USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 785 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 NoAdj-H: A 362 HIS HE2 : A 362 HIS NE2 : A 440 ZNZN :(H bumps) USER MOD NoAdj-H: A 393 HIS HE2 : A 393 HIS NE2 : A 441 ZNZN :(H bumps) USER MOD NoAdj-H: A 417 HIS HE2 : A 417 HIS NE2 : A 442 ZNZN :(H bumps) USER MOD Set 1.1: A 416 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 420 ASN : amide:sc= 0.814 K(o=0.81,f=0) USER MOD Set 2.1: A 395 THR OG1 : rot -37:sc= 0.947 USER MOD Set 2.2: A 396 HIS : no HE2:sc= 0.535 K(o=1.5,f=-1.7!) USER MOD Set 3.1: A 394 MET CE :methyl -179:sc= -0.402 (180deg=-0.0188) USER MOD Set 3.2: A 411 SER OG : rot -170:sc= -0.498 USER MOD Set 4.1: A 356 GLN : amide:sc= 0.963 K(o=0.76,f=-0.28) USER MOD Set 4.2: A 387 MET CE :methyl 170:sc= -0.207 (180deg=-0.284) USER MOD Set 5.1: A 344 THR OG1 : rot 160:sc= 0.545 USER MOD Set 5.2: A 349 LYS NZ :NH3+ -161:sc= 2.23 (180deg=1.52) USER MOD Single : A 341 THR OG1 : rot 180:sc= 0.00176 USER MOD Single : A 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 354 GLN : amide:sc= 0.124 X(o=0.12,f=0) USER MOD Single : A 355 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 364 HIS : no HE2:sc= 0.925 K(o=0.92,f=-4.4!) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 367 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 371 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 373 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 380 SER OG : rot 180:sc= 0 USER MOD Single : A 383 HIS : no HE2:sc= 0.153 K(o=0.15,f=-1.3) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 388 LYS NZ :NH3+ -172:sc= 0.817 (180deg=0.535) USER MOD Single : A 389 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 392 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.13) USER MOD Single : A 407 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 410 SER OG : rot 89:sc= 0.0165 USER MOD Single : A 413 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 419 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000574) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0.00285 USER MOD Single : A 424 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.5!) USER MOD Single : A 433 LYS NZ :NH3+ -129:sc= 1.04 (180deg=0.0192) USER MOD Single : A 434 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 436 SER OG : rot 82:sc= 0.471 USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 340 12.176 -13.477 11.853 1.00 0.00 N ATOM 2 CA ALA A 340 13.141 -14.323 11.111 1.00 0.00 C ATOM 3 C ALA A 340 12.718 -14.513 9.658 1.00 0.00 C ATOM 4 O ALA A 340 11.564 -14.823 9.365 1.00 0.00 O ATOM 5 CB ALA A 340 13.341 -15.702 11.777 1.00 0.00 C ATOM 0 HA ALA A 340 14.092 -13.791 11.136 1.00 0.00 H new ATOM 0 HB1 ALA A 340 14.056 -16.286 11.197 1.00 0.00 H new ATOM 0 HB2 ALA A 340 13.720 -15.565 12.790 1.00 0.00 H new ATOM 0 HB3 ALA A 340 12.388 -16.230 11.814 1.00 0.00 H new ATOM 13 N THR A 341 13.680 -14.385 8.741 1.00 0.00 N ATOM 14 CA THR A 341 13.528 -14.614 7.289 1.00 0.00 C ATOM 15 C THR A 341 13.398 -16.108 6.933 1.00 0.00 C ATOM 16 O THR A 341 13.128 -16.460 5.782 1.00 0.00 O ATOM 17 CB THR A 341 14.742 -14.019 6.558 1.00 0.00 C ATOM 18 OG1 THR A 341 15.935 -14.579 7.071 1.00 0.00 O ATOM 19 CG2 THR A 341 14.826 -12.504 6.769 1.00 0.00 C ATOM 0 H THR A 341 14.629 -14.108 8.993 1.00 0.00 H new ATOM 0 HA THR A 341 12.605 -14.126 6.974 1.00 0.00 H new ATOM 0 HB THR A 341 14.624 -14.243 5.498 1.00 0.00 H new ATOM 0 HG1 THR A 341 16.705 -14.197 6.600 1.00 0.00 H new ATOM 0 HG21 THR A 341 15.694 -12.111 6.240 1.00 0.00 H new ATOM 0 HG22 THR A 341 13.922 -12.032 6.383 1.00 0.00 H new ATOM 0 HG23 THR A 341 14.921 -12.290 7.833 1.00 0.00 H new ATOM 27 N GLY A 342 13.590 -16.980 7.930 1.00 0.00 N ATOM 28 CA GLY A 342 13.517 -18.436 7.903 1.00 0.00 C ATOM 29 C GLY A 342 12.165 -19.059 7.517 1.00 0.00 C ATOM 30 O GLY A 342 11.207 -18.360 7.171 1.00 0.00 O ATOM 0 H GLY A 342 13.823 -16.645 8.865 1.00 0.00 H new ATOM 0 HA2 GLY A 342 14.270 -18.800 7.204 1.00 0.00 H new ATOM 0 HA3 GLY A 342 13.792 -18.808 8.890 1.00 0.00 H new ATOM 34 N PRO A 343 12.065 -20.395 7.635 1.00 0.00 N ATOM 35 CA PRO A 343 10.850 -21.179 7.381 1.00 0.00 C ATOM 36 C PRO A 343 9.771 -21.023 8.479 1.00 0.00 C ATOM 37 O PRO A 343 8.721 -21.667 8.416 1.00 0.00 O ATOM 38 CB PRO A 343 11.354 -22.627 7.300 1.00 0.00 C ATOM 39 CG PRO A 343 12.540 -22.644 8.267 1.00 0.00 C ATOM 40 CD PRO A 343 13.156 -21.261 8.066 1.00 0.00 C ATOM 0 HA PRO A 343 10.349 -20.842 6.474 1.00 0.00 H new ATOM 0 HB2 PRO A 343 10.583 -23.338 7.597 1.00 0.00 H new ATOM 0 HB3 PRO A 343 11.658 -22.891 6.287 1.00 0.00 H new ATOM 0 HG2 PRO A 343 12.220 -22.799 9.297 1.00 0.00 H new ATOM 0 HG3 PRO A 343 13.245 -23.440 8.029 1.00 0.00 H new ATOM 0 HD2 PRO A 343 13.603 -20.895 8.990 1.00 0.00 H new ATOM 0 HD3 PRO A 343 13.949 -21.292 7.318 1.00 0.00 H new ATOM 48 N THR A 344 10.030 -20.197 9.500 1.00 0.00 N ATOM 49 CA THR A 344 9.167 -19.939 10.665 1.00 0.00 C ATOM 50 C THR A 344 7.754 -19.435 10.328 1.00 0.00 C ATOM 51 O THR A 344 7.538 -18.779 9.305 1.00 0.00 O ATOM 52 CB THR A 344 9.833 -18.920 11.607 1.00 0.00 C ATOM 53 OG1 THR A 344 10.166 -17.741 10.901 1.00 0.00 O ATOM 54 CG2 THR A 344 11.121 -19.454 12.235 1.00 0.00 C ATOM 0 H THR A 344 10.896 -19.659 9.540 1.00 0.00 H new ATOM 0 HA THR A 344 9.048 -20.912 11.141 1.00 0.00 H new ATOM 0 HB THR A 344 9.107 -18.720 12.395 1.00 0.00 H new ATOM 0 HG1 THR A 344 10.283 -17.002 11.534 1.00 0.00 H new ATOM 0 HG21 THR A 344 11.549 -18.695 12.890 1.00 0.00 H new ATOM 0 HG22 THR A 344 10.899 -20.350 12.815 1.00 0.00 H new ATOM 0 HG23 THR A 344 11.835 -19.699 11.449 1.00 0.00 H new ATOM 62 N ALA A 345 6.799 -19.695 11.230 1.00 0.00 N ATOM 63 CA ALA A 345 5.391 -19.268 11.146 1.00 0.00 C ATOM 64 C ALA A 345 4.879 -18.635 12.469 1.00 0.00 C ATOM 65 O ALA A 345 3.673 -18.515 12.694 1.00 0.00 O ATOM 66 CB ALA A 345 4.553 -20.474 10.696 1.00 0.00 C ATOM 0 H ALA A 345 6.992 -20.232 12.076 1.00 0.00 H new ATOM 0 HA ALA A 345 5.295 -18.470 10.410 1.00 0.00 H new ATOM 0 HB1 ALA A 345 3.505 -20.183 10.626 1.00 0.00 H new ATOM 0 HB2 ALA A 345 4.901 -20.815 9.721 1.00 0.00 H new ATOM 0 HB3 ALA A 345 4.658 -21.281 11.421 1.00 0.00 H new ATOM 72 N ASP A 346 5.806 -18.238 13.346 1.00 0.00 N ATOM 73 CA ASP A 346 5.598 -17.603 14.658 1.00 0.00 C ATOM 74 C ASP A 346 4.799 -16.280 14.574 1.00 0.00 C ATOM 75 O ASP A 346 4.911 -15.593 13.556 1.00 0.00 O ATOM 76 CB ASP A 346 7.013 -17.317 15.197 1.00 0.00 C ATOM 77 CG ASP A 346 7.040 -16.773 16.633 1.00 0.00 C ATOM 78 OD1 ASP A 346 6.850 -15.549 16.817 1.00 0.00 O ATOM 79 OD2 ASP A 346 7.249 -17.575 17.575 1.00 0.00 O ATOM 0 H ASP A 346 6.799 -18.360 13.145 1.00 0.00 H new ATOM 0 HA ASP A 346 5.012 -18.260 15.301 1.00 0.00 H new ATOM 0 HB2 ASP A 346 7.598 -18.236 15.157 1.00 0.00 H new ATOM 0 HB3 ASP A 346 7.502 -16.599 14.539 1.00 0.00 H new ATOM 84 N PRO A 347 4.025 -15.863 15.599 1.00 0.00 N ATOM 85 CA PRO A 347 3.323 -14.573 15.612 1.00 0.00 C ATOM 86 C PRO A 347 4.149 -13.356 15.163 1.00 0.00 C ATOM 87 O PRO A 347 3.592 -12.475 14.518 1.00 0.00 O ATOM 88 CB PRO A 347 2.804 -14.399 17.042 1.00 0.00 C ATOM 89 CG PRO A 347 2.586 -15.838 17.500 1.00 0.00 C ATOM 90 CD PRO A 347 3.743 -16.583 16.835 1.00 0.00 C ATOM 0 HA PRO A 347 2.528 -14.604 14.867 1.00 0.00 H new ATOM 0 HB2 PRO A 347 3.524 -13.878 17.673 1.00 0.00 H new ATOM 0 HB3 PRO A 347 1.880 -13.821 17.069 1.00 0.00 H new ATOM 0 HG2 PRO A 347 2.619 -15.926 18.586 1.00 0.00 H new ATOM 0 HG3 PRO A 347 1.618 -16.223 17.178 1.00 0.00 H new ATOM 0 HD2 PRO A 347 4.619 -16.603 17.484 1.00 0.00 H new ATOM 0 HD3 PRO A 347 3.474 -17.619 16.631 1.00 0.00 H new ATOM 98 N GLU A 348 5.463 -13.296 15.419 1.00 0.00 N ATOM 99 CA GLU A 348 6.332 -12.200 14.944 1.00 0.00 C ATOM 100 C GLU A 348 6.357 -12.116 13.409 1.00 0.00 C ATOM 101 O GLU A 348 6.327 -11.031 12.827 1.00 0.00 O ATOM 102 CB GLU A 348 7.746 -12.295 15.549 1.00 0.00 C ATOM 103 CG GLU A 348 8.623 -13.472 15.077 1.00 0.00 C ATOM 104 CD GLU A 348 9.607 -13.108 13.948 1.00 0.00 C ATOM 105 OE1 GLU A 348 10.491 -12.242 14.149 1.00 0.00 O ATOM 106 OE2 GLU A 348 9.566 -13.744 12.869 1.00 0.00 O ATOM 0 H GLU A 348 5.958 -14.004 15.961 1.00 0.00 H new ATOM 0 HA GLU A 348 5.900 -11.264 15.299 1.00 0.00 H new ATOM 0 HB2 GLU A 348 8.274 -11.367 15.328 1.00 0.00 H new ATOM 0 HB3 GLU A 348 7.649 -12.356 16.633 1.00 0.00 H new ATOM 0 HG2 GLU A 348 9.187 -13.855 15.927 1.00 0.00 H new ATOM 0 HG3 GLU A 348 7.976 -14.279 14.734 1.00 0.00 H new ATOM 113 N LYS A 349 6.298 -13.275 12.749 1.00 0.00 N ATOM 114 CA LYS A 349 6.210 -13.417 11.303 1.00 0.00 C ATOM 115 C LYS A 349 4.894 -12.807 10.848 1.00 0.00 C ATOM 116 O LYS A 349 4.901 -11.933 9.999 1.00 0.00 O ATOM 117 CB LYS A 349 6.330 -14.912 10.944 1.00 0.00 C ATOM 118 CG LYS A 349 6.774 -15.187 9.501 1.00 0.00 C ATOM 119 CD LYS A 349 8.188 -14.661 9.202 1.00 0.00 C ATOM 120 CE LYS A 349 8.828 -15.353 7.990 1.00 0.00 C ATOM 121 NZ LYS A 349 9.252 -16.736 8.320 1.00 0.00 N ATOM 0 H LYS A 349 6.311 -14.174 13.232 1.00 0.00 H new ATOM 0 HA LYS A 349 7.018 -12.894 10.791 1.00 0.00 H new ATOM 0 HB2 LYS A 349 7.041 -15.380 11.625 1.00 0.00 H new ATOM 0 HB3 LYS A 349 5.365 -15.391 11.111 1.00 0.00 H new ATOM 0 HG2 LYS A 349 6.744 -16.261 9.315 1.00 0.00 H new ATOM 0 HG3 LYS A 349 6.066 -14.724 8.813 1.00 0.00 H new ATOM 0 HD2 LYS A 349 8.142 -13.587 9.021 1.00 0.00 H new ATOM 0 HD3 LYS A 349 8.820 -14.810 10.077 1.00 0.00 H new ATOM 0 HE2 LYS A 349 8.117 -15.376 7.164 1.00 0.00 H new ATOM 0 HE3 LYS A 349 9.690 -14.777 7.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 9.949 -17.062 7.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 9.680 -16.751 9.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 8.425 -17.366 8.304 1.00 0.00 H new ATOM 135 N ARG A 350 3.776 -13.195 11.471 1.00 0.00 N ATOM 136 CA ARG A 350 2.419 -12.674 11.207 1.00 0.00 C ATOM 137 C ARG A 350 2.380 -11.148 11.159 1.00 0.00 C ATOM 138 O ARG A 350 1.975 -10.602 10.134 1.00 0.00 O ATOM 139 CB ARG A 350 1.392 -13.250 12.212 1.00 0.00 C ATOM 140 CG ARG A 350 1.489 -14.762 12.475 1.00 0.00 C ATOM 141 CD ARG A 350 1.107 -15.640 11.287 1.00 0.00 C ATOM 142 NE ARG A 350 1.397 -17.056 11.588 1.00 0.00 N ATOM 143 CZ ARG A 350 0.646 -18.116 11.360 1.00 0.00 C ATOM 144 NH1 ARG A 350 -0.512 -18.054 10.762 1.00 0.00 N ATOM 145 NH2 ARG A 350 1.072 -19.282 11.746 1.00 0.00 N ATOM 0 H ARG A 350 3.786 -13.907 12.201 1.00 0.00 H new ATOM 0 HA ARG A 350 2.132 -13.017 10.213 1.00 0.00 H new ATOM 0 HB2 ARG A 350 1.508 -12.727 13.161 1.00 0.00 H new ATOM 0 HB3 ARG A 350 0.390 -13.027 11.846 1.00 0.00 H new ATOM 0 HG2 ARG A 350 2.510 -15.001 12.773 1.00 0.00 H new ATOM 0 HG3 ARG A 350 0.844 -15.013 13.317 1.00 0.00 H new ATOM 0 HD2 ARG A 350 0.048 -15.518 11.060 1.00 0.00 H new ATOM 0 HD3 ARG A 350 1.660 -15.328 10.401 1.00 0.00 H new ATOM 0 HE ARG A 350 2.297 -17.239 12.031 1.00 0.00 H new ATOM 0 HH11 ARG A 350 -0.876 -17.155 10.446 1.00 0.00 H new ATOM 0 HH12 ARG A 350 -1.054 -18.905 10.610 1.00 0.00 H new ATOM 0 HH21 ARG A 350 1.973 -19.366 12.216 1.00 0.00 H new ATOM 0 HH22 ARG A 350 0.505 -20.113 11.578 1.00 0.00 H new ATOM 159 N LYS A 351 2.822 -10.471 12.225 1.00 0.00 N ATOM 160 CA LYS A 351 2.851 -8.991 12.322 1.00 0.00 C ATOM 161 C LYS A 351 3.805 -8.337 11.324 1.00 0.00 C ATOM 162 O LYS A 351 3.362 -7.475 10.565 1.00 0.00 O ATOM 163 CB LYS A 351 3.135 -8.456 13.744 1.00 0.00 C ATOM 164 CG LYS A 351 3.582 -9.507 14.758 1.00 0.00 C ATOM 165 CD LYS A 351 4.137 -8.868 16.031 1.00 0.00 C ATOM 166 CE LYS A 351 4.169 -9.883 17.182 1.00 0.00 C ATOM 167 NZ LYS A 351 4.705 -9.274 18.428 1.00 0.00 N ATOM 0 H LYS A 351 3.177 -10.935 13.061 1.00 0.00 H new ATOM 0 HA LYS A 351 1.833 -8.702 12.062 1.00 0.00 H new ATOM 0 HB2 LYS A 351 3.905 -7.687 13.678 1.00 0.00 H new ATOM 0 HB3 LYS A 351 2.233 -7.973 14.120 1.00 0.00 H new ATOM 0 HG2 LYS A 351 2.739 -10.149 15.012 1.00 0.00 H new ATOM 0 HG3 LYS A 351 4.344 -10.144 14.309 1.00 0.00 H new ATOM 0 HD2 LYS A 351 5.143 -8.491 15.845 1.00 0.00 H new ATOM 0 HD3 LYS A 351 3.522 -8.013 16.312 1.00 0.00 H new ATOM 0 HE2 LYS A 351 3.163 -10.261 17.364 1.00 0.00 H new ATOM 0 HE3 LYS A 351 4.784 -10.737 16.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 4.714 -9.986 19.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 5.674 -8.935 18.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 4.103 -8.474 18.710 1.00 0.00 H new ATOM 181 N LEU A 352 5.088 -8.717 11.277 1.00 0.00 N ATOM 182 CA LEU A 352 5.996 -8.110 10.302 1.00 0.00 C ATOM 183 C LEU A 352 5.675 -8.418 8.827 1.00 0.00 C ATOM 184 O LEU A 352 5.794 -7.519 7.990 1.00 0.00 O ATOM 185 CB LEU A 352 7.482 -8.172 10.702 1.00 0.00 C ATOM 186 CG LEU A 352 7.834 -8.146 12.205 1.00 0.00 C ATOM 187 CD1 LEU A 352 9.323 -8.425 12.412 1.00 0.00 C ATOM 188 CD2 LEU A 352 7.526 -6.771 12.800 1.00 0.00 C ATOM 0 H LEU A 352 5.509 -9.420 11.884 1.00 0.00 H new ATOM 0 HA LEU A 352 5.774 -7.044 10.354 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.904 -9.083 10.277 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.990 -7.333 10.226 1.00 0.00 H new ATOM 0 HG LEU A 352 7.237 -8.913 12.698 1.00 0.00 H new ATOM 0 HD11 LEU A 352 9.553 -8.403 13.477 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.569 -9.407 12.008 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.911 -7.664 11.898 1.00 0.00 H new ATOM 0 HD21 LEU A 352 7.779 -6.768 13.860 1.00 0.00 H new ATOM 0 HD22 LEU A 352 8.114 -6.012 12.284 1.00 0.00 H new ATOM 0 HD23 LEU A 352 6.465 -6.552 12.680 1.00 0.00 H new ATOM 200 N ILE A 353 5.208 -9.627 8.488 1.00 0.00 N ATOM 201 CA ILE A 353 4.826 -9.988 7.104 1.00 0.00 C ATOM 202 C ILE A 353 3.589 -9.201 6.644 1.00 0.00 C ATOM 203 O ILE A 353 3.602 -8.581 5.570 1.00 0.00 O ATOM 204 CB ILE A 353 4.707 -11.523 6.944 1.00 0.00 C ATOM 205 CG1 ILE A 353 5.273 -11.990 5.591 1.00 0.00 C ATOM 206 CG2 ILE A 353 3.308 -12.117 7.193 1.00 0.00 C ATOM 207 CD1 ILE A 353 5.550 -13.500 5.564 1.00 0.00 C ATOM 0 H ILE A 353 5.082 -10.385 9.159 1.00 0.00 H new ATOM 0 HA ILE A 353 5.623 -9.687 6.424 1.00 0.00 H new ATOM 0 HB ILE A 353 5.318 -11.922 7.753 1.00 0.00 H new ATOM 0 HG12 ILE A 353 4.568 -11.738 4.799 1.00 0.00 H new ATOM 0 HG13 ILE A 353 6.196 -11.450 5.380 1.00 0.00 H new ATOM 0 HG21 ILE A 353 3.341 -13.198 7.053 1.00 0.00 H new ATOM 0 HG22 ILE A 353 2.993 -11.892 8.212 1.00 0.00 H new ATOM 0 HG23 ILE A 353 2.598 -11.682 6.490 1.00 0.00 H new ATOM 0 HD11 ILE A 353 5.948 -13.780 4.588 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.276 -13.751 6.337 1.00 0.00 H new ATOM 0 HD13 ILE A 353 4.623 -14.043 5.747 1.00 0.00 H new ATOM 219 N GLN A 354 2.548 -9.145 7.492 1.00 0.00 N ATOM 220 CA GLN A 354 1.375 -8.314 7.177 1.00 0.00 C ATOM 221 C GLN A 354 1.765 -6.831 7.109 1.00 0.00 C ATOM 222 O GLN A 354 1.233 -6.115 6.271 1.00 0.00 O ATOM 223 CB GLN A 354 0.174 -8.572 8.099 1.00 0.00 C ATOM 224 CG GLN A 354 0.311 -8.009 9.518 1.00 0.00 C ATOM 225 CD GLN A 354 -0.866 -8.411 10.401 1.00 0.00 C ATOM 226 OE1 GLN A 354 -1.758 -7.630 10.703 1.00 0.00 O ATOM 227 NE2 GLN A 354 -0.907 -9.651 10.843 1.00 0.00 N ATOM 0 H GLN A 354 2.494 -9.650 8.377 1.00 0.00 H new ATOM 0 HA GLN A 354 1.029 -8.614 6.188 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -0.716 -8.143 7.639 1.00 0.00 H new ATOM 0 HB3 GLN A 354 0.011 -9.648 8.166 1.00 0.00 H new ATOM 0 HG2 GLN A 354 1.239 -8.367 9.964 1.00 0.00 H new ATOM 0 HG3 GLN A 354 0.378 -6.922 9.473 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -0.166 -10.306 10.594 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -1.680 -9.956 11.434 1.00 0.00 H new ATOM 236 N GLN A 355 2.728 -6.371 7.921 1.00 0.00 N ATOM 237 CA GLN A 355 3.252 -5.005 7.838 1.00 0.00 C ATOM 238 C GLN A 355 3.882 -4.747 6.455 1.00 0.00 C ATOM 239 O GLN A 355 3.558 -3.719 5.862 1.00 0.00 O ATOM 240 CB GLN A 355 4.161 -4.705 9.027 1.00 0.00 C ATOM 241 CG GLN A 355 5.020 -3.437 8.876 1.00 0.00 C ATOM 242 CD GLN A 355 5.913 -3.173 10.088 1.00 0.00 C ATOM 243 OE1 GLN A 355 5.504 -3.251 11.240 1.00 0.00 O ATOM 244 NE2 GLN A 355 7.174 -2.848 9.883 1.00 0.00 N ATOM 0 H GLN A 355 3.163 -6.936 8.651 1.00 0.00 H new ATOM 0 HA GLN A 355 2.435 -4.287 7.916 1.00 0.00 H new ATOM 0 HB2 GLN A 355 3.546 -4.606 9.921 1.00 0.00 H new ATOM 0 HB3 GLN A 355 4.821 -5.558 9.187 1.00 0.00 H new ATOM 0 HG2 GLN A 355 5.643 -3.530 7.986 1.00 0.00 H new ATOM 0 HG3 GLN A 355 4.367 -2.579 8.719 1.00 0.00 H new ATOM 0 HE21 GLN A 355 7.534 -2.778 8.931 1.00 0.00 H new ATOM 0 HE22 GLN A 355 7.789 -2.667 10.676 1.00 0.00 H new ATOM 253 N GLN A 356 4.676 -5.670 5.873 1.00 0.00 N ATOM 254 CA GLN A 356 5.106 -5.510 4.474 1.00 0.00 C ATOM 255 C GLN A 356 3.933 -5.343 3.517 1.00 0.00 C ATOM 256 O GLN A 356 3.892 -4.387 2.755 1.00 0.00 O ATOM 257 CB GLN A 356 5.989 -6.643 3.941 1.00 0.00 C ATOM 258 CG GLN A 356 6.914 -7.405 4.889 1.00 0.00 C ATOM 259 CD GLN A 356 8.013 -6.506 5.451 1.00 0.00 C ATOM 260 OE1 GLN A 356 8.905 -6.054 4.744 1.00 0.00 O ATOM 261 NE2 GLN A 356 7.999 -6.212 6.733 1.00 0.00 N ATOM 0 H GLN A 356 5.023 -6.510 6.337 1.00 0.00 H new ATOM 0 HA GLN A 356 5.705 -4.600 4.506 1.00 0.00 H new ATOM 0 HB2 GLN A 356 5.330 -7.375 3.474 1.00 0.00 H new ATOM 0 HB3 GLN A 356 6.611 -6.224 3.150 1.00 0.00 H new ATOM 0 HG2 GLN A 356 6.330 -7.822 5.710 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.366 -8.244 4.360 1.00 0.00 H new ATOM 0 HE21 GLN A 356 7.262 -6.582 7.333 1.00 0.00 H new ATOM 0 HE22 GLN A 356 8.725 -5.614 7.127 1.00 0.00 H new ATOM 270 N LEU A 357 2.980 -6.270 3.570 1.00 0.00 N ATOM 271 CA LEU A 357 1.775 -6.253 2.731 1.00 0.00 C ATOM 272 C LEU A 357 1.008 -4.906 2.860 1.00 0.00 C ATOM 273 O LEU A 357 0.712 -4.245 1.866 1.00 0.00 O ATOM 274 CB LEU A 357 0.964 -7.495 3.141 1.00 0.00 C ATOM 275 CG LEU A 357 0.127 -8.063 1.994 1.00 0.00 C ATOM 276 CD1 LEU A 357 -0.469 -9.401 2.414 1.00 0.00 C ATOM 277 CD2 LEU A 357 -0.959 -7.089 1.571 1.00 0.00 C ATOM 0 H LEU A 357 3.020 -7.067 4.205 1.00 0.00 H new ATOM 0 HA LEU A 357 2.006 -6.308 1.667 1.00 0.00 H new ATOM 0 HB2 LEU A 357 1.646 -8.265 3.503 1.00 0.00 H new ATOM 0 HB3 LEU A 357 0.306 -7.236 3.971 1.00 0.00 H new ATOM 0 HG LEU A 357 0.773 -8.219 1.130 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.066 -9.806 1.597 1.00 0.00 H new ATOM 0 HD12 LEU A 357 0.334 -10.097 2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.102 -9.258 3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -1.537 -7.521 0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.618 -6.889 2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -0.502 -6.157 1.239 1.00 0.00 H new ATOM 289 N VAL A 358 0.753 -4.433 4.080 1.00 0.00 N ATOM 290 CA VAL A 358 0.116 -3.133 4.369 1.00 0.00 C ATOM 291 C VAL A 358 0.937 -1.961 3.797 1.00 0.00 C ATOM 292 O VAL A 358 0.371 -1.008 3.262 1.00 0.00 O ATOM 293 CB VAL A 358 -0.066 -2.988 5.900 1.00 0.00 C ATOM 294 CG1 VAL A 358 -0.481 -1.579 6.345 1.00 0.00 C ATOM 295 CG2 VAL A 358 -1.115 -3.965 6.464 1.00 0.00 C ATOM 0 H VAL A 358 0.988 -4.954 4.925 1.00 0.00 H new ATOM 0 HA VAL A 358 -0.859 -3.103 3.883 1.00 0.00 H new ATOM 0 HB VAL A 358 0.924 -3.214 6.295 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -0.589 -1.557 7.429 1.00 0.00 H new ATOM 0 HG12 VAL A 358 0.282 -0.862 6.041 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -1.431 -1.316 5.881 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -1.204 -3.822 7.541 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -2.079 -3.776 5.992 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -0.805 -4.990 6.259 1.00 0.00 H new ATOM 305 N LEU A 359 2.271 -2.041 3.853 1.00 0.00 N ATOM 306 CA LEU A 359 3.199 -1.020 3.336 1.00 0.00 C ATOM 307 C LEU A 359 3.304 -1.055 1.808 1.00 0.00 C ATOM 308 O LEU A 359 3.502 -0.018 1.188 1.00 0.00 O ATOM 309 CB LEU A 359 4.590 -1.197 3.967 1.00 0.00 C ATOM 310 CG LEU A 359 4.688 -0.741 5.433 1.00 0.00 C ATOM 311 CD1 LEU A 359 5.994 -1.266 6.023 1.00 0.00 C ATOM 312 CD2 LEU A 359 4.697 0.785 5.556 1.00 0.00 C ATOM 0 H LEU A 359 2.752 -2.838 4.270 1.00 0.00 H new ATOM 0 HA LEU A 359 2.796 -0.046 3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.871 -2.248 3.907 1.00 0.00 H new ATOM 0 HB3 LEU A 359 5.317 -0.639 3.377 1.00 0.00 H new ATOM 0 HG LEU A 359 3.818 -1.129 5.963 1.00 0.00 H new ATOM 0 HD11 LEU A 359 6.077 -0.950 7.063 1.00 0.00 H new ATOM 0 HD12 LEU A 359 6.004 -2.355 5.973 1.00 0.00 H new ATOM 0 HD13 LEU A 359 6.835 -0.869 5.455 1.00 0.00 H new ATOM 0 HD21 LEU A 359 4.767 1.065 6.607 1.00 0.00 H new ATOM 0 HD22 LEU A 359 5.553 1.189 5.015 1.00 0.00 H new ATOM 0 HD23 LEU A 359 3.777 1.190 5.134 1.00 0.00 H new ATOM 324 N LEU A 360 3.133 -2.225 1.196 1.00 0.00 N ATOM 325 CA LEU A 360 3.084 -2.465 -0.249 1.00 0.00 C ATOM 326 C LEU A 360 1.844 -1.789 -0.838 1.00 0.00 C ATOM 327 O LEU A 360 1.913 -1.042 -1.817 1.00 0.00 O ATOM 328 CB LEU A 360 2.992 -3.994 -0.447 1.00 0.00 C ATOM 329 CG LEU A 360 4.247 -4.750 -0.914 1.00 0.00 C ATOM 330 CD1 LEU A 360 5.552 -4.187 -0.354 1.00 0.00 C ATOM 331 CD2 LEU A 360 4.127 -6.213 -0.469 1.00 0.00 C ATOM 0 H LEU A 360 3.017 -3.087 1.728 1.00 0.00 H new ATOM 0 HA LEU A 360 3.965 -2.060 -0.747 1.00 0.00 H new ATOM 0 HB2 LEU A 360 2.674 -4.432 0.499 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.200 -4.188 -1.170 1.00 0.00 H new ATOM 0 HG LEU A 360 4.292 -4.644 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 360 6.391 -4.773 -0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 360 5.665 -3.149 -0.668 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.532 -4.236 0.735 1.00 0.00 H new ATOM 0 HD21 LEU A 360 5.010 -6.765 -0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.049 -6.258 0.617 1.00 0.00 H new ATOM 0 HD23 LEU A 360 3.237 -6.657 -0.916 1.00 0.00 H new ATOM 343 N LEU A 361 0.702 -2.033 -0.197 1.00 0.00 N ATOM 344 CA LEU A 361 -0.568 -1.429 -0.573 1.00 0.00 C ATOM 345 C LEU A 361 -0.514 0.085 -0.346 1.00 0.00 C ATOM 346 O LEU A 361 -0.933 0.835 -1.229 1.00 0.00 O ATOM 347 CB LEU A 361 -1.691 -2.126 0.200 1.00 0.00 C ATOM 348 CG LEU A 361 -1.805 -3.618 -0.177 1.00 0.00 C ATOM 349 CD1 LEU A 361 -2.807 -4.288 0.749 1.00 0.00 C ATOM 350 CD2 LEU A 361 -2.266 -3.851 -1.619 1.00 0.00 C ATOM 0 H LEU A 361 0.635 -2.661 0.604 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.771 -1.567 -1.635 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.507 -2.035 1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.638 -1.626 -0.004 1.00 0.00 H new ATOM 0 HG LEU A 361 -0.805 -4.040 -0.078 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -2.894 -5.343 0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -2.468 -4.195 1.781 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -3.779 -3.807 0.642 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -2.324 -4.922 -1.814 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -3.249 -3.402 -1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -1.554 -3.395 -2.307 1.00 0.00 H new ATOM 362 N HIS A 362 0.084 0.536 0.769 1.00 0.00 N ATOM 363 CA HIS A 362 0.310 1.964 1.002 1.00 0.00 C ATOM 364 C HIS A 362 1.231 2.529 -0.085 1.00 0.00 C ATOM 365 O HIS A 362 0.938 3.588 -0.615 1.00 0.00 O ATOM 366 CB HIS A 362 0.875 2.257 2.401 1.00 0.00 C ATOM 367 CG HIS A 362 0.996 3.744 2.680 1.00 0.00 C ATOM 368 ND1 HIS A 362 0.153 4.503 3.461 1.00 0.00 N ATOM 369 CD2 HIS A 362 1.931 4.606 2.165 1.00 0.00 C ATOM 370 CE1 HIS A 362 0.569 5.782 3.413 1.00 0.00 C ATOM 371 NE2 HIS A 362 1.650 5.901 2.624 1.00 0.00 N ATOM 0 H HIS A 362 0.417 -0.070 1.519 1.00 0.00 H new ATOM 0 HA HIS A 362 -0.660 2.459 0.952 1.00 0.00 H new ATOM 0 HB2 HIS A 362 0.230 1.801 3.152 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.856 1.792 2.498 1.00 0.00 H new ATOM 0 HD1 HIS A 362 -0.649 4.155 3.986 1.00 0.00 H new ATOM 0 HD2 HIS A 362 2.748 4.332 1.514 1.00 0.00 H new ATOM 0 HE1 HIS A 362 0.098 6.601 3.937 1.00 0.00 H new ATOM 379 N ALA A 363 2.314 1.845 -0.460 1.00 0.00 N ATOM 380 CA ALA A 363 3.232 2.285 -1.506 1.00 0.00 C ATOM 381 C ALA A 363 2.518 2.497 -2.852 1.00 0.00 C ATOM 382 O ALA A 363 2.741 3.528 -3.482 1.00 0.00 O ATOM 383 CB ALA A 363 4.403 1.301 -1.598 1.00 0.00 C ATOM 0 H ALA A 363 2.580 0.956 -0.037 1.00 0.00 H new ATOM 0 HA ALA A 363 3.631 3.264 -1.241 1.00 0.00 H new ATOM 0 HB1 ALA A 363 5.091 1.626 -2.378 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.927 1.269 -0.643 1.00 0.00 H new ATOM 0 HB3 ALA A 363 4.025 0.307 -1.839 1.00 0.00 H new ATOM 389 N HIS A 364 1.631 1.586 -3.278 1.00 0.00 N ATOM 390 CA HIS A 364 0.833 1.751 -4.501 1.00 0.00 C ATOM 391 C HIS A 364 -0.090 2.982 -4.407 1.00 0.00 C ATOM 392 O HIS A 364 -0.035 3.908 -5.228 1.00 0.00 O ATOM 393 CB HIS A 364 0.002 0.483 -4.739 1.00 0.00 C ATOM 394 CG HIS A 364 -0.768 0.536 -6.035 1.00 0.00 C ATOM 395 ND1 HIS A 364 -0.280 0.237 -7.287 1.00 0.00 N ATOM 396 CD2 HIS A 364 -2.064 0.948 -6.195 1.00 0.00 C ATOM 397 CE1 HIS A 364 -1.260 0.456 -8.180 1.00 0.00 C ATOM 398 NE2 HIS A 364 -2.369 0.903 -7.563 1.00 0.00 N ATOM 0 H HIS A 364 1.447 0.713 -2.783 1.00 0.00 H new ATOM 0 HA HIS A 364 1.511 1.910 -5.339 1.00 0.00 H new ATOM 0 HB2 HIS A 364 0.662 -0.385 -4.747 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.694 0.347 -3.911 1.00 0.00 H new ATOM 0 HD1 HIS A 364 0.661 -0.093 -7.500 1.00 0.00 H new ATOM 0 HD2 HIS A 364 -2.734 1.254 -5.405 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -1.170 0.296 -9.244 1.00 0.00 H new ATOM 406 N LYS A 365 -0.898 3.001 -3.338 1.00 0.00 N ATOM 407 CA LYS A 365 -1.796 4.100 -2.933 1.00 0.00 C ATOM 408 C LYS A 365 -1.117 5.459 -3.013 1.00 0.00 C ATOM 409 O LYS A 365 -1.589 6.385 -3.667 1.00 0.00 O ATOM 410 CB LYS A 365 -2.262 3.789 -1.490 1.00 0.00 C ATOM 411 CG LYS A 365 -2.576 5.002 -0.594 1.00 0.00 C ATOM 412 CD LYS A 365 -3.136 4.514 0.751 1.00 0.00 C ATOM 413 CE LYS A 365 -3.712 5.696 1.540 1.00 0.00 C ATOM 414 NZ LYS A 365 -4.369 5.246 2.796 1.00 0.00 N ATOM 0 H LYS A 365 -0.948 2.210 -2.696 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.645 4.159 -3.614 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.155 3.166 -1.546 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -1.489 3.195 -1.002 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -1.673 5.591 -0.432 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -3.298 5.654 -1.086 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -3.911 3.767 0.582 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -2.348 4.030 1.328 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -2.914 6.399 1.778 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -4.434 6.230 0.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -4.747 6.071 3.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -5.146 4.594 2.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -3.674 4.758 3.396 1.00 0.00 H new ATOM 428 N CYS A 366 -0.005 5.558 -2.307 1.00 0.00 N ATOM 429 CA CYS A 366 0.785 6.745 -2.131 1.00 0.00 C ATOM 430 C CYS A 366 1.559 7.088 -3.406 1.00 0.00 C ATOM 431 O CYS A 366 1.779 8.262 -3.653 1.00 0.00 O ATOM 432 CB CYS A 366 1.593 6.489 -0.858 1.00 0.00 C ATOM 433 SG CYS A 366 2.583 7.889 -0.294 1.00 0.00 S ATOM 0 H CYS A 366 0.388 4.756 -1.814 1.00 0.00 H new ATOM 0 HA CYS A 366 0.210 7.659 -1.985 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.907 6.203 -0.061 1.00 0.00 H new ATOM 0 HB3 CYS A 366 2.255 5.640 -1.029 1.00 0.00 H new ATOM 438 N GLN A 367 1.928 6.127 -4.261 1.00 0.00 N ATOM 439 CA GLN A 367 2.534 6.419 -5.567 1.00 0.00 C ATOM 440 C GLN A 367 1.514 7.170 -6.433 1.00 0.00 C ATOM 441 O GLN A 367 1.832 8.253 -6.932 1.00 0.00 O ATOM 442 CB GLN A 367 3.040 5.129 -6.234 1.00 0.00 C ATOM 443 CG GLN A 367 3.692 5.381 -7.603 1.00 0.00 C ATOM 444 CD GLN A 367 4.339 4.118 -8.172 1.00 0.00 C ATOM 445 OE1 GLN A 367 3.742 3.051 -8.245 1.00 0.00 O ATOM 446 NE2 GLN A 367 5.584 4.179 -8.593 1.00 0.00 N ATOM 0 H GLN A 367 1.816 5.131 -4.070 1.00 0.00 H new ATOM 0 HA GLN A 367 3.407 7.059 -5.440 1.00 0.00 H new ATOM 0 HB2 GLN A 367 3.762 4.645 -5.577 1.00 0.00 H new ATOM 0 HB3 GLN A 367 2.206 4.437 -6.356 1.00 0.00 H new ATOM 0 HG2 GLN A 367 2.939 5.748 -8.301 1.00 0.00 H new ATOM 0 HG3 GLN A 367 4.446 6.162 -7.507 1.00 0.00 H new ATOM 0 HE21 GLN A 367 6.098 5.059 -8.540 1.00 0.00 H new ATOM 0 HE22 GLN A 367 6.036 3.347 -8.972 1.00 0.00 H new ATOM 455 N ARG A 368 0.272 6.665 -6.557 1.00 0.00 N ATOM 456 CA ARG A 368 -0.766 7.400 -7.310 1.00 0.00 C ATOM 457 C ARG A 368 -1.138 8.735 -6.662 1.00 0.00 C ATOM 458 O ARG A 368 -1.284 9.722 -7.378 1.00 0.00 O ATOM 459 CB ARG A 368 -1.976 6.522 -7.687 1.00 0.00 C ATOM 460 CG ARG A 368 -2.839 6.040 -6.511 1.00 0.00 C ATOM 461 CD ARG A 368 -4.101 5.288 -6.957 1.00 0.00 C ATOM 462 NE ARG A 368 -3.789 4.068 -7.734 1.00 0.00 N ATOM 463 CZ ARG A 368 -4.014 3.846 -9.017 1.00 0.00 C ATOM 464 NH1 ARG A 368 -4.536 4.740 -9.813 1.00 0.00 N ATOM 465 NH2 ARG A 368 -3.707 2.693 -9.533 1.00 0.00 N ATOM 0 H ARG A 368 -0.033 5.777 -6.159 1.00 0.00 H new ATOM 0 HA ARG A 368 -0.314 7.669 -8.265 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -2.610 7.084 -8.373 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -1.614 5.649 -8.230 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -2.242 5.388 -5.873 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -3.130 6.899 -5.906 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -4.687 5.016 -6.079 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -4.721 5.951 -7.561 1.00 0.00 H new ATOM 0 HE ARG A 368 -3.347 3.307 -7.217 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -4.790 5.659 -9.451 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -4.690 4.519 -10.797 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -3.295 1.966 -8.948 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -3.878 2.515 -10.523 1.00 0.00 H new ATOM 479 N ARG A 369 -1.231 8.808 -5.329 1.00 0.00 N ATOM 480 CA ARG A 369 -1.538 10.064 -4.615 1.00 0.00 C ATOM 481 C ARG A 369 -0.414 11.101 -4.740 1.00 0.00 C ATOM 482 O ARG A 369 -0.688 12.276 -4.960 1.00 0.00 O ATOM 483 CB ARG A 369 -2.042 9.756 -3.181 1.00 0.00 C ATOM 484 CG ARG A 369 -1.622 10.663 -2.006 1.00 0.00 C ATOM 485 CD ARG A 369 -0.515 10.012 -1.162 1.00 0.00 C ATOM 486 NE ARG A 369 -0.208 10.812 0.035 1.00 0.00 N ATOM 487 CZ ARG A 369 0.104 10.373 1.240 1.00 0.00 C ATOM 488 NH1 ARG A 369 0.361 9.126 1.499 1.00 0.00 N ATOM 489 NH2 ARG A 369 0.174 11.216 2.224 1.00 0.00 N ATOM 0 H ARG A 369 -1.097 8.006 -4.713 1.00 0.00 H new ATOM 0 HA ARG A 369 -2.372 10.569 -5.102 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -3.131 9.751 -3.214 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -1.726 8.742 -2.937 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -1.272 11.621 -2.391 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -2.488 10.869 -1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -0.826 9.011 -0.862 1.00 0.00 H new ATOM 0 HD3 ARG A 369 0.385 9.899 -1.766 1.00 0.00 H new ATOM 0 HE ARG A 369 -0.240 11.825 -0.080 1.00 0.00 H new ATOM 0 HH11 ARG A 369 0.327 8.432 0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 369 0.597 8.841 2.449 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -0.011 12.206 2.062 1.00 0.00 H new ATOM 0 HH22 ARG A 369 0.414 10.889 3.160 1.00 0.00 H new ATOM 503 N GLU A 370 0.845 10.676 -4.691 1.00 0.00 N ATOM 504 CA GLU A 370 2.024 11.531 -4.897 1.00 0.00 C ATOM 505 C GLU A 370 2.027 12.118 -6.311 1.00 0.00 C ATOM 506 O GLU A 370 2.124 13.333 -6.495 1.00 0.00 O ATOM 507 CB GLU A 370 3.280 10.686 -4.666 1.00 0.00 C ATOM 508 CG GLU A 370 4.612 11.436 -4.793 1.00 0.00 C ATOM 509 CD GLU A 370 5.811 10.564 -4.359 1.00 0.00 C ATOM 510 OE1 GLU A 370 5.625 9.525 -3.680 1.00 0.00 O ATOM 511 OE2 GLU A 370 6.980 10.924 -4.626 1.00 0.00 O ATOM 0 H GLU A 370 1.087 9.703 -4.502 1.00 0.00 H new ATOM 0 HA GLU A 370 2.001 12.364 -4.194 1.00 0.00 H new ATOM 0 HB2 GLU A 370 3.224 10.247 -3.670 1.00 0.00 H new ATOM 0 HB3 GLU A 370 3.278 9.861 -5.378 1.00 0.00 H new ATOM 0 HG2 GLU A 370 4.751 11.755 -5.826 1.00 0.00 H new ATOM 0 HG3 GLU A 370 4.580 12.338 -4.182 1.00 0.00 H new ATOM 518 N GLN A 371 1.864 11.245 -7.305 1.00 0.00 N ATOM 519 CA GLN A 371 1.770 11.628 -8.719 1.00 0.00 C ATOM 520 C GLN A 371 0.546 12.525 -9.009 1.00 0.00 C ATOM 521 O GLN A 371 0.603 13.363 -9.912 1.00 0.00 O ATOM 522 CB GLN A 371 1.739 10.364 -9.594 1.00 0.00 C ATOM 523 CG GLN A 371 3.107 9.656 -9.629 1.00 0.00 C ATOM 524 CD GLN A 371 3.080 8.326 -10.388 1.00 0.00 C ATOM 525 OE1 GLN A 371 2.108 7.581 -10.397 1.00 0.00 O ATOM 526 NE2 GLN A 371 4.153 7.968 -11.064 1.00 0.00 N ATOM 0 H GLN A 371 1.792 10.239 -7.152 1.00 0.00 H new ATOM 0 HA GLN A 371 2.652 12.220 -8.962 1.00 0.00 H new ATOM 0 HB2 GLN A 371 0.984 9.677 -9.212 1.00 0.00 H new ATOM 0 HB3 GLN A 371 1.443 10.632 -10.608 1.00 0.00 H new ATOM 0 HG2 GLN A 371 3.839 10.317 -10.093 1.00 0.00 H new ATOM 0 HG3 GLN A 371 3.442 9.477 -8.607 1.00 0.00 H new ATOM 0 HE21 GLN A 371 4.975 8.571 -11.072 1.00 0.00 H new ATOM 0 HE22 GLN A 371 4.161 7.088 -11.579 1.00 0.00 H new ATOM 535 N ALA A 372 -0.551 12.366 -8.258 1.00 0.00 N ATOM 536 CA ALA A 372 -1.780 13.150 -8.425 1.00 0.00 C ATOM 537 C ALA A 372 -1.710 14.557 -7.790 1.00 0.00 C ATOM 538 O ALA A 372 -1.997 15.549 -8.467 1.00 0.00 O ATOM 539 CB ALA A 372 -2.959 12.355 -7.843 1.00 0.00 C ATOM 0 H ALA A 372 -0.610 11.679 -7.506 1.00 0.00 H new ATOM 0 HA ALA A 372 -1.917 13.317 -9.493 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -3.878 12.928 -7.962 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -3.053 11.405 -8.370 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -2.783 12.166 -6.784 1.00 0.00 H new ATOM 545 N ASN A 373 -1.362 14.655 -6.500 1.00 0.00 N ATOM 546 CA ASN A 373 -1.321 15.913 -5.734 1.00 0.00 C ATOM 547 C ASN A 373 -0.331 15.903 -4.544 1.00 0.00 C ATOM 548 O ASN A 373 -0.548 16.592 -3.542 1.00 0.00 O ATOM 549 CB ASN A 373 -2.760 16.299 -5.311 1.00 0.00 C ATOM 550 CG ASN A 373 -3.434 15.372 -4.306 1.00 0.00 C ATOM 551 OD1 ASN A 373 -3.037 14.244 -4.053 1.00 0.00 O ATOM 552 ND2 ASN A 373 -4.505 15.825 -3.693 1.00 0.00 N ATOM 0 H ASN A 373 -1.094 13.843 -5.944 1.00 0.00 H new ATOM 0 HA ASN A 373 -0.921 16.684 -6.392 1.00 0.00 H new ATOM 0 HB2 ASN A 373 -2.736 17.304 -4.889 1.00 0.00 H new ATOM 0 HB3 ASN A 373 -3.380 16.344 -6.206 1.00 0.00 H new ATOM 0 HD21 ASN A 373 -4.993 15.237 -3.017 1.00 0.00 H new ATOM 0 HD22 ASN A 373 -4.848 16.764 -3.894 1.00 0.00 H new ATOM 559 N GLY A 374 0.765 15.140 -4.634 1.00 0.00 N ATOM 560 CA GLY A 374 1.806 15.012 -3.598 1.00 0.00 C ATOM 561 C GLY A 374 2.405 16.326 -3.079 1.00 0.00 C ATOM 562 O GLY A 374 2.870 16.376 -1.943 1.00 0.00 O ATOM 0 H GLY A 374 0.962 14.573 -5.459 1.00 0.00 H new ATOM 0 HA2 GLY A 374 1.384 14.469 -2.752 1.00 0.00 H new ATOM 0 HA3 GLY A 374 2.615 14.400 -3.998 1.00 0.00 H new ATOM 566 N GLU A 375 2.363 17.401 -3.870 1.00 0.00 N ATOM 567 CA GLU A 375 2.835 18.742 -3.481 1.00 0.00 C ATOM 568 C GLU A 375 2.013 19.364 -2.327 1.00 0.00 C ATOM 569 O GLU A 375 2.466 20.311 -1.680 1.00 0.00 O ATOM 570 CB GLU A 375 2.805 19.673 -4.705 1.00 0.00 C ATOM 571 CG GLU A 375 3.746 19.197 -5.821 1.00 0.00 C ATOM 572 CD GLU A 375 3.797 20.213 -6.978 1.00 0.00 C ATOM 573 OE1 GLU A 375 4.640 21.143 -6.941 1.00 0.00 O ATOM 574 OE2 GLU A 375 3.001 20.085 -7.942 1.00 0.00 O ATOM 0 H GLU A 375 1.993 17.368 -4.820 1.00 0.00 H new ATOM 0 HA GLU A 375 3.855 18.628 -3.113 1.00 0.00 H new ATOM 0 HB2 GLU A 375 1.787 19.730 -5.091 1.00 0.00 H new ATOM 0 HB3 GLU A 375 3.087 20.681 -4.400 1.00 0.00 H new ATOM 0 HG2 GLU A 375 4.748 19.051 -5.418 1.00 0.00 H new ATOM 0 HG3 GLU A 375 3.409 18.231 -6.197 1.00 0.00 H new ATOM 581 N VAL A 376 0.817 18.820 -2.057 1.00 0.00 N ATOM 582 CA VAL A 376 -0.118 19.251 -0.999 1.00 0.00 C ATOM 583 C VAL A 376 -0.505 18.073 -0.090 1.00 0.00 C ATOM 584 O VAL A 376 -0.585 18.230 1.130 1.00 0.00 O ATOM 585 CB VAL A 376 -1.376 19.892 -1.632 1.00 0.00 C ATOM 586 CG1 VAL A 376 -2.366 20.402 -0.577 1.00 0.00 C ATOM 587 CG2 VAL A 376 -1.017 21.079 -2.538 1.00 0.00 C ATOM 0 H VAL A 376 0.456 18.031 -2.593 1.00 0.00 H new ATOM 0 HA VAL A 376 0.381 19.996 -0.380 1.00 0.00 H new ATOM 0 HB VAL A 376 -1.838 19.096 -2.216 1.00 0.00 H new ATOM 0 HG11 VAL A 376 -3.231 20.843 -1.073 1.00 0.00 H new ATOM 0 HG12 VAL A 376 -2.691 19.571 0.049 1.00 0.00 H new ATOM 0 HG13 VAL A 376 -1.881 21.155 0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 376 -1.928 21.501 -2.963 1.00 0.00 H new ATOM 0 HG22 VAL A 376 -0.503 21.841 -1.952 1.00 0.00 H new ATOM 0 HG23 VAL A 376 -0.365 20.739 -3.343 1.00 0.00 H new ATOM 597 N ARG A 377 -0.707 16.880 -0.664 1.00 0.00 N ATOM 598 CA ARG A 377 -1.079 15.621 0.011 1.00 0.00 C ATOM 599 C ARG A 377 0.139 14.784 0.455 1.00 0.00 C ATOM 600 O ARG A 377 0.037 13.563 0.558 1.00 0.00 O ATOM 601 CB ARG A 377 -2.011 14.865 -0.964 1.00 0.00 C ATOM 602 CG ARG A 377 -2.944 13.796 -0.371 1.00 0.00 C ATOM 603 CD ARG A 377 -3.962 14.364 0.627 1.00 0.00 C ATOM 604 NE ARG A 377 -4.956 13.341 1.014 1.00 0.00 N ATOM 605 CZ ARG A 377 -5.833 13.419 2.000 1.00 0.00 C ATOM 606 NH1 ARG A 377 -5.921 14.465 2.773 1.00 0.00 N ATOM 607 NH2 ARG A 377 -6.651 12.432 2.233 1.00 0.00 N ATOM 0 H ARG A 377 -0.610 16.756 -1.672 1.00 0.00 H new ATOM 0 HA ARG A 377 -1.593 15.830 0.949 1.00 0.00 H new ATOM 0 HB2 ARG A 377 -2.628 15.602 -1.478 1.00 0.00 H new ATOM 0 HB3 ARG A 377 -1.389 14.386 -1.720 1.00 0.00 H new ATOM 0 HG2 ARG A 377 -3.478 13.300 -1.181 1.00 0.00 H new ATOM 0 HG3 ARG A 377 -2.343 13.035 0.127 1.00 0.00 H new ATOM 0 HD2 ARG A 377 -3.443 14.725 1.515 1.00 0.00 H new ATOM 0 HD3 ARG A 377 -4.471 15.221 0.185 1.00 0.00 H new ATOM 0 HE ARG A 377 -4.966 12.484 0.462 1.00 0.00 H new ATOM 0 HH11 ARG A 377 -5.300 15.261 2.627 1.00 0.00 H new ATOM 0 HH12 ARG A 377 -6.611 14.488 3.524 1.00 0.00 H new ATOM 0 HH21 ARG A 377 -6.617 11.594 1.653 1.00 0.00 H new ATOM 0 HH22 ARG A 377 -7.326 12.498 2.995 1.00 0.00 H new ATOM 621 N ALA A 378 1.296 15.413 0.673 1.00 0.00 N ATOM 622 CA ALA A 378 2.573 14.792 1.040 1.00 0.00 C ATOM 623 C ALA A 378 2.503 13.739 2.170 1.00 0.00 C ATOM 624 O ALA A 378 1.670 13.814 3.079 1.00 0.00 O ATOM 625 CB ALA A 378 3.560 15.912 1.403 1.00 0.00 C ATOM 0 H ALA A 378 1.372 16.427 0.594 1.00 0.00 H new ATOM 0 HA ALA A 378 2.904 14.221 0.172 1.00 0.00 H new ATOM 0 HB1 ALA A 378 4.520 15.476 1.680 1.00 0.00 H new ATOM 0 HB2 ALA A 378 3.695 16.570 0.545 1.00 0.00 H new ATOM 0 HB3 ALA A 378 3.166 16.486 2.242 1.00 0.00 H new ATOM 631 N CYS A 379 3.427 12.778 2.105 1.00 0.00 N ATOM 632 CA CYS A 379 3.602 11.671 3.053 1.00 0.00 C ATOM 633 C CYS A 379 4.787 11.933 4.017 1.00 0.00 C ATOM 634 O CYS A 379 5.672 12.747 3.729 1.00 0.00 O ATOM 635 CB CYS A 379 3.775 10.388 2.219 1.00 0.00 C ATOM 636 SG CYS A 379 3.475 8.887 3.200 1.00 0.00 S ATOM 0 H CYS A 379 4.111 12.748 1.349 1.00 0.00 H new ATOM 0 HA CYS A 379 2.732 11.568 3.702 1.00 0.00 H new ATOM 0 HB2 CYS A 379 3.088 10.411 1.373 1.00 0.00 H new ATOM 0 HB3 CYS A 379 4.784 10.356 1.809 1.00 0.00 H new ATOM 641 N SER A 380 4.798 11.248 5.163 1.00 0.00 N ATOM 642 CA SER A 380 5.812 11.388 6.230 1.00 0.00 C ATOM 643 C SER A 380 6.291 10.065 6.853 1.00 0.00 C ATOM 644 O SER A 380 7.269 10.060 7.606 1.00 0.00 O ATOM 645 CB SER A 380 5.271 12.309 7.331 1.00 0.00 C ATOM 646 OG SER A 380 4.095 11.762 7.914 1.00 0.00 O ATOM 0 H SER A 380 4.082 10.557 5.388 1.00 0.00 H new ATOM 0 HA SER A 380 6.690 11.815 5.746 1.00 0.00 H new ATOM 0 HB2 SER A 380 6.031 12.450 8.099 1.00 0.00 H new ATOM 0 HB3 SER A 380 5.052 13.292 6.914 1.00 0.00 H new ATOM 0 HG SER A 380 3.767 12.364 8.615 1.00 0.00 H new ATOM 652 N LEU A 381 5.649 8.936 6.530 1.00 0.00 N ATOM 653 CA LEU A 381 6.015 7.591 6.990 1.00 0.00 C ATOM 654 C LEU A 381 7.389 7.204 6.381 1.00 0.00 C ATOM 655 O LEU A 381 7.513 7.209 5.154 1.00 0.00 O ATOM 656 CB LEU A 381 4.865 6.661 6.547 1.00 0.00 C ATOM 657 CG LEU A 381 4.958 5.188 6.982 1.00 0.00 C ATOM 658 CD1 LEU A 381 4.818 5.021 8.497 1.00 0.00 C ATOM 659 CD2 LEU A 381 3.822 4.396 6.332 1.00 0.00 C ATOM 0 H LEU A 381 4.832 8.934 5.920 1.00 0.00 H new ATOM 0 HA LEU A 381 6.134 7.521 8.071 1.00 0.00 H new ATOM 0 HB2 LEU A 381 3.930 7.070 6.930 1.00 0.00 H new ATOM 0 HB3 LEU A 381 4.804 6.691 5.459 1.00 0.00 H new ATOM 0 HG LEU A 381 5.938 4.826 6.673 1.00 0.00 H new ATOM 0 HD11 LEU A 381 4.890 3.964 8.755 1.00 0.00 H new ATOM 0 HD12 LEU A 381 5.613 5.572 8.999 1.00 0.00 H new ATOM 0 HD13 LEU A 381 3.851 5.407 8.818 1.00 0.00 H new ATOM 0 HD21 LEU A 381 3.885 3.352 6.638 1.00 0.00 H new ATOM 0 HD22 LEU A 381 2.864 4.809 6.647 1.00 0.00 H new ATOM 0 HD23 LEU A 381 3.907 4.462 5.247 1.00 0.00 H new ATOM 671 N PRO A 382 8.442 6.887 7.165 1.00 0.00 N ATOM 672 CA PRO A 382 9.769 6.604 6.603 1.00 0.00 C ATOM 673 C PRO A 382 9.857 5.278 5.828 1.00 0.00 C ATOM 674 O PRO A 382 10.511 5.216 4.786 1.00 0.00 O ATOM 675 CB PRO A 382 10.729 6.641 7.798 1.00 0.00 C ATOM 676 CG PRO A 382 9.848 6.273 8.991 1.00 0.00 C ATOM 677 CD PRO A 382 8.484 6.854 8.620 1.00 0.00 C ATOM 0 HA PRO A 382 10.022 7.346 5.846 1.00 0.00 H new ATOM 0 HB2 PRO A 382 11.549 5.933 7.674 1.00 0.00 H new ATOM 0 HB3 PRO A 382 11.176 7.628 7.921 1.00 0.00 H new ATOM 0 HG2 PRO A 382 9.799 5.194 9.136 1.00 0.00 H new ATOM 0 HG3 PRO A 382 10.228 6.702 9.918 1.00 0.00 H new ATOM 0 HD2 PRO A 382 7.677 6.240 9.019 1.00 0.00 H new ATOM 0 HD3 PRO A 382 8.360 7.854 9.036 1.00 0.00 H new ATOM 685 N HIS A 383 9.190 4.216 6.303 1.00 0.00 N ATOM 686 CA HIS A 383 9.196 2.888 5.663 1.00 0.00 C ATOM 687 C HIS A 383 8.504 2.870 4.279 1.00 0.00 C ATOM 688 O HIS A 383 8.783 2.002 3.444 1.00 0.00 O ATOM 689 CB HIS A 383 8.551 1.877 6.628 1.00 0.00 C ATOM 690 CG HIS A 383 9.048 0.458 6.484 1.00 0.00 C ATOM 691 ND1 HIS A 383 9.447 -0.173 5.326 1.00 0.00 N ATOM 692 CD2 HIS A 383 9.167 -0.456 7.497 1.00 0.00 C ATOM 693 CE1 HIS A 383 9.801 -1.434 5.635 1.00 0.00 C ATOM 694 NE2 HIS A 383 9.646 -1.656 6.953 1.00 0.00 N ATOM 0 H HIS A 383 8.625 4.253 7.151 1.00 0.00 H new ATOM 0 HA HIS A 383 10.232 2.611 5.465 1.00 0.00 H new ATOM 0 HB2 HIS A 383 8.730 2.208 7.651 1.00 0.00 H new ATOM 0 HB3 HIS A 383 7.472 1.887 6.474 1.00 0.00 H new ATOM 0 HD1 HIS A 383 9.470 0.244 4.395 1.00 0.00 H new ATOM 0 HD2 HIS A 383 8.932 -0.282 8.537 1.00 0.00 H new ATOM 0 HE1 HIS A 383 10.159 -2.165 4.925 1.00 0.00 H new ATOM 702 N CYS A 384 7.629 3.852 4.031 1.00 0.00 N ATOM 703 CA CYS A 384 6.873 4.067 2.800 1.00 0.00 C ATOM 704 C CYS A 384 7.773 4.121 1.558 1.00 0.00 C ATOM 705 O CYS A 384 7.571 3.380 0.598 1.00 0.00 O ATOM 706 CB CYS A 384 6.144 5.401 2.994 1.00 0.00 C ATOM 707 SG CYS A 384 5.017 5.776 1.633 1.00 0.00 S ATOM 0 H CYS A 384 7.420 4.562 4.733 1.00 0.00 H new ATOM 0 HA CYS A 384 6.187 3.239 2.625 1.00 0.00 H new ATOM 0 HB2 CYS A 384 5.584 5.373 3.929 1.00 0.00 H new ATOM 0 HB3 CYS A 384 6.877 6.202 3.086 1.00 0.00 H new ATOM 712 N ARG A 385 8.795 4.984 1.596 1.00 0.00 N ATOM 713 CA ARG A 385 9.767 5.208 0.510 1.00 0.00 C ATOM 714 C ARG A 385 10.554 3.939 0.166 1.00 0.00 C ATOM 715 O ARG A 385 10.790 3.645 -1.008 1.00 0.00 O ATOM 716 CB ARG A 385 10.701 6.365 0.903 1.00 0.00 C ATOM 717 CG ARG A 385 9.997 7.654 1.367 1.00 0.00 C ATOM 718 CD ARG A 385 8.826 8.171 0.522 1.00 0.00 C ATOM 719 NE ARG A 385 9.206 8.584 -0.846 1.00 0.00 N ATOM 720 CZ ARG A 385 8.379 9.141 -1.716 1.00 0.00 C ATOM 721 NH1 ARG A 385 7.143 9.400 -1.413 1.00 0.00 N ATOM 722 NH2 ARG A 385 8.751 9.446 -2.924 1.00 0.00 N ATOM 0 H ARG A 385 8.978 5.569 2.412 1.00 0.00 H new ATOM 0 HA ARG A 385 9.222 5.477 -0.395 1.00 0.00 H new ATOM 0 HB2 ARG A 385 11.359 6.023 1.702 1.00 0.00 H new ATOM 0 HB3 ARG A 385 11.334 6.604 0.049 1.00 0.00 H new ATOM 0 HG2 ARG A 385 9.632 7.490 2.381 1.00 0.00 H new ATOM 0 HG3 ARG A 385 10.746 8.444 1.421 1.00 0.00 H new ATOM 0 HD2 ARG A 385 8.067 7.392 0.457 1.00 0.00 H new ATOM 0 HD3 ARG A 385 8.370 9.019 1.033 1.00 0.00 H new ATOM 0 HE ARG A 385 10.171 8.429 -1.139 1.00 0.00 H new ATOM 0 HH11 ARG A 385 6.787 9.174 -0.484 1.00 0.00 H new ATOM 0 HH12 ARG A 385 6.528 9.830 -2.104 1.00 0.00 H new ATOM 0 HH21 ARG A 385 9.707 9.257 -3.226 1.00 0.00 H new ATOM 0 HH22 ARG A 385 8.087 9.875 -3.569 1.00 0.00 H new ATOM 736 N THR A 386 10.898 3.151 1.182 1.00 0.00 N ATOM 737 CA THR A 386 11.577 1.856 1.054 1.00 0.00 C ATOM 738 C THR A 386 10.658 0.880 0.329 1.00 0.00 C ATOM 739 O THR A 386 11.055 0.307 -0.684 1.00 0.00 O ATOM 740 CB THR A 386 11.968 1.295 2.433 1.00 0.00 C ATOM 741 OG1 THR A 386 12.724 2.259 3.137 1.00 0.00 O ATOM 742 CG2 THR A 386 12.811 0.022 2.347 1.00 0.00 C ATOM 0 H THR A 386 10.707 3.402 2.152 1.00 0.00 H new ATOM 0 HA THR A 386 12.494 1.994 0.481 1.00 0.00 H new ATOM 0 HB THR A 386 11.035 1.055 2.942 1.00 0.00 H new ATOM 0 HG1 THR A 386 12.972 1.903 4.016 1.00 0.00 H new ATOM 0 HG21 THR A 386 13.053 -0.323 3.352 1.00 0.00 H new ATOM 0 HG22 THR A 386 12.249 -0.752 1.824 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.732 0.232 1.803 1.00 0.00 H new ATOM 750 N MET A 387 9.405 0.730 0.778 1.00 0.00 N ATOM 751 CA MET A 387 8.448 -0.154 0.102 1.00 0.00 C ATOM 752 C MET A 387 8.057 0.343 -1.296 1.00 0.00 C ATOM 753 O MET A 387 7.877 -0.478 -2.186 1.00 0.00 O ATOM 754 CB MET A 387 7.240 -0.469 0.996 1.00 0.00 C ATOM 755 CG MET A 387 7.367 -1.918 1.490 1.00 0.00 C ATOM 756 SD MET A 387 8.877 -2.315 2.419 1.00 0.00 S ATOM 757 CE MET A 387 9.062 -4.076 2.003 1.00 0.00 C ATOM 0 H MET A 387 9.033 1.206 1.600 1.00 0.00 H new ATOM 0 HA MET A 387 8.960 -1.101 -0.071 1.00 0.00 H new ATOM 0 HB2 MET A 387 7.204 0.218 1.841 1.00 0.00 H new ATOM 0 HB3 MET A 387 6.312 -0.338 0.440 1.00 0.00 H new ATOM 0 HG2 MET A 387 6.507 -2.142 2.121 1.00 0.00 H new ATOM 0 HG3 MET A 387 7.311 -2.581 0.627 1.00 0.00 H new ATOM 0 HE1 MET A 387 10.034 -4.431 2.346 1.00 0.00 H new ATOM 0 HE2 MET A 387 8.274 -4.650 2.490 1.00 0.00 H new ATOM 0 HE3 MET A 387 8.989 -4.204 0.923 1.00 0.00 H new ATOM 767 N LYS A 388 8.010 1.657 -1.544 1.00 0.00 N ATOM 768 CA LYS A 388 7.825 2.247 -2.886 1.00 0.00 C ATOM 769 C LYS A 388 8.969 1.814 -3.814 1.00 0.00 C ATOM 770 O LYS A 388 8.722 1.392 -4.947 1.00 0.00 O ATOM 771 CB LYS A 388 7.761 3.781 -2.747 1.00 0.00 C ATOM 772 CG LYS A 388 6.362 4.315 -2.385 1.00 0.00 C ATOM 773 CD LYS A 388 6.482 5.739 -1.826 1.00 0.00 C ATOM 774 CE LYS A 388 5.144 6.442 -1.554 1.00 0.00 C ATOM 775 NZ LYS A 388 4.613 7.147 -2.743 1.00 0.00 N ATOM 0 H LYS A 388 8.101 2.357 -0.808 1.00 0.00 H new ATOM 0 HA LYS A 388 6.894 1.894 -3.329 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.470 4.097 -1.981 1.00 0.00 H new ATOM 0 HB3 LYS A 388 8.082 4.235 -3.685 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.722 4.313 -3.267 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.892 3.663 -1.649 1.00 0.00 H new ATOM 0 HD2 LYS A 388 7.052 5.702 -0.898 1.00 0.00 H new ATOM 0 HD3 LYS A 388 7.056 6.342 -2.529 1.00 0.00 H new ATOM 0 HE2 LYS A 388 4.414 5.706 -1.218 1.00 0.00 H new ATOM 0 HE3 LYS A 388 5.273 7.157 -0.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.784 7.713 -2.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 5.347 7.773 -3.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.334 6.451 -3.464 1.00 0.00 H new ATOM 789 N ASN A 389 10.213 1.839 -3.314 1.00 0.00 N ATOM 790 CA ASN A 389 11.377 1.375 -4.086 1.00 0.00 C ATOM 791 C ASN A 389 11.311 -0.145 -4.337 1.00 0.00 C ATOM 792 O ASN A 389 11.555 -0.595 -5.455 1.00 0.00 O ATOM 793 CB ASN A 389 12.684 1.804 -3.393 1.00 0.00 C ATOM 794 CG ASN A 389 13.102 3.208 -3.800 1.00 0.00 C ATOM 795 OD1 ASN A 389 13.891 3.404 -4.714 1.00 0.00 O ATOM 796 ND2 ASN A 389 12.583 4.229 -3.159 1.00 0.00 N ATOM 0 H ASN A 389 10.440 2.176 -2.378 1.00 0.00 H new ATOM 0 HA ASN A 389 11.359 1.849 -5.067 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.553 1.762 -2.312 1.00 0.00 H new ATOM 0 HB3 ASN A 389 13.477 1.101 -3.645 1.00 0.00 H new ATOM 0 HD21 ASN A 389 12.838 5.180 -3.424 1.00 0.00 H new ATOM 0 HD22 ASN A 389 11.925 4.071 -2.396 1.00 0.00 H new ATOM 803 N VAL A 390 10.913 -0.932 -3.331 1.00 0.00 N ATOM 804 CA VAL A 390 10.699 -2.391 -3.442 1.00 0.00 C ATOM 805 C VAL A 390 9.593 -2.705 -4.447 1.00 0.00 C ATOM 806 O VAL A 390 9.717 -3.669 -5.193 1.00 0.00 O ATOM 807 CB VAL A 390 10.313 -2.976 -2.072 1.00 0.00 C ATOM 808 CG1 VAL A 390 9.772 -4.415 -2.131 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.506 -2.961 -1.114 1.00 0.00 C ATOM 0 H VAL A 390 10.725 -0.571 -2.396 1.00 0.00 H new ATOM 0 HA VAL A 390 11.630 -2.841 -3.787 1.00 0.00 H new ATOM 0 HB VAL A 390 9.510 -2.331 -1.714 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.524 -4.752 -1.125 1.00 0.00 H new ATOM 0 HG12 VAL A 390 8.878 -4.442 -2.754 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.531 -5.072 -2.557 1.00 0.00 H new ATOM 0 HG21 VAL A 390 11.206 -3.380 -0.153 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.316 -3.557 -1.533 1.00 0.00 H new ATOM 0 HG23 VAL A 390 11.846 -1.935 -0.973 1.00 0.00 H new ATOM 819 N LEU A 391 8.519 -1.912 -4.491 1.00 0.00 N ATOM 820 CA LEU A 391 7.405 -2.111 -5.415 1.00 0.00 C ATOM 821 C LEU A 391 7.896 -1.884 -6.852 1.00 0.00 C ATOM 822 O LEU A 391 7.767 -2.767 -7.696 1.00 0.00 O ATOM 823 CB LEU A 391 6.228 -1.197 -5.018 1.00 0.00 C ATOM 824 CG LEU A 391 4.835 -1.665 -5.478 1.00 0.00 C ATOM 825 CD1 LEU A 391 3.792 -0.648 -5.015 1.00 0.00 C ATOM 826 CD2 LEU A 391 4.685 -1.824 -6.990 1.00 0.00 C ATOM 0 H LEU A 391 8.400 -1.105 -3.878 1.00 0.00 H new ATOM 0 HA LEU A 391 7.033 -3.134 -5.361 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.218 -1.099 -3.932 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.410 -0.203 -5.426 1.00 0.00 H new ATOM 0 HG LEU A 391 4.694 -2.651 -5.036 1.00 0.00 H new ATOM 0 HD11 LEU A 391 2.802 -0.971 -5.336 1.00 0.00 H new ATOM 0 HD12 LEU A 391 3.814 -0.573 -3.928 1.00 0.00 H new ATOM 0 HD13 LEU A 391 4.015 0.326 -5.450 1.00 0.00 H new ATOM 0 HD21 LEU A 391 3.673 -2.156 -7.222 1.00 0.00 H new ATOM 0 HD22 LEU A 391 4.873 -0.867 -7.477 1.00 0.00 H new ATOM 0 HD23 LEU A 391 5.401 -2.562 -7.351 1.00 0.00 H new ATOM 838 N ASN A 392 8.547 -0.748 -7.121 1.00 0.00 N ATOM 839 CA ASN A 392 9.125 -0.472 -8.444 1.00 0.00 C ATOM 840 C ASN A 392 10.157 -1.550 -8.842 1.00 0.00 C ATOM 841 O ASN A 392 10.215 -1.973 -10.000 1.00 0.00 O ATOM 842 CB ASN A 392 9.731 0.939 -8.406 1.00 0.00 C ATOM 843 CG ASN A 392 10.393 1.330 -9.717 1.00 0.00 C ATOM 844 OD1 ASN A 392 11.580 1.127 -9.925 1.00 0.00 O ATOM 845 ND2 ASN A 392 9.655 1.907 -10.638 1.00 0.00 N ATOM 0 H ASN A 392 8.688 -0.002 -6.440 1.00 0.00 H new ATOM 0 HA ASN A 392 8.353 -0.510 -9.213 1.00 0.00 H new ATOM 0 HB2 ASN A 392 8.948 1.660 -8.170 1.00 0.00 H new ATOM 0 HB3 ASN A 392 10.466 0.993 -7.603 1.00 0.00 H new ATOM 0 HD21 ASN A 392 10.073 2.185 -11.526 1.00 0.00 H new ATOM 0 HD22 ASN A 392 8.664 2.077 -10.465 1.00 0.00 H new ATOM 852 N HIS A 393 10.926 -2.063 -7.877 1.00 0.00 N ATOM 853 CA HIS A 393 11.821 -3.180 -8.152 1.00 0.00 C ATOM 854 C HIS A 393 11.002 -4.423 -8.513 1.00 0.00 C ATOM 855 O HIS A 393 11.276 -5.027 -9.543 1.00 0.00 O ATOM 856 CB HIS A 393 12.764 -3.460 -6.983 1.00 0.00 C ATOM 857 CG HIS A 393 13.649 -4.648 -7.280 1.00 0.00 C ATOM 858 ND1 HIS A 393 14.854 -4.645 -7.949 1.00 0.00 N ATOM 859 CD2 HIS A 393 13.274 -5.957 -7.149 1.00 0.00 C ATOM 860 CE1 HIS A 393 15.187 -5.922 -8.217 1.00 0.00 C ATOM 861 NE2 HIS A 393 14.242 -6.762 -7.762 1.00 0.00 N ATOM 0 H HIS A 393 10.945 -1.726 -6.914 1.00 0.00 H new ATOM 0 HA HIS A 393 12.449 -2.910 -9.001 1.00 0.00 H new ATOM 0 HB2 HIS A 393 13.380 -2.582 -6.788 1.00 0.00 H new ATOM 0 HB3 HIS A 393 12.184 -3.650 -6.080 1.00 0.00 H new ATOM 0 HD1 HIS A 393 15.399 -3.819 -8.198 1.00 0.00 H new ATOM 0 HD2 HIS A 393 12.381 -6.310 -6.655 1.00 0.00 H new ATOM 0 HE1 HIS A 393 16.088 -6.228 -8.727 1.00 0.00 H new ATOM 869 N MET A 394 9.979 -4.791 -7.725 1.00 0.00 N ATOM 870 CA MET A 394 9.122 -5.948 -8.007 1.00 0.00 C ATOM 871 C MET A 394 8.456 -5.849 -9.394 1.00 0.00 C ATOM 872 O MET A 394 8.181 -6.888 -9.999 1.00 0.00 O ATOM 873 CB MET A 394 8.101 -6.253 -6.880 1.00 0.00 C ATOM 874 CG MET A 394 6.732 -5.555 -6.996 1.00 0.00 C ATOM 875 SD MET A 394 5.302 -6.659 -6.901 1.00 0.00 S ATOM 876 CE MET A 394 5.369 -6.947 -5.121 1.00 0.00 C ATOM 0 H MET A 394 9.724 -4.292 -6.873 1.00 0.00 H new ATOM 0 HA MET A 394 9.788 -6.811 -8.032 1.00 0.00 H new ATOM 0 HB2 MET A 394 7.935 -7.330 -6.850 1.00 0.00 H new ATOM 0 HB3 MET A 394 8.549 -5.973 -5.927 1.00 0.00 H new ATOM 0 HG2 MET A 394 6.652 -4.811 -6.203 1.00 0.00 H new ATOM 0 HG3 MET A 394 6.694 -5.017 -7.943 1.00 0.00 H new ATOM 0 HE1 MET A 394 4.571 -7.631 -4.833 1.00 0.00 H new ATOM 0 HE2 MET A 394 6.333 -7.383 -4.859 1.00 0.00 H new ATOM 0 HE3 MET A 394 5.244 -6.001 -4.594 1.00 0.00 H new ATOM 886 N THR A 395 8.221 -4.631 -9.916 1.00 0.00 N ATOM 887 CA THR A 395 7.656 -4.449 -11.271 1.00 0.00 C ATOM 888 C THR A 395 8.724 -4.649 -12.350 1.00 0.00 C ATOM 889 O THR A 395 8.451 -5.287 -13.370 1.00 0.00 O ATOM 890 CB THR A 395 6.948 -3.097 -11.503 1.00 0.00 C ATOM 891 OG1 THR A 395 7.823 -1.993 -11.477 1.00 0.00 O ATOM 892 CG2 THR A 395 5.838 -2.811 -10.499 1.00 0.00 C ATOM 0 H THR A 395 8.412 -3.759 -9.423 1.00 0.00 H new ATOM 0 HA THR A 395 6.888 -5.219 -11.347 1.00 0.00 H new ATOM 0 HB THR A 395 6.525 -3.212 -12.501 1.00 0.00 H new ATOM 0 HG1 THR A 395 8.512 -2.138 -10.796 1.00 0.00 H new ATOM 0 HG21 THR A 395 5.385 -1.845 -10.723 1.00 0.00 H new ATOM 0 HG22 THR A 395 5.079 -3.591 -10.563 1.00 0.00 H new ATOM 0 HG23 THR A 395 6.254 -2.792 -9.492 1.00 0.00 H new ATOM 900 N HIS A 396 9.946 -4.149 -12.128 1.00 0.00 N ATOM 901 CA HIS A 396 11.080 -4.307 -13.053 1.00 0.00 C ATOM 902 C HIS A 396 11.791 -5.681 -12.957 1.00 0.00 C ATOM 903 O HIS A 396 12.613 -6.013 -13.817 1.00 0.00 O ATOM 904 CB HIS A 396 12.071 -3.152 -12.830 1.00 0.00 C ATOM 905 CG HIS A 396 11.537 -1.817 -13.294 1.00 0.00 C ATOM 906 ND1 HIS A 396 10.478 -1.126 -12.753 1.00 0.00 N ATOM 907 CD2 HIS A 396 11.978 -1.092 -14.370 1.00 0.00 C ATOM 908 CE1 HIS A 396 10.274 -0.019 -13.484 1.00 0.00 C ATOM 909 NE2 HIS A 396 11.173 0.052 -14.483 1.00 0.00 N ATOM 0 H HIS A 396 10.180 -3.616 -11.290 1.00 0.00 H new ATOM 0 HA HIS A 396 10.677 -4.273 -14.065 1.00 0.00 H new ATOM 0 HB2 HIS A 396 12.316 -3.090 -11.770 1.00 0.00 H new ATOM 0 HB3 HIS A 396 12.999 -3.370 -13.359 1.00 0.00 H new ATOM 0 HD1 HIS A 396 9.939 -1.407 -11.934 1.00 0.00 H new ATOM 0 HD2 HIS A 396 12.801 -1.355 -15.018 1.00 0.00 H new ATOM 0 HE1 HIS A 396 9.500 0.710 -13.297 1.00 0.00 H new ATOM 917 N CYS A 397 11.499 -6.465 -11.913 1.00 0.00 N ATOM 918 CA CYS A 397 12.063 -7.776 -11.592 1.00 0.00 C ATOM 919 C CYS A 397 11.910 -8.825 -12.716 1.00 0.00 C ATOM 920 O CYS A 397 11.032 -8.719 -13.580 1.00 0.00 O ATOM 921 CB CYS A 397 11.377 -8.243 -10.297 1.00 0.00 C ATOM 922 SG CYS A 397 12.391 -9.454 -9.417 1.00 0.00 S ATOM 0 H CYS A 397 10.810 -6.175 -11.219 1.00 0.00 H new ATOM 0 HA CYS A 397 13.142 -7.676 -11.470 1.00 0.00 H new ATOM 0 HB2 CYS A 397 11.190 -7.385 -9.652 1.00 0.00 H new ATOM 0 HB3 CYS A 397 10.407 -8.681 -10.534 1.00 0.00 H new ATOM 927 N GLN A 398 12.747 -9.869 -12.670 1.00 0.00 N ATOM 928 CA GLN A 398 12.759 -10.983 -13.636 1.00 0.00 C ATOM 929 C GLN A 398 12.728 -12.384 -12.991 1.00 0.00 C ATOM 930 O GLN A 398 12.995 -13.394 -13.646 1.00 0.00 O ATOM 931 CB GLN A 398 13.909 -10.801 -14.648 1.00 0.00 C ATOM 932 CG GLN A 398 13.720 -9.560 -15.537 1.00 0.00 C ATOM 933 CD GLN A 398 14.775 -9.483 -16.638 1.00 0.00 C ATOM 934 OE1 GLN A 398 14.637 -10.052 -17.716 1.00 0.00 O ATOM 935 NE2 GLN A 398 15.872 -8.783 -16.423 1.00 0.00 N ATOM 0 H GLN A 398 13.455 -9.968 -11.942 1.00 0.00 H new ATOM 0 HA GLN A 398 11.818 -10.937 -14.184 1.00 0.00 H new ATOM 0 HB2 GLN A 398 14.853 -10.718 -14.109 1.00 0.00 H new ATOM 0 HB3 GLN A 398 13.978 -11.688 -15.278 1.00 0.00 H new ATOM 0 HG2 GLN A 398 12.727 -9.583 -15.986 1.00 0.00 H new ATOM 0 HG3 GLN A 398 13.771 -8.662 -14.922 1.00 0.00 H new ATOM 0 HE21 GLN A 398 16.004 -8.303 -15.533 1.00 0.00 H new ATOM 0 HE22 GLN A 398 16.588 -8.722 -17.147 1.00 0.00 H new ATOM 944 N ALA A 399 12.333 -12.450 -11.717 1.00 0.00 N ATOM 945 CA ALA A 399 12.106 -13.692 -10.971 1.00 0.00 C ATOM 946 C ALA A 399 10.979 -13.560 -9.943 1.00 0.00 C ATOM 947 O ALA A 399 10.231 -14.512 -9.718 1.00 0.00 O ATOM 948 CB ALA A 399 13.371 -14.122 -10.218 1.00 0.00 C ATOM 0 H ALA A 399 12.157 -11.615 -11.158 1.00 0.00 H new ATOM 0 HA ALA A 399 11.828 -14.437 -11.717 1.00 0.00 H new ATOM 0 HB1 ALA A 399 13.174 -15.046 -9.674 1.00 0.00 H new ATOM 0 HB2 ALA A 399 14.180 -14.286 -10.930 1.00 0.00 H new ATOM 0 HB3 ALA A 399 13.659 -13.341 -9.515 1.00 0.00 H new ATOM 954 N PRO A 400 10.883 -12.389 -9.307 1.00 0.00 N ATOM 955 CA PRO A 400 9.947 -12.054 -8.230 1.00 0.00 C ATOM 956 C PRO A 400 10.143 -12.881 -6.947 1.00 0.00 C ATOM 957 O PRO A 400 10.558 -12.353 -5.919 1.00 0.00 O ATOM 961 N LYS A 401 9.874 -14.191 -7.012 1.00 0.00 N ATOM 962 CA LYS A 401 10.019 -15.169 -5.915 1.00 0.00 C ATOM 963 C LYS A 401 11.466 -15.635 -5.723 1.00 0.00 C ATOM 964 O LYS A 401 11.981 -15.659 -4.606 1.00 0.00 O ATOM 965 CB LYS A 401 9.078 -16.356 -6.199 1.00 0.00 C ATOM 966 CG LYS A 401 9.091 -17.411 -5.078 1.00 0.00 C ATOM 967 CD LYS A 401 8.048 -18.524 -5.276 1.00 0.00 C ATOM 968 CE LYS A 401 8.311 -19.360 -6.537 1.00 0.00 C ATOM 969 NZ LYS A 401 7.355 -20.493 -6.653 1.00 0.00 N ATOM 0 H LYS A 401 9.533 -14.623 -7.870 1.00 0.00 H new ATOM 0 HA LYS A 401 9.743 -14.687 -4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 401 8.062 -15.984 -6.330 1.00 0.00 H new ATOM 0 HB3 LYS A 401 9.368 -16.827 -7.138 1.00 0.00 H new ATOM 0 HG2 LYS A 401 10.083 -17.859 -5.022 1.00 0.00 H new ATOM 0 HG3 LYS A 401 8.909 -16.918 -4.123 1.00 0.00 H new ATOM 0 HD2 LYS A 401 8.049 -19.178 -4.404 1.00 0.00 H new ATOM 0 HD3 LYS A 401 7.055 -18.079 -5.340 1.00 0.00 H new ATOM 0 HE2 LYS A 401 8.231 -18.724 -7.419 1.00 0.00 H new ATOM 0 HE3 LYS A 401 9.331 -19.745 -6.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 7.562 -21.035 -7.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 7.449 -21.113 -5.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 6.384 -20.124 -6.701 1.00 0.00 H new ATOM 983 N ALA A 402 12.116 -15.995 -6.832 1.00 0.00 N ATOM 984 CA ALA A 402 13.497 -16.488 -6.891 1.00 0.00 C ATOM 985 C ALA A 402 14.548 -15.360 -6.826 1.00 0.00 C ATOM 986 O ALA A 402 15.732 -15.636 -6.639 1.00 0.00 O ATOM 987 CB ALA A 402 13.669 -17.472 -8.057 1.00 0.00 C ATOM 0 H ALA A 402 11.678 -15.950 -7.752 1.00 0.00 H new ATOM 0 HA ALA A 402 13.695 -17.059 -5.984 1.00 0.00 H new ATOM 0 HB1 ALA A 402 14.699 -17.827 -8.085 1.00 0.00 H new ATOM 0 HB2 ALA A 402 12.997 -18.319 -7.920 1.00 0.00 H new ATOM 0 HB3 ALA A 402 13.433 -16.969 -8.995 1.00 0.00 H new ATOM 993 N CYS A 403 14.115 -14.093 -6.928 1.00 0.00 N ATOM 994 CA CYS A 403 14.893 -12.865 -6.768 1.00 0.00 C ATOM 995 C CYS A 403 15.037 -12.612 -5.242 1.00 0.00 C ATOM 996 O CYS A 403 14.572 -11.631 -4.668 1.00 0.00 O ATOM 997 CB CYS A 403 14.272 -11.681 -7.517 1.00 0.00 C ATOM 998 SG CYS A 403 15.216 -10.147 -7.228 1.00 0.00 S ATOM 0 H CYS A 403 13.138 -13.891 -7.140 1.00 0.00 H new ATOM 0 HA CYS A 403 15.880 -12.977 -7.217 1.00 0.00 H new ATOM 0 HB2 CYS A 403 14.244 -11.898 -8.585 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.241 -11.543 -7.192 1.00 0.00 H new ATOM 1003 N GLN A 404 15.582 -13.632 -4.590 1.00 0.00 N ATOM 1004 CA GLN A 404 15.869 -13.899 -3.170 1.00 0.00 C ATOM 1005 C GLN A 404 16.185 -12.725 -2.211 1.00 0.00 C ATOM 1006 O GLN A 404 16.239 -12.948 -0.999 1.00 0.00 O ATOM 1007 CB GLN A 404 16.936 -15.011 -3.071 1.00 0.00 C ATOM 1008 CG GLN A 404 18.398 -14.565 -3.279 1.00 0.00 C ATOM 1009 CD GLN A 404 18.697 -13.994 -4.665 1.00 0.00 C ATOM 1010 OE1 GLN A 404 18.626 -14.671 -5.681 1.00 0.00 O ATOM 1011 NE2 GLN A 404 19.067 -12.733 -4.769 1.00 0.00 N ATOM 0 H GLN A 404 15.888 -14.435 -5.140 1.00 0.00 H new ATOM 0 HA GLN A 404 14.897 -14.203 -2.781 1.00 0.00 H new ATOM 0 HB2 GLN A 404 16.856 -15.478 -2.089 1.00 0.00 H new ATOM 0 HB3 GLN A 404 16.702 -15.778 -3.809 1.00 0.00 H new ATOM 0 HG2 GLN A 404 18.645 -13.813 -2.529 1.00 0.00 H new ATOM 0 HG3 GLN A 404 19.053 -15.418 -3.103 1.00 0.00 H new ATOM 0 HE21 GLN A 404 19.133 -12.150 -3.934 1.00 0.00 H new ATOM 0 HE22 GLN A 404 19.287 -12.340 -5.684 1.00 0.00 H new ATOM 1020 N VAL A 405 16.391 -11.499 -2.705 1.00 0.00 N ATOM 1021 CA VAL A 405 16.608 -10.281 -1.900 1.00 0.00 C ATOM 1022 C VAL A 405 15.449 -10.154 -0.910 1.00 0.00 C ATOM 1023 O VAL A 405 14.293 -10.183 -1.329 1.00 0.00 O ATOM 1024 CB VAL A 405 16.666 -9.016 -2.783 1.00 0.00 C ATOM 1025 CG1 VAL A 405 17.097 -7.796 -1.957 1.00 0.00 C ATOM 1026 CG2 VAL A 405 17.640 -9.166 -3.955 1.00 0.00 C ATOM 0 H VAL A 405 16.413 -11.316 -3.708 1.00 0.00 H new ATOM 0 HA VAL A 405 17.563 -10.366 -1.382 1.00 0.00 H new ATOM 0 HB VAL A 405 15.660 -8.876 -3.177 1.00 0.00 H new ATOM 0 HG11 VAL A 405 17.131 -6.916 -2.599 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.381 -7.630 -1.152 1.00 0.00 H new ATOM 0 HG13 VAL A 405 18.085 -7.974 -1.533 1.00 0.00 H new ATOM 0 HG21 VAL A 405 17.644 -8.249 -4.545 1.00 0.00 H new ATOM 0 HG22 VAL A 405 18.643 -9.355 -3.573 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.328 -10.000 -4.583 1.00 0.00 H new ATOM 1036 N ALA A 406 15.753 -10.052 0.388 1.00 0.00 N ATOM 1037 CA ALA A 406 14.785 -10.050 1.489 1.00 0.00 C ATOM 1038 C ALA A 406 13.435 -9.374 1.184 1.00 0.00 C ATOM 1039 O ALA A 406 12.400 -10.042 1.118 1.00 0.00 O ATOM 1040 CB ALA A 406 15.473 -9.477 2.737 1.00 0.00 C ATOM 0 H ALA A 406 16.716 -9.965 0.712 1.00 0.00 H new ATOM 0 HA ALA A 406 14.489 -11.085 1.663 1.00 0.00 H new ATOM 0 HB1 ALA A 406 14.768 -9.467 3.569 1.00 0.00 H new ATOM 0 HB2 ALA A 406 16.331 -10.097 2.996 1.00 0.00 H new ATOM 0 HB3 ALA A 406 15.808 -8.460 2.533 1.00 0.00 H new ATOM 1046 N HIS A 407 13.439 -8.056 0.974 1.00 0.00 N ATOM 1047 CA HIS A 407 12.204 -7.310 0.718 1.00 0.00 C ATOM 1048 C HIS A 407 11.532 -7.633 -0.628 1.00 0.00 C ATOM 1049 O HIS A 407 10.305 -7.668 -0.653 1.00 0.00 O ATOM 1050 CB HIS A 407 12.423 -5.800 0.886 1.00 0.00 C ATOM 1051 CG HIS A 407 13.044 -5.405 2.205 1.00 0.00 C ATOM 1052 ND1 HIS A 407 14.263 -4.786 2.377 1.00 0.00 N ATOM 1053 CD2 HIS A 407 12.508 -5.591 3.452 1.00 0.00 C ATOM 1054 CE1 HIS A 407 14.461 -4.607 3.695 1.00 0.00 C ATOM 1055 NE2 HIS A 407 13.415 -5.084 4.395 1.00 0.00 N ATOM 0 H HIS A 407 14.283 -7.483 0.976 1.00 0.00 H new ATOM 0 HA HIS A 407 11.499 -7.650 1.477 1.00 0.00 H new ATOM 0 HB2 HIS A 407 13.061 -5.445 0.077 1.00 0.00 H new ATOM 0 HB3 HIS A 407 11.464 -5.292 0.782 1.00 0.00 H new ATOM 0 HD2 HIS A 407 11.554 -6.048 3.671 1.00 0.00 H new ATOM 0 HE1 HIS A 407 15.335 -4.146 4.130 1.00 0.00 H new ATOM 0 HE2 HIS A 407 13.304 -5.078 5.409 1.00 0.00 H new ATOM 1063 N CYS A 408 12.264 -7.906 -1.720 1.00 0.00 N ATOM 1064 CA CYS A 408 11.661 -8.252 -3.018 1.00 0.00 C ATOM 1065 C CYS A 408 10.987 -9.634 -2.977 1.00 0.00 C ATOM 1066 O CYS A 408 9.785 -9.749 -3.242 1.00 0.00 O ATOM 1067 CB CYS A 408 12.751 -8.195 -4.099 1.00 0.00 C ATOM 1068 SG CYS A 408 12.088 -8.704 -5.717 1.00 0.00 S ATOM 0 H CYS A 408 13.284 -7.893 -1.729 1.00 0.00 H new ATOM 0 HA CYS A 408 10.878 -7.531 -3.253 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.149 -7.183 -4.167 1.00 0.00 H new ATOM 0 HB3 CYS A 408 13.580 -8.846 -3.820 1.00 0.00 H new ATOM 1073 N ALA A 409 11.745 -10.665 -2.585 1.00 0.00 N ATOM 1074 CA ALA A 409 11.244 -12.026 -2.447 1.00 0.00 C ATOM 1075 C ALA A 409 10.037 -12.063 -1.491 1.00 0.00 C ATOM 1076 O ALA A 409 9.011 -12.658 -1.830 1.00 0.00 O ATOM 1077 CB ALA A 409 12.394 -12.950 -2.026 1.00 0.00 C ATOM 0 H ALA A 409 12.734 -10.570 -2.354 1.00 0.00 H new ATOM 0 HA ALA A 409 10.874 -12.394 -3.404 1.00 0.00 H new ATOM 0 HB1 ALA A 409 12.022 -13.969 -1.922 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.177 -12.925 -2.784 1.00 0.00 H new ATOM 0 HB3 ALA A 409 12.801 -12.613 -1.073 1.00 0.00 H new ATOM 1083 N SER A 410 10.108 -11.369 -0.342 1.00 0.00 N ATOM 1084 CA SER A 410 8.963 -11.284 0.576 1.00 0.00 C ATOM 1085 C SER A 410 7.790 -10.543 -0.067 1.00 0.00 C ATOM 1086 O SER A 410 6.703 -11.106 -0.133 1.00 0.00 O ATOM 1087 CB SER A 410 9.329 -10.618 1.907 1.00 0.00 C ATOM 1088 OG SER A 410 10.111 -11.502 2.694 1.00 0.00 O ATOM 0 H SER A 410 10.938 -10.864 -0.031 1.00 0.00 H new ATOM 0 HA SER A 410 8.664 -12.311 0.786 1.00 0.00 H new ATOM 0 HB2 SER A 410 9.882 -9.697 1.722 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.423 -10.343 2.447 1.00 0.00 H new ATOM 0 HG SER A 410 11.059 -11.380 2.479 1.00 0.00 H new ATOM 1094 N SER A 411 7.990 -9.322 -0.582 1.00 0.00 N ATOM 1095 CA SER A 411 6.957 -8.496 -1.236 1.00 0.00 C ATOM 1096 C SER A 411 6.144 -9.283 -2.268 1.00 0.00 C ATOM 1097 O SER A 411 4.913 -9.332 -2.200 1.00 0.00 O ATOM 1098 CB SER A 411 7.630 -7.282 -1.909 1.00 0.00 C ATOM 1099 OG SER A 411 6.702 -6.459 -2.567 1.00 0.00 O ATOM 0 H SER A 411 8.902 -8.865 -0.556 1.00 0.00 H new ATOM 0 HA SER A 411 6.259 -8.165 -0.467 1.00 0.00 H new ATOM 0 HB2 SER A 411 8.160 -6.699 -1.156 1.00 0.00 H new ATOM 0 HB3 SER A 411 8.374 -7.632 -2.624 1.00 0.00 H new ATOM 0 HG SER A 411 7.179 -5.796 -3.108 1.00 0.00 H new ATOM 1105 N ARG A 412 6.826 -9.977 -3.183 1.00 0.00 N ATOM 1106 CA ARG A 412 6.187 -10.842 -4.184 1.00 0.00 C ATOM 1107 C ARG A 412 5.488 -12.033 -3.539 1.00 0.00 C ATOM 1108 O ARG A 412 4.364 -12.320 -3.932 1.00 0.00 O ATOM 1109 CB ARG A 412 7.219 -11.279 -5.234 1.00 0.00 C ATOM 1110 CG ARG A 412 7.333 -10.238 -6.363 1.00 0.00 C ATOM 1111 CD ARG A 412 6.492 -10.629 -7.587 1.00 0.00 C ATOM 1112 NE ARG A 412 6.803 -9.780 -8.755 1.00 0.00 N ATOM 1113 CZ ARG A 412 6.591 -10.073 -10.026 1.00 0.00 C ATOM 1114 NH1 ARG A 412 5.996 -11.171 -10.400 1.00 0.00 N ATOM 1115 NH2 ARG A 412 6.984 -9.257 -10.958 1.00 0.00 N ATOM 0 H ARG A 412 7.843 -9.956 -3.252 1.00 0.00 H new ATOM 0 HA ARG A 412 5.409 -10.269 -4.689 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.191 -11.414 -4.759 1.00 0.00 H new ATOM 0 HB3 ARG A 412 6.932 -12.244 -5.652 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.008 -9.265 -5.994 1.00 0.00 H new ATOM 0 HG3 ARG A 412 8.377 -10.134 -6.658 1.00 0.00 H new ATOM 0 HD2 ARG A 412 6.676 -11.674 -7.837 1.00 0.00 H new ATOM 0 HD3 ARG A 412 5.433 -10.541 -7.344 1.00 0.00 H new ATOM 0 HE ARG A 412 7.226 -8.872 -8.560 1.00 0.00 H new ATOM 0 HH11 ARG A 412 5.675 -11.841 -9.701 1.00 0.00 H new ATOM 0 HH12 ARG A 412 5.851 -11.360 -11.392 1.00 0.00 H new ATOM 0 HH21 ARG A 412 7.457 -8.388 -10.709 1.00 0.00 H new ATOM 0 HH22 ARG A 412 6.819 -9.485 -11.938 1.00 0.00 H new ATOM 1129 N GLN A 413 6.080 -12.695 -2.543 1.00 0.00 N ATOM 1130 CA GLN A 413 5.418 -13.808 -1.843 1.00 0.00 C ATOM 1131 C GLN A 413 4.099 -13.378 -1.160 1.00 0.00 C ATOM 1132 O GLN A 413 3.078 -14.044 -1.354 1.00 0.00 O ATOM 1133 CB GLN A 413 6.386 -14.474 -0.849 1.00 0.00 C ATOM 1134 CG GLN A 413 7.422 -15.380 -1.537 1.00 0.00 C ATOM 1135 CD GLN A 413 6.856 -16.755 -1.894 1.00 0.00 C ATOM 1136 OE1 GLN A 413 6.082 -16.922 -2.828 1.00 0.00 O ATOM 1137 NE2 GLN A 413 7.214 -17.796 -1.171 1.00 0.00 N ATOM 0 H GLN A 413 7.017 -12.483 -2.200 1.00 0.00 H new ATOM 0 HA GLN A 413 5.141 -14.547 -2.595 1.00 0.00 H new ATOM 0 HB2 GLN A 413 6.906 -13.701 -0.283 1.00 0.00 H new ATOM 0 HB3 GLN A 413 5.814 -15.064 -0.133 1.00 0.00 H new ATOM 0 HG2 GLN A 413 7.781 -14.892 -2.443 1.00 0.00 H new ATOM 0 HG3 GLN A 413 8.283 -15.505 -0.880 1.00 0.00 H new ATOM 0 HE21 GLN A 413 7.858 -17.677 -0.389 1.00 0.00 H new ATOM 0 HE22 GLN A 413 6.847 -18.722 -1.393 1.00 0.00 H new ATOM 1146 N ILE A 414 4.066 -12.254 -0.426 1.00 0.00 N ATOM 1147 CA ILE A 414 2.821 -11.751 0.184 1.00 0.00 C ATOM 1148 C ILE A 414 1.763 -11.303 -0.825 1.00 0.00 C ATOM 1149 O ILE A 414 0.586 -11.654 -0.698 1.00 0.00 O ATOM 1150 CB ILE A 414 3.020 -10.662 1.271 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.220 -9.693 1.220 1.00 0.00 C ATOM 1152 CG2 ILE A 414 2.765 -11.282 2.655 1.00 0.00 C ATOM 1153 CD1 ILE A 414 5.338 -9.965 2.240 1.00 0.00 C ATOM 0 H ILE A 414 4.885 -11.676 -0.240 1.00 0.00 H new ATOM 0 HA ILE A 414 2.440 -12.638 0.690 1.00 0.00 H new ATOM 0 HB ILE A 414 2.266 -9.918 1.012 1.00 0.00 H new ATOM 0 HG12 ILE A 414 4.650 -9.728 0.219 1.00 0.00 H new ATOM 0 HG13 ILE A 414 3.852 -8.679 1.374 1.00 0.00 H new ATOM 0 HG21 ILE A 414 2.903 -10.523 3.425 1.00 0.00 H new ATOM 0 HG22 ILE A 414 1.745 -11.664 2.700 1.00 0.00 H new ATOM 0 HG23 ILE A 414 3.466 -12.100 2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 414 6.130 -9.227 2.117 1.00 0.00 H new ATOM 0 HD12 ILE A 414 4.933 -9.898 3.250 1.00 0.00 H new ATOM 0 HD13 ILE A 414 5.744 -10.963 2.077 1.00 0.00 H new ATOM 1165 N ILE A 415 2.160 -10.536 -1.835 1.00 0.00 N ATOM 1166 CA ILE A 415 1.207 -10.056 -2.845 1.00 0.00 C ATOM 1167 C ILE A 415 0.708 -11.228 -3.714 1.00 0.00 C ATOM 1168 O ILE A 415 -0.471 -11.275 -4.061 1.00 0.00 O ATOM 1169 CB ILE A 415 1.847 -8.873 -3.595 1.00 0.00 C ATOM 1170 CG1 ILE A 415 1.475 -7.572 -2.837 1.00 0.00 C ATOM 1171 CG2 ILE A 415 1.463 -8.838 -5.084 1.00 0.00 C ATOM 1172 CD1 ILE A 415 1.864 -6.261 -3.534 1.00 0.00 C ATOM 0 H ILE A 415 3.123 -10.233 -1.981 1.00 0.00 H new ATOM 0 HA ILE A 415 0.294 -9.663 -2.397 1.00 0.00 H new ATOM 0 HB ILE A 415 2.931 -8.985 -3.604 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.398 -7.567 -2.669 1.00 0.00 H new ATOM 0 HG13 ILE A 415 1.951 -7.596 -1.857 1.00 0.00 H new ATOM 0 HG21 ILE A 415 1.942 -7.984 -5.563 1.00 0.00 H new ATOM 0 HG22 ILE A 415 1.794 -9.758 -5.567 1.00 0.00 H new ATOM 0 HG23 ILE A 415 0.381 -8.747 -5.179 1.00 0.00 H new ATOM 0 HD11 ILE A 415 1.557 -5.416 -2.917 1.00 0.00 H new ATOM 0 HD12 ILE A 415 2.944 -6.232 -3.678 1.00 0.00 H new ATOM 0 HD13 ILE A 415 1.367 -6.202 -4.502 1.00 0.00 H new ATOM 1184 N SER A 416 1.554 -12.221 -4.002 1.00 0.00 N ATOM 1185 CA SER A 416 1.179 -13.445 -4.721 1.00 0.00 C ATOM 1186 C SER A 416 0.206 -14.278 -3.884 1.00 0.00 C ATOM 1187 O SER A 416 -0.765 -14.795 -4.439 1.00 0.00 O ATOM 1188 CB SER A 416 2.397 -14.261 -5.120 1.00 0.00 C ATOM 1189 OG SER A 416 2.016 -15.376 -5.909 1.00 0.00 O ATOM 0 H SER A 416 2.539 -12.197 -3.737 1.00 0.00 H new ATOM 0 HA SER A 416 0.678 -13.150 -5.643 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.093 -13.635 -5.678 1.00 0.00 H new ATOM 0 HB3 SER A 416 2.921 -14.603 -4.227 1.00 0.00 H new ATOM 0 HG SER A 416 2.813 -15.889 -6.157 1.00 0.00 H new ATOM 1195 N HIS A 417 0.389 -14.342 -2.553 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.607 -14.960 -1.672 1.00 0.00 C ATOM 1197 C HIS A 417 -1.947 -14.244 -1.889 1.00 0.00 C ATOM 1198 O HIS A 417 -2.933 -14.893 -2.224 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.204 -14.913 -0.176 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.421 -14.990 0.732 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -2.227 -16.096 0.888 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.164 -13.904 1.133 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.439 -15.681 1.294 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.461 -14.343 1.425 1.00 0.00 N ATOM 0 H HIS A 417 1.210 -13.976 -2.071 1.00 0.00 H new ATOM 0 HA HIS A 417 -0.683 -16.017 -1.928 1.00 0.00 H new ATOM 0 HB2 HIS A 417 0.470 -15.740 0.046 1.00 0.00 H new ATOM 0 HB3 HIS A 417 0.344 -13.992 0.025 1.00 0.00 H new ATOM 0 HD1 HIS A 417 -1.951 -17.064 0.724 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -1.808 -12.887 1.209 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -4.279 -16.332 1.488 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.983 -12.914 -1.735 1.00 0.00 N ATOM 1213 CA TRP A 418 -3.208 -12.112 -1.864 1.00 0.00 C ATOM 1214 C TRP A 418 -3.902 -12.287 -3.225 1.00 0.00 C ATOM 1215 O TRP A 418 -5.135 -12.297 -3.290 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.849 -10.653 -1.589 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.923 -9.730 -1.099 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -4.875 -9.125 -1.833 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -4.089 -9.177 0.229 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -5.452 -8.090 -1.128 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -4.947 -8.041 0.145 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -3.569 -9.504 1.487 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -5.144 -7.173 1.215 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -3.757 -8.639 2.571 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -4.508 -7.466 2.429 1.00 0.00 C ATOM 0 H TRP A 418 -1.156 -12.359 -1.515 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.938 -12.462 -1.134 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -2.044 -10.643 -0.855 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -2.446 -10.232 -2.510 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -5.150 -9.411 -2.838 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -6.155 -7.452 -1.501 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -3.022 -10.425 1.621 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -5.769 -6.298 1.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -3.318 -8.879 3.528 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -4.598 -6.783 3.260 1.00 0.00 H new ATOM 1236 N LYS A 419 -3.124 -12.463 -4.308 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.645 -12.721 -5.664 1.00 0.00 C ATOM 1238 C LYS A 419 -4.284 -14.115 -5.786 1.00 0.00 C ATOM 1239 O LYS A 419 -5.387 -14.244 -6.317 1.00 0.00 O ATOM 1240 CB LYS A 419 -2.505 -12.572 -6.690 1.00 0.00 C ATOM 1241 CG LYS A 419 -2.122 -11.104 -6.942 1.00 0.00 C ATOM 1242 CD LYS A 419 -0.823 -11.011 -7.761 1.00 0.00 C ATOM 1243 CE LYS A 419 -0.432 -9.564 -8.085 1.00 0.00 C ATOM 1244 NZ LYS A 419 -1.366 -8.918 -9.049 1.00 0.00 N ATOM 0 H LYS A 419 -2.105 -12.430 -4.267 1.00 0.00 H new ATOM 0 HA LYS A 419 -4.427 -11.989 -5.865 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.629 -13.116 -6.336 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.806 -13.031 -7.631 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -2.929 -10.599 -7.473 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -1.995 -10.588 -5.990 1.00 0.00 H new ATOM 0 HD2 LYS A 419 -0.014 -11.487 -7.207 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -0.943 -11.568 -8.690 1.00 0.00 H new ATOM 0 HE2 LYS A 419 -0.409 -8.983 -7.163 1.00 0.00 H new ATOM 0 HE3 LYS A 419 0.577 -9.548 -8.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 -1.046 -7.948 -9.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -1.383 -9.463 -9.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -2.322 -8.891 -8.641 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.592 -15.155 -5.313 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.029 -16.559 -5.358 1.00 0.00 C ATOM 1260 C ASN A 420 -5.041 -16.982 -4.264 1.00 0.00 C ATOM 1261 O ASN A 420 -5.643 -18.054 -4.380 1.00 0.00 O ATOM 1262 CB ASN A 420 -2.777 -17.455 -5.326 1.00 0.00 C ATOM 1263 CG ASN A 420 -1.977 -17.372 -6.617 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -2.313 -17.981 -7.623 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -0.907 -16.612 -6.645 1.00 0.00 N ATOM 0 H ASN A 420 -2.679 -15.042 -4.872 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.588 -16.681 -6.286 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.144 -17.161 -4.489 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.076 -18.489 -5.152 1.00 0.00 H new ATOM 0 HD21 ASN A 420 -0.361 -16.532 -7.503 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -0.622 -16.102 -5.809 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.198 -16.193 -3.195 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.040 -16.473 -2.031 1.00 0.00 C ATOM 1274 C CYS A 421 -7.491 -16.852 -2.377 1.00 0.00 C ATOM 1275 O CYS A 421 -8.105 -16.315 -3.303 1.00 0.00 O ATOM 1276 CB CYS A 421 -5.991 -15.248 -1.098 1.00 0.00 C ATOM 1277 SG CYS A 421 -6.689 -15.605 0.544 1.00 0.00 S ATOM 0 H CYS A 421 -4.716 -15.297 -3.116 1.00 0.00 H new ATOM 0 HA CYS A 421 -5.639 -17.357 -1.536 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -4.958 -14.919 -0.988 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -6.541 -14.425 -1.553 1.00 0.00 H new ATOM 1282 N THR A 422 -8.071 -17.720 -1.546 1.00 0.00 N ATOM 1283 CA THR A 422 -9.488 -18.128 -1.575 1.00 0.00 C ATOM 1284 C THR A 422 -10.412 -17.051 -0.972 1.00 0.00 C ATOM 1285 O THR A 422 -11.588 -17.324 -0.746 1.00 0.00 O ATOM 1286 CB THR A 422 -9.678 -19.464 -0.829 1.00 0.00 C ATOM 1287 OG1 THR A 422 -9.124 -19.388 0.471 1.00 0.00 O ATOM 1288 CG2 THR A 422 -8.992 -20.624 -1.556 1.00 0.00 C ATOM 0 H THR A 422 -7.549 -18.181 -0.801 1.00 0.00 H new ATOM 0 HA THR A 422 -9.767 -18.255 -2.621 1.00 0.00 H new ATOM 0 HB THR A 422 -10.752 -19.645 -0.784 1.00 0.00 H new ATOM 0 HG1 THR A 422 -9.254 -20.243 0.932 1.00 0.00 H new ATOM 0 HG21 THR A 422 -9.150 -21.547 -0.998 1.00 0.00 H new ATOM 0 HG22 THR A 422 -9.414 -20.728 -2.556 1.00 0.00 H new ATOM 0 HG23 THR A 422 -7.923 -20.424 -1.633 1.00 0.00 H new ATOM 1296 N ARG A 423 -9.872 -15.841 -0.736 1.00 0.00 N ATOM 1297 CA ARG A 423 -10.333 -14.564 -0.137 1.00 0.00 C ATOM 1298 C ARG A 423 -11.762 -14.373 0.421 1.00 0.00 C ATOM 1299 O ARG A 423 -12.304 -13.270 0.360 1.00 0.00 O ATOM 1300 CB ARG A 423 -9.913 -13.433 -1.112 1.00 0.00 C ATOM 1301 CG ARG A 423 -10.448 -13.523 -2.558 1.00 0.00 C ATOM 1302 CD ARG A 423 -11.977 -13.524 -2.688 1.00 0.00 C ATOM 1303 NE ARG A 423 -12.401 -13.542 -4.101 1.00 0.00 N ATOM 1304 CZ ARG A 423 -13.643 -13.595 -4.548 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -14.670 -13.601 -3.743 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -13.883 -13.645 -5.826 1.00 0.00 N ATOM 0 H ARG A 423 -8.901 -15.713 -1.021 1.00 0.00 H new ATOM 0 HA ARG A 423 -9.837 -14.553 0.834 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -10.237 -12.482 -0.689 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -8.824 -13.408 -1.154 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -10.051 -12.683 -3.129 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -10.059 -14.432 -3.017 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -12.386 -14.394 -2.174 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -12.385 -12.641 -2.196 1.00 0.00 H new ATOM 0 HE ARG A 423 -11.661 -13.510 -4.803 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -14.527 -13.564 -2.734 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -15.616 -13.643 -4.123 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -13.109 -13.643 -6.491 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -14.845 -13.686 -6.163 1.00 0.00 H new ATOM 1320 N HIS A 424 -12.387 -15.403 0.983 1.00 0.00 N ATOM 1321 CA HIS A 424 -13.669 -15.324 1.679 1.00 0.00 C ATOM 1322 C HIS A 424 -13.540 -14.800 3.127 1.00 0.00 C ATOM 1323 O HIS A 424 -14.455 -14.141 3.623 1.00 0.00 O ATOM 1324 CB HIS A 424 -14.372 -16.691 1.660 1.00 0.00 C ATOM 1325 CG HIS A 424 -15.025 -17.007 0.334 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -14.384 -17.348 -0.833 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -16.366 -16.983 0.058 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -15.305 -17.525 -1.793 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -16.538 -17.312 -1.295 1.00 0.00 N ATOM 0 H HIS A 424 -12.003 -16.348 0.966 1.00 0.00 H new ATOM 0 HA HIS A 424 -14.275 -14.597 1.139 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -13.646 -17.469 1.894 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -15.128 -16.714 2.445 1.00 0.00 H new ATOM 0 HD1 HIS A 424 -13.376 -17.450 -0.950 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -17.154 -16.751 0.759 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -15.089 -17.798 -2.815 1.00 0.00 H new ATOM 1337 N ASP A 425 -12.431 -15.109 3.818 1.00 0.00 N ATOM 1338 CA ASP A 425 -12.196 -14.789 5.238 1.00 0.00 C ATOM 1339 C ASP A 425 -10.702 -14.828 5.650 1.00 0.00 C ATOM 1340 O ASP A 425 -10.350 -15.447 6.658 1.00 0.00 O ATOM 1341 CB ASP A 425 -13.072 -15.704 6.131 1.00 0.00 C ATOM 1342 CG ASP A 425 -12.651 -17.191 6.177 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -12.417 -17.811 5.111 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -12.614 -17.771 7.291 1.00 0.00 O ATOM 0 H ASP A 425 -11.648 -15.604 3.392 1.00 0.00 H new ATOM 0 HA ASP A 425 -12.494 -13.751 5.389 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -13.060 -15.310 7.147 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -14.102 -15.647 5.779 1.00 0.00 H new ATOM 1349 N CYS A 426 -9.802 -14.168 4.901 1.00 0.00 N ATOM 1350 CA CYS A 426 -8.368 -14.179 5.225 1.00 0.00 C ATOM 1351 C CYS A 426 -8.044 -12.982 6.175 1.00 0.00 C ATOM 1352 O CYS A 426 -8.638 -11.910 6.011 1.00 0.00 O ATOM 1353 CB CYS A 426 -7.637 -14.365 3.891 1.00 0.00 C ATOM 1354 SG CYS A 426 -5.836 -14.280 4.047 1.00 0.00 S ATOM 0 H CYS A 426 -10.042 -13.624 4.072 1.00 0.00 H new ATOM 0 HA CYS A 426 -8.000 -15.004 5.835 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -7.913 -15.329 3.464 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -7.971 -13.599 3.191 1.00 0.00 H new ATOM 1359 N PRO A 427 -7.185 -13.157 7.209 1.00 0.00 N ATOM 1360 CA PRO A 427 -6.936 -12.201 8.308 1.00 0.00 C ATOM 1361 C PRO A 427 -6.486 -10.781 7.964 1.00 0.00 C ATOM 1362 O PRO A 427 -6.513 -9.906 8.832 1.00 0.00 O ATOM 1363 CB PRO A 427 -5.862 -12.840 9.202 1.00 0.00 C ATOM 1364 CG PRO A 427 -5.963 -14.326 8.904 1.00 0.00 C ATOM 1365 CD PRO A 427 -6.387 -14.348 7.440 1.00 0.00 C ATOM 0 HA PRO A 427 -7.912 -12.042 8.766 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -4.869 -12.454 8.970 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -6.046 -12.632 10.256 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -5.011 -14.835 9.057 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -6.695 -14.818 9.545 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -5.515 -14.360 6.786 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -6.963 -15.247 7.219 1.00 0.00 H new ATOM 1373 N VAL A 428 -6.034 -10.553 6.733 1.00 0.00 N ATOM 1374 CA VAL A 428 -5.492 -9.268 6.261 1.00 0.00 C ATOM 1375 C VAL A 428 -6.150 -8.855 4.929 1.00 0.00 C ATOM 1376 O VAL A 428 -6.561 -7.697 4.767 1.00 0.00 O ATOM 1377 CB VAL A 428 -3.966 -9.392 6.126 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -3.365 -7.983 5.983 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -3.222 -10.043 7.295 1.00 0.00 C ATOM 0 H VAL A 428 -6.032 -11.274 6.011 1.00 0.00 H new ATOM 0 HA VAL A 428 -5.719 -8.484 6.983 1.00 0.00 H new ATOM 0 HB VAL A 428 -3.834 -10.043 5.262 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -2.282 -8.058 5.886 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.776 -7.500 5.096 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -3.611 -7.391 6.865 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -2.154 -10.071 7.077 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -3.392 -9.464 8.202 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -3.589 -11.059 7.439 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.337 -9.857 4.055 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.071 -9.881 2.786 1.00 0.00 C ATOM 1391 C CYS A 429 -8.379 -9.101 2.970 1.00 0.00 C ATOM 1392 O CYS A 429 -8.531 -8.017 2.422 1.00 0.00 O ATOM 1393 CB CYS A 429 -7.328 -11.373 2.514 1.00 0.00 C ATOM 1394 SG CYS A 429 -6.288 -12.013 1.165 1.00 0.00 S ATOM 0 H CYS A 429 -5.930 -10.772 4.246 1.00 0.00 H new ATOM 0 HA CYS A 429 -6.537 -9.423 1.954 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -7.136 -11.945 3.422 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.378 -11.519 2.262 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.309 -9.637 3.772 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.623 -9.065 4.028 1.00 0.00 C ATOM 1401 C LEU A 430 -10.578 -7.634 4.589 1.00 0.00 C ATOM 1402 O LEU A 430 -11.160 -6.759 3.942 1.00 0.00 O ATOM 1403 CB LEU A 430 -11.417 -10.063 4.880 1.00 0.00 C ATOM 1404 CG LEU A 430 -12.222 -11.065 4.054 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -13.483 -10.468 3.424 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -11.400 -11.762 2.976 1.00 0.00 C ATOM 0 H LEU A 430 -9.154 -10.511 4.274 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.148 -8.922 3.084 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -10.727 -10.607 5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -12.096 -9.513 5.531 1.00 0.00 H new ATOM 0 HG LEU A 430 -12.529 -11.811 4.787 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -14.003 -11.237 2.853 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -14.139 -10.093 4.209 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -13.205 -9.649 2.761 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -12.034 -12.459 2.428 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -10.999 -11.019 2.287 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -10.578 -12.307 3.441 1.00 0.00 H new ATOM 1418 N PRO A 431 -9.890 -7.346 5.718 1.00 0.00 N ATOM 1419 CA PRO A 431 -9.745 -5.984 6.231 1.00 0.00 C ATOM 1420 C PRO A 431 -9.378 -4.937 5.182 1.00 0.00 C ATOM 1421 O PRO A 431 -10.116 -3.967 5.004 1.00 0.00 O ATOM 1422 CB PRO A 431 -8.638 -6.068 7.280 1.00 0.00 C ATOM 1423 CG PRO A 431 -8.841 -7.458 7.864 1.00 0.00 C ATOM 1424 CD PRO A 431 -9.205 -8.271 6.620 1.00 0.00 C ATOM 0 HA PRO A 431 -10.707 -5.650 6.621 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -7.649 -5.955 6.836 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -8.738 -5.291 8.038 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -7.940 -7.833 8.348 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -9.635 -7.476 8.611 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -8.313 -8.685 6.150 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -9.849 -9.112 6.878 1.00 0.00 H new ATOM 1432 N LEU A 432 -8.260 -5.120 4.470 1.00 0.00 N ATOM 1433 CA LEU A 432 -7.824 -4.146 3.460 1.00 0.00 C ATOM 1434 C LEU A 432 -8.688 -4.145 2.201 1.00 0.00 C ATOM 1435 O LEU A 432 -8.820 -3.101 1.559 1.00 0.00 O ATOM 1436 CB LEU A 432 -6.370 -4.411 3.082 1.00 0.00 C ATOM 1437 CG LEU A 432 -5.410 -3.620 3.992 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -4.077 -4.338 4.190 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -5.145 -2.233 3.399 1.00 0.00 C ATOM 0 H LEU A 432 -7.644 -5.927 4.572 1.00 0.00 H new ATOM 0 HA LEU A 432 -7.931 -3.161 3.914 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -6.158 -5.477 3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -6.204 -4.131 2.042 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.895 -3.531 4.964 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -3.435 -3.741 4.838 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.252 -5.311 4.649 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -3.591 -4.475 3.224 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -4.466 -1.683 4.050 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -4.695 -2.339 2.412 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.085 -1.689 3.313 1.00 0.00 H new ATOM 1451 N LYS A 433 -9.286 -5.289 1.852 1.00 0.00 N ATOM 1452 CA LYS A 433 -10.144 -5.395 0.659 1.00 0.00 C ATOM 1453 C LYS A 433 -11.379 -4.514 0.890 1.00 0.00 C ATOM 1454 O LYS A 433 -11.742 -3.714 0.030 1.00 0.00 O ATOM 1455 CB LYS A 433 -10.536 -6.863 0.418 1.00 0.00 C ATOM 1456 CG LYS A 433 -9.502 -7.560 -0.485 1.00 0.00 C ATOM 1457 CD LYS A 433 -9.927 -9.008 -0.793 1.00 0.00 C ATOM 1458 CE LYS A 433 -8.913 -9.772 -1.658 1.00 0.00 C ATOM 1459 NZ LYS A 433 -7.698 -10.179 -0.902 1.00 0.00 N ATOM 0 H LYS A 433 -9.194 -6.158 2.378 1.00 0.00 H new ATOM 0 HA LYS A 433 -9.615 -5.054 -0.231 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -10.606 -7.387 1.371 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -11.522 -6.910 -0.045 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -9.392 -7.003 -1.416 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -8.528 -7.559 0.004 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -10.069 -9.544 0.145 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -10.891 -8.995 -1.302 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -9.392 -10.660 -2.072 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -8.618 -9.147 -2.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -6.849 -9.878 -1.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -7.707 -9.731 0.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -7.688 -11.213 -0.792 1.00 0.00 H new ATOM 1473 N ASN A 434 -11.965 -4.597 2.090 1.00 0.00 N ATOM 1474 CA ASN A 434 -13.072 -3.748 2.533 1.00 0.00 C ATOM 1475 C ASN A 434 -12.626 -2.276 2.676 1.00 0.00 C ATOM 1476 O ASN A 434 -13.323 -1.371 2.213 1.00 0.00 O ATOM 1477 CB ASN A 434 -13.603 -4.311 3.863 1.00 0.00 C ATOM 1478 CG ASN A 434 -14.801 -3.533 4.388 1.00 0.00 C ATOM 1479 OD1 ASN A 434 -15.761 -3.265 3.679 1.00 0.00 O ATOM 1480 ND2 ASN A 434 -14.788 -3.141 5.643 1.00 0.00 N ATOM 0 H ASN A 434 -11.674 -5.274 2.796 1.00 0.00 H new ATOM 0 HA ASN A 434 -13.868 -3.756 1.789 1.00 0.00 H new ATOM 0 HB2 ASN A 434 -13.884 -5.355 3.726 1.00 0.00 H new ATOM 0 HB3 ASN A 434 -12.806 -4.290 4.607 1.00 0.00 H new ATOM 0 HD21 ASN A 434 -15.576 -2.616 6.021 1.00 0.00 H new ATOM 0 HD22 ASN A 434 -13.990 -3.362 6.238 1.00 0.00 H new ATOM 1487 N ALA A 435 -11.451 -2.030 3.270 1.00 0.00 N ATOM 1488 CA ALA A 435 -10.869 -0.693 3.455 1.00 0.00 C ATOM 1489 C ALA A 435 -10.581 0.069 2.136 1.00 0.00 C ATOM 1490 O ALA A 435 -10.379 1.285 2.162 1.00 0.00 O ATOM 1491 CB ALA A 435 -9.592 -0.824 4.299 1.00 0.00 C ATOM 0 H ALA A 435 -10.863 -2.774 3.645 1.00 0.00 H new ATOM 0 HA ALA A 435 -11.616 -0.088 3.969 1.00 0.00 H new ATOM 0 HB1 ALA A 435 -9.149 0.161 4.444 1.00 0.00 H new ATOM 0 HB2 ALA A 435 -9.839 -1.257 5.268 1.00 0.00 H new ATOM 0 HB3 ALA A 435 -8.880 -1.469 3.784 1.00 0.00 H new ATOM 1497 N SER A 436 -10.569 -0.633 0.994 1.00 0.00 N ATOM 1498 CA SER A 436 -10.300 -0.086 -0.349 1.00 0.00 C ATOM 1499 C SER A 436 -11.490 -0.213 -1.318 1.00 0.00 C ATOM 1500 O SER A 436 -11.398 0.228 -2.465 1.00 0.00 O ATOM 1501 CB SER A 436 -9.069 -0.771 -0.963 1.00 0.00 C ATOM 1502 OG SER A 436 -7.964 -0.771 -0.072 1.00 0.00 O ATOM 0 H SER A 436 -10.753 -1.636 0.977 1.00 0.00 H new ATOM 0 HA SER A 436 -10.117 0.979 -0.209 1.00 0.00 H new ATOM 0 HB2 SER A 436 -9.320 -1.798 -1.230 1.00 0.00 H new ATOM 0 HB3 SER A 436 -8.792 -0.261 -1.885 1.00 0.00 H new ATOM 0 HG SER A 436 -8.058 -1.510 0.565 1.00 0.00 H new ATOM 1508 N ASP A 437 -12.615 -0.793 -0.882 1.00 0.00 N ATOM 1509 CA ASP A 437 -13.833 -0.965 -1.692 1.00 0.00 C ATOM 1510 C ASP A 437 -14.471 0.380 -2.094 1.00 0.00 C ATOM 1511 O ASP A 437 -15.023 0.514 -3.191 1.00 0.00 O ATOM 1512 CB ASP A 437 -14.834 -1.805 -0.887 1.00 0.00 C ATOM 1513 CG ASP A 437 -16.112 -2.116 -1.685 1.00 0.00 C ATOM 1514 OD1 ASP A 437 -16.045 -2.914 -2.650 1.00 0.00 O ATOM 1515 OD2 ASP A 437 -17.192 -1.584 -1.333 1.00 0.00 O ATOM 0 H ASP A 437 -12.709 -1.165 0.063 1.00 0.00 H new ATOM 0 HA ASP A 437 -13.561 -1.469 -2.620 1.00 0.00 H new ATOM 0 HB2 ASP A 437 -14.361 -2.739 -0.585 1.00 0.00 H new ATOM 0 HB3 ASP A 437 -15.099 -1.273 0.026 1.00 0.00 H new ATOM 1520 N LYS A 438 -14.369 1.380 -1.207 1.00 0.00 N ATOM 1521 CA LYS A 438 -14.876 2.751 -1.374 1.00 0.00 C ATOM 1522 C LYS A 438 -14.096 3.735 -0.489 1.00 0.00 C ATOM 1523 O LYS A 438 -13.688 3.380 0.622 1.00 0.00 O ATOM 1524 CB LYS A 438 -16.382 2.754 -1.041 1.00 0.00 C ATOM 1525 CG LYS A 438 -17.088 4.070 -1.407 1.00 0.00 C ATOM 1526 CD LYS A 438 -18.601 4.032 -1.140 1.00 0.00 C ATOM 1527 CE LYS A 438 -19.329 3.005 -2.021 1.00 0.00 C ATOM 1528 NZ LYS A 438 -20.796 3.024 -1.784 1.00 0.00 N ATOM 0 H LYS A 438 -13.907 1.248 -0.307 1.00 0.00 H new ATOM 0 HA LYS A 438 -14.735 3.080 -2.404 1.00 0.00 H new ATOM 0 HB2 LYS A 438 -16.865 1.932 -1.570 1.00 0.00 H new ATOM 0 HB3 LYS A 438 -16.511 2.566 0.025 1.00 0.00 H new ATOM 0 HG2 LYS A 438 -16.644 4.885 -0.836 1.00 0.00 H new ATOM 0 HG3 LYS A 438 -16.916 4.288 -2.461 1.00 0.00 H new ATOM 0 HD2 LYS A 438 -18.776 3.794 -0.091 1.00 0.00 H new ATOM 0 HD3 LYS A 438 -19.023 5.021 -1.317 1.00 0.00 H new ATOM 0 HE2 LYS A 438 -19.127 3.217 -3.071 1.00 0.00 H new ATOM 0 HE3 LYS A 438 -18.940 2.008 -1.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 -21.256 2.319 -2.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 -20.990 2.798 -0.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 -21.171 3.969 -2.003 1.00 0.00 H new ATOM 1542 N ARG A 439 -13.906 4.967 -0.978 1.00 0.00 N ATOM 1543 CA ARG A 439 -13.215 6.084 -0.301 1.00 0.00 C ATOM 1544 C ARG A 439 -13.694 7.450 -0.812 1.00 0.00 C ATOM 1545 O ARG A 439 -13.859 8.371 0.019 1.00 0.00 O ATOM 1546 CB ARG A 439 -11.676 5.933 -0.391 1.00 0.00 C ATOM 1547 CG ARG A 439 -10.990 6.391 -1.693 1.00 0.00 C ATOM 1548 CD ARG A 439 -11.448 5.649 -2.957 1.00 0.00 C ATOM 1549 NE ARG A 439 -10.908 6.268 -4.179 1.00 0.00 N ATOM 1550 CZ ARG A 439 -11.433 7.283 -4.843 1.00 0.00 C ATOM 1551 NH1 ARG A 439 -12.497 7.919 -4.443 1.00 0.00 N ATOM 1552 NH2 ARG A 439 -10.882 7.687 -5.950 1.00 0.00 N ATOM 1553 OXT ARG A 439 -13.903 7.583 -2.040 1.00 0.00 O ATOM 0 H ARG A 439 -14.245 5.230 -1.903 1.00 0.00 H new ATOM 0 HA ARG A 439 -13.481 6.039 0.755 1.00 0.00 H new ATOM 0 HB2 ARG A 439 -11.235 6.490 0.435 1.00 0.00 H new ATOM 0 HB3 ARG A 439 -11.432 4.882 -0.234 1.00 0.00 H new ATOM 0 HG2 ARG A 439 -11.173 7.457 -1.828 1.00 0.00 H new ATOM 0 HG3 ARG A 439 -9.913 6.264 -1.584 1.00 0.00 H new ATOM 0 HD2 ARG A 439 -11.127 4.609 -2.904 1.00 0.00 H new ATOM 0 HD3 ARG A 439 -12.537 5.645 -3.002 1.00 0.00 H new ATOM 0 HE ARG A 439 -10.043 5.874 -4.550 1.00 0.00 H new ATOM 0 HH11 ARG A 439 -12.964 7.639 -3.581 1.00 0.00 H new ATOM 0 HH12 ARG A 439 -12.863 8.697 -4.992 1.00 0.00 H new ATOM 0 HH21 ARG A 439 -10.047 7.221 -6.304 1.00 0.00 H new ATOM 0 HH22 ARG A 439 -11.285 8.470 -6.464 1.00 0.00 H new TER 1567 ARG A 439 HETATM 1568 ZN ZN A 440 3.151 7.099 1.795 1.00 0.00 ZN HETATM 1569 ZN ZN A 441 13.481 -8.696 -7.542 1.00 0.00 ZN HETATM 1570 ZN ZN A 442 -5.504 -14.079 1.791 1.00 0.00 ZN