USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 555 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 290 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 294 MET CE :methyl 153:sc=-0.00491 (180deg=-1.11) USER MOD Single : A 293 THR OG1 : rot -140:sc= 0 USER MOD Single : A 295 LYS NZ :NH3+ 162:sc= 1.04 (180deg=-0.0748) USER MOD Single : A 301 THR OG1 : rot 30:sc= 0.101 USER MOD Single : A 305 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 306 THR OG1 : rot 78:sc= 0.682 USER MOD Single : A 310 HIS : no HE2:sc= -6.19! C(o=-6.2!,f=-13!) USER MOD Single : A 311 LYS NZ :NH3+ 156:sc= -0.141 (180deg=-1.05) USER MOD Single : A 312 CYS SG : rot -90:sc= -3.35! USER MOD Single : A 313 GLN :FLIP amide:sc= -3.35! C(o=-4.1!,f=-3.4!) USER MOD Single : A 318 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.443) USER MOD Single : A 323 SER OG : rot 150:sc= -1.08 USER MOD Single : A 325 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 THR OG1 : rot 51:sc= 0.619 USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 HIS : no HE2:sc= -0.424 K(o=-0.42,f=-3.1) USER MOD Single : A 336 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 337 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 340 THR OG1 : rot 180:sc= -0.612 USER MOD Single : A 341 GLN : amide:sc= -0.132 K(o=-0.13,f=-2.2!) USER MOD Single : A 342 TYR OH : rot 30:sc= -0.108 USER MOD Single : A 344 SER OG : rot -61:sc= 0.932 USER MOD Single : A 345 THR OG1 : rot -35:sc= 0.382 USER MOD Single : A 346 ASN : amide:sc= -0.169 X(o=-0.17,f=-0.071) USER MOD Single : A 350 GLN : amide:sc= -0.28 K(o=-0.28,f=-3.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.245 2.993 3.705 1.00 0.00 N ATOM 2 CA PHE A 289 -17.937 2.466 3.250 1.00 0.00 C ATOM 3 C PHE A 289 -17.672 2.949 1.826 1.00 0.00 C ATOM 4 O PHE A 289 -16.772 2.488 1.153 1.00 0.00 O ATOM 5 CB PHE A 289 -17.977 0.939 3.265 1.00 0.00 C ATOM 6 CG PHE A 289 -18.641 0.464 4.536 1.00 0.00 C ATOM 7 CD1 PHE A 289 -17.901 0.360 5.719 1.00 0.00 C ATOM 8 CD2 PHE A 289 -20.001 0.130 4.529 1.00 0.00 C ATOM 9 CE1 PHE A 289 -18.520 -0.078 6.896 1.00 0.00 C ATOM 10 CE2 PHE A 289 -20.620 -0.308 5.706 1.00 0.00 C ATOM 11 CZ PHE A 289 -19.880 -0.412 6.890 1.00 0.00 C ATOM 0 HA PHE A 289 -17.146 2.818 3.912 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -18.524 0.571 2.397 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -16.966 0.538 3.199 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -16.852 0.618 5.724 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -20.572 0.210 3.616 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -17.948 -0.158 7.809 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -21.669 -0.566 5.701 1.00 0.00 H new ATOM 0 HZ PHE A 289 -20.358 -0.750 7.798 1.00 0.00 H new ATOM 21 N SER A 290 -18.470 3.862 1.358 1.00 0.00 N ATOM 22 CA SER A 290 -18.302 4.377 -0.030 1.00 0.00 C ATOM 23 C SER A 290 -17.426 5.640 -0.055 1.00 0.00 C ATOM 24 O SER A 290 -16.673 5.845 -0.986 1.00 0.00 O ATOM 25 CB SER A 290 -19.690 4.676 -0.623 1.00 0.00 C ATOM 26 OG SER A 290 -20.108 3.565 -1.404 1.00 0.00 O ATOM 0 H SER A 290 -19.240 4.279 1.881 1.00 0.00 H new ATOM 0 HA SER A 290 -17.799 3.619 -0.630 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.407 4.866 0.175 1.00 0.00 H new ATOM 0 HB3 SER A 290 -19.651 5.575 -1.238 1.00 0.00 H new ATOM 0 HG SER A 290 -20.993 3.747 -1.784 1.00 0.00 H new ATOM 32 N PRO A 291 -17.524 6.489 0.931 1.00 0.00 N ATOM 33 CA PRO A 291 -16.738 7.741 0.978 1.00 0.00 C ATOM 34 C PRO A 291 -15.381 7.581 1.677 1.00 0.00 C ATOM 35 O PRO A 291 -14.361 7.976 1.156 1.00 0.00 O ATOM 36 CB PRO A 291 -17.653 8.678 1.765 1.00 0.00 C ATOM 37 CG PRO A 291 -18.366 7.783 2.736 1.00 0.00 C ATOM 38 CD PRO A 291 -18.387 6.370 2.115 1.00 0.00 C ATOM 0 HA PRO A 291 -16.477 8.099 -0.018 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.081 9.448 2.282 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -18.356 9.190 1.108 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -17.855 7.774 3.699 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -19.380 8.140 2.917 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.008 5.622 2.812 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -19.399 6.069 1.843 1.00 0.00 H new ATOM 46 N GLU A 292 -15.367 7.041 2.868 1.00 0.00 N ATOM 47 CA GLU A 292 -14.070 6.901 3.612 1.00 0.00 C ATOM 48 C GLU A 292 -13.368 5.575 3.299 1.00 0.00 C ATOM 49 O GLU A 292 -12.222 5.545 2.890 1.00 0.00 O ATOM 50 CB GLU A 292 -14.328 7.011 5.122 1.00 0.00 C ATOM 51 CG GLU A 292 -15.328 5.939 5.578 1.00 0.00 C ATOM 52 CD GLU A 292 -15.951 6.349 6.916 1.00 0.00 C ATOM 53 OE1 GLU A 292 -15.256 6.274 7.917 1.00 0.00 O ATOM 54 OE2 GLU A 292 -17.109 6.730 6.917 1.00 0.00 O ATOM 0 H GLU A 292 -16.190 6.691 3.359 1.00 0.00 H new ATOM 0 HA GLU A 292 -13.411 7.706 3.286 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -13.390 6.897 5.666 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -14.715 8.002 5.359 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -16.107 5.812 4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -14.824 4.978 5.680 1.00 0.00 H new ATOM 61 N THR A 293 -14.029 4.480 3.520 1.00 0.00 N ATOM 62 CA THR A 293 -13.395 3.153 3.275 1.00 0.00 C ATOM 63 C THR A 293 -12.951 3.019 1.829 1.00 0.00 C ATOM 64 O THR A 293 -11.854 2.581 1.542 1.00 0.00 O ATOM 65 CB THR A 293 -14.411 2.052 3.560 1.00 0.00 C ATOM 66 OG1 THR A 293 -14.849 2.142 4.908 1.00 0.00 O ATOM 67 CG2 THR A 293 -13.775 0.687 3.312 1.00 0.00 C ATOM 0 H THR A 293 -14.989 4.442 3.863 1.00 0.00 H new ATOM 0 HA THR A 293 -12.527 3.066 3.928 1.00 0.00 H new ATOM 0 HB THR A 293 -15.268 2.173 2.897 1.00 0.00 H new ATOM 0 HG1 THR A 293 -14.935 1.241 5.285 1.00 0.00 H new ATOM 0 HG21 THR A 293 -14.504 -0.097 3.517 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.452 0.620 2.273 1.00 0.00 H new ATOM 0 HG23 THR A 293 -12.914 0.562 3.969 1.00 0.00 H new ATOM 75 N MET A 294 -13.809 3.336 0.914 1.00 0.00 N ATOM 76 CA MET A 294 -13.444 3.163 -0.509 1.00 0.00 C ATOM 77 C MET A 294 -12.219 4.019 -0.842 1.00 0.00 C ATOM 78 O MET A 294 -11.399 3.631 -1.643 1.00 0.00 O ATOM 79 CB MET A 294 -14.645 3.535 -1.394 1.00 0.00 C ATOM 80 CG MET A 294 -14.667 2.651 -2.648 1.00 0.00 C ATOM 81 SD MET A 294 -16.175 2.980 -3.591 1.00 0.00 S ATOM 82 CE MET A 294 -17.232 1.785 -2.734 1.00 0.00 C ATOM 0 H MET A 294 -14.744 3.706 1.087 1.00 0.00 H new ATOM 0 HA MET A 294 -13.186 2.122 -0.701 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.572 3.410 -0.835 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.585 4.585 -1.680 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.790 2.852 -3.263 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.624 1.599 -2.365 1.00 0.00 H new ATOM 0 HE1 MET A 294 -18.270 2.114 -2.787 1.00 0.00 H new ATOM 0 HE2 MET A 294 -17.136 0.809 -3.209 1.00 0.00 H new ATOM 0 HE3 MET A 294 -16.927 1.712 -1.690 1.00 0.00 H new ATOM 92 N LYS A 295 -12.061 5.163 -0.225 1.00 0.00 N ATOM 93 CA LYS A 295 -10.850 5.981 -0.525 1.00 0.00 C ATOM 94 C LYS A 295 -9.625 5.113 -0.265 1.00 0.00 C ATOM 95 O LYS A 295 -8.715 5.057 -1.063 1.00 0.00 O ATOM 96 CB LYS A 295 -10.809 7.224 0.375 1.00 0.00 C ATOM 97 CG LYS A 295 -11.689 8.325 -0.218 1.00 0.00 C ATOM 98 CD LYS A 295 -11.847 9.444 0.811 1.00 0.00 C ATOM 99 CE LYS A 295 -12.642 10.600 0.199 1.00 0.00 C ATOM 100 NZ LYS A 295 -13.788 10.058 -0.586 1.00 0.00 N ATOM 0 H LYS A 295 -12.705 5.559 0.460 1.00 0.00 H new ATOM 0 HA LYS A 295 -10.871 6.315 -1.562 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -11.155 6.970 1.377 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -9.783 7.579 0.473 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -11.240 8.714 -1.132 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -12.665 7.922 -0.489 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -12.359 9.067 1.697 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -10.867 9.795 1.134 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -13.007 11.260 0.986 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -11.997 11.198 -0.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -14.488 10.811 -0.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -13.446 9.708 -1.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -14.230 9.277 -0.060 1.00 0.00 H new ATOM 114 N ALA A 296 -9.607 4.409 0.831 1.00 0.00 N ATOM 115 CA ALA A 296 -8.446 3.521 1.104 1.00 0.00 C ATOM 116 C ALA A 296 -8.380 2.496 -0.025 1.00 0.00 C ATOM 117 O ALA A 296 -7.324 2.145 -0.511 1.00 0.00 O ATOM 118 CB ALA A 296 -8.642 2.809 2.444 1.00 0.00 C ATOM 0 H ALA A 296 -10.338 4.410 1.542 1.00 0.00 H new ATOM 0 HA ALA A 296 -7.522 4.097 1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -7.789 2.160 2.639 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -8.725 3.549 3.240 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -9.552 2.211 2.408 1.00 0.00 H new ATOM 124 N ARG A 297 -9.522 2.034 -0.457 1.00 0.00 N ATOM 125 CA ARG A 297 -9.579 1.049 -1.569 1.00 0.00 C ATOM 126 C ARG A 297 -9.056 1.710 -2.850 1.00 0.00 C ATOM 127 O ARG A 297 -8.356 1.106 -3.637 1.00 0.00 O ATOM 128 CB ARG A 297 -11.038 0.618 -1.753 1.00 0.00 C ATOM 129 CG ARG A 297 -11.106 -0.728 -2.476 1.00 0.00 C ATOM 130 CD ARG A 297 -12.561 -1.192 -2.548 1.00 0.00 C ATOM 131 NE ARG A 297 -13.274 -0.442 -3.621 1.00 0.00 N ATOM 132 CZ ARG A 297 -14.415 -0.884 -4.075 1.00 0.00 C ATOM 133 NH1 ARG A 297 -14.922 -1.990 -3.602 1.00 0.00 N ATOM 134 NH2 ARG A 297 -15.048 -0.223 -5.005 1.00 0.00 N ATOM 0 H ARG A 297 -10.430 2.303 -0.079 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.964 0.177 -1.346 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -11.527 0.542 -0.782 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -11.578 1.373 -2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -10.692 -0.635 -3.480 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -10.502 -1.467 -1.949 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -12.602 -2.262 -2.750 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -13.053 -1.030 -1.589 1.00 0.00 H new ATOM 0 HE ARG A 297 -12.871 0.415 -4.000 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -14.426 -2.509 -2.877 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -15.814 -2.335 -3.957 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -14.651 0.640 -5.378 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -15.940 -0.569 -5.359 1.00 0.00 H new ATOM 148 N ARG A 298 -9.381 2.955 -3.057 1.00 0.00 N ATOM 149 CA ARG A 298 -8.885 3.661 -4.272 1.00 0.00 C ATOM 150 C ARG A 298 -7.382 3.875 -4.112 1.00 0.00 C ATOM 151 O ARG A 298 -6.598 3.568 -4.986 1.00 0.00 O ATOM 152 CB ARG A 298 -9.600 5.015 -4.416 1.00 0.00 C ATOM 153 CG ARG A 298 -9.123 5.753 -5.694 1.00 0.00 C ATOM 154 CD ARG A 298 -8.081 6.824 -5.343 1.00 0.00 C ATOM 155 NE ARG A 298 -8.738 7.916 -4.569 1.00 0.00 N ATOM 156 CZ ARG A 298 -8.011 8.787 -3.924 1.00 0.00 C ATOM 157 NH1 ARG A 298 -6.709 8.707 -3.962 1.00 0.00 N ATOM 158 NH2 ARG A 298 -8.588 9.739 -3.244 1.00 0.00 N ATOM 0 H ARG A 298 -9.968 3.514 -2.438 1.00 0.00 H new ATOM 0 HA ARG A 298 -9.087 3.070 -5.165 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.678 4.860 -4.460 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -9.403 5.631 -3.539 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -8.694 5.037 -6.395 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -9.975 6.216 -6.192 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -7.273 6.384 -4.759 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -7.634 7.225 -6.253 1.00 0.00 H new ATOM 0 HE ARG A 298 -9.756 7.982 -4.544 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -6.259 7.963 -4.496 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -6.141 9.388 -3.458 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -9.606 9.802 -3.217 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -8.021 10.421 -2.739 1.00 0.00 H new ATOM 172 N ALA A 299 -6.976 4.380 -2.984 1.00 0.00 N ATOM 173 CA ALA A 299 -5.523 4.590 -2.744 1.00 0.00 C ATOM 174 C ALA A 299 -4.812 3.244 -2.885 1.00 0.00 C ATOM 175 O ALA A 299 -3.629 3.170 -3.153 1.00 0.00 O ATOM 176 CB ALA A 299 -5.316 5.123 -1.327 1.00 0.00 C ATOM 0 H ALA A 299 -7.588 4.657 -2.216 1.00 0.00 H new ATOM 0 HA ALA A 299 -5.122 5.306 -3.461 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -4.252 5.278 -1.148 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -5.845 6.070 -1.213 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.704 4.402 -0.607 1.00 0.00 H new ATOM 182 N TRP A 300 -5.543 2.177 -2.707 1.00 0.00 N ATOM 183 CA TRP A 300 -4.942 0.822 -2.825 1.00 0.00 C ATOM 184 C TRP A 300 -4.876 0.416 -4.299 1.00 0.00 C ATOM 185 O TRP A 300 -4.111 -0.450 -4.667 1.00 0.00 O ATOM 186 CB TRP A 300 -5.808 -0.179 -2.069 1.00 0.00 C ATOM 187 CG TRP A 300 -5.794 0.032 -0.570 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.650 -0.615 0.256 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.948 0.876 0.313 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.390 -0.261 1.560 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.363 0.646 1.655 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.879 1.797 0.120 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.756 1.278 2.738 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -3.275 2.430 1.219 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.711 2.168 2.521 1.00 0.00 C ATOM 0 H TRP A 300 -6.538 2.188 -2.483 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.936 0.834 -2.405 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.834 -0.107 -2.430 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -5.462 -1.189 -2.290 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -7.419 -1.304 -0.060 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -6.901 -0.629 2.363 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.530 2.011 -0.879 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -5.096 1.077 3.743 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.466 3.126 1.056 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.236 2.657 3.358 1.00 0.00 H new ATOM 206 N THR A 301 -5.639 1.039 -5.155 1.00 0.00 N ATOM 207 CA THR A 301 -5.568 0.676 -6.602 1.00 0.00 C ATOM 208 C THR A 301 -4.407 1.441 -7.245 1.00 0.00 C ATOM 209 O THR A 301 -3.623 0.889 -7.993 1.00 0.00 O ATOM 210 CB THR A 301 -6.887 1.046 -7.301 1.00 0.00 C ATOM 211 OG1 THR A 301 -7.436 2.206 -6.695 1.00 0.00 O ATOM 212 CG2 THR A 301 -7.884 -0.109 -7.184 1.00 0.00 C ATOM 0 H THR A 301 -6.303 1.777 -4.920 1.00 0.00 H new ATOM 0 HA THR A 301 -5.407 -0.397 -6.705 1.00 0.00 H new ATOM 0 HB THR A 301 -6.688 1.242 -8.355 1.00 0.00 H new ATOM 0 HG1 THR A 301 -6.712 2.769 -6.350 1.00 0.00 H new ATOM 0 HG21 THR A 301 -8.815 0.162 -7.682 1.00 0.00 H new ATOM 0 HG22 THR A 301 -7.467 -0.999 -7.655 1.00 0.00 H new ATOM 0 HG23 THR A 301 -8.082 -0.314 -6.132 1.00 0.00 H new ATOM 220 N ASP A 302 -4.296 2.710 -6.961 1.00 0.00 N ATOM 221 CA ASP A 302 -3.192 3.514 -7.553 1.00 0.00 C ATOM 222 C ASP A 302 -1.848 2.881 -7.195 1.00 0.00 C ATOM 223 O ASP A 302 -0.948 2.802 -8.007 1.00 0.00 O ATOM 224 CB ASP A 302 -3.244 4.939 -6.994 1.00 0.00 C ATOM 225 CG ASP A 302 -2.176 5.795 -7.676 1.00 0.00 C ATOM 226 OD1 ASP A 302 -1.228 5.227 -8.192 1.00 0.00 O ATOM 227 OD2 ASP A 302 -2.324 7.007 -7.671 1.00 0.00 O ATOM 0 H ASP A 302 -4.924 3.225 -6.343 1.00 0.00 H new ATOM 0 HA ASP A 302 -3.305 3.540 -8.637 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -4.231 5.370 -7.160 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -3.080 4.924 -5.917 1.00 0.00 H new ATOM 232 N VAL A 303 -1.698 2.435 -5.981 1.00 0.00 N ATOM 233 CA VAL A 303 -0.407 1.820 -5.577 1.00 0.00 C ATOM 234 C VAL A 303 -0.281 0.420 -6.192 1.00 0.00 C ATOM 235 O VAL A 303 0.798 -0.015 -6.540 1.00 0.00 O ATOM 236 CB VAL A 303 -0.353 1.723 -4.051 1.00 0.00 C ATOM 237 CG1 VAL A 303 -0.539 3.112 -3.437 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.463 0.793 -3.566 1.00 0.00 C ATOM 0 H VAL A 303 -2.412 2.470 -5.253 1.00 0.00 H new ATOM 0 HA VAL A 303 0.418 2.437 -5.933 1.00 0.00 H new ATOM 0 HB VAL A 303 0.615 1.326 -3.746 1.00 0.00 H new ATOM 0 HG11 VAL A 303 -0.500 3.038 -2.350 1.00 0.00 H new ATOM 0 HG12 VAL A 303 0.255 3.773 -3.784 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -1.505 3.517 -3.738 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -1.428 0.721 -2.479 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -2.431 1.190 -3.873 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.324 -0.197 -4.000 1.00 0.00 H new ATOM 248 N ILE A 304 -1.372 -0.294 -6.334 1.00 0.00 N ATOM 249 CA ILE A 304 -1.287 -1.666 -6.926 1.00 0.00 C ATOM 250 C ILE A 304 -0.510 -1.599 -8.249 1.00 0.00 C ATOM 251 O ILE A 304 0.346 -2.420 -8.515 1.00 0.00 O ATOM 252 CB ILE A 304 -2.719 -2.218 -7.157 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.193 -2.984 -5.908 1.00 0.00 C ATOM 254 CG2 ILE A 304 -2.756 -3.177 -8.359 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.716 -3.188 -5.952 1.00 0.00 C ATOM 0 H ILE A 304 -2.309 0.010 -6.068 1.00 0.00 H new ATOM 0 HA ILE A 304 -0.762 -2.336 -6.245 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.374 -1.370 -7.355 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.691 -3.950 -5.854 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -2.919 -2.432 -5.009 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -3.771 -3.548 -8.497 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.438 -2.647 -9.257 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.085 -4.016 -8.176 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -5.036 -3.731 -5.063 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.212 -2.218 -5.983 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -4.981 -3.760 -6.841 1.00 0.00 H new ATOM 267 N GLN A 305 -0.807 -0.642 -9.083 1.00 0.00 N ATOM 268 CA GLN A 305 -0.088 -0.550 -10.384 1.00 0.00 C ATOM 269 C GLN A 305 1.331 -0.029 -10.154 1.00 0.00 C ATOM 270 O GLN A 305 2.230 -0.292 -10.925 1.00 0.00 O ATOM 271 CB GLN A 305 -0.835 0.401 -11.320 1.00 0.00 C ATOM 272 CG GLN A 305 -1.119 1.716 -10.596 1.00 0.00 C ATOM 273 CD GLN A 305 -1.536 2.779 -11.615 1.00 0.00 C ATOM 274 OE1 GLN A 305 -0.702 3.477 -12.156 1.00 0.00 O ATOM 275 NE2 GLN A 305 -2.800 2.930 -11.901 1.00 0.00 N ATOM 0 H GLN A 305 -1.512 0.077 -8.922 1.00 0.00 H new ATOM 0 HA GLN A 305 -0.040 -1.540 -10.837 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.241 0.588 -12.215 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.770 -0.055 -11.647 1.00 0.00 H new ATOM 0 HG2 GLN A 305 -1.909 1.574 -9.858 1.00 0.00 H new ATOM 0 HG3 GLN A 305 -0.232 2.044 -10.054 1.00 0.00 H new ATOM 0 HE21 GLN A 305 -3.499 2.343 -11.446 1.00 0.00 H new ATOM 0 HE22 GLN A 305 -3.089 3.635 -12.580 1.00 0.00 H new ATOM 284 N THR A 306 1.540 0.717 -9.104 1.00 0.00 N ATOM 285 CA THR A 306 2.905 1.256 -8.841 1.00 0.00 C ATOM 286 C THR A 306 3.795 0.167 -8.230 1.00 0.00 C ATOM 287 O THR A 306 4.916 -0.026 -8.642 1.00 0.00 O ATOM 288 CB THR A 306 2.812 2.430 -7.866 1.00 0.00 C ATOM 289 OG1 THR A 306 1.884 3.385 -8.360 1.00 0.00 O ATOM 290 CG2 THR A 306 4.186 3.085 -7.704 1.00 0.00 C ATOM 0 H THR A 306 0.829 0.976 -8.420 1.00 0.00 H new ATOM 0 HA THR A 306 3.339 1.589 -9.784 1.00 0.00 H new ATOM 0 HB THR A 306 2.476 2.063 -6.896 1.00 0.00 H new ATOM 0 HG1 THR A 306 0.971 3.076 -8.184 1.00 0.00 H new ATOM 0 HG21 THR A 306 4.111 3.920 -7.008 1.00 0.00 H new ATOM 0 HG22 THR A 306 4.895 2.353 -7.317 1.00 0.00 H new ATOM 0 HG23 THR A 306 4.532 3.449 -8.671 1.00 0.00 H new ATOM 298 N LEU A 307 3.317 -0.534 -7.240 1.00 0.00 N ATOM 299 CA LEU A 307 4.160 -1.591 -6.597 1.00 0.00 C ATOM 300 C LEU A 307 4.840 -2.451 -7.677 1.00 0.00 C ATOM 301 O LEU A 307 6.023 -2.720 -7.614 1.00 0.00 O ATOM 302 CB LEU A 307 3.271 -2.493 -5.705 1.00 0.00 C ATOM 303 CG LEU A 307 3.196 -1.977 -4.248 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.596 -1.905 -3.602 1.00 0.00 C ATOM 305 CD2 LEU A 307 2.526 -0.599 -4.215 1.00 0.00 C ATOM 0 H LEU A 307 2.382 -0.424 -6.846 1.00 0.00 H new ATOM 0 HA LEU A 307 4.925 -1.112 -5.986 1.00 0.00 H new ATOM 0 HB2 LEU A 307 2.266 -2.540 -6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.666 -3.509 -5.710 1.00 0.00 H new ATOM 0 HG LEU A 307 2.599 -2.682 -3.670 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.506 -1.539 -2.579 1.00 0.00 H new ATOM 0 HD12 LEU A 307 5.044 -2.898 -3.594 1.00 0.00 H new ATOM 0 HD13 LEU A 307 5.227 -1.227 -4.176 1.00 0.00 H new ATOM 0 HD21 LEU A 307 2.477 -0.243 -3.186 1.00 0.00 H new ATOM 0 HD22 LEU A 307 3.106 0.102 -4.815 1.00 0.00 H new ATOM 0 HD23 LEU A 307 1.517 -0.675 -4.621 1.00 0.00 H new ATOM 317 N ARG A 308 4.098 -2.900 -8.649 1.00 0.00 N ATOM 318 CA ARG A 308 4.696 -3.761 -9.712 1.00 0.00 C ATOM 319 C ARG A 308 5.808 -3.010 -10.466 1.00 0.00 C ATOM 320 O ARG A 308 6.454 -3.566 -11.332 1.00 0.00 O ATOM 321 CB ARG A 308 3.589 -4.228 -10.685 1.00 0.00 C ATOM 322 CG ARG A 308 3.409 -3.236 -11.845 1.00 0.00 C ATOM 323 CD ARG A 308 2.079 -3.510 -12.559 1.00 0.00 C ATOM 324 NE ARG A 308 2.109 -2.904 -13.920 1.00 0.00 N ATOM 325 CZ ARG A 308 1.221 -3.254 -14.809 1.00 0.00 C ATOM 326 NH1 ARG A 308 0.299 -4.126 -14.505 1.00 0.00 N ATOM 327 NH2 ARG A 308 1.253 -2.733 -16.005 1.00 0.00 N ATOM 0 H ARG A 308 3.102 -2.709 -8.756 1.00 0.00 H new ATOM 0 HA ARG A 308 5.148 -4.636 -9.245 1.00 0.00 H new ATOM 0 HB2 ARG A 308 3.841 -5.212 -11.081 1.00 0.00 H new ATOM 0 HB3 ARG A 308 2.648 -4.334 -10.145 1.00 0.00 H new ATOM 0 HG2 ARG A 308 3.426 -2.214 -11.468 1.00 0.00 H new ATOM 0 HG3 ARG A 308 4.236 -3.330 -12.548 1.00 0.00 H new ATOM 0 HD2 ARG A 308 1.908 -4.584 -12.632 1.00 0.00 H new ATOM 0 HD3 ARG A 308 1.253 -3.094 -11.983 1.00 0.00 H new ATOM 0 HE ARG A 308 2.824 -2.216 -14.156 1.00 0.00 H new ATOM 0 HH11 ARG A 308 0.272 -4.535 -13.571 1.00 0.00 H new ATOM 0 HH12 ARG A 308 -0.395 -4.399 -15.201 1.00 0.00 H new ATOM 0 HH21 ARG A 308 1.973 -2.051 -16.245 1.00 0.00 H new ATOM 0 HH22 ARG A 308 0.558 -3.007 -16.700 1.00 0.00 H new ATOM 341 N GLU A 309 6.033 -1.756 -10.169 1.00 0.00 N ATOM 342 CA GLU A 309 7.097 -1.015 -10.911 1.00 0.00 C ATOM 343 C GLU A 309 8.481 -1.425 -10.399 1.00 0.00 C ATOM 344 O GLU A 309 9.486 -1.052 -10.972 1.00 0.00 O ATOM 345 CB GLU A 309 6.913 0.495 -10.728 1.00 0.00 C ATOM 346 CG GLU A 309 5.666 0.950 -11.488 1.00 0.00 C ATOM 347 CD GLU A 309 5.445 2.446 -11.260 1.00 0.00 C ATOM 348 OE1 GLU A 309 6.331 3.079 -10.712 1.00 0.00 O ATOM 349 OE2 GLU A 309 4.394 2.934 -11.641 1.00 0.00 O ATOM 0 H GLU A 309 5.536 -1.220 -9.457 1.00 0.00 H new ATOM 0 HA GLU A 309 7.018 -1.262 -11.970 1.00 0.00 H new ATOM 0 HB2 GLU A 309 6.815 0.735 -9.669 1.00 0.00 H new ATOM 0 HB3 GLU A 309 7.791 1.027 -11.095 1.00 0.00 H new ATOM 0 HG2 GLU A 309 5.782 0.747 -12.553 1.00 0.00 H new ATOM 0 HG3 GLU A 309 4.796 0.388 -11.149 1.00 0.00 H new ATOM 356 N HIS A 310 8.549 -2.209 -9.346 1.00 0.00 N ATOM 357 CA HIS A 310 9.882 -2.665 -8.824 1.00 0.00 C ATOM 358 C HIS A 310 9.845 -4.176 -8.572 1.00 0.00 C ATOM 359 O HIS A 310 9.967 -4.968 -9.484 1.00 0.00 O ATOM 360 CB HIS A 310 10.253 -1.912 -7.536 1.00 0.00 C ATOM 361 CG HIS A 310 9.116 -1.914 -6.545 1.00 0.00 C ATOM 362 ND1 HIS A 310 9.183 -2.628 -5.357 1.00 0.00 N ATOM 363 CD2 HIS A 310 7.907 -1.260 -6.518 1.00 0.00 C ATOM 364 CE1 HIS A 310 8.052 -2.386 -4.672 1.00 0.00 C ATOM 365 NE2 HIS A 310 7.238 -1.561 -5.334 1.00 0.00 N ATOM 0 H HIS A 310 7.741 -2.552 -8.826 1.00 0.00 H new ATOM 0 HA HIS A 310 10.646 -2.445 -9.570 1.00 0.00 H new ATOM 0 HB2 HIS A 310 11.131 -2.373 -7.084 1.00 0.00 H new ATOM 0 HB3 HIS A 310 10.523 -0.884 -7.779 1.00 0.00 H new ATOM 0 HD1 HIS A 310 9.952 -3.228 -5.058 1.00 0.00 H new ATOM 0 HD2 HIS A 310 7.533 -0.612 -7.296 1.00 0.00 H new ATOM 0 HE1 HIS A 310 7.829 -2.808 -3.703 1.00 0.00 H new ATOM 373 N LYS A 311 9.683 -4.583 -7.343 1.00 0.00 N ATOM 374 CA LYS A 311 9.645 -6.044 -7.035 1.00 0.00 C ATOM 375 C LYS A 311 8.788 -6.268 -5.799 1.00 0.00 C ATOM 376 O LYS A 311 9.274 -6.343 -4.688 1.00 0.00 O ATOM 377 CB LYS A 311 11.071 -6.546 -6.784 1.00 0.00 C ATOM 378 CG LYS A 311 11.865 -5.464 -6.044 1.00 0.00 C ATOM 379 CD LYS A 311 13.132 -6.075 -5.443 1.00 0.00 C ATOM 380 CE LYS A 311 13.890 -5.002 -4.659 1.00 0.00 C ATOM 381 NZ LYS A 311 12.977 -4.382 -3.657 1.00 0.00 N ATOM 0 H LYS A 311 9.575 -3.968 -6.537 1.00 0.00 H new ATOM 0 HA LYS A 311 9.217 -6.592 -7.874 1.00 0.00 H new ATOM 0 HB2 LYS A 311 11.048 -7.463 -6.195 1.00 0.00 H new ATOM 0 HB3 LYS A 311 11.556 -6.787 -7.730 1.00 0.00 H new ATOM 0 HG2 LYS A 311 12.128 -4.659 -6.730 1.00 0.00 H new ATOM 0 HG3 LYS A 311 11.253 -5.024 -5.257 1.00 0.00 H new ATOM 0 HD2 LYS A 311 12.873 -6.906 -4.787 1.00 0.00 H new ATOM 0 HD3 LYS A 311 13.765 -6.479 -6.233 1.00 0.00 H new ATOM 0 HE2 LYS A 311 14.752 -5.443 -4.158 1.00 0.00 H new ATOM 0 HE3 LYS A 311 14.272 -4.241 -5.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 13.538 -3.976 -2.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 12.421 -3.630 -4.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 12.334 -5.106 -3.278 1.00 0.00 H new ATOM 395 N CYS A 312 7.510 -6.379 -5.992 1.00 0.00 N ATOM 396 CA CYS A 312 6.606 -6.601 -4.844 1.00 0.00 C ATOM 397 C CYS A 312 5.205 -6.876 -5.360 1.00 0.00 C ATOM 398 O CYS A 312 4.527 -6.005 -5.860 1.00 0.00 O ATOM 399 CB CYS A 312 6.585 -5.362 -3.961 1.00 0.00 C ATOM 400 SG CYS A 312 5.163 -5.413 -2.845 1.00 0.00 S ATOM 0 H CYS A 312 7.052 -6.325 -6.902 1.00 0.00 H new ATOM 0 HA CYS A 312 6.959 -7.452 -4.261 1.00 0.00 H new ATOM 0 HB2 CYS A 312 7.508 -5.303 -3.384 1.00 0.00 H new ATOM 0 HB3 CYS A 312 6.538 -4.466 -4.580 1.00 0.00 H new ATOM 0 HG CYS A 312 4.145 -4.839 -3.413 1.00 0.00 H new ATOM 406 N GLN A 313 4.780 -8.082 -5.227 1.00 0.00 N ATOM 407 CA GLN A 313 3.416 -8.458 -5.693 1.00 0.00 C ATOM 408 C GLN A 313 2.371 -7.789 -4.773 1.00 0.00 C ATOM 409 O GLN A 313 2.303 -8.104 -3.602 1.00 0.00 O ATOM 410 CB GLN A 313 3.264 -9.980 -5.600 1.00 0.00 C ATOM 411 CG GLN A 313 4.231 -10.656 -6.576 1.00 0.00 C ATOM 412 CD GLN A 313 5.670 -10.438 -6.108 1.00 0.00 C ATOM 413 OE1 GLN A 313 6.010 -10.785 -4.897 1.00 0.00 O flip ATOM 414 NE2 GLN A 313 6.496 -9.948 -6.852 1.00 0.00 N flip ATOM 0 H GLN A 313 5.318 -8.842 -4.811 1.00 0.00 H new ATOM 0 HA GLN A 313 3.267 -8.131 -6.722 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.467 -10.314 -4.582 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.238 -10.268 -5.831 1.00 0.00 H new ATOM 0 HG2 GLN A 313 4.016 -11.723 -6.637 1.00 0.00 H new ATOM 0 HG3 GLN A 313 4.098 -10.247 -7.577 1.00 0.00 H new ATOM 0 HE21 GLN A 313 6.232 -9.676 -7.799 1.00 0.00 H new ATOM 0 HE22 GLN A 313 7.454 -9.808 -6.530 1.00 0.00 H new ATOM 423 N PRO A 314 1.567 -6.862 -5.272 1.00 0.00 N ATOM 424 CA PRO A 314 0.544 -6.162 -4.437 1.00 0.00 C ATOM 425 C PRO A 314 -0.790 -6.916 -4.370 1.00 0.00 C ATOM 426 O PRO A 314 -1.238 -7.498 -5.339 1.00 0.00 O ATOM 427 CB PRO A 314 0.371 -4.839 -5.175 1.00 0.00 C ATOM 428 CG PRO A 314 0.510 -5.209 -6.618 1.00 0.00 C ATOM 429 CD PRO A 314 1.525 -6.366 -6.667 1.00 0.00 C ATOM 0 HA PRO A 314 0.855 -6.066 -3.397 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.601 -4.391 -4.970 1.00 0.00 H new ATOM 0 HB3 PRO A 314 1.126 -4.113 -4.875 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.449 -5.514 -7.036 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.858 -4.360 -7.206 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.208 -7.146 -7.359 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.505 -6.024 -6.999 1.00 0.00 H new ATOM 437 N ARG A 315 -1.431 -6.903 -3.228 1.00 0.00 N ATOM 438 CA ARG A 315 -2.743 -7.609 -3.083 1.00 0.00 C ATOM 439 C ARG A 315 -3.646 -6.793 -2.140 1.00 0.00 C ATOM 440 O ARG A 315 -3.226 -6.368 -1.081 1.00 0.00 O ATOM 441 CB ARG A 315 -2.530 -9.041 -2.508 1.00 0.00 C ATOM 442 CG ARG A 315 -1.033 -9.421 -2.496 1.00 0.00 C ATOM 443 CD ARG A 315 -0.233 -8.511 -1.527 1.00 0.00 C ATOM 444 NE ARG A 315 0.589 -9.343 -0.581 1.00 0.00 N ATOM 445 CZ ARG A 315 0.054 -10.277 0.165 1.00 0.00 C ATOM 446 NH1 ARG A 315 -1.235 -10.473 0.162 1.00 0.00 N ATOM 447 NH2 ARG A 315 0.816 -11.004 0.934 1.00 0.00 N ATOM 0 H ARG A 315 -1.101 -6.432 -2.386 1.00 0.00 H new ATOM 0 HA ARG A 315 -3.215 -7.700 -4.061 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -2.929 -9.092 -1.495 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -3.086 -9.763 -3.106 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -0.922 -10.463 -2.196 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -0.624 -9.333 -3.503 1.00 0.00 H new ATOM 0 HD2 ARG A 315 0.418 -7.847 -2.096 1.00 0.00 H new ATOM 0 HD3 ARG A 315 -0.919 -7.879 -0.963 1.00 0.00 H new ATOM 0 HE ARG A 315 1.593 -9.175 -0.519 1.00 0.00 H new ATOM 0 HH11 ARG A 315 -1.837 -9.896 -0.425 1.00 0.00 H new ATOM 0 HH12 ARG A 315 -1.641 -11.203 0.747 1.00 0.00 H new ATOM 0 HH21 ARG A 315 1.823 -10.844 0.952 1.00 0.00 H new ATOM 0 HH22 ARG A 315 0.405 -11.733 1.517 1.00 0.00 H new ATOM 461 N LEU A 316 -4.885 -6.584 -2.513 1.00 0.00 N ATOM 462 CA LEU A 316 -5.825 -5.818 -1.654 1.00 0.00 C ATOM 463 C LEU A 316 -6.712 -6.813 -0.912 1.00 0.00 C ATOM 464 O LEU A 316 -7.399 -7.619 -1.508 1.00 0.00 O ATOM 465 CB LEU A 316 -6.688 -4.918 -2.540 1.00 0.00 C ATOM 466 CG LEU A 316 -7.232 -3.739 -1.733 1.00 0.00 C ATOM 467 CD1 LEU A 316 -8.012 -2.824 -2.672 1.00 0.00 C ATOM 468 CD2 LEU A 316 -8.161 -4.242 -0.621 1.00 0.00 C ATOM 0 H LEU A 316 -5.285 -6.919 -3.390 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.279 -5.201 -0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.098 -4.551 -3.380 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.514 -5.493 -2.958 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.404 -3.196 -1.278 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.407 -1.977 -2.110 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.351 -2.461 -3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -8.837 -3.379 -3.119 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.542 -3.393 -0.053 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -8.995 -4.787 -1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.607 -4.904 0.044 1.00 0.00 H new ATOM 480 N LEU A 317 -6.690 -6.762 0.381 1.00 0.00 N ATOM 481 CA LEU A 317 -7.513 -7.698 1.205 1.00 0.00 C ATOM 482 C LEU A 317 -8.705 -6.936 1.763 1.00 0.00 C ATOM 483 O LEU A 317 -9.176 -6.027 1.122 1.00 0.00 O ATOM 484 CB LEU A 317 -6.643 -8.244 2.335 1.00 0.00 C ATOM 485 CG LEU A 317 -5.293 -8.673 1.750 1.00 0.00 C ATOM 486 CD1 LEU A 317 -4.444 -9.326 2.833 1.00 0.00 C ATOM 487 CD2 LEU A 317 -5.521 -9.674 0.609 1.00 0.00 C ATOM 0 H LEU A 317 -6.129 -6.102 0.920 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.877 -8.531 0.604 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -6.498 -7.483 3.102 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -7.134 -9.091 2.815 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.775 -7.794 1.367 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -3.486 -9.629 2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -4.276 -8.615 3.642 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -4.962 -10.202 3.222 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -4.560 -9.978 0.194 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -6.044 -10.550 0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -6.121 -9.206 -0.171 1.00 0.00 H new ATOM 499 N TYR A 318 -9.178 -7.320 2.938 1.00 0.00 N ATOM 500 CA TYR A 318 -10.364 -6.657 3.616 1.00 0.00 C ATOM 501 C TYR A 318 -10.767 -5.346 2.899 1.00 0.00 C ATOM 502 O TYR A 318 -9.907 -4.639 2.436 1.00 0.00 O ATOM 503 CB TYR A 318 -9.958 -6.345 5.075 1.00 0.00 C ATOM 504 CG TYR A 318 -11.134 -6.503 6.016 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.547 -7.779 6.415 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.808 -5.369 6.488 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.635 -7.923 7.286 1.00 0.00 C ATOM 508 CE2 TYR A 318 -12.894 -5.513 7.359 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.308 -6.789 7.757 1.00 0.00 C ATOM 510 OH TYR A 318 -14.379 -6.929 8.615 1.00 0.00 O ATOM 0 H TYR A 318 -8.779 -8.091 3.474 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.222 -7.328 3.579 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -9.152 -7.011 5.381 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.572 -5.328 5.138 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -11.027 -8.653 6.052 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.490 -4.384 6.180 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.954 -8.908 7.594 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.413 -4.639 7.724 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.731 -6.044 8.846 1.00 0.00 H new ATOM 520 N PRO A 319 -12.052 -5.028 2.803 1.00 0.00 N ATOM 521 CA PRO A 319 -12.553 -3.802 2.116 1.00 0.00 C ATOM 522 C PRO A 319 -11.519 -2.676 1.983 1.00 0.00 C ATOM 523 O PRO A 319 -11.588 -1.870 1.076 1.00 0.00 O ATOM 524 CB PRO A 319 -13.718 -3.406 3.008 1.00 0.00 C ATOM 525 CG PRO A 319 -14.333 -4.722 3.406 1.00 0.00 C ATOM 526 CD PRO A 319 -13.201 -5.779 3.341 1.00 0.00 C ATOM 0 HA PRO A 319 -12.816 -3.989 1.075 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.381 -2.843 3.878 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.432 -2.776 2.477 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.753 -4.665 4.410 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.149 -4.987 2.734 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -12.983 -6.193 4.325 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.470 -6.615 2.696 1.00 0.00 H new ATOM 534 N ALA A 320 -10.543 -2.631 2.844 1.00 0.00 N ATOM 535 CA ALA A 320 -9.495 -1.581 2.725 1.00 0.00 C ATOM 536 C ALA A 320 -8.186 -2.063 3.372 1.00 0.00 C ATOM 537 O ALA A 320 -7.547 -1.319 4.090 1.00 0.00 O ATOM 538 CB ALA A 320 -9.975 -0.299 3.411 1.00 0.00 C ATOM 0 H ALA A 320 -10.425 -3.276 3.625 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.310 -1.379 1.670 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.207 0.470 3.324 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -10.892 0.048 2.934 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.168 -0.501 4.465 1.00 0.00 H new ATOM 544 N LYS A 321 -7.762 -3.292 3.113 1.00 0.00 N ATOM 545 CA LYS A 321 -6.470 -3.788 3.711 1.00 0.00 C ATOM 546 C LYS A 321 -5.482 -4.055 2.570 1.00 0.00 C ATOM 547 O LYS A 321 -5.662 -4.965 1.787 1.00 0.00 O ATOM 548 CB LYS A 321 -6.728 -5.085 4.505 1.00 0.00 C ATOM 549 CG LYS A 321 -7.094 -4.750 5.966 1.00 0.00 C ATOM 550 CD LYS A 321 -5.817 -4.519 6.801 1.00 0.00 C ATOM 551 CE LYS A 321 -5.304 -5.850 7.360 1.00 0.00 C ATOM 552 NZ LYS A 321 -4.073 -5.606 8.163 1.00 0.00 N ATOM 0 H LYS A 321 -8.251 -3.963 2.520 1.00 0.00 H new ATOM 0 HA LYS A 321 -6.058 -3.043 4.391 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.536 -5.650 4.040 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -5.841 -5.718 4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -7.721 -3.859 5.995 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -7.676 -5.564 6.398 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -5.048 -4.055 6.183 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -6.028 -3.830 7.619 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -6.070 -6.316 7.980 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -5.089 -6.541 6.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -3.505 -6.476 8.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -3.515 -4.847 7.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -4.338 -5.324 9.128 1.00 0.00 H new ATOM 566 N LEU A 322 -4.452 -3.247 2.456 1.00 0.00 N ATOM 567 CA LEU A 322 -3.461 -3.427 1.344 1.00 0.00 C ATOM 568 C LEU A 322 -2.175 -4.073 1.867 1.00 0.00 C ATOM 569 O LEU A 322 -1.502 -3.543 2.729 1.00 0.00 O ATOM 570 CB LEU A 322 -3.171 -2.036 0.759 1.00 0.00 C ATOM 571 CG LEU A 322 -2.316 -2.096 -0.525 1.00 0.00 C ATOM 572 CD1 LEU A 322 -0.883 -2.549 -0.204 1.00 0.00 C ATOM 573 CD2 LEU A 322 -2.953 -3.042 -1.560 1.00 0.00 C ATOM 0 H LEU A 322 -4.255 -2.470 3.086 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.864 -4.087 0.576 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -4.114 -1.535 0.540 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.655 -1.432 1.506 1.00 0.00 H new ATOM 0 HG LEU A 322 -2.276 -1.093 -0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 322 -0.298 -2.584 -1.123 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -0.426 -1.844 0.490 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -0.908 -3.540 0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -2.334 -3.069 -2.457 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -3.027 -4.045 -1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -3.949 -2.682 -1.817 1.00 0.00 H new ATOM 585 N SER A 323 -1.832 -5.226 1.335 1.00 0.00 N ATOM 586 CA SER A 323 -0.590 -5.943 1.768 1.00 0.00 C ATOM 587 C SER A 323 0.474 -5.830 0.676 1.00 0.00 C ATOM 588 O SER A 323 0.169 -5.732 -0.496 1.00 0.00 O ATOM 589 CB SER A 323 -0.912 -7.418 2.015 1.00 0.00 C ATOM 590 OG SER A 323 0.294 -8.171 1.993 1.00 0.00 O ATOM 0 H SER A 323 -2.368 -5.704 0.611 1.00 0.00 H new ATOM 0 HA SER A 323 -0.215 -5.493 2.687 1.00 0.00 H new ATOM 0 HB2 SER A 323 -1.411 -7.537 2.976 1.00 0.00 H new ATOM 0 HB3 SER A 323 -1.598 -7.785 1.252 1.00 0.00 H new ATOM 0 HG SER A 323 0.206 -8.947 2.585 1.00 0.00 H new ATOM 596 N ILE A 324 1.726 -5.831 1.056 1.00 0.00 N ATOM 597 CA ILE A 324 2.822 -5.704 0.053 1.00 0.00 C ATOM 598 C ILE A 324 4.026 -6.576 0.451 1.00 0.00 C ATOM 599 O ILE A 324 4.280 -6.835 1.609 1.00 0.00 O ATOM 600 CB ILE A 324 3.236 -4.230 -0.058 1.00 0.00 C ATOM 601 CG1 ILE A 324 4.004 -3.762 1.184 1.00 0.00 C ATOM 602 CG2 ILE A 324 1.996 -3.362 -0.235 1.00 0.00 C ATOM 603 CD1 ILE A 324 3.235 -4.073 2.457 1.00 0.00 C ATOM 0 H ILE A 324 2.036 -5.915 2.024 1.00 0.00 H new ATOM 0 HA ILE A 324 2.464 -6.052 -0.916 1.00 0.00 H new ATOM 0 HB ILE A 324 3.893 -4.134 -0.922 1.00 0.00 H new ATOM 0 HG12 ILE A 324 4.979 -4.249 1.217 1.00 0.00 H new ATOM 0 HG13 ILE A 324 4.186 -2.689 1.119 1.00 0.00 H new ATOM 0 HG21 ILE A 324 2.292 -2.316 -0.314 1.00 0.00 H new ATOM 0 HG22 ILE A 324 1.470 -3.659 -1.142 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.337 -3.489 0.624 1.00 0.00 H new ATOM 0 HD11 ILE A 324 3.805 -3.729 3.320 1.00 0.00 H new ATOM 0 HD12 ILE A 324 2.271 -3.565 2.433 1.00 0.00 H new ATOM 0 HD13 ILE A 324 3.076 -5.149 2.532 1.00 0.00 H new ATOM 615 N THR A 325 4.751 -7.054 -0.524 1.00 0.00 N ATOM 616 CA THR A 325 5.933 -7.934 -0.251 1.00 0.00 C ATOM 617 C THR A 325 7.232 -7.125 -0.381 1.00 0.00 C ATOM 618 O THR A 325 7.557 -6.626 -1.438 1.00 0.00 O ATOM 619 CB THR A 325 5.935 -9.086 -1.270 1.00 0.00 C ATOM 620 OG1 THR A 325 4.851 -9.960 -0.987 1.00 0.00 O ATOM 621 CG2 THR A 325 7.252 -9.863 -1.177 1.00 0.00 C ATOM 0 H THR A 325 4.575 -6.872 -1.512 1.00 0.00 H new ATOM 0 HA THR A 325 5.869 -8.332 0.762 1.00 0.00 H new ATOM 0 HB THR A 325 5.831 -8.679 -2.276 1.00 0.00 H new ATOM 0 HG1 THR A 325 4.846 -10.696 -1.635 1.00 0.00 H new ATOM 0 HG21 THR A 325 7.246 -10.677 -1.902 1.00 0.00 H new ATOM 0 HG22 THR A 325 8.085 -9.194 -1.390 1.00 0.00 H new ATOM 0 HG23 THR A 325 7.363 -10.272 -0.173 1.00 0.00 H new ATOM 629 N ILE A 326 7.983 -6.999 0.690 1.00 0.00 N ATOM 630 CA ILE A 326 9.269 -6.229 0.631 1.00 0.00 C ATOM 631 C ILE A 326 10.328 -6.941 1.476 1.00 0.00 C ATOM 632 O ILE A 326 10.045 -7.456 2.540 1.00 0.00 O ATOM 633 CB ILE A 326 9.065 -4.819 1.190 1.00 0.00 C ATOM 634 CG1 ILE A 326 7.815 -4.198 0.571 1.00 0.00 C ATOM 635 CG2 ILE A 326 10.285 -3.957 0.851 1.00 0.00 C ATOM 636 CD1 ILE A 326 7.570 -2.818 1.183 1.00 0.00 C ATOM 0 H ILE A 326 7.761 -7.396 1.603 1.00 0.00 H new ATOM 0 HA ILE A 326 9.593 -6.167 -0.408 1.00 0.00 H new ATOM 0 HB ILE A 326 8.944 -4.872 2.272 1.00 0.00 H new ATOM 0 HG12 ILE A 326 7.936 -4.112 -0.509 1.00 0.00 H new ATOM 0 HG13 ILE A 326 6.953 -4.842 0.744 1.00 0.00 H new ATOM 0 HG21 ILE A 326 10.142 -2.952 1.248 1.00 0.00 H new ATOM 0 HG22 ILE A 326 11.177 -4.399 1.294 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.405 -3.906 -0.231 1.00 0.00 H new ATOM 0 HD11 ILE A 326 6.677 -2.377 0.740 1.00 0.00 H new ATOM 0 HD12 ILE A 326 7.430 -2.917 2.259 1.00 0.00 H new ATOM 0 HD13 ILE A 326 8.428 -2.175 0.987 1.00 0.00 H new ATOM 648 N ASP A 327 11.546 -6.964 1.006 1.00 0.00 N ATOM 649 CA ASP A 327 12.647 -7.629 1.764 1.00 0.00 C ATOM 650 C ASP A 327 12.160 -8.961 2.348 1.00 0.00 C ATOM 651 O ASP A 327 12.666 -9.436 3.345 1.00 0.00 O ATOM 652 CB ASP A 327 13.116 -6.702 2.894 1.00 0.00 C ATOM 653 CG ASP A 327 14.553 -7.052 3.295 1.00 0.00 C ATOM 654 OD1 ASP A 327 14.730 -8.050 3.975 1.00 0.00 O ATOM 655 OD2 ASP A 327 15.448 -6.317 2.914 1.00 0.00 O ATOM 0 H ASP A 327 11.829 -6.546 0.120 1.00 0.00 H new ATOM 0 HA ASP A 327 13.478 -7.830 1.088 1.00 0.00 H new ATOM 0 HB2 ASP A 327 13.063 -5.663 2.569 1.00 0.00 H new ATOM 0 HB3 ASP A 327 12.455 -6.801 3.755 1.00 0.00 H new ATOM 660 N GLY A 328 11.191 -9.569 1.724 1.00 0.00 N ATOM 661 CA GLY A 328 10.675 -10.876 2.230 1.00 0.00 C ATOM 662 C GLY A 328 9.629 -10.643 3.322 1.00 0.00 C ATOM 663 O GLY A 328 8.610 -11.306 3.365 1.00 0.00 O ATOM 0 H GLY A 328 10.732 -9.219 0.883 1.00 0.00 H new ATOM 0 HA2 GLY A 328 10.235 -11.444 1.410 1.00 0.00 H new ATOM 0 HA3 GLY A 328 11.498 -11.472 2.625 1.00 0.00 H new ATOM 667 N GLU A 329 9.864 -9.715 4.210 1.00 0.00 N ATOM 668 CA GLU A 329 8.880 -9.461 5.291 1.00 0.00 C ATOM 669 C GLU A 329 7.713 -8.649 4.722 1.00 0.00 C ATOM 670 O GLU A 329 7.877 -7.548 4.236 1.00 0.00 O ATOM 671 CB GLU A 329 9.584 -8.709 6.435 1.00 0.00 C ATOM 672 CG GLU A 329 8.604 -7.804 7.185 1.00 0.00 C ATOM 673 CD GLU A 329 9.231 -7.349 8.504 1.00 0.00 C ATOM 674 OE1 GLU A 329 10.181 -6.587 8.453 1.00 0.00 O ATOM 675 OE2 GLU A 329 8.749 -7.771 9.543 1.00 0.00 O ATOM 0 H GLU A 329 10.695 -9.124 4.230 1.00 0.00 H new ATOM 0 HA GLU A 329 8.484 -10.397 5.685 1.00 0.00 H new ATOM 0 HB2 GLU A 329 10.025 -9.425 7.128 1.00 0.00 H new ATOM 0 HB3 GLU A 329 10.401 -8.110 6.032 1.00 0.00 H new ATOM 0 HG2 GLU A 329 8.352 -6.938 6.573 1.00 0.00 H new ATOM 0 HG3 GLU A 329 7.674 -8.339 7.378 1.00 0.00 H new ATOM 682 N THR A 330 6.538 -9.202 4.785 1.00 0.00 N ATOM 683 CA THR A 330 5.333 -8.496 4.257 1.00 0.00 C ATOM 684 C THR A 330 4.703 -7.631 5.353 1.00 0.00 C ATOM 685 O THR A 330 4.768 -7.947 6.524 1.00 0.00 O ATOM 686 CB THR A 330 4.308 -9.525 3.775 1.00 0.00 C ATOM 687 OG1 THR A 330 3.122 -8.856 3.373 1.00 0.00 O ATOM 688 CG2 THR A 330 3.985 -10.503 4.907 1.00 0.00 C ATOM 0 H THR A 330 6.355 -10.123 5.183 1.00 0.00 H new ATOM 0 HA THR A 330 5.635 -7.857 3.427 1.00 0.00 H new ATOM 0 HB THR A 330 4.720 -10.077 2.931 1.00 0.00 H new ATOM 0 HG1 THR A 330 3.348 -8.136 2.748 1.00 0.00 H new ATOM 0 HG21 THR A 330 3.255 -11.234 4.559 1.00 0.00 H new ATOM 0 HG22 THR A 330 4.895 -11.018 5.214 1.00 0.00 H new ATOM 0 HG23 THR A 330 3.574 -9.955 5.755 1.00 0.00 H new ATOM 696 N LYS A 331 4.075 -6.547 4.971 1.00 0.00 N ATOM 697 CA LYS A 331 3.409 -5.647 5.962 1.00 0.00 C ATOM 698 C LYS A 331 2.034 -5.286 5.392 1.00 0.00 C ATOM 699 O LYS A 331 1.733 -5.596 4.257 1.00 0.00 O ATOM 700 CB LYS A 331 4.277 -4.375 6.155 1.00 0.00 C ATOM 701 CG LYS A 331 4.566 -4.126 7.646 1.00 0.00 C ATOM 702 CD LYS A 331 3.285 -3.693 8.366 1.00 0.00 C ATOM 703 CE LYS A 331 3.642 -3.069 9.717 1.00 0.00 C ATOM 704 NZ LYS A 331 2.406 -2.899 10.531 1.00 0.00 N ATOM 0 H LYS A 331 3.995 -6.244 4.001 1.00 0.00 H new ATOM 0 HA LYS A 331 3.295 -6.130 6.932 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.216 -4.485 5.612 1.00 0.00 H new ATOM 0 HB3 LYS A 331 3.763 -3.512 5.731 1.00 0.00 H new ATOM 0 HG2 LYS A 331 4.961 -5.033 8.104 1.00 0.00 H new ATOM 0 HG3 LYS A 331 5.330 -3.356 7.753 1.00 0.00 H new ATOM 0 HD2 LYS A 331 2.738 -2.975 7.756 1.00 0.00 H new ATOM 0 HD3 LYS A 331 2.630 -4.552 8.512 1.00 0.00 H new ATOM 0 HE2 LYS A 331 4.353 -3.704 10.246 1.00 0.00 H new ATOM 0 HE3 LYS A 331 4.126 -2.104 9.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 2.650 -2.475 11.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 1.742 -2.277 10.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 1.962 -3.827 10.686 1.00 0.00 H new ATOM 718 N VAL A 332 1.192 -4.636 6.151 1.00 0.00 N ATOM 719 CA VAL A 332 -0.153 -4.271 5.617 1.00 0.00 C ATOM 720 C VAL A 332 -0.574 -2.908 6.158 1.00 0.00 C ATOM 721 O VAL A 332 -0.022 -2.404 7.115 1.00 0.00 O ATOM 722 CB VAL A 332 -1.170 -5.341 6.013 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.381 -5.264 5.084 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.536 -6.723 5.867 1.00 0.00 C ATOM 0 H VAL A 332 1.375 -4.344 7.111 1.00 0.00 H new ATOM 0 HA VAL A 332 -0.108 -4.214 4.529 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.479 -5.176 7.045 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -3.106 -6.027 5.367 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -2.841 -4.279 5.166 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -2.062 -5.431 4.055 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -1.260 -7.487 6.149 1.00 0.00 H new ATOM 0 HG22 VAL A 332 -0.232 -6.876 4.832 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.337 -6.793 6.516 1.00 0.00 H new ATOM 734 N PHE A 333 -1.538 -2.296 5.522 1.00 0.00 N ATOM 735 CA PHE A 333 -2.000 -0.946 5.951 1.00 0.00 C ATOM 736 C PHE A 333 -3.526 -0.866 5.841 1.00 0.00 C ATOM 737 O PHE A 333 -4.107 -1.236 4.840 1.00 0.00 O ATOM 738 CB PHE A 333 -1.343 0.083 5.033 1.00 0.00 C ATOM 739 CG PHE A 333 0.100 -0.320 4.816 1.00 0.00 C ATOM 740 CD1 PHE A 333 1.024 -0.192 5.861 1.00 0.00 C ATOM 741 CD2 PHE A 333 0.514 -0.826 3.577 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.359 -0.569 5.666 1.00 0.00 C ATOM 743 CE2 PHE A 333 1.850 -1.200 3.383 1.00 0.00 C ATOM 744 CZ PHE A 333 2.771 -1.073 4.429 1.00 0.00 C ATOM 0 H PHE A 333 -2.029 -2.680 4.715 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.724 -0.752 6.987 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.870 0.132 4.080 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.396 1.077 5.478 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.707 0.197 6.817 1.00 0.00 H new ATOM 0 HD2 PHE A 333 -0.197 -0.928 2.771 1.00 0.00 H new ATOM 0 HE1 PHE A 333 3.071 -0.470 6.472 1.00 0.00 H new ATOM 0 HE2 PHE A 333 2.169 -1.586 2.426 1.00 0.00 H new ATOM 0 HZ PHE A 333 3.800 -1.364 4.280 1.00 0.00 H new ATOM 754 N HIS A 334 -4.180 -0.400 6.877 1.00 0.00 N ATOM 755 CA HIS A 334 -5.674 -0.308 6.859 1.00 0.00 C ATOM 756 C HIS A 334 -6.114 1.128 6.542 1.00 0.00 C ATOM 757 O HIS A 334 -7.292 1.415 6.456 1.00 0.00 O ATOM 758 CB HIS A 334 -6.213 -0.719 8.239 1.00 0.00 C ATOM 759 CG HIS A 334 -7.662 -1.120 8.133 1.00 0.00 C ATOM 760 ND1 HIS A 334 -8.353 -1.099 6.931 1.00 0.00 N ATOM 761 CD2 HIS A 334 -8.561 -1.561 9.073 1.00 0.00 C ATOM 762 CE1 HIS A 334 -9.610 -1.516 7.179 1.00 0.00 C ATOM 763 NE2 HIS A 334 -9.789 -1.811 8.469 1.00 0.00 N ATOM 0 H HIS A 334 -3.741 -0.078 7.739 1.00 0.00 H new ATOM 0 HA HIS A 334 -6.069 -0.972 6.090 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.627 -1.548 8.634 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -6.107 0.109 8.940 1.00 0.00 H new ATOM 0 HD1 HIS A 334 -7.978 -0.819 6.025 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -8.347 -1.694 10.123 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -10.379 -1.601 6.426 1.00 0.00 H new ATOM 771 N ASP A 335 -5.187 2.039 6.375 1.00 0.00 N ATOM 772 CA ASP A 335 -5.577 3.455 6.073 1.00 0.00 C ATOM 773 C ASP A 335 -4.522 4.112 5.176 1.00 0.00 C ATOM 774 O ASP A 335 -3.335 3.914 5.343 1.00 0.00 O ATOM 775 CB ASP A 335 -5.692 4.238 7.382 1.00 0.00 C ATOM 776 CG ASP A 335 -6.828 3.658 8.226 1.00 0.00 C ATOM 777 OD1 ASP A 335 -6.561 2.761 9.007 1.00 0.00 O ATOM 778 OD2 ASP A 335 -7.947 4.120 8.073 1.00 0.00 O ATOM 0 H ASP A 335 -4.183 1.867 6.434 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.536 3.459 5.555 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -4.753 4.186 7.933 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -5.881 5.291 7.173 1.00 0.00 H new ATOM 783 N LYS A 336 -4.956 4.898 4.224 1.00 0.00 N ATOM 784 CA LYS A 336 -3.996 5.578 3.305 1.00 0.00 C ATOM 785 C LYS A 336 -2.902 6.281 4.114 1.00 0.00 C ATOM 786 O LYS A 336 -1.760 6.333 3.711 1.00 0.00 O ATOM 787 CB LYS A 336 -4.747 6.609 2.458 1.00 0.00 C ATOM 788 CG LYS A 336 -5.700 7.410 3.350 1.00 0.00 C ATOM 789 CD LYS A 336 -6.342 8.532 2.531 1.00 0.00 C ATOM 790 CE LYS A 336 -7.537 9.105 3.295 1.00 0.00 C ATOM 791 NZ LYS A 336 -8.182 10.173 2.478 1.00 0.00 N ATOM 0 H LYS A 336 -5.940 5.099 4.043 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.535 4.834 2.656 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -4.039 7.279 1.971 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.307 6.108 1.668 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.471 6.756 3.757 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -5.157 7.829 4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -5.612 9.317 2.336 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.666 8.150 1.563 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -8.256 8.315 3.513 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -7.210 9.512 4.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -8.995 10.563 2.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -7.494 10.930 2.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -8.508 9.771 1.576 1.00 0.00 H new ATOM 805 N THR A 337 -3.241 6.822 5.250 1.00 0.00 N ATOM 806 CA THR A 337 -2.217 7.519 6.077 1.00 0.00 C ATOM 807 C THR A 337 -1.164 6.510 6.515 1.00 0.00 C ATOM 808 O THR A 337 0.016 6.678 6.277 1.00 0.00 O ATOM 809 CB THR A 337 -2.884 8.111 7.322 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.803 9.122 6.932 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.818 8.710 8.243 1.00 0.00 C ATOM 0 H THR A 337 -4.183 6.812 5.642 1.00 0.00 H new ATOM 0 HA THR A 337 -1.755 8.315 5.493 1.00 0.00 H new ATOM 0 HB THR A 337 -3.417 7.324 7.856 1.00 0.00 H new ATOM 0 HG1 THR A 337 -4.231 9.500 7.728 1.00 0.00 H new ATOM 0 HG21 THR A 337 -2.296 9.130 9.128 1.00 0.00 H new ATOM 0 HG22 THR A 337 -1.118 7.931 8.544 1.00 0.00 H new ATOM 0 HG23 THR A 337 -1.280 9.496 7.713 1.00 0.00 H new ATOM 819 N LYS A 338 -1.585 5.456 7.152 1.00 0.00 N ATOM 820 CA LYS A 338 -0.627 4.421 7.608 1.00 0.00 C ATOM 821 C LYS A 338 0.318 4.067 6.453 1.00 0.00 C ATOM 822 O LYS A 338 1.487 3.802 6.652 1.00 0.00 O ATOM 823 CB LYS A 338 -1.437 3.197 8.041 1.00 0.00 C ATOM 824 CG LYS A 338 -0.656 2.353 9.055 1.00 0.00 C ATOM 825 CD LYS A 338 -1.613 1.352 9.698 1.00 0.00 C ATOM 826 CE LYS A 338 -0.889 0.589 10.808 1.00 0.00 C ATOM 827 NZ LYS A 338 -1.734 -0.553 11.259 1.00 0.00 N ATOM 0 H LYS A 338 -2.562 5.268 7.377 1.00 0.00 H new ATOM 0 HA LYS A 338 -0.026 4.778 8.444 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -2.381 3.518 8.480 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -1.681 2.591 7.169 1.00 0.00 H new ATOM 0 HG2 LYS A 338 0.162 1.830 8.561 1.00 0.00 H new ATOM 0 HG3 LYS A 338 -0.211 2.993 9.817 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -2.479 1.873 10.106 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -1.985 0.655 8.947 1.00 0.00 H new ATOM 0 HE2 LYS A 338 0.072 0.223 10.446 1.00 0.00 H new ATOM 0 HE3 LYS A 338 -0.681 1.255 11.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 -1.242 -1.072 12.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 -2.640 -0.193 11.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 -1.910 -1.192 10.458 1.00 0.00 H new ATOM 841 N PHE A 339 -0.181 4.079 5.245 1.00 0.00 N ATOM 842 CA PHE A 339 0.690 3.764 4.079 1.00 0.00 C ATOM 843 C PHE A 339 1.814 4.794 4.008 1.00 0.00 C ATOM 844 O PHE A 339 2.972 4.479 4.177 1.00 0.00 O ATOM 845 CB PHE A 339 -0.126 3.818 2.786 1.00 0.00 C ATOM 846 CG PHE A 339 0.691 3.235 1.661 1.00 0.00 C ATOM 847 CD1 PHE A 339 0.664 1.859 1.424 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.481 4.066 0.863 1.00 0.00 C ATOM 849 CE1 PHE A 339 1.432 1.307 0.394 1.00 0.00 C ATOM 850 CE2 PHE A 339 2.246 3.518 -0.173 1.00 0.00 C ATOM 851 CZ PHE A 339 2.224 2.135 -0.408 1.00 0.00 C ATOM 0 H PHE A 339 -1.152 4.293 5.017 1.00 0.00 H new ATOM 0 HA PHE A 339 1.105 2.763 4.197 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -1.055 3.260 2.904 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.400 4.848 2.557 1.00 0.00 H new ATOM 0 HD1 PHE A 339 0.048 1.219 2.038 1.00 0.00 H new ATOM 0 HD2 PHE A 339 1.501 5.130 1.045 1.00 0.00 H new ATOM 0 HE1 PHE A 339 1.414 0.242 0.218 1.00 0.00 H new ATOM 0 HE2 PHE A 339 2.854 4.161 -0.792 1.00 0.00 H new ATOM 0 HZ PHE A 339 2.817 1.711 -1.205 1.00 0.00 H new ATOM 861 N THR A 340 1.481 6.029 3.760 1.00 0.00 N ATOM 862 CA THR A 340 2.546 7.077 3.683 1.00 0.00 C ATOM 863 C THR A 340 3.479 6.944 4.894 1.00 0.00 C ATOM 864 O THR A 340 4.685 6.867 4.758 1.00 0.00 O ATOM 865 CB THR A 340 1.910 8.476 3.679 1.00 0.00 C ATOM 866 OG1 THR A 340 1.799 8.946 5.015 1.00 0.00 O ATOM 867 CG2 THR A 340 0.519 8.419 3.043 1.00 0.00 C ATOM 0 H THR A 340 0.528 6.360 3.608 1.00 0.00 H new ATOM 0 HA THR A 340 3.114 6.942 2.763 1.00 0.00 H new ATOM 0 HB THR A 340 2.539 9.153 3.100 1.00 0.00 H new ATOM 0 HG1 THR A 340 1.395 9.839 5.015 1.00 0.00 H new ATOM 0 HG21 THR A 340 0.077 9.415 3.045 1.00 0.00 H new ATOM 0 HG22 THR A 340 0.603 8.061 2.017 1.00 0.00 H new ATOM 0 HG23 THR A 340 -0.114 7.740 3.614 1.00 0.00 H new ATOM 875 N GLN A 341 2.926 6.904 6.074 1.00 0.00 N ATOM 876 CA GLN A 341 3.768 6.764 7.301 1.00 0.00 C ATOM 877 C GLN A 341 4.683 5.552 7.151 1.00 0.00 C ATOM 878 O GLN A 341 5.856 5.609 7.462 1.00 0.00 O ATOM 879 CB GLN A 341 2.859 6.575 8.520 1.00 0.00 C ATOM 880 CG GLN A 341 1.892 7.763 8.634 1.00 0.00 C ATOM 881 CD GLN A 341 2.627 8.971 9.220 1.00 0.00 C ATOM 882 OE1 GLN A 341 3.672 8.829 9.824 1.00 0.00 O ATOM 883 NE2 GLN A 341 2.122 10.165 9.065 1.00 0.00 N ATOM 0 H GLN A 341 1.922 6.962 6.245 1.00 0.00 H new ATOM 0 HA GLN A 341 4.374 7.660 7.436 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.298 5.645 8.427 1.00 0.00 H new ATOM 0 HB3 GLN A 341 3.461 6.495 9.425 1.00 0.00 H new ATOM 0 HG2 GLN A 341 1.488 8.012 7.652 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.046 7.497 9.268 1.00 0.00 H new ATOM 0 HE21 GLN A 341 1.245 10.286 8.558 1.00 0.00 H new ATOM 0 HE22 GLN A 341 2.604 10.977 9.451 1.00 0.00 H new ATOM 892 N TYR A 342 4.165 4.458 6.670 1.00 0.00 N ATOM 893 CA TYR A 342 5.025 3.256 6.497 1.00 0.00 C ATOM 894 C TYR A 342 6.201 3.622 5.586 1.00 0.00 C ATOM 895 O TYR A 342 7.285 3.085 5.704 1.00 0.00 O ATOM 896 CB TYR A 342 4.209 2.118 5.887 1.00 0.00 C ATOM 897 CG TYR A 342 5.125 0.967 5.551 1.00 0.00 C ATOM 898 CD1 TYR A 342 5.607 0.131 6.565 1.00 0.00 C ATOM 899 CD2 TYR A 342 5.496 0.743 4.223 1.00 0.00 C ATOM 900 CE1 TYR A 342 6.459 -0.934 6.247 1.00 0.00 C ATOM 901 CE2 TYR A 342 6.349 -0.321 3.903 1.00 0.00 C ATOM 902 CZ TYR A 342 6.831 -1.159 4.915 1.00 0.00 C ATOM 903 OH TYR A 342 7.672 -2.207 4.600 1.00 0.00 O ATOM 0 H TYR A 342 3.191 4.344 6.391 1.00 0.00 H new ATOM 0 HA TYR A 342 5.404 2.924 7.463 1.00 0.00 H new ATOM 0 HB2 TYR A 342 3.439 1.792 6.587 1.00 0.00 H new ATOM 0 HB3 TYR A 342 3.697 2.464 4.989 1.00 0.00 H new ATOM 0 HD1 TYR A 342 5.322 0.307 7.592 1.00 0.00 H new ATOM 0 HD2 TYR A 342 5.125 1.391 3.442 1.00 0.00 H new ATOM 0 HE1 TYR A 342 6.829 -1.582 7.028 1.00 0.00 H new ATOM 0 HE2 TYR A 342 6.635 -0.495 2.876 1.00 0.00 H new ATOM 0 HH TYR A 342 7.543 -2.935 5.244 1.00 0.00 H new ATOM 913 N LEU A 343 6.002 4.548 4.684 1.00 0.00 N ATOM 914 CA LEU A 343 7.118 4.966 3.783 1.00 0.00 C ATOM 915 C LEU A 343 7.980 5.999 4.499 1.00 0.00 C ATOM 916 O LEU A 343 9.194 5.938 4.462 1.00 0.00 O ATOM 917 CB LEU A 343 6.575 5.603 2.502 1.00 0.00 C ATOM 918 CG LEU A 343 5.807 4.584 1.648 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.437 5.244 0.318 1.00 0.00 C ATOM 920 CD2 LEU A 343 6.675 3.346 1.369 1.00 0.00 C ATOM 0 H LEU A 343 5.117 5.032 4.532 1.00 0.00 H new ATOM 0 HA LEU A 343 7.701 4.081 3.527 1.00 0.00 H new ATOM 0 HB2 LEU A 343 5.917 6.434 2.758 1.00 0.00 H new ATOM 0 HB3 LEU A 343 7.400 6.017 1.922 1.00 0.00 H new ATOM 0 HG LEU A 343 4.913 4.269 2.185 1.00 0.00 H new ATOM 0 HD11 LEU A 343 4.890 4.533 -0.301 1.00 0.00 H new ATOM 0 HD12 LEU A 343 4.812 6.117 0.506 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.345 5.553 -0.200 1.00 0.00 H new ATOM 0 HD21 LEU A 343 6.112 2.636 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 343 7.576 3.646 0.834 1.00 0.00 H new ATOM 0 HD23 LEU A 343 6.953 2.876 2.313 1.00 0.00 H new ATOM 932 N SER A 344 7.369 6.950 5.151 1.00 0.00 N ATOM 933 CA SER A 344 8.168 7.977 5.872 1.00 0.00 C ATOM 934 C SER A 344 9.219 7.262 6.718 1.00 0.00 C ATOM 935 O SER A 344 10.265 7.799 7.024 1.00 0.00 O ATOM 936 CB SER A 344 7.251 8.798 6.780 1.00 0.00 C ATOM 937 OG SER A 344 7.085 8.118 8.018 1.00 0.00 O ATOM 0 H SER A 344 6.357 7.059 5.215 1.00 0.00 H new ATOM 0 HA SER A 344 8.650 8.646 5.159 1.00 0.00 H new ATOM 0 HB2 SER A 344 7.678 9.787 6.949 1.00 0.00 H new ATOM 0 HB3 SER A 344 6.283 8.946 6.301 1.00 0.00 H new ATOM 0 HG SER A 344 6.662 7.249 7.859 1.00 0.00 H new ATOM 943 N THR A 345 8.938 6.035 7.086 1.00 0.00 N ATOM 944 CA THR A 345 9.901 5.243 7.904 1.00 0.00 C ATOM 945 C THR A 345 10.638 4.239 7.001 1.00 0.00 C ATOM 946 O THR A 345 11.405 3.422 7.469 1.00 0.00 O ATOM 947 CB THR A 345 9.135 4.525 9.028 1.00 0.00 C ATOM 948 OG1 THR A 345 10.060 3.916 9.920 1.00 0.00 O ATOM 949 CG2 THR A 345 8.200 3.460 8.457 1.00 0.00 C ATOM 0 H THR A 345 8.074 5.547 6.851 1.00 0.00 H new ATOM 0 HA THR A 345 10.644 5.900 8.356 1.00 0.00 H new ATOM 0 HB THR A 345 8.535 5.262 9.562 1.00 0.00 H new ATOM 0 HG1 THR A 345 10.835 3.590 9.416 1.00 0.00 H new ATOM 0 HG21 THR A 345 7.670 2.967 9.272 1.00 0.00 H new ATOM 0 HG22 THR A 345 7.480 3.930 7.787 1.00 0.00 H new ATOM 0 HG23 THR A 345 8.783 2.723 7.904 1.00 0.00 H new ATOM 957 N ASN A 346 10.418 4.302 5.704 1.00 0.00 N ATOM 958 CA ASN A 346 11.115 3.364 4.763 1.00 0.00 C ATOM 959 C ASN A 346 11.549 4.156 3.525 1.00 0.00 C ATOM 960 O ASN A 346 10.974 4.032 2.461 1.00 0.00 O ATOM 961 CB ASN A 346 10.163 2.235 4.345 1.00 0.00 C ATOM 962 CG ASN A 346 10.968 1.074 3.755 1.00 0.00 C ATOM 963 OD1 ASN A 346 11.770 0.466 4.436 1.00 0.00 O ATOM 964 ND2 ASN A 346 10.788 0.742 2.505 1.00 0.00 N ATOM 0 H ASN A 346 9.784 4.965 5.258 1.00 0.00 H new ATOM 0 HA ASN A 346 11.983 2.924 5.254 1.00 0.00 H new ATOM 0 HB2 ASN A 346 9.590 1.892 5.206 1.00 0.00 H new ATOM 0 HB3 ASN A 346 9.446 2.603 3.611 1.00 0.00 H new ATOM 0 HD21 ASN A 346 11.321 -0.028 2.100 1.00 0.00 H new ATOM 0 HD22 ASN A 346 10.115 1.253 1.934 1.00 0.00 H new ATOM 971 N PRO A 347 12.553 4.976 3.678 1.00 0.00 N ATOM 972 CA PRO A 347 13.087 5.832 2.575 1.00 0.00 C ATOM 973 C PRO A 347 13.337 5.050 1.278 1.00 0.00 C ATOM 974 O PRO A 347 13.258 5.591 0.194 1.00 0.00 O ATOM 975 CB PRO A 347 14.405 6.373 3.150 1.00 0.00 C ATOM 976 CG PRO A 347 14.195 6.384 4.628 1.00 0.00 C ATOM 977 CD PRO A 347 13.299 5.182 4.932 1.00 0.00 C ATOM 0 HA PRO A 347 12.379 6.611 2.290 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.248 5.739 2.874 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.621 7.373 2.773 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.144 6.308 5.158 1.00 0.00 H new ATOM 0 HG3 PRO A 347 13.724 7.313 4.949 1.00 0.00 H new ATOM 0 HD2 PRO A 347 13.885 4.303 5.198 1.00 0.00 H new ATOM 0 HD3 PRO A 347 12.629 5.383 5.768 1.00 0.00 H new ATOM 985 N ALA A 348 13.646 3.789 1.377 1.00 0.00 N ATOM 986 CA ALA A 348 13.909 2.989 0.146 1.00 0.00 C ATOM 987 C ALA A 348 12.743 3.136 -0.837 1.00 0.00 C ATOM 988 O ALA A 348 12.930 3.459 -1.996 1.00 0.00 O ATOM 989 CB ALA A 348 14.073 1.515 0.521 1.00 0.00 C ATOM 0 H ALA A 348 13.728 3.276 2.255 1.00 0.00 H new ATOM 0 HA ALA A 348 14.822 3.353 -0.326 1.00 0.00 H new ATOM 0 HB1 ALA A 348 14.265 0.930 -0.378 1.00 0.00 H new ATOM 0 HB2 ALA A 348 14.910 1.406 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 348 13.161 1.157 0.998 1.00 0.00 H new ATOM 995 N LEU A 349 11.541 2.894 -0.392 1.00 0.00 N ATOM 996 CA LEU A 349 10.377 3.008 -1.314 1.00 0.00 C ATOM 997 C LEU A 349 10.087 4.490 -1.599 1.00 0.00 C ATOM 998 O LEU A 349 9.435 4.813 -2.566 1.00 0.00 O ATOM 999 CB LEU A 349 9.135 2.328 -0.684 1.00 0.00 C ATOM 1000 CG LEU A 349 8.898 0.928 -1.285 1.00 0.00 C ATOM 1001 CD1 LEU A 349 7.693 0.283 -0.586 1.00 0.00 C ATOM 1002 CD2 LEU A 349 8.622 1.028 -2.803 1.00 0.00 C ATOM 0 H LEU A 349 11.315 2.624 0.565 1.00 0.00 H new ATOM 0 HA LEU A 349 10.610 2.506 -2.253 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.271 2.245 0.394 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.255 2.950 -0.847 1.00 0.00 H new ATOM 0 HG LEU A 349 9.790 0.320 -1.134 1.00 0.00 H new ATOM 0 HD11 LEU A 349 7.517 -0.708 -1.004 1.00 0.00 H new ATOM 0 HD12 LEU A 349 7.895 0.196 0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 349 6.809 0.903 -0.738 1.00 0.00 H new ATOM 0 HD21 LEU A 349 8.457 0.030 -3.209 1.00 0.00 H new ATOM 0 HD22 LEU A 349 7.736 1.640 -2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 349 9.478 1.485 -3.299 1.00 0.00 H new ATOM 1014 N GLN A 350 10.551 5.393 -0.778 1.00 0.00 N ATOM 1015 CA GLN A 350 10.272 6.834 -1.052 1.00 0.00 C ATOM 1016 C GLN A 350 10.952 7.233 -2.364 1.00 0.00 C ATOM 1017 O GLN A 350 10.379 7.918 -3.186 1.00 0.00 O ATOM 1018 CB GLN A 350 10.805 7.708 0.088 1.00 0.00 C ATOM 1019 CG GLN A 350 9.942 7.522 1.339 1.00 0.00 C ATOM 1020 CD GLN A 350 10.262 8.629 2.346 1.00 0.00 C ATOM 1021 OE1 GLN A 350 11.358 8.698 2.866 1.00 0.00 O ATOM 1022 NE2 GLN A 350 9.343 9.505 2.648 1.00 0.00 N ATOM 0 H GLN A 350 11.103 5.201 0.058 1.00 0.00 H new ATOM 0 HA GLN A 350 9.195 6.981 -1.129 1.00 0.00 H new ATOM 0 HB2 GLN A 350 11.839 7.443 0.307 1.00 0.00 H new ATOM 0 HB3 GLN A 350 10.801 8.755 -0.214 1.00 0.00 H new ATOM 0 HG2 GLN A 350 8.885 7.551 1.073 1.00 0.00 H new ATOM 0 HG3 GLN A 350 10.132 6.545 1.783 1.00 0.00 H new ATOM 0 HE21 GLN A 350 8.422 9.449 2.213 1.00 0.00 H new ATOM 0 HE22 GLN A 350 9.545 10.246 3.319 1.00 0.00 H new ATOM 1031 N ARG A 351 12.170 6.803 -2.574 1.00 0.00 N ATOM 1032 CA ARG A 351 12.870 7.154 -3.842 1.00 0.00 C ATOM 1033 C ARG A 351 12.139 6.486 -5.006 1.00 0.00 C ATOM 1034 O ARG A 351 11.871 7.097 -6.022 1.00 0.00 O ATOM 1035 CB ARG A 351 14.318 6.653 -3.796 1.00 0.00 C ATOM 1036 CG ARG A 351 14.923 6.968 -2.430 1.00 0.00 C ATOM 1037 CD ARG A 351 16.408 6.600 -2.429 1.00 0.00 C ATOM 1038 NE ARG A 351 17.173 7.605 -3.220 1.00 0.00 N ATOM 1039 CZ ARG A 351 18.471 7.675 -3.102 1.00 0.00 C ATOM 1040 NH1 ARG A 351 19.098 6.868 -2.291 1.00 0.00 N ATOM 1041 NH2 ARG A 351 19.144 8.552 -3.797 1.00 0.00 N ATOM 0 H ARG A 351 12.706 6.227 -1.925 1.00 0.00 H new ATOM 0 HA ARG A 351 12.874 8.236 -3.971 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.348 5.579 -3.980 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.904 7.128 -4.583 1.00 0.00 H new ATOM 0 HG2 ARG A 351 14.800 8.027 -2.202 1.00 0.00 H new ATOM 0 HG3 ARG A 351 14.400 6.412 -1.652 1.00 0.00 H new ATOM 0 HD2 ARG A 351 16.784 6.565 -1.406 1.00 0.00 H new ATOM 0 HD3 ARG A 351 16.547 5.606 -2.854 1.00 0.00 H new ATOM 0 HE ARG A 351 16.683 8.237 -3.853 1.00 0.00 H new ATOM 0 HH11 ARG A 351 18.574 6.182 -1.748 1.00 0.00 H new ATOM 0 HH12 ARG A 351 20.112 6.924 -2.200 1.00 0.00 H new ATOM 0 HH21 ARG A 351 18.655 9.183 -4.432 1.00 0.00 H new ATOM 0 HH22 ARG A 351 20.158 8.606 -3.704 1.00 0.00 H new ATOM 1055 N ILE A 352 11.812 5.232 -4.859 1.00 0.00 N ATOM 1056 CA ILE A 352 11.091 4.512 -5.948 1.00 0.00 C ATOM 1057 C ILE A 352 9.626 4.938 -5.949 1.00 0.00 C ATOM 1058 O ILE A 352 8.908 4.736 -6.909 1.00 0.00 O ATOM 1059 CB ILE A 352 11.185 3.001 -5.718 1.00 0.00 C ATOM 1060 CG1 ILE A 352 12.623 2.621 -5.354 1.00 0.00 C ATOM 1061 CG2 ILE A 352 10.780 2.262 -6.996 1.00 0.00 C ATOM 1062 CD1 ILE A 352 12.702 1.115 -5.095 1.00 0.00 C ATOM 0 H ILE A 352 12.013 4.673 -4.030 1.00 0.00 H new ATOM 0 HA ILE A 352 11.544 4.757 -6.908 1.00 0.00 H new ATOM 0 HB ILE A 352 10.517 2.722 -4.903 1.00 0.00 H new ATOM 0 HG12 ILE A 352 13.300 2.898 -6.163 1.00 0.00 H new ATOM 0 HG13 ILE A 352 12.943 3.170 -4.469 1.00 0.00 H new ATOM 0 HG21 ILE A 352 10.847 1.187 -6.831 1.00 0.00 H new ATOM 0 HG22 ILE A 352 9.756 2.525 -7.260 1.00 0.00 H new ATOM 0 HG23 ILE A 352 11.448 2.547 -7.808 1.00 0.00 H new ATOM 0 HD11 ILE A 352 13.725 0.844 -4.836 1.00 0.00 H new ATOM 0 HD12 ILE A 352 12.037 0.852 -4.272 1.00 0.00 H new ATOM 0 HD13 ILE A 352 12.400 0.575 -5.992 1.00 0.00 H new ATOM 1074 N ILE A 353 9.168 5.517 -4.874 1.00 0.00 N ATOM 1075 CA ILE A 353 7.749 5.940 -4.802 1.00 0.00 C ATOM 1076 C ILE A 353 7.625 7.099 -3.797 1.00 0.00 C ATOM 1077 O ILE A 353 7.541 8.250 -4.174 1.00 0.00 O ATOM 1078 CB ILE A 353 6.900 4.704 -4.380 1.00 0.00 C ATOM 1079 CG1 ILE A 353 5.760 4.495 -5.381 1.00 0.00 C ATOM 1080 CG2 ILE A 353 6.303 4.860 -2.972 1.00 0.00 C ATOM 1081 CD1 ILE A 353 4.918 5.778 -5.507 1.00 0.00 C ATOM 0 H ILE A 353 9.721 5.715 -4.040 1.00 0.00 H new ATOM 0 HA ILE A 353 7.384 6.298 -5.765 1.00 0.00 H new ATOM 0 HB ILE A 353 7.568 3.842 -4.370 1.00 0.00 H new ATOM 0 HG12 ILE A 353 6.167 4.222 -6.355 1.00 0.00 H new ATOM 0 HG13 ILE A 353 5.129 3.668 -5.056 1.00 0.00 H new ATOM 0 HG21 ILE A 353 5.720 3.973 -2.724 1.00 0.00 H new ATOM 0 HG22 ILE A 353 7.108 4.980 -2.247 1.00 0.00 H new ATOM 0 HG23 ILE A 353 5.657 5.738 -2.946 1.00 0.00 H new ATOM 0 HD11 ILE A 353 4.111 5.615 -6.222 1.00 0.00 H new ATOM 0 HD12 ILE A 353 4.496 6.033 -4.535 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.550 6.596 -5.854 1.00 0.00 H new TER 1093 ILE A 353