5.326 -15.736 1.00 2.84 H new ATOM 467 N GLY A 306 -7.628 7.401 -12.235 1.00 0.55 N ATOM 468 CA GLY A 306 -8.416 8.610 -12.384 1.00 0.61 C ATOM 469 C GLY A 306 -9.117 8.989 -11.094 1.00 0.56 C ATOM 470 O GLY A 306 -9.757 10.037 -11.006 1.00 0.70 O ATOM 0 H GLY A 306 -6.704 7.543 -11.827 1.00 0.55 H new ATOM 0 HA2 GLY A 306 -7.769 9.429 -12.700 1.00 0.61 H new ATOM 0 HA3 GLY A 306 -9.156 8.466 -13.171 1.00 0.61 H new ATOM 474 N THR A 307 -8.991 8.131 -10.092 1.00 0.40 N ATOM 475 CA THR A 307 -9.621 8.358 -8.800 1.00 0.34 C ATOM 476 C THR A 307 -8.659 9.055 -7.836 1.00 0.30 C ATOM 477 O THR A 307 -7.449 8.821 -7.875 1.00 0.31 O ATOM 478 CB THR A 307 -10.082 7.019 -8.189 1.00 0.32 C ATOM 479 OG1 THR A 307 -10.878 6.304 -9.142 1.00 0.40 O ATOM 480 CG2 THR A 307 -10.891 7.232 -6.922 1.00 0.32 C ATOM 0 H THR A 307 -8.454 7.266 -10.150 1.00 0.40 H new ATOM 0 HA THR A 307 -10.486 9.003 -8.957 1.00 0.34 H new ATOM 0 HB THR A 307 -9.192 6.444 -7.933 1.00 0.32 H new ATOM 0 HG1 THR A 307 -11.422 5.634 -8.677 1.00 0.40 H new ATOM 0 HG21 THR A 307 -11.198 6.267 -6.520 1.00 0.32 H new ATOM 0 HG22 THR A 307 -10.282 7.755 -6.185 1.00 0.32 H new ATOM 0 HG23 THR A 307 -11.775 7.828 -7.150 1.00 0.32 H new ATOM 488 N ARG A 308 -9.202 9.904 -6.970 1.00 0.33 N ATOM 489 CA ARG A 308 -8.407 10.598 -5.968 1.00 0.36 C ATOM 490 C ARG A 308 -8.752 10.061 -4.593 1.00 0.36 C ATOM 491 O ARG A 308 -9.804 10.374 -4.038 1.00 0.52 O ATOM 492 CB ARG A 308 -8.671 12.101 -6.011 1.00 0.46 C ATOM 493 CG ARG A 308 -8.266 12.759 -7.318 1.00 0.98 C ATOM 494 CD ARG A 308 -8.744 14.197 -7.368 1.00 1.14 C ATOM 495 NE ARG A 308 -10.204 14.277 -7.359 1.00 1.95 N ATOM 496 CZ ARG A 308 -10.895 15.291 -7.865 1.00 2.39 C ATOM 497 NH1 ARG A 308 -10.266 16.325 -8.417 1.00 2.12 N ATOM 498 NH2 ARG A 308 -12.220 15.258 -7.830 1.00 3.45 N ATOM 0 H ARG A 308 -10.197 10.128 -6.944 1.00 0.33 H new ATOM 0 HA ARG A 308 -7.352 10.427 -6.180 1.00 0.36 H new ATOM 0 HB2 ARG A 308 -9.733 12.279 -5.840 1.00 0.46 H new ATOM 0 HB3 ARG A 308 -8.132 12.578 -5.193 1.00 0.46 H new ATOM 0 HG2 ARG A 308 -7.182 12.728 -7.425 1.00 0.98 H new ATOM 0 HG3 ARG A 308 -8.686 12.202 -8.156 1.00 0.98 H new ATOM 0 HD2 ARG A 308 -8.343 14.745 -6.515 1.00 1.14 H new ATOM 0 HD3 ARG A 308 -8.358 14.679 -8.266 1.00 1.14 H new ATOM 0 HE ARG A 308 -10.723 13.506 -6.938 1.00 1.95 H new ATOM 0 HH11 ARG A 308 -9.247 16.342 -8.453 1.00 2.12 H new ATOM 0 HH12 ARG A 308 -10.803 17.101 -8.804 1.00 2.12 H new ATOM 0 HH21 ARG A 308 -12.699 14.458 -7.417 1.00 3.45 H new ATOM 0 HH22 ARG A 308 -12.760 16.032 -8.216 1.00 3.45 H new ATOM 512 N VAL A 309 -7.880 9.246 -4.045 1.00 0.28 N ATOM 513 CA VAL A 309 -8.185 8.573 -2.800 1.00 0.28 C ATOM 514 C VAL A 309 -7.485 9.224 -1.615 1.00 0.28 C ATOM 515 O VAL A 309 -6.382 9.759 -1.737 1.00 0.34 O ATOM 516 CB VAL A 309 -7.829 7.075 -2.865 1.00 0.29 C ATOM 517 CG1 VAL A 309 -8.670 6.380 -3.923 1.00 0.31 C ATOM 518 CG2 VAL A 309 -6.347 6.872 -3.138 1.00 0.28 C ATOM 0 H VAL A 309 -6.962 9.033 -4.436 1.00 0.28 H new ATOM 0 HA VAL A 309 -9.261 8.668 -2.652 1.00 0.28 H new ATOM 0 HB VAL A 309 -8.051 6.631 -1.894 1.00 0.29 H new ATOM 0 HG11 VAL A 309 -8.409 5.322 -3.959 1.00 0.31 H new ATOM 0 HG12 VAL A 309 -9.726 6.485 -3.675 1.00 0.31 H new ATOM 0 HG13 VAL A 309 -8.479 6.834 -4.895 1.00 0.31 H new ATOM 0 HG21 VAL A 309 -6.127 5.805 -3.178 1.00 0.28 H new ATOM 0 HG22 VAL A 309 -6.086 7.332 -4.091 1.00 0.28 H new ATOM 0 HG23 VAL A 309 -5.764 7.333 -2.341 1.00 0.28 H new ATOM 528 N GLY A 310 -8.158 9.178 -0.478 1.00 0.25 N ATOM 529 CA GLY A 310 -7.597 9.676 0.758 1.00 0.27 C ATOM 530 C GLY A 310 -7.479 8.549 1.752 1.00 0.24 C ATOM 531 O GLY A 310 -8.485 7.944 2.131 1.00 0.26 O ATOM 0 H GLY A 310 -9.100 8.797 -0.389 1.00 0.25 H new ATOM 0 HA2 GLY A 310 -6.617 10.115 0.573 1.00 0.27 H new ATOM 0 HA3 GLY A 310 -8.229 10.467 1.163 1.00 0.27 H new ATOM 535 N MET A 311 -6.264 8.232 2.156 1.00 0.22 N ATOM 536 CA MET A 311 -6.037 7.021 2.921 1.00 0.19 C ATOM 537 C MET A 311 -5.120 7.243 4.115 1.00 0.18 C ATOM 538 O MET A 311 -4.599 8.341 4.335 1.00 0.19 O ATOM 539 CB MET A 311 -5.448 5.946 2.009 1.00 0.22 C ATOM 540 CG MET A 311 -4.079 6.294 1.445 1.00 0.34 C ATOM 541 SD MET A 311 -3.478 5.051 0.288 1.00 0.67 S ATOM 542 CE MET A 311 -3.598 3.569 1.288 1.00 0.76 C ATOM 0 H MET A 311 -5.429 8.788 1.971 1.00 0.22 H new ATOM 0 HA MET A 311 -7.001 6.700 3.315 1.00 0.19 H new ATOM 0 HB2 MET A 311 -5.373 5.012 2.567 1.00 0.22 H new ATOM 0 HB3 MET A 311 -6.136 5.769 1.182 1.00 0.22 H new ATOM 0 HG2 MET A 311 -4.131 7.260 0.942 1.00 0.34 H new ATOM 0 HG3 MET A 311 -3.367 6.399 2.264 1.00 0.34 H new ATOM 0 HE1 MET A 311 -2.901 2.820 0.913 1.00 0.76 H new ATOM 0 HE2 MET A 311 -3.352 3.807 2.323 1.00 0.76 H new ATOM 0 HE3 MET A 311 -4.614 3.177 1.238 1.00 0.76 H new ATOM 552 N ARG A 312 -4.939 6.172 4.874 1.00 0.19 N ATOM 553 CA ARG A 312 -4.044 6.152 6.017 1.00 0.21 C ATOM 554 C ARG A 312 -3.230 4.869 5.933 1.00 0.24 C ATOM 555 O ARG A 312 -3.740 3.855 5.449 1.00 0.30 O ATOM 556 CB ARG A 312 -4.819 6.195 7.338 1.00 0.27 C ATOM 557 CG ARG A 312 -5.903 7.262 7.404 1.00 0.40 C ATOM 558 CD ARG A 312 -6.570 7.279 8.768 1.00 0.67 C ATOM 559 NE ARG A 312 -7.764 8.121 8.800 1.00 1.24 N ATOM 560 CZ ARG A 312 -8.253 8.664 9.912 1.00 1.67 C ATOM 561 NH1 ARG A 312 -7.592 8.530 11.053 1.00 1.85 N ATOM 562 NH2 ARG A 312 -9.392 9.345 9.879 1.00 2.51 N ATOM 0 H ARG A 312 -5.415 5.285 4.710 1.00 0.19 H new ATOM 0 HA ARG A 312 -3.400 7.031 5.995 1.00 0.21 H new ATOM 0 HB2 ARG A 312 -5.277 5.220 7.507 1.00 0.27 H new ATOM 0 HB3 ARG A 312 -4.114 6.362 8.152 1.00 0.27 H new ATOM 0 HG2 ARG A 312 -5.469 8.240 7.196 1.00 0.40 H new ATOM 0 HG3 ARG A 312 -6.650 7.074 6.633 1.00 0.40 H new ATOM 0 HD2 ARG A 312 -6.840 6.261 9.049 1.00 0.67 H new ATOM 0 HD3 ARG A 312 -5.858 7.636 9.512 1.00 0.67 H new ATOM 0 HE ARG A 312 -8.249 8.302 7.921 1.00 1.24 H new ATOM 0 HH11 ARG A 312 -6.713 8.013 11.076 1.00 1.85 H new ATOM 0 HH12 ARG A 312 -7.962 8.944 11.908 1.00 1.85 H new ATOM 0 HH21 ARG A 312 -9.896 9.454 8.999 1.00 2.51 H new ATOM 0 HH22 ARG A 312 -9.763 9.760 10.734 1.00 2.51 H new ATOM 576 N TYR A 313 -1.990 4.890 6.394 1.00 0.23 N ATOM 577 CA TYR A 313 -1.115 3.743 6.192 1.00 0.26 C ATOM 578 C TYR A 313 0.112 3.770 7.090 1.00 0.27 C ATOM 579 O TYR A 313 0.523 4.823 7.582 1.00 0.31 O ATOM 580 CB TYR A 313 -0.672 3.670 4.732 1.00 0.28 C ATOM 581 CG TYR A 313 0.046 4.902 4.230 1.00 0.34 C ATOM 582 CD1 TYR A 313 1.432 4.993 4.266 1.00 0.45 C ATOM 583 CD2 TYR A 313 -0.666 5.970 3.700 1.00 0.40 C ATOM 584 CE1 TYR A 313 2.086 6.114 3.793 1.00 0.53 C ATOM 585 CE2 TYR A 313 -0.021 7.093 3.226 1.00 0.51 C ATOM 586 CZ TYR A 313 1.356 7.161 3.271 1.00 0.56 C ATOM 587 OH TYR A 313 2.002 8.280 2.800 1.00 0.68 O ATOM 0 H TYR A 313 -1.571 5.670 6.900 1.00 0.23 H new ATOM 0 HA TYR A 313 -1.694 2.859 6.457 1.00 0.26 H new ATOM 0 HB2 TYR A 313 -0.017 2.808 4.607 1.00 0.28 H new ATOM 0 HB3 TYR A 313 -1.549 3.497 4.108 1.00 0.28 H new ATOM 0 HD1 TYR A 313 2.008 4.174 4.671 1.00 0.45 H new ATOM 0 HD2 TYR A 313 -1.744 5.920 3.658 1.00 0.40 H new ATOM 0 HE1 TYR A 313 3.164 6.170 3.832 1.00 0.53 H new ATOM 0 HE2 TYR A 313 -0.592 7.916 2.821 1.00 0.51 H new ATOM 0 HH TYR A 313 1.352 8.881 2.380 1.00 0.68 H new ATOM 597 N VAL A 314 0.681 2.590 7.290 1.00 0.26 N ATOM 598 CA VAL A 314 1.925 2.421 8.017 1.00 0.27 C ATOM 599 C VAL A 314 2.923 1.656 7.147 1.00 0.28 C ATOM 600 O VAL A 314 2.689 0.499 6.796 1.00 0.35 O ATOM 601 CB VAL A 314 1.705 1.649 9.340 1.00 0.29 C ATOM 602 CG1 VAL A 314 3.014 1.479 10.094 1.00 0.32 C ATOM 603 CG2 VAL A 314 0.672 2.351 10.213 1.00 0.32 C ATOM 0 H VAL A 314 0.285 1.715 6.947 1.00 0.26 H new ATOM 0 HA VAL A 314 2.314 3.410 8.258 1.00 0.27 H new ATOM 0 HB VAL A 314 1.325 0.659 9.090 1.00 0.29 H new ATOM 0 HG11 VAL A 314 2.832 0.933 11.020 1.00 0.32 H new ATOM 0 HG12 VAL A 314 3.719 0.922 9.477 1.00 0.32 H new ATOM 0 HG13 VAL A 314 3.430 2.459 10.326 1.00 0.32 H new ATOM 0 HG21 VAL A 314 0.535 1.789 11.137 1.00 0.32 H new ATOM 0 HG22 VAL A 314 1.018 3.358 10.448 1.00 0.32 H new ATOM 0 HG23 VAL A 314 -0.277 2.409 9.679 1.00 0.32 H new ATOM 613 N GLY A 315 4.024 2.305 6.793 1.00 0.27 N ATOM 614 CA GLY A 315 5.007 1.686 5.927 1.00 0.28 C ATOM 615 C GLY A 315 6.203 1.166 6.698 1.00 0.25 C ATOM 616 O GLY A 315 6.936 1.947 7.322 1.00 0.27 O ATOM 0 H GLY A 315 4.254 3.253 7.092 1.00 0.27 H new ATOM 0 HA2 GLY A 315 4.543 0.864 5.383 1.00 0.28 H new ATOM 0 HA3 GLY A 315 5.342 2.411 5.185 1.00 0.28 H new ATOM 620 N LYS A 316 6.400 -0.146 6.656 1.00 0.25 N ATOM 621 CA LYS A 316 7.484 -0.788 7.384 1.00 0.27 C ATOM 622 C LYS A 316 8.433 -1.509 6.431 1.00 0.30 C ATOM 623 O LYS A 316 8.097 -1.785 5.278 1.00 0.32 O ATOM 624 CB LYS A 316 6.936 -1.809 8.387 1.00 0.36 C ATOM 625 CG LYS A 316 6.055 -1.232 9.483 1.00 0.48 C ATOM 626 CD LYS A 316 5.637 -2.319 10.461 1.00 0.69 C ATOM 627 CE LYS A 316 4.679 -1.793 11.512 1.00 0.99 C ATOM 628 NZ LYS A 316 4.213 -2.871 12.424 1.00 1.94 N ATOM 0 H LYS A 316 5.817 -0.789 6.120 1.00 0.25 H new ATOM 0 HA LYS A 316 8.025 -0.003 7.913 1.00 0.27 H new ATOM 0 HB2 LYS A 316 6.364 -2.560 7.841 1.00 0.36 H new ATOM 0 HB3 LYS A 316 7.776 -2.324 8.852 1.00 0.36 H new ATOM 0 HG2 LYS A 316 6.592 -0.446 10.013 1.00 0.48 H new ATOM 0 HG3 LYS A 316 5.171 -0.772 9.042 1.00 0.48 H new ATOM 0 HD2 LYS A 316 5.165 -3.137 9.916 1.00 0.69 H new ATOM 0 HD3 LYS A 316 6.522 -2.729 10.948 1.00 0.69 H new ATOM 0 HE2 LYS A 316 5.170 -1.012 12.093 1.00 0.99 H new ATOM 0 HE3 LYS A 316 3.820 -1.334 11.023 1.00 0.99 H new ATOM 0 HZ1 LYS A 316 3.560 -2.472 13.128 1.00 1.94 H new ATOM 0 HZ2 LYS A 316 3.722 -3.604 11.873 1.00 1.94 H new ATOM 0 HZ3 LYS A 316 5.030 -3.292 12.910 1.00 1.94 H new ATOM 642 N LEU A 317 9.616 -1.804 6.938 1.00 0.35 N ATOM 643 CA LEU A 317 10.592 -2.610 6.226 1.00 0.46 C ATOM 644 C LEU A 317 10.350 -4.078 6.532 1.00 0.56 C ATOM 645 O LEU A 317 9.631 -4.404 7.477 1.00 0.54 O ATOM 646 CB LEU A 317 12.003 -2.229 6.679 1.00 0.51 C ATOM 647 CG LEU A 317 12.390 -0.770 6.447 1.00 0.53 C ATOM 648 CD1 LEU A 317 13.686 -0.444 7.164 1.00 0.61 C ATOM 649 CD2 LEU A 317 12.540 -0.494 4.960 1.00 0.65 C ATOM 0 H LEU A 317 9.928 -1.491 7.857 1.00 0.35 H new ATOM 0 HA LEU A 317 10.494 -2.434 5.155 1.00 0.46 H new ATOM 0 HB2 LEU A 317 12.097 -2.448 7.743 1.00 0.51 H new ATOM 0 HB3 LEU A 317 12.719 -2.865 6.158 1.00 0.51 H new ATOM 0 HG LEU A 317 11.598 -0.137 6.847 1.00 0.53 H new ATOM 0 HD11 LEU A 317 13.947 0.600 6.988 1.00 0.61 H new ATOM 0 HD12 LEU A 317 13.562 -0.611 8.234 1.00 0.61 H new ATOM 0 HD13 LEU A 317 14.482 -1.086 6.786 1.00 0.61 H new ATOM 0 HD21 LEU A 317 12.816 0.550 4.810 1.00 0.65 H new ATOM 0 HD22 LEU A 317 13.317 -1.138 4.547 1.00 0.65 H new ATOM 0 HD23 LEU A 317 11.595 -0.696 4.455 1.00 0.65 H new ATOM 661 N LYS A 318 10.980 -4.962 5.762 1.00 0.74 N ATOM 662 CA LYS A 318 10.900 -6.398 6.028 1.00 0.89 C ATOM 663 C LYS A 318 11.597 -6.733 7.349 1.00 0.81 C ATOM 664 O LYS A 318 11.518 -7.853 7.848 1.00 0.87 O ATOM 665 CB LYS A 318 11.533 -7.202 4.884 1.00 1.14 C ATOM 666 CG LYS A 318 13.053 -7.098 4.819 1.00 1.33 C ATOM 667 CD LYS A 318 13.617 -7.906 3.660 1.00 1.34 C ATOM 668 CE LYS A 318 15.136 -8.009 3.732 1.00 1.96 C ATOM 669 NZ LYS A 318 15.581 -8.904 4.839 1.00 2.42 N ATOM 0 H LYS A 318 11.549 -4.712 4.953 1.00 0.74 H new ATOM 0 HA LYS A 318 9.847 -6.671 6.101 1.00 0.89 H new ATOM 0 HB2 LYS A 318 11.255 -8.250 4.994 1.00 1.14 H new ATOM 0 HB3 LYS A 318 11.115 -6.859 3.938 1.00 1.14 H new ATOM 0 HG2 LYS A 318 13.343 -6.053 4.711 1.00 1.33 H new ATOM 0 HG3 LYS A 318 13.484 -7.453 5.755 1.00 1.33 H new ATOM 0 HD2 LYS A 318 13.184 -8.906 3.668 1.00 1.34 H new ATOM 0 HD3 LYS A 318 13.328 -7.441 2.717 1.00 1.34 H new ATOM 0 HE2 LYS A 318 15.520 -8.386 2.784 1.00 1.96 H new ATOM 0 HE3 LYS A 318 15.561 -7.015 3.875 1.00 1.96 H new ATOM 0 HZ1 LYS A 318 16.595 -9.110 4.732 1.00 2.42 H new ATOM 0 HZ2 LYS A 318 15.417 -8.434 5.752 1.00 2.42 H new ATOM 0 HZ3 LYS A 318 15.042 -9.793 4.805 1.00 2.42 H new ATOM 683 N ASN A 319 12.287 -5.740 7.905 1.00 0.73 N ATOM 684 CA ASN A 319 13.008 -5.898 9.165 1.00 0.71 C ATOM 685 C ASN A 319 12.074 -5.637 10.347 1.00 0.63 C ATOM 686 O ASN A 319 12.436 -5.838 11.506 1.00 0.69 O ATOM 687 CB ASN A 319 14.210 -4.940 9.200 1.00 0.78 C ATOM 688 CG ASN A 319 15.189 -5.242 10.318 1.00 1.31 C ATOM 689 OD1 ASN A 319 15.048 -4.547 11.436 1.00 2.20 O flip ATOM 690 ND2 ASN A 319 16.082 -6.075 10.166 1.00 1.70 N flip ATOM 0 H ASN A 319 12.362 -4.808 7.497 1.00 0.73 H new ATOM 0 HA ASN A 319 13.374 -6.922 9.241 1.00 0.71 H new ATOM 0 HB2 ASN A 319 14.733 -4.991 8.245 1.00 0.78 H new ATOM 0 HB3 ASN A 319 13.847 -3.918 9.311 1.00 0.78 H new ATOM 0 HD21 ASN A 319 16.156 -6.589 9.288 1.00 1.70 H new ATOM 0 HD22 ASN A 319 16.748 -6.251 10.918 1.00 1.70 H new ATOM 697 N GLY A 320 10.862 -5.186 10.039 1.00 0.55 N ATOM 698 CA GLY A 320 9.874 -4.930 11.071 1.00 0.57 C ATOM 699 C GLY A 320 9.833 -3.474 11.488 1.00 0.53 C ATOM 700 O GLY A 320 8.901 -3.036 12.161 1.00 0.69 O ATOM 0 H GLY A 320 10.546 -4.993 9.089 1.00 0.55 H new ATOM 0 HA2 GLY A 320 8.890 -5.229 10.709 1.00 0.57 H new ATOM 0 HA3 GLY A 320 10.095 -5.548 11.942 1.00 0.57 H new ATOM 704 N LYS A 321 10.841 -2.720 11.076 1.00 0.42 N ATOM 705 CA LYS A 321 10.940 -1.317 11.450 1.00 0.45 C ATOM 706 C LYS A 321 10.092 -0.450 10.533 1.00 0.39 C ATOM 707 O LYS A 321 10.144 -0.590 9.311 1.00 0.44 O ATOM 708 CB LYS A 321 12.396 -0.849 11.402 1.00 0.56 C ATOM 709 CG LYS A 321 13.314 -1.586 12.368 1.00 1.36 C ATOM 710 CD LYS A 321 12.860 -1.441 13.815 1.00 1.84 C ATOM 711 CE LYS A 321 12.819 0.014 14.262 1.00 2.33 C ATOM 712 NZ LYS A 321 14.144 0.680 14.153 1.00 2.42 N ATOM 0 H LYS A 321 11.601 -3.055 10.484 1.00 0.42 H new ATOM 0 HA LYS A 321 10.567 -1.216 12.469 1.00 0.45 H new ATOM 0 HB2 LYS A 321 12.775 -0.976 10.388 1.00 0.56 H new ATOM 0 HB3 LYS A 321 12.432 0.217 11.624 1.00 0.56 H new ATOM 0 HG2 LYS A 321 13.345 -2.643 12.103 1.00 1.36 H new ATOM 0 HG3 LYS A 321 14.329 -1.202 12.267 1.00 1.36 H new ATOM 0 HD2 LYS A 321 11.870 -1.882 13.929 1.00 1.84 H new ATOM 0 HD3 LYS A 321 13.535 -2.000 14.463 1.00 1.84 H new ATOM 0 HE2 LYS A 321 12.092 0.556 13.657 1.00 2.33 H new ATOM 0 HE3 LYS A 321 12.475 0.064 15.295 1.00 2.33 H new ATOM 0 HZ1 LYS A 321 14.092 1.628 14.578 1.00 2.42 H new ATOM 0 HZ2 LYS A 321 14.859 0.115 14.654 1.00 2.42 H new ATOM 0 HZ3 LYS A 321 14.409 0.764 13.151 1.00 2.42 H new ATOM 726 N VAL A 322 9.308 0.432 11.128 1.00 0.35 N ATOM 727 CA VAL A 322 8.490 1.365 10.368 1.00 0.33 C ATOM 728 C VAL A 322 9.320 2.586 9.979 1.00 0.35 C ATOM 729 O VAL A 322 10.064 3.127 10.799 1.00 0.42 O ATOM 730 CB VAL A 322 7.236 1.802 11.171 1.00 0.36 C ATOM 731 CG1 VAL A 322 7.620 2.368 12.532 1.00 1.17 C ATOM 732 CG2 VAL A 322 6.406 2.809 10.388 1.00 1.26 C ATOM 0 H VAL A 322 9.220 0.523 12.140 1.00 0.35 H new ATOM 0 HA VAL A 322 8.148 0.859 9.465 1.00 0.33 H new ATOM 0 HB VAL A 322 6.627 0.913 11.335 1.00 0.36 H new ATOM 0 HG11 VAL A 322 6.720 2.665 13.070 1.00 1.17 H new ATOM 0 HG12 VAL A 322 8.151 1.608 13.105 1.00 1.17 H new ATOM 0 HG13 VAL A 322 8.264 3.237 12.396 1.00 1.17 H new ATOM 0 HG21 VAL A 322 5.534 3.097 10.975 1.00 1.26 H new ATOM 0 HG22 VAL A 322 7.009 3.692 10.177 1.00 1.26 H new ATOM 0 HG23 VAL A 322 6.079 2.360 9.450 1.00 1.26 H new ATOM 742 N PHE A 323 9.220 3.000 8.722 1.00 0.35 N ATOM 743 CA PHE A 323 9.965 4.162 8.257 1.00 0.38 C ATOM 744 C PHE A 323 9.056 5.373 8.083 1.00 0.41 C ATOM 745 O PHE A 323 9.485 6.509 8.280 1.00 0.55 O ATOM 746 CB PHE A 323 10.728 3.861 6.958 1.00 0.37 C ATOM 747 CG PHE A 323 9.895 3.274 5.847 1.00 0.37 C ATOM 748 CD1 PHE A 323 9.825 1.901 5.657 1.00 0.36 C ATOM 749 CD2 PHE A 323 9.165 4.098 5.010 1.00 0.43 C ATOM 750 CE1 PHE A 323 9.044 1.367 4.651 1.00 0.39 C ATOM 751 CE2 PHE A 323 8.387 3.569 4.000 1.00 0.48 C ATOM 752 CZ PHE A 323 8.397 2.179 3.781 1.00 0.43 C ATOM 0 H PHE A 323 8.637 2.554 8.014 1.00 0.35 H new ATOM 0 HA PHE A 323 10.699 4.401 9.026 1.00 0.38 H new ATOM 0 HB2 PHE A 323 11.183 4.784 6.600 1.00 0.37 H new ATOM 0 HB3 PHE A 323 11.541 3.171 7.184 1.00 0.37 H new ATOM 0 HD1 PHE A 323 10.387 1.243 6.303 1.00 0.36 H new ATOM 0 HD2 PHE A 323 9.204 5.168 5.148 1.00 0.43 H new ATOM 0 HE1 PHE A 323 8.948 0.295 4.557 1.00 0.39 H new ATOM 0 HE2 PHE A 323 7.778 4.214 3.385 1.00 0.48 H new ATOM 0 HZ PHE A 323 7.891 1.761 2.923 1.00 0.43 H new ATOM 762 N ASP A 324 7.802 5.133 7.725 1.00 0.37 N ATOM 763 CA ASP A 324 6.843 6.223 7.569 1.00 0.45 C ATOM 764 C ASP A 324 5.448 5.743 7.921 1.00 0.36 C ATOM 765 O ASP A 324 5.147 4.559 7.799 1.00 0.47 O ATOM 766 CB ASP A 324 6.873 6.796 6.144 1.00 0.61 C ATOM 767 CG ASP A 324 5.936 7.979 5.980 1.00 0.85 C ATOM 768 OD1 ASP A 324 5.045 7.923 5.111 1.00 1.68 O ATOM 769 OD2 ASP A 324 6.081 8.966 6.739 1.00 0.91 O ATOM 0 H ASP A 324 7.426 4.204 7.538 1.00 0.37 H new ATOM 0 HA ASP A 324 7.126 7.024 8.252 1.00 0.45 H new ATOM 0 HB2 ASP A 324 7.890 7.104 5.900 1.00 0.61 H new ATOM 0 HB3 ASP A 324 6.597 6.016 5.435 1.00 0.61 H new ATOM 774 N LYS A 325 4.611 6.658 8.383 1.00 0.35 N ATOM 775 CA LYS A 325 3.257 6.327 8.801 1.00 0.31 C ATOM 776 C LYS A 325 2.391 7.581 8.813 1.00 0.32 C ATOM 777 O LYS A 325 2.814 8.640 9.284 1.00 0.45 O ATOM 778 CB LYS A 325 3.254 5.652 10.191 1.00 0.43 C ATOM 779 CG LYS A 325 3.666 6.554 11.357 1.00 0.61 C ATOM 780 CD LYS A 325 5.116 6.991 11.257 1.00 1.17 C ATOM 781 CE LYS A 325 5.447 8.087 12.253 1.00 1.44 C ATOM 782 NZ LYS A 325 6.773 8.694 11.970 1.00 1.99 N ATOM 0 H LYS A 325 4.848 7.645 8.479 1.00 0.35 H new ATOM 0 HA LYS A 325 2.841 5.619 8.085 1.00 0.31 H new ATOM 0 HB2 LYS A 325 2.254 5.267 10.387 1.00 0.43 H new ATOM 0 HB3 LYS A 325 3.926 4.794 10.162 1.00 0.43 H new ATOM 0 HG2 LYS A 325 3.023 7.434 11.378 1.00 0.61 H new ATOM 0 HG3 LYS A 325 3.512 6.024 12.297 1.00 0.61 H new ATOM 0 HD2 LYS A 325 5.766 6.134 11.431 1.00 1.17 H new ATOM 0 HD3 LYS A 325 5.319 7.345 10.246 1.00 1.17 H new ATOM 0 HE2 LYS A 325 4.677 8.858 12.217 1.00 1.44 H new ATOM 0 HE3 LYS A 325 5.441 7.677 13.263 1.00 1.44 H new ATOM 0 HZ1 LYS A 325 6.970 9.439 12.668 1.00 1.99 H new ATOM 0 HZ2 LYS A 325 7.509 7.962 12.028 1.00 1.99 H new ATOM 0 HZ3 LYS A 325 6.769 9.106 11.015 1.00 1.99 H new ATOM 796 N ASN A 326 1.187 7.460 8.275 1.00 0.33 N ATOM 797 CA ASN A 326 0.245 8.568 8.226 1.00 0.40 C ATOM 798 C ASN A 326 -1.149 8.064 8.559 1.00 0.39 C ATOM 799 O ASN A 326 -1.688 7.208 7.859 1.00 0.42 O ATOM 800 CB ASN A 326 0.242 9.232 6.839 1.00 0.56 C ATOM 801 CG ASN A 326 1.566 9.886 6.482 1.00 0.95 C ATOM 802 OD1 ASN A 326 1.805 11.048 6.812 1.00 1.92 O ATOM 803 ND2 ASN A 326 2.424 9.151 5.791 1.00 0.82 N ATOM 0 H ASN A 326 0.837 6.596 7.862 1.00 0.33 H new ATOM 0 HA ASN A 326 0.552 9.314 8.959 1.00 0.40 H new ATOM 0 HB2 ASN A 326 0.000 8.482 6.086 1.00 0.56 H new ATOM 0 HB3 ASN A 326 -0.547 9.983 6.805 1.00 0.56 H new ATOM 0 HD21 ASN A 326 3.323 9.544 5.512 1.00 0.82 H new ATOM 0 HD22 ASN A 326 2.186 8.192 5.538 1.00 0.82 H new ATOM 810 N THR A 327 -1.723 8.577 9.638 1.00 0.45 N ATOM 811 CA THR A 327 -3.045 8.151 10.076 1.00 0.54 C ATOM 812 C THR A 327 -3.654 9.166 11.045 1.00 0.52 C ATOM 813 O THR A 327 -4.830 9.508 10.934 1.00 0.58 O ATOM 814 CB THR A 327 -3.005 6.739 10.718 1.00 0.69 C ATOM 815 OG1 THR A 327 -4.305 6.359 11.183 1.00 1.69 O ATOM 816 CG2 THR A 327 -2.016 6.668 11.872 1.00 1.26 C ATOM 0 H THR A 327 -1.293 9.290 10.227 1.00 0.45 H new ATOM 0 HA THR A 327 -3.679 8.096 9.191 1.00 0.54 H new ATOM 0 HB THR A 327 -2.677 6.047 9.943 1.00 0.69 H new ATOM 0 HG1 THR A 327 -4.261 5.466 11.583 1.00 1.69 H new ATOM 0 HG21 THR A 327 -2.020 5.663 12.293 1.00 1.26 H new ATOM 0 HG22 THR A 327 -1.016 6.906 11.509 1.00 1.26 H new ATOM 0 HG23 THR A 327 -2.303 7.384 12.642 1.00 1.26 H new ATOM 824 N LYS A 328 -2.857 9.658 11.987 1.00 0.51 N ATOM 825 CA LYS A 328 -3.329 10.674 12.916 1.00 0.60 C ATOM 826 C LYS A 328 -2.858 12.049 12.462 1.00 0.61 C ATOM 827 O LYS A 328 -1.660 12.281 12.301 1.00 0.63 O ATOM 828 CB LYS A 328 -2.854 10.397 14.351 1.00 0.65 C ATOM 829 CG LYS A 328 -1.343 10.277 14.494 1.00 1.07 C ATOM 830 CD LYS A 328 -0.894 10.522 15.928 1.00 1.29 C ATOM 831 CE LYS A 328 -1.424 9.464 16.884 1.00 1.63 C ATOM 832 NZ LYS A 328 -0.713 8.165 16.733 1.00 2.55 N ATOM 0 H LYS A 328 -1.888 9.371 12.126 1.00 0.51 H new ATOM 0 HA LYS A 328 -4.419 10.646 12.919 1.00 0.60 H new ATOM 0 HB2 LYS A 328 -3.207 11.198 15.000 1.00 0.65 H new ATOM 0 HB3 LYS A 328 -3.316 9.475 14.703 1.00 0.65 H new ATOM 0 HG2 LYS A 328 -1.025 9.284 14.177 1.00 1.07 H new ATOM 0 HG3 LYS A 328 -0.856 10.994 13.832 1.00 1.07 H new ATOM 0 HD2 LYS A 328 0.195 10.534 15.969 1.00 1.29 H new ATOM 0 HD3 LYS A 328 -1.236 11.505 16.251 1.00 1.29 H new ATOM 0 HE2 LYS A 328 -1.318 9.817 17.910 1.00 1.63 H new ATOM 0 HE3 LYS A 328 -2.489 9.316 16.706 1.00 1.63 H new ATOM 0 HZ1 LYS A 328 -1.106 7.474 17.403 1.00 2.55 H new ATOM 0 HZ2 LYS A 328 -0.835 7.813 15.762 1.00 2.55 H new ATOM 0 HZ3 LYS A 328 0.300 8.299 16.928 1.00 2.55 H new ATOM 846 N GLY A 329 -3.808 12.941 12.210 1.00 0.78 N ATOM 847 CA GLY A 329 -3.477 14.300 11.811 1.00 0.97 C ATOM 848 C GLY A 329 -3.096 14.413 10.344 1.00 0.84 C ATOM 849 O GLY A 329 -3.428 15.400 9.689 1.00 0.88 O ATOM 0 H GLY A 329 -4.808 12.748 12.275 1.00 0.78 H new ATOM 0 HA2 GLY A 329 -4.330 14.949 12.010 1.00 0.97 H new ATOM 0 HA3 GLY A 329 -2.651 14.662 12.424 1.00 0.97 H new ATOM 853 N LYS A 330 -2.392 13.406 9.836 1.00 0.72 N ATOM 854 CA LYS A 330 -1.943 13.402 8.448 1.00 0.62 C ATOM 855 C LYS A 330 -2.791 12.477 7.581 1.00 0.49 C ATOM 856 O LYS A 330 -2.617 11.257 7.617 1.00 0.41 O ATOM 857 CB LYS A 330 -0.478 12.964 8.357 1.00 0.64 C ATOM 858 CG LYS A 330 0.513 13.994 8.876 1.00 0.90 C ATOM 859 CD LYS A 330 0.454 15.268 8.047 1.00 1.51 C ATOM 860 CE LYS A 330 1.572 16.232 8.404 1.00 1.80 C ATOM 861 NZ LYS A 330 2.914 15.661 8.114 1.00 2.08 N ATOM 0 H LYS A 330 -2.119 12.579 10.367 1.00 0.72 H new ATOM 0 HA LYS A 330 -2.049 14.421 8.077 1.00 0.62 H new ATOM 0 HB2 LYS A 330 -0.351 12.039 8.919 1.00 0.64 H new ATOM 0 HB3 LYS A 330 -0.241 12.740 7.317 1.00 0.64 H new ATOM 0 HG2 LYS A 330 0.293 14.223 9.919 1.00 0.90 H new ATOM 0 HG3 LYS A 330 1.522 13.582 8.846 1.00 0.90 H new ATOM 0 HD2 LYS A 330 0.518 15.015 6.989 1.00 1.51 H new ATOM 0 HD3 LYS A 330 -0.508 15.756 8.201 1.00 1.51 H new ATOM 0 HE2 LYS A 330 1.444 17.159 7.845 1.00 1.80 H new ATOM 0 HE3 LYS A 330 1.507 16.486 9.462 1.00 1.80 H new ATOM 0 HZ1 LYS A 330 3.616 16.427 8.077 1.00 2.08 H new ATOM 0 HZ2 LYS A 330 3.174 14.989 8.863 1.00 2.08 H new ATOM 0 HZ3 LYS A 330 2.891 15.168 7.199 1.00 2.08 H new ATOM 875 N PRO A 331 -3.736 13.037 6.820 1.00 0.49 N ATOM 876 CA PRO A 331 -4.430 12.306 5.777 1.00 0.43 C ATOM 877 C PRO A 331 -3.661 12.382 4.458 1.00 0.39 C ATOM 878 O PRO A 331 -3.293 13.470 4.006 1.00 0.55 O ATOM 879 CB PRO A 331 -5.767 13.040 5.698 1.00 0.53 C ATOM 880 CG PRO A 331 -5.443 14.459 6.038 1.00 0.62 C ATOM 881 CD PRO A 331 -4.218 14.426 6.923 1.00 0.60 C ATOM 0 HA PRO A 331 -4.539 11.240 5.978 1.00 0.43 H new ATOM 0 HB2 PRO A 331 -6.203 12.961 4.702 1.00 0.53 H new ATOM 0 HB3 PRO A 331 -6.491 12.621 6.397 1.00 0.53 H new ATOM 0 HG2 PRO A 331 -5.252 15.039 5.135 1.00 0.62 H new ATOM 0 HG3 PRO A 331 -6.279 14.934 6.552 1.00 0.62 H new ATOM 0 HD2 PRO A 331 -3.463 15.136 6.585 1.00 0.60 H new ATOM 0 HD3 PRO A 331 -4.463 14.687 7.952 1.00 0.60 H new ATOM 889 N PHE A 332 -3.389 11.238 3.851 1.00 0.28 N ATOM 890 CA PHE A 332 -2.642 11.222 2.605 1.00 0.29 C ATOM 891 C PHE A 332 -3.582 11.016 1.425 1.00 0.27 C ATOM 892 O PHE A 332 -4.260 9.995 1.325 1.00 0.26 O ATOM 893 CB PHE A 332 -1.557 10.140 2.630 1.00 0.31 C ATOM 894 CG PHE A 332 -0.693 10.118 1.400 1.00 0.40 C ATOM 895 CD1 PHE A 332 0.278 11.086 1.204 1.00 0.53 C ATOM 896 CD2 PHE A 332 -0.852 9.130 0.443 1.00 0.42 C ATOM 897 CE1 PHE A 332 1.074 11.066 0.077 1.00 0.64 C ATOM 898 CE2 PHE A 332 -0.058 9.106 -0.687 1.00 0.53 C ATOM 899 CZ PHE A 332 0.899 10.076 -0.876 1.00 0.63 C ATOM 0 H PHE A 332 -3.670 10.320 4.195 1.00 0.28 H new ATOM 0 HA PHE A 332 -2.149 12.188 2.490 1.00 0.29 H new ATOM 0 HB2 PHE A 332 -0.924 10.293 3.504 1.00 0.31 H new ATOM 0 HB3 PHE A 332 -2.031 9.166 2.747 1.00 0.31 H new ATOM 0 HD1 PHE A 332 0.414 11.864 1.941 1.00 0.53 H new ATOM 0 HD2 PHE A 332 -1.606 8.369 0.582 1.00 0.42 H new ATOM 0 HE1 PHE A 332 1.833 11.822 -0.062 1.00 0.64 H new ATOM 0 HE2 PHE A 332 -0.188 8.326 -1.422 1.00 0.53 H new ATOM 0 HZ PHE A 332 1.512 10.066 -1.765 1.00 0.63 H new ATOM 909 N VAL A 333 -3.629 12.002 0.548 1.00 0.29 N ATOM 910 CA VAL A 333 -4.470 11.937 -0.633 1.00 0.30 C ATOM 911 C VAL A 333 -3.609 11.909 -1.886 1.00 0.30 C ATOM 912 O VAL A 333 -2.787 12.805 -2.097 1.00 0.36 O ATOM 913 CB VAL A 333 -5.431 13.144 -0.709 1.00 0.34 C ATOM 914 CG1 VAL A 333 -6.259 13.098 -1.985 1.00 0.38 C ATOM 915 CG2 VAL A 333 -6.337 13.193 0.510 1.00 0.36 C ATOM 0 H VAL A 333 -3.090 12.864 0.633 1.00 0.29 H new ATOM 0 HA VAL A 333 -5.062 11.024 -0.566 1.00 0.30 H new ATOM 0 HB VAL A 333 -4.828 14.052 -0.724 1.00 0.34 H new ATOM 0 HG11 VAL A 333 -6.928 13.958 -2.016 1.00 0.38 H new ATOM 0 HG12 VAL A 333 -5.596 13.123 -2.850 1.00 0.38 H new ATOM 0 HG13 VAL A 333 -6.847 12.180 -2.004 1.00 0.38 H new ATOM 0 HG21 VAL A 333 -7.004 14.051 0.433 1.00 0.36 H new ATOM 0 HG22 VAL A 333 -6.927 12.278 0.562 1.00 0.36 H new ATOM 0 HG23 VAL A 333 -5.730 13.285 1.411 1.00 0.36 H new ATOM 925 N PHE A 334 -3.775 10.874 -2.695 1.00 0.29 N ATOM 926 CA PHE A 334 -3.083 10.790 -3.967 1.00 0.31 C ATOM 927 C PHE A 334 -4.032 10.262 -5.034 1.00 0.28 C ATOM 928 O PHE A 334 -5.023 9.598 -4.723 1.00 0.30 O ATOM 929 CB PHE A 334 -1.834 9.897 -3.867 1.00 0.33 C ATOM 930 CG PHE A 334 -2.112 8.416 -3.866 1.00 0.31 C ATOM 931 CD1 PHE A 334 -1.870 7.638 -4.990 1.00 0.36 C ATOM 932 CD2 PHE A 334 -2.626 7.802 -2.732 1.00 0.33 C ATOM 933 CE1 PHE A 334 -2.140 6.282 -4.980 1.00 0.39 C ATOM 934 CE2 PHE A 334 -2.896 6.448 -2.719 1.00 0.39 C ATOM 935 CZ PHE A 334 -2.599 5.677 -3.888 1.00 0.41 C ATOM 0 H PHE A 334 -4.384 10.081 -2.491 1.00 0.29 H new ATOM 0 HA PHE A 334 -2.751 11.790 -4.244 1.00 0.31 H new ATOM 0 HB2 PHE A 334 -1.173 10.127 -4.702 1.00 0.33 H new ATOM 0 HB3 PHE A 334 -1.295 10.152 -2.954 1.00 0.33 H new ATOM 0 HD1 PHE A 334 -1.467 8.096 -5.881 1.00 0.36 H new ATOM 0 HD2 PHE A 334 -2.817 8.392 -1.848 1.00 0.33 H new ATOM 0 HE1 PHE A 334 -1.975 5.703 -5.876 1.00 0.39 H new ATOM 0 HE2 PHE A 334 -3.323 5.980 -1.844 1.00 0.39 H new ATOM 0 HZ PHE A 334 -2.747 4.607 -3.883 1.00 0.41 H new ATOM 945 N LYS A 335 -3.745 10.581 -6.281 1.00 0.33 N ATOM 946 CA LYS A 335 -4.571 10.136 -7.389 1.00 0.35 C ATOM 947 C LYS A 335 -3.856 9.077 -8.215 1.00 0.35 C ATOM 948 O LYS A 335 -2.673 9.215 -8.533 1.00 0.43 O ATOM 949 CB LYS A 335 -4.999 11.321 -8.275 1.00 0.53 C ATOM 950 CG LYS A 335 -4.249 12.622 -8.012 1.00 1.05 C ATOM 951 CD LYS A 335 -2.816 12.580 -8.521 1.00 1.46 C ATOM 952 CE LYS A 335 -2.090 13.875 -8.203 1.00 1.95 C ATOM 953 NZ LYS A 335 -0.685 13.854 -8.674 1.00 2.58 N ATOM 0 H LYS A 335 -2.943 11.149 -6.554 1.00 0.33 H new ATOM 0 HA LYS A 335 -5.471 9.687 -6.969 1.00 0.35 H new ATOM 0 HB2 LYS A 335 -4.860 11.043 -9.320 1.00 0.53 H new ATOM 0 HB3 LYS A 335 -6.065 11.497 -8.131 1.00 0.53 H new ATOM 0 HG2 LYS A 335 -4.778 13.446 -8.491 1.00 1.05 H new ATOM 0 HG3 LYS A 335 -4.245 12.826 -6.941 1.00 1.05 H new ATOM 0 HD2 LYS A 335 -2.289 11.742 -8.066 1.00 1.46 H new ATOM 0 HD3 LYS A 335 -2.813 12.412 -9.598 1.00 1.46 H new ATOM 0 HE2 LYS A 335 -2.616 14.709 -8.668 1.00 1.95 H new ATOM 0 HE3 LYS A 335 -2.109 14.046 -7.127 1.00 1.95 H new ATOM 0 HZ1 LYS A 335 -0.157 14.630 -8.226 1.00 2.58 H new ATOM 0 HZ2 LYS A 335 -0.247 12.945 -8.420 1.00 2.58 H new ATOM 0 HZ3 LYS A 335 -0.663 13.972 -9.707 1.00 2.58 H new ATOM 967 N LEU A 336 -4.587 8.023 -8.555 1.00 0.33 N ATOM 968 CA LEU A 336 -4.039 6.934 -9.351 1.00 0.41 C ATOM 969 C LEU A 336 -3.982 7.352 -10.809 1.00 0.51 C ATOM 970 O LEU A 336 -5.011 7.515 -11.460 1.00 0.58 O ATOM 971 CB LEU A 336 -4.876 5.650 -9.209 1.00 0.40 C ATOM 972 CG LEU A 336 -4.659 4.837 -7.926 1.00 0.38 C ATOM 973 CD1 LEU A 336 -5.201 5.573 -6.711 1.00 0.33 C ATOM 974 CD2 LEU A 336 -5.308 3.464 -8.061 1.00 0.46 C ATOM 0 H LEU A 336 -5.564 7.900 -8.290 1.00 0.33 H new ATOM 0 HA LEU A 336 -3.035 6.719 -8.985 1.00 0.41 H new ATOM 0 HB2 LEU A 336 -5.930 5.920 -9.269 1.00 0.40 H new ATOM 0 HB3 LEU A 336 -4.663 5.006 -10.062 1.00 0.40 H new ATOM 0 HG LEU A 336 -3.587 4.705 -7.780 1.00 0.38 H new ATOM 0 HD11 LEU A 336 -5.033 4.973 -5.817 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -4.689 6.530 -6.607 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -6.270 5.745 -6.837 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -5.148 2.895 -7.145 1.00 0.46 H new ATOM 0 HD22 LEU A 336 -6.378 3.583 -8.233 1.00 0.46 H new ATOM 0 HD23 LEU A 336 -4.862 2.932 -8.901 1.00 0.46 H new ATOM 986 N GLY A 337 -2.778 7.539 -11.313 1.00 0.67 N ATOM 987 CA GLY A 337 -2.610 7.974 -12.680 1.00 0.84 C ATOM 988 C GLY A 337 -1.156 8.170 -13.025 1.00 0.75 C ATOM 989 O GLY A 337 -0.615 7.476 -13.884 1.00 0.94 O ATOM 0 H GLY A 337 -1.909 7.397 -10.798 1.00 0.67 H new ATOM 0 HA2 GLY A 337 -3.048 7.237 -13.353 1.00 0.84 H new ATOM 0 HA3 GLY A 337 -3.150 8.908 -12.834 1.00 0.84 H new ATOM 993 N GLN A 338 -0.515 9.104 -12.341 1.00 0.82 N ATOM 994 CA GLN A 338 0.886 9.385 -12.584 1.00 0.87 C ATOM 995 C GLN A 338 1.764 8.641 -11.583 1.00 0.64 C ATOM 996 O GLN A 338 1.345 8.354 -10.460 1.00 0.63 O ATOM 997 CB GLN A 338 1.153 10.889 -12.522 1.00 1.14 C ATOM 998 CG GLN A 338 0.936 11.502 -11.154 1.00 1.26 C ATOM 999 CD GLN A 338 1.149 12.997 -11.162 1.00 1.97 C ATOM 1000 OE1 GLN A 338 0.211 13.771 -11.344 1.00 2.30 O ATOM 1001 NE2 GLN A 338 2.389 13.411 -10.981 1.00 2.62 N ATOM 0 H GLN A 338 -0.944 9.678 -11.615 1.00 0.82 H new ATOM 0 HA GLN A 338 1.137 9.035 -13.585 1.00 0.87 H new ATOM 0 HB2 GLN A 338 2.180 11.077 -12.833 1.00 1.14 H new ATOM 0 HB3 GLN A 338 0.505 11.392 -13.240 1.00 1.14 H new ATOM 0 HG2 GLN A 338 -0.076 11.282 -10.815 1.00 1.26 H new ATOM 0 HG3 GLN A 338 1.618 11.043 -10.439 1.00 1.26 H new ATOM 0 HE21 GLN A 338 3.137 12.733 -10.833 1.00 2.62 H new ATOM 0 HE22 GLN A 338 2.600 14.409 -10.989 1.00 2.62 H new ATOM 1010 N GLY A 339 2.990 8.353 -11.990 1.00 0.74 N ATOM 1011 CA GLY A 339 3.876 7.555 -11.176 1.00 0.70 C ATOM 1012 C GLY A 339 4.686 8.394 -10.215 1.00 0.55 C ATOM 1013 O GLY A 339 5.915 8.412 -10.281 1.00 0.70 O ATOM 0 H GLY A 339 3.388 8.661 -12.877 1.00 0.74 H new ATOM 0 HA2 GLY A 339 3.292 6.826 -10.614 1.00 0.70 H new ATOM 0 HA3 GLY A 339 4.551 6.993 -11.822 1.00 0.70 H new ATOM 1017 N GLU A 340 3.997 9.117 -9.343 1.00 0.49 N ATOM 1018 CA GLU A 340 4.655 9.872 -8.283 1.00 0.54 C ATOM 1019 C GLU A 340 4.840 8.982 -7.060 1.00 0.41 C ATOM 1020 O GLU A 340 5.680 9.240 -6.197 1.00 0.53 O ATOM 1021 CB GLU A 340 3.844 11.123 -7.929 1.00 0.82 C ATOM 1022 CG GLU A 340 2.397 10.840 -7.569 1.00 1.01 C ATOM 1023 CD GLU A 340 1.581 12.107 -7.430 1.00 1.53 C ATOM 1024 OE1 GLU A 340 0.404 12.027 -7.022 1.00 2.09 O ATOM 1025 OE2 GLU A 340 2.106 13.192 -7.748 1.00 1.89 O ATOM 0 H GLU A 340 2.980 9.197 -9.348 1.00 0.49 H new ATOM 0 HA GLU A 340 5.635 10.197 -8.633 1.00 0.54 H new ATOM 0 HB2 GLU A 340 4.324 11.629 -7.091 1.00 0.82 H new ATOM 0 HB3 GLU A 340 3.869 11.811 -8.774 1.00 0.82 H new ATOM 0 HG2 GLU A 340 1.952 10.206 -8.336 1.00 1.01 H new ATOM 0 HG3 GLU A 340 2.360 10.282 -6.633 1.00 1.01 H new ATOM 1032 N VAL A 341 4.039 7.928 -7.006 1.00 0.34 N ATOM 1033 CA VAL A 341 4.160 6.907 -5.980 1.00 0.30 C ATOM 1034 C VAL A 341 4.995 5.755 -6.523 1.00 0.29 C ATOM 1035 O VAL A 341 5.251 5.690 -7.727 1.00 0.36 O ATOM 1036 CB VAL A 341 2.777 6.370 -5.556 1.00 0.35 C ATOM 1037 CG1 VAL A 341 1.889 7.506 -5.066 1.00 0.41 C ATOM 1038 CG2 VAL A 341 2.114 5.621 -6.709 1.00 0.43 C ATOM 0 H VAL A 341 3.287 7.758 -7.674 1.00 0.34 H new ATOM 0 HA VAL A 341 4.638 7.352 -5.107 1.00 0.30 H new ATOM 0 HB VAL A 341 2.918 5.669 -4.733 1.00 0.35 H new ATOM 0 HG11 VAL A 341 0.918 7.108 -4.771 1.00 0.41 H new ATOM 0 HG12 VAL A 341 2.358 7.990 -4.209 1.00 0.41 H new ATOM 0 HG13 VAL A 341 1.755 8.234 -5.866 1.00 0.41 H new ATOM 0 HG21 VAL A 341 1.140 5.250 -6.390 1.00 0.43 H new ATOM 0 HG22 VAL A 341 1.986 6.296 -7.555 1.00 0.43 H new ATOM 0 HG23 VAL A 341 2.742 4.781 -7.006 1.00 0.43 H new ATOM 1048 N ILE A 342 5.421 4.848 -5.655 1.00 0.29 N ATOM 1049 CA ILE A 342 6.113 3.658 -6.117 1.00 0.30 C ATOM 1050 C ILE A 342 5.109 2.729 -6.805 1.00 0.31 C ATOM 1051 O ILE A 342 3.938 2.695 -6.431 1.00 0.32 O ATOM 1052 CB ILE A 342 6.856 2.920 -4.972 1.00 0.30 C ATOM 1053 CG1 ILE A 342 5.886 2.466 -3.877 1.00 0.30 C ATOM 1054 CG2 ILE A 342 7.944 3.818 -4.388 1.00 0.32 C ATOM 1055 CD1 ILE A 342 6.561 1.789 -2.701 1.00 0.32 C ATOM 0 H ILE A 342 5.302 4.912 -4.644 1.00 0.29 H new ATOM 0 HA ILE A 342 6.879 3.966 -6.828 1.00 0.30 H new ATOM 0 HB ILE A 342 7.321 2.027 -5.390 1.00 0.30 H new ATOM 0 HG12 ILE A 342 5.331 3.331 -3.516 1.00 0.30 H new ATOM 0 HG13 ILE A 342 5.159 1.779 -4.311 1.00 0.30 H new ATOM 0 HG21 ILE A 342 8.459 3.290 -3.585 1.00 0.32 H new ATOM 0 HG22 ILE A 342 8.659 4.078 -5.169 1.00 0.32 H new ATOM 0 HG23 ILE A 342 7.492 4.727 -3.993 1.00 0.32 H new ATOM 0 HD11 ILE A 342 5.809 1.497 -1.968 1.00 0.32 H new ATOM 0 HD12 ILE A 342 7.093 0.903 -3.048 1.00 0.32 H new ATOM 0 HD13 ILE A 342 7.267 2.479 -2.240 1.00 0.32 H new ATOM 1067 N LYS A 343 5.577 1.997 -7.813 1.00 0.34 N ATOM 1068 CA LYS A 343 4.712 1.193 -8.687 1.00 0.38 C ATOM 1069 C LYS A 343 3.749 0.300 -7.905 1.00 0.32 C ATOM 1070 O LYS A 343 2.585 0.156 -8.278 1.00 0.36 O ATOM 1071 CB LYS A 343 5.577 0.338 -9.617 1.00 0.46 C ATOM 1072 CG LYS A 343 6.353 1.153 -10.641 1.00 0.60 C ATOM 1073 CD LYS A 343 7.846 0.857 -10.600 1.00 1.39 C ATOM 1074 CE LYS A 343 8.482 1.372 -9.321 1.00 2.16 C ATOM 1075 NZ LYS A 343 9.933 1.050 -9.245 1.00 2.93 N ATOM 0 H LYS A 343 6.567 1.941 -8.051 1.00 0.34 H new ATOM 0 HA LYS A 343 4.103 1.886 -9.268 1.00 0.38 H new ATOM 0 HB2 LYS A 343 6.279 -0.241 -9.017 1.00 0.46 H new ATOM 0 HB3 LYS A 343 4.940 -0.376 -10.139 1.00 0.46 H new ATOM 0 HG2 LYS A 343 5.969 0.940 -11.639 1.00 0.60 H new ATOM 0 HG3 LYS A 343 6.190 2.215 -10.457 1.00 0.60 H new ATOM 0 HD2 LYS A 343 8.007 -0.218 -10.680 1.00 1.39 H new ATOM 0 HD3 LYS A 343 8.333 1.317 -11.460 1.00 1.39 H new ATOM 0 HE2 LYS A 343 8.348 2.452 -9.260 1.00 2.16 H new ATOM 0 HE3 LYS A 343 7.970 0.938 -8.462 1.00 2.16 H new ATOM 0 HZ1 LYS A 343 10.325 1.421 -8.356 1.00 2.93 H new ATOM 0 HZ2 LYS A 343 10.062 0.018 -9.277 1.00 2.93 H new ATOM 0 HZ3 LYS A 343 10.428 1.486 -10.049 1.00 2.93 H new ATOM 1089 N GLY A 344 4.240 -0.294 -6.826 1.00 0.28 N ATOM 1090 CA GLY A 344 3.413 -1.149 -5.992 1.00 0.28 C ATOM 1091 C GLY A 344 2.150 -0.470 -5.476 1.00 0.27 C ATOM 1092 O GLY A 344 1.161 -1.137 -5.184 1.00 0.30 O ATOM 0 H GLY A 344 5.205 -0.199 -6.510 1.00 0.28 H new ATOM 0 HA2 GLY A 344 3.131 -2.034 -6.562 1.00 0.28 H new ATOM 0 HA3 GLY A 344 4.003 -1.492 -5.142 1.00 0.28 H new ATOM 1096 N TRP A 345 2.178 0.852 -5.374 1.00 0.27 N ATOM 1097 CA TRP A 345 1.030 1.604 -4.882 1.00 0.27 C ATOM 1098 C TRP A 345 -0.081 1.688 -5.922 1.00 0.29 C ATOM 1099 O TRP A 345 -1.190 1.241 -5.664 1.00 0.32 O ATOM 1100 CB TRP A 345 1.459 2.996 -4.430 1.00 0.27 C ATOM 1101 CG TRP A 345 1.915 3.024 -3.009 1.00 0.28 C ATOM 1102 CD1 TRP A 345 2.979 2.369 -2.468 1.00 0.32 C ATOM 1103 CD2 TRP A 345 1.297 3.740 -1.941 1.00 0.28 C ATOM 1104 NE1 TRP A 345 3.063 2.634 -1.124 1.00 0.36 N ATOM 1105 CE2 TRP A 345 2.039 3.478 -0.777 1.00 0.34 C ATOM 1106 CE3 TRP A 345 0.193 4.583 -1.860 1.00 0.27 C ATOM 1107 CZ2 TRP A 345 1.701 4.019 0.458 1.00 0.39 C ATOM 1108 CZ3 TRP A 345 -0.143 5.123 -0.636 1.00 0.32 C ATOM 1109 CH2 TRP A 345 0.611 4.844 0.508 1.00 0.37 C ATOM 0 H TRP A 345 2.983 1.426 -5.625 1.00 0.27 H new ATOM 0 HA TRP A 345 0.627 1.067 -4.023 1.00 0.27 H new ATOM 0 HB2 TRP A 345 2.265 3.350 -5.073 1.00 0.27 H new ATOM 0 HB3 TRP A 345 0.625 3.687 -4.554 1.00 0.27 H new ATOM 0 HD1 TRP A 345 3.658 1.733 -3.017 1.00 0.32 H new ATOM 0 HE1 TRP A 345 3.770 2.264 -0.488 1.00 0.36 H new ATOM 0 HE3 TRP A 345 -0.390 4.810 -2.740 1.00 0.27 H new ATOM 0 HZ2 TRP A 345 2.277 3.797 1.344 1.00 0.39 H new ATOM 0 HZ3 TRP A 345 -1.003 5.772 -0.560 1.00 0.32 H new ATOM 0 HH2 TRP A 345 0.327 5.289 1.450 1.00 0.37 H new ATOM 1120 N ASP A 346 0.207 2.256 -7.090 1.00 0.34 N ATOM 1121 CA ASP A 346 -0.782 2.342 -8.179 1.00 0.40 C ATOM 1122 C ASP A 346 -1.435 0.985 -8.441 1.00 0.39 C ATOM 1123 O ASP A 346 -2.634 0.897 -8.703 1.00 0.46 O ATOM 1124 CB ASP A 346 -0.114 2.854 -9.462 1.00 0.49 C ATOM 1125 CG ASP A 346 -1.074 2.976 -10.640 1.00 0.84 C ATOM 1126 OD1 ASP A 346 -1.649 4.068 -10.840 1.00 1.75 O ATOM 1127 OD2 ASP A 346 -1.288 1.967 -11.348 1.00 0.97 O ATOM 0 H ASP A 346 1.114 2.665 -7.314 1.00 0.34 H new ATOM 0 HA ASP A 346 -1.559 3.042 -7.872 1.00 0.40 H new ATOM 0 HB2 ASP A 346 0.333 3.828 -9.265 1.00 0.49 H new ATOM 0 HB3 ASP A 346 0.698 2.180 -9.734 1.00 0.49 H new ATOM 1132 N ILE A 347 -0.642 -0.068 -8.326 1.00 0.34 N ATOM 1133 CA ILE A 347 -1.122 -1.419 -8.578 1.00 0.35 C ATOM 1134 C ILE A 347 -1.882 -1.985 -7.374 1.00 0.35 C ATOM 1135 O ILE A 347 -3.008 -2.461 -7.512 1.00 0.38 O ATOM 1136 CB ILE A 347 0.050 -2.349 -8.956 1.00 0.35 C ATOM 1137 CG1 ILE A 347 0.691 -1.862 -10.258 1.00 0.36 C ATOM 1138 CG2 ILE A 347 -0.416 -3.793 -9.084 1.00 0.38 C ATOM 1139 CD1 ILE A 347 1.841 -2.721 -10.736 1.00 0.39 C ATOM 0 H ILE A 347 0.341 -0.014 -8.059 1.00 0.34 H new ATOM 0 HA ILE A 347 -1.818 -1.367 -9.415 1.00 0.35 H new ATOM 0 HB ILE A 347 0.795 -2.317 -8.161 1.00 0.35 H new ATOM 0 HG12 ILE A 347 -0.072 -1.828 -11.036 1.00 0.36 H new ATOM 0 HG13 ILE A 347 1.047 -0.842 -10.116 1.00 0.36 H new ATOM 0 HG21 ILE A 347 0.430 -4.426 -9.351 1.00 0.38 H new ATOM 0 HG22 ILE A 347 -0.833 -4.126 -8.134 1.00 0.38 H new ATOM 0 HG23 ILE A 347 -1.179 -3.862 -9.859 1.00 0.38 H new ATOM 0 HD11 ILE A 347 2.241 -2.310 -11.663 1.00 0.39 H new ATOM 0 HD12 ILE A 347 2.624 -2.735 -9.978 1.00 0.39 H new ATOM 0 HD13 ILE A 347 1.488 -3.737 -10.912 1.00 0.39 H new ATOM 1151 N GLY A 348 -1.261 -1.935 -6.201 1.00 0.33 N ATOM 1152 CA GLY A 348 -1.868 -2.495 -5.002 1.00 0.34 C ATOM 1153 C GLY A 348 -3.100 -1.743 -4.530 1.00 0.31 C ATOM 1154 O GLY A 348 -4.039 -2.349 -4.013 1.00 0.34 O ATOM 0 H GLY A 348 -0.343 -1.515 -6.056 1.00 0.33 H new ATOM 0 HA2 GLY A 348 -2.139 -3.533 -5.194 1.00 0.34 H new ATOM 0 HA3 GLY A 348 -1.129 -2.502 -4.201 1.00 0.34 H new ATOM 1158 N VAL A 349 -3.093 -0.427 -4.689 1.00 0.28 N ATOM 1159 CA VAL A 349 -4.213 0.402 -4.255 1.00 0.27 C ATOM 1160 C VAL A 349 -5.389 0.279 -5.222 1.00 0.24 C ATOM 1161 O VAL A 349 -6.540 0.502 -4.844 1.00 0.24 O ATOM 1162 CB VAL A 349 -3.797 1.891 -4.107 1.00 0.28 C ATOM 1163 CG1 VAL A 349 -4.971 2.761 -3.684 1.00 0.28 C ATOM 1164 CG2 VAL A 349 -2.667 2.025 -3.098 1.00 0.32 C ATOM 0 H VAL A 349 -2.325 0.091 -5.115 1.00 0.28 H new ATOM 0 HA VAL A 349 -4.524 0.038 -3.276 1.00 0.27 H new ATOM 0 HB VAL A 349 -3.455 2.235 -5.083 1.00 0.28 H new ATOM 0 HG11 VAL A 349 -4.642 3.796 -3.591 1.00 0.28 H new ATOM 0 HG12 VAL A 349 -5.760 2.697 -4.434 1.00 0.28 H new ATOM 0 HG13 VAL A 349 -5.354 2.414 -2.724 1.00 0.28 H new ATOM 0 HG21 VAL A 349 -2.385 3.074 -3.004 1.00 0.32 H new ATOM 0 HG22 VAL A 349 -2.998 1.650 -2.129 1.00 0.32 H new ATOM 0 HG23 VAL A 349 -1.807 1.447 -3.436 1.00 0.32 H new ATOM 1174 N ALA A 350 -5.103 -0.093 -6.465 1.00 0.28 N ATOM 1175 CA ALA A 350 -6.149 -0.290 -7.458 1.00 0.28 C ATOM 1176 C ALA A 350 -7.036 -1.472 -7.069 1.00 0.30 C ATOM 1177 O ALA A 350 -6.708 -2.631 -7.337 1.00 0.47 O ATOM 1178 CB ALA A 350 -5.548 -0.498 -8.838 1.00 0.37 C ATOM 0 H ALA A 350 -4.157 -0.264 -6.807 1.00 0.28 H new ATOM 0 HA ALA A 350 -6.767 0.607 -7.491 1.00 0.28 H new ATOM 0 HB1 ALA A 350 -6.347 -0.643 -9.565 1.00 0.37 H new ATOM 0 HB2 ALA A 350 -4.961 0.377 -9.115 1.00 0.37 H new ATOM 0 HB3 ALA A 350 -4.904 -1.378 -8.826 1.00 0.37 H new ATOM 1184 N GLY A 351 -8.162 -1.172 -6.435 1.00 0.30 N ATOM 1185 CA GLY A 351 -9.041 -2.213 -5.933 1.00 0.37 C ATOM 1186 C GLY A 351 -9.266 -2.116 -4.433 1.00 0.33 C ATOM 1187 O GLY A 351 -9.890 -2.990 -3.835 1.00 0.39 O ATOM 0 H GLY A 351 -8.485 -0.221 -6.258 1.00 0.30 H new ATOM 0 HA2 GLY A 351 -10.001 -2.151 -6.445 1.00 0.37 H new ATOM 0 HA3 GLY A 351 -8.616 -3.188 -6.170 1.00 0.37 H new ATOM 1191 N MET A 352 -8.747 -1.060 -3.823 1.00 0.30 N ATOM 1192 CA MET A 352 -8.972 -0.812 -2.402 1.00 0.31 C ATOM 1193 C MET A 352 -10.286 -0.070 -2.178 1.00 0.26 C ATOM 1194 O MET A 352 -10.622 0.854 -2.923 1.00 0.37 O ATOM 1195 CB MET A 352 -7.810 -0.015 -1.800 1.00 0.41 C ATOM 1196 CG MET A 352 -6.546 -0.835 -1.587 1.00 0.65 C ATOM 1197 SD MET A 352 -6.748 -2.104 -0.319 1.00 1.28 S ATOM 1198 CE MET A 352 -7.066 -1.094 1.129 1.00 0.56 C ATOM 0 H MET A 352 -8.168 -0.361 -4.287 1.00 0.30 H new ATOM 0 HA MET A 352 -9.031 -1.778 -1.901 1.00 0.31 H new ATOM 0 HB2 MET A 352 -7.580 0.825 -2.455 1.00 0.41 H new ATOM 0 HB3 MET A 352 -8.126 0.403 -0.844 1.00 0.41 H new ATOM 0 HG2 MET A 352 -6.261 -1.308 -2.527 1.00 0.65 H new ATOM 0 HG3 MET A 352 -5.730 -0.171 -1.304 1.00 0.65 H new ATOM 0 HE1 MET A 352 -6.666 -1.590 2.013 1.00 0.56 H new ATOM 0 HE2 MET A 352 -6.585 -0.123 1.008 1.00 0.56 H new ATOM 0 HE3 MET A 352 -8.141 -0.955 1.247 1.00 0.56 H new ATOM 1208 N ALA A 353 -11.022 -0.481 -1.147 1.00 0.34 N ATOM 1209 CA ALA A 353 -12.324 0.105 -0.839 1.00 0.37 C ATOM 1210 C ALA A 353 -12.247 1.005 0.386 1.00 0.32 C ATOM 1211 O ALA A 353 -11.524 0.706 1.340 1.00 0.34 O ATOM 1212 CB ALA A 353 -13.362 -0.990 -0.611 1.00 0.55 C ATOM 0 H ALA A 353 -10.736 -1.222 -0.508 1.00 0.34 H new ATOM 0 HA ALA A 353 -12.625 0.711 -1.693 1.00 0.37 H new ATOM 0 HB1 ALA A 353 -14.326 -0.536 -0.383 1.00 0.55 H new ATOM 0 HB2 ALA A 353 -13.452 -1.599 -1.510 1.00 0.55 H new ATOM 0 HB3 ALA A 353 -13.051 -1.619 0.223 1.00 0.55 H new ATOM 1218 N VAL A 354 -12.976 2.115 0.342 1.00 0.31 N ATOM 1219 CA VAL A 354 -13.117 2.997 1.492 1.00 0.29 C ATOM 1220 C VAL A 354 -13.687 2.230 2.685 1.00 0.29 C ATOM 1221 O VAL A 354 -14.778 1.664 2.603 1.00 0.32 O ATOM 1222 CB VAL A 354 -14.041 4.194 1.178 1.00 0.33 C ATOM 1223 CG1 VAL A 354 -14.165 5.103 2.390 1.00 0.35 C ATOM 1224 CG2 VAL A 354 -13.522 4.977 -0.015 1.00 0.36 C ATOM 0 H VAL A 354 -13.482 2.426 -0.487 1.00 0.31 H new ATOM 0 HA VAL A 354 -12.123 3.375 1.734 1.00 0.29 H new ATOM 0 HB VAL A 354 -15.029 3.805 0.931 1.00 0.33 H new ATOM 0 HG11 VAL A 354 -14.820 5.941 2.151 1.00 0.35 H new ATOM 0 HG12 VAL A 354 -14.585 4.541 3.225 1.00 0.35 H new ATOM 0 HG13 VAL A 354 -13.180 5.479 2.665 1.00 0.35 H new ATOM 0 HG21 VAL A 354 -14.189 5.815 -0.218 1.00 0.36 H new ATOM 0 HG22 VAL A 354 -12.522 5.353 0.203 1.00 0.36 H new ATOM 0 HG23 VAL A 354 -13.482 4.326 -0.888 1.00 0.36 H new ATOM 1234 N GLY A 355 -12.937 2.201 3.777 1.00 0.28 N ATOM 1235 CA GLY A 355 -13.377 1.509 4.971 1.00 0.30 C ATOM 1236 C GLY A 355 -12.664 0.187 5.158 1.00 0.30 C ATOM 1237 O GLY A 355 -12.740 -0.423 6.226 1.00 0.44 O ATOM 0 H GLY A 355 -12.024 2.648 3.857 1.00 0.28 H new ATOM 0 HA2 GLY A 355 -13.202 2.141 5.841 1.00 0.30 H new ATOM 0 HA3 GLY A 355 -14.452 1.336 4.914 1.00 0.30 H new ATOM 1241 N GLY A 356 -11.963 -0.249 4.119 1.00 0.26 N ATOM 1242 CA GLY A 356 -11.287 -1.528 4.164 1.00 0.30 C ATOM 1243 C GLY A 356 -9.799 -1.386 4.400 1.00 0.25 C ATOM 1244 O GLY A 356 -9.172 -0.446 3.900 1.00 0.27 O ATOM 0 H GLY A 356 -11.851 0.263 3.244 1.00 0.26 H new ATOM 0 HA2 GLY A 356 -11.721 -2.138 4.956 1.00 0.30 H new ATOM 0 HA3 GLY A 356 -11.454 -2.058 3.226 1.00 0.30 H new ATOM 1248 N GLU A 357 -9.241 -2.317 5.161 1.00 0.27 N ATOM 1249 CA GLU A 357 -7.816 -2.316 5.476 1.00 0.33 C ATOM 1250 C GLU A 357 -7.152 -3.563 4.910 1.00 0.30 C ATOM 1251 O GLU A 357 -7.673 -4.673 5.062 1.00 0.34 O ATOM 1252 CB GLU A 357 -7.607 -2.257 6.994 1.00 0.48 C ATOM 1253 CG GLU A 357 -6.146 -2.189 7.424 1.00 0.99 C ATOM 1254 CD GLU A 357 -5.968 -2.319 8.928 1.00 1.06 C ATOM 1255 OE1 GLU A 357 -5.687 -3.441 9.413 1.00 1.18 O ATOM 1256 OE2 GLU A 357 -6.112 -1.300 9.635 1.00 1.41 O ATOM 0 H GLU A 357 -9.759 -3.091 5.577 1.00 0.27 H new ATOM 0 HA GLU A 357 -7.361 -1.435 5.023 1.00 0.33 H new ATOM 0 HB2 GLU A 357 -8.130 -1.386 7.387 1.00 0.48 H new ATOM 0 HB3 GLU A 357 -8.066 -3.136 7.447 1.00 0.48 H new ATOM 0 HG2 GLU A 357 -5.588 -2.983 6.927 1.00 0.99 H new ATOM 0 HG3 GLU A 357 -5.718 -1.243 7.093 1.00 0.99 H new ATOM 1263 N ARG A 358 -6.014 -3.385 4.253 1.00 0.31 N ATOM 1264 CA ARG A 358 -5.302 -4.500 3.653 1.00 0.30 C ATOM 1265 C ARG A 358 -3.797 -4.300 3.741 1.00 0.28 C ATOM 1266 O ARG A 358 -3.296 -3.181 3.644 1.00 0.31 O ATOM 1267 CB ARG A 358 -5.744 -4.697 2.193 1.00 0.37 C ATOM 1268 CG ARG A 358 -4.612 -4.655 1.166 1.00 0.73 C ATOM 1269 CD ARG A 358 -5.067 -5.212 -0.172 1.00 0.75 C ATOM 1270 NE ARG A 358 -5.423 -6.629 -0.069 1.00 0.93 N ATOM 1271 CZ ARG A 358 -6.577 -7.144 -0.492 1.00 1.09 C ATOM 1272 NH1 ARG A 358 -7.481 -6.370 -1.082 1.00 1.17 N ATOM 1273 NH2 ARG A 358 -6.828 -8.437 -0.323 1.00 1.37 N ATOM 0 H ARG A 358 -5.566 -2.478 4.123 1.00 0.31 H new ATOM 0 HA ARG A 358 -5.550 -5.402 4.213 1.00 0.30 H new ATOM 0 HB2 ARG A 358 -6.255 -5.656 2.110 1.00 0.37 H new ATOM 0 HB3 ARG A 358 -6.472 -3.925 1.942 1.00 0.37 H new ATOM 0 HG2 ARG A 358 -4.270 -3.628 1.039 1.00 0.73 H new ATOM 0 HG3 ARG A 358 -3.762 -5.230 1.533 1.00 0.73 H new ATOM 0 HD2 ARG A 358 -5.926 -4.645 -0.531 1.00 0.75 H new ATOM 0 HD3 ARG A 358 -4.273 -5.088 -0.908 1.00 0.75 H new ATOM 0 HE ARG A 358 -4.744 -7.262 0.354 1.00 0.93 H new ATOM 0 HH11 ARG A 358 -7.294 -5.376 -1.213 1.00 1.17 H new ATOM 0 HH12 ARG A 358 -8.363 -6.770 -1.404 1.00 1.17 H new ATOM 0 HH21 ARG A 358 -6.138 -9.036 0.130 1.00 1.37 H new ATOM 0 HH22 ARG A 358 -7.711 -8.832 -0.647 1.00 1.37 H new ATOM 1287 N ARG A 359 -3.092 -5.393 3.941 1.00 0.26 N ATOM 1288 CA ARG A 359 -1.648 -5.383 3.969 1.00 0.27 C ATOM 1289 C ARG A 359 -1.094 -5.590 2.561 1.00 0.31 C ATOM 1290 O ARG A 359 -1.371 -6.605 1.918 1.00 0.40 O ATOM 1291 CB ARG A 359 -1.147 -6.481 4.905 1.00 0.35 C ATOM 1292 CG ARG A 359 0.361 -6.531 5.047 1.00 0.85 C ATOM 1293 CD ARG A 359 0.895 -5.309 5.769 1.00 0.93 C ATOM 1294 NE ARG A 359 0.356 -5.185 7.121 1.00 1.42 N ATOM 1295 CZ ARG A 359 0.920 -5.725 8.199 1.00 1.87 C ATOM 1296 NH1 ARG A 359 1.974 -6.524 8.077 1.00 1.91 N ATOM 1297 NH2 ARG A 359 0.409 -5.485 9.398 1.00 2.79 N ATOM 0 H ARG A 359 -3.506 -6.314 4.089 1.00 0.26 H new ATOM 0 HA ARG A 359 -1.302 -4.417 4.337 1.00 0.27 H new ATOM 0 HB2 ARG A 359 -1.589 -6.334 5.890 1.00 0.35 H new ATOM 0 HB3 ARG A 359 -1.499 -7.445 4.538 1.00 0.35 H new ATOM 0 HG2 ARG A 359 0.646 -7.430 5.593 1.00 0.85 H new ATOM 0 HG3 ARG A 359 0.818 -6.599 4.060 1.00 0.85 H new ATOM 0 HD2 ARG A 359 1.983 -5.365 5.817 1.00 0.93 H new ATOM 0 HD3 ARG A 359 0.647 -4.415 5.198 1.00 0.93 H new ATOM 0 HE ARG A 359 -0.505 -4.652 7.247 1.00 1.42 H new ATOM 0 HH11 ARG A 359 2.356 -6.727 7.153 1.00 1.91 H new ATOM 0 HH12 ARG A 359 2.402 -6.935 8.907 1.00 1.91 H new ATOM 0 HH21 ARG A 359 -0.413 -4.889 9.492 1.00 2.79 H new ATOM 0 HH22 ARG A 359 0.838 -5.897 10.227 1.00 2.79 H new ATOM 1311 N ILE A 360 -0.343 -4.614 2.075 1.00 0.29 N ATOM 1312 CA ILE A 360 0.290 -4.710 0.770 1.00 0.30 C ATOM 1313 C ILE A 360 1.786 -4.969 0.934 1.00 0.31 C ATOM 1314 O ILE A 360 2.494 -4.190 1.575 1.00 0.34 O ATOM 1315 CB ILE A 360 0.087 -3.416 -0.057 1.00 0.32 C ATOM 1316 CG1 ILE A 360 -1.402 -3.068 -0.166 1.00 0.34 C ATOM 1317 CG2 ILE A 360 0.696 -3.571 -1.443 1.00 0.35 C ATOM 1318 CD1 ILE A 360 -1.674 -1.770 -0.901 1.00 0.38 C ATOM 0 H ILE A 360 -0.157 -3.741 2.569 1.00 0.29 H new ATOM 0 HA ILE A 360 -0.177 -5.538 0.237 1.00 0.30 H new ATOM 0 HB ILE A 360 0.593 -2.599 0.458 1.00 0.32 H new ATOM 0 HG12 ILE A 360 -1.919 -3.880 -0.678 1.00 0.34 H new ATOM 0 HG13 ILE A 360 -1.825 -3.003 0.837 1.00 0.34 H new ATOM 0 HG21 ILE A 360 0.545 -2.653 -2.011 1.00 0.35 H new ATOM 0 HG22 ILE A 360 1.764 -3.769 -1.351 1.00 0.35 H new ATOM 0 HG23 ILE A 360 0.216 -4.402 -1.961 1.00 0.35 H new ATOM 0 HD11 ILE A 360 -2.749 -1.591 -0.938 1.00 0.38 H new ATOM 0 HD12 ILE A 360 -1.187 -0.947 -0.378 1.00 0.38 H new ATOM 0 HD13 ILE A 360 -1.282 -1.838 -1.916 1.00 0.38 H new ATOM 1330 N VAL A 361 2.256 -6.070 0.378 1.00 0.29 N ATOM 1331 CA VAL A 361 3.671 -6.398 0.402 1.00 0.30 C ATOM 1332 C VAL A 361 4.292 -6.072 -0.954 1.00 0.29 C ATOM 1333 O VAL A 361 3.914 -6.653 -1.974 1.00 0.33 O ATOM 1334 CB VAL A 361 3.901 -7.888 0.734 1.00 0.35 C ATOM 1335 CG1 VAL A 361 5.386 -8.188 0.846 1.00 0.39 C ATOM 1336 CG2 VAL A 361 3.174 -8.274 2.017 1.00 0.38 C ATOM 0 H VAL A 361 1.674 -6.758 -0.100 1.00 0.29 H new ATOM 0 HA VAL A 361 4.145 -5.803 1.183 1.00 0.30 H new ATOM 0 HB VAL A 361 3.492 -8.486 -0.080 1.00 0.35 H new ATOM 0 HG11 VAL A 361 5.527 -9.243 1.080 1.00 0.39 H new ATOM 0 HG12 VAL A 361 5.876 -7.958 -0.100 1.00 0.39 H new ATOM 0 HG13 VAL A 361 5.822 -7.579 1.638 1.00 0.39 H new ATOM 0 HG21 VAL A 361 3.350 -9.328 2.232 1.00 0.38 H new ATOM 0 HG22 VAL A 361 3.547 -7.668 2.843 1.00 0.38 H new ATOM 0 HG23 VAL A 361 2.105 -8.102 1.895 1.00 0.38 H new ATOM 1346 N ILE A 362 5.229 -5.139 -0.963 1.00 0.25 N ATOM 1347 CA ILE A 362 5.793 -4.645 -2.209 1.00 0.25 C ATOM 1348 C ILE A 362 7.261 -5.033 -2.346 1.00 0.26 C ATOM 1349 O ILE A 362 8.116 -4.525 -1.618 1.00 0.29 O ATOM 1350 CB ILE A 362 5.664 -3.109 -2.312 1.00 0.25 C ATOM 1351 CG1 ILE A 362 4.204 -2.687 -2.129 1.00 0.25 C ATOM 1352 CG2 ILE A 362 6.198 -2.613 -3.653 1.00 0.28 C ATOM 1353 CD1 ILE A 362 3.990 -1.188 -2.141 1.00 0.27 C ATOM 0 H ILE A 362 5.615 -4.708 -0.123 1.00 0.25 H new ATOM 0 HA ILE A 362 5.226 -5.107 -3.017 1.00 0.25 H new ATOM 0 HB ILE A 362 6.260 -2.658 -1.519 1.00 0.25 H new ATOM 0 HG12 ILE A 362 3.605 -3.136 -2.921 1.00 0.25 H new ATOM 0 HG13 ILE A 362 3.836 -3.089 -1.185 1.00 0.25 H new ATOM 0 HG21 ILE A 362 6.098 -1.529 -3.706 1.00 0.28 H new ATOM 0 HG22 ILE A 362 7.249 -2.886 -3.750 1.00 0.28 H new ATOM 0 HG23 ILE A 362 5.629 -3.070 -4.463 1.00 0.28 H new ATOM 0 HD11 ILE A 362 2.930 -0.971 -2.006 1.00 0.27 H new ATOM 0 HD12 ILE A 362 4.560 -0.733 -1.331 1.00 0.27 H new ATOM 0 HD13 ILE A 362 4.325 -0.780 -3.095 1.00 0.27 H new ATOM 1365 N PRO A 363 7.562 -5.963 -3.270 1.00 0.28 N ATOM 1366 CA PRO A 363 8.938 -6.331 -3.619 1.00 0.29 C ATOM 1367 C PRO A 363 9.781 -5.117 -4.003 1.00 0.26 C ATOM 1368 O PRO A 363 9.260 -4.122 -4.519 1.00 0.27 O ATOM 1369 CB PRO A 363 8.776 -7.264 -4.830 1.00 0.36 C ATOM 1370 CG PRO A 363 7.361 -7.089 -5.272 1.00 0.66 C ATOM 1371 CD PRO A 363 6.593 -6.761 -4.029 1.00 0.36 C ATOM 0 HA PRO A 363 9.455 -6.792 -2.777 1.00 0.29 H new ATOM 0 HB2 PRO A 363 9.473 -7.001 -5.626 1.00 0.36 H new ATOM 0 HB3 PRO A 363 8.979 -8.300 -4.559 1.00 0.36 H new ATOM 0 HG2 PRO A 363 7.276 -6.290 -6.009 1.00 0.66 H new ATOM 0 HG3 PRO A 363 6.981 -7.997 -5.741 1.00 0.66 H new ATOM 0 HD2 PRO A 363 5.685 -6.199 -4.247 1.00 0.36 H new ATOM 0 HD3 PRO A 363 6.291 -7.658 -3.488 1.00 0.36 H new ATOM 1379 N ALA A 364 11.087 -5.227 -3.781 1.00 0.29 N ATOM 1380 CA ALA A 364 12.015 -4.120 -4.011 1.00 0.34 C ATOM 1381 C ALA A 364 11.891 -3.500 -5.417 1.00 0.34 C ATOM 1382 O ALA A 364 11.790 -2.277 -5.527 1.00 0.36 O ATOM 1383 CB ALA A 364 13.450 -4.557 -3.735 1.00 0.42 C ATOM 0 H ALA A 364 11.532 -6.079 -3.439 1.00 0.29 H new ATOM 0 HA ALA A 364 11.738 -3.334 -3.308 1.00 0.34 H new ATOM 0 HB1 ALA A 364 14.126 -3.720 -3.912 1.00 0.42 H new ATOM 0 HB2 ALA A 364 13.538 -4.882 -2.698 1.00 0.42 H new ATOM 0 HB3 ALA A 364 13.713 -5.382 -4.398 1.00 0.42 H new ATOM 1389 N PRO A 365 11.884 -4.312 -6.513 1.00 0.35 N ATOM 1390 CA PRO A 365 11.832 -3.783 -7.893 1.00 0.40 C ATOM 1391 C PRO A 365 10.669 -2.824 -8.141 1.00 0.36 C ATOM 1392 O PRO A 365 10.787 -1.877 -8.923 1.00 0.41 O ATOM 1393 CB PRO A 365 11.663 -5.041 -8.753 1.00 0.47 C ATOM 1394 CG PRO A 365 12.242 -6.139 -7.939 1.00 0.70 C ATOM 1395 CD PRO A 365 11.933 -5.793 -6.511 1.00 0.38 C ATOM 0 HA PRO A 365 12.723 -3.196 -8.117 1.00 0.40 H new ATOM 0 HB2 PRO A 365 10.613 -5.228 -8.979 1.00 0.47 H new ATOM 0 HB3 PRO A 365 12.181 -4.940 -9.707 1.00 0.47 H new ATOM 0 HG2 PRO A 365 11.806 -7.100 -8.212 1.00 0.70 H new ATOM 0 HG3 PRO A 365 13.317 -6.219 -8.098 1.00 0.70 H new ATOM 0 HD2 PRO A 365 10.985 -6.225 -6.190 1.00 0.38 H new ATOM 0 HD3 PRO A 365 12.700 -6.168 -5.833 1.00 0.38 H new ATOM 1403 N TYR A 366 9.550 -3.043 -7.464 1.00 0.31 N ATOM 1404 CA TYR A 366 8.362 -2.240 -7.705 1.00 0.29 C ATOM 1405 C TYR A 366 8.281 -1.083 -6.725 1.00 0.30 C ATOM 1406 O TYR A 366 7.277 -0.372 -6.658 1.00 0.30 O ATOM 1407 CB TYR A 366 7.096 -3.102 -7.668 1.00 0.30 C ATOM 1408 CG TYR A 366 6.734 -3.646 -9.032 1.00 0.36 C ATOM 1409 CD1 TYR A 366 5.480 -3.414 -9.583 1.00 0.43 C ATOM 1410 CD2 TYR A 366 7.632 -4.420 -9.751 1.00 0.53 C ATOM 1411 CE1 TYR A 366 5.132 -3.935 -10.814 1.00 0.50 C ATOM 1412 CE2 TYR A 366 7.296 -4.941 -10.987 1.00 0.64 C ATOM 1413 CZ TYR A 366 6.095 -4.593 -11.569 1.00 0.59 C ATOM 1414 OH TYR A 366 5.692 -5.233 -12.737 1.00 0.69 O ATOM 0 H TYR A 366 9.441 -3.763 -6.750 1.00 0.31 H new ATOM 0 HA TYR A 366 8.437 -1.817 -8.707 1.00 0.29 H new ATOM 0 HB2 TYR A 366 7.243 -3.931 -6.976 1.00 0.30 H new ATOM 0 HB3 TYR A 366 6.266 -2.509 -7.283 1.00 0.30 H new ATOM 0 HD1 TYR A 366 4.764 -2.815 -9.039 1.00 0.43 H new ATOM 0 HD2 TYR A 366 8.610 -4.619 -9.339 1.00 0.53 H new ATOM 0 HE1 TYR A 366 4.123 -3.832 -11.185 1.00 0.50 H new ATOM 0 HE2 TYR A 366 7.970 -5.616 -11.493 1.00 0.64 H new ATOM 0 HH TYR A 366 6.468 -5.651 -13.165 1.00 0.69 H new ATOM 1424 N ALA A 367 9.362 -0.884 -5.983 1.00 0.33 N ATOM 1425 CA ALA A 367 9.503 0.285 -5.135 1.00 0.40 C ATOM 1426 C ALA A 367 10.733 1.087 -5.559 1.00 0.50 C ATOM 1427 O ALA A 367 10.738 1.690 -6.634 1.00 0.86 O ATOM 1428 CB ALA A 367 9.569 -0.109 -3.666 1.00 0.40 C ATOM 0 H ALA A 367 10.157 -1.523 -5.954 1.00 0.33 H new ATOM 0 HA ALA A 367 8.623 0.917 -5.256 1.00 0.40 H new ATOM 0 HB1 ALA A 367 9.675 0.786 -3.054 1.00 0.40 H new ATOM 0 HB2 ALA A 367 8.654 -0.633 -3.388 1.00 0.40 H new ATOM 0 HB3 ALA A 367 10.425 -0.763 -3.503 1.00 0.40 H new ATOM 1434 N TYR A 368 11.779 1.074 -4.735 1.00 0.44 N ATOM 1435 CA TYR A 368 13.015 1.794 -5.042 1.00 0.52 C ATOM 1436 C TYR A 368 13.907 0.997 -5.993 1.00 0.51 C ATOM 1437 O TYR A 368 14.876 1.521 -6.542 1.00 0.58 O ATOM 1438 CB TYR A 368 13.769 2.120 -3.748 1.00 0.57 C ATOM 1439 CG TYR A 368 12.980 2.990 -2.796 1.00 0.63 C ATOM 1440 CD1 TYR A 368 13.021 4.375 -2.893 1.00 0.74 C ATOM 1441 CD2 TYR A 368 12.190 2.425 -1.804 1.00 0.69 C ATOM 1442 CE1 TYR A 368 12.301 5.172 -2.026 1.00 0.85 C ATOM 1443 CE2 TYR A 368 11.465 3.214 -0.934 1.00 0.80 C ATOM 1444 CZ TYR A 368 11.522 4.587 -1.049 1.00 0.86 C ATOM 1445 OH TYR A 368 10.802 5.376 -0.181 1.00 1.00 O ATOM 0 H TYR A 368 11.796 0.572 -3.847 1.00 0.44 H new ATOM 0 HA TYR A 368 12.747 2.724 -5.543 1.00 0.52 H new ATOM 0 HB2 TYR A 368 14.032 1.189 -3.245 1.00 0.57 H new ATOM 0 HB3 TYR A 368 14.704 2.622 -3.998 1.00 0.57 H new ATOM 0 HD1 TYR A 368 13.626 4.836 -3.660 1.00 0.74 H new ATOM 0 HD2 TYR A 368 12.142 1.350 -1.711 1.00 0.69 H new ATOM 0 HE1 TYR A 368 12.347 6.248 -2.112 1.00 0.85 H new ATOM 0 HE2 TYR A 368 10.856 2.758 -0.167 1.00 0.80 H new ATOM 0 HH TYR A 368 10.306 4.807 0.444 1.00 1.00 H new ATOM 1455 N GLY A 369 13.579 -0.275 -6.179 1.00 0.51 N ATOM 1456 CA GLY A 369 14.299 -1.096 -7.130 1.00 0.56 C ATOM 1457 C GLY A 369 15.531 -1.741 -6.533 1.00 0.52 C ATOM 1458 O GLY A 369 15.430 -2.584 -5.642 1.00 0.54 O ATOM 0 H GLY A 369 12.825 -0.753 -5.686 1.00 0.51 H new ATOM 0 HA2 GLY A 369 13.635 -1.873 -7.508 1.00 0.56 H new ATOM 0 HA3 GLY A 369 14.592 -0.484 -7.983 1.00 0.56 H new ATOM 1462 N LYS A 370 16.695 -1.339 -7.025 1.00 0.55 N ATOM 1463 CA LYS A 370 17.959 -1.946 -6.612 1.00 0.59 C ATOM 1464 C LYS A 370 18.823 -0.930 -5.878 1.00 0.65 C ATOM 1465 O LYS A 370 20.019 -1.145 -5.671 1.00 0.74 O ATOM 1466 CB LYS A 370 18.705 -2.471 -7.842 1.00 0.61 C ATOM 1467 CG LYS A 370 17.813 -3.255 -8.789 1.00 1.27 C ATOM 1468 CD LYS A 370 18.574 -3.740 -10.007 1.00 1.26 C ATOM 1469 CE LYS A 370 17.633 -4.297 -11.065 1.00 2.26 C ATOM 1470 NZ LYS A 370 16.814 -3.226 -11.697 1.00 2.76 N ATOM 0 H LYS A 370 16.793 -0.593 -7.713 1.00 0.55 H new ATOM 0 HA LYS A 370 17.746 -2.774 -5.936 1.00 0.59 H new ATOM 0 HB2 LYS A 370 19.145 -1.631 -8.379 1.00 0.61 H new ATOM 0 HB3 LYS A 370 19.528 -3.108 -7.516 1.00 0.61 H new ATOM 0 HG2 LYS A 370 17.386 -4.109 -8.263 1.00 1.27 H new ATOM 0 HG3 LYS A 370 16.980 -2.628 -9.107 1.00 1.27 H new ATOM 0 HD2 LYS A 370 19.151 -2.917 -10.428 1.00 1.26 H new ATOM 0 HD3 LYS A 370 19.286 -4.510 -9.710 1.00 1.26 H new ATOM 0 HE2 LYS A 370 18.212 -4.812 -11.832 1.00 2.26 H new ATOM 0 HE3 LYS A 370 16.975 -5.038 -10.612 1.00 2.26 H new ATOM 0 HZ1 LYS A 370 16.394 -3.585 -12.578 1.00 2.76 H new ATOM 0 HZ2 LYS A 370 16.057 -2.937 -11.045 1.00 2.76 H new ATOM 0 HZ3 LYS A 370 17.418 -2.407 -11.910 1.00 2.76 H new ATOM 1484 N GLN A 371 18.209 0.172 -5.477 1.00 0.63 N ATOM 1485 CA GLN A 371 18.930 1.254 -4.829 1.00 0.70 C ATOM 1486 C GLN A 371 18.999 1.028 -3.325 1.00 0.73 C ATOM 1487 O GLN A 371 17.972 0.979 -2.646 1.00 0.74 O ATOM 1488 CB GLN A 371 18.258 2.595 -5.139 1.00 0.76 C ATOM 1489 CG GLN A 371 19.074 3.802 -4.702 1.00 1.22 C ATOM 1490 CD GLN A 371 20.414 3.902 -5.416 1.00 1.85 C ATOM 1491 OE1 GLN A 371 20.475 3.431 -6.654 1.00 2.65 O flip ATOM 1492 NE2 GLN A 371 21.386 4.411 -4.863 1.00 2.26 N flip ATOM 0 H GLN A 371 17.209 0.340 -5.590 1.00 0.63 H new ATOM 0 HA GLN A 371 19.948 1.274 -5.217 1.00 0.70 H new ATOM 0 HB2 GLN A 371 18.075 2.660 -6.211 1.00 0.76 H new ATOM 0 HB3 GLN A 371 17.286 2.627 -4.647 1.00 0.76 H new ATOM 0 HG2 GLN A 371 18.500 4.709 -4.889 1.00 1.22 H new ATOM 0 HG3 GLN A 371 19.244 3.749 -3.627 1.00 1.22 H new ATOM 0 HE21 GLN A 371 21.304 4.763 -3.909 1.00 2.26 H new ATOM 0 HE22 GLN A 371 22.275 4.481 -5.358 1.00 2.26 H new ATOM 1501 N ALA A 372 20.211 0.872 -2.815 1.00 0.77 N ATOM 1502 CA ALA A 372 20.423 0.696 -1.392 1.00 0.79 C ATOM 1503 C ALA A 372 20.557 2.044 -0.698 1.00 0.86 C ATOM 1504 O ALA A 372 21.618 2.667 -0.724 1.00 1.01 O ATOM 1505 CB ALA A 372 21.651 -0.166 -1.137 1.00 0.86 C ATOM 0 H ALA A 372 21.066 0.864 -3.372 1.00 0.77 H new ATOM 0 HA ALA A 372 19.555 0.185 -0.976 1.00 0.79 H new ATOM 0 HB1 ALA A 372 21.794 -0.287 -0.063 1.00 0.86 H new ATOM 0 HB2 ALA A 372 21.511 -1.144 -1.597 1.00 0.86 H new ATOM 0 HB3 ALA A 372 22.529 0.315 -1.568 1.00 0.86 H new ATOM 1511 N LEU A 373 19.470 2.496 -0.097 1.00 0.77 N ATOM 1512 CA LEU A 373 19.452 3.758 0.625 1.00 0.82 C ATOM 1513 C LEU A 373 19.824 3.528 2.081 1.00 0.84 C ATOM 1514 O LEU A 373 19.689 2.412 2.583 1.00 0.80 O ATOM 1515 CB LEU A 373 18.055 4.389 0.560 1.00 0.79 C ATOM 1516 CG LEU A 373 17.509 4.655 -0.843 1.00 0.81 C ATOM 1517 CD1 LEU A 373 16.073 5.151 -0.762 1.00 0.80 C ATOM 1518 CD2 LEU A 373 18.390 5.663 -1.573 1.00 0.93 C ATOM 0 H LEU A 373 18.578 2.001 -0.095 1.00 0.77 H new ATOM 0 HA LEU A 373 20.174 4.430 0.162 1.00 0.82 H new ATOM 0 HB2 LEU A 373 17.357 3.735 1.083 1.00 0.79 H new ATOM 0 HB3 LEU A 373 18.078 5.332 1.105 1.00 0.79 H new ATOM 0 HG LEU A 373 17.519 3.723 -1.407 1.00 0.81 H new ATOM 0 HD11 LEU A 373 15.695 5.337 -1.767 1.00 0.80 H new ATOM 0 HD12 LEU A 373 15.454 4.397 -0.276 1.00 0.80 H new ATOM 0 HD13 LEU A 373 16.039 6.075 -0.185 1.00 0.80 H new ATOM 0 HD21 LEU A 373 17.988 5.842 -2.570 1.00 0.93 H new ATOM 0 HD22 LEU A 373 18.409 6.600 -1.016 1.00 0.93 H new ATOM 0 HD23 LEU A 373 19.403 5.269 -1.655 1.00 0.93 H new ATOM 1530 N PRO A 374 20.314 4.565 2.781 1.00 0.94 N ATOM 1531 CA PRO A 374 20.529 4.487 4.222 1.00 0.98 C ATOM 1532 C PRO A 374 19.216 4.229 4.946 1.00 0.92 C ATOM 1533 O PRO A 374 18.308 5.062 4.925 1.00 0.92 O ATOM 1534 CB PRO A 374 21.088 5.867 4.590 1.00 1.10 C ATOM 1535 CG PRO A 374 21.598 6.430 3.310 1.00 1.31 C ATOM 1536 CD PRO A 374 20.720 5.864 2.229 1.00 1.05 C ATOM 0 HA PRO A 374 21.199 3.674 4.504 1.00 0.98 H new ATOM 0 HB2 PRO A 374 20.315 6.504 5.021 1.00 1.10 H new ATOM 0 HB3 PRO A 374 21.884 5.786 5.330 1.00 1.10 H new ATOM 0 HG2 PRO A 374 21.554 7.519 3.318 1.00 1.31 H new ATOM 0 HG3 PRO A 374 22.640 6.154 3.150 1.00 1.31 H new ATOM 0 HD2 PRO A 374 19.861 6.504 2.030 1.00 1.05 H new ATOM 0 HD3 PRO A 374 21.259 5.752 1.288 1.00 1.05 H new ATOM 1544 N GLY A 375 19.118 3.066 5.566 1.00 0.90 N ATOM 1545 CA GLY A 375 17.891 2.668 6.223 1.00 0.90 C ATOM 1546 C GLY A 375 17.032 1.778 5.344 1.00 0.82 C ATOM 1547 O GLY A 375 16.320 0.909 5.845 1.00 0.86 O ATOM 0 H GLY A 375 19.874 2.383 5.627 1.00 0.90 H new ATOM 0 HA2 GLY A 375 18.130 2.141 7.147 1.00 0.90 H new ATOM 0 HA3 GLY A 375 17.325 3.557 6.500 1.00 0.90 H new ATOM 1551 N ILE A 376 17.119 1.972 4.032 1.00 0.74 N ATOM 1552 CA ILE A 376 16.331 1.183 3.086 1.00 0.68 C ATOM 1553 C ILE A 376 17.237 0.607 1.998 1.00 0.65 C ATOM 1554 O ILE A 376 17.311 1.146 0.892 1.00 0.67 O ATOM 1555 CB ILE A 376 15.221 2.024 2.406 1.00 0.66 C ATOM 1556 CG1 ILE A 376 14.446 2.843 3.444 1.00 0.72 C ATOM 1557 CG2 ILE A 376 14.273 1.117 1.625 1.00 0.64 C ATOM 1558 CD1 ILE A 376 13.414 3.768 2.835 1.00 0.74 C ATOM 0 H ILE A 376 17.726 2.667 3.598 1.00 0.74 H new ATOM 0 HA ILE A 376 15.860 0.383 3.657 1.00 0.68 H new ATOM 0 HB ILE A 376 15.693 2.717 1.710 1.00 0.66 H new ATOM 0 HG12 ILE A 376 13.949 2.162 4.135 1.00 0.72 H new ATOM 0 HG13 ILE A 376 15.151 3.433 4.029 1.00 0.72 H new ATOM 0 HG21 ILE A 376 13.498 1.721 1.153 1.00 0.64 H new ATOM 0 HG22 ILE A 376 14.832 0.580 0.859 1.00 0.64 H new ATOM 0 HG23 ILE A 376 13.811 0.402 2.305 1.00 0.64 H new ATOM 0 HD11 ILE A 376 12.904 4.316 3.627 1.00 0.74 H new ATOM 0 HD12 ILE A 376 13.907 4.473 2.166 1.00 0.74 H new ATOM 0 HD13 ILE A 376 12.687 3.182 2.273 1.00 0.74 H new ATOM 1570 N PRO A 377 17.971 -0.471 2.304 1.00 0.64 N ATOM 1571 CA PRO A 377 18.881 -1.100 1.353 1.00 0.67 C ATOM 1572 C PRO A 377 18.141 -1.946 0.323 1.00 0.63 C ATOM 1573 O PRO A 377 16.955 -2.241 0.483 1.00 0.58 O ATOM 1574 CB PRO A 377 19.779 -1.989 2.224 1.00 0.71 C ATOM 1575 CG PRO A 377 19.384 -1.718 3.642 1.00 0.71 C ATOM 1576 CD PRO A 377 17.989 -1.164 3.594 1.00 0.63 C ATOM 0 HA PRO A 377 19.435 -0.357 0.779 1.00 0.67 H new ATOM 0 HB2 PRO A 377 19.643 -3.042 1.976 1.00 0.71 H new ATOM 0 HB3 PRO A 377 20.832 -1.757 2.062 1.00 0.71 H new ATOM 0 HG2 PRO A 377 19.419 -2.631 4.236 1.00 0.71 H new ATOM 0 HG3 PRO A 377 20.068 -1.008 4.107 1.00 0.71 H new ATOM 0 HD2 PRO A 377 17.237 -1.952 3.643 1.00 0.63 H new ATOM 0 HD3 PRO A 377 17.793 -0.484 4.423 1.00 0.63 H new ATOM 1584 N ALA A 378 18.840 -2.323 -0.739 1.00 0.68 N ATOM 1585 CA ALA A 378 18.264 -3.188 -1.759 1.00 0.68 C ATOM 1586 C ALA A 378 17.818 -4.517 -1.151 1.00 0.65 C ATOM 1587 O ALA A 378 18.358 -4.948 -0.130 1.00 0.65 O ATOM 1588 CB ALA A 378 19.266 -3.424 -2.876 1.00 0.74 C ATOM 0 H ALA A 378 19.805 -2.044 -0.916 1.00 0.68 H new ATOM 0 HA ALA A 378 17.387 -2.693 -2.176 1.00 0.68 H new ATOM 0 HB1 ALA A 378 18.822 -4.072 -3.632 1.00 0.74 H new ATOM 0 HB2 ALA A 378 19.537 -2.470 -3.329 1.00 0.74 H new ATOM 0 HB3 ALA A 378 20.159 -3.899 -2.469 1.00 0.74 H new ATOM 1594 N ASN A 379 16.819 -5.145 -1.775 1.00 0.68 N ATOM 1595 CA ASN A 379 16.268 -6.429 -1.315 1.00 0.69 C ATOM 1596 C ASN A 379 15.389 -6.250 -0.078 1.00 0.62 C ATOM 1597 O ASN A 379 14.913 -7.229 0.494 1.00 0.67 O ATOM 1598 CB ASN A 379 17.375 -7.456 -1.021 1.00 0.80 C ATOM 1599 CG ASN A 379 18.110 -7.915 -2.268 1.00 0.93 C ATOM 1600 OD1 ASN A 379 17.388 -8.082 -3.363 1.00 1.49 O flip ATOM 1601 ND2 ASN A 379 19.317 -8.149 -2.235 1.00 1.37 N flip ATOM 0 H ASN A 379 16.367 -4.781 -2.614 1.00 0.68 H new ATOM 0 HA ASN A 379 15.653 -6.811 -2.130 1.00 0.69 H new ATOM 0 HB2 ASN A 379 18.091 -7.020 -0.325 1.00 0.80 H new ATOM 0 HB3 ASN A 379 16.936 -8.322 -0.526 1.00 0.80 H new ATOM 0 HD21 ASN A 379 19.840 -8.008 -1.371 1.00 1.37 H new ATOM 0 HD22 ASN A 379 19.795 -8.484 -3.072 1.00 1.37 H new ATOM 1608 N SER A 380 15.166 -5.008 0.335 1.00 0.63 N ATOM 1609 CA SER A 380 14.279 -4.745 1.453 1.00 0.64 C ATOM 1610 C SER A 380 12.836 -4.697 0.976 1.00 0.49 C ATOM 1611 O SER A 380 12.361 -3.679 0.479 1.00 0.60 O ATOM 1612 CB SER A 380 14.659 -3.446 2.159 1.00 0.84 C ATOM 1613 OG SER A 380 15.988 -3.515 2.640 1.00 1.84 O ATOM 0 H SER A 380 15.584 -4.178 -0.085 1.00 0.63 H new ATOM 0 HA SER A 380 14.382 -5.557 2.173 1.00 0.64 H new ATOM 0 HB2 SER A 380 14.558 -2.608 1.470 1.00 0.84 H new ATOM 0 HB3 SER A 380 13.975 -3.262 2.987 1.00 0.84 H new ATOM 0 HG SER A 380 16.594 -3.106 1.987 1.00 1.84 H new ATOM 1619 N GLU A 381 12.174 -5.836 1.085 1.00 0.39 N ATOM 1620 CA GLU A 381 10.783 -5.966 0.690 1.00 0.30 C ATOM 1621 C GLU A 381 9.905 -5.134 1.623 1.00 0.27 C ATOM 1622 O GLU A 381 9.795 -5.422 2.814 1.00 0.32 O ATOM 1623 CB GLU A 381 10.402 -7.450 0.724 1.00 0.39 C ATOM 1624 CG GLU A 381 9.139 -7.801 -0.041 1.00 0.52 C ATOM 1625 CD GLU A 381 9.086 -9.275 -0.391 1.00 0.82 C ATOM 1626 OE1 GLU A 381 9.360 -9.616 -1.562 1.00 0.98 O ATOM 1627 OE2 GLU A 381 8.815 -10.101 0.510 1.00 1.03 O ATOM 0 H GLU A 381 12.585 -6.695 1.449 1.00 0.39 H new ATOM 0 HA GLU A 381 10.632 -5.592 -0.323 1.00 0.30 H new ATOM 0 HB2 GLU A 381 11.229 -8.032 0.318 1.00 0.39 H new ATOM 0 HB3 GLU A 381 10.277 -7.755 1.763 1.00 0.39 H new ATOM 0 HG2 GLU A 381 8.267 -7.537 0.557 1.00 0.52 H new ATOM 0 HG3 GLU A 381 9.090 -7.208 -0.954 1.00 0.52 H new ATOM 1634 N LEU A 382 9.312 -4.081 1.080 1.00 0.24 N ATOM 1635 CA LEU A 382 8.553 -3.130 1.879 1.00 0.23 C ATOM 1636 C LEU A 382 7.181 -3.681 2.220 1.00 0.20 C ATOM 1637 O LEU A 382 6.536 -4.331 1.396 1.00 0.22 O ATOM 1638 CB LEU A 382 8.412 -1.799 1.136 1.00 0.27 C ATOM 1639 CG LEU A 382 9.733 -1.114 0.774 1.00 0.32 C ATOM 1640 CD1 LEU A 382 9.466 0.200 0.062 1.00 0.37 C ATOM 1641 CD2 LEU A 382 10.579 -0.877 2.014 1.00 0.37 C ATOM 0 H LEU A 382 9.342 -3.863 0.084 1.00 0.24 H new ATOM 0 HA LEU A 382 9.098 -2.961 2.808 1.00 0.23 H new ATOM 0 HB2 LEU A 382 7.846 -1.970 0.220 1.00 0.27 H new ATOM 0 HB3 LEU A 382 7.824 -1.118 1.751 1.00 0.27 H new ATOM 0 HG LEU A 382 10.286 -1.773 0.105 1.00 0.32 H new ATOM 0 HD11 LEU A 382 10.413 0.677 -0.190 1.00 0.37 H new ATOM 0 HD12 LEU A 382 8.901 0.011 -0.851 1.00 0.37 H new ATOM 0 HD13 LEU A 382 8.891 0.857 0.715 1.00 0.37 H new ATOM 0 HD21 LEU A 382 11.512 -0.390 1.730 1.00 0.37 H new ATOM 0 HD22 LEU A 382 10.034 -0.240 2.710 1.00 0.37 H new ATOM 0 HD23 LEU A 382 10.799 -1.831 2.492 1.00 0.37 H new ATOM 1653 N THR A 383 6.733 -3.425 3.435 1.00 0.20 N ATOM 1654 CA THR A 383 5.449 -3.909 3.887 1.00 0.20 C ATOM 1655 C THR A 383 4.569 -2.722 4.270 1.00 0.19 C ATOM 1656 O THR A 383 4.918 -1.942 5.156 1.00 0.18 O ATOM 1657 CB THR A 383 5.623 -4.846 5.098 1.00 0.23 C ATOM 1658 OG1 THR A 383 6.597 -5.847 4.784 1.00 0.26 O ATOM 1659 CG2 THR A 383 4.309 -5.516 5.475 1.00 0.27 C ATOM 0 H THR A 383 7.246 -2.880 4.128 1.00 0.20 H new ATOM 0 HA THR A 383 4.976 -4.471 3.081 1.00 0.20 H new ATOM 0 HB THR A 383 5.955 -4.250 5.948 1.00 0.23 H new ATOM 0 HG1 THR A 383 6.712 -6.444 5.553 1.00 0.26 H new ATOM 0 HG21 THR A 383 4.467 -6.170 6.333 1.00 0.27 H new ATOM 0 HG22 THR A 383 3.572 -4.754 5.730 1.00 0.27 H new ATOM 0 HG23 THR A 383 3.946 -6.104 4.632 1.00 0.27 H new ATOM 1667 N PHE A 384 3.439 -2.580 3.597 1.00 0.21 N ATOM 1668 CA PHE A 384 2.569 -1.438 3.817 1.00 0.20 C ATOM 1669 C PHE A 384 1.230 -1.870 4.386 1.00 0.21 C ATOM 1670 O PHE A 384 0.459 -2.573 3.732 1.00 0.24 O ATOM 1671 CB PHE A 384 2.353 -0.660 2.515 1.00 0.21 C ATOM 1672 CG PHE A 384 3.506 0.229 2.136 1.00 0.21 C ATOM 1673 CD1 PHE A 384 3.541 1.558 2.532 1.00 0.27 C ATOM 1674 CD2 PHE A 384 4.555 -0.266 1.379 1.00 0.22 C ATOM 1675 CE1 PHE A 384 4.600 2.372 2.180 1.00 0.32 C ATOM 1676 CE2 PHE A 384 5.617 0.545 1.024 1.00 0.27 C ATOM 1677 CZ PHE A 384 5.637 1.879 1.450 1.00 0.31 C ATOM 0 H PHE A 384 3.104 -3.240 2.895 1.00 0.21 H new ATOM 0 HA PHE A 384 3.059 -0.787 4.541 1.00 0.20 H new ATOM 0 HB2 PHE A 384 2.172 -1.368 1.706 1.00 0.21 H new ATOM 0 HB3 PHE A 384 1.454 -0.051 2.612 1.00 0.21 H new ATOM 0 HD1 PHE A 384 2.731 1.961 3.122 1.00 0.27 H new ATOM 0 HD2 PHE A 384 4.543 -1.298 1.062 1.00 0.22 H new ATOM 0 HE1 PHE A 384 4.605 3.408 2.487 1.00 0.32 H new ATOM 0 HE2 PHE A 384 6.424 0.153 0.423 1.00 0.27 H new ATOM 0 HZ PHE A 384 6.473 2.515 1.200 1.00 0.31 H new ATOM 1687 N ASP A 385 0.966 -1.456 5.611 1.00 0.21 N ATOM 1688 CA ASP A 385 -0.321 -1.700 6.243 1.00 0.27 C ATOM 1689 C ASP A 385 -1.217 -0.506 5.954 1.00 0.23 C ATOM 1690 O ASP A 385 -1.037 0.564 6.536 1.00 0.27 O ATOM 1691 CB ASP A 385 -0.131 -1.885 7.753 1.00 0.42 C ATOM 1692 CG ASP A 385 -1.305 -2.562 8.433 1.00 0.95 C ATOM 1693 OD1 ASP A 385 -1.814 -2.020 9.440 1.00 1.80 O ATOM 1694 OD2 ASP A 385 -1.688 -3.667 7.996 1.00 1.30 O ATOM 0 H ASP A 385 1.630 -0.945 6.193 1.00 0.21 H new ATOM 0 HA ASP A 385 -0.779 -2.608 5.850 1.00 0.27 H new ATOM 0 HB2 ASP A 385 0.769 -2.474 7.928 1.00 0.42 H new ATOM 0 HB3 ASP A 385 0.032 -0.910 8.213 1.00 0.42 H new ATOM 1699 N VAL A 386 -2.161 -0.673 5.038 1.00 0.21 N ATOM 1700 CA VAL A 386 -2.882 0.471 4.490 1.00 0.23 C ATOM 1701 C VAL A 386 -4.394 0.281 4.532 1.00 0.22 C ATOM 1702 O VAL A 386 -4.900 -0.836 4.413 1.00 0.31 O ATOM 1703 CB VAL A 386 -2.462 0.749 3.022 1.00 0.26 C ATOM 1704 CG1 VAL A 386 -0.958 0.931 2.901 1.00 0.28 C ATOM 1705 CG2 VAL A 386 -2.928 -0.362 2.093 1.00 0.29 C ATOM 0 H VAL A 386 -2.444 -1.578 4.661 1.00 0.21 H new ATOM 0 HA VAL A 386 -2.618 1.319 5.121 1.00 0.23 H new ATOM 0 HB VAL A 386 -2.947 1.678 2.721 1.00 0.26 H new ATOM 0 HG11 VAL A 386 -0.697 1.124 1.860 1.00 0.28 H new ATOM 0 HG12 VAL A 386 -0.643 1.774 3.516 1.00 0.28 H new ATOM 0 HG13 VAL A 386 -0.454 0.026 3.239 1.00 0.28 H new ATOM 0 HG21 VAL A 386 -2.618 -0.137 1.073 1.00 0.29 H new ATOM 0 HG22 VAL A 386 -2.486 -1.308 2.406 1.00 0.29 H new ATOM 0 HG23 VAL A 386 -4.015 -0.438 2.134 1.00 0.29 H new ATOM 1715 N LYS A 387 -5.108 1.381 4.707 1.00 0.19 N ATOM 1716 CA LYS A 387 -6.553 1.374 4.570 1.00 0.22 C ATOM 1717 C LYS A 387 -7.055 2.673 3.970 1.00 0.21 C ATOM 1718 O LYS A 387 -6.456 3.737 4.154 1.00 0.22 O ATOM 1719 CB LYS A 387 -7.249 1.090 5.900 1.00 0.32 C ATOM 1720 CG LYS A 387 -6.762 1.901 7.081 1.00 1.08 C ATOM 1721 CD LYS A 387 -7.421 1.374 8.338 1.00 1.06 C ATOM 1722 CE LYS A 387 -6.758 1.871 9.603 1.00 1.62 C ATOM 1723 NZ LYS A 387 -7.038 0.952 10.739 1.00 2.53 N ATOM 0 H LYS A 387 -4.709 2.289 4.944 1.00 0.19 H new ATOM 0 HA LYS A 387 -6.804 0.563 3.886 1.00 0.22 H new ATOM 0 HB2 LYS A 387 -8.317 1.269 5.776 1.00 0.32 H new ATOM 0 HB3 LYS A 387 -7.128 0.032 6.134 1.00 0.32 H new ATOM 0 HG2 LYS A 387 -5.678 1.831 7.166 1.00 1.08 H new ATOM 0 HG3 LYS A 387 -7.004 2.955 6.941 1.00 1.08 H new ATOM 0 HD2 LYS A 387 -8.470 1.670 8.343 1.00 1.06 H new ATOM 0 HD3 LYS A 387 -7.397 0.284 8.325 1.00 1.06 H new ATOM 0 HE2 LYS A 387 -5.682 1.949 9.449 1.00 1.62 H new ATOM 0 HE3 LYS A 387 -7.120 2.871 9.840 1.00 1.62 H new ATOM 0 HZ1 LYS A 387 -6.738 1.399 11.629 1.00 2.53 H new ATOM 0 HZ2 LYS A 387 -8.058 0.751 10.780 1.00 2.53 H new ATOM 0 HZ3 LYS A 387 -6.515 0.063 10.604 1.00 2.53 H new ATOM 1737 N LEU A 388 -8.160 2.573 3.252 1.00 0.21 N ATOM 1738 CA LEU A 388 -8.727 3.711 2.555 1.00 0.21 C ATOM 1739 C LEU A 388 -9.866 4.288 3.381 1.00 0.24 C ATOM 1740 O LEU A 388 -10.652 3.538 3.957 1.00 0.28 O ATOM 1741 CB LEU A 388 -9.221 3.272 1.173 1.00 0.21 C ATOM 1742 CG LEU A 388 -9.623 4.401 0.232 1.00 0.21 C ATOM 1743 CD1 LEU A 388 -8.456 5.348 0.027 1.00 0.22 C ATOM 1744 CD2 LEU A 388 -10.095 3.834 -1.096 1.00 0.24 C ATOM 0 H LEU A 388 -8.685 1.706 3.137 1.00 0.21 H new ATOM 0 HA LEU A 388 -7.969 4.482 2.419 1.00 0.21 H new ATOM 0 HB2 LEU A 388 -8.436 2.686 0.695 1.00 0.21 H new ATOM 0 HB3 LEU A 388 -10.077 2.610 1.305 1.00 0.21 H new ATOM 0 HG LEU A 388 -10.446 4.959 0.678 1.00 0.21 H new ATOM 0 HD11 LEU A 388 -8.753 6.151 -0.647 1.00 0.22 H new ATOM 0 HD12 LEU A 388 -8.158 5.771 0.986 1.00 0.22 H new ATOM 0 HD13 LEU A 388 -7.617 4.803 -0.406 1.00 0.22 H new ATOM 0 HD21 LEU A 388 -10.379 4.650 -1.760 1.00 0.24 H new ATOM 0 HD22 LEU A 388 -9.290 3.259 -1.553 1.00 0.24 H new ATOM 0 HD23 LEU A 388 -10.955 3.185 -0.930 1.00 0.24 H new ATOM 1756 N VAL A 389 -9.952 5.612 3.460 1.00 0.26 N ATOM 1757 CA VAL A 389 -10.947 6.244 4.322 1.00 0.32 C ATOM 1758 C VAL A 389 -11.775 7.300 3.585 1.00 0.33 C ATOM 1759 O VAL A 389 -12.756 7.809 4.127 1.00 0.39 O ATOM 1760 CB VAL A 389 -10.297 6.882 5.576 1.00 0.39 C ATOM 1761 CG1 VAL A 389 -9.632 5.818 6.444 1.00 0.45 C ATOM 1762 CG2 VAL A 389 -9.299 7.967 5.190 1.00 0.40 C ATOM 0 H VAL A 389 -9.355 6.261 2.947 1.00 0.26 H new ATOM 0 HA VAL A 389 -11.617 5.444 4.636 1.00 0.32 H new ATOM 0 HB VAL A 389 -11.090 7.351 6.159 1.00 0.39 H new ATOM 0 HG11 VAL A 389 -9.183 6.290 7.318 1.00 0.45 H new ATOM 0 HG12 VAL A 389 -10.379 5.093 6.767 1.00 0.45 H new ATOM 0 HG13 VAL A 389 -8.858 5.310 5.868 1.00 0.45 H new ATOM 0 HG21 VAL A 389 -8.860 8.395 6.091 1.00 0.40 H new ATOM 0 HG22 VAL A 389 -8.511 7.534 4.573 1.00 0.40 H new ATOM 0 HG23 VAL A 389 -9.811 8.749 4.629 1.00 0.40 H new ATOM 1772 N SER A 390 -11.389 7.627 2.353 1.00 0.32 N ATOM 1773 CA SER A 390 -12.102 8.633 1.562 1.00 0.35 C ATOM 1774 C SER A 390 -11.763 8.498 0.078 1.00 0.31 C ATOM 1775 O SER A 390 -10.726 7.940 -0.280 1.00 0.26 O ATOM 1776 CB SER A 390 -11.761 10.050 2.052 1.00 0.43 C ATOM 1777 OG SER A 390 -12.247 10.270 3.370 1.00 1.32 O ATOM 0 H SER A 390 -10.587 7.211 1.879 1.00 0.32 H new ATOM 0 HA SER A 390 -13.171 8.465 1.691 1.00 0.35 H new ATOM 0 HB2 SER A 390 -10.681 10.195 2.031 1.00 0.43 H new ATOM 0 HB3 SER A 390 -12.194 10.786 1.374 1.00 0.43 H new ATOM 0 HG SER A 390 -12.769 9.493 3.660 1.00 1.32 H new ATOM 1783 N MET A 391 -12.644 9.011 -0.778 1.00 0.38 N ATOM 1784 CA MET A 391 -12.454 8.929 -2.223 1.00 0.37 C ATOM 1785 C MET A 391 -13.207 10.049 -2.935 1.00 0.49 C ATOM 1786 O MET A 391 -14.382 10.295 -2.650 1.00 0.56 O ATOM 1787 CB MET A 391 -12.932 7.568 -2.740 1.00 0.36 C ATOM 1788 CG MET A 391 -12.930 7.448 -4.253 1.00 0.41 C ATOM 1789 SD MET A 391 -13.392 5.800 -4.810 1.00 0.49 S ATOM 1790 CE MET A 391 -12.123 4.820 -4.015 1.00 0.44 C ATOM 0 H MET A 391 -13.499 9.489 -0.494 1.00 0.38 H new ATOM 0 HA MET A 391 -11.390 9.040 -2.434 1.00 0.37 H new ATOM 0 HB2 MET A 391 -12.295 6.788 -2.323 1.00 0.36 H new ATOM 0 HB3 MET A 391 -13.942 7.385 -2.372 1.00 0.36 H new ATOM 0 HG2 MET A 391 -13.621 8.178 -4.674 1.00 0.41 H new ATOM 0 HG3 MET A 391 -11.938 7.692 -4.633 1.00 0.41 H new ATOM 0 HE1 MET A 391 -12.348 3.761 -4.142 1.00 0.44 H new ATOM 0 HE2 MET A 391 -11.156 5.042 -4.466 1.00 0.44 H new ATOM 0 HE3 MET A 391 -12.091 5.059 -2.952 1.00 0.44 H new ATOM 1800 N LYS A 392 -12.518 10.726 -3.847 1.00 0.56 N ATOM 1801 CA LYS A 392 -13.110 11.780 -4.664 1.00 0.71 C ATOM 1802 C LYS A 392 -12.490 11.756 -6.059 1.00 1.63 C ATOM 1803 O LYS A 392 -11.927 10.708 -6.442 1.00 2.38 O ATOM 1804 CB LYS A 392 -12.887 13.162 -4.030 1.00 1.70 C ATOM 1805 CG LYS A 392 -13.703 13.413 -2.769 1.00 2.54 C ATOM 1806 CD LYS A 392 -13.366 14.760 -2.147 1.00 3.38 C ATOM 1807 CE LYS A 392 -14.236 15.053 -0.931 1.00 4.14 C ATOM 1808 NZ LYS A 392 -15.650 15.322 -1.305 1.00 4.91 N ATOM 1809 OXT LYS A 392 -12.554 12.786 -6.761 1.00 2.36 O ATOM 0 H LYS A 392 -11.531 10.559 -4.041 1.00 0.56 H new ATOM 0 HA LYS A 392 -14.183 11.599 -4.730 1.00 0.71 H new ATOM 0 HB2 LYS A 392 -11.829 13.273 -3.792 1.00 1.70 H new ATOM 0 HB3 LYS A 392 -13.131 13.929 -4.765 1.00 1.70 H new ATOM 0 HG2 LYS A 392 -14.766 13.377 -3.009 1.00 2.54 H new ATOM 0 HG3 LYS A 392 -13.512 12.619 -2.047 1.00 2.54 H new ATOM 0 HD2 LYS A 392 -12.316 14.773 -1.855 1.00 3.38 H new ATOM 0 HD3 LYS A 392 -13.501 15.547 -2.889 1.00 3.38 H new ATOM 0 HE2 LYS A 392 -14.198 14.206 -0.246 1.00 4.14 H new ATOM 0 HE3 LYS A 392 -13.833 15.913 -0.397 1.00 4.14 H new ATOM 0 HZ1 LYS A 392 -16.179 15.632 -0.465 1.00 4.91 H new ATOM 0 HZ2 LYS A 392 -15.682 16.068 -2.028 1.00 4.91 H new ATOM 0 HZ3 LYS A 392 -16.080 14.454 -1.684 1.00 4.91 H new