USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=29 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 313 TYR OH : rot -168:sc= 0.0947 USER MOD Set 1.2: A 326 ASN : amide:sc= 1.47 K(o=1.6,f=0.97) USER MOD Single : A 283 THR OG1 : rot -26:sc= 0.285 USER MOD Single : A 284 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 297 THR OG1 : rot 36:sc= 0.289 USER MOD Single : A 299 LYS NZ :NH3+ -166:sc= -0.0229 (180deg=-0.205) USER MOD Single : A 302 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 304 LYS NZ :NH3+ 166:sc= -0.0527 (180deg=-0.248) USER MOD Single : A 305 LYS NZ :NH3+ -124:sc= 0.44 (180deg=-0.612) USER MOD Single : A 307 THR OG1 : rot -140:sc= 0.156 USER MOD Single : A 311 MET CE :methyl -162:sc= -3.26! (180deg=-3.83!) USER MOD Single : A 316 LYS NZ :NH3+ -151:sc= -0.182 (180deg=-1.04!) USER MOD Single : A 318 LYS NZ :NH3+ 151:sc= 1.25 (180deg=0.599) USER MOD Single : A 319 ASN : amide:sc= -0.42 K(o=-0.42,f=-10!) USER MOD Single : A 321 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0255) USER MOD Single : A 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 327 THR OG1 : rot 180:sc= -0.0835 USER MOD Single : A 328 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0105) USER MOD Single : A 330 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00661) USER MOD Single : A 335 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0128) USER MOD Single : A 338 GLN :FLIP amide:sc= -1.6 F(o=-3.7!,f=-1.6) USER MOD Single : A 343 LYS NZ :NH3+ 154:sc= 1.26 (180deg=1.01) USER MOD Single : A 352 MET CE :methyl -144:sc= -3.02! (180deg=-7.73!) USER MOD Single : A 366 TYR OH : rot 14:sc= -0.643! USER MOD Single : A 368 TYR OH : rot 180:sc= 0 USER MOD Single : A 370 LYS NZ :NH3+ -166:sc= -0.0163 (180deg=-0.197) USER MOD Single : A 371 GLN :FLIP amide:sc= -1.01 F(o=-5.3!,f=-1) USER MOD Single : A 379 ASN :FLIP amide:sc= -0.043 F(o=-0.96,f=-0.043) USER MOD Single : A 380 SER OG : rot -94:sc= 0.982 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 LYS NZ :NH3+ -134:sc= 0.22 (180deg=-0.0686) USER MOD Single : A 390 SER OG : rot 180:sc= -0.487 USER MOD Single : A 391 MET CE :methyl 171:sc= -2.3! (180deg=-2.69) USER MOD Single : A 392 LYS NZ :NH3+ -128:sc= -1.94! (180deg=-4.47!) USER MOD ----------------------------------------------------------------- ATOM 105 N THR A 283 -3.728 -14.488 1.530 1.00 0.54 N ATOM 106 CA THR A 283 -3.010 -13.484 0.762 1.00 0.50 C ATOM 107 C THR A 283 -2.949 -13.845 -0.721 1.00 0.56 C ATOM 108 O THR A 283 -2.949 -15.023 -1.091 1.00 0.71 O ATOM 109 CB THR A 283 -1.585 -13.317 1.313 1.00 0.64 C ATOM 110 OG1 THR A 283 -0.984 -14.606 1.496 1.00 0.76 O ATOM 111 CG2 THR A 283 -1.596 -12.562 2.635 1.00 0.71 C ATOM 0 HA THR A 283 -3.554 -12.544 0.859 1.00 0.50 H new ATOM 0 HB THR A 283 -1.004 -12.740 0.594 1.00 0.64 H new ATOM 0 HG1 THR A 283 -1.684 -15.275 1.644 1.00 0.76 H new ATOM 0 HG21 THR A 283 -0.575 -12.458 3.003 1.00 0.71 H new ATOM 0 HG22 THR A 283 -2.031 -11.574 2.486 1.00 0.71 H new ATOM 0 HG23 THR A 283 -2.190 -13.113 3.364 1.00 0.71 H new ATOM 119 N LYS A 284 -2.888 -12.816 -1.555 1.00 0.52 N ATOM 120 CA LYS A 284 -2.964 -12.980 -2.998 1.00 0.58 C ATOM 121 C LYS A 284 -1.698 -12.489 -3.668 1.00 0.51 C ATOM 122 O LYS A 284 -1.094 -11.509 -3.233 1.00 0.47 O ATOM 123 CB LYS A 284 -4.178 -12.243 -3.567 1.00 0.73 C ATOM 124 CG LYS A 284 -5.499 -12.920 -3.252 1.00 0.87 C ATOM 125 CD LYS A 284 -6.675 -12.136 -3.808 1.00 1.49 C ATOM 126 CE LYS A 284 -7.960 -12.942 -3.743 1.00 1.78 C ATOM 127 NZ LYS A 284 -9.139 -12.155 -4.197 1.00 2.06 N ATOM 0 H LYS A 284 -2.785 -11.848 -1.251 1.00 0.52 H new ATOM 0 HA LYS A 284 -3.074 -14.045 -3.204 1.00 0.58 H new ATOM 0 HB2 LYS A 284 -4.195 -11.228 -3.171 1.00 0.73 H new ATOM 0 HB3 LYS A 284 -4.069 -12.161 -4.648 1.00 0.73 H new ATOM 0 HG2 LYS A 284 -5.502 -13.927 -3.670 1.00 0.87 H new ATOM 0 HG3 LYS A 284 -5.607 -13.023 -2.172 1.00 0.87 H new ATOM 0 HD2 LYS A 284 -6.796 -11.210 -3.245 1.00 1.49 H new ATOM 0 HD3 LYS A 284 -6.471 -11.856 -4.842 1.00 1.49 H new ATOM 0 HE2 LYS A 284 -7.860 -13.834 -4.362 1.00 1.78 H new ATOM 0 HE3 LYS A 284 -8.123 -13.281 -2.720 1.00 1.78 H new ATOM 0 HZ1 LYS A 284 -9.994 -12.744 -4.136 1.00 2.06 H new ATOM 0 HZ2 LYS A 284 -9.252 -11.317 -3.591 1.00 2.06 H new ATOM 0 HZ3 LYS A 284 -8.996 -11.853 -5.182 1.00 2.06 H new ATOM 141 N LEU A 285 -1.310 -13.180 -4.725 1.00 0.61 N ATOM 142 CA LEU A 285 -0.095 -12.860 -5.447 1.00 0.63 C ATOM 143 C LEU A 285 -0.424 -12.121 -6.737 1.00 0.67 C ATOM 144 O LEU A 285 -1.191 -12.612 -7.566 1.00 0.75 O ATOM 145 CB LEU A 285 0.678 -14.145 -5.760 1.00 0.76 C ATOM 146 CG LEU A 285 2.017 -13.949 -6.477 1.00 0.84 C ATOM 147 CD1 LEU A 285 2.991 -13.183 -5.597 1.00 0.78 C ATOM 148 CD2 LEU A 285 2.605 -15.291 -6.888 1.00 0.98 C ATOM 0 H LEU A 285 -1.826 -13.974 -5.104 1.00 0.61 H new ATOM 0 HA LEU A 285 0.524 -12.214 -4.824 1.00 0.63 H new ATOM 0 HB2 LEU A 285 0.860 -14.676 -4.826 1.00 0.76 H new ATOM 0 HB3 LEU A 285 0.047 -14.788 -6.374 1.00 0.76 H new ATOM 0 HG LEU A 285 1.840 -13.362 -7.378 1.00 0.84 H new ATOM 0 HD11 LEU A 285 3.936 -13.055 -6.126 1.00 0.78 H new ATOM 0 HD12 LEU A 285 2.573 -12.205 -5.358 1.00 0.78 H new ATOM 0 HD13 LEU A 285 3.163 -13.739 -4.675 1.00 0.78 H new ATOM 0 HD21 LEU A 285 3.556 -15.131 -7.396 1.00 0.98 H new ATOM 0 HD22 LEU A 285 2.766 -15.905 -6.002 1.00 0.98 H new ATOM 0 HD23 LEU A 285 1.915 -15.800 -7.561 1.00 0.98 H new ATOM 160 N LEU A 286 0.156 -10.945 -6.892 1.00 0.65 N ATOM 161 CA LEU A 286 -0.038 -10.140 -8.089 1.00 0.71 C ATOM 162 C LEU A 286 1.272 -10.041 -8.859 1.00 0.77 C ATOM 163 O LEU A 286 2.265 -10.671 -8.482 1.00 0.80 O ATOM 164 CB LEU A 286 -0.535 -8.737 -7.720 1.00 0.64 C ATOM 165 CG LEU A 286 -1.888 -8.693 -7.014 1.00 0.64 C ATOM 166 CD1 LEU A 286 -2.244 -7.263 -6.640 1.00 0.63 C ATOM 167 CD2 LEU A 286 -2.965 -9.295 -7.898 1.00 0.76 C ATOM 0 H LEU A 286 0.771 -10.521 -6.198 1.00 0.65 H new ATOM 0 HA LEU A 286 -0.790 -10.620 -8.715 1.00 0.71 H new ATOM 0 HB2 LEU A 286 0.208 -8.263 -7.078 1.00 0.64 H new ATOM 0 HB3 LEU A 286 -0.598 -8.140 -8.630 1.00 0.64 H new ATOM 0 HG LEU A 286 -1.822 -9.283 -6.100 1.00 0.64 H new ATOM 0 HD11 LEU A 286 -3.211 -7.248 -6.138 1.00 0.63 H new ATOM 0 HD12 LEU A 286 -1.482 -6.861 -5.972 1.00 0.63 H new ATOM 0 HD13 LEU A 286 -2.294 -6.653 -7.542 1.00 0.63 H new ATOM 0 HD21 LEU A 286 -3.924 -9.256 -7.381 1.00 0.76 H new ATOM 0 HD22 LEU A 286 -3.031 -8.729 -8.827 1.00 0.76 H new ATOM 0 HD23 LEU A 286 -2.715 -10.332 -8.121 1.00 0.76 H new ATOM 179 N GLU A 287 1.271 -9.262 -9.933 1.00 0.84 N ATOM 180 CA GLU A 287 2.463 -9.079 -10.757 1.00 0.92 C ATOM 181 C GLU A 287 3.643 -8.561 -9.934 1.00 0.77 C ATOM 182 O GLU A 287 3.475 -7.766 -9.010 1.00 0.64 O ATOM 183 CB GLU A 287 2.169 -8.108 -11.899 1.00 1.05 C ATOM 184 CG GLU A 287 3.186 -8.156 -13.026 1.00 1.39 C ATOM 185 CD GLU A 287 2.843 -7.203 -14.146 1.00 1.96 C ATOM 186 OE1 GLU A 287 1.999 -7.563 -14.994 1.00 2.48 O ATOM 187 OE2 GLU A 287 3.411 -6.089 -14.187 1.00 2.64 O ATOM 0 H GLU A 287 0.454 -8.743 -10.257 1.00 0.84 H new ATOM 0 HA GLU A 287 2.735 -10.053 -11.164 1.00 0.92 H new ATOM 0 HB2 GLU A 287 1.181 -8.328 -12.305 1.00 1.05 H new ATOM 0 HB3 GLU A 287 2.131 -7.094 -11.500 1.00 1.05 H new ATOM 0 HG2 GLU A 287 4.173 -7.912 -12.633 1.00 1.39 H new ATOM 0 HG3 GLU A 287 3.242 -9.171 -13.419 1.00 1.39 H new ATOM 194 N GLY A 288 4.835 -9.024 -10.281 1.00 0.88 N ATOM 195 CA GLY A 288 6.040 -8.596 -9.594 1.00 0.87 C ATOM 196 C GLY A 288 6.183 -9.167 -8.193 1.00 0.98 C ATOM 197 O GLY A 288 7.159 -8.876 -7.501 1.00 1.84 O ATOM 0 H GLY A 288 4.991 -9.695 -11.033 1.00 0.88 H new ATOM 0 HA2 GLY A 288 6.908 -8.888 -10.186 1.00 0.87 H new ATOM 0 HA3 GLY A 288 6.046 -7.508 -9.535 1.00 0.87 H new ATOM 201 N GLY A 289 5.217 -9.977 -7.771 1.00 0.64 N ATOM 202 CA GLY A 289 5.281 -10.583 -6.454 1.00 0.58 C ATOM 203 C GLY A 289 4.518 -9.798 -5.401 1.00 0.48 C ATOM 204 O GLY A 289 4.667 -10.053 -4.208 1.00 0.48 O ATOM 0 H GLY A 289 4.392 -10.224 -8.317 1.00 0.64 H new ATOM 0 HA2 GLY A 289 4.880 -11.595 -6.506 1.00 0.58 H new ATOM 0 HA3 GLY A 289 6.324 -10.669 -6.150 1.00 0.58 H new ATOM 208 N ILE A 290 3.704 -8.842 -5.835 1.00 0.42 N ATOM 209 CA ILE A 290 2.941 -8.017 -4.906 1.00 0.36 C ATOM 210 C ILE A 290 1.895 -8.850 -4.168 1.00 0.36 C ATOM 211 O ILE A 290 1.034 -9.482 -4.780 1.00 0.40 O ATOM 212 CB ILE A 290 2.250 -6.835 -5.625 1.00 0.34 C ATOM 213 CG1 ILE A 290 3.294 -5.929 -6.288 1.00 0.36 C ATOM 214 CG2 ILE A 290 1.396 -6.036 -4.648 1.00 0.32 C ATOM 215 CD1 ILE A 290 2.689 -4.773 -7.056 1.00 0.37 C ATOM 0 H ILE A 290 3.556 -8.620 -6.819 1.00 0.42 H new ATOM 0 HA ILE A 290 3.651 -7.612 -4.184 1.00 0.36 H new ATOM 0 HB ILE A 290 1.598 -7.239 -6.399 1.00 0.34 H new ATOM 0 HG12 ILE A 290 3.962 -5.536 -5.521 1.00 0.36 H new ATOM 0 HG13 ILE A 290 3.904 -6.526 -6.966 1.00 0.36 H new ATOM 0 HG21 ILE A 290 0.919 -5.209 -5.174 1.00 0.32 H new ATOM 0 HG22 ILE A 290 0.631 -6.684 -4.220 1.00 0.32 H new ATOM 0 HG23 ILE A 290 2.027 -5.643 -3.851 1.00 0.32 H new ATOM 0 HD11 ILE A 290 3.485 -4.174 -7.499 1.00 0.37 H new ATOM 0 HD12 ILE A 290 2.043 -5.159 -7.845 1.00 0.37 H new ATOM 0 HD13 ILE A 290 2.103 -4.153 -6.378 1.00 0.37 H new ATOM 227 N ILE A 291 1.991 -8.855 -2.850 1.00 0.35 N ATOM 228 CA ILE A 291 1.057 -9.580 -2.007 1.00 0.37 C ATOM 229 C ILE A 291 0.082 -8.614 -1.350 1.00 0.34 C ATOM 230 O ILE A 291 0.471 -7.534 -0.917 1.00 0.36 O ATOM 231 CB ILE A 291 1.814 -10.373 -0.921 1.00 0.46 C ATOM 232 CG1 ILE A 291 2.652 -11.469 -1.571 1.00 0.60 C ATOM 233 CG2 ILE A 291 0.856 -10.963 0.103 1.00 0.60 C ATOM 234 CD1 ILE A 291 1.845 -12.645 -2.086 1.00 0.93 C ATOM 0 H ILE A 291 2.717 -8.357 -2.335 1.00 0.35 H new ATOM 0 HA ILE A 291 0.501 -10.279 -2.632 1.00 0.37 H new ATOM 0 HB ILE A 291 2.475 -9.687 -0.392 1.00 0.46 H new ATOM 0 HG12 ILE A 291 3.214 -11.038 -2.399 1.00 0.60 H new ATOM 0 HG13 ILE A 291 3.380 -11.832 -0.846 1.00 0.60 H new ATOM 0 HG21 ILE A 291 1.421 -11.515 0.854 1.00 0.60 H new ATOM 0 HG22 ILE A 291 0.300 -10.160 0.586 1.00 0.60 H new ATOM 0 HG23 ILE A 291 0.160 -11.637 -0.396 1.00 0.60 H new ATOM 0 HD11 ILE A 291 2.516 -13.379 -2.533 1.00 0.93 H new ATOM 0 HD12 ILE A 291 1.303 -13.105 -1.259 1.00 0.93 H new ATOM 0 HD13 ILE A 291 1.135 -12.298 -2.837 1.00 0.93 H new ATOM 246 N ILE A 292 -1.181 -8.993 -1.284 1.00 0.34 N ATOM 247 CA ILE A 292 -2.180 -8.173 -0.622 1.00 0.36 C ATOM 248 C ILE A 292 -2.946 -8.989 0.415 1.00 0.41 C ATOM 249 O ILE A 292 -3.408 -10.098 0.134 1.00 0.43 O ATOM 250 CB ILE A 292 -3.163 -7.533 -1.630 1.00 0.38 C ATOM 251 CG1 ILE A 292 -3.733 -8.592 -2.575 1.00 0.41 C ATOM 252 CG2 ILE A 292 -2.466 -6.432 -2.414 1.00 0.39 C ATOM 253 CD1 ILE A 292 -4.800 -8.067 -3.511 1.00 0.48 C ATOM 0 H ILE A 292 -1.540 -9.862 -1.680 1.00 0.34 H new ATOM 0 HA ILE A 292 -1.650 -7.365 -0.118 1.00 0.36 H new ATOM 0 HB ILE A 292 -3.992 -7.093 -1.076 1.00 0.38 H new ATOM 0 HG12 ILE A 292 -2.920 -9.013 -3.166 1.00 0.41 H new ATOM 0 HG13 ILE A 292 -4.151 -9.406 -1.983 1.00 0.41 H new ATOM 0 HG21 ILE A 292 -3.168 -5.989 -3.121 1.00 0.39 H new ATOM 0 HG22 ILE A 292 -2.110 -5.665 -1.726 1.00 0.39 H new ATOM 0 HG23 ILE A 292 -1.620 -6.852 -2.958 1.00 0.39 H new ATOM 0 HD11 ILE A 292 -5.155 -8.876 -4.149 1.00 0.48 H new ATOM 0 HD12 ILE A 292 -5.633 -7.672 -2.929 1.00 0.48 H new ATOM 0 HD13 ILE A 292 -4.382 -7.273 -4.130 1.00 0.48 H new ATOM 265 N GLU A 293 -3.028 -8.450 1.623 1.00 0.46 N ATOM 266 CA GLU A 293 -3.761 -9.075 2.718 1.00 0.51 C ATOM 267 C GLU A 293 -4.884 -8.158 3.174 1.00 0.43 C ATOM 268 O GLU A 293 -4.617 -7.063 3.654 1.00 0.43 O ATOM 269 CB GLU A 293 -2.823 -9.342 3.902 1.00 0.60 C ATOM 270 CG GLU A 293 -3.544 -9.822 5.156 1.00 1.21 C ATOM 271 CD GLU A 293 -2.689 -9.720 6.407 1.00 1.53 C ATOM 272 OE1 GLU A 293 -2.467 -8.590 6.895 1.00 2.31 O ATOM 273 OE2 GLU A 293 -2.265 -10.771 6.926 1.00 1.58 O ATOM 0 H GLU A 293 -2.587 -7.565 1.873 1.00 0.46 H new ATOM 0 HA GLU A 293 -4.174 -10.020 2.364 1.00 0.51 H new ATOM 0 HB2 GLU A 293 -2.085 -10.089 3.609 1.00 0.60 H new ATOM 0 HB3 GLU A 293 -2.276 -8.428 4.135 1.00 0.60 H new ATOM 0 HG2 GLU A 293 -4.452 -9.235 5.294 1.00 1.21 H new ATOM 0 HG3 GLU A 293 -3.853 -10.858 5.017 1.00 1.21 H new ATOM 280 N ASP A 294 -6.126 -8.598 3.057 1.00 0.46 N ATOM 281 CA ASP A 294 -7.252 -7.761 3.447 1.00 0.49 C ATOM 282 C ASP A 294 -7.539 -7.988 4.931 1.00 0.47 C ATOM 283 O ASP A 294 -8.194 -8.956 5.311 1.00 0.71 O ATOM 284 CB ASP A 294 -8.481 -8.069 2.580 1.00 0.65 C ATOM 285 CG ASP A 294 -9.299 -6.828 2.252 1.00 1.60 C ATOM 286 OD1 ASP A 294 -10.389 -6.652 2.852 1.00 2.25 O ATOM 287 OD2 ASP A 294 -8.845 -6.009 1.425 1.00 2.36 O ATOM 0 H ASP A 294 -6.380 -9.519 2.700 1.00 0.46 H new ATOM 0 HA ASP A 294 -7.007 -6.710 3.290 1.00 0.49 H new ATOM 0 HB2 ASP A 294 -8.156 -8.540 1.652 1.00 0.65 H new ATOM 0 HB3 ASP A 294 -9.114 -8.789 3.098 1.00 0.65 H new ATOM 292 N ARG A 295 -6.992 -7.109 5.762 1.00 0.35 N ATOM 293 CA ARG A 295 -7.017 -7.275 7.213 1.00 0.35 C ATOM 294 C ARG A 295 -8.391 -6.944 7.793 1.00 0.40 C ATOM 295 O ARG A 295 -8.923 -7.692 8.611 1.00 0.47 O ATOM 296 CB ARG A 295 -5.927 -6.406 7.851 1.00 0.39 C ATOM 297 CG ARG A 295 -5.932 -6.404 9.371 1.00 1.19 C ATOM 298 CD ARG A 295 -4.678 -5.743 9.923 1.00 1.47 C ATOM 299 NE ARG A 295 -4.413 -4.441 9.306 1.00 2.06 N ATOM 300 CZ ARG A 295 -3.195 -3.910 9.185 1.00 2.62 C ATOM 301 NH1 ARG A 295 -2.142 -4.536 9.696 1.00 2.77 N ATOM 302 NH2 ARG A 295 -3.024 -2.747 8.579 1.00 3.50 N ATOM 0 H ARG A 295 -6.518 -6.261 5.451 1.00 0.35 H new ATOM 0 HA ARG A 295 -6.817 -8.321 7.443 1.00 0.35 H new ATOM 0 HB2 ARG A 295 -4.954 -6.753 7.504 1.00 0.39 H new ATOM 0 HB3 ARG A 295 -6.044 -5.381 7.498 1.00 0.39 H new ATOM 0 HG2 ARG A 295 -6.814 -5.877 9.734 1.00 1.19 H new ATOM 0 HG3 ARG A 295 -5.999 -7.428 9.739 1.00 1.19 H new ATOM 0 HD2 ARG A 295 -4.782 -5.616 11.001 1.00 1.47 H new ATOM 0 HD3 ARG A 295 -3.823 -6.399 9.760 1.00 1.47 H new ATOM 0 HE ARG A 295 -5.206 -3.909 8.948 1.00 2.06 H new ATOM 0 HH11 ARG A 295 -2.263 -5.424 10.182 1.00 2.77 H new ATOM 0 HH12 ARG A 295 -1.212 -4.129 9.603 1.00 2.77 H new ATOM 0 HH21 ARG A 295 -3.828 -2.247 8.199 1.00 3.50 H new ATOM 0 HH22 ARG A 295 -2.088 -2.350 8.492 1.00 3.50 H new ATOM 316 N VAL A 296 -8.963 -5.820 7.386 1.00 0.41 N ATOM 317 CA VAL A 296 -10.329 -5.498 7.765 1.00 0.50 C ATOM 318 C VAL A 296 -11.175 -5.379 6.513 1.00 0.53 C ATOM 319 O VAL A 296 -11.097 -4.386 5.782 1.00 0.51 O ATOM 320 CB VAL A 296 -10.435 -4.199 8.593 1.00 0.56 C ATOM 321 CG1 VAL A 296 -11.852 -4.008 9.109 1.00 0.70 C ATOM 322 CG2 VAL A 296 -9.442 -4.214 9.745 1.00 0.68 C ATOM 0 H VAL A 296 -8.507 -5.122 6.799 1.00 0.41 H new ATOM 0 HA VAL A 296 -10.691 -6.305 8.402 1.00 0.50 H new ATOM 0 HB VAL A 296 -10.191 -3.358 7.943 1.00 0.56 H new ATOM 0 HG11 VAL A 296 -11.907 -3.087 9.690 1.00 0.70 H new ATOM 0 HG12 VAL A 296 -12.541 -3.947 8.266 1.00 0.70 H new ATOM 0 HG13 VAL A 296 -12.126 -4.853 9.741 1.00 0.70 H new ATOM 0 HG21 VAL A 296 -9.533 -3.290 10.316 1.00 0.68 H new ATOM 0 HG22 VAL A 296 -9.651 -5.064 10.395 1.00 0.68 H new ATOM 0 HG23 VAL A 296 -8.429 -4.299 9.351 1.00 0.68 H new ATOM 332 N THR A 297 -11.962 -6.415 6.271 1.00 0.77 N ATOM 333 CA THR A 297 -12.749 -6.540 5.058 1.00 0.88 C ATOM 334 C THR A 297 -13.774 -5.419 4.918 1.00 0.77 C ATOM 335 O THR A 297 -14.730 -5.327 5.697 1.00 0.98 O ATOM 336 CB THR A 297 -13.469 -7.899 5.029 1.00 1.21 C ATOM 337 OG1 THR A 297 -14.186 -8.092 6.256 1.00 1.89 O ATOM 338 CG2 THR A 297 -12.476 -9.038 4.840 1.00 1.93 C ATOM 0 H THR A 297 -12.072 -7.197 6.916 1.00 0.77 H new ATOM 0 HA THR A 297 -12.057 -6.468 4.219 1.00 0.88 H new ATOM 0 HB THR A 297 -14.163 -7.900 4.189 1.00 1.21 H new ATOM 0 HG1 THR A 297 -14.542 -7.233 6.566 1.00 1.89 H new ATOM 0 HG21 THR A 297 -13.011 -9.988 4.823 1.00 1.93 H new ATOM 0 HG22 THR A 297 -11.944 -8.904 3.898 1.00 1.93 H new ATOM 0 HG23 THR A 297 -11.762 -9.038 5.663 1.00 1.93 H new ATOM 346 N GLY A 298 -13.570 -4.578 3.917 1.00 0.77 N ATOM 347 CA GLY A 298 -14.491 -3.498 3.649 1.00 0.83 C ATOM 348 C GLY A 298 -15.088 -3.605 2.264 1.00 0.90 C ATOM 349 O GLY A 298 -14.474 -4.173 1.361 1.00 1.04 O ATOM 0 H GLY A 298 -12.775 -4.626 3.280 1.00 0.77 H new ATOM 0 HA2 GLY A 298 -15.289 -3.507 4.391 1.00 0.83 H new ATOM 0 HA3 GLY A 298 -13.973 -2.544 3.750 1.00 0.83 H new ATOM 353 N LYS A 299 -16.292 -3.080 2.103 1.00 0.96 N ATOM 354 CA LYS A 299 -16.985 -3.110 0.823 1.00 1.08 C ATOM 355 C LYS A 299 -17.446 -1.711 0.438 1.00 0.82 C ATOM 356 O LYS A 299 -18.297 -1.122 1.106 1.00 1.36 O ATOM 357 CB LYS A 299 -18.187 -4.061 0.885 1.00 1.88 C ATOM 358 CG LYS A 299 -17.809 -5.509 1.160 1.00 2.40 C ATOM 359 CD LYS A 299 -16.911 -6.074 0.066 1.00 3.13 C ATOM 360 CE LYS A 299 -16.431 -7.481 0.397 1.00 4.13 C ATOM 361 NZ LYS A 299 -15.557 -7.505 1.598 1.00 4.49 N ATOM 0 H LYS A 299 -16.815 -2.623 2.850 1.00 0.96 H new ATOM 0 HA LYS A 299 -16.291 -3.473 0.065 1.00 1.08 H new ATOM 0 HB2 LYS A 299 -18.870 -3.719 1.663 1.00 1.88 H new ATOM 0 HB3 LYS A 299 -18.729 -4.009 -0.059 1.00 1.88 H new ATOM 0 HG2 LYS A 299 -17.298 -5.576 2.121 1.00 2.40 H new ATOM 0 HG3 LYS A 299 -18.713 -6.113 1.237 1.00 2.40 H new ATOM 0 HD2 LYS A 299 -17.455 -6.089 -0.879 1.00 3.13 H new ATOM 0 HD3 LYS A 299 -16.050 -5.420 -0.072 1.00 3.13 H new ATOM 0 HE2 LYS A 299 -17.292 -8.128 0.563 1.00 4.13 H new ATOM 0 HE3 LYS A 299 -15.887 -7.888 -0.455 1.00 4.13 H new ATOM 0 HZ1 LYS A 299 -15.066 -8.420 1.652 1.00 4.49 H new ATOM 0 HZ2 LYS A 299 -14.856 -6.739 1.533 1.00 4.49 H new ATOM 0 HZ3 LYS A 299 -16.136 -7.372 2.452 1.00 4.49 H new ATOM 375 N GLY A 300 -16.873 -1.185 -0.632 1.00 0.58 N ATOM 376 CA GLY A 300 -17.222 0.147 -1.088 1.00 1.04 C ATOM 377 C GLY A 300 -16.625 0.457 -2.443 1.00 0.73 C ATOM 378 O GLY A 300 -16.369 -0.457 -3.229 1.00 0.67 O ATOM 0 H GLY A 300 -16.168 -1.658 -1.197 1.00 0.58 H new ATOM 0 HA2 GLY A 300 -18.307 0.240 -1.140 1.00 1.04 H new ATOM 0 HA3 GLY A 300 -16.874 0.882 -0.362 1.00 1.04 H new ATOM 382 N PRO A 301 -16.411 1.745 -2.753 1.00 0.68 N ATOM 383 CA PRO A 301 -15.812 2.168 -4.022 1.00 0.52 C ATOM 384 C PRO A 301 -14.392 1.641 -4.188 1.00 0.51 C ATOM 385 O PRO A 301 -13.609 1.651 -3.236 1.00 0.57 O ATOM 386 CB PRO A 301 -15.794 3.696 -3.937 1.00 0.53 C ATOM 387 CG PRO A 301 -16.772 4.040 -2.871 1.00 0.77 C ATOM 388 CD PRO A 301 -16.749 2.894 -1.900 1.00 0.88 C ATOM 0 HA PRO A 301 -16.373 1.786 -4.875 1.00 0.52 H new ATOM 0 HB2 PRO A 301 -14.798 4.065 -3.691 1.00 0.53 H new ATOM 0 HB3 PRO A 301 -16.075 4.146 -4.889 1.00 0.53 H new ATOM 0 HG2 PRO A 301 -16.500 4.974 -2.379 1.00 0.77 H new ATOM 0 HG3 PRO A 301 -17.770 4.178 -3.287 1.00 0.77 H new ATOM 0 HD2 PRO A 301 -16.009 3.045 -1.115 1.00 0.88 H new ATOM 0 HD3 PRO A 301 -17.713 2.762 -1.408 1.00 0.88 H new ATOM 396 N HIS A 302 -14.071 1.178 -5.392 1.00 0.53 N ATOM 397 CA HIS A 302 -12.731 0.684 -5.686 1.00 0.60 C ATOM 398 C HIS A 302 -11.937 1.717 -6.472 1.00 0.50 C ATOM 399 O HIS A 302 -12.441 2.310 -7.431 1.00 0.57 O ATOM 400 CB HIS A 302 -12.791 -0.628 -6.472 1.00 0.78 C ATOM 401 CG HIS A 302 -13.390 -1.768 -5.703 1.00 0.99 C ATOM 402 ND1 HIS A 302 -14.501 -2.439 -6.154 1.00 1.42 N ATOM 403 CD2 HIS A 302 -12.994 -2.309 -4.527 1.00 1.16 C ATOM 404 CE1 HIS A 302 -14.752 -3.370 -5.248 1.00 1.49 C ATOM 405 NE2 HIS A 302 -13.866 -3.329 -4.241 1.00 1.33 N ATOM 0 H HIS A 302 -14.719 1.135 -6.178 1.00 0.53 H new ATOM 0 HA HIS A 302 -12.230 0.500 -4.735 1.00 0.60 H new ATOM 0 HB2 HIS A 302 -13.372 -0.470 -7.381 1.00 0.78 H new ATOM 0 HB3 HIS A 302 -11.782 -0.901 -6.782 1.00 0.78 H new ATOM 0 HD2 HIS A 302 -12.152 -1.997 -3.928 1.00 1.16 H new ATOM 0 HE1 HIS A 302 -15.568 -4.075 -5.311 1.00 1.49 H new ATOM 0 HE2 HIS A 302 -13.845 -3.937 -3.423 1.00 1.33 H new ATOM 413 N ALA A 303 -10.696 1.934 -6.058 1.00 0.40 N ATOM 414 CA ALA A 303 -9.827 2.917 -6.694 1.00 0.36 C ATOM 415 C ALA A 303 -9.411 2.479 -8.095 1.00 0.39 C ATOM 416 O ALA A 303 -9.004 1.335 -8.306 1.00 0.54 O ATOM 417 CB ALA A 303 -8.598 3.163 -5.830 1.00 0.38 C ATOM 0 H ALA A 303 -10.265 1.438 -5.278 1.00 0.40 H new ATOM 0 HA ALA A 303 -10.389 3.846 -6.793 1.00 0.36 H new ATOM 0 HB1 ALA A 303 -7.955 3.899 -6.313 1.00 0.38 H new ATOM 0 HB2 ALA A 303 -8.908 3.537 -4.854 1.00 0.38 H new ATOM 0 HB3 ALA A 303 -8.050 2.230 -5.703 1.00 0.38 H new ATOM 423 N LYS A 304 -9.531 3.398 -9.047 1.00 0.39 N ATOM 424 CA LYS A 304 -9.098 3.161 -10.417 1.00 0.45 C ATOM 425 C LYS A 304 -7.979 4.140 -10.762 1.00 0.44 C ATOM 426 O LYS A 304 -7.622 4.988 -9.939 1.00 0.43 O ATOM 427 CB LYS A 304 -10.266 3.369 -11.393 1.00 0.60 C ATOM 428 CG LYS A 304 -11.552 2.659 -11.003 1.00 1.03 C ATOM 429 CD LYS A 304 -11.427 1.149 -11.095 1.00 1.17 C ATOM 430 CE LYS A 304 -12.723 0.466 -10.682 1.00 2.23 C ATOM 431 NZ LYS A 304 -13.870 0.861 -11.547 1.00 2.84 N ATOM 0 H LYS A 304 -9.929 4.324 -8.891 1.00 0.39 H new ATOM 0 HA LYS A 304 -8.743 2.134 -10.504 1.00 0.45 H new ATOM 0 HB2 LYS A 304 -10.467 4.437 -11.476 1.00 0.60 H new ATOM 0 HB3 LYS A 304 -9.962 3.024 -12.381 1.00 0.60 H new ATOM 0 HG2 LYS A 304 -11.824 2.937 -9.985 1.00 1.03 H new ATOM 0 HG3 LYS A 304 -12.361 2.995 -11.652 1.00 1.03 H new ATOM 0 HD2 LYS A 304 -11.171 0.864 -12.115 1.00 1.17 H new ATOM 0 HD3 LYS A 304 -10.613 0.809 -10.455 1.00 1.17 H new ATOM 0 HE2 LYS A 304 -12.592 -0.615 -10.727 1.00 2.23 H new ATOM 0 HE3 LYS A 304 -12.949 0.717 -9.646 1.00 2.23 H new ATOM 0 HZ1 LYS A 304 -14.664 0.208 -11.390 1.00 2.84 H new ATOM 0 HZ2 LYS A 304 -14.166 1.830 -11.310 1.00 2.84 H new ATOM 0 HZ3 LYS A 304 -13.582 0.821 -12.545 1.00 2.84 H new ATOM 445 N LYS A 305 -7.429 4.043 -11.965 1.00 0.51 N ATOM 446 CA LYS A 305 -6.464 5.024 -12.423 1.00 0.55 C ATOM 447 C LYS A 305 -7.158 6.361 -12.647 1.00 0.56 C ATOM 448 O LYS A 305 -8.223 6.428 -13.263 1.00 0.63 O ATOM 449 CB LYS A 305 -5.772 4.553 -13.704 1.00 0.67 C ATOM 450 CG LYS A 305 -4.666 3.534 -13.469 1.00 1.35 C ATOM 451 CD LYS A 305 -4.015 3.117 -14.776 1.00 1.42 C ATOM 452 CE LYS A 305 -2.888 2.123 -14.548 1.00 2.35 C ATOM 453 NZ LYS A 305 -1.701 2.749 -13.902 1.00 2.84 N ATOM 0 H LYS A 305 -7.634 3.301 -12.634 1.00 0.51 H new ATOM 0 HA LYS A 305 -5.698 5.146 -11.657 1.00 0.55 H new ATOM 0 HB2 LYS A 305 -6.518 4.118 -14.369 1.00 0.67 H new ATOM 0 HB3 LYS A 305 -5.352 5.418 -14.218 1.00 0.67 H new ATOM 0 HG2 LYS A 305 -3.913 3.958 -12.804 1.00 1.35 H new ATOM 0 HG3 LYS A 305 -5.077 2.657 -12.968 1.00 1.35 H new ATOM 0 HD2 LYS A 305 -4.765 2.674 -15.431 1.00 1.42 H new ATOM 0 HD3 LYS A 305 -3.626 3.998 -15.287 1.00 1.42 H new ATOM 0 HE2 LYS A 305 -3.249 1.305 -13.924 1.00 2.35 H new ATOM 0 HE3 LYS A 305 -2.592 1.688 -15.503 1.00 2.35 H new ATOM 0 HZ1 LYS A 305 -0.860 2.590 -14.493 1.00 2.84 H new ATOM 0 HZ2 LYS A 305 -1.862 3.771 -13.797 1.00 2.84 H new ATOM 0 HZ3 LYS A 305 -1.551 2.324 -12.965 1.00 2.84 H new ATOM 467 N GLY A 306 -6.563 7.421 -12.125 1.00 0.55 N ATOM 468 CA GLY A 306 -7.170 8.732 -12.222 1.00 0.61 C ATOM 469 C GLY A 306 -8.181 8.989 -11.118 1.00 0.56 C ATOM 470 O GLY A 306 -8.905 9.985 -11.150 1.00 0.70 O ATOM 0 H GLY A 306 -5.669 7.398 -11.635 1.00 0.55 H new ATOM 0 HA2 GLY A 306 -6.391 9.493 -12.181 1.00 0.61 H new ATOM 0 HA3 GLY A 306 -7.661 8.830 -13.190 1.00 0.61 H new ATOM 474 N THR A 307 -8.248 8.082 -10.152 1.00 0.40 N ATOM 475 CA THR A 307 -9.141 8.252 -9.012 1.00 0.34 C ATOM 476 C THR A 307 -8.379 8.846 -7.825 1.00 0.30 C ATOM 477 O THR A 307 -7.184 8.589 -7.659 1.00 0.31 O ATOM 478 CB THR A 307 -9.770 6.903 -8.604 1.00 0.32 C ATOM 479 OG1 THR A 307 -10.316 6.252 -9.759 1.00 0.40 O ATOM 480 CG2 THR A 307 -10.875 7.098 -7.579 1.00 0.32 C ATOM 0 H THR A 307 -7.697 7.224 -10.134 1.00 0.40 H new ATOM 0 HA THR A 307 -9.938 8.935 -9.305 1.00 0.34 H new ATOM 0 HB THR A 307 -8.986 6.289 -8.161 1.00 0.32 H new ATOM 0 HG1 THR A 307 -11.169 5.831 -9.524 1.00 0.40 H new ATOM 0 HG21 THR A 307 -11.298 6.130 -7.312 1.00 0.32 H new ATOM 0 HG22 THR A 307 -10.465 7.573 -6.688 1.00 0.32 H new ATOM 0 HG23 THR A 307 -11.655 7.731 -8.001 1.00 0.32 H new ATOM 488 N ARG A 308 -9.066 9.641 -7.012 1.00 0.33 N ATOM 489 CA ARG A 308 -8.457 10.242 -5.836 1.00 0.36 C ATOM 490 C ARG A 308 -8.900 9.477 -4.606 1.00 0.36 C ATOM 491 O ARG A 308 -10.088 9.221 -4.425 1.00 0.52 O ATOM 492 CB ARG A 308 -8.859 11.711 -5.695 1.00 0.46 C ATOM 493 CG ARG A 308 -8.532 12.569 -6.907 1.00 0.98 C ATOM 494 CD ARG A 308 -8.900 14.016 -6.651 1.00 1.14 C ATOM 495 NE ARG A 308 -8.793 14.843 -7.850 1.00 1.95 N ATOM 496 CZ ARG A 308 -8.034 15.935 -7.932 1.00 2.39 C ATOM 497 NH1 ARG A 308 -7.227 16.271 -6.931 1.00 2.12 N ATOM 498 NH2 ARG A 308 -8.063 16.679 -9.031 1.00 3.45 N ATOM 0 H ARG A 308 -10.047 9.883 -7.148 1.00 0.33 H new ATOM 0 HA ARG A 308 -7.373 10.195 -5.942 1.00 0.36 H new ATOM 0 HB2 ARG A 308 -9.931 11.765 -5.505 1.00 0.46 H new ATOM 0 HB3 ARG A 308 -8.359 12.130 -4.822 1.00 0.46 H new ATOM 0 HG2 ARG A 308 -7.469 12.494 -7.137 1.00 0.98 H new ATOM 0 HG3 ARG A 308 -9.073 12.199 -7.778 1.00 0.98 H new ATOM 0 HD2 ARG A 308 -9.920 14.066 -6.270 1.00 1.14 H new ATOM 0 HD3 ARG A 308 -8.250 14.421 -5.876 1.00 1.14 H new ATOM 0 HE ARG A 308 -9.331 14.569 -8.672 1.00 1.95 H new ATOM 0 HH11 ARG A 308 -7.186 15.691 -6.093 1.00 2.12 H new ATOM 0 HH12 ARG A 308 -6.649 17.108 -7.001 1.00 2.12 H new ATOM 0 HH21 ARG A 308 -8.665 16.414 -9.810 1.00 3.45 H new ATOM 0 HH22 ARG A 308 -7.483 17.515 -9.096 1.00 3.45 H new ATOM 512 N VAL A 309 -7.952 9.107 -3.771 1.00 0.28 N ATOM 513 CA VAL A 309 -8.266 8.332 -2.586 1.00 0.28 C ATOM 514 C VAL A 309 -7.640 8.931 -1.337 1.00 0.28 C ATOM 515 O VAL A 309 -6.490 9.376 -1.351 1.00 0.34 O ATOM 516 CB VAL A 309 -7.837 6.855 -2.726 1.00 0.29 C ATOM 517 CG1 VAL A 309 -8.674 6.148 -3.777 1.00 0.31 C ATOM 518 CG2 VAL A 309 -6.363 6.737 -3.065 1.00 0.28 C ATOM 0 H VAL A 309 -6.963 9.328 -3.888 1.00 0.28 H new ATOM 0 HA VAL A 309 -9.351 8.365 -2.483 1.00 0.28 H new ATOM 0 HB VAL A 309 -8.003 6.373 -1.763 1.00 0.29 H new ATOM 0 HG11 VAL A 309 -8.354 5.109 -3.858 1.00 0.31 H new ATOM 0 HG12 VAL A 309 -9.725 6.183 -3.489 1.00 0.31 H new ATOM 0 HG13 VAL A 309 -8.545 6.644 -4.739 1.00 0.31 H new ATOM 0 HG21 VAL A 309 -6.094 5.685 -3.156 1.00 0.28 H new ATOM 0 HG22 VAL A 309 -6.165 7.246 -4.008 1.00 0.28 H new ATOM 0 HG23 VAL A 309 -5.770 7.196 -2.274 1.00 0.28 H new ATOM 528 N GLY A 310 -8.418 8.950 -0.269 1.00 0.25 N ATOM 529 CA GLY A 310 -7.934 9.417 1.009 1.00 0.27 C ATOM 530 C GLY A 310 -7.755 8.249 1.946 1.00 0.24 C ATOM 531 O GLY A 310 -8.710 7.516 2.214 1.00 0.26 O ATOM 0 H GLY A 310 -9.391 8.645 -0.266 1.00 0.25 H new ATOM 0 HA2 GLY A 310 -6.986 9.940 0.880 1.00 0.27 H new ATOM 0 HA3 GLY A 310 -8.637 10.132 1.435 1.00 0.27 H new ATOM 535 N MET A 311 -6.538 8.048 2.414 1.00 0.22 N ATOM 536 CA MET A 311 -6.212 6.855 3.168 1.00 0.19 C ATOM 537 C MET A 311 -5.290 7.151 4.344 1.00 0.18 C ATOM 538 O MET A 311 -4.868 8.288 4.563 1.00 0.19 O ATOM 539 CB MET A 311 -5.553 5.833 2.241 1.00 0.22 C ATOM 540 CG MET A 311 -4.215 6.283 1.675 1.00 0.34 C ATOM 541 SD MET A 311 -3.597 5.159 0.411 1.00 0.67 S ATOM 542 CE MET A 311 -3.550 3.624 1.322 1.00 0.76 C ATOM 0 H MET A 311 -5.760 8.695 2.285 1.00 0.22 H new ATOM 0 HA MET A 311 -7.141 6.455 3.574 1.00 0.19 H new ATOM 0 HB2 MET A 311 -5.409 4.901 2.788 1.00 0.22 H new ATOM 0 HB3 MET A 311 -6.231 5.617 1.415 1.00 0.22 H new ATOM 0 HG2 MET A 311 -4.319 7.282 1.251 1.00 0.34 H new ATOM 0 HG3 MET A 311 -3.487 6.354 2.483 1.00 0.34 H new ATOM 0 HE1 MET A 311 -2.906 2.913 0.804 1.00 0.76 H new ATOM 0 HE2 MET A 311 -3.158 3.807 2.323 1.00 0.76 H new ATOM 0 HE3 MET A 311 -4.557 3.214 1.396 1.00 0.76 H new ATOM 552 N ARG A 312 -5.014 6.101 5.099 1.00 0.19 N ATOM 553 CA ARG A 312 -4.072 6.138 6.207 1.00 0.21 C ATOM 554 C ARG A 312 -3.178 4.915 6.079 1.00 0.24 C ATOM 555 O ARG A 312 -3.650 3.863 5.642 1.00 0.30 O ATOM 556 CB ARG A 312 -4.806 6.117 7.556 1.00 0.27 C ATOM 557 CG ARG A 312 -5.989 7.072 7.634 1.00 0.40 C ATOM 558 CD ARG A 312 -6.556 7.154 9.044 1.00 0.67 C ATOM 559 NE ARG A 312 -6.921 5.840 9.573 1.00 1.24 N ATOM 560 CZ ARG A 312 -7.938 5.634 10.410 1.00 1.67 C ATOM 561 NH1 ARG A 312 -8.751 6.636 10.742 1.00 1.85 N ATOM 562 NH2 ARG A 312 -8.154 4.419 10.899 1.00 2.51 N ATOM 0 H ARG A 312 -5.443 5.186 4.958 1.00 0.19 H new ATOM 0 HA ARG A 312 -3.487 7.057 6.172 1.00 0.21 H new ATOM 0 HB2 ARG A 312 -5.157 5.104 7.751 1.00 0.27 H new ATOM 0 HB3 ARG A 312 -4.098 6.367 8.347 1.00 0.27 H new ATOM 0 HG2 ARG A 312 -5.677 8.065 7.309 1.00 0.40 H new ATOM 0 HG3 ARG A 312 -6.769 6.742 6.947 1.00 0.40 H new ATOM 0 HD2 ARG A 312 -5.821 7.617 9.702 1.00 0.67 H new ATOM 0 HD3 ARG A 312 -7.434 7.800 9.043 1.00 0.67 H new ATOM 0 HE ARG A 312 -6.365 5.035 9.285 1.00 1.24 H new ATOM 0 HH11 ARG A 312 -8.597 7.567 10.355 1.00 1.85 H new ATOM 0 HH12 ARG A 312 -9.527 6.472 11.383 1.00 1.85 H new ATOM 0 HH21 ARG A 312 -7.543 3.647 10.634 1.00 2.51 H new ATOM 0 HH22 ARG A 312 -8.931 4.258 11.540 1.00 2.51 H new ATOM 576 N TYR A 313 -1.909 5.024 6.445 1.00 0.23 N ATOM 577 CA TYR A 313 -0.987 3.924 6.204 1.00 0.26 C ATOM 578 C TYR A 313 0.275 4.003 7.049 1.00 0.27 C ATOM 579 O TYR A 313 0.656 5.066 7.544 1.00 0.31 O ATOM 580 CB TYR A 313 -0.606 3.850 4.722 1.00 0.28 C ATOM 581 CG TYR A 313 0.060 5.091 4.166 1.00 0.34 C ATOM 582 CD1 TYR A 313 1.424 5.305 4.328 1.00 0.45 C ATOM 583 CD2 TYR A 313 -0.669 6.030 3.450 1.00 0.40 C ATOM 584 CE1 TYR A 313 2.039 6.418 3.794 1.00 0.53 C ATOM 585 CE2 TYR A 313 -0.062 7.149 2.919 1.00 0.51 C ATOM 586 CZ TYR A 313 1.293 7.335 3.091 1.00 0.56 C ATOM 587 OH TYR A 313 1.905 8.449 2.565 1.00 0.68 O ATOM 0 H TYR A 313 -1.502 5.842 6.899 1.00 0.23 H new ATOM 0 HA TYR A 313 -1.518 3.018 6.498 1.00 0.26 H new ATOM 0 HB2 TYR A 313 0.063 3.002 4.577 1.00 0.28 H new ATOM 0 HB3 TYR A 313 -1.506 3.649 4.141 1.00 0.28 H new ATOM 0 HD1 TYR A 313 2.012 4.588 4.881 1.00 0.45 H new ATOM 0 HD2 TYR A 313 -1.729 5.882 3.306 1.00 0.40 H new ATOM 0 HE1 TYR A 313 3.100 6.569 3.927 1.00 0.53 H new ATOM 0 HE2 TYR A 313 -0.645 7.875 2.372 1.00 0.51 H new ATOM 0 HH TYR A 313 1.223 9.090 2.273 1.00 0.68 H new ATOM 597 N VAL A 314 0.912 2.852 7.201 1.00 0.26 N ATOM 598 CA VAL A 314 2.194 2.752 7.878 1.00 0.27 C ATOM 599 C VAL A 314 3.204 2.051 6.968 1.00 0.28 C ATOM 600 O VAL A 314 2.936 0.963 6.459 1.00 0.35 O ATOM 601 CB VAL A 314 2.076 1.973 9.209 1.00 0.29 C ATOM 602 CG1 VAL A 314 3.408 1.939 9.940 1.00 0.32 C ATOM 603 CG2 VAL A 314 1.003 2.576 10.101 1.00 0.32 C ATOM 0 H VAL A 314 0.554 1.961 6.858 1.00 0.26 H new ATOM 0 HA VAL A 314 2.532 3.763 8.105 1.00 0.27 H new ATOM 0 HB VAL A 314 1.788 0.950 8.967 1.00 0.29 H new ATOM 0 HG11 VAL A 314 3.297 1.385 10.872 1.00 0.32 H new ATOM 0 HG12 VAL A 314 4.154 1.450 9.314 1.00 0.32 H new ATOM 0 HG13 VAL A 314 3.729 2.957 10.159 1.00 0.32 H new ATOM 0 HG21 VAL A 314 0.941 2.009 11.030 1.00 0.32 H new ATOM 0 HG22 VAL A 314 1.256 3.612 10.325 1.00 0.32 H new ATOM 0 HG23 VAL A 314 0.041 2.540 9.589 1.00 0.32 H new ATOM 613 N GLY A 315 4.353 2.682 6.761 1.00 0.27 N ATOM 614 CA GLY A 315 5.379 2.111 5.909 1.00 0.28 C ATOM 615 C GLY A 315 6.437 1.373 6.705 1.00 0.25 C ATOM 616 O GLY A 315 7.274 1.994 7.372 1.00 0.27 O ATOM 0 H GLY A 315 4.594 3.585 7.171 1.00 0.27 H new ATOM 0 HA2 GLY A 315 4.918 1.426 5.197 1.00 0.28 H new ATOM 0 HA3 GLY A 315 5.850 2.904 5.329 1.00 0.28 H new ATOM 620 N LYS A 316 6.398 0.048 6.632 1.00 0.25 N ATOM 621 CA LYS A 316 7.285 -0.803 7.419 1.00 0.27 C ATOM 622 C LYS A 316 8.275 -1.556 6.536 1.00 0.30 C ATOM 623 O LYS A 316 8.018 -1.808 5.357 1.00 0.32 O ATOM 624 CB LYS A 316 6.471 -1.832 8.206 1.00 0.36 C ATOM 625 CG LYS A 316 5.391 -1.245 9.093 1.00 0.48 C ATOM 626 CD LYS A 316 4.507 -2.350 9.638 1.00 0.69 C ATOM 627 CE LYS A 316 3.399 -1.809 10.518 1.00 0.99 C ATOM 628 NZ LYS A 316 2.396 -2.856 10.850 1.00 1.94 N ATOM 0 H LYS A 316 5.755 -0.465 6.029 1.00 0.25 H new ATOM 0 HA LYS A 316 7.835 -0.149 8.096 1.00 0.27 H new ATOM 0 HB2 LYS A 316 6.007 -2.523 7.502 1.00 0.36 H new ATOM 0 HB3 LYS A 316 7.152 -2.417 8.825 1.00 0.36 H new ATOM 0 HG2 LYS A 316 5.845 -0.693 9.916 1.00 0.48 H new ATOM 0 HG3 LYS A 316 4.790 -0.534 8.526 1.00 0.48 H new ATOM 0 HD2 LYS A 316 4.072 -2.908 8.809 1.00 0.69 H new ATOM 0 HD3 LYS A 316 5.115 -3.051 10.210 1.00 0.69 H new ATOM 0 HE2 LYS A 316 3.827 -1.411 11.438 1.00 0.99 H new ATOM 0 HE3 LYS A 316 2.905 -0.980 10.012 1.00 0.99 H new ATOM 0 HZ1 LYS A 316 1.468 -2.412 11.000 1.00 1.94 H new ATOM 0 HZ2 LYS A 316 2.332 -3.536 10.066 1.00 1.94 H new ATOM 0 HZ3 LYS A 316 2.687 -3.353 11.716 1.00 1.94 H new ATOM 642 N LEU A 317 9.408 -1.909 7.119 1.00 0.35 N ATOM 643 CA LEU A 317 10.351 -2.815 6.484 1.00 0.46 C ATOM 644 C LEU A 317 9.992 -4.251 6.856 1.00 0.56 C ATOM 645 O LEU A 317 9.233 -4.476 7.802 1.00 0.54 O ATOM 646 CB LEU A 317 11.777 -2.506 6.943 1.00 0.51 C ATOM 647 CG LEU A 317 12.333 -1.153 6.502 1.00 0.53 C ATOM 648 CD1 LEU A 317 13.640 -0.856 7.221 1.00 0.61 C ATOM 649 CD2 LEU A 317 12.542 -1.137 5.000 1.00 0.65 C ATOM 0 H LEU A 317 9.699 -1.579 8.039 1.00 0.35 H new ATOM 0 HA LEU A 317 10.298 -2.687 5.403 1.00 0.46 H new ATOM 0 HB2 LEU A 317 11.808 -2.554 8.032 1.00 0.51 H new ATOM 0 HB3 LEU A 317 12.437 -3.289 6.570 1.00 0.51 H new ATOM 0 HG LEU A 317 11.612 -0.379 6.763 1.00 0.53 H new ATOM 0 HD11 LEU A 317 14.023 0.111 6.895 1.00 0.61 H new ATOM 0 HD12 LEU A 317 13.467 -0.834 8.297 1.00 0.61 H new ATOM 0 HD13 LEU A 317 14.369 -1.632 6.987 1.00 0.61 H new ATOM 0 HD21 LEU A 317 12.938 -0.168 4.698 1.00 0.65 H new ATOM 0 HD22 LEU A 317 13.248 -1.920 4.722 1.00 0.65 H new ATOM 0 HD23 LEU A 317 11.590 -1.312 4.498 1.00 0.65 H new ATOM 661 N LYS A 318 10.540 -5.223 6.133 1.00 0.74 N ATOM 662 CA LYS A 318 10.274 -6.629 6.429 1.00 0.89 C ATOM 663 C LYS A 318 10.867 -7.022 7.782 1.00 0.81 C ATOM 664 O LYS A 318 10.425 -7.978 8.412 1.00 0.87 O ATOM 665 CB LYS A 318 10.825 -7.531 5.320 1.00 1.14 C ATOM 666 CG LYS A 318 10.594 -9.015 5.576 1.00 1.33 C ATOM 667 CD LYS A 318 10.857 -9.865 4.343 1.00 1.34 C ATOM 668 CE LYS A 318 12.284 -9.730 3.847 1.00 1.96 C ATOM 669 NZ LYS A 318 12.546 -10.614 2.681 1.00 2.42 N ATOM 0 H LYS A 318 11.167 -5.066 5.344 1.00 0.74 H new ATOM 0 HA LYS A 318 9.193 -6.764 6.477 1.00 0.89 H new ATOM 0 HB2 LYS A 318 10.359 -7.256 4.374 1.00 1.14 H new ATOM 0 HB3 LYS A 318 11.895 -7.351 5.213 1.00 1.14 H new ATOM 0 HG2 LYS A 318 11.243 -9.346 6.387 1.00 1.33 H new ATOM 0 HG3 LYS A 318 9.567 -9.168 5.907 1.00 1.33 H new ATOM 0 HD2 LYS A 318 10.652 -10.910 4.574 1.00 1.34 H new ATOM 0 HD3 LYS A 318 10.169 -9.573 3.549 1.00 1.34 H new ATOM 0 HE2 LYS A 318 12.476 -8.694 3.569 1.00 1.96 H new ATOM 0 HE3 LYS A 318 12.975 -9.977 4.653 1.00 1.96 H new ATOM 0 HZ1 LYS A 318 13.280 -10.188 2.080 1.00 2.42 H new ATOM 0 HZ2 LYS A 318 12.870 -11.544 3.016 1.00 2.42 H new ATOM 0 HZ3 LYS A 318 11.672 -10.730 2.130 1.00 2.42 H new ATOM 683 N ASN A 319 11.854 -6.258 8.235 1.00 0.73 N ATOM 684 CA ASN A 319 12.489 -6.521 9.526 1.00 0.71 C ATOM 685 C ASN A 319 11.685 -5.896 10.672 1.00 0.63 C ATOM 686 O ASN A 319 12.106 -5.919 11.828 1.00 0.69 O ATOM 687 CB ASN A 319 13.940 -6.010 9.536 1.00 0.78 C ATOM 688 CG ASN A 319 14.064 -4.541 9.178 1.00 1.31 C ATOM 689 OD1 ASN A 319 13.186 -3.734 9.473 1.00 2.20 O ATOM 690 ND2 ASN A 319 15.154 -4.186 8.519 1.00 1.70 N ATOM 0 H ASN A 319 12.232 -5.455 7.733 1.00 0.73 H new ATOM 0 HA ASN A 319 12.507 -7.600 9.677 1.00 0.71 H new ATOM 0 HB2 ASN A 319 14.368 -6.173 10.525 1.00 0.78 H new ATOM 0 HB3 ASN A 319 14.530 -6.599 8.833 1.00 0.78 H new ATOM 0 HD21 ASN A 319 15.287 -3.214 8.239 1.00 1.70 H new ATOM 0 HD22 ASN A 319 15.862 -4.884 8.291 1.00 1.70 H new ATOM 697 N GLY A 320 10.532 -5.324 10.336 1.00 0.55 N ATOM 698 CA GLY A 320 9.627 -4.799 11.347 1.00 0.57 C ATOM 699 C GLY A 320 9.871 -3.338 11.668 1.00 0.53 C ATOM 700 O GLY A 320 9.075 -2.708 12.368 1.00 0.69 O ATOM 0 H GLY A 320 10.206 -5.214 9.376 1.00 0.55 H new ATOM 0 HA2 GLY A 320 8.600 -4.922 11.004 1.00 0.57 H new ATOM 0 HA3 GLY A 320 9.731 -5.387 12.259 1.00 0.57 H new ATOM 704 N LYS A 321 10.966 -2.794 11.155 1.00 0.42 N ATOM 705 CA LYS A 321 11.316 -1.403 11.413 1.00 0.45 C ATOM 706 C LYS A 321 10.474 -0.473 10.543 1.00 0.39 C ATOM 707 O LYS A 321 10.455 -0.598 9.319 1.00 0.44 O ATOM 708 CB LYS A 321 12.810 -1.175 11.150 1.00 0.56 C ATOM 709 CG LYS A 321 13.348 0.131 11.714 1.00 1.36 C ATOM 710 CD LYS A 321 14.832 0.299 11.408 1.00 1.84 C ATOM 711 CE LYS A 321 15.666 -0.858 11.954 1.00 2.33 C ATOM 712 NZ LYS A 321 15.579 -0.970 13.436 1.00 2.42 N ATOM 0 H LYS A 321 11.626 -3.293 10.559 1.00 0.42 H new ATOM 0 HA LYS A 321 11.108 -1.179 12.459 1.00 0.45 H new ATOM 0 HB2 LYS A 321 13.374 -2.003 11.579 1.00 0.56 H new ATOM 0 HB3 LYS A 321 12.985 -1.193 10.074 1.00 0.56 H new ATOM 0 HG2 LYS A 321 12.791 0.968 11.293 1.00 1.36 H new ATOM 0 HG3 LYS A 321 13.192 0.155 12.793 1.00 1.36 H new ATOM 0 HD2 LYS A 321 14.973 0.370 10.330 1.00 1.84 H new ATOM 0 HD3 LYS A 321 15.187 1.236 11.838 1.00 1.84 H new ATOM 0 HE2 LYS A 321 15.329 -1.791 11.501 1.00 2.33 H new ATOM 0 HE3 LYS A 321 16.707 -0.721 11.663 1.00 2.33 H new ATOM 0 HZ1 LYS A 321 16.226 -1.714 13.767 1.00 2.42 H new ATOM 0 HZ2 LYS A 321 15.845 -0.062 13.869 1.00 2.42 H new ATOM 0 HZ3 LYS A 321 14.605 -1.212 13.709 1.00 2.42 H new ATOM 726 N VAL A 322 9.767 0.443 11.183 1.00 0.35 N ATOM 727 CA VAL A 322 8.915 1.390 10.473 1.00 0.33 C ATOM 728 C VAL A 322 9.728 2.599 10.019 1.00 0.35 C ATOM 729 O VAL A 322 10.436 3.214 10.819 1.00 0.42 O ATOM 730 CB VAL A 322 7.750 1.864 11.368 1.00 0.36 C ATOM 731 CG1 VAL A 322 6.862 2.861 10.640 1.00 1.17 C ATOM 732 CG2 VAL A 322 6.934 0.678 11.852 1.00 1.26 C ATOM 0 H VAL A 322 9.764 0.553 12.197 1.00 0.35 H new ATOM 0 HA VAL A 322 8.504 0.880 9.601 1.00 0.33 H new ATOM 0 HB VAL A 322 8.179 2.370 12.233 1.00 0.36 H new ATOM 0 HG11 VAL A 322 6.052 3.175 11.298 1.00 1.17 H new ATOM 0 HG12 VAL A 322 7.452 3.731 10.351 1.00 1.17 H new ATOM 0 HG13 VAL A 322 6.445 2.393 9.748 1.00 1.17 H new ATOM 0 HG21 VAL A 322 6.117 1.031 12.482 1.00 1.26 H new ATOM 0 HG22 VAL A 322 6.526 0.143 10.995 1.00 1.26 H new ATOM 0 HG23 VAL A 322 7.572 0.008 12.428 1.00 1.26 H new ATOM 742 N PHE A 323 9.634 2.941 8.740 1.00 0.35 N ATOM 743 CA PHE A 323 10.385 4.071 8.218 1.00 0.38 C ATOM 744 C PHE A 323 9.509 5.311 8.080 1.00 0.41 C ATOM 745 O PHE A 323 9.976 6.426 8.314 1.00 0.55 O ATOM 746 CB PHE A 323 11.076 3.734 6.886 1.00 0.37 C ATOM 747 CG PHE A 323 10.177 3.196 5.807 1.00 0.37 C ATOM 748 CD1 PHE A 323 10.071 1.830 5.601 1.00 0.36 C ATOM 749 CD2 PHE A 323 9.460 4.049 4.982 1.00 0.43 C ATOM 750 CE1 PHE A 323 9.268 1.326 4.596 1.00 0.39 C ATOM 751 CE2 PHE A 323 8.651 3.551 3.980 1.00 0.48 C ATOM 752 CZ PHE A 323 8.556 2.186 3.785 1.00 0.43 C ATOM 0 H PHE A 323 9.053 2.458 8.055 1.00 0.35 H new ATOM 0 HA PHE A 323 11.166 4.294 8.945 1.00 0.38 H new ATOM 0 HB2 PHE A 323 11.564 4.634 6.512 1.00 0.37 H new ATOM 0 HB3 PHE A 323 11.861 3.002 7.079 1.00 0.37 H new ATOM 0 HD1 PHE A 323 10.623 1.151 6.234 1.00 0.36 H new ATOM 0 HD2 PHE A 323 9.535 5.117 5.125 1.00 0.43 H new ATOM 0 HE1 PHE A 323 9.198 0.259 4.445 1.00 0.39 H new ATOM 0 HE2 PHE A 323 8.093 4.227 3.349 1.00 0.48 H new ATOM 0 HZ PHE A 323 7.926 1.794 3.000 1.00 0.43 H new ATOM 762 N ASP A 324 8.241 5.125 7.727 1.00 0.37 N ATOM 763 CA ASP A 324 7.322 6.258 7.610 1.00 0.45 C ATOM 764 C ASP A 324 5.914 5.833 8.005 1.00 0.36 C ATOM 765 O ASP A 324 5.645 4.640 8.145 1.00 0.47 O ATOM 766 CB ASP A 324 7.316 6.837 6.191 1.00 0.61 C ATOM 767 CG ASP A 324 7.123 8.344 6.198 1.00 0.85 C ATOM 768 OD1 ASP A 324 7.986 9.058 5.649 1.00 1.68 O ATOM 769 OD2 ASP A 324 6.130 8.822 6.788 1.00 0.91 O ATOM 0 H ASP A 324 7.828 4.216 7.519 1.00 0.37 H new ATOM 0 HA ASP A 324 7.669 7.038 8.287 1.00 0.45 H new ATOM 0 HB2 ASP A 324 8.255 6.593 5.695 1.00 0.61 H new ATOM 0 HB3 ASP A 324 6.519 6.371 5.612 1.00 0.61 H new ATOM 774 N LYS A 325 5.012 6.800 8.177 1.00 0.35 N ATOM 775 CA LYS A 325 3.678 6.512 8.687 1.00 0.31 C ATOM 776 C LYS A 325 2.802 7.760 8.717 1.00 0.32 C ATOM 777 O LYS A 325 3.275 8.867 8.982 1.00 0.45 O ATOM 778 CB LYS A 325 3.747 5.914 10.108 1.00 0.43 C ATOM 779 CG LYS A 325 4.249 6.881 11.184 1.00 0.61 C ATOM 780 CD LYS A 325 5.727 7.212 11.015 1.00 1.17 C ATOM 781 CE LYS A 325 6.173 8.340 11.926 1.00 1.44 C ATOM 782 NZ LYS A 325 7.596 8.692 11.687 1.00 1.99 N ATOM 0 H LYS A 325 5.183 7.784 7.971 1.00 0.35 H new ATOM 0 HA LYS A 325 3.233 5.787 8.006 1.00 0.31 H new ATOM 0 HB2 LYS A 325 2.754 5.563 10.389 1.00 0.43 H new ATOM 0 HB3 LYS A 325 4.400 5.041 10.089 1.00 0.43 H new ATOM 0 HG2 LYS A 325 3.665 7.801 11.145 1.00 0.61 H new ATOM 0 HG3 LYS A 325 4.087 6.443 12.169 1.00 0.61 H new ATOM 0 HD2 LYS A 325 6.322 6.323 11.223 1.00 1.17 H new ATOM 0 HD3 LYS A 325 5.919 7.488 9.978 1.00 1.17 H new ATOM 0 HE2 LYS A 325 5.546 9.216 11.759 1.00 1.44 H new ATOM 0 HE3 LYS A 325 6.038 8.045 12.967 1.00 1.44 H new ATOM 0 HZ1 LYS A 325 7.874 9.466 12.324 1.00 1.99 H new ATOM 0 HZ2 LYS A 325 8.195 7.861 11.870 1.00 1.99 H new ATOM 0 HZ3 LYS A 325 7.717 8.995 10.700 1.00 1.99 H new ATOM 796 N ASN A 326 1.529 7.570 8.423 1.00 0.33 N ATOM 797 CA ASN A 326 0.513 8.569 8.698 1.00 0.40 C ATOM 798 C ASN A 326 -0.816 7.881 8.948 1.00 0.39 C ATOM 799 O ASN A 326 -1.329 7.158 8.100 1.00 0.42 O ATOM 800 CB ASN A 326 0.392 9.630 7.591 1.00 0.56 C ATOM 801 CG ASN A 326 0.393 9.070 6.184 1.00 0.95 C ATOM 802 OD1 ASN A 326 -0.629 8.622 5.676 1.00 1.92 O ATOM 803 ND2 ASN A 326 1.544 9.131 5.536 1.00 0.82 N ATOM 0 H ASN A 326 1.171 6.720 7.987 1.00 0.33 H new ATOM 0 HA ASN A 326 0.819 9.112 9.592 1.00 0.40 H new ATOM 0 HB2 ASN A 326 -0.528 10.193 7.744 1.00 0.56 H new ATOM 0 HB3 ASN A 326 1.217 10.335 7.689 1.00 0.56 H new ATOM 0 HD21 ASN A 326 1.606 8.797 4.574 1.00 0.82 H new ATOM 0 HD22 ASN A 326 2.370 9.512 5.998 1.00 0.82 H new ATOM 810 N THR A 327 -1.344 8.060 10.148 1.00 0.45 N ATOM 811 CA THR A 327 -2.566 7.384 10.546 1.00 0.54 C ATOM 812 C THR A 327 -3.347 8.211 11.564 1.00 0.52 C ATOM 813 O THR A 327 -4.516 8.530 11.352 1.00 0.58 O ATOM 814 CB THR A 327 -2.257 6.000 11.141 1.00 0.69 C ATOM 815 OG1 THR A 327 -1.441 5.241 10.239 1.00 1.69 O ATOM 816 CG2 THR A 327 -3.532 5.228 11.443 1.00 1.26 C ATOM 0 H THR A 327 -0.945 8.668 10.863 1.00 0.45 H new ATOM 0 HA THR A 327 -3.175 7.261 9.651 1.00 0.54 H new ATOM 0 HB THR A 327 -1.719 6.157 12.076 1.00 0.69 H new ATOM 0 HG1 THR A 327 -1.250 4.363 10.630 1.00 1.69 H new ATOM 0 HG21 THR A 327 -3.277 4.255 11.862 1.00 1.26 H new ATOM 0 HG22 THR A 327 -4.134 5.786 12.160 1.00 1.26 H new ATOM 0 HG23 THR A 327 -4.100 5.089 10.523 1.00 1.26 H new ATOM 824 N LYS A 328 -2.689 8.568 12.664 1.00 0.51 N ATOM 825 CA LYS A 328 -3.346 9.309 13.738 1.00 0.60 C ATOM 826 C LYS A 328 -3.617 10.751 13.329 1.00 0.61 C ATOM 827 O LYS A 328 -2.742 11.616 13.432 1.00 0.63 O ATOM 828 CB LYS A 328 -2.504 9.276 15.018 1.00 0.65 C ATOM 829 CG LYS A 328 -2.294 7.878 15.569 1.00 1.07 C ATOM 830 CD LYS A 328 -1.584 7.904 16.915 1.00 1.29 C ATOM 831 CE LYS A 328 -0.119 8.286 16.772 1.00 1.63 C ATOM 832 NZ LYS A 328 0.698 7.163 16.236 1.00 2.55 N ATOM 0 H LYS A 328 -1.706 8.357 12.835 1.00 0.51 H new ATOM 0 HA LYS A 328 -4.302 8.823 13.934 1.00 0.60 H new ATOM 0 HB2 LYS A 328 -1.533 9.728 14.816 1.00 0.65 H new ATOM 0 HB3 LYS A 328 -2.989 9.888 15.778 1.00 0.65 H new ATOM 0 HG2 LYS A 328 -3.258 7.380 15.676 1.00 1.07 H new ATOM 0 HG3 LYS A 328 -1.709 7.292 14.860 1.00 1.07 H new ATOM 0 HD2 LYS A 328 -2.082 8.614 17.575 1.00 1.29 H new ATOM 0 HD3 LYS A 328 -1.660 6.924 17.385 1.00 1.29 H new ATOM 0 HE2 LYS A 328 -0.031 9.147 16.109 1.00 1.63 H new ATOM 0 HE3 LYS A 328 0.273 8.589 17.743 1.00 1.63 H new ATOM 0 HZ1 LYS A 328 1.700 7.441 16.217 1.00 2.55 H new ATOM 0 HZ2 LYS A 328 0.582 6.328 16.844 1.00 2.55 H new ATOM 0 HZ3 LYS A 328 0.384 6.935 15.271 1.00 2.55 H new ATOM 846 N GLY A 329 -4.820 10.993 12.823 1.00 0.78 N ATOM 847 CA GLY A 329 -5.234 12.338 12.475 1.00 0.97 C ATOM 848 C GLY A 329 -4.694 12.795 11.134 1.00 0.84 C ATOM 849 O GLY A 329 -5.112 13.829 10.615 1.00 0.88 O ATOM 0 H GLY A 329 -5.522 10.274 12.646 1.00 0.78 H new ATOM 0 HA2 GLY A 329 -6.323 12.384 12.457 1.00 0.97 H new ATOM 0 HA3 GLY A 329 -4.899 13.028 13.250 1.00 0.97 H new ATOM 853 N LYS A 330 -3.765 12.031 10.571 1.00 0.72 N ATOM 854 CA LYS A 330 -3.139 12.401 9.312 1.00 0.62 C ATOM 855 C LYS A 330 -3.696 11.570 8.161 1.00 0.49 C ATOM 856 O LYS A 330 -3.318 10.410 7.999 1.00 0.41 O ATOM 857 CB LYS A 330 -1.622 12.207 9.388 1.00 0.64 C ATOM 858 CG LYS A 330 -0.970 12.868 10.595 1.00 0.90 C ATOM 859 CD LYS A 330 0.548 12.763 10.543 1.00 1.51 C ATOM 860 CE LYS A 330 1.123 13.435 9.306 1.00 1.80 C ATOM 861 NZ LYS A 330 0.970 14.915 9.340 1.00 2.08 N ATOM 0 H LYS A 330 -3.430 11.153 10.968 1.00 0.72 H new ATOM 0 HA LYS A 330 -3.360 13.453 9.129 1.00 0.62 H new ATOM 0 HB2 LYS A 330 -1.404 11.139 9.410 1.00 0.64 H new ATOM 0 HB3 LYS A 330 -1.170 12.606 8.480 1.00 0.64 H new ATOM 0 HG2 LYS A 330 -1.261 13.918 10.636 1.00 0.90 H new ATOM 0 HG3 LYS A 330 -1.336 12.399 11.509 1.00 0.90 H new ATOM 0 HD2 LYS A 330 0.974 13.221 11.436 1.00 1.51 H new ATOM 0 HD3 LYS A 330 0.839 11.713 10.554 1.00 1.51 H new ATOM 0 HE2 LYS A 330 2.180 13.184 9.218 1.00 1.80 H new ATOM 0 HE3 LYS A 330 0.627 13.042 8.419 1.00 1.80 H new ATOM 0 HZ1 LYS A 330 1.407 15.329 8.492 1.00 2.08 H new ATOM 0 HZ2 LYS A 330 -0.041 15.159 9.363 1.00 2.08 H new ATOM 0 HZ3 LYS A 330 1.437 15.293 10.189 1.00 2.08 H new ATOM 875 N PRO A 331 -4.620 12.131 7.370 1.00 0.49 N ATOM 876 CA PRO A 331 -5.104 11.497 6.156 1.00 0.43 C ATOM 877 C PRO A 331 -4.248 11.851 4.942 1.00 0.39 C ATOM 878 O PRO A 331 -3.871 13.009 4.751 1.00 0.55 O ATOM 879 CB PRO A 331 -6.514 12.058 6.015 1.00 0.53 C ATOM 880 CG PRO A 331 -6.484 13.399 6.684 1.00 0.62 C ATOM 881 CD PRO A 331 -5.275 13.432 7.594 1.00 0.60 C ATOM 0 HA PRO A 331 -5.071 10.409 6.210 1.00 0.43 H new ATOM 0 HB2 PRO A 331 -6.796 12.150 4.966 1.00 0.53 H new ATOM 0 HB3 PRO A 331 -7.246 11.402 6.486 1.00 0.53 H new ATOM 0 HG2 PRO A 331 -6.426 14.195 5.942 1.00 0.62 H new ATOM 0 HG3 PRO A 331 -7.398 13.562 7.256 1.00 0.62 H new ATOM 0 HD2 PRO A 331 -4.612 14.260 7.345 1.00 0.60 H new ATOM 0 HD3 PRO A 331 -5.565 13.558 8.637 1.00 0.60 H new ATOM 889 N PHE A 332 -3.942 10.862 4.123 1.00 0.28 N ATOM 890 CA PHE A 332 -3.174 11.096 2.914 1.00 0.29 C ATOM 891 C PHE A 332 -4.068 10.894 1.698 1.00 0.27 C ATOM 892 O PHE A 332 -4.655 9.828 1.526 1.00 0.26 O ATOM 893 CB PHE A 332 -1.966 10.160 2.851 1.00 0.31 C ATOM 894 CG PHE A 332 -1.065 10.422 1.679 1.00 0.40 C ATOM 895 CD1 PHE A 332 -0.262 11.553 1.648 1.00 0.53 C ATOM 896 CD2 PHE A 332 -1.019 9.544 0.609 1.00 0.42 C ATOM 897 CE1 PHE A 332 0.570 11.798 0.572 1.00 0.64 C ATOM 898 CE2 PHE A 332 -0.190 9.786 -0.468 1.00 0.53 C ATOM 899 CZ PHE A 332 0.605 10.913 -0.487 1.00 0.63 C ATOM 0 H PHE A 332 -4.213 9.890 4.272 1.00 0.28 H new ATOM 0 HA PHE A 332 -2.804 12.121 2.922 1.00 0.29 H new ATOM 0 HB2 PHE A 332 -1.390 10.260 3.771 1.00 0.31 H new ATOM 0 HB3 PHE A 332 -2.317 9.129 2.806 1.00 0.31 H new ATOM 0 HD1 PHE A 332 -0.287 12.249 2.473 1.00 0.53 H new ATOM 0 HD2 PHE A 332 -1.639 8.660 0.617 1.00 0.42 H new ATOM 0 HE1 PHE A 332 1.192 12.681 0.560 1.00 0.64 H new ATOM 0 HE2 PHE A 332 -0.164 9.093 -1.296 1.00 0.53 H new ATOM 0 HZ PHE A 332 1.254 11.103 -1.329 1.00 0.63 H new ATOM 909 N VAL A 333 -4.177 11.915 0.863 1.00 0.29 N ATOM 910 CA VAL A 333 -5.057 11.861 -0.293 1.00 0.30 C ATOM 911 C VAL A 333 -4.250 12.015 -1.575 1.00 0.30 C ATOM 912 O VAL A 333 -3.651 13.064 -1.814 1.00 0.36 O ATOM 913 CB VAL A 333 -6.134 12.970 -0.237 1.00 0.34 C ATOM 914 CG1 VAL A 333 -7.086 12.870 -1.423 1.00 0.38 C ATOM 915 CG2 VAL A 333 -6.905 12.909 1.071 1.00 0.36 C ATOM 0 H VAL A 333 -3.666 12.792 0.965 1.00 0.29 H new ATOM 0 HA VAL A 333 -5.555 10.891 -0.281 1.00 0.30 H new ATOM 0 HB VAL A 333 -5.624 13.932 -0.291 1.00 0.34 H new ATOM 0 HG11 VAL A 333 -7.833 13.662 -1.358 1.00 0.38 H new ATOM 0 HG12 VAL A 333 -6.524 12.977 -2.351 1.00 0.38 H new ATOM 0 HG13 VAL A 333 -7.583 11.900 -1.410 1.00 0.38 H new ATOM 0 HG21 VAL A 333 -7.657 13.698 1.087 1.00 0.36 H new ATOM 0 HG22 VAL A 333 -7.395 11.939 1.160 1.00 0.36 H new ATOM 0 HG23 VAL A 333 -6.217 13.046 1.905 1.00 0.36 H new ATOM 925 N PHE A 334 -4.227 10.975 -2.394 1.00 0.29 N ATOM 926 CA PHE A 334 -3.465 11.010 -3.629 1.00 0.31 C ATOM 927 C PHE A 334 -4.300 10.483 -4.789 1.00 0.28 C ATOM 928 O PHE A 334 -5.408 9.983 -4.589 1.00 0.30 O ATOM 929 CB PHE A 334 -2.164 10.204 -3.489 1.00 0.33 C ATOM 930 CG PHE A 334 -2.341 8.707 -3.516 1.00 0.31 C ATOM 931 CD1 PHE A 334 -2.094 7.976 -4.669 1.00 0.36 C ATOM 932 CD2 PHE A 334 -2.768 8.034 -2.383 1.00 0.33 C ATOM 933 CE1 PHE A 334 -2.272 6.606 -4.683 1.00 0.39 C ATOM 934 CE2 PHE A 334 -2.944 6.667 -2.393 1.00 0.39 C ATOM 935 CZ PHE A 334 -2.634 5.945 -3.587 1.00 0.41 C ATOM 0 H PHE A 334 -4.725 10.101 -2.226 1.00 0.29 H new ATOM 0 HA PHE A 334 -3.202 12.047 -3.838 1.00 0.31 H new ATOM 0 HB2 PHE A 334 -1.488 10.490 -4.294 1.00 0.33 H new ATOM 0 HB3 PHE A 334 -1.680 10.482 -2.553 1.00 0.33 H new ATOM 0 HD1 PHE A 334 -1.760 8.482 -5.563 1.00 0.36 H new ATOM 0 HD2 PHE A 334 -2.966 8.589 -1.478 1.00 0.33 H new ATOM 0 HE1 PHE A 334 -2.114 6.061 -5.602 1.00 0.39 H new ATOM 0 HE2 PHE A 334 -3.309 6.152 -1.517 1.00 0.39 H new ATOM 0 HZ PHE A 334 -2.693 4.867 -3.599 1.00 0.41 H new ATOM 945 N LYS A 335 -3.775 10.612 -5.996 1.00 0.33 N ATOM 946 CA LYS A 335 -4.474 10.150 -7.183 1.00 0.35 C ATOM 947 C LYS A 335 -3.676 9.047 -7.868 1.00 0.35 C ATOM 948 O LYS A 335 -2.448 9.097 -7.914 1.00 0.43 O ATOM 949 CB LYS A 335 -4.748 11.318 -8.157 1.00 0.53 C ATOM 950 CG LYS A 335 -3.518 11.867 -8.892 1.00 1.05 C ATOM 951 CD LYS A 335 -2.491 12.479 -7.945 1.00 1.46 C ATOM 952 CE LYS A 335 -3.025 13.708 -7.224 1.00 1.95 C ATOM 953 NZ LYS A 335 -3.184 14.868 -8.136 1.00 2.58 N ATOM 0 H LYS A 335 -2.865 11.034 -6.180 1.00 0.33 H new ATOM 0 HA LYS A 335 -5.437 9.742 -6.877 1.00 0.35 H new ATOM 0 HB2 LYS A 335 -5.475 10.987 -8.899 1.00 0.53 H new ATOM 0 HB3 LYS A 335 -5.210 12.133 -7.599 1.00 0.53 H new ATOM 0 HG2 LYS A 335 -3.049 11.062 -9.459 1.00 1.05 H new ATOM 0 HG3 LYS A 335 -3.837 12.621 -9.612 1.00 1.05 H new ATOM 0 HD2 LYS A 335 -2.189 11.733 -7.210 1.00 1.46 H new ATOM 0 HD3 LYS A 335 -1.598 12.751 -8.508 1.00 1.46 H new ATOM 0 HE2 LYS A 335 -3.987 13.471 -6.769 1.00 1.95 H new ATOM 0 HE3 LYS A 335 -2.347 13.975 -6.414 1.00 1.95 H new ATOM 0 HZ1 LYS A 335 -3.469 15.704 -7.587 1.00 2.58 H new ATOM 0 HZ2 LYS A 335 -2.281 15.059 -8.615 1.00 2.58 H new ATOM 0 HZ3 LYS A 335 -3.914 14.654 -8.845 1.00 2.58 H new ATOM 967 N LEU A 336 -4.368 8.035 -8.363 1.00 0.33 N ATOM 968 CA LEU A 336 -3.719 6.935 -9.070 1.00 0.41 C ATOM 969 C LEU A 336 -3.389 7.337 -10.501 1.00 0.51 C ATOM 970 O LEU A 336 -4.076 8.170 -11.095 1.00 0.58 O ATOM 971 CB LEU A 336 -4.594 5.678 -9.066 1.00 0.40 C ATOM 972 CG LEU A 336 -4.575 4.857 -7.771 1.00 0.38 C ATOM 973 CD1 LEU A 336 -5.236 5.619 -6.633 1.00 0.33 C ATOM 974 CD2 LEU A 336 -5.263 3.521 -7.987 1.00 0.46 C ATOM 0 H LEU A 336 -5.382 7.949 -8.290 1.00 0.33 H new ATOM 0 HA LEU A 336 -2.792 6.707 -8.544 1.00 0.41 H new ATOM 0 HB2 LEU A 336 -5.623 5.973 -9.272 1.00 0.40 H new ATOM 0 HB3 LEU A 336 -4.277 5.035 -9.887 1.00 0.40 H new ATOM 0 HG LEU A 336 -3.536 4.676 -7.496 1.00 0.38 H new ATOM 0 HD11 LEU A 336 -5.209 5.014 -5.726 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -4.702 6.553 -6.462 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -6.272 5.836 -6.894 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -5.243 2.947 -7.060 1.00 0.46 H new ATOM 0 HD22 LEU A 336 -6.297 3.689 -8.288 1.00 0.46 H new ATOM 0 HD23 LEU A 336 -4.743 2.966 -8.768 1.00 0.46 H new ATOM 986 N GLY A 337 -2.338 6.743 -11.049 1.00 0.67 N ATOM 987 CA GLY A 337 -1.885 7.111 -12.373 1.00 0.84 C ATOM 988 C GLY A 337 -0.823 8.192 -12.330 1.00 0.75 C ATOM 989 O GLY A 337 -0.450 8.746 -13.363 1.00 0.94 O ATOM 0 H GLY A 337 -1.790 6.011 -10.598 1.00 0.67 H new ATOM 0 HA2 GLY A 337 -1.486 6.231 -12.877 1.00 0.84 H new ATOM 0 HA3 GLY A 337 -2.733 7.459 -12.963 1.00 0.84 H new ATOM 993 N GLN A 338 -0.340 8.496 -11.133 1.00 0.82 N ATOM 994 CA GLN A 338 0.680 9.524 -10.966 1.00 0.87 C ATOM 995 C GLN A 338 2.066 8.891 -10.864 1.00 0.64 C ATOM 996 O GLN A 338 2.196 7.699 -10.577 1.00 0.63 O ATOM 997 CB GLN A 338 0.404 10.375 -9.722 1.00 1.14 C ATOM 998 CG GLN A 338 0.579 9.613 -8.421 1.00 1.26 C ATOM 999 CD GLN A 338 0.380 10.486 -7.203 1.00 1.97 C ATOM 1000 OE1 GLN A 338 -0.062 9.882 -6.116 1.00 2.30 O flip ATOM 1001 NE2 GLN A 338 0.630 11.687 -7.234 1.00 2.62 N flip ATOM 0 H GLN A 338 -0.636 8.048 -10.266 1.00 0.82 H new ATOM 0 HA GLN A 338 0.648 10.171 -11.842 1.00 0.87 H new ATOM 0 HB2 GLN A 338 1.073 11.236 -9.724 1.00 1.14 H new ATOM 0 HB3 GLN A 338 -0.614 10.762 -9.774 1.00 1.14 H new ATOM 0 HG2 GLN A 338 -0.131 8.786 -8.390 1.00 1.26 H new ATOM 0 HG3 GLN A 338 1.578 9.177 -8.391 1.00 1.26 H new ATOM 0 HE21 GLN A 338 0.970 12.115 -8.095 1.00 2.62 H new ATOM 0 HE22 GLN A 338 0.498 12.257 -6.399 1.00 2.62 H new ATOM 1010 N GLY A 339 3.097 9.695 -11.089 1.00 0.74 N ATOM 1011 CA GLY A 339 4.453 9.197 -11.027 1.00 0.70 C ATOM 1012 C GLY A 339 5.127 9.527 -9.709 1.00 0.55 C ATOM 1013 O GLY A 339 6.315 9.251 -9.527 1.00 0.70 O ATOM 0 H GLY A 339 3.015 10.687 -11.314 1.00 0.74 H new ATOM 0 HA2 GLY A 339 4.448 8.116 -11.169 1.00 0.70 H new ATOM 0 HA3 GLY A 339 5.032 9.624 -11.846 1.00 0.70 H new ATOM 1017 N GLU A 340 4.370 10.121 -8.795 1.00 0.49 N ATOM 1018 CA GLU A 340 4.887 10.459 -7.474 1.00 0.54 C ATOM 1019 C GLU A 340 5.042 9.206 -6.620 1.00 0.41 C ATOM 1020 O GLU A 340 5.955 9.107 -5.806 1.00 0.53 O ATOM 1021 CB GLU A 340 3.955 11.441 -6.766 1.00 0.82 C ATOM 1022 CG GLU A 340 3.713 12.728 -7.534 1.00 1.01 C ATOM 1023 CD GLU A 340 4.982 13.517 -7.766 1.00 1.53 C ATOM 1024 OE1 GLU A 340 5.709 13.792 -6.789 1.00 2.09 O ATOM 1025 OE2 GLU A 340 5.253 13.884 -8.926 1.00 1.89 O ATOM 0 H GLU A 340 3.395 10.379 -8.944 1.00 0.49 H new ATOM 0 HA GLU A 340 5.864 10.924 -7.607 1.00 0.54 H new ATOM 0 HB2 GLU A 340 2.998 10.952 -6.587 1.00 0.82 H new ATOM 0 HB3 GLU A 340 4.376 11.686 -5.791 1.00 0.82 H new ATOM 0 HG2 GLU A 340 3.256 12.492 -8.495 1.00 1.01 H new ATOM 0 HG3 GLU A 340 3.001 13.345 -6.985 1.00 1.01 H new ATOM 1032 N VAL A 341 4.140 8.254 -6.816 1.00 0.34 N ATOM 1033 CA VAL A 341 4.146 7.020 -6.040 1.00 0.30 C ATOM 1034 C VAL A 341 4.778 5.879 -6.833 1.00 0.29 C ATOM 1035 O VAL A 341 4.809 5.913 -8.068 1.00 0.36 O ATOM 1036 CB VAL A 341 2.717 6.615 -5.609 1.00 0.35 C ATOM 1037 CG1 VAL A 341 2.112 7.672 -4.697 1.00 0.41 C ATOM 1038 CG2 VAL A 341 1.818 6.392 -6.818 1.00 0.43 C ATOM 0 H VAL A 341 3.393 8.312 -7.508 1.00 0.34 H new ATOM 0 HA VAL A 341 4.740 7.208 -5.146 1.00 0.30 H new ATOM 0 HB VAL A 341 2.791 5.676 -5.061 1.00 0.35 H new ATOM 0 HG11 VAL A 341 1.107 7.368 -4.405 1.00 0.41 H new ATOM 0 HG12 VAL A 341 2.731 7.782 -3.807 1.00 0.41 H new ATOM 0 HG13 VAL A 341 2.064 8.624 -5.225 1.00 0.41 H new ATOM 0 HG21 VAL A 341 0.820 6.109 -6.482 1.00 0.43 H new ATOM 0 HG22 VAL A 341 1.757 7.311 -7.401 1.00 0.43 H new ATOM 0 HG23 VAL A 341 2.232 5.596 -7.437 1.00 0.43 H new ATOM 1048 N ILE A 342 5.281 4.873 -6.125 1.00 0.29 N ATOM 1049 CA ILE A 342 5.867 3.703 -6.773 1.00 0.30 C ATOM 1050 C ILE A 342 4.778 2.847 -7.420 1.00 0.31 C ATOM 1051 O ILE A 342 3.598 2.973 -7.085 1.00 0.32 O ATOM 1052 CB ILE A 342 6.683 2.843 -5.775 1.00 0.30 C ATOM 1053 CG1 ILE A 342 5.793 2.355 -4.628 1.00 0.30 C ATOM 1054 CG2 ILE A 342 7.870 3.632 -5.239 1.00 0.32 C ATOM 1055 CD1 ILE A 342 6.543 1.647 -3.519 1.00 0.32 C ATOM 0 H ILE A 342 5.295 4.843 -5.106 1.00 0.29 H new ATOM 0 HA ILE A 342 6.547 4.066 -7.543 1.00 0.30 H new ATOM 0 HB ILE A 342 7.063 1.969 -6.304 1.00 0.30 H new ATOM 0 HG12 ILE A 342 5.263 3.209 -4.206 1.00 0.30 H new ATOM 0 HG13 ILE A 342 5.039 1.679 -5.031 1.00 0.30 H new ATOM 0 HG21 ILE A 342 8.432 3.013 -4.540 1.00 0.32 H new ATOM 0 HG22 ILE A 342 8.517 3.923 -6.067 1.00 0.32 H new ATOM 0 HG23 ILE A 342 7.512 4.525 -4.727 1.00 0.32 H new ATOM 0 HD11 ILE A 342 5.840 1.334 -2.747 1.00 0.32 H new ATOM 0 HD12 ILE A 342 7.051 0.772 -3.924 1.00 0.32 H new ATOM 0 HD13 ILE A 342 7.279 2.325 -3.087 1.00 0.32 H new ATOM 1067 N LYS A 343 5.180 1.978 -8.340 1.00 0.34 N ATOM 1068 CA LYS A 343 4.233 1.150 -9.084 1.00 0.38 C ATOM 1069 C LYS A 343 3.439 0.231 -8.164 1.00 0.32 C ATOM 1070 O LYS A 343 2.251 0.014 -8.386 1.00 0.36 O ATOM 1071 CB LYS A 343 4.959 0.328 -10.152 1.00 0.46 C ATOM 1072 CG LYS A 343 5.171 1.075 -11.466 1.00 0.60 C ATOM 1073 CD LYS A 343 4.115 0.709 -12.508 1.00 1.39 C ATOM 1074 CE LYS A 343 2.708 1.132 -12.100 1.00 2.16 C ATOM 1075 NZ LYS A 343 2.473 2.588 -12.286 1.00 2.93 N ATOM 0 H LYS A 343 6.157 1.827 -8.590 1.00 0.34 H new ATOM 0 HA LYS A 343 3.528 1.823 -9.571 1.00 0.38 H new ATOM 0 HB2 LYS A 343 5.928 0.017 -9.761 1.00 0.46 H new ATOM 0 HB3 LYS A 343 4.388 -0.580 -10.349 1.00 0.46 H new ATOM 0 HG2 LYS A 343 5.142 2.149 -11.282 1.00 0.60 H new ATOM 0 HG3 LYS A 343 6.162 0.846 -11.858 1.00 0.60 H new ATOM 0 HD2 LYS A 343 4.370 1.180 -13.457 1.00 1.39 H new ATOM 0 HD3 LYS A 343 4.132 -0.368 -12.672 1.00 1.39 H new ATOM 0 HE2 LYS A 343 1.980 0.572 -12.687 1.00 2.16 H new ATOM 0 HE3 LYS A 343 2.543 0.872 -11.055 1.00 2.16 H new ATOM 0 HZ1 LYS A 343 1.457 2.760 -12.428 1.00 2.93 H new ATOM 0 HZ2 LYS A 343 2.796 3.102 -11.442 1.00 2.93 H new ATOM 0 HZ3 LYS A 343 3.001 2.921 -13.118 1.00 2.93 H new ATOM 1089 N GLY A 344 4.102 -0.308 -7.144 1.00 0.28 N ATOM 1090 CA GLY A 344 3.422 -1.129 -6.155 1.00 0.28 C ATOM 1091 C GLY A 344 2.195 -0.448 -5.578 1.00 0.27 C ATOM 1092 O GLY A 344 1.185 -1.097 -5.319 1.00 0.30 O ATOM 0 H GLY A 344 5.102 -0.190 -6.984 1.00 0.28 H new ATOM 0 HA2 GLY A 344 3.128 -2.074 -6.612 1.00 0.28 H new ATOM 0 HA3 GLY A 344 4.114 -1.368 -5.348 1.00 0.28 H new ATOM 1096 N TRP A 345 2.281 0.866 -5.396 1.00 0.27 N ATOM 1097 CA TRP A 345 1.157 1.650 -4.907 1.00 0.27 C ATOM 1098 C TRP A 345 0.091 1.810 -5.984 1.00 0.29 C ATOM 1099 O TRP A 345 -1.039 1.379 -5.805 1.00 0.32 O ATOM 1100 CB TRP A 345 1.637 3.019 -4.429 1.00 0.27 C ATOM 1101 CG TRP A 345 2.081 3.028 -3.003 1.00 0.28 C ATOM 1102 CD1 TRP A 345 3.162 2.394 -2.464 1.00 0.32 C ATOM 1103 CD2 TRP A 345 1.448 3.723 -1.932 1.00 0.28 C ATOM 1104 NE1 TRP A 345 3.228 2.643 -1.115 1.00 0.36 N ATOM 1105 CE2 TRP A 345 2.187 3.463 -0.765 1.00 0.34 C ATOM 1106 CE3 TRP A 345 0.326 4.543 -1.851 1.00 0.27 C ATOM 1107 CZ2 TRP A 345 1.833 3.995 0.471 1.00 0.39 C ATOM 1108 CZ3 TRP A 345 -0.028 5.069 -0.627 1.00 0.32 C ATOM 1109 CH2 TRP A 345 0.725 4.792 0.520 1.00 0.37 C ATOM 0 H TRP A 345 3.123 1.411 -5.582 1.00 0.27 H new ATOM 0 HA TRP A 345 0.711 1.118 -4.067 1.00 0.27 H new ATOM 0 HB2 TRP A 345 2.462 3.347 -5.061 1.00 0.27 H new ATOM 0 HB3 TRP A 345 0.832 3.743 -4.555 1.00 0.27 H new ATOM 0 HD1 TRP A 345 3.863 1.786 -3.017 1.00 0.32 H new ATOM 0 HE1 TRP A 345 3.936 2.278 -0.478 1.00 0.36 H new ATOM 0 HE3 TRP A 345 -0.258 4.763 -2.733 1.00 0.27 H new ATOM 0 HZ2 TRP A 345 2.412 3.786 1.358 1.00 0.39 H new ATOM 0 HZ3 TRP A 345 -0.899 5.704 -0.552 1.00 0.32 H new ATOM 0 HH2 TRP A 345 0.423 5.218 1.465 1.00 0.37 H new ATOM 1120 N ASP A 346 0.470 2.419 -7.097 1.00 0.34 N ATOM 1121 CA ASP A 346 -0.439 2.645 -8.229 1.00 0.40 C ATOM 1122 C ASP A 346 -1.189 1.370 -8.630 1.00 0.39 C ATOM 1123 O ASP A 346 -2.348 1.424 -9.039 1.00 0.46 O ATOM 1124 CB ASP A 346 0.370 3.185 -9.413 1.00 0.49 C ATOM 1125 CG ASP A 346 -0.452 3.395 -10.672 1.00 0.84 C ATOM 1126 OD1 ASP A 346 -1.366 4.242 -10.658 1.00 1.75 O ATOM 1127 OD2 ASP A 346 -0.156 2.734 -11.691 1.00 0.97 O ATOM 0 H ASP A 346 1.414 2.773 -7.249 1.00 0.34 H new ATOM 0 HA ASP A 346 -1.193 3.372 -7.926 1.00 0.40 H new ATOM 0 HB2 ASP A 346 0.827 4.132 -9.127 1.00 0.49 H new ATOM 0 HB3 ASP A 346 1.182 2.492 -9.632 1.00 0.49 H new ATOM 1132 N ILE A 347 -0.531 0.223 -8.492 1.00 0.34 N ATOM 1133 CA ILE A 347 -1.147 -1.060 -8.810 1.00 0.35 C ATOM 1134 C ILE A 347 -1.943 -1.616 -7.622 1.00 0.35 C ATOM 1135 O ILE A 347 -3.123 -1.936 -7.757 1.00 0.38 O ATOM 1136 CB ILE A 347 -0.083 -2.088 -9.248 1.00 0.35 C ATOM 1137 CG1 ILE A 347 0.592 -1.619 -10.541 1.00 0.36 C ATOM 1138 CG2 ILE A 347 -0.703 -3.470 -9.430 1.00 0.38 C ATOM 1139 CD1 ILE A 347 1.659 -2.564 -11.050 1.00 0.39 C ATOM 0 H ILE A 347 0.432 0.156 -8.161 1.00 0.34 H new ATOM 0 HA ILE A 347 -1.838 -0.887 -9.635 1.00 0.35 H new ATOM 0 HB ILE A 347 0.672 -2.165 -8.466 1.00 0.35 H new ATOM 0 HG12 ILE A 347 -0.168 -1.495 -11.312 1.00 0.36 H new ATOM 0 HG13 ILE A 347 1.038 -0.639 -10.372 1.00 0.36 H new ATOM 0 HG21 ILE A 347 0.067 -4.177 -9.739 1.00 0.38 H new ATOM 0 HG22 ILE A 347 -1.141 -3.799 -8.488 1.00 0.38 H new ATOM 0 HG23 ILE A 347 -1.479 -3.423 -10.194 1.00 0.38 H new ATOM 0 HD11 ILE A 347 2.091 -2.165 -11.968 1.00 0.39 H new ATOM 0 HD12 ILE A 347 2.440 -2.670 -10.297 1.00 0.39 H new ATOM 0 HD13 ILE A 347 1.215 -3.539 -11.252 1.00 0.39 H new ATOM 1151 N GLY A 348 -1.285 -1.745 -6.472 1.00 0.33 N ATOM 1152 CA GLY A 348 -1.920 -2.313 -5.288 1.00 0.34 C ATOM 1153 C GLY A 348 -3.128 -1.527 -4.802 1.00 0.31 C ATOM 1154 O GLY A 348 -4.104 -2.108 -4.324 1.00 0.34 O ATOM 0 H GLY A 348 -0.314 -1.464 -6.336 1.00 0.33 H new ATOM 0 HA2 GLY A 348 -2.228 -3.335 -5.508 1.00 0.34 H new ATOM 0 HA3 GLY A 348 -1.186 -2.367 -4.484 1.00 0.34 H new ATOM 1158 N VAL A 349 -3.060 -0.208 -4.908 1.00 0.28 N ATOM 1159 CA VAL A 349 -4.160 0.648 -4.483 1.00 0.27 C ATOM 1160 C VAL A 349 -5.336 0.536 -5.451 1.00 0.24 C ATOM 1161 O VAL A 349 -6.488 0.761 -5.076 1.00 0.24 O ATOM 1162 CB VAL A 349 -3.701 2.120 -4.352 1.00 0.28 C ATOM 1163 CG1 VAL A 349 -4.858 3.042 -4.007 1.00 0.28 C ATOM 1164 CG2 VAL A 349 -2.613 2.236 -3.296 1.00 0.32 C ATOM 0 H VAL A 349 -2.255 0.293 -5.284 1.00 0.28 H new ATOM 0 HA VAL A 349 -4.489 0.309 -3.501 1.00 0.27 H new ATOM 0 HB VAL A 349 -3.305 2.430 -5.319 1.00 0.28 H new ATOM 0 HG11 VAL A 349 -4.495 4.066 -3.924 1.00 0.28 H new ATOM 0 HG12 VAL A 349 -5.613 2.987 -4.791 1.00 0.28 H new ATOM 0 HG13 VAL A 349 -5.298 2.735 -3.058 1.00 0.28 H new ATOM 0 HG21 VAL A 349 -2.297 3.276 -3.212 1.00 0.32 H new ATOM 0 HG22 VAL A 349 -3.000 1.895 -2.336 1.00 0.32 H new ATOM 0 HG23 VAL A 349 -1.761 1.620 -3.583 1.00 0.32 H new ATOM 1174 N ALA A 350 -5.048 0.163 -6.693 1.00 0.28 N ATOM 1175 CA ALA A 350 -6.099 -0.062 -7.672 1.00 0.28 C ATOM 1176 C ALA A 350 -6.949 -1.255 -7.252 1.00 0.30 C ATOM 1177 O ALA A 350 -6.500 -2.403 -7.298 1.00 0.47 O ATOM 1178 CB ALA A 350 -5.513 -0.273 -9.060 1.00 0.37 C ATOM 0 H ALA A 350 -4.102 0.011 -7.042 1.00 0.28 H new ATOM 0 HA ALA A 350 -6.734 0.823 -7.714 1.00 0.28 H new ATOM 0 HB1 ALA A 350 -6.320 -0.439 -9.774 1.00 0.37 H new ATOM 0 HB2 ALA A 350 -4.945 0.610 -9.353 1.00 0.37 H new ATOM 0 HB3 ALA A 350 -4.854 -1.141 -9.049 1.00 0.37 H new ATOM 1184 N GLY A 351 -8.173 -0.977 -6.828 1.00 0.30 N ATOM 1185 CA GLY A 351 -9.041 -2.017 -6.311 1.00 0.37 C ATOM 1186 C GLY A 351 -9.216 -1.923 -4.806 1.00 0.33 C ATOM 1187 O GLY A 351 -9.845 -2.786 -4.191 1.00 0.39 O ATOM 0 H GLY A 351 -8.584 -0.043 -6.833 1.00 0.30 H new ATOM 0 HA2 GLY A 351 -10.016 -1.947 -6.793 1.00 0.37 H new ATOM 0 HA3 GLY A 351 -8.628 -2.993 -6.567 1.00 0.37 H new ATOM 1191 N MET A 352 -8.649 -0.878 -4.207 1.00 0.30 N ATOM 1192 CA MET A 352 -8.813 -0.629 -2.780 1.00 0.31 C ATOM 1193 C MET A 352 -10.233 -0.128 -2.515 1.00 0.26 C ATOM 1194 O MET A 352 -10.766 0.654 -3.300 1.00 0.37 O ATOM 1195 CB MET A 352 -7.795 0.415 -2.304 1.00 0.41 C ATOM 1196 CG MET A 352 -7.112 0.065 -0.990 1.00 0.65 C ATOM 1197 SD MET A 352 -8.277 -0.194 0.361 1.00 1.28 S ATOM 1198 CE MET A 352 -7.145 -0.404 1.729 1.00 0.56 C ATOM 0 H MET A 352 -8.071 -0.190 -4.690 1.00 0.30 H new ATOM 0 HA MET A 352 -8.644 -1.556 -2.232 1.00 0.31 H new ATOM 0 HB2 MET A 352 -7.034 0.542 -3.074 1.00 0.41 H new ATOM 0 HB3 MET A 352 -8.300 1.375 -2.194 1.00 0.41 H new ATOM 0 HG2 MET A 352 -6.515 -0.837 -1.126 1.00 0.65 H new ATOM 0 HG3 MET A 352 -6.423 0.865 -0.720 1.00 0.65 H new ATOM 0 HE1 MET A 352 -7.544 -1.145 2.421 1.00 0.56 H new ATOM 0 HE2 MET A 352 -6.179 -0.741 1.353 1.00 0.56 H new ATOM 0 HE3 MET A 352 -7.021 0.547 2.248 1.00 0.56 H new ATOM 1208 N ALA A 353 -10.833 -0.576 -1.418 1.00 0.34 N ATOM 1209 CA ALA A 353 -12.207 -0.212 -1.092 1.00 0.37 C ATOM 1210 C ALA A 353 -12.252 0.756 0.080 1.00 0.32 C ATOM 1211 O ALA A 353 -11.592 0.544 1.096 1.00 0.34 O ATOM 1212 CB ALA A 353 -13.024 -1.454 -0.767 1.00 0.55 C ATOM 0 H ALA A 353 -10.389 -1.193 -0.738 1.00 0.34 H new ATOM 0 HA ALA A 353 -12.638 0.280 -1.964 1.00 0.37 H new ATOM 0 HB1 ALA A 353 -14.047 -1.164 -0.526 1.00 0.55 H new ATOM 0 HB2 ALA A 353 -13.030 -2.122 -1.629 1.00 0.55 H new ATOM 0 HB3 ALA A 353 -12.582 -1.967 0.087 1.00 0.55 H new ATOM 1218 N VAL A 354 -13.016 1.827 -0.072 1.00 0.31 N ATOM 1219 CA VAL A 354 -13.231 2.776 1.010 1.00 0.29 C ATOM 1220 C VAL A 354 -13.797 2.069 2.238 1.00 0.29 C ATOM 1221 O VAL A 354 -14.894 1.513 2.199 1.00 0.32 O ATOM 1222 CB VAL A 354 -14.182 3.910 0.582 1.00 0.33 C ATOM 1223 CG1 VAL A 354 -14.421 4.890 1.722 1.00 0.35 C ATOM 1224 CG2 VAL A 354 -13.632 4.637 -0.631 1.00 0.36 C ATOM 0 H VAL A 354 -13.500 2.061 -0.939 1.00 0.31 H new ATOM 0 HA VAL A 354 -12.264 3.213 1.259 1.00 0.29 H new ATOM 0 HB VAL A 354 -15.139 3.460 0.318 1.00 0.33 H new ATOM 0 HG11 VAL A 354 -15.096 5.678 1.389 1.00 0.35 H new ATOM 0 HG12 VAL A 354 -14.866 4.364 2.567 1.00 0.35 H new ATOM 0 HG13 VAL A 354 -13.472 5.330 2.028 1.00 0.35 H new ATOM 0 HG21 VAL A 354 -14.317 5.434 -0.919 1.00 0.36 H new ATOM 0 HG22 VAL A 354 -12.659 5.064 -0.389 1.00 0.36 H new ATOM 0 HG23 VAL A 354 -13.524 3.935 -1.458 1.00 0.36 H new ATOM 1234 N GLY A 355 -13.031 2.079 3.317 1.00 0.28 N ATOM 1235 CA GLY A 355 -13.431 1.395 4.525 1.00 0.30 C ATOM 1236 C GLY A 355 -12.562 0.186 4.794 1.00 0.30 C ATOM 1237 O GLY A 355 -12.478 -0.290 5.925 1.00 0.44 O ATOM 0 H GLY A 355 -12.130 2.554 3.376 1.00 0.28 H new ATOM 0 HA2 GLY A 355 -13.372 2.082 5.369 1.00 0.30 H new ATOM 0 HA3 GLY A 355 -14.472 1.084 4.440 1.00 0.30 H new ATOM 1241 N GLY A 356 -11.886 -0.284 3.754 1.00 0.26 N ATOM 1242 CA GLY A 356 -11.081 -1.484 3.863 1.00 0.30 C ATOM 1243 C GLY A 356 -9.696 -1.211 4.416 1.00 0.25 C ATOM 1244 O GLY A 356 -9.129 -0.140 4.193 1.00 0.27 O ATOM 0 H GLY A 356 -11.882 0.149 2.830 1.00 0.26 H new ATOM 0 HA2 GLY A 356 -11.590 -2.201 4.507 1.00 0.30 H new ATOM 0 HA3 GLY A 356 -10.991 -1.947 2.880 1.00 0.30 H new ATOM 1248 N GLU A 357 -9.167 -2.188 5.135 1.00 0.27 N ATOM 1249 CA GLU A 357 -7.842 -2.106 5.745 1.00 0.33 C ATOM 1250 C GLU A 357 -7.024 -3.319 5.318 1.00 0.30 C ATOM 1251 O GLU A 357 -7.398 -4.445 5.619 1.00 0.34 O ATOM 1252 CB GLU A 357 -8.006 -2.066 7.271 1.00 0.48 C ATOM 1253 CG GLU A 357 -6.743 -2.338 8.075 1.00 0.99 C ATOM 1254 CD GLU A 357 -5.807 -1.154 8.150 1.00 1.06 C ATOM 1255 OE1 GLU A 357 -4.794 -1.164 7.433 1.00 1.18 O ATOM 1256 OE2 GLU A 357 -6.073 -0.234 8.956 1.00 1.41 O ATOM 0 H GLU A 357 -9.647 -3.070 5.315 1.00 0.27 H new ATOM 0 HA GLU A 357 -7.321 -1.205 5.422 1.00 0.33 H new ATOM 0 HB2 GLU A 357 -8.390 -1.085 7.552 1.00 0.48 H new ATOM 0 HB3 GLU A 357 -8.762 -2.798 7.557 1.00 0.48 H new ATOM 0 HG2 GLU A 357 -7.023 -2.634 9.086 1.00 0.99 H new ATOM 0 HG3 GLU A 357 -6.214 -3.181 7.631 1.00 0.99 H new ATOM 1263 N ARG A 358 -5.919 -3.102 4.616 1.00 0.31 N ATOM 1264 CA ARG A 358 -5.167 -4.213 4.047 1.00 0.30 C ATOM 1265 C ARG A 358 -3.663 -3.957 4.052 1.00 0.28 C ATOM 1266 O ARG A 358 -3.208 -2.822 3.949 1.00 0.31 O ATOM 1267 CB ARG A 358 -5.625 -4.492 2.613 1.00 0.37 C ATOM 1268 CG ARG A 358 -5.384 -3.345 1.647 1.00 0.73 C ATOM 1269 CD ARG A 358 -5.604 -3.783 0.210 1.00 0.75 C ATOM 1270 NE ARG A 358 -6.921 -4.386 0.009 1.00 0.93 N ATOM 1271 CZ ARG A 358 -7.486 -4.546 -1.179 1.00 1.09 C ATOM 1272 NH1 ARG A 358 -6.867 -4.114 -2.274 1.00 1.17 N ATOM 1273 NH2 ARG A 358 -8.665 -5.143 -1.266 1.00 1.37 N ATOM 0 H ARG A 358 -5.527 -2.179 4.428 1.00 0.31 H new ATOM 0 HA ARG A 358 -5.365 -5.080 4.677 1.00 0.30 H new ATOM 0 HB2 ARG A 358 -5.107 -5.377 2.244 1.00 0.37 H new ATOM 0 HB3 ARG A 358 -6.690 -4.726 2.623 1.00 0.37 H new ATOM 0 HG2 ARG A 358 -6.054 -2.519 1.885 1.00 0.73 H new ATOM 0 HG3 ARG A 358 -4.366 -2.974 1.765 1.00 0.73 H new ATOM 0 HD2 ARG A 358 -5.496 -2.922 -0.450 1.00 0.75 H new ATOM 0 HD3 ARG A 358 -4.832 -4.499 -0.071 1.00 0.75 H new ATOM 0 HE ARG A 358 -7.435 -4.702 0.831 1.00 0.93 H new ATOM 0 HH11 ARG A 358 -5.957 -3.659 -2.200 1.00 1.17 H new ATOM 0 HH12 ARG A 358 -7.302 -4.237 -3.188 1.00 1.17 H new ATOM 0 HH21 ARG A 358 -9.132 -5.476 -0.422 1.00 1.37 H new ATOM 0 HH22 ARG A 358 -9.106 -5.270 -2.177 1.00 1.37 H new ATOM 1287 N ARG A 359 -2.898 -5.028 4.189 1.00 0.26 N ATOM 1288 CA ARG A 359 -1.456 -4.964 4.041 1.00 0.27 C ATOM 1289 C ARG A 359 -1.066 -5.194 2.591 1.00 0.31 C ATOM 1290 O ARG A 359 -1.488 -6.172 1.970 1.00 0.40 O ATOM 1291 CB ARG A 359 -0.770 -6.018 4.904 1.00 0.35 C ATOM 1292 CG ARG A 359 -0.676 -5.673 6.376 1.00 0.85 C ATOM 1293 CD ARG A 359 0.020 -6.791 7.129 1.00 0.93 C ATOM 1294 NE ARG A 359 0.222 -6.479 8.540 1.00 1.42 N ATOM 1295 CZ ARG A 359 -0.354 -7.152 9.533 1.00 1.87 C ATOM 1296 NH1 ARG A 359 -1.283 -8.065 9.278 1.00 1.91 N ATOM 1297 NH2 ARG A 359 -0.017 -6.895 10.788 1.00 2.79 N ATOM 0 H ARG A 359 -3.257 -5.958 4.404 1.00 0.26 H new ATOM 0 HA ARG A 359 -1.135 -3.973 4.362 1.00 0.27 H new ATOM 0 HB2 ARG A 359 -1.309 -6.959 4.800 1.00 0.35 H new ATOM 0 HB3 ARG A 359 0.236 -6.183 4.519 1.00 0.35 H new ATOM 0 HG2 ARG A 359 -0.127 -4.740 6.505 1.00 0.85 H new ATOM 0 HG3 ARG A 359 -1.674 -5.514 6.785 1.00 0.85 H new ATOM 0 HD2 ARG A 359 -0.570 -7.703 7.044 1.00 0.93 H new ATOM 0 HD3 ARG A 359 0.985 -6.991 6.664 1.00 0.93 H new ATOM 0 HE ARG A 359 0.839 -5.702 8.778 1.00 1.42 H new ATOM 0 HH11 ARG A 359 -1.560 -8.255 8.315 1.00 1.91 H new ATOM 0 HH12 ARG A 359 -1.720 -8.576 10.045 1.00 1.91 H new ATOM 0 HH21 ARG A 359 0.683 -6.182 10.992 1.00 2.79 H new ATOM 0 HH22 ARG A 359 -0.458 -7.410 11.550 1.00 2.79 H new ATOM 1311 N ILE A 360 -0.274 -4.295 2.053 1.00 0.29 N ATOM 1312 CA ILE A 360 0.264 -4.465 0.718 1.00 0.30 C ATOM 1313 C ILE A 360 1.765 -4.709 0.810 1.00 0.31 C ATOM 1314 O ILE A 360 2.509 -3.871 1.320 1.00 0.34 O ATOM 1315 CB ILE A 360 -0.008 -3.231 -0.173 1.00 0.32 C ATOM 1316 CG1 ILE A 360 -1.512 -2.976 -0.283 1.00 0.34 C ATOM 1317 CG2 ILE A 360 0.600 -3.423 -1.556 1.00 0.35 C ATOM 1318 CD1 ILE A 360 -1.875 -1.792 -1.160 1.00 0.38 C ATOM 0 H ILE A 360 0.014 -3.435 2.519 1.00 0.29 H new ATOM 0 HA ILE A 360 -0.232 -5.320 0.259 1.00 0.30 H new ATOM 0 HB ILE A 360 0.460 -2.362 0.290 1.00 0.32 H new ATOM 0 HG12 ILE A 360 -1.994 -3.870 -0.680 1.00 0.34 H new ATOM 0 HG13 ILE A 360 -1.916 -2.813 0.716 1.00 0.34 H new ATOM 0 HG21 ILE A 360 0.398 -2.544 -2.168 1.00 0.35 H new ATOM 0 HG22 ILE A 360 1.677 -3.561 -1.464 1.00 0.35 H new ATOM 0 HG23 ILE A 360 0.161 -4.302 -2.028 1.00 0.35 H new ATOM 0 HD11 ILE A 360 -2.959 -1.678 -1.187 1.00 0.38 H new ATOM 0 HD12 ILE A 360 -1.424 -0.886 -0.754 1.00 0.38 H new ATOM 0 HD13 ILE A 360 -1.503 -1.960 -2.171 1.00 0.38 H new ATOM 1330 N VAL A 361 2.202 -5.866 0.347 1.00 0.29 N ATOM 1331 CA VAL A 361 3.612 -6.214 0.356 1.00 0.30 C ATOM 1332 C VAL A 361 4.209 -5.913 -1.007 1.00 0.29 C ATOM 1333 O VAL A 361 3.795 -6.492 -2.014 1.00 0.33 O ATOM 1334 CB VAL A 361 3.828 -7.704 0.696 1.00 0.35 C ATOM 1335 CG1 VAL A 361 5.311 -8.041 0.758 1.00 0.39 C ATOM 1336 CG2 VAL A 361 3.142 -8.060 2.007 1.00 0.38 C ATOM 0 H VAL A 361 1.595 -6.587 -0.043 1.00 0.29 H new ATOM 0 HA VAL A 361 4.105 -5.620 1.126 1.00 0.30 H new ATOM 0 HB VAL A 361 3.380 -8.299 -0.100 1.00 0.35 H new ATOM 0 HG11 VAL A 361 5.434 -9.097 0.999 1.00 0.39 H new ATOM 0 HG12 VAL A 361 5.772 -7.833 -0.208 1.00 0.39 H new ATOM 0 HG13 VAL A 361 5.790 -7.435 1.527 1.00 0.39 H new ATOM 0 HG21 VAL A 361 3.306 -9.114 2.229 1.00 0.38 H new ATOM 0 HG22 VAL A 361 3.556 -7.451 2.811 1.00 0.38 H new ATOM 0 HG23 VAL A 361 2.072 -7.869 1.921 1.00 0.38 H new ATOM 1346 N ILE A 362 5.165 -5.001 -1.040 1.00 0.25 N ATOM 1347 CA ILE A 362 5.728 -4.537 -2.294 1.00 0.25 C ATOM 1348 C ILE A 362 7.195 -4.926 -2.405 1.00 0.26 C ATOM 1349 O ILE A 362 8.056 -4.336 -1.745 1.00 0.29 O ATOM 1350 CB ILE A 362 5.589 -3.005 -2.437 1.00 0.25 C ATOM 1351 CG1 ILE A 362 4.125 -2.588 -2.292 1.00 0.25 C ATOM 1352 CG2 ILE A 362 6.140 -2.542 -3.779 1.00 0.28 C ATOM 1353 CD1 ILE A 362 3.909 -1.093 -2.298 1.00 0.27 C ATOM 0 H ILE A 362 5.568 -4.567 -0.210 1.00 0.25 H new ATOM 0 HA ILE A 362 5.169 -5.016 -3.098 1.00 0.25 H new ATOM 0 HB ILE A 362 6.167 -2.531 -1.644 1.00 0.25 H new ATOM 0 HG12 ILE A 362 3.549 -3.031 -3.105 1.00 0.25 H new ATOM 0 HG13 ILE A 362 3.731 -2.998 -1.362 1.00 0.25 H new ATOM 0 HG21 ILE A 362 6.034 -1.460 -3.862 1.00 0.28 H new ATOM 0 HG22 ILE A 362 7.194 -2.810 -3.851 1.00 0.28 H new ATOM 0 HG23 ILE A 362 5.587 -3.024 -4.585 1.00 0.28 H new ATOM 0 HD11 ILE A 362 2.846 -0.879 -2.191 1.00 0.27 H new ATOM 0 HD12 ILE A 362 4.455 -0.643 -1.469 1.00 0.27 H new ATOM 0 HD13 ILE A 362 4.270 -0.677 -3.239 1.00 0.27 H new ATOM 1365 N PRO A 363 7.495 -5.954 -3.214 1.00 0.28 N ATOM 1366 CA PRO A 363 8.872 -6.359 -3.498 1.00 0.29 C ATOM 1367 C PRO A 363 9.672 -5.241 -4.155 1.00 0.26 C ATOM 1368 O PRO A 363 9.109 -4.314 -4.742 1.00 0.27 O ATOM 1369 CB PRO A 363 8.718 -7.541 -4.462 1.00 0.36 C ATOM 1370 CG PRO A 363 7.331 -8.033 -4.239 1.00 0.66 C ATOM 1371 CD PRO A 363 6.517 -6.823 -3.885 1.00 0.36 C ATOM 0 HA PRO A 363 9.415 -6.611 -2.587 1.00 0.29 H new ATOM 0 HB2 PRO A 363 8.866 -7.230 -5.496 1.00 0.36 H new ATOM 0 HB3 PRO A 363 9.452 -8.319 -4.255 1.00 0.36 H new ATOM 0 HG2 PRO A 363 6.940 -8.519 -5.133 1.00 0.66 H new ATOM 0 HG3 PRO A 363 7.303 -8.771 -3.437 1.00 0.66 H new ATOM 0 HD2 PRO A 363 6.094 -6.347 -4.770 1.00 0.36 H new ATOM 0 HD3 PRO A 363 5.683 -7.075 -3.229 1.00 0.36 H new ATOM 1379 N ALA A 364 10.991 -5.365 -4.069 1.00 0.29 N ATOM 1380 CA ALA A 364 11.923 -4.352 -4.566 1.00 0.34 C ATOM 1381 C ALA A 364 11.606 -3.845 -5.984 1.00 0.34 C ATOM 1382 O ALA A 364 11.534 -2.633 -6.185 1.00 0.36 O ATOM 1383 CB ALA A 364 13.344 -4.887 -4.508 1.00 0.42 C ATOM 0 H ALA A 364 11.450 -6.174 -3.651 1.00 0.29 H new ATOM 0 HA ALA A 364 11.811 -3.489 -3.910 1.00 0.34 H new ATOM 0 HB1 ALA A 364 14.034 -4.129 -4.879 1.00 0.42 H new ATOM 0 HB2 ALA A 364 13.598 -5.135 -3.477 1.00 0.42 H new ATOM 0 HB3 ALA A 364 13.421 -5.782 -5.126 1.00 0.42 H new ATOM 1389 N PRO A 365 11.411 -4.738 -6.989 1.00 0.35 N ATOM 1390 CA PRO A 365 11.277 -4.321 -8.398 1.00 0.40 C ATOM 1391 C PRO A 365 10.153 -3.315 -8.649 1.00 0.36 C ATOM 1392 O PRO A 365 10.215 -2.538 -9.601 1.00 0.41 O ATOM 1393 CB PRO A 365 10.991 -5.628 -9.151 1.00 0.47 C ATOM 1394 CG PRO A 365 10.573 -6.600 -8.106 1.00 0.70 C ATOM 1395 CD PRO A 365 11.309 -6.204 -6.861 1.00 0.38 C ATOM 0 HA PRO A 365 12.179 -3.804 -8.724 1.00 0.40 H new ATOM 0 HB2 PRO A 365 10.207 -5.489 -9.895 1.00 0.47 H new ATOM 0 HB3 PRO A 365 11.876 -5.978 -9.682 1.00 0.47 H new ATOM 0 HG2 PRO A 365 9.495 -6.567 -7.950 1.00 0.70 H new ATOM 0 HG3 PRO A 365 10.821 -7.620 -8.399 1.00 0.70 H new ATOM 0 HD2 PRO A 365 10.766 -6.494 -5.961 1.00 0.38 H new ATOM 0 HD3 PRO A 365 12.291 -6.674 -6.806 1.00 0.38 H new ATOM 1403 N TYR A 366 9.134 -3.319 -7.799 1.00 0.31 N ATOM 1404 CA TYR A 366 7.989 -2.438 -7.997 1.00 0.29 C ATOM 1405 C TYR A 366 8.039 -1.249 -7.051 1.00 0.30 C ATOM 1406 O TYR A 366 7.062 -0.503 -6.912 1.00 0.30 O ATOM 1407 CB TYR A 366 6.681 -3.220 -7.848 1.00 0.30 C ATOM 1408 CG TYR A 366 6.349 -4.045 -9.073 1.00 0.36 C ATOM 1409 CD1 TYR A 366 5.088 -3.999 -9.659 1.00 0.43 C ATOM 1410 CD2 TYR A 366 7.310 -4.854 -9.661 1.00 0.53 C ATOM 1411 CE1 TYR A 366 4.801 -4.740 -10.793 1.00 0.50 C ATOM 1412 CE2 TYR A 366 7.031 -5.594 -10.789 1.00 0.64 C ATOM 1413 CZ TYR A 366 5.779 -5.535 -11.352 1.00 0.59 C ATOM 1414 OH TYR A 366 5.507 -6.271 -12.479 1.00 0.69 O ATOM 0 H TYR A 366 9.076 -3.916 -6.974 1.00 0.31 H new ATOM 0 HA TYR A 366 8.032 -2.043 -9.012 1.00 0.29 H new ATOM 0 HB2 TYR A 366 6.752 -3.877 -6.981 1.00 0.30 H new ATOM 0 HB3 TYR A 366 5.866 -2.523 -7.653 1.00 0.30 H new ATOM 0 HD1 TYR A 366 4.321 -3.376 -9.223 1.00 0.43 H new ATOM 0 HD2 TYR A 366 8.297 -4.905 -9.226 1.00 0.53 H new ATOM 0 HE1 TYR A 366 3.817 -4.695 -11.237 1.00 0.50 H new ATOM 0 HE2 TYR A 366 7.794 -6.219 -11.229 1.00 0.64 H new ATOM 0 HH TYR A 366 4.670 -5.957 -12.881 1.00 0.69 H new ATOM 1424 N ALA A 367 9.186 -1.072 -6.412 1.00 0.33 N ATOM 1425 CA ALA A 367 9.430 0.093 -5.586 1.00 0.40 C ATOM 1426 C ALA A 367 10.738 0.770 -6.002 1.00 0.50 C ATOM 1427 O ALA A 367 10.862 1.246 -7.131 1.00 0.86 O ATOM 1428 CB ALA A 367 9.447 -0.290 -4.111 1.00 0.40 C ATOM 0 H ALA A 367 9.966 -1.728 -6.453 1.00 0.33 H new ATOM 0 HA ALA A 367 8.619 0.806 -5.732 1.00 0.40 H new ATOM 0 HB1 ALA A 367 9.632 0.598 -3.507 1.00 0.40 H new ATOM 0 HB2 ALA A 367 8.485 -0.722 -3.836 1.00 0.40 H new ATOM 0 HB3 ALA A 367 10.237 -1.020 -3.934 1.00 0.40 H new ATOM 1434 N TYR A 368 11.718 0.803 -5.104 1.00 0.44 N ATOM 1435 CA TYR A 368 12.987 1.468 -5.389 1.00 0.52 C ATOM 1436 C TYR A 368 13.959 0.542 -6.121 1.00 0.51 C ATOM 1437 O TYR A 368 14.957 0.995 -6.681 1.00 0.58 O ATOM 1438 CB TYR A 368 13.613 1.992 -4.095 1.00 0.57 C ATOM 1439 CG TYR A 368 12.773 3.049 -3.414 1.00 0.63 C ATOM 1440 CD1 TYR A 368 12.698 4.337 -3.925 1.00 0.74 C ATOM 1441 CD2 TYR A 368 12.056 2.758 -2.258 1.00 0.69 C ATOM 1442 CE1 TYR A 368 11.933 5.307 -3.306 1.00 0.85 C ATOM 1443 CE2 TYR A 368 11.288 3.722 -1.634 1.00 0.80 C ATOM 1444 CZ TYR A 368 11.228 4.993 -2.158 1.00 0.86 C ATOM 1445 OH TYR A 368 10.462 5.961 -1.547 1.00 1.00 O ATOM 0 H TYR A 368 11.660 0.380 -4.178 1.00 0.44 H new ATOM 0 HA TYR A 368 12.780 2.311 -6.049 1.00 0.52 H new ATOM 0 HB2 TYR A 368 13.764 1.159 -3.409 1.00 0.57 H new ATOM 0 HB3 TYR A 368 14.597 2.405 -4.316 1.00 0.57 H new ATOM 0 HD1 TYR A 368 13.247 4.585 -4.821 1.00 0.74 H new ATOM 0 HD2 TYR A 368 12.100 1.762 -1.842 1.00 0.69 H new ATOM 0 HE1 TYR A 368 11.886 6.305 -3.716 1.00 0.85 H new ATOM 0 HE2 TYR A 368 10.736 3.479 -0.738 1.00 0.80 H new ATOM 0 HH TYR A 368 10.029 5.583 -0.754 1.00 1.00 H new ATOM 1455 N GLY A 369 13.652 -0.748 -6.119 1.00 0.51 N ATOM 1456 CA GLY A 369 14.436 -1.713 -6.869 1.00 0.56 C ATOM 1457 C GLY A 369 15.873 -1.824 -6.398 1.00 0.52 C ATOM 1458 O GLY A 369 16.145 -2.342 -5.315 1.00 0.54 O ATOM 0 H GLY A 369 12.866 -1.148 -5.606 1.00 0.51 H new ATOM 0 HA2 GLY A 369 13.961 -2.691 -6.794 1.00 0.56 H new ATOM 0 HA3 GLY A 369 14.428 -1.435 -7.923 1.00 0.56 H new ATOM 1462 N LYS A 370 16.791 -1.331 -7.216 1.00 0.55 N ATOM 1463 CA LYS A 370 18.216 -1.446 -6.942 1.00 0.59 C ATOM 1464 C LYS A 370 18.796 -0.140 -6.417 1.00 0.65 C ATOM 1465 O LYS A 370 20.013 -0.007 -6.272 1.00 0.74 O ATOM 1466 CB LYS A 370 18.962 -1.868 -8.208 1.00 0.61 C ATOM 1467 CG LYS A 370 18.751 -3.322 -8.587 1.00 1.27 C ATOM 1468 CD LYS A 370 19.356 -3.633 -9.944 1.00 1.26 C ATOM 1469 CE LYS A 370 19.356 -5.126 -10.221 1.00 2.26 C ATOM 1470 NZ LYS A 370 20.342 -5.841 -9.366 1.00 2.76 N ATOM 0 H LYS A 370 16.571 -0.842 -8.084 1.00 0.55 H new ATOM 0 HA LYS A 370 18.342 -2.205 -6.170 1.00 0.59 H new ATOM 0 HB2 LYS A 370 18.640 -1.236 -9.036 1.00 0.61 H new ATOM 0 HB3 LYS A 370 20.028 -1.690 -8.067 1.00 0.61 H new ATOM 0 HG2 LYS A 370 19.200 -3.966 -7.831 1.00 1.27 H new ATOM 0 HG3 LYS A 370 17.684 -3.545 -8.603 1.00 1.27 H new ATOM 0 HD2 LYS A 370 18.793 -3.117 -10.722 1.00 1.26 H new ATOM 0 HD3 LYS A 370 20.377 -3.254 -9.984 1.00 1.26 H new ATOM 0 HE2 LYS A 370 18.359 -5.530 -10.044 1.00 2.26 H new ATOM 0 HE3 LYS A 370 19.589 -5.302 -11.271 1.00 2.26 H new ATOM 0 HZ1 LYS A 370 20.489 -6.802 -9.735 1.00 2.76 H new ATOM 0 HZ2 LYS A 370 21.245 -5.325 -9.372 1.00 2.76 H new ATOM 0 HZ3 LYS A 370 19.981 -5.896 -8.392 1.00 2.76 H new ATOM 1484 N GLN A 371 17.942 0.826 -6.131 1.00 0.63 N ATOM 1485 CA GLN A 371 18.407 2.101 -5.619 1.00 0.70 C ATOM 1486 C GLN A 371 18.492 2.063 -4.097 1.00 0.73 C ATOM 1487 O GLN A 371 17.484 2.185 -3.404 1.00 0.74 O ATOM 1488 CB GLN A 371 17.483 3.233 -6.079 1.00 0.76 C ATOM 1489 CG GLN A 371 18.041 4.629 -5.820 1.00 1.22 C ATOM 1490 CD GLN A 371 19.157 5.027 -6.780 1.00 1.85 C ATOM 1491 OE1 GLN A 371 19.903 4.055 -7.290 1.00 2.65 O flip ATOM 1492 NE2 GLN A 371 19.341 6.209 -7.072 1.00 2.26 N flip ATOM 0 H GLN A 371 16.931 0.753 -6.244 1.00 0.63 H new ATOM 0 HA GLN A 371 19.405 2.291 -6.015 1.00 0.70 H new ATOM 0 HB2 GLN A 371 17.291 3.121 -7.146 1.00 0.76 H new ATOM 0 HB3 GLN A 371 16.524 3.135 -5.570 1.00 0.76 H new ATOM 0 HG2 GLN A 371 17.231 5.355 -5.896 1.00 1.22 H new ATOM 0 HG3 GLN A 371 18.417 4.677 -4.798 1.00 1.22 H new ATOM 0 HE21 GLN A 371 18.751 6.933 -6.663 1.00 2.26 H new ATOM 0 HE22 GLN A 371 20.084 6.464 -7.723 1.00 2.26 H new ATOM 1501 N ALA A 372 19.701 1.859 -3.588 1.00 0.77 N ATOM 1502 CA ALA A 372 19.934 1.828 -2.157 1.00 0.79 C ATOM 1503 C ALA A 372 19.879 3.231 -1.564 1.00 0.86 C ATOM 1504 O ALA A 372 20.747 4.063 -1.826 1.00 1.01 O ATOM 1505 CB ALA A 372 21.271 1.173 -1.860 1.00 0.86 C ATOM 0 H ALA A 372 20.538 1.712 -4.153 1.00 0.77 H new ATOM 0 HA ALA A 372 19.144 1.238 -1.692 1.00 0.79 H new ATOM 0 HB1 ALA A 372 21.436 1.155 -0.783 1.00 0.86 H new ATOM 0 HB2 ALA A 372 21.270 0.153 -2.244 1.00 0.86 H new ATOM 0 HB3 ALA A 372 22.069 1.740 -2.340 1.00 0.86 H new ATOM 1511 N LEU A 373 18.844 3.482 -0.782 1.00 0.77 N ATOM 1512 CA LEU A 373 18.683 4.745 -0.083 1.00 0.82 C ATOM 1513 C LEU A 373 19.092 4.564 1.372 1.00 0.84 C ATOM 1514 O LEU A 373 19.150 3.431 1.861 1.00 0.80 O ATOM 1515 CB LEU A 373 17.222 5.202 -0.147 1.00 0.79 C ATOM 1516 CG LEU A 373 16.635 5.333 -1.552 1.00 0.81 C ATOM 1517 CD1 LEU A 373 15.158 5.687 -1.474 1.00 0.80 C ATOM 1518 CD2 LEU A 373 17.397 6.379 -2.355 1.00 0.93 C ATOM 0 H LEU A 373 18.091 2.815 -0.613 1.00 0.77 H new ATOM 0 HA LEU A 373 19.311 5.500 -0.556 1.00 0.82 H new ATOM 0 HB2 LEU A 373 16.613 4.496 0.418 1.00 0.79 H new ATOM 0 HB3 LEU A 373 17.139 6.166 0.354 1.00 0.79 H new ATOM 0 HG LEU A 373 16.735 4.375 -2.062 1.00 0.81 H new ATOM 0 HD11 LEU A 373 14.752 5.777 -2.481 1.00 0.80 H new ATOM 0 HD12 LEU A 373 14.624 4.903 -0.936 1.00 0.80 H new ATOM 0 HD13 LEU A 373 15.038 6.634 -0.948 1.00 0.80 H new ATOM 0 HD21 LEU A 373 16.965 6.458 -3.352 1.00 0.93 H new ATOM 0 HD22 LEU A 373 17.329 7.344 -1.853 1.00 0.93 H new ATOM 0 HD23 LEU A 373 18.443 6.085 -2.436 1.00 0.93 H new ATOM 1530 N PRO A 374 19.390 5.654 2.092 1.00 0.94 N ATOM 1531 CA PRO A 374 19.681 5.570 3.520 1.00 0.98 C ATOM 1532 C PRO A 374 18.487 5.005 4.289 1.00 0.92 C ATOM 1533 O PRO A 374 17.418 5.615 4.334 1.00 0.92 O ATOM 1534 CB PRO A 374 19.959 7.020 3.930 1.00 1.10 C ATOM 1535 CG PRO A 374 20.280 7.729 2.656 1.00 1.31 C ATOM 1536 CD PRO A 374 19.492 7.031 1.584 1.00 1.05 C ATOM 0 HA PRO A 374 20.518 4.906 3.737 1.00 0.98 H new ATOM 0 HB2 PRO A 374 19.093 7.464 4.421 1.00 1.10 H new ATOM 0 HB3 PRO A 374 20.789 7.079 4.634 1.00 1.10 H new ATOM 0 HG2 PRO A 374 20.008 8.783 2.717 1.00 1.31 H new ATOM 0 HG3 PRO A 374 21.349 7.687 2.445 1.00 1.31 H new ATOM 0 HD2 PRO A 374 18.510 7.484 1.445 1.00 1.05 H new ATOM 0 HD3 PRO A 374 20.000 7.069 0.620 1.00 1.05 H new ATOM 1544 N GLY A 375 18.672 3.829 4.868 1.00 0.90 N ATOM 1545 CA GLY A 375 17.598 3.185 5.597 1.00 0.90 C ATOM 1546 C GLY A 375 16.787 2.246 4.720 1.00 0.82 C ATOM 1547 O GLY A 375 16.101 1.357 5.225 1.00 0.86 O ATOM 0 H GLY A 375 19.548 3.307 4.846 1.00 0.90 H new ATOM 0 HA2 GLY A 375 18.015 2.626 6.435 1.00 0.90 H new ATOM 0 HA3 GLY A 375 16.940 3.946 6.017 1.00 0.90 H new ATOM 1551 N ILE A 376 16.873 2.437 3.403 1.00 0.74 N ATOM 1552 CA ILE A 376 16.128 1.618 2.444 1.00 0.68 C ATOM 1553 C ILE A 376 17.047 1.143 1.317 1.00 0.65 C ATOM 1554 O ILE A 376 17.054 1.713 0.226 1.00 0.67 O ATOM 1555 CB ILE A 376 14.935 2.388 1.816 1.00 0.66 C ATOM 1556 CG1 ILE A 376 14.122 3.102 2.897 1.00 0.72 C ATOM 1557 CG2 ILE A 376 14.037 1.430 1.043 1.00 0.64 C ATOM 1558 CD1 ILE A 376 13.009 3.967 2.345 1.00 0.74 C ATOM 0 H ILE A 376 17.455 3.156 2.973 1.00 0.74 H new ATOM 0 HA ILE A 376 15.738 0.766 3.001 1.00 0.68 H new ATOM 0 HB ILE A 376 15.335 3.135 1.130 1.00 0.66 H new ATOM 0 HG12 ILE A 376 13.694 2.358 3.569 1.00 0.72 H new ATOM 0 HG13 ILE A 376 14.791 3.722 3.493 1.00 0.72 H new ATOM 0 HG21 ILE A 376 13.204 1.983 0.608 1.00 0.64 H new ATOM 0 HG22 ILE A 376 14.611 0.954 0.248 1.00 0.64 H new ATOM 0 HG23 ILE A 376 13.652 0.667 1.719 1.00 0.64 H new ATOM 0 HD11 ILE A 376 12.475 4.442 3.168 1.00 0.74 H new ATOM 0 HD12 ILE A 376 13.432 4.734 1.696 1.00 0.74 H new ATOM 0 HD13 ILE A 376 12.317 3.349 1.773 1.00 0.74 H new ATOM 1570 N PRO A 377 17.862 0.112 1.573 1.00 0.64 N ATOM 1571 CA PRO A 377 18.813 -0.408 0.591 1.00 0.67 C ATOM 1572 C PRO A 377 18.138 -1.141 -0.562 1.00 0.63 C ATOM 1573 O PRO A 377 16.946 -1.440 -0.511 1.00 0.58 O ATOM 1574 CB PRO A 377 19.697 -1.373 1.391 1.00 0.71 C ATOM 1575 CG PRO A 377 19.355 -1.133 2.827 1.00 0.71 C ATOM 1576 CD PRO A 377 17.940 -0.629 2.836 1.00 0.63 C ATOM 0 HA PRO A 377 19.369 0.404 0.122 1.00 0.67 H new ATOM 0 HB2 PRO A 377 19.503 -2.408 1.109 1.00 0.71 H new ATOM 0 HB3 PRO A 377 20.754 -1.184 1.203 1.00 0.71 H new ATOM 0 HG2 PRO A 377 19.446 -2.050 3.409 1.00 0.71 H new ATOM 0 HG3 PRO A 377 20.032 -0.404 3.273 1.00 0.71 H new ATOM 0 HD2 PRO A 377 17.218 -1.445 2.874 1.00 0.63 H new ATOM 0 HD3 PRO A 377 17.742 0.011 3.696 1.00 0.63 H new ATOM 1584 N ALA A 378 18.910 -1.398 -1.614 1.00 0.68 N ATOM 1585 CA ALA A 378 18.423 -2.128 -2.777 1.00 0.68 C ATOM 1586 C ALA A 378 17.868 -3.485 -2.371 1.00 0.65 C ATOM 1587 O ALA A 378 18.298 -4.060 -1.369 1.00 0.65 O ATOM 1588 CB ALA A 378 19.542 -2.304 -3.792 1.00 0.74 C ATOM 0 H ALA A 378 19.885 -1.107 -1.683 1.00 0.68 H new ATOM 0 HA ALA A 378 17.618 -1.550 -3.231 1.00 0.68 H new ATOM 0 HB1 ALA A 378 19.166 -2.851 -4.657 1.00 0.74 H new ATOM 0 HB2 ALA A 378 19.902 -1.326 -4.110 1.00 0.74 H new ATOM 0 HB3 ALA A 378 20.361 -2.862 -3.338 1.00 0.74 H new ATOM 1594 N ASN A 379 16.913 -3.984 -3.151 1.00 0.68 N ATOM 1595 CA ASN A 379 16.261 -5.262 -2.868 1.00 0.69 C ATOM 1596 C ASN A 379 15.474 -5.177 -1.568 1.00 0.62 C ATOM 1597 O ASN A 379 15.325 -6.162 -0.849 1.00 0.67 O ATOM 1598 CB ASN A 379 17.282 -6.411 -2.807 1.00 0.80 C ATOM 1599 CG ASN A 379 17.848 -6.788 -4.169 1.00 0.93 C ATOM 1600 OD1 ASN A 379 17.007 -6.807 -5.196 1.00 1.49 O flip ATOM 1601 ND2 ASN A 379 19.033 -7.090 -4.296 1.00 1.37 N flip ATOM 0 H ASN A 379 16.570 -3.519 -3.992 1.00 0.68 H new ATOM 0 HA ASN A 379 15.571 -5.475 -3.684 1.00 0.69 H new ATOM 0 HB2 ASN A 379 18.101 -6.125 -2.148 1.00 0.80 H new ATOM 0 HB3 ASN A 379 16.807 -7.286 -2.364 1.00 0.80 H new ATOM 0 HD21 ASN A 379 19.655 -7.066 -3.488 1.00 1.37 H new ATOM 0 HD22 ASN A 379 19.394 -7.365 -5.209 1.00 1.37 H new ATOM 1608 N SER A 380 14.949 -3.990 -1.291 1.00 0.63 N ATOM 1609 CA SER A 380 14.138 -3.763 -0.112 1.00 0.64 C ATOM 1610 C SER A 380 12.725 -4.305 -0.303 1.00 0.49 C ATOM 1611 O SER A 380 11.986 -3.864 -1.186 1.00 0.60 O ATOM 1612 CB SER A 380 14.101 -2.270 0.209 1.00 0.84 C ATOM 1613 OG SER A 380 14.229 -1.498 -0.975 1.00 1.84 O ATOM 0 H SER A 380 15.075 -3.165 -1.877 1.00 0.63 H new ATOM 0 HA SER A 380 14.587 -4.298 0.725 1.00 0.64 H new ATOM 0 HB2 SER A 380 13.165 -2.024 0.710 1.00 0.84 H new ATOM 0 HB3 SER A 380 14.907 -2.022 0.900 1.00 0.84 H new ATOM 0 HG SER A 380 15.171 -1.266 -1.114 1.00 1.84 H new ATOM 1619 N GLU A 381 12.371 -5.281 0.516 1.00 0.39 N ATOM 1620 CA GLU A 381 11.039 -5.859 0.491 1.00 0.30 C ATOM 1621 C GLU A 381 10.155 -5.116 1.490 1.00 0.27 C ATOM 1622 O GLU A 381 10.238 -5.337 2.703 1.00 0.32 O ATOM 1623 CB GLU A 381 11.137 -7.350 0.818 1.00 0.39 C ATOM 1624 CG GLU A 381 9.937 -8.177 0.384 1.00 0.52 C ATOM 1625 CD GLU A 381 10.263 -9.656 0.343 1.00 0.82 C ATOM 1626 OE1 GLU A 381 10.632 -10.159 -0.736 1.00 0.98 O ATOM 1627 OE2 GLU A 381 10.191 -10.318 1.397 1.00 1.03 O ATOM 0 H GLU A 381 12.994 -5.692 1.212 1.00 0.39 H new ATOM 0 HA GLU A 381 10.590 -5.758 -0.497 1.00 0.30 H new ATOM 0 HB2 GLU A 381 12.031 -7.754 0.342 1.00 0.39 H new ATOM 0 HB3 GLU A 381 11.269 -7.464 1.894 1.00 0.39 H new ATOM 0 HG2 GLU A 381 9.109 -8.006 1.071 1.00 0.52 H new ATOM 0 HG3 GLU A 381 9.606 -7.849 -0.602 1.00 0.52 H new ATOM 1634 N LEU A 382 9.338 -4.207 0.973 1.00 0.24 N ATOM 1635 CA LEU A 382 8.576 -3.284 1.807 1.00 0.23 C ATOM 1636 C LEU A 382 7.171 -3.801 2.102 1.00 0.20 C ATOM 1637 O LEU A 382 6.579 -4.521 1.299 1.00 0.22 O ATOM 1638 CB LEU A 382 8.474 -1.919 1.124 1.00 0.27 C ATOM 1639 CG LEU A 382 9.810 -1.259 0.768 1.00 0.32 C ATOM 1640 CD1 LEU A 382 9.575 0.042 0.019 1.00 0.37 C ATOM 1641 CD2 LEU A 382 10.632 -1.010 2.022 1.00 0.37 C ATOM 0 H LEU A 382 9.185 -4.088 -0.028 1.00 0.24 H new ATOM 0 HA LEU A 382 9.110 -3.193 2.753 1.00 0.23 H new ATOM 0 HB2 LEU A 382 7.889 -2.032 0.211 1.00 0.27 H new ATOM 0 HB3 LEU A 382 7.919 -1.246 1.777 1.00 0.27 H new ATOM 0 HG LEU A 382 10.368 -1.935 0.120 1.00 0.32 H new ATOM 0 HD11 LEU A 382 10.534 0.499 -0.227 1.00 0.37 H new ATOM 0 HD12 LEU A 382 9.024 -0.161 -0.899 1.00 0.37 H new ATOM 0 HD13 LEU A 382 8.999 0.723 0.645 1.00 0.37 H new ATOM 0 HD21 LEU A 382 11.578 -0.541 1.750 1.00 0.37 H new ATOM 0 HD22 LEU A 382 10.081 -0.352 2.694 1.00 0.37 H new ATOM 0 HD23 LEU A 382 10.828 -1.958 2.523 1.00 0.37 H new ATOM 1653 N THR A 383 6.643 -3.435 3.262 1.00 0.20 N ATOM 1654 CA THR A 383 5.285 -3.792 3.631 1.00 0.20 C ATOM 1655 C THR A 383 4.522 -2.543 4.058 1.00 0.19 C ATOM 1656 O THR A 383 4.995 -1.770 4.892 1.00 0.18 O ATOM 1657 CB THR A 383 5.280 -4.822 4.776 1.00 0.23 C ATOM 1658 OG1 THR A 383 6.113 -5.935 4.425 1.00 0.26 O ATOM 1659 CG2 THR A 383 3.867 -5.312 5.069 1.00 0.27 C ATOM 0 H THR A 383 7.140 -2.888 3.965 1.00 0.20 H new ATOM 0 HA THR A 383 4.798 -4.239 2.764 1.00 0.20 H new ATOM 0 HB THR A 383 5.667 -4.338 5.673 1.00 0.23 H new ATOM 0 HG1 THR A 383 6.110 -6.589 5.155 1.00 0.26 H new ATOM 0 HG21 THR A 383 3.895 -6.038 5.882 1.00 0.27 H new ATOM 0 HG22 THR A 383 3.242 -4.467 5.358 1.00 0.27 H new ATOM 0 HG23 THR A 383 3.452 -5.782 4.177 1.00 0.27 H new ATOM 1667 N PHE A 384 3.355 -2.334 3.473 1.00 0.21 N ATOM 1668 CA PHE A 384 2.562 -1.153 3.768 1.00 0.20 C ATOM 1669 C PHE A 384 1.203 -1.530 4.341 1.00 0.21 C ATOM 1670 O PHE A 384 0.375 -2.127 3.653 1.00 0.24 O ATOM 1671 CB PHE A 384 2.369 -0.295 2.512 1.00 0.21 C ATOM 1672 CG PHE A 384 3.585 0.497 2.110 1.00 0.21 C ATOM 1673 CD1 PHE A 384 3.814 1.761 2.629 1.00 0.27 C ATOM 1674 CD2 PHE A 384 4.502 -0.029 1.211 1.00 0.22 C ATOM 1675 CE1 PHE A 384 4.935 2.486 2.260 1.00 0.32 C ATOM 1676 CE2 PHE A 384 5.621 0.689 0.839 1.00 0.27 C ATOM 1677 CZ PHE A 384 5.824 1.973 1.369 1.00 0.31 C ATOM 0 H PHE A 384 2.936 -2.966 2.791 1.00 0.21 H new ATOM 0 HA PHE A 384 3.108 -0.575 4.514 1.00 0.20 H new ATOM 0 HB2 PHE A 384 2.082 -0.943 1.684 1.00 0.21 H new ATOM 0 HB3 PHE A 384 1.541 0.393 2.680 1.00 0.21 H new ATOM 0 HD1 PHE A 384 3.110 2.186 3.329 1.00 0.27 H new ATOM 0 HD2 PHE A 384 4.338 -1.013 0.797 1.00 0.22 H new ATOM 0 HE1 PHE A 384 5.104 3.465 2.683 1.00 0.32 H new ATOM 0 HE2 PHE A 384 6.334 0.267 0.146 1.00 0.27 H new ATOM 0 HZ PHE A 384 6.685 2.552 1.069 1.00 0.31 H new ATOM 1687 N ASP A 385 0.992 -1.193 5.605 1.00 0.21 N ATOM 1688 CA ASP A 385 -0.314 -1.340 6.234 1.00 0.27 C ATOM 1689 C ASP A 385 -1.183 -0.165 5.807 1.00 0.23 C ATOM 1690 O ASP A 385 -0.975 0.953 6.273 1.00 0.27 O ATOM 1691 CB ASP A 385 -0.197 -1.353 7.767 1.00 0.42 C ATOM 1692 CG ASP A 385 0.618 -2.512 8.304 1.00 0.95 C ATOM 1693 OD1 ASP A 385 1.811 -2.609 7.976 1.00 1.80 O ATOM 1694 OD2 ASP A 385 0.080 -3.306 9.102 1.00 1.30 O ATOM 0 H ASP A 385 1.713 -0.814 6.219 1.00 0.21 H new ATOM 0 HA ASP A 385 -0.754 -2.287 5.922 1.00 0.27 H new ATOM 0 HB2 ASP A 385 0.256 -0.418 8.096 1.00 0.42 H new ATOM 0 HB3 ASP A 385 -1.197 -1.392 8.199 1.00 0.42 H new ATOM 1699 N VAL A 386 -2.128 -0.404 4.912 1.00 0.21 N ATOM 1700 CA VAL A 386 -2.886 0.686 4.317 1.00 0.23 C ATOM 1701 C VAL A 386 -4.397 0.495 4.463 1.00 0.22 C ATOM 1702 O VAL A 386 -4.941 -0.571 4.167 1.00 0.31 O ATOM 1703 CB VAL A 386 -2.527 0.864 2.818 1.00 0.26 C ATOM 1704 CG1 VAL A 386 -1.050 1.191 2.645 1.00 0.28 C ATOM 1705 CG2 VAL A 386 -2.881 -0.376 2.010 1.00 0.29 C ATOM 0 H VAL A 386 -2.387 -1.334 4.583 1.00 0.21 H new ATOM 0 HA VAL A 386 -2.607 1.586 4.864 1.00 0.23 H new ATOM 0 HB VAL A 386 -3.118 1.699 2.442 1.00 0.26 H new ATOM 0 HG11 VAL A 386 -0.826 1.311 1.585 1.00 0.28 H new ATOM 0 HG12 VAL A 386 -0.818 2.117 3.172 1.00 0.28 H new ATOM 0 HG13 VAL A 386 -0.447 0.380 3.054 1.00 0.28 H new ATOM 0 HG21 VAL A 386 -2.616 -0.217 0.965 1.00 0.29 H new ATOM 0 HG22 VAL A 386 -2.330 -1.233 2.398 1.00 0.29 H new ATOM 0 HG23 VAL A 386 -3.951 -0.568 2.088 1.00 0.29 H new ATOM 1715 N LYS A 387 -5.071 1.539 4.918 1.00 0.19 N ATOM 1716 CA LYS A 387 -6.522 1.529 5.026 1.00 0.22 C ATOM 1717 C LYS A 387 -7.101 2.733 4.303 1.00 0.21 C ATOM 1718 O LYS A 387 -6.645 3.860 4.494 1.00 0.22 O ATOM 1719 CB LYS A 387 -6.968 1.533 6.493 1.00 0.32 C ATOM 1720 CG LYS A 387 -8.480 1.521 6.682 1.00 1.08 C ATOM 1721 CD LYS A 387 -8.865 1.686 8.143 1.00 1.06 C ATOM 1722 CE LYS A 387 -10.310 1.278 8.402 1.00 1.62 C ATOM 1723 NZ LYS A 387 -11.271 1.985 7.513 1.00 2.53 N ATOM 0 H LYS A 387 -4.634 2.409 5.220 1.00 0.19 H new ATOM 0 HA LYS A 387 -6.893 0.615 4.563 1.00 0.22 H new ATOM 0 HB2 LYS A 387 -6.543 0.663 6.994 1.00 0.32 H new ATOM 0 HB3 LYS A 387 -6.558 2.415 6.984 1.00 0.32 H new ATOM 0 HG2 LYS A 387 -8.927 2.324 6.095 1.00 1.08 H new ATOM 0 HG3 LYS A 387 -8.887 0.584 6.302 1.00 1.08 H new ATOM 0 HD2 LYS A 387 -8.201 1.083 8.763 1.00 1.06 H new ATOM 0 HD3 LYS A 387 -8.723 2.725 8.440 1.00 1.06 H new ATOM 0 HE2 LYS A 387 -10.411 0.202 8.258 1.00 1.62 H new ATOM 0 HE3 LYS A 387 -10.562 1.486 9.442 1.00 1.62 H new ATOM 0 HZ1 LYS A 387 -12.072 2.335 8.076 1.00 2.53 H new ATOM 0 HZ2 LYS A 387 -10.794 2.787 7.054 1.00 2.53 H new ATOM 0 HZ3 LYS A 387 -11.619 1.328 6.786 1.00 2.53 H new ATOM 1737 N LEU A 388 -8.107 2.495 3.483 1.00 0.21 N ATOM 1738 CA LEU A 388 -8.723 3.558 2.710 1.00 0.21 C ATOM 1739 C LEU A 388 -9.933 4.082 3.466 1.00 0.24 C ATOM 1740 O LEU A 388 -10.696 3.297 4.031 1.00 0.28 O ATOM 1741 CB LEU A 388 -9.131 3.043 1.329 1.00 0.21 C ATOM 1742 CG LEU A 388 -9.538 4.122 0.323 1.00 0.21 C ATOM 1743 CD1 LEU A 388 -8.413 5.122 0.144 1.00 0.22 C ATOM 1744 CD2 LEU A 388 -9.902 3.500 -1.019 1.00 0.24 C ATOM 0 H LEU A 388 -8.516 1.573 3.334 1.00 0.21 H new ATOM 0 HA LEU A 388 -8.008 4.369 2.568 1.00 0.21 H new ATOM 0 HB2 LEU A 388 -8.300 2.475 0.911 1.00 0.21 H new ATOM 0 HB3 LEU A 388 -9.963 2.349 1.449 1.00 0.21 H new ATOM 0 HG LEU A 388 -10.415 4.639 0.713 1.00 0.21 H new ATOM 0 HD11 LEU A 388 -8.715 5.885 -0.574 1.00 0.22 H new ATOM 0 HD12 LEU A 388 -8.189 5.593 1.101 1.00 0.22 H new ATOM 0 HD13 LEU A 388 -7.525 4.608 -0.224 1.00 0.22 H new ATOM 0 HD21 LEU A 388 -10.188 4.286 -1.718 1.00 0.24 H new ATOM 0 HD22 LEU A 388 -9.043 2.958 -1.414 1.00 0.24 H new ATOM 0 HD23 LEU A 388 -10.736 2.811 -0.886 1.00 0.24 H new ATOM 1756 N VAL A 389 -10.107 5.396 3.497 1.00 0.26 N ATOM 1757 CA VAL A 389 -11.177 5.989 4.289 1.00 0.32 C ATOM 1758 C VAL A 389 -12.051 6.925 3.459 1.00 0.33 C ATOM 1759 O VAL A 389 -13.085 7.384 3.933 1.00 0.39 O ATOM 1760 CB VAL A 389 -10.630 6.753 5.522 1.00 0.39 C ATOM 1761 CG1 VAL A 389 -9.859 5.814 6.444 1.00 0.45 C ATOM 1762 CG2 VAL A 389 -9.762 7.928 5.098 1.00 0.40 C ATOM 0 H VAL A 389 -9.529 6.066 2.989 1.00 0.26 H new ATOM 0 HA VAL A 389 -11.789 5.157 4.636 1.00 0.32 H new ATOM 0 HB VAL A 389 -11.482 7.149 6.075 1.00 0.39 H new ATOM 0 HG11 VAL A 389 -9.485 6.373 7.302 1.00 0.45 H new ATOM 0 HG12 VAL A 389 -10.520 5.019 6.789 1.00 0.45 H new ATOM 0 HG13 VAL A 389 -9.020 5.378 5.901 1.00 0.45 H new ATOM 0 HG21 VAL A 389 -9.392 8.445 5.983 1.00 0.40 H new ATOM 0 HG22 VAL A 389 -8.918 7.564 4.511 1.00 0.40 H new ATOM 0 HG23 VAL A 389 -10.353 8.618 4.495 1.00 0.40 H new ATOM 1772 N SER A 390 -11.656 7.186 2.219 1.00 0.32 N ATOM 1773 CA SER A 390 -12.397 8.111 1.369 1.00 0.35 C ATOM 1774 C SER A 390 -11.940 8.015 -0.084 1.00 0.31 C ATOM 1775 O SER A 390 -10.880 7.456 -0.375 1.00 0.26 O ATOM 1776 CB SER A 390 -12.236 9.548 1.884 1.00 0.43 C ATOM 1777 OG SER A 390 -10.871 9.879 2.076 1.00 1.32 O ATOM 0 H SER A 390 -10.832 6.774 1.781 1.00 0.32 H new ATOM 0 HA SER A 390 -13.451 7.835 1.408 1.00 0.35 H new ATOM 0 HB2 SER A 390 -12.684 10.243 1.174 1.00 0.43 H new ATOM 0 HB3 SER A 390 -12.775 9.662 2.824 1.00 0.43 H new ATOM 0 HG SER A 390 -10.801 10.800 2.403 1.00 1.32 H new ATOM 1783 N MET A 391 -12.749 8.560 -0.988 1.00 0.38 N ATOM 1784 CA MET A 391 -12.438 8.557 -2.415 1.00 0.37 C ATOM 1785 C MET A 391 -13.216 9.656 -3.129 1.00 0.49 C ATOM 1786 O MET A 391 -14.327 10.002 -2.723 1.00 0.56 O ATOM 1787 CB MET A 391 -12.773 7.192 -3.027 1.00 0.36 C ATOM 1788 CG MET A 391 -12.582 7.114 -4.532 1.00 0.41 C ATOM 1789 SD MET A 391 -13.018 5.496 -5.198 1.00 0.49 S ATOM 1790 CE MET A 391 -11.956 4.435 -4.220 1.00 0.44 C ATOM 0 H MET A 391 -13.633 9.013 -0.755 1.00 0.38 H new ATOM 0 HA MET A 391 -11.372 8.746 -2.539 1.00 0.37 H new ATOM 0 HB2 MET A 391 -12.150 6.433 -2.554 1.00 0.36 H new ATOM 0 HB3 MET A 391 -13.808 6.946 -2.791 1.00 0.36 H new ATOM 0 HG2 MET A 391 -13.193 7.878 -5.013 1.00 0.41 H new ATOM 0 HG3 MET A 391 -11.543 7.336 -4.776 1.00 0.41 H new ATOM 0 HE1 MET A 391 -12.220 3.393 -4.398 1.00 0.44 H new ATOM 0 HE2 MET A 391 -10.917 4.599 -4.504 1.00 0.44 H new ATOM 0 HE3 MET A 391 -12.084 4.667 -3.163 1.00 0.44 H new ATOM 1800 N LYS A 392 -12.620 10.217 -4.171 1.00 0.56 N ATOM 1801 CA LYS A 392 -13.263 11.240 -4.975 1.00 0.71 C ATOM 1802 C LYS A 392 -12.991 10.988 -6.451 1.00 1.63 C ATOM 1803 O LYS A 392 -11.811 10.821 -6.821 1.00 2.38 O ATOM 1804 CB LYS A 392 -12.783 12.642 -4.588 1.00 1.70 C ATOM 1805 CG LYS A 392 -13.160 13.057 -3.176 1.00 2.54 C ATOM 1806 CD LYS A 392 -12.979 14.554 -2.951 1.00 3.38 C ATOM 1807 CE LYS A 392 -13.992 15.378 -3.741 1.00 4.14 C ATOM 1808 NZ LYS A 392 -13.597 15.565 -5.166 1.00 4.91 N ATOM 1809 OXT LYS A 392 -13.956 10.986 -7.239 1.00 2.36 O ATOM 0 H LYS A 392 -11.679 9.975 -4.481 1.00 0.56 H new ATOM 0 HA LYS A 392 -14.336 11.188 -4.788 1.00 0.71 H new ATOM 0 HB2 LYS A 392 -11.699 12.685 -4.691 1.00 1.70 H new ATOM 0 HB3 LYS A 392 -13.199 13.364 -5.291 1.00 1.70 H new ATOM 0 HG2 LYS A 392 -14.198 12.785 -2.983 1.00 2.54 H new ATOM 0 HG3 LYS A 392 -12.548 12.507 -2.461 1.00 2.54 H new ATOM 0 HD2 LYS A 392 -13.081 14.776 -1.889 1.00 3.38 H new ATOM 0 HD3 LYS A 392 -11.970 14.845 -3.242 1.00 3.38 H new ATOM 0 HE2 LYS A 392 -14.964 14.887 -3.699 1.00 4.14 H new ATOM 0 HE3 LYS A 392 -14.107 16.354 -3.269 1.00 4.14 H new ATOM 0 HZ1 LYS A 392 -13.628 16.577 -5.405 1.00 4.91 H new ATOM 0 HZ2 LYS A 392 -12.632 15.205 -5.309 1.00 4.91 H new ATOM 0 HZ3 LYS A 392 -14.255 15.044 -5.780 1.00 4.91 H new