USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=16 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 395 THR OG1 : rot -34:sc= 0.801 USER MOD Set 1.2: A 396 HIS : no HE2:sc= 0.668 K(o=1.5,f=-1.9!) USER MOD Set 2.1: A 394 MET CE :methyl 177:sc= -0.212 (180deg=-0.0509) USER MOD Set 2.2: A 411 SER OG : rot -49:sc= 1 USER MOD Set 3.1: A 367 GLN : amide:sc= 1.56 K(o=4.2,f=0.33) USER MOD Set 3.2: A 371 GLN : amide:sc= 0.792 K(o=4.2,f=0.33) USER MOD Set 3.3: A 392 ASN : amide:sc= 1.8 K(o=4.2,f=1.7) USER MOD Set 4.1: A 356 GLN : amide:sc= -0.194 X(o=-0.27,f=-0.5) USER MOD Set 4.2: A 387 MET CE :methyl -164:sc= -0.0812 (180deg=-0.509) USER MOD Single : A 341 THR OG1 : rot 180:sc= 0 USER MOD Single : A 344 THR OG1 : rot 180:sc= 0.00937 USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 351 LYS NZ :NH3+ 173:sc= 1.23 (180deg=0.994) USER MOD Single : A 354 GLN : amide:sc= 0.103 X(o=0.1,f=0) USER MOD Single : A 355 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 364 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 380 SER OG : rot 180:sc= 0 USER MOD Single : A 383 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 388 LYS NZ :NH3+ 177:sc= 0.963 (180deg=0.94) USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 GLN : amide:sc= -0.467 X(o=-0.47,f=-0.47) USER MOD Single : A 407 HIS : no HD1:sc= -0.299 X(o=-0.3,f=-0.037) USER MOD Single : A 410 SER OG : rot 85:sc= 0.743 USER MOD Single : A 413 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 416 SER OG : rot 122:sc= 0.78 USER MOD Single : A 419 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0124) USER MOD Single : A 420 ASN : amide:sc= 0.989 K(o=0.99,f=0) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 HIS : no HD1:sc= -0.034 X(o=-0.034,f=0) USER MOD Single : A 433 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 434 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 436 SER OG : rot 180:sc= 0 USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 340 8.212 -22.854 18.291 1.00 0.00 N ATOM 2 CA ALA A 340 7.091 -22.638 17.343 1.00 0.00 C ATOM 3 C ALA A 340 6.687 -23.930 16.642 1.00 0.00 C ATOM 4 O ALA A 340 7.511 -24.816 16.411 1.00 0.00 O ATOM 5 CB ALA A 340 7.445 -21.589 16.260 1.00 0.00 C ATOM 0 HA ALA A 340 6.259 -22.273 17.945 1.00 0.00 H new ATOM 0 HB1 ALA A 340 6.597 -21.461 15.587 1.00 0.00 H new ATOM 0 HB2 ALA A 340 7.676 -20.637 16.738 1.00 0.00 H new ATOM 0 HB3 ALA A 340 8.311 -21.930 15.692 1.00 0.00 H new ATOM 13 N THR A 341 5.422 -23.994 16.224 1.00 0.00 N ATOM 14 CA THR A 341 4.874 -25.063 15.369 1.00 0.00 C ATOM 15 C THR A 341 5.512 -24.980 13.969 1.00 0.00 C ATOM 16 O THR A 341 5.732 -25.993 13.302 1.00 0.00 O ATOM 17 CB THR A 341 3.348 -24.918 15.292 1.00 0.00 C ATOM 18 OG1 THR A 341 3.004 -23.621 14.848 1.00 0.00 O ATOM 19 CG2 THR A 341 2.723 -25.090 16.679 1.00 0.00 C ATOM 0 H THR A 341 4.728 -23.289 16.474 1.00 0.00 H new ATOM 0 HA THR A 341 5.107 -26.040 15.793 1.00 0.00 H new ATOM 0 HB THR A 341 2.981 -25.680 14.604 1.00 0.00 H new ATOM 0 HG1 THR A 341 2.029 -23.539 14.801 1.00 0.00 H new ATOM 0 HG21 THR A 341 1.641 -24.984 16.606 1.00 0.00 H new ATOM 0 HG22 THR A 341 2.965 -26.079 17.067 1.00 0.00 H new ATOM 0 HG23 THR A 341 3.117 -24.329 17.353 1.00 0.00 H new ATOM 27 N GLY A 342 5.896 -23.756 13.584 1.00 0.00 N ATOM 28 CA GLY A 342 6.667 -23.355 12.424 1.00 0.00 C ATOM 29 C GLY A 342 6.980 -21.857 12.476 1.00 0.00 C ATOM 30 O GLY A 342 6.198 -21.087 13.045 1.00 0.00 O ATOM 0 H GLY A 342 5.641 -22.943 14.145 1.00 0.00 H new ATOM 0 HA2 GLY A 342 7.595 -23.925 12.383 1.00 0.00 H new ATOM 0 HA3 GLY A 342 6.112 -23.585 11.515 1.00 0.00 H new ATOM 34 N PRO A 343 8.076 -21.408 11.843 1.00 0.00 N ATOM 35 CA PRO A 343 8.426 -19.993 11.721 1.00 0.00 C ATOM 36 C PRO A 343 7.332 -19.229 10.954 1.00 0.00 C ATOM 37 O PRO A 343 7.118 -18.043 11.187 1.00 0.00 O ATOM 38 CB PRO A 343 9.784 -19.971 11.008 1.00 0.00 C ATOM 39 CG PRO A 343 9.827 -21.298 10.245 1.00 0.00 C ATOM 40 CD PRO A 343 9.024 -22.242 11.139 1.00 0.00 C ATOM 0 HA PRO A 343 8.497 -19.492 12.686 1.00 0.00 H new ATOM 0 HB2 PRO A 343 9.866 -19.120 10.332 1.00 0.00 H new ATOM 0 HB3 PRO A 343 10.606 -19.893 11.719 1.00 0.00 H new ATOM 0 HG2 PRO A 343 9.383 -21.207 9.254 1.00 0.00 H new ATOM 0 HG3 PRO A 343 10.849 -21.649 10.105 1.00 0.00 H new ATOM 0 HD2 PRO A 343 8.513 -23.001 10.547 1.00 0.00 H new ATOM 0 HD3 PRO A 343 9.675 -22.768 11.837 1.00 0.00 H new ATOM 48 N THR A 344 6.583 -19.929 10.096 1.00 0.00 N ATOM 49 CA THR A 344 5.423 -19.424 9.347 1.00 0.00 C ATOM 50 C THR A 344 4.234 -19.040 10.240 1.00 0.00 C ATOM 51 O THR A 344 3.388 -18.239 9.835 1.00 0.00 O ATOM 52 CB THR A 344 4.953 -20.470 8.322 1.00 0.00 C ATOM 53 OG1 THR A 344 4.836 -21.736 8.944 1.00 0.00 O ATOM 54 CG2 THR A 344 5.950 -20.611 7.170 1.00 0.00 C ATOM 0 H THR A 344 6.777 -20.910 9.894 1.00 0.00 H new ATOM 0 HA THR A 344 5.764 -18.516 8.849 1.00 0.00 H new ATOM 0 HB THR A 344 3.992 -20.133 7.934 1.00 0.00 H new ATOM 0 HG1 THR A 344 4.535 -22.397 8.286 1.00 0.00 H new ATOM 0 HG21 THR A 344 5.587 -21.358 6.464 1.00 0.00 H new ATOM 0 HG22 THR A 344 6.056 -19.653 6.662 1.00 0.00 H new ATOM 0 HG23 THR A 344 6.918 -20.923 7.563 1.00 0.00 H new ATOM 62 N ALA A 345 4.170 -19.576 11.463 1.00 0.00 N ATOM 63 CA ALA A 345 3.114 -19.333 12.448 1.00 0.00 C ATOM 64 C ALA A 345 3.592 -18.491 13.651 1.00 0.00 C ATOM 65 O ALA A 345 2.780 -18.109 14.497 1.00 0.00 O ATOM 66 CB ALA A 345 2.560 -20.694 12.888 1.00 0.00 C ATOM 0 H ALA A 345 4.884 -20.218 11.807 1.00 0.00 H new ATOM 0 HA ALA A 345 2.328 -18.736 11.986 1.00 0.00 H new ATOM 0 HB1 ALA A 345 1.770 -20.545 13.624 1.00 0.00 H new ATOM 0 HB2 ALA A 345 2.156 -21.219 12.023 1.00 0.00 H new ATOM 0 HB3 ALA A 345 3.360 -21.287 13.331 1.00 0.00 H new ATOM 72 N ASP A 346 4.890 -18.176 13.728 1.00 0.00 N ATOM 73 CA ASP A 346 5.475 -17.339 14.780 1.00 0.00 C ATOM 74 C ASP A 346 4.839 -15.927 14.766 1.00 0.00 C ATOM 75 O ASP A 346 4.720 -15.339 13.685 1.00 0.00 O ATOM 76 CB ASP A 346 6.993 -17.264 14.567 1.00 0.00 C ATOM 77 CG ASP A 346 7.688 -16.492 15.701 1.00 0.00 C ATOM 78 OD1 ASP A 346 7.581 -15.245 15.734 1.00 0.00 O ATOM 79 OD2 ASP A 346 8.327 -17.139 16.565 1.00 0.00 O ATOM 0 H ASP A 346 5.576 -18.502 13.047 1.00 0.00 H new ATOM 0 HA ASP A 346 5.273 -17.779 15.757 1.00 0.00 H new ATOM 0 HB2 ASP A 346 7.403 -18.272 14.509 1.00 0.00 H new ATOM 0 HB3 ASP A 346 7.203 -16.779 13.614 1.00 0.00 H new ATOM 84 N PRO A 347 4.418 -15.359 15.915 1.00 0.00 N ATOM 85 CA PRO A 347 3.782 -14.042 15.976 1.00 0.00 C ATOM 86 C PRO A 347 4.506 -12.907 15.250 1.00 0.00 C ATOM 87 O PRO A 347 3.834 -12.082 14.637 1.00 0.00 O ATOM 88 CB PRO A 347 3.620 -13.725 17.466 1.00 0.00 C ATOM 89 CG PRO A 347 3.545 -15.104 18.116 1.00 0.00 C ATOM 90 CD PRO A 347 4.470 -15.950 17.244 1.00 0.00 C ATOM 0 HA PRO A 347 2.836 -14.100 15.438 1.00 0.00 H new ATOM 0 HB2 PRO A 347 4.461 -13.146 17.847 1.00 0.00 H new ATOM 0 HB3 PRO A 347 2.719 -13.141 17.657 1.00 0.00 H new ATOM 0 HG2 PRO A 347 3.880 -15.079 19.153 1.00 0.00 H new ATOM 0 HG3 PRO A 347 2.527 -15.493 18.119 1.00 0.00 H new ATOM 0 HD2 PRO A 347 5.488 -15.944 17.634 1.00 0.00 H new ATOM 0 HD3 PRO A 347 4.143 -16.990 17.222 1.00 0.00 H new ATOM 98 N GLU A 348 5.841 -12.865 15.239 1.00 0.00 N ATOM 99 CA GLU A 348 6.602 -11.826 14.523 1.00 0.00 C ATOM 100 C GLU A 348 6.352 -11.924 13.015 1.00 0.00 C ATOM 101 O GLU A 348 6.200 -10.914 12.333 1.00 0.00 O ATOM 102 CB GLU A 348 8.112 -11.957 14.770 1.00 0.00 C ATOM 103 CG GLU A 348 8.560 -11.772 16.228 1.00 0.00 C ATOM 104 CD GLU A 348 8.604 -10.288 16.631 1.00 0.00 C ATOM 105 OE1 GLU A 348 7.558 -9.738 17.051 1.00 0.00 O ATOM 106 OE2 GLU A 348 9.687 -9.658 16.542 1.00 0.00 O ATOM 0 H GLU A 348 6.427 -13.545 15.723 1.00 0.00 H new ATOM 0 HA GLU A 348 6.260 -10.864 14.903 1.00 0.00 H new ATOM 0 HB2 GLU A 348 8.434 -12.941 14.431 1.00 0.00 H new ATOM 0 HB3 GLU A 348 8.629 -11.222 14.153 1.00 0.00 H new ATOM 0 HG2 GLU A 348 7.878 -12.307 16.888 1.00 0.00 H new ATOM 0 HG3 GLU A 348 9.547 -12.214 16.363 1.00 0.00 H new ATOM 113 N LYS A 349 6.229 -13.147 12.496 1.00 0.00 N ATOM 114 CA LYS A 349 5.921 -13.410 11.094 1.00 0.00 C ATOM 115 C LYS A 349 4.545 -12.840 10.780 1.00 0.00 C ATOM 116 O LYS A 349 4.418 -12.076 9.839 1.00 0.00 O ATOM 117 CB LYS A 349 6.016 -14.923 10.824 1.00 0.00 C ATOM 118 CG LYS A 349 6.237 -15.268 9.340 1.00 0.00 C ATOM 119 CD LYS A 349 7.712 -15.417 8.929 1.00 0.00 C ATOM 120 CE LYS A 349 8.535 -14.134 9.105 1.00 0.00 C ATOM 121 NZ LYS A 349 9.944 -14.325 8.666 1.00 0.00 N ATOM 0 H LYS A 349 6.343 -13.996 13.050 1.00 0.00 H new ATOM 0 HA LYS A 349 6.640 -12.923 10.435 1.00 0.00 H new ATOM 0 HB2 LYS A 349 6.835 -15.338 11.411 1.00 0.00 H new ATOM 0 HB3 LYS A 349 5.101 -15.404 11.168 1.00 0.00 H new ATOM 0 HG2 LYS A 349 5.715 -16.198 9.115 1.00 0.00 H new ATOM 0 HG3 LYS A 349 5.780 -14.490 8.728 1.00 0.00 H new ATOM 0 HD2 LYS A 349 8.166 -16.213 9.520 1.00 0.00 H new ATOM 0 HD3 LYS A 349 7.759 -15.728 7.885 1.00 0.00 H new ATOM 0 HE2 LYS A 349 8.080 -13.327 8.531 1.00 0.00 H new ATOM 0 HE3 LYS A 349 8.517 -13.830 10.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 10.472 -13.439 8.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 10.385 -15.078 9.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 9.961 -14.591 7.661 1.00 0.00 H new ATOM 135 N ARG A 350 3.534 -13.142 11.598 1.00 0.00 N ATOM 136 CA ARG A 350 2.151 -12.639 11.461 1.00 0.00 C ATOM 137 C ARG A 350 2.085 -11.117 11.292 1.00 0.00 C ATOM 138 O ARG A 350 1.594 -10.649 10.262 1.00 0.00 O ATOM 139 CB ARG A 350 1.263 -13.165 12.615 1.00 0.00 C ATOM 140 CG ARG A 350 1.360 -14.673 12.937 1.00 0.00 C ATOM 141 CD ARG A 350 1.425 -15.642 11.750 1.00 0.00 C ATOM 142 NE ARG A 350 0.198 -15.611 10.937 1.00 0.00 N ATOM 143 CZ ARG A 350 -0.069 -16.357 9.880 1.00 0.00 C ATOM 144 NH1 ARG A 350 0.779 -17.202 9.366 1.00 0.00 N ATOM 145 NH2 ARG A 350 -1.232 -16.270 9.307 1.00 0.00 N ATOM 0 H ARG A 350 3.651 -13.761 12.400 1.00 0.00 H new ATOM 0 HA ARG A 350 1.744 -13.038 10.532 1.00 0.00 H new ATOM 0 HB2 ARG A 350 1.514 -12.608 13.518 1.00 0.00 H new ATOM 0 HB3 ARG A 350 0.225 -12.935 12.377 1.00 0.00 H new ATOM 0 HG2 ARG A 350 2.247 -14.831 13.550 1.00 0.00 H new ATOM 0 HG3 ARG A 350 0.498 -14.944 13.547 1.00 0.00 H new ATOM 0 HD2 ARG A 350 2.280 -15.389 11.123 1.00 0.00 H new ATOM 0 HD3 ARG A 350 1.589 -16.655 12.119 1.00 0.00 H new ATOM 0 HE ARG A 350 -0.521 -14.944 11.219 1.00 0.00 H new ATOM 0 HH11 ARG A 350 1.704 -17.313 9.782 1.00 0.00 H new ATOM 0 HH12 ARG A 350 0.518 -17.753 8.548 1.00 0.00 H new ATOM 0 HH21 ARG A 350 -1.934 -15.628 9.674 1.00 0.00 H new ATOM 0 HH22 ARG A 350 -1.443 -16.844 8.491 1.00 0.00 H new ATOM 159 N LYS A 351 2.602 -10.350 12.259 1.00 0.00 N ATOM 160 CA LYS A 351 2.619 -8.867 12.220 1.00 0.00 C ATOM 161 C LYS A 351 3.489 -8.307 11.095 1.00 0.00 C ATOM 162 O LYS A 351 2.981 -7.515 10.303 1.00 0.00 O ATOM 163 CB LYS A 351 2.990 -8.200 13.562 1.00 0.00 C ATOM 164 CG LYS A 351 3.710 -9.120 14.542 1.00 0.00 C ATOM 165 CD LYS A 351 4.359 -8.378 15.710 1.00 0.00 C ATOM 166 CE LYS A 351 4.320 -9.273 16.955 1.00 0.00 C ATOM 167 NZ LYS A 351 5.194 -8.754 18.033 1.00 0.00 N ATOM 0 H LYS A 351 3.026 -10.736 13.102 1.00 0.00 H new ATOM 0 HA LYS A 351 1.581 -8.605 12.013 1.00 0.00 H new ATOM 0 HB2 LYS A 351 3.623 -7.335 13.362 1.00 0.00 H new ATOM 0 HB3 LYS A 351 2.080 -7.827 14.033 1.00 0.00 H new ATOM 0 HG2 LYS A 351 2.999 -9.848 14.934 1.00 0.00 H new ATOM 0 HG3 LYS A 351 4.477 -9.680 14.006 1.00 0.00 H new ATOM 0 HD2 LYS A 351 5.389 -8.119 15.465 1.00 0.00 H new ATOM 0 HD3 LYS A 351 3.832 -7.443 15.902 1.00 0.00 H new ATOM 0 HE2 LYS A 351 3.295 -9.344 17.320 1.00 0.00 H new ATOM 0 HE3 LYS A 351 4.633 -10.282 16.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 5.051 -9.316 18.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 6.188 -8.821 17.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 4.956 -7.760 18.224 1.00 0.00 H new ATOM 181 N LEU A 352 4.760 -8.704 10.969 1.00 0.00 N ATOM 182 CA LEU A 352 5.577 -8.210 9.863 1.00 0.00 C ATOM 183 C LEU A 352 5.086 -8.604 8.458 1.00 0.00 C ATOM 184 O LEU A 352 5.090 -7.745 7.581 1.00 0.00 O ATOM 185 CB LEU A 352 7.096 -8.314 10.099 1.00 0.00 C ATOM 186 CG LEU A 352 7.631 -8.202 11.544 1.00 0.00 C ATOM 187 CD1 LEU A 352 9.058 -8.746 11.638 1.00 0.00 C ATOM 188 CD2 LEU A 352 7.648 -6.736 11.975 1.00 0.00 C ATOM 0 H LEU A 352 5.233 -9.349 11.602 1.00 0.00 H new ATOM 0 HA LEU A 352 5.402 -7.134 9.867 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.428 -9.271 9.697 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.577 -7.535 9.507 1.00 0.00 H new ATOM 0 HG LEU A 352 6.976 -8.784 12.193 1.00 0.00 H new ATOM 0 HD11 LEU A 352 9.414 -8.657 12.664 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.068 -9.794 11.340 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.710 -8.175 10.977 1.00 0.00 H new ATOM 0 HD21 LEU A 352 8.026 -6.661 12.995 1.00 0.00 H new ATOM 0 HD22 LEU A 352 8.294 -6.167 11.306 1.00 0.00 H new ATOM 0 HD23 LEU A 352 6.636 -6.332 11.932 1.00 0.00 H new ATOM 200 N ILE A 353 4.596 -9.826 8.214 1.00 0.00 N ATOM 201 CA ILE A 353 4.071 -10.226 6.886 1.00 0.00 C ATOM 202 C ILE A 353 2.813 -9.427 6.513 1.00 0.00 C ATOM 203 O ILE A 353 2.714 -8.876 5.407 1.00 0.00 O ATOM 204 CB ILE A 353 3.877 -11.762 6.813 1.00 0.00 C ATOM 205 CG1 ILE A 353 4.222 -12.338 5.427 1.00 0.00 C ATOM 206 CG2 ILE A 353 2.504 -12.285 7.278 1.00 0.00 C ATOM 207 CD1 ILE A 353 4.536 -13.840 5.506 1.00 0.00 C ATOM 0 H ILE A 353 4.549 -10.563 8.917 1.00 0.00 H new ATOM 0 HA ILE A 353 4.811 -9.974 6.126 1.00 0.00 H new ATOM 0 HB ILE A 353 4.596 -12.131 7.545 1.00 0.00 H new ATOM 0 HG12 ILE A 353 3.387 -12.175 4.745 1.00 0.00 H new ATOM 0 HG13 ILE A 353 5.079 -11.807 5.014 1.00 0.00 H new ATOM 0 HG21 ILE A 353 2.478 -13.371 7.185 1.00 0.00 H new ATOM 0 HG22 ILE A 353 2.342 -12.006 8.319 1.00 0.00 H new ATOM 0 HG23 ILE A 353 1.720 -11.849 6.659 1.00 0.00 H new ATOM 0 HD11 ILE A 353 4.775 -14.215 4.511 1.00 0.00 H new ATOM 0 HD12 ILE A 353 5.387 -13.999 6.168 1.00 0.00 H new ATOM 0 HD13 ILE A 353 3.669 -14.373 5.895 1.00 0.00 H new ATOM 219 N GLN A 354 1.872 -9.296 7.459 1.00 0.00 N ATOM 220 CA GLN A 354 0.684 -8.475 7.188 1.00 0.00 C ATOM 221 C GLN A 354 1.042 -6.989 7.022 1.00 0.00 C ATOM 222 O GLN A 354 0.429 -6.305 6.204 1.00 0.00 O ATOM 223 CB GLN A 354 -0.431 -8.692 8.222 1.00 0.00 C ATOM 224 CG GLN A 354 -0.161 -8.071 9.596 1.00 0.00 C ATOM 225 CD GLN A 354 -1.257 -8.415 10.597 1.00 0.00 C ATOM 226 OE1 GLN A 354 -2.126 -7.618 10.921 1.00 0.00 O ATOM 227 NE2 GLN A 354 -1.247 -9.623 11.122 1.00 0.00 N ATOM 0 H GLN A 354 1.905 -9.728 8.382 1.00 0.00 H new ATOM 0 HA GLN A 354 0.282 -8.814 6.233 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -1.359 -8.278 7.828 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -0.588 -9.763 8.347 1.00 0.00 H new ATOM 0 HG2 GLN A 354 0.799 -8.424 9.972 1.00 0.00 H new ATOM 0 HG3 GLN A 354 -0.086 -6.988 9.497 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -0.523 -10.290 10.854 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -1.963 -9.892 11.797 1.00 0.00 H new ATOM 236 N GLN A 355 2.061 -6.483 7.731 1.00 0.00 N ATOM 237 CA GLN A 355 2.488 -5.089 7.620 1.00 0.00 C ATOM 238 C GLN A 355 3.177 -4.845 6.275 1.00 0.00 C ATOM 239 O GLN A 355 2.956 -3.808 5.659 1.00 0.00 O ATOM 240 CB GLN A 355 3.370 -4.736 8.814 1.00 0.00 C ATOM 241 CG GLN A 355 3.916 -3.298 8.802 1.00 0.00 C ATOM 242 CD GLN A 355 4.808 -2.985 10.008 1.00 0.00 C ATOM 243 OE1 GLN A 355 5.417 -3.849 10.626 1.00 0.00 O ATOM 244 NE2 GLN A 355 4.926 -1.731 10.390 1.00 0.00 N ATOM 0 H GLN A 355 2.609 -7.031 8.395 1.00 0.00 H new ATOM 0 HA GLN A 355 1.622 -4.427 7.644 1.00 0.00 H new ATOM 0 HB2 GLN A 355 2.797 -4.886 9.729 1.00 0.00 H new ATOM 0 HB3 GLN A 355 4.210 -5.430 8.846 1.00 0.00 H new ATOM 0 HG2 GLN A 355 4.485 -3.139 7.886 1.00 0.00 H new ATOM 0 HG3 GLN A 355 3.080 -2.598 8.784 1.00 0.00 H new ATOM 0 HE21 GLN A 355 4.427 -0.996 9.889 1.00 0.00 H new ATOM 0 HE22 GLN A 355 5.516 -1.494 11.187 1.00 0.00 H new ATOM 253 N GLN A 356 3.974 -5.805 5.797 1.00 0.00 N ATOM 254 CA GLN A 356 4.696 -5.735 4.526 1.00 0.00 C ATOM 255 C GLN A 356 3.674 -5.573 3.406 1.00 0.00 C ATOM 256 O GLN A 356 3.751 -4.628 2.627 1.00 0.00 O ATOM 257 CB GLN A 356 5.382 -7.082 4.274 1.00 0.00 C ATOM 258 CG GLN A 356 6.790 -7.127 4.875 1.00 0.00 C ATOM 259 CD GLN A 356 7.741 -6.099 4.262 1.00 0.00 C ATOM 260 OE1 GLN A 356 8.055 -6.123 3.081 1.00 0.00 O ATOM 261 NE2 GLN A 356 8.230 -5.154 5.037 1.00 0.00 N ATOM 0 H GLN A 356 4.139 -6.677 6.299 1.00 0.00 H new ATOM 0 HA GLN A 356 5.412 -4.914 4.556 1.00 0.00 H new ATOM 0 HB2 GLN A 356 4.779 -7.882 4.702 1.00 0.00 H new ATOM 0 HB3 GLN A 356 5.439 -7.265 3.201 1.00 0.00 H new ATOM 0 HG2 GLN A 356 6.725 -6.956 5.950 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.206 -8.125 4.736 1.00 0.00 H new ATOM 0 HE21 GLN A 356 7.976 -5.122 6.024 1.00 0.00 H new ATOM 0 HE22 GLN A 356 8.863 -4.454 4.650 1.00 0.00 H new ATOM 270 N LEU A 357 2.700 -6.491 3.364 1.00 0.00 N ATOM 271 CA LEU A 357 1.613 -6.485 2.390 1.00 0.00 C ATOM 272 C LEU A 357 0.815 -5.161 2.477 1.00 0.00 C ATOM 273 O LEU A 357 0.635 -4.486 1.465 1.00 0.00 O ATOM 274 CB LEU A 357 0.831 -7.784 2.666 1.00 0.00 C ATOM 275 CG LEU A 357 -0.294 -8.117 1.676 1.00 0.00 C ATOM 276 CD1 LEU A 357 -0.748 -9.571 1.823 1.00 0.00 C ATOM 277 CD2 LEU A 357 -1.471 -7.205 1.976 1.00 0.00 C ATOM 0 H LEU A 357 2.649 -7.271 4.020 1.00 0.00 H new ATOM 0 HA LEU A 357 1.934 -6.494 1.348 1.00 0.00 H new ATOM 0 HB2 LEU A 357 1.537 -8.614 2.675 1.00 0.00 H new ATOM 0 HB3 LEU A 357 0.401 -7.720 3.666 1.00 0.00 H new ATOM 0 HG LEU A 357 0.073 -7.973 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.545 -9.777 1.109 1.00 0.00 H new ATOM 0 HD12 LEU A 357 0.093 -10.236 1.629 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.116 -9.737 2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -2.285 -7.422 1.285 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.809 -7.372 2.999 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -1.164 -6.165 1.860 1.00 0.00 H new ATOM 289 N VAL A 358 0.378 -4.729 3.666 1.00 0.00 N ATOM 290 CA VAL A 358 -0.358 -3.456 3.843 1.00 0.00 C ATOM 291 C VAL A 358 0.457 -2.231 3.378 1.00 0.00 C ATOM 292 O VAL A 358 -0.092 -1.332 2.737 1.00 0.00 O ATOM 293 CB VAL A 358 -0.822 -3.314 5.309 1.00 0.00 C ATOM 294 CG1 VAL A 358 -1.385 -1.925 5.642 1.00 0.00 C ATOM 295 CG2 VAL A 358 -1.931 -4.328 5.647 1.00 0.00 C ATOM 0 H VAL A 358 0.520 -5.245 4.534 1.00 0.00 H new ATOM 0 HA VAL A 358 -1.238 -3.488 3.201 1.00 0.00 H new ATOM 0 HB VAL A 358 0.079 -3.491 5.897 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -1.691 -1.898 6.688 1.00 0.00 H new ATOM 0 HG12 VAL A 358 -0.618 -1.170 5.469 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -2.246 -1.720 5.006 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -2.235 -4.202 6.686 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -2.788 -4.160 4.995 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -1.555 -5.341 5.500 1.00 0.00 H new ATOM 305 N LEU A 359 1.769 -2.194 3.633 1.00 0.00 N ATOM 306 CA LEU A 359 2.658 -1.096 3.214 1.00 0.00 C ATOM 307 C LEU A 359 2.970 -1.161 1.714 1.00 0.00 C ATOM 308 O LEU A 359 3.164 -0.124 1.091 1.00 0.00 O ATOM 309 CB LEU A 359 3.951 -1.069 4.056 1.00 0.00 C ATOM 310 CG LEU A 359 3.937 -0.153 5.294 1.00 0.00 C ATOM 311 CD1 LEU A 359 3.990 1.318 4.876 1.00 0.00 C ATOM 312 CD2 LEU A 359 2.732 -0.354 6.215 1.00 0.00 C ATOM 0 H LEU A 359 2.253 -2.933 4.142 1.00 0.00 H new ATOM 0 HA LEU A 359 2.126 -0.162 3.394 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.167 -2.086 4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 359 4.774 -0.761 3.411 1.00 0.00 H new ATOM 0 HG LEU A 359 4.825 -0.434 5.861 1.00 0.00 H new ATOM 0 HD11 LEU A 359 3.979 1.949 5.764 1.00 0.00 H new ATOM 0 HD12 LEU A 359 4.903 1.503 4.311 1.00 0.00 H new ATOM 0 HD13 LEU A 359 3.125 1.551 4.255 1.00 0.00 H new ATOM 0 HD21 LEU A 359 2.802 0.330 7.060 1.00 0.00 H new ATOM 0 HD22 LEU A 359 1.814 -0.155 5.662 1.00 0.00 H new ATOM 0 HD23 LEU A 359 2.720 -1.381 6.580 1.00 0.00 H new ATOM 324 N LEU A 360 2.960 -2.352 1.115 1.00 0.00 N ATOM 325 CA LEU A 360 3.090 -2.574 -0.328 1.00 0.00 C ATOM 326 C LEU A 360 1.892 -1.953 -1.050 1.00 0.00 C ATOM 327 O LEU A 360 2.043 -1.244 -2.044 1.00 0.00 O ATOM 328 CB LEU A 360 3.107 -4.094 -0.580 1.00 0.00 C ATOM 329 CG LEU A 360 4.429 -4.727 -1.055 1.00 0.00 C ATOM 330 CD1 LEU A 360 5.697 -4.126 -0.452 1.00 0.00 C ATOM 331 CD2 LEU A 360 4.436 -6.219 -0.711 1.00 0.00 C ATOM 0 H LEU A 360 2.858 -3.221 1.639 1.00 0.00 H new ATOM 0 HA LEU A 360 4.007 -2.117 -0.700 1.00 0.00 H new ATOM 0 HB2 LEU A 360 2.811 -4.590 0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.342 -4.319 -1.323 1.00 0.00 H new ATOM 0 HG LEU A 360 4.456 -4.531 -2.127 1.00 0.00 H new ATOM 0 HD11 LEU A 360 6.570 -4.642 -0.852 1.00 0.00 H new ATOM 0 HD12 LEU A 360 5.754 -3.067 -0.705 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.673 -4.239 0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 360 5.372 -6.666 -1.048 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.341 -6.344 0.368 1.00 0.00 H new ATOM 0 HD23 LEU A 360 3.600 -6.711 -1.208 1.00 0.00 H new ATOM 343 N LEU A 361 0.695 -2.202 -0.521 1.00 0.00 N ATOM 344 CA LEU A 361 -0.539 -1.635 -1.050 1.00 0.00 C ATOM 345 C LEU A 361 -0.562 -0.115 -0.844 1.00 0.00 C ATOM 346 O LEU A 361 -0.924 0.611 -1.773 1.00 0.00 O ATOM 347 CB LEU A 361 -1.730 -2.342 -0.405 1.00 0.00 C ATOM 348 CG LEU A 361 -1.764 -3.853 -0.731 1.00 0.00 C ATOM 349 CD1 LEU A 361 -2.916 -4.488 0.039 1.00 0.00 C ATOM 350 CD2 LEU A 361 -1.982 -4.146 -2.217 1.00 0.00 C ATOM 0 H LEU A 361 0.556 -2.805 0.290 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.600 -1.798 -2.126 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.688 -2.207 0.676 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.654 -1.878 -0.748 1.00 0.00 H new ATOM 0 HG LEU A 361 -0.794 -4.262 -0.449 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -2.955 -5.555 -0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -2.763 -4.342 1.108 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -3.855 -4.022 -0.261 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -1.995 -5.224 -2.377 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -2.933 -3.720 -2.536 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -1.173 -3.703 -2.798 1.00 0.00 H new ATOM 362 N HIS A 362 -0.095 0.376 0.315 1.00 0.00 N ATOM 363 CA HIS A 362 0.062 1.816 0.531 1.00 0.00 C ATOM 364 C HIS A 362 1.052 2.383 -0.495 1.00 0.00 C ATOM 365 O HIS A 362 0.778 3.417 -1.085 1.00 0.00 O ATOM 366 CB HIS A 362 0.509 2.156 1.962 1.00 0.00 C ATOM 367 CG HIS A 362 0.565 3.652 2.200 1.00 0.00 C ATOM 368 ND1 HIS A 362 -0.357 4.411 2.888 1.00 0.00 N ATOM 369 CD2 HIS A 362 1.508 4.525 1.719 1.00 0.00 C ATOM 370 CE1 HIS A 362 0.021 5.701 2.817 1.00 0.00 C ATOM 371 NE2 HIS A 362 1.151 5.824 2.101 1.00 0.00 N ATOM 0 H HIS A 362 0.178 -0.202 1.110 1.00 0.00 H new ATOM 0 HA HIS A 362 -0.915 2.279 0.396 1.00 0.00 H new ATOM 0 HB2 HIS A 362 -0.179 1.701 2.674 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.492 1.723 2.147 1.00 0.00 H new ATOM 0 HD1 HIS A 362 -1.184 4.056 3.368 1.00 0.00 H new ATOM 0 HD2 HIS A 362 2.380 4.255 1.142 1.00 0.00 H new ATOM 0 HE1 HIS A 362 -0.511 6.523 3.273 1.00 0.00 H new ATOM 379 N ALA A 363 2.178 1.714 -0.754 1.00 0.00 N ATOM 380 CA ALA A 363 3.155 2.143 -1.746 1.00 0.00 C ATOM 381 C ALA A 363 2.552 2.211 -3.159 1.00 0.00 C ATOM 382 O ALA A 363 2.828 3.173 -3.864 1.00 0.00 O ATOM 383 CB ALA A 363 4.388 1.242 -1.673 1.00 0.00 C ATOM 0 H ALA A 363 2.436 0.852 -0.274 1.00 0.00 H new ATOM 0 HA ALA A 363 3.466 3.162 -1.515 1.00 0.00 H new ATOM 0 HB1 ALA A 363 5.118 1.564 -2.416 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.829 1.308 -0.678 1.00 0.00 H new ATOM 0 HB3 ALA A 363 4.097 0.211 -1.873 1.00 0.00 H new ATOM 389 N HIS A 364 1.703 1.260 -3.574 1.00 0.00 N ATOM 390 CA HIS A 364 1.013 1.299 -4.868 1.00 0.00 C ATOM 391 C HIS A 364 0.125 2.553 -4.970 1.00 0.00 C ATOM 392 O HIS A 364 0.287 3.402 -5.856 1.00 0.00 O ATOM 393 CB HIS A 364 0.177 0.020 -5.037 1.00 0.00 C ATOM 394 CG HIS A 364 -0.485 -0.075 -6.388 1.00 0.00 C ATOM 395 ND1 HIS A 364 0.130 -0.398 -7.579 1.00 0.00 N ATOM 396 CD2 HIS A 364 -1.801 0.183 -6.671 1.00 0.00 C ATOM 397 CE1 HIS A 364 -0.791 -0.338 -8.555 1.00 0.00 C ATOM 398 NE2 HIS A 364 -1.989 0.013 -8.050 1.00 0.00 N ATOM 0 H HIS A 364 1.475 0.437 -3.016 1.00 0.00 H new ATOM 0 HA HIS A 364 1.751 1.349 -5.669 1.00 0.00 H new ATOM 0 HB2 HIS A 364 0.818 -0.849 -4.891 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.587 -0.014 -4.261 1.00 0.00 H new ATOM 0 HD2 HIS A 364 -2.560 0.467 -5.957 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -0.598 -0.542 -9.598 1.00 0.00 H new ATOM 0 HE2 HIS A 364 -2.860 0.132 -8.568 1.00 0.00 H new ATOM 406 N LYS A 365 -0.761 2.690 -3.975 1.00 0.00 N ATOM 407 CA LYS A 365 -1.647 3.842 -3.738 1.00 0.00 C ATOM 408 C LYS A 365 -0.912 5.173 -3.838 1.00 0.00 C ATOM 409 O LYS A 365 -1.288 6.058 -4.604 1.00 0.00 O ATOM 410 CB LYS A 365 -2.265 3.637 -2.334 1.00 0.00 C ATOM 411 CG LYS A 365 -2.626 4.902 -1.532 1.00 0.00 C ATOM 412 CD LYS A 365 -3.233 4.469 -0.185 1.00 0.00 C ATOM 413 CE LYS A 365 -4.001 5.638 0.446 1.00 0.00 C ATOM 414 NZ LYS A 365 -4.686 5.233 1.703 1.00 0.00 N ATOM 0 H LYS A 365 -0.887 1.960 -3.274 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.419 3.889 -4.506 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.169 3.039 -2.447 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -1.566 3.048 -1.740 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -1.738 5.513 -1.369 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -3.336 5.514 -2.088 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -3.903 3.622 -0.334 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -2.443 4.136 0.489 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -3.311 6.456 0.655 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -4.737 6.015 -0.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -5.194 6.049 2.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -5.362 4.470 1.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -3.981 4.897 2.390 1.00 0.00 H new ATOM 428 N CYS A 366 0.121 5.303 -3.021 1.00 0.00 N ATOM 429 CA CYS A 366 0.905 6.496 -2.819 1.00 0.00 C ATOM 430 C CYS A 366 1.848 6.779 -4.004 1.00 0.00 C ATOM 431 O CYS A 366 2.115 7.939 -4.295 1.00 0.00 O ATOM 432 CB CYS A 366 1.518 6.327 -1.431 1.00 0.00 C ATOM 433 SG CYS A 366 2.315 7.814 -0.800 1.00 0.00 S ATOM 0 H CYS A 366 0.449 4.525 -2.448 1.00 0.00 H new ATOM 0 HA CYS A 366 0.329 7.421 -2.819 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.737 6.021 -0.734 1.00 0.00 H new ATOM 0 HB3 CYS A 366 2.250 5.520 -1.463 1.00 0.00 H new ATOM 438 N GLN A 367 2.312 5.765 -4.745 1.00 0.00 N ATOM 439 CA GLN A 367 3.083 5.936 -5.990 1.00 0.00 C ATOM 440 C GLN A 367 2.173 6.590 -7.041 1.00 0.00 C ATOM 441 O GLN A 367 2.544 7.613 -7.617 1.00 0.00 O ATOM 442 CB GLN A 367 3.628 4.570 -6.459 1.00 0.00 C ATOM 443 CG GLN A 367 4.349 4.575 -7.816 1.00 0.00 C ATOM 444 CD GLN A 367 5.628 5.410 -7.824 1.00 0.00 C ATOM 445 OE1 GLN A 367 6.524 5.235 -7.008 1.00 0.00 O ATOM 446 NE2 GLN A 367 5.773 6.333 -8.748 1.00 0.00 N ATOM 0 H GLN A 367 2.162 4.787 -4.496 1.00 0.00 H new ATOM 0 HA GLN A 367 3.943 6.585 -5.828 1.00 0.00 H new ATOM 0 HB2 GLN A 367 4.317 4.195 -5.703 1.00 0.00 H new ATOM 0 HB3 GLN A 367 2.798 3.866 -6.511 1.00 0.00 H new ATOM 0 HG2 GLN A 367 4.593 3.549 -8.093 1.00 0.00 H new ATOM 0 HG3 GLN A 367 3.670 4.958 -8.578 1.00 0.00 H new ATOM 0 HE21 GLN A 367 5.034 6.489 -9.434 1.00 0.00 H new ATOM 0 HE22 GLN A 367 6.624 6.894 -8.780 1.00 0.00 H new ATOM 455 N ARG A 368 0.958 6.048 -7.231 1.00 0.00 N ATOM 456 CA ARG A 368 -0.073 6.610 -8.128 1.00 0.00 C ATOM 457 C ARG A 368 -0.452 8.033 -7.734 1.00 0.00 C ATOM 458 O ARG A 368 -0.440 8.935 -8.570 1.00 0.00 O ATOM 459 CB ARG A 368 -1.275 5.648 -8.154 1.00 0.00 C ATOM 460 CG ARG A 368 -2.388 6.074 -9.124 1.00 0.00 C ATOM 461 CD ARG A 368 -3.544 5.069 -9.060 1.00 0.00 C ATOM 462 NE ARG A 368 -4.663 5.465 -9.943 1.00 0.00 N ATOM 463 CZ ARG A 368 -5.012 4.923 -11.097 1.00 0.00 C ATOM 464 NH1 ARG A 368 -4.339 3.954 -11.652 1.00 0.00 N ATOM 465 NH2 ARG A 368 -6.068 5.353 -11.728 1.00 0.00 N ATOM 0 H ARG A 368 0.658 5.195 -6.760 1.00 0.00 H new ATOM 0 HA ARG A 368 0.322 6.695 -9.140 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -0.926 4.653 -8.430 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -1.690 5.573 -7.149 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -2.746 7.071 -8.866 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -1.997 6.128 -10.140 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -3.184 4.082 -9.349 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -3.901 4.990 -8.033 1.00 0.00 H new ATOM 0 HE ARG A 368 -5.232 6.249 -9.624 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -3.506 3.584 -11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -4.645 3.566 -12.544 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -6.627 6.109 -11.332 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -6.336 4.934 -12.618 1.00 0.00 H new ATOM 479 N ARG A 369 -0.729 8.239 -6.451 1.00 0.00 N ATOM 480 CA ARG A 369 -1.092 9.529 -5.858 1.00 0.00 C ATOM 481 C ARG A 369 -0.021 10.589 -6.096 1.00 0.00 C ATOM 482 O ARG A 369 -0.332 11.717 -6.472 1.00 0.00 O ATOM 483 CB ARG A 369 -1.294 9.261 -4.357 1.00 0.00 C ATOM 484 CG ARG A 369 -1.387 10.435 -3.363 1.00 0.00 C ATOM 485 CD ARG A 369 -0.638 10.033 -2.076 1.00 0.00 C ATOM 486 NE ARG A 369 -0.906 10.951 -0.951 1.00 0.00 N ATOM 487 CZ ARG A 369 -0.287 10.953 0.220 1.00 0.00 C ATOM 488 NH1 ARG A 369 0.655 10.105 0.514 1.00 0.00 N ATOM 489 NH2 ARG A 369 -0.609 11.822 1.135 1.00 0.00 N ATOM 0 H ARG A 369 -0.707 7.484 -5.765 1.00 0.00 H new ATOM 0 HA ARG A 369 -1.997 9.927 -6.317 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -2.209 8.678 -4.254 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -0.472 8.625 -4.029 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -0.947 11.335 -3.794 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -2.429 10.664 -3.141 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -0.929 9.022 -1.792 1.00 0.00 H new ATOM 0 HD3 ARG A 369 0.433 10.012 -2.275 1.00 0.00 H new ATOM 0 HE ARG A 369 -1.637 11.649 -1.089 1.00 0.00 H new ATOM 0 HH11 ARG A 369 0.942 9.404 -0.170 1.00 0.00 H new ATOM 0 HH12 ARG A 369 1.106 10.141 1.428 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -1.342 12.507 0.952 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -0.128 11.817 2.034 1.00 0.00 H new ATOM 503 N GLU A 370 1.235 10.215 -5.871 1.00 0.00 N ATOM 504 CA GLU A 370 2.388 11.099 -6.032 1.00 0.00 C ATOM 505 C GLU A 370 2.579 11.500 -7.497 1.00 0.00 C ATOM 506 O GLU A 370 2.504 12.681 -7.836 1.00 0.00 O ATOM 507 CB GLU A 370 3.640 10.392 -5.499 1.00 0.00 C ATOM 508 CG GLU A 370 4.899 11.272 -5.476 1.00 0.00 C ATOM 509 CD GLU A 370 6.086 10.573 -4.787 1.00 0.00 C ATOM 510 OE1 GLU A 370 5.878 9.664 -3.948 1.00 0.00 O ATOM 511 OE2 GLU A 370 7.257 10.938 -5.041 1.00 0.00 O ATOM 0 H GLU A 370 1.486 9.274 -5.567 1.00 0.00 H new ATOM 0 HA GLU A 370 2.215 12.013 -5.464 1.00 0.00 H new ATOM 0 HB2 GLU A 370 3.440 10.037 -4.488 1.00 0.00 H new ATOM 0 HB3 GLU A 370 3.836 9.513 -6.113 1.00 0.00 H new ATOM 0 HG2 GLU A 370 5.176 11.533 -6.497 1.00 0.00 H new ATOM 0 HG3 GLU A 370 4.678 12.205 -4.957 1.00 0.00 H new ATOM 518 N GLN A 371 2.783 10.514 -8.378 1.00 0.00 N ATOM 519 CA GLN A 371 2.993 10.755 -9.814 1.00 0.00 C ATOM 520 C GLN A 371 1.813 11.478 -10.495 1.00 0.00 C ATOM 521 O GLN A 371 2.021 12.203 -11.470 1.00 0.00 O ATOM 522 CB GLN A 371 3.418 9.462 -10.533 1.00 0.00 C ATOM 523 CG GLN A 371 2.276 8.472 -10.809 1.00 0.00 C ATOM 524 CD GLN A 371 2.782 7.114 -11.297 1.00 0.00 C ATOM 525 OE1 GLN A 371 3.731 6.542 -10.776 1.00 0.00 O ATOM 526 NE2 GLN A 371 2.175 6.537 -12.312 1.00 0.00 N ATOM 0 H GLN A 371 2.808 9.528 -8.118 1.00 0.00 H new ATOM 0 HA GLN A 371 3.822 11.457 -9.903 1.00 0.00 H new ATOM 0 HB2 GLN A 371 3.887 9.727 -11.481 1.00 0.00 H new ATOM 0 HB3 GLN A 371 4.177 8.961 -9.931 1.00 0.00 H new ATOM 0 HG2 GLN A 371 1.693 8.333 -9.899 1.00 0.00 H new ATOM 0 HG3 GLN A 371 1.605 8.896 -11.556 1.00 0.00 H new ATOM 0 HE21 GLN A 371 1.382 6.996 -12.760 1.00 0.00 H new ATOM 0 HE22 GLN A 371 2.497 5.630 -12.650 1.00 0.00 H new ATOM 535 N ALA A 372 0.589 11.335 -9.969 1.00 0.00 N ATOM 536 CA ALA A 372 -0.597 12.047 -10.461 1.00 0.00 C ATOM 537 C ALA A 372 -0.601 13.562 -10.127 1.00 0.00 C ATOM 538 O ALA A 372 -1.460 14.288 -10.637 1.00 0.00 O ATOM 539 CB ALA A 372 -1.854 11.364 -9.910 1.00 0.00 C ATOM 0 H ALA A 372 0.393 10.716 -9.183 1.00 0.00 H new ATOM 0 HA ALA A 372 -0.579 11.992 -11.549 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -2.740 11.887 -10.271 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -1.882 10.328 -10.246 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -1.835 11.391 -8.821 1.00 0.00 H new ATOM 545 N ASN A 373 0.319 14.049 -9.278 1.00 0.00 N ATOM 546 CA ASN A 373 0.387 15.451 -8.842 1.00 0.00 C ATOM 547 C ASN A 373 1.778 16.108 -8.996 1.00 0.00 C ATOM 548 O ASN A 373 1.852 17.260 -9.432 1.00 0.00 O ATOM 549 CB ASN A 373 -0.101 15.505 -7.383 1.00 0.00 C ATOM 550 CG ASN A 373 -0.188 16.927 -6.850 1.00 0.00 C ATOM 551 OD1 ASN A 373 -0.864 17.784 -7.401 1.00 0.00 O ATOM 552 ND2 ASN A 373 0.487 17.228 -5.763 1.00 0.00 N ATOM 0 H ASN A 373 1.050 13.467 -8.868 1.00 0.00 H new ATOM 0 HA ASN A 373 -0.253 16.040 -9.500 1.00 0.00 H new ATOM 0 HB2 ASN A 373 -1.081 15.034 -7.314 1.00 0.00 H new ATOM 0 HB3 ASN A 373 0.576 14.926 -6.755 1.00 0.00 H new ATOM 0 HD21 ASN A 373 0.446 18.173 -5.382 1.00 0.00 H new ATOM 0 HD22 ASN A 373 1.052 16.516 -5.300 1.00 0.00 H new ATOM 559 N GLY A 374 2.873 15.414 -8.661 1.00 0.00 N ATOM 560 CA GLY A 374 4.242 15.939 -8.771 1.00 0.00 C ATOM 561 C GLY A 374 5.236 15.351 -7.763 1.00 0.00 C ATOM 562 O GLY A 374 4.970 14.352 -7.096 1.00 0.00 O ATOM 0 H GLY A 374 2.834 14.460 -8.301 1.00 0.00 H new ATOM 0 HA2 GLY A 374 4.611 15.747 -9.779 1.00 0.00 H new ATOM 0 HA3 GLY A 374 4.213 17.021 -8.643 1.00 0.00 H new ATOM 566 N GLU A 375 6.406 15.980 -7.658 1.00 0.00 N ATOM 567 CA GLU A 375 7.538 15.628 -6.784 1.00 0.00 C ATOM 568 C GLU A 375 7.279 15.892 -5.278 1.00 0.00 C ATOM 569 O GLU A 375 8.056 16.585 -4.612 1.00 0.00 O ATOM 570 CB GLU A 375 8.815 16.352 -7.270 1.00 0.00 C ATOM 571 CG GLU A 375 9.162 16.133 -8.755 1.00 0.00 C ATOM 572 CD GLU A 375 8.683 17.283 -9.671 1.00 0.00 C ATOM 573 OE1 GLU A 375 7.492 17.678 -9.611 1.00 0.00 O ATOM 574 OE2 GLU A 375 9.500 17.798 -10.475 1.00 0.00 O ATOM 0 H GLU A 375 6.608 16.808 -8.218 1.00 0.00 H new ATOM 0 HA GLU A 375 7.673 14.549 -6.862 1.00 0.00 H new ATOM 0 HB2 GLU A 375 8.698 17.421 -7.094 1.00 0.00 H new ATOM 0 HB3 GLU A 375 9.657 16.019 -6.663 1.00 0.00 H new ATOM 0 HG2 GLU A 375 10.242 16.023 -8.856 1.00 0.00 H new ATOM 0 HG3 GLU A 375 8.713 15.199 -9.092 1.00 0.00 H new ATOM 581 N VAL A 376 6.175 15.371 -4.728 1.00 0.00 N ATOM 582 CA VAL A 376 5.765 15.511 -3.313 1.00 0.00 C ATOM 583 C VAL A 376 6.835 14.954 -2.351 1.00 0.00 C ATOM 584 O VAL A 376 7.507 13.962 -2.653 1.00 0.00 O ATOM 585 CB VAL A 376 4.395 14.831 -3.074 1.00 0.00 C ATOM 586 CG1 VAL A 376 3.873 15.015 -1.642 1.00 0.00 C ATOM 587 CG2 VAL A 376 3.308 15.396 -4.004 1.00 0.00 C ATOM 0 H VAL A 376 5.513 14.818 -5.272 1.00 0.00 H new ATOM 0 HA VAL A 376 5.663 16.575 -3.101 1.00 0.00 H new ATOM 0 HB VAL A 376 4.579 13.775 -3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 376 2.910 14.515 -1.539 1.00 0.00 H new ATOM 0 HG12 VAL A 376 4.583 14.582 -0.937 1.00 0.00 H new ATOM 0 HG13 VAL A 376 3.755 16.078 -1.432 1.00 0.00 H new ATOM 0 HG21 VAL A 376 2.362 14.893 -3.805 1.00 0.00 H new ATOM 0 HG22 VAL A 376 3.195 16.465 -3.825 1.00 0.00 H new ATOM 0 HG23 VAL A 376 3.596 15.231 -5.042 1.00 0.00 H new ATOM 597 N ARG A 377 6.997 15.598 -1.184 1.00 0.00 N ATOM 598 CA ARG A 377 7.953 15.229 -0.116 1.00 0.00 C ATOM 599 C ARG A 377 7.612 13.892 0.570 1.00 0.00 C ATOM 600 O ARG A 377 6.592 13.267 0.271 1.00 0.00 O ATOM 601 CB ARG A 377 8.035 16.401 0.893 1.00 0.00 C ATOM 602 CG ARG A 377 9.452 16.757 1.397 1.00 0.00 C ATOM 603 CD ARG A 377 10.481 17.121 0.308 1.00 0.00 C ATOM 604 NE ARG A 377 9.927 18.053 -0.699 1.00 0.00 N ATOM 605 CZ ARG A 377 9.604 17.765 -1.948 1.00 0.00 C ATOM 606 NH1 ARG A 377 9.972 16.668 -2.541 1.00 0.00 N ATOM 607 NH2 ARG A 377 8.862 18.567 -2.652 1.00 0.00 N ATOM 0 H ARG A 377 6.446 16.423 -0.945 1.00 0.00 H new ATOM 0 HA ARG A 377 8.931 15.063 -0.567 1.00 0.00 H new ATOM 0 HB2 ARG A 377 7.602 17.287 0.428 1.00 0.00 H new ATOM 0 HB3 ARG A 377 7.414 16.158 1.755 1.00 0.00 H new ATOM 0 HG2 ARG A 377 9.371 17.596 2.088 1.00 0.00 H new ATOM 0 HG3 ARG A 377 9.838 15.911 1.966 1.00 0.00 H new ATOM 0 HD2 ARG A 377 11.356 17.572 0.775 1.00 0.00 H new ATOM 0 HD3 ARG A 377 10.818 16.211 -0.189 1.00 0.00 H new ATOM 0 HE ARG A 377 9.779 19.016 -0.399 1.00 0.00 H new ATOM 0 HH11 ARG A 377 10.537 15.982 -2.040 1.00 0.00 H new ATOM 0 HH12 ARG A 377 9.696 16.493 -3.507 1.00 0.00 H new ATOM 0 HH21 ARG A 377 8.519 19.436 -2.242 1.00 0.00 H new ATOM 0 HH22 ARG A 377 8.623 18.328 -3.614 1.00 0.00 H new ATOM 621 N ALA A 378 8.468 13.453 1.498 1.00 0.00 N ATOM 622 CA ALA A 378 8.312 12.216 2.264 1.00 0.00 C ATOM 623 C ALA A 378 6.916 12.085 2.914 1.00 0.00 C ATOM 624 O ALA A 378 6.393 13.034 3.512 1.00 0.00 O ATOM 625 CB ALA A 378 9.432 12.140 3.310 1.00 0.00 C ATOM 0 H ALA A 378 9.315 13.966 1.743 1.00 0.00 H new ATOM 0 HA ALA A 378 8.391 11.373 1.578 1.00 0.00 H new ATOM 0 HB1 ALA A 378 9.328 11.222 3.889 1.00 0.00 H new ATOM 0 HB2 ALA A 378 10.400 12.145 2.808 1.00 0.00 H new ATOM 0 HB3 ALA A 378 9.365 12.999 3.977 1.00 0.00 H new ATOM 631 N CYS A 379 6.326 10.896 2.774 1.00 0.00 N ATOM 632 CA CYS A 379 4.998 10.544 3.278 1.00 0.00 C ATOM 633 C CYS A 379 4.906 10.557 4.824 1.00 0.00 C ATOM 634 O CYS A 379 5.915 10.547 5.538 1.00 0.00 O ATOM 635 CB CYS A 379 4.631 9.185 2.661 1.00 0.00 C ATOM 636 SG CYS A 379 2.841 8.888 2.733 1.00 0.00 S ATOM 0 H CYS A 379 6.778 10.122 2.287 1.00 0.00 H new ATOM 0 HA CYS A 379 4.273 11.300 2.978 1.00 0.00 H new ATOM 0 HB2 CYS A 379 4.966 9.152 1.624 1.00 0.00 H new ATOM 0 HB3 CYS A 379 5.155 8.390 3.191 1.00 0.00 H new ATOM 641 N SER A 380 3.674 10.556 5.340 1.00 0.00 N ATOM 642 CA SER A 380 3.308 10.574 6.769 1.00 0.00 C ATOM 643 C SER A 380 3.716 9.323 7.577 1.00 0.00 C ATOM 644 O SER A 380 3.444 9.248 8.778 1.00 0.00 O ATOM 645 CB SER A 380 1.787 10.763 6.897 1.00 0.00 C ATOM 646 OG SER A 380 1.341 11.882 6.140 1.00 0.00 O ATOM 0 H SER A 380 2.851 10.542 4.738 1.00 0.00 H new ATOM 0 HA SER A 380 3.872 11.402 7.198 1.00 0.00 H new ATOM 0 HB2 SER A 380 1.276 9.863 6.555 1.00 0.00 H new ATOM 0 HB3 SER A 380 1.522 10.901 7.945 1.00 0.00 H new ATOM 0 HG SER A 380 0.371 11.978 6.238 1.00 0.00 H new ATOM 652 N LEU A 381 4.351 8.336 6.938 1.00 0.00 N ATOM 653 CA LEU A 381 4.782 7.059 7.514 1.00 0.00 C ATOM 654 C LEU A 381 6.158 6.674 6.928 1.00 0.00 C ATOM 655 O LEU A 381 6.217 6.353 5.742 1.00 0.00 O ATOM 656 CB LEU A 381 3.677 6.034 7.177 1.00 0.00 C ATOM 657 CG LEU A 381 3.913 4.589 7.645 1.00 0.00 C ATOM 658 CD1 LEU A 381 4.159 4.490 9.151 1.00 0.00 C ATOM 659 CD2 LEU A 381 2.674 3.757 7.312 1.00 0.00 C ATOM 0 H LEU A 381 4.591 8.411 5.950 1.00 0.00 H new ATOM 0 HA LEU A 381 4.911 7.105 8.595 1.00 0.00 H new ATOM 0 HB2 LEU A 381 2.742 6.385 7.614 1.00 0.00 H new ATOM 0 HB3 LEU A 381 3.540 6.024 6.096 1.00 0.00 H new ATOM 0 HG LEU A 381 4.802 4.222 7.133 1.00 0.00 H new ATOM 0 HD11 LEU A 381 4.319 3.447 9.426 1.00 0.00 H new ATOM 0 HD12 LEU A 381 5.040 5.075 9.415 1.00 0.00 H new ATOM 0 HD13 LEU A 381 3.293 4.877 9.687 1.00 0.00 H new ATOM 0 HD21 LEU A 381 2.828 2.729 7.639 1.00 0.00 H new ATOM 0 HD22 LEU A 381 1.807 4.175 7.824 1.00 0.00 H new ATOM 0 HD23 LEU A 381 2.503 3.774 6.236 1.00 0.00 H new ATOM 671 N PRO A 382 7.271 6.708 7.693 1.00 0.00 N ATOM 672 CA PRO A 382 8.625 6.413 7.195 1.00 0.00 C ATOM 673 C PRO A 382 8.774 5.151 6.325 1.00 0.00 C ATOM 674 O PRO A 382 9.494 5.172 5.323 1.00 0.00 O ATOM 675 CB PRO A 382 9.510 6.338 8.443 1.00 0.00 C ATOM 676 CG PRO A 382 8.818 7.293 9.412 1.00 0.00 C ATOM 677 CD PRO A 382 7.337 7.098 9.096 1.00 0.00 C ATOM 0 HA PRO A 382 8.914 7.202 6.501 1.00 0.00 H new ATOM 0 HB2 PRO A 382 9.560 5.325 8.842 1.00 0.00 H new ATOM 0 HB3 PRO A 382 10.533 6.649 8.232 1.00 0.00 H new ATOM 0 HG2 PRO A 382 9.044 7.048 10.450 1.00 0.00 H new ATOM 0 HG3 PRO A 382 9.131 8.325 9.253 1.00 0.00 H new ATOM 0 HD2 PRO A 382 6.900 6.331 9.735 1.00 0.00 H new ATOM 0 HD3 PRO A 382 6.777 8.016 9.272 1.00 0.00 H new ATOM 685 N HIS A 383 8.085 4.060 6.679 1.00 0.00 N ATOM 686 CA HIS A 383 8.117 2.786 5.943 1.00 0.00 C ATOM 687 C HIS A 383 7.555 2.870 4.509 1.00 0.00 C ATOM 688 O HIS A 383 7.898 2.034 3.670 1.00 0.00 O ATOM 689 CB HIS A 383 7.351 1.721 6.744 1.00 0.00 C ATOM 690 CG HIS A 383 7.894 1.496 8.134 1.00 0.00 C ATOM 691 ND1 HIS A 383 9.127 0.973 8.456 1.00 0.00 N ATOM 692 CD2 HIS A 383 7.257 1.780 9.314 1.00 0.00 C ATOM 693 CE1 HIS A 383 9.234 0.943 9.795 1.00 0.00 C ATOM 694 NE2 HIS A 383 8.115 1.427 10.365 1.00 0.00 N ATOM 0 H HIS A 383 7.478 4.035 7.499 1.00 0.00 H new ATOM 0 HA HIS A 383 9.167 2.516 5.834 1.00 0.00 H new ATOM 0 HB2 HIS A 383 6.305 2.017 6.817 1.00 0.00 H new ATOM 0 HB3 HIS A 383 7.378 0.779 6.197 1.00 0.00 H new ATOM 0 HD2 HIS A 383 6.268 2.202 9.416 1.00 0.00 H new ATOM 0 HE1 HIS A 383 10.096 0.582 10.337 1.00 0.00 H new ATOM 0 HE2 HIS A 383 7.928 1.519 11.364 1.00 0.00 H new ATOM 702 N CYS A 384 6.723 3.876 4.208 1.00 0.00 N ATOM 703 CA CYS A 384 6.136 4.103 2.888 1.00 0.00 C ATOM 704 C CYS A 384 7.217 4.240 1.804 1.00 0.00 C ATOM 705 O CYS A 384 7.159 3.554 0.784 1.00 0.00 O ATOM 706 CB CYS A 384 5.247 5.348 2.993 1.00 0.00 C ATOM 707 SG CYS A 384 4.564 5.809 1.384 1.00 0.00 S ATOM 0 H CYS A 384 6.434 4.571 4.897 1.00 0.00 H new ATOM 0 HA CYS A 384 5.534 3.247 2.583 1.00 0.00 H new ATOM 0 HB2 CYS A 384 4.434 5.158 3.694 1.00 0.00 H new ATOM 0 HB3 CYS A 384 5.827 6.178 3.395 1.00 0.00 H new ATOM 712 N ARG A 385 8.241 5.077 2.033 1.00 0.00 N ATOM 713 CA ARG A 385 9.354 5.280 1.086 1.00 0.00 C ATOM 714 C ARG A 385 10.163 4.002 0.835 1.00 0.00 C ATOM 715 O ARG A 385 10.556 3.727 -0.298 1.00 0.00 O ATOM 716 CB ARG A 385 10.242 6.453 1.552 1.00 0.00 C ATOM 717 CG ARG A 385 10.630 7.373 0.383 1.00 0.00 C ATOM 718 CD ARG A 385 9.444 8.236 -0.077 1.00 0.00 C ATOM 719 NE ARG A 385 9.760 8.972 -1.317 1.00 0.00 N ATOM 720 CZ ARG A 385 8.879 9.500 -2.148 1.00 0.00 C ATOM 721 NH1 ARG A 385 7.615 9.555 -1.856 1.00 0.00 N ATOM 722 NH2 ARG A 385 9.236 9.973 -3.304 1.00 0.00 N ATOM 0 H ARG A 385 8.323 5.635 2.883 1.00 0.00 H new ATOM 0 HA ARG A 385 8.922 5.541 0.120 1.00 0.00 H new ATOM 0 HB2 ARG A 385 9.713 7.031 2.310 1.00 0.00 H new ATOM 0 HB3 ARG A 385 11.144 6.062 2.022 1.00 0.00 H new ATOM 0 HG2 ARG A 385 11.454 8.019 0.686 1.00 0.00 H new ATOM 0 HG3 ARG A 385 10.987 6.770 -0.452 1.00 0.00 H new ATOM 0 HD2 ARG A 385 8.573 7.602 -0.241 1.00 0.00 H new ATOM 0 HD3 ARG A 385 9.180 8.943 0.710 1.00 0.00 H new ATOM 0 HE ARG A 385 10.746 9.083 -1.553 1.00 0.00 H new ATOM 0 HH11 ARG A 385 7.281 9.185 -0.966 1.00 0.00 H new ATOM 0 HH12 ARG A 385 6.957 9.968 -2.516 1.00 0.00 H new ATOM 0 HH21 ARG A 385 10.215 9.942 -3.588 1.00 0.00 H new ATOM 0 HH22 ARG A 385 8.537 10.376 -3.928 1.00 0.00 H new ATOM 736 N THR A 386 10.347 3.187 1.872 1.00 0.00 N ATOM 737 CA THR A 386 11.025 1.885 1.796 1.00 0.00 C ATOM 738 C THR A 386 10.215 0.944 0.910 1.00 0.00 C ATOM 739 O THR A 386 10.744 0.404 -0.059 1.00 0.00 O ATOM 740 CB THR A 386 11.206 1.249 3.188 1.00 0.00 C ATOM 741 OG1 THR A 386 11.660 2.201 4.128 1.00 0.00 O ATOM 742 CG2 THR A 386 12.217 0.103 3.165 1.00 0.00 C ATOM 0 H THR A 386 10.023 3.415 2.812 1.00 0.00 H new ATOM 0 HA THR A 386 12.016 2.048 1.372 1.00 0.00 H new ATOM 0 HB THR A 386 10.226 0.868 3.475 1.00 0.00 H new ATOM 0 HG1 THR A 386 11.765 1.772 5.003 1.00 0.00 H new ATOM 0 HG21 THR A 386 12.314 -0.317 4.166 1.00 0.00 H new ATOM 0 HG22 THR A 386 11.874 -0.671 2.479 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.185 0.478 2.834 1.00 0.00 H new ATOM 750 N MET A 387 8.917 0.778 1.180 1.00 0.00 N ATOM 751 CA MET A 387 8.062 -0.073 0.351 1.00 0.00 C ATOM 752 C MET A 387 7.873 0.479 -1.068 1.00 0.00 C ATOM 753 O MET A 387 7.834 -0.315 -2.003 1.00 0.00 O ATOM 754 CB MET A 387 6.725 -0.362 1.042 1.00 0.00 C ATOM 755 CG MET A 387 6.767 -1.723 1.751 1.00 0.00 C ATOM 756 SD MET A 387 7.807 -1.861 3.233 1.00 0.00 S ATOM 757 CE MET A 387 9.279 -2.642 2.509 1.00 0.00 C ATOM 0 H MET A 387 8.437 1.221 1.964 1.00 0.00 H new ATOM 0 HA MET A 387 8.582 -1.024 0.234 1.00 0.00 H new ATOM 0 HB2 MET A 387 6.505 0.424 1.765 1.00 0.00 H new ATOM 0 HB3 MET A 387 5.920 -0.353 0.307 1.00 0.00 H new ATOM 0 HG2 MET A 387 5.747 -1.990 2.029 1.00 0.00 H new ATOM 0 HG3 MET A 387 7.106 -2.468 1.031 1.00 0.00 H new ATOM 0 HE1 MET A 387 9.899 -3.056 3.304 1.00 0.00 H new ATOM 0 HE2 MET A 387 8.972 -3.441 1.834 1.00 0.00 H new ATOM 0 HE3 MET A 387 9.850 -1.898 1.954 1.00 0.00 H new ATOM 767 N LYS A 388 7.840 1.802 -1.282 1.00 0.00 N ATOM 768 CA LYS A 388 7.843 2.409 -2.628 1.00 0.00 C ATOM 769 C LYS A 388 9.115 2.005 -3.372 1.00 0.00 C ATOM 770 O LYS A 388 9.036 1.666 -4.553 1.00 0.00 O ATOM 771 CB LYS A 388 7.776 3.939 -2.510 1.00 0.00 C ATOM 772 CG LYS A 388 6.362 4.518 -2.330 1.00 0.00 C ATOM 773 CD LYS A 388 6.488 5.944 -1.773 1.00 0.00 C ATOM 774 CE LYS A 388 5.170 6.725 -1.704 1.00 0.00 C ATOM 775 NZ LYS A 388 4.783 7.322 -3.006 1.00 0.00 N ATOM 0 H LYS A 388 7.810 2.487 -0.526 1.00 0.00 H new ATOM 0 HA LYS A 388 6.974 2.055 -3.182 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.390 4.250 -1.664 1.00 0.00 H new ATOM 0 HB3 LYS A 388 8.220 4.377 -3.404 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.833 4.529 -3.283 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.781 3.895 -1.650 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.916 5.892 -0.772 1.00 0.00 H new ATOM 0 HD3 LYS A 388 7.192 6.500 -2.392 1.00 0.00 H new ATOM 0 HE2 LYS A 388 4.376 6.059 -1.365 1.00 0.00 H new ATOM 0 HE3 LYS A 388 5.261 7.516 -0.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.861 7.794 -2.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 5.500 8.018 -3.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.717 6.574 -3.725 1.00 0.00 H new ATOM 789 N ASN A 389 10.272 1.983 -2.699 1.00 0.00 N ATOM 790 CA ASN A 389 11.525 1.538 -3.323 1.00 0.00 C ATOM 791 C ASN A 389 11.463 0.038 -3.685 1.00 0.00 C ATOM 792 O ASN A 389 11.841 -0.350 -4.788 1.00 0.00 O ATOM 793 CB ASN A 389 12.710 1.871 -2.400 1.00 0.00 C ATOM 794 CG ASN A 389 14.039 1.473 -3.024 1.00 0.00 C ATOM 795 OD1 ASN A 389 14.436 1.967 -4.070 1.00 0.00 O ATOM 796 ND2 ASN A 389 14.766 0.563 -2.412 1.00 0.00 N ATOM 0 H ASN A 389 10.367 2.268 -1.724 1.00 0.00 H new ATOM 0 HA ASN A 389 11.671 2.074 -4.261 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.715 2.940 -2.185 1.00 0.00 H new ATOM 0 HB3 ASN A 389 12.586 1.355 -1.448 1.00 0.00 H new ATOM 0 HD21 ASN A 389 15.659 0.271 -2.810 1.00 0.00 H new ATOM 0 HD22 ASN A 389 14.437 0.150 -1.540 1.00 0.00 H new ATOM 803 N VAL A 390 10.929 -0.795 -2.786 1.00 0.00 N ATOM 804 CA VAL A 390 10.718 -2.245 -2.986 1.00 0.00 C ATOM 805 C VAL A 390 9.740 -2.521 -4.135 1.00 0.00 C ATOM 806 O VAL A 390 9.960 -3.434 -4.928 1.00 0.00 O ATOM 807 CB VAL A 390 10.195 -2.858 -1.673 1.00 0.00 C ATOM 808 CG1 VAL A 390 9.683 -4.296 -1.775 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.293 -2.861 -0.609 1.00 0.00 C ATOM 0 H VAL A 390 10.620 -0.475 -1.868 1.00 0.00 H new ATOM 0 HA VAL A 390 11.669 -2.704 -3.258 1.00 0.00 H new ATOM 0 HB VAL A 390 9.349 -2.222 -1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.339 -4.630 -0.796 1.00 0.00 H new ATOM 0 HG12 VAL A 390 8.856 -4.338 -2.484 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.489 -4.946 -2.117 1.00 0.00 H new ATOM 0 HG21 VAL A 390 10.906 -3.297 0.312 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.140 -3.450 -0.962 1.00 0.00 H new ATOM 0 HG23 VAL A 390 11.617 -1.838 -0.418 1.00 0.00 H new ATOM 819 N LEU A 391 8.672 -1.729 -4.259 1.00 0.00 N ATOM 820 CA LEU A 391 7.676 -1.862 -5.323 1.00 0.00 C ATOM 821 C LEU A 391 8.288 -1.450 -6.671 1.00 0.00 C ATOM 822 O LEU A 391 8.246 -2.225 -7.623 1.00 0.00 O ATOM 823 CB LEU A 391 6.429 -1.041 -4.943 1.00 0.00 C ATOM 824 CG LEU A 391 5.120 -1.471 -5.629 1.00 0.00 C ATOM 825 CD1 LEU A 391 3.997 -0.576 -5.115 1.00 0.00 C ATOM 826 CD2 LEU A 391 5.133 -1.369 -7.153 1.00 0.00 C ATOM 0 H LEU A 391 8.473 -0.966 -3.612 1.00 0.00 H new ATOM 0 HA LEU A 391 7.363 -2.900 -5.435 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.290 -1.102 -3.864 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.618 0.006 -5.182 1.00 0.00 H new ATOM 0 HG LEU A 391 4.981 -2.525 -5.386 1.00 0.00 H new ATOM 0 HD11 LEU A 391 3.058 -0.863 -5.588 1.00 0.00 H new ATOM 0 HD12 LEU A 391 3.908 -0.688 -4.034 1.00 0.00 H new ATOM 0 HD13 LEU A 391 4.222 0.463 -5.355 1.00 0.00 H new ATOM 0 HD21 LEU A 391 4.170 -1.692 -7.548 1.00 0.00 H new ATOM 0 HD22 LEU A 391 5.317 -0.336 -7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 391 5.922 -2.006 -7.554 1.00 0.00 H new ATOM 838 N ASN A 392 8.939 -0.284 -6.751 1.00 0.00 N ATOM 839 CA ASN A 392 9.645 0.136 -7.971 1.00 0.00 C ATOM 840 C ASN A 392 10.727 -0.896 -8.350 1.00 0.00 C ATOM 841 O ASN A 392 10.937 -1.180 -9.532 1.00 0.00 O ATOM 842 CB ASN A 392 10.229 1.549 -7.788 1.00 0.00 C ATOM 843 CG ASN A 392 9.193 2.647 -7.992 1.00 0.00 C ATOM 844 OD1 ASN A 392 8.951 3.103 -9.100 1.00 0.00 O ATOM 845 ND2 ASN A 392 8.547 3.102 -6.943 1.00 0.00 N ATOM 0 H ASN A 392 8.993 0.388 -5.985 1.00 0.00 H new ATOM 0 HA ASN A 392 8.937 0.180 -8.799 1.00 0.00 H new ATOM 0 HB2 ASN A 392 10.651 1.636 -6.787 1.00 0.00 H new ATOM 0 HB3 ASN A 392 11.048 1.693 -8.493 1.00 0.00 H new ATOM 0 HD21 ASN A 392 7.845 3.834 -7.054 1.00 0.00 H new ATOM 0 HD22 ASN A 392 8.747 2.723 -6.017 1.00 0.00 H new ATOM 852 N HIS A 393 11.364 -1.532 -7.360 1.00 0.00 N ATOM 853 CA HIS A 393 12.280 -2.628 -7.638 1.00 0.00 C ATOM 854 C HIS A 393 11.493 -3.786 -8.254 1.00 0.00 C ATOM 855 O HIS A 393 11.871 -4.216 -9.334 1.00 0.00 O ATOM 856 CB HIS A 393 13.061 -3.064 -6.399 1.00 0.00 C ATOM 857 CG HIS A 393 13.941 -4.257 -6.694 1.00 0.00 C ATOM 858 ND1 HIS A 393 15.221 -4.247 -7.202 1.00 0.00 N ATOM 859 CD2 HIS A 393 13.518 -5.559 -6.705 1.00 0.00 C ATOM 860 CE1 HIS A 393 15.549 -5.512 -7.531 1.00 0.00 C ATOM 861 NE2 HIS A 393 14.532 -6.350 -7.264 1.00 0.00 N ATOM 0 H HIS A 393 11.259 -1.305 -6.371 1.00 0.00 H new ATOM 0 HA HIS A 393 13.031 -2.285 -8.349 1.00 0.00 H new ATOM 0 HB2 HIS A 393 13.675 -2.236 -6.044 1.00 0.00 H new ATOM 0 HB3 HIS A 393 12.366 -3.312 -5.597 1.00 0.00 H new ATOM 0 HD1 HIS A 393 15.816 -3.426 -7.310 1.00 0.00 H new ATOM 0 HD2 HIS A 393 12.565 -5.916 -6.344 1.00 0.00 H new ATOM 0 HE1 HIS A 393 16.498 -5.811 -7.951 1.00 0.00 H new ATOM 869 N MET A 394 10.387 -4.254 -7.652 1.00 0.00 N ATOM 870 CA MET A 394 9.579 -5.337 -8.241 1.00 0.00 C ATOM 871 C MET A 394 9.077 -5.016 -9.662 1.00 0.00 C ATOM 872 O MET A 394 8.882 -5.946 -10.449 1.00 0.00 O ATOM 873 CB MET A 394 8.442 -5.845 -7.324 1.00 0.00 C ATOM 874 CG MET A 394 7.079 -5.138 -7.428 1.00 0.00 C ATOM 875 SD MET A 394 5.629 -6.149 -6.999 1.00 0.00 S ATOM 876 CE MET A 394 6.034 -6.630 -5.302 1.00 0.00 C ATOM 0 H MET A 394 10.033 -3.902 -6.763 1.00 0.00 H new ATOM 0 HA MET A 394 10.275 -6.171 -8.336 1.00 0.00 H new ATOM 0 HB2 MET A 394 8.289 -6.904 -7.532 1.00 0.00 H new ATOM 0 HB3 MET A 394 8.783 -5.769 -6.291 1.00 0.00 H new ATOM 0 HG2 MET A 394 7.094 -4.263 -6.778 1.00 0.00 H new ATOM 0 HG3 MET A 394 6.956 -4.775 -8.448 1.00 0.00 H new ATOM 0 HE1 MET A 394 5.213 -7.211 -4.883 1.00 0.00 H new ATOM 0 HE2 MET A 394 6.942 -7.233 -5.302 1.00 0.00 H new ATOM 0 HE3 MET A 394 6.192 -5.736 -4.698 1.00 0.00 H new ATOM 886 N THR A 395 8.894 -3.734 -10.019 1.00 0.00 N ATOM 887 CA THR A 395 8.487 -3.368 -11.396 1.00 0.00 C ATOM 888 C THR A 395 9.668 -3.471 -12.364 1.00 0.00 C ATOM 889 O THR A 395 9.498 -3.950 -13.489 1.00 0.00 O ATOM 890 CB THR A 395 7.825 -1.984 -11.543 1.00 0.00 C ATOM 891 OG1 THR A 395 8.702 -0.917 -11.268 1.00 0.00 O ATOM 892 CG2 THR A 395 6.604 -1.810 -10.648 1.00 0.00 C ATOM 0 H THR A 395 9.018 -2.942 -9.389 1.00 0.00 H new ATOM 0 HA THR A 395 7.717 -4.097 -11.648 1.00 0.00 H new ATOM 0 HB THR A 395 7.525 -1.953 -12.591 1.00 0.00 H new ATOM 0 HG1 THR A 395 9.331 -1.183 -10.565 1.00 0.00 H new ATOM 0 HG21 THR A 395 6.182 -0.816 -10.797 1.00 0.00 H new ATOM 0 HG22 THR A 395 5.857 -2.562 -10.901 1.00 0.00 H new ATOM 0 HG23 THR A 395 6.898 -1.927 -9.605 1.00 0.00 H new ATOM 900 N HIS A 396 10.870 -3.065 -11.937 1.00 0.00 N ATOM 901 CA HIS A 396 12.100 -3.169 -12.740 1.00 0.00 C ATOM 902 C HIS A 396 12.737 -4.584 -12.732 1.00 0.00 C ATOM 903 O HIS A 396 13.535 -4.907 -13.619 1.00 0.00 O ATOM 904 CB HIS A 396 13.101 -2.104 -12.265 1.00 0.00 C ATOM 905 CG HIS A 396 12.666 -0.689 -12.578 1.00 0.00 C ATOM 906 ND1 HIS A 396 11.601 -0.015 -12.023 1.00 0.00 N ATOM 907 CD2 HIS A 396 13.247 0.165 -13.480 1.00 0.00 C ATOM 908 CE1 HIS A 396 11.538 1.210 -12.568 1.00 0.00 C ATOM 909 NE2 HIS A 396 12.527 1.370 -13.468 1.00 0.00 N ATOM 0 H HIS A 396 11.020 -2.651 -11.017 1.00 0.00 H new ATOM 0 HA HIS A 396 11.826 -2.990 -13.780 1.00 0.00 H new ATOM 0 HB2 HIS A 396 13.242 -2.203 -11.189 1.00 0.00 H new ATOM 0 HB3 HIS A 396 14.068 -2.291 -12.732 1.00 0.00 H new ATOM 0 HD1 HIS A 396 10.966 -0.385 -11.316 1.00 0.00 H new ATOM 0 HD2 HIS A 396 14.109 -0.052 -14.093 1.00 0.00 H new ATOM 0 HE1 HIS A 396 10.801 1.959 -12.320 1.00 0.00 H new ATOM 917 N CYS A 397 12.408 -5.416 -11.736 1.00 0.00 N ATOM 918 CA CYS A 397 12.892 -6.779 -11.507 1.00 0.00 C ATOM 919 C CYS A 397 12.546 -7.738 -12.667 1.00 0.00 C ATOM 920 O CYS A 397 11.586 -7.523 -13.416 1.00 0.00 O ATOM 921 CB CYS A 397 12.295 -7.244 -10.165 1.00 0.00 C ATOM 922 SG CYS A 397 13.049 -8.755 -9.509 1.00 0.00 S ATOM 0 H CYS A 397 11.746 -5.130 -11.015 1.00 0.00 H new ATOM 0 HA CYS A 397 13.981 -6.788 -11.465 1.00 0.00 H new ATOM 0 HB2 CYS A 397 12.409 -6.445 -9.432 1.00 0.00 H new ATOM 0 HB3 CYS A 397 11.225 -7.410 -10.293 1.00 0.00 H new ATOM 927 N GLN A 398 13.331 -8.812 -12.795 1.00 0.00 N ATOM 928 CA GLN A 398 13.177 -9.835 -13.841 1.00 0.00 C ATOM 929 C GLN A 398 13.029 -11.267 -13.303 1.00 0.00 C ATOM 930 O GLN A 398 12.503 -12.128 -14.012 1.00 0.00 O ATOM 931 CB GLN A 398 14.336 -9.729 -14.849 1.00 0.00 C ATOM 932 CG GLN A 398 14.322 -8.404 -15.631 1.00 0.00 C ATOM 933 CD GLN A 398 15.487 -8.276 -16.616 1.00 0.00 C ATOM 934 OE1 GLN A 398 15.915 -9.224 -17.264 1.00 0.00 O ATOM 935 NE2 GLN A 398 16.051 -7.096 -16.772 1.00 0.00 N ATOM 0 H GLN A 398 14.108 -9.001 -12.162 1.00 0.00 H new ATOM 0 HA GLN A 398 12.233 -9.627 -14.345 1.00 0.00 H new ATOM 0 HB2 GLN A 398 15.284 -9.823 -14.319 1.00 0.00 H new ATOM 0 HB3 GLN A 398 14.279 -10.561 -15.551 1.00 0.00 H new ATOM 0 HG2 GLN A 398 13.382 -8.321 -16.176 1.00 0.00 H new ATOM 0 HG3 GLN A 398 14.356 -7.573 -14.927 1.00 0.00 H new ATOM 0 HE21 GLN A 398 15.710 -6.294 -16.242 1.00 0.00 H new ATOM 0 HE22 GLN A 398 16.829 -6.984 -17.423 1.00 0.00 H new ATOM 944 N ALA A 399 13.427 -11.526 -12.052 1.00 0.00 N ATOM 945 CA ALA A 399 13.234 -12.827 -11.407 1.00 0.00 C ATOM 946 C ALA A 399 11.943 -12.880 -10.581 1.00 0.00 C ATOM 947 O ALA A 399 11.257 -13.903 -10.581 1.00 0.00 O ATOM 948 CB ALA A 399 14.405 -13.123 -10.464 1.00 0.00 C ATOM 0 H ALA A 399 13.892 -10.838 -11.459 1.00 0.00 H new ATOM 0 HA ALA A 399 13.173 -13.566 -12.206 1.00 0.00 H new ATOM 0 HB1 ALA A 399 14.253 -14.092 -9.989 1.00 0.00 H new ATOM 0 HB2 ALA A 399 15.335 -13.139 -11.033 1.00 0.00 H new ATOM 0 HB3 ALA A 399 14.461 -12.349 -9.699 1.00 0.00 H new ATOM 954 N PRO A 400 11.644 -11.794 -9.859 1.00 0.00 N ATOM 955 CA PRO A 400 10.528 -11.625 -8.921 1.00 0.00 C ATOM 956 C PRO A 400 10.497 -12.630 -7.753 1.00 0.00 C ATOM 957 O PRO A 400 10.722 -12.268 -6.600 1.00 0.00 O ATOM 961 N LYS A 401 10.244 -13.907 -8.056 1.00 0.00 N ATOM 962 CA LYS A 401 10.206 -15.046 -7.113 1.00 0.00 C ATOM 963 C LYS A 401 11.608 -15.559 -6.776 1.00 0.00 C ATOM 964 O LYS A 401 11.945 -15.770 -5.612 1.00 0.00 O ATOM 965 CB LYS A 401 9.318 -16.168 -7.681 1.00 0.00 C ATOM 966 CG LYS A 401 7.841 -15.739 -7.757 1.00 0.00 C ATOM 967 CD LYS A 401 6.912 -16.860 -8.248 1.00 0.00 C ATOM 968 CE LYS A 401 7.156 -17.208 -9.723 1.00 0.00 C ATOM 969 NZ LYS A 401 6.240 -18.284 -10.190 1.00 0.00 N ATOM 0 H LYS A 401 10.049 -14.197 -9.014 1.00 0.00 H new ATOM 0 HA LYS A 401 9.771 -14.696 -6.177 1.00 0.00 H new ATOM 0 HB2 LYS A 401 9.669 -16.442 -8.676 1.00 0.00 H new ATOM 0 HB3 LYS A 401 9.408 -17.056 -7.055 1.00 0.00 H new ATOM 0 HG2 LYS A 401 7.513 -15.410 -6.771 1.00 0.00 H new ATOM 0 HG3 LYS A 401 7.752 -14.882 -8.425 1.00 0.00 H new ATOM 0 HD2 LYS A 401 7.063 -17.749 -7.636 1.00 0.00 H new ATOM 0 HD3 LYS A 401 5.874 -16.554 -8.115 1.00 0.00 H new ATOM 0 HE2 LYS A 401 7.015 -16.318 -10.336 1.00 0.00 H new ATOM 0 HE3 LYS A 401 8.190 -17.526 -9.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 6.432 -18.494 -11.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 6.393 -19.141 -9.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 5.254 -17.970 -10.086 1.00 0.00 H new ATOM 983 N ALA A 402 12.430 -15.712 -7.816 1.00 0.00 N ATOM 984 CA ALA A 402 13.835 -16.125 -7.758 1.00 0.00 C ATOM 985 C ALA A 402 14.764 -14.998 -7.248 1.00 0.00 C ATOM 986 O ALA A 402 15.939 -15.242 -6.972 1.00 0.00 O ATOM 987 CB ALA A 402 14.257 -16.722 -9.109 1.00 0.00 C ATOM 0 H ALA A 402 12.118 -15.542 -8.772 1.00 0.00 H new ATOM 0 HA ALA A 402 13.941 -16.912 -7.012 1.00 0.00 H new ATOM 0 HB1 ALA A 402 15.302 -17.028 -9.061 1.00 0.00 H new ATOM 0 HB2 ALA A 402 13.635 -17.589 -9.334 1.00 0.00 H new ATOM 0 HB3 ALA A 402 14.133 -15.974 -9.892 1.00 0.00 H new ATOM 993 N CYS A 403 14.241 -13.766 -7.120 1.00 0.00 N ATOM 994 CA CYS A 403 14.887 -12.554 -6.627 1.00 0.00 C ATOM 995 C CYS A 403 14.942 -12.584 -5.100 1.00 0.00 C ATOM 996 O CYS A 403 14.434 -11.714 -4.396 1.00 0.00 O ATOM 997 CB CYS A 403 14.203 -11.280 -7.104 1.00 0.00 C ATOM 998 SG CYS A 403 15.328 -9.860 -6.891 1.00 0.00 S ATOM 0 H CYS A 403 13.272 -13.586 -7.384 1.00 0.00 H new ATOM 0 HA CYS A 403 15.897 -12.538 -7.038 1.00 0.00 H new ATOM 0 HB2 CYS A 403 13.921 -11.378 -8.152 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.285 -11.116 -6.540 1.00 0.00 H new ATOM 1003 N GLN A 404 15.543 -13.667 -4.637 1.00 0.00 N ATOM 1004 CA GLN A 404 15.890 -14.081 -3.273 1.00 0.00 C ATOM 1005 C GLN A 404 16.331 -12.952 -2.314 1.00 0.00 C ATOM 1006 O GLN A 404 16.416 -13.196 -1.107 1.00 0.00 O ATOM 1007 CB GLN A 404 16.897 -15.249 -3.330 1.00 0.00 C ATOM 1008 CG GLN A 404 18.205 -14.985 -4.105 1.00 0.00 C ATOM 1009 CD GLN A 404 19.136 -13.965 -3.447 1.00 0.00 C ATOM 1010 OE1 GLN A 404 19.486 -14.055 -2.278 1.00 0.00 O ATOM 1011 NE2 GLN A 404 19.581 -12.956 -4.167 1.00 0.00 N ATOM 0 H GLN A 404 15.844 -14.382 -5.299 1.00 0.00 H new ATOM 0 HA GLN A 404 14.961 -14.420 -2.814 1.00 0.00 H new ATOM 0 HB2 GLN A 404 17.155 -15.529 -2.309 1.00 0.00 H new ATOM 0 HB3 GLN A 404 16.400 -16.108 -3.780 1.00 0.00 H new ATOM 0 HG2 GLN A 404 18.741 -15.927 -4.219 1.00 0.00 H new ATOM 0 HG3 GLN A 404 17.955 -14.637 -5.107 1.00 0.00 H new ATOM 0 HE21 GLN A 404 19.301 -12.863 -5.143 1.00 0.00 H new ATOM 0 HE22 GLN A 404 20.206 -12.267 -3.748 1.00 0.00 H new ATOM 1020 N VAL A 405 16.564 -11.727 -2.814 1.00 0.00 N ATOM 1021 CA VAL A 405 16.817 -10.530 -1.991 1.00 0.00 C ATOM 1022 C VAL A 405 15.648 -10.404 -1.010 1.00 0.00 C ATOM 1023 O VAL A 405 14.502 -10.300 -1.445 1.00 0.00 O ATOM 1024 CB VAL A 405 16.902 -9.256 -2.854 1.00 0.00 C ATOM 1025 CG1 VAL A 405 17.263 -8.040 -1.992 1.00 0.00 C ATOM 1026 CG2 VAL A 405 17.953 -9.375 -3.960 1.00 0.00 C ATOM 0 H VAL A 405 16.582 -11.537 -3.816 1.00 0.00 H new ATOM 0 HA VAL A 405 17.771 -10.635 -1.474 1.00 0.00 H new ATOM 0 HB VAL A 405 15.919 -9.129 -3.307 1.00 0.00 H new ATOM 0 HG11 VAL A 405 17.318 -7.151 -2.621 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.500 -7.897 -1.227 1.00 0.00 H new ATOM 0 HG13 VAL A 405 18.228 -8.206 -1.514 1.00 0.00 H new ATOM 0 HG21 VAL A 405 17.976 -8.453 -4.541 1.00 0.00 H new ATOM 0 HG22 VAL A 405 18.933 -9.547 -3.514 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.700 -10.210 -4.614 1.00 0.00 H new ATOM 1036 N ALA A 406 15.922 -10.465 0.296 1.00 0.00 N ATOM 1037 CA ALA A 406 14.927 -10.499 1.376 1.00 0.00 C ATOM 1038 C ALA A 406 13.637 -9.702 1.114 1.00 0.00 C ATOM 1039 O ALA A 406 12.541 -10.273 1.055 1.00 0.00 O ATOM 1040 CB ALA A 406 15.619 -10.045 2.666 1.00 0.00 C ATOM 0 H ALA A 406 16.880 -10.493 0.646 1.00 0.00 H new ATOM 0 HA ALA A 406 14.571 -11.526 1.454 1.00 0.00 H new ATOM 0 HB1 ALA A 406 14.903 -10.060 3.488 1.00 0.00 H new ATOM 0 HB2 ALA A 406 16.445 -10.719 2.892 1.00 0.00 H new ATOM 0 HB3 ALA A 406 16.002 -9.033 2.537 1.00 0.00 H new ATOM 1046 N HIS A 407 13.778 -8.386 0.937 1.00 0.00 N ATOM 1047 CA HIS A 407 12.654 -7.486 0.702 1.00 0.00 C ATOM 1048 C HIS A 407 11.887 -7.781 -0.595 1.00 0.00 C ATOM 1049 O HIS A 407 10.660 -7.827 -0.541 1.00 0.00 O ATOM 1050 CB HIS A 407 13.110 -6.021 0.786 1.00 0.00 C ATOM 1051 CG HIS A 407 14.226 -5.609 -0.148 1.00 0.00 C ATOM 1052 ND1 HIS A 407 15.537 -5.382 0.211 1.00 0.00 N ATOM 1053 CD2 HIS A 407 14.117 -5.292 -1.478 1.00 0.00 C ATOM 1054 CE1 HIS A 407 16.201 -4.944 -0.874 1.00 0.00 C ATOM 1055 NE2 HIS A 407 15.375 -4.877 -1.932 1.00 0.00 N ATOM 0 H HIS A 407 14.683 -7.915 0.953 1.00 0.00 H new ATOM 0 HA HIS A 407 11.934 -7.669 1.500 1.00 0.00 H new ATOM 0 HB2 HIS A 407 12.248 -5.383 0.590 1.00 0.00 H new ATOM 0 HB3 HIS A 407 13.429 -5.821 1.809 1.00 0.00 H new ATOM 0 HD2 HIS A 407 13.217 -5.352 -2.072 1.00 0.00 H new ATOM 0 HE1 HIS A 407 17.249 -4.683 -0.892 1.00 0.00 H new ATOM 0 HE2 HIS A 407 15.617 -4.582 -2.878 1.00 0.00 H new ATOM 1063 N CYS A 408 12.555 -8.010 -1.734 1.00 0.00 N ATOM 1064 CA CYS A 408 11.867 -8.267 -3.006 1.00 0.00 C ATOM 1065 C CYS A 408 11.194 -9.648 -3.032 1.00 0.00 C ATOM 1066 O CYS A 408 9.998 -9.725 -3.332 1.00 0.00 O ATOM 1067 CB CYS A 408 12.871 -8.107 -4.162 1.00 0.00 C ATOM 1068 SG CYS A 408 12.086 -8.432 -5.779 1.00 0.00 S ATOM 0 H CYS A 408 13.573 -8.022 -1.800 1.00 0.00 H new ATOM 0 HA CYS A 408 11.065 -7.538 -3.121 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.281 -7.097 -4.152 1.00 0.00 H new ATOM 0 HB3 CYS A 408 13.706 -8.792 -4.017 1.00 0.00 H new ATOM 1073 N ALA A 409 11.910 -10.716 -2.658 1.00 0.00 N ATOM 1074 CA ALA A 409 11.349 -12.067 -2.578 1.00 0.00 C ATOM 1075 C ALA A 409 10.107 -12.077 -1.670 1.00 0.00 C ATOM 1076 O ALA A 409 9.053 -12.590 -2.065 1.00 0.00 O ATOM 1077 CB ALA A 409 12.420 -13.057 -2.099 1.00 0.00 C ATOM 0 H ALA A 409 12.896 -10.666 -2.402 1.00 0.00 H new ATOM 0 HA ALA A 409 11.029 -12.384 -3.571 1.00 0.00 H new ATOM 0 HB1 ALA A 409 11.992 -14.058 -2.043 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.254 -13.058 -2.800 1.00 0.00 H new ATOM 0 HB3 ALA A 409 12.776 -12.759 -1.113 1.00 0.00 H new ATOM 1083 N SER A 410 10.200 -11.445 -0.488 1.00 0.00 N ATOM 1084 CA SER A 410 9.044 -11.311 0.404 1.00 0.00 C ATOM 1085 C SER A 410 7.927 -10.524 -0.285 1.00 0.00 C ATOM 1086 O SER A 410 6.814 -11.033 -0.388 1.00 0.00 O ATOM 1087 CB SER A 410 9.406 -10.632 1.731 1.00 0.00 C ATOM 1088 OG SER A 410 10.347 -11.407 2.455 1.00 0.00 O ATOM 0 H SER A 410 11.058 -11.023 -0.133 1.00 0.00 H new ATOM 0 HA SER A 410 8.701 -12.321 0.630 1.00 0.00 H new ATOM 0 HB2 SER A 410 9.817 -9.641 1.537 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.506 -10.492 2.330 1.00 0.00 H new ATOM 0 HG SER A 410 11.252 -11.196 2.145 1.00 0.00 H new ATOM 1094 N SER A 411 8.211 -9.320 -0.801 1.00 0.00 N ATOM 1095 CA SER A 411 7.232 -8.457 -1.480 1.00 0.00 C ATOM 1096 C SER A 411 6.425 -9.192 -2.546 1.00 0.00 C ATOM 1097 O SER A 411 5.196 -9.133 -2.550 1.00 0.00 O ATOM 1098 CB SER A 411 7.912 -7.210 -2.085 1.00 0.00 C ATOM 1099 OG SER A 411 8.459 -7.398 -3.374 1.00 0.00 O ATOM 0 H SER A 411 9.144 -8.910 -0.758 1.00 0.00 H new ATOM 0 HA SER A 411 6.527 -8.139 -0.712 1.00 0.00 H new ATOM 0 HB2 SER A 411 7.182 -6.402 -2.130 1.00 0.00 H new ATOM 0 HB3 SER A 411 8.706 -6.885 -1.413 1.00 0.00 H new ATOM 0 HG SER A 411 9.006 -8.211 -3.382 1.00 0.00 H new ATOM 1105 N ARG A 412 7.106 -9.933 -3.424 1.00 0.00 N ATOM 1106 CA ARG A 412 6.483 -10.708 -4.490 1.00 0.00 C ATOM 1107 C ARG A 412 5.646 -11.843 -3.926 1.00 0.00 C ATOM 1108 O ARG A 412 4.532 -12.026 -4.403 1.00 0.00 O ATOM 1109 CB ARG A 412 7.562 -11.196 -5.472 1.00 0.00 C ATOM 1110 CG ARG A 412 7.777 -10.165 -6.598 1.00 0.00 C ATOM 1111 CD ARG A 412 7.046 -10.549 -7.894 1.00 0.00 C ATOM 1112 NE ARG A 412 5.603 -10.824 -7.700 1.00 0.00 N ATOM 1113 CZ ARG A 412 4.579 -10.194 -8.247 1.00 0.00 C ATOM 1114 NH1 ARG A 412 4.715 -9.080 -8.910 1.00 0.00 N ATOM 1115 NH2 ARG A 412 3.382 -10.689 -8.142 1.00 0.00 N ATOM 0 H ARG A 412 8.123 -10.010 -3.410 1.00 0.00 H new ATOM 0 HA ARG A 412 5.793 -10.072 -5.044 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.498 -11.361 -4.939 1.00 0.00 H new ATOM 0 HB3 ARG A 412 7.266 -12.154 -5.900 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.428 -9.188 -6.263 1.00 0.00 H new ATOM 0 HG3 ARG A 412 8.844 -10.070 -6.801 1.00 0.00 H new ATOM 0 HD2 ARG A 412 7.160 -9.743 -8.618 1.00 0.00 H new ATOM 0 HD3 ARG A 412 7.522 -11.431 -8.322 1.00 0.00 H new ATOM 0 HE ARG A 412 5.373 -11.591 -7.069 1.00 0.00 H new ATOM 0 HH11 ARG A 412 5.639 -8.663 -9.022 1.00 0.00 H new ATOM 0 HH12 ARG A 412 3.897 -8.626 -9.317 1.00 0.00 H new ATOM 0 HH21 ARG A 412 3.234 -11.563 -7.638 1.00 0.00 H new ATOM 0 HH22 ARG A 412 2.590 -10.203 -8.564 1.00 0.00 H new ATOM 1129 N GLN A 413 6.119 -12.554 -2.898 1.00 0.00 N ATOM 1130 CA GLN A 413 5.328 -13.611 -2.251 1.00 0.00 C ATOM 1131 C GLN A 413 4.018 -13.066 -1.642 1.00 0.00 C ATOM 1132 O GLN A 413 2.949 -13.612 -1.928 1.00 0.00 O ATOM 1133 CB GLN A 413 6.173 -14.344 -1.196 1.00 0.00 C ATOM 1134 CG GLN A 413 7.196 -15.295 -1.840 1.00 0.00 C ATOM 1135 CD GLN A 413 8.190 -15.873 -0.831 1.00 0.00 C ATOM 1136 OE1 GLN A 413 7.894 -16.101 0.336 1.00 0.00 O ATOM 1137 NE2 GLN A 413 9.414 -16.142 -1.236 1.00 0.00 N ATOM 0 H GLN A 413 7.046 -12.418 -2.494 1.00 0.00 H new ATOM 0 HA GLN A 413 5.040 -14.327 -3.021 1.00 0.00 H new ATOM 0 HB2 GLN A 413 6.695 -13.614 -0.578 1.00 0.00 H new ATOM 0 HB3 GLN A 413 5.517 -14.910 -0.535 1.00 0.00 H new ATOM 0 HG2 GLN A 413 6.666 -16.112 -2.330 1.00 0.00 H new ATOM 0 HG3 GLN A 413 7.744 -14.760 -2.616 1.00 0.00 H new ATOM 0 HE21 GLN A 413 9.683 -15.960 -2.203 1.00 0.00 H new ATOM 0 HE22 GLN A 413 10.093 -16.532 -0.583 1.00 0.00 H new ATOM 1146 N ILE A 414 4.059 -11.972 -0.861 1.00 0.00 N ATOM 1147 CA ILE A 414 2.835 -11.380 -0.286 1.00 0.00 C ATOM 1148 C ILE A 414 1.867 -10.802 -1.315 1.00 0.00 C ATOM 1149 O ILE A 414 0.661 -11.033 -1.223 1.00 0.00 O ATOM 1150 CB ILE A 414 3.063 -10.369 0.869 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.350 -9.519 0.928 1.00 0.00 C ATOM 1152 CG2 ILE A 414 2.727 -11.071 2.201 1.00 0.00 C ATOM 1153 CD1 ILE A 414 5.397 -9.957 1.967 1.00 0.00 C ATOM 0 H ILE A 414 4.919 -11.482 -0.614 1.00 0.00 H new ATOM 0 HA ILE A 414 2.360 -12.255 0.158 1.00 0.00 H new ATOM 0 HB ILE A 414 2.376 -9.555 0.639 1.00 0.00 H new ATOM 0 HG12 ILE A 414 4.816 -9.532 -0.057 1.00 0.00 H new ATOM 0 HG13 ILE A 414 4.071 -8.486 1.135 1.00 0.00 H new ATOM 0 HG21 ILE A 414 2.881 -10.377 3.027 1.00 0.00 H new ATOM 0 HG22 ILE A 414 1.687 -11.396 2.189 1.00 0.00 H new ATOM 0 HG23 ILE A 414 3.376 -11.937 2.330 1.00 0.00 H new ATOM 0 HD11 ILE A 414 6.258 -9.290 1.920 1.00 0.00 H new ATOM 0 HD12 ILE A 414 4.959 -9.915 2.964 1.00 0.00 H new ATOM 0 HD13 ILE A 414 5.717 -10.977 1.754 1.00 0.00 H new ATOM 1165 N ILE A 415 2.366 -10.068 -2.304 1.00 0.00 N ATOM 1166 CA ILE A 415 1.506 -9.487 -3.345 1.00 0.00 C ATOM 1167 C ILE A 415 0.929 -10.567 -4.275 1.00 0.00 C ATOM 1168 O ILE A 415 -0.238 -10.477 -4.651 1.00 0.00 O ATOM 1169 CB ILE A 415 2.255 -8.335 -4.038 1.00 0.00 C ATOM 1170 CG1 ILE A 415 1.928 -7.013 -3.302 1.00 0.00 C ATOM 1171 CG2 ILE A 415 1.979 -8.263 -5.546 1.00 0.00 C ATOM 1172 CD1 ILE A 415 2.474 -5.750 -3.981 1.00 0.00 C ATOM 0 H ILE A 415 3.358 -9.858 -2.412 1.00 0.00 H new ATOM 0 HA ILE A 415 0.616 -9.041 -2.902 1.00 0.00 H new ATOM 0 HB ILE A 415 3.327 -8.521 -3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.846 -6.921 -3.211 1.00 0.00 H new ATOM 0 HG13 ILE A 415 2.329 -7.067 -2.290 1.00 0.00 H new ATOM 0 HG21 ILE A 415 2.535 -7.431 -5.978 1.00 0.00 H new ATOM 0 HG22 ILE A 415 2.293 -9.194 -6.018 1.00 0.00 H new ATOM 0 HG23 ILE A 415 0.913 -8.113 -5.714 1.00 0.00 H new ATOM 0 HD11 ILE A 415 2.197 -4.873 -3.396 1.00 0.00 H new ATOM 0 HD12 ILE A 415 3.560 -5.813 -4.047 1.00 0.00 H new ATOM 0 HD13 ILE A 415 2.054 -5.665 -4.983 1.00 0.00 H new ATOM 1184 N SER A 416 1.684 -11.618 -4.608 1.00 0.00 N ATOM 1185 CA SER A 416 1.182 -12.729 -5.426 1.00 0.00 C ATOM 1186 C SER A 416 0.110 -13.483 -4.633 1.00 0.00 C ATOM 1187 O SER A 416 -0.916 -13.845 -5.213 1.00 0.00 O ATOM 1188 CB SER A 416 2.294 -13.711 -5.815 1.00 0.00 C ATOM 1189 OG SER A 416 2.885 -13.312 -7.042 1.00 0.00 O ATOM 0 H SER A 416 2.657 -11.724 -4.320 1.00 0.00 H new ATOM 0 HA SER A 416 0.771 -12.309 -6.344 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.051 -13.746 -5.031 1.00 0.00 H new ATOM 0 HB3 SER A 416 1.886 -14.717 -5.908 1.00 0.00 H new ATOM 0 HG SER A 416 3.845 -13.167 -6.911 1.00 0.00 H new ATOM 1195 N HIS A 417 0.290 -13.666 -3.312 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.752 -14.239 -2.453 1.00 0.00 C ATOM 1197 C HIS A 417 -2.011 -13.360 -2.541 1.00 0.00 C ATOM 1198 O HIS A 417 -3.080 -13.857 -2.887 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.283 -14.378 -0.987 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.440 -14.670 -0.055 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -2.087 -15.880 0.069 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.249 -13.725 0.529 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.276 -15.665 0.658 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.428 -14.359 0.937 1.00 0.00 N ATOM 0 H HIS A 417 1.150 -13.424 -2.820 1.00 0.00 H new ATOM 0 HA HIS A 417 -0.977 -15.245 -2.806 1.00 0.00 H new ATOM 0 HB2 HIS A 417 0.454 -15.178 -0.915 1.00 0.00 H new ATOM 0 HB3 HIS A 417 0.213 -13.459 -0.675 1.00 0.00 H new ATOM 0 HD1 HIS A 417 -1.726 -16.784 -0.234 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -2.016 -12.678 0.652 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -4.005 -16.432 0.876 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.881 -12.052 -2.281 1.00 0.00 N ATOM 1213 CA TRP A 418 -2.987 -11.089 -2.334 1.00 0.00 C ATOM 1214 C TRP A 418 -3.739 -11.116 -3.676 1.00 0.00 C ATOM 1215 O TRP A 418 -4.969 -11.010 -3.697 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.446 -9.690 -2.011 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.487 -8.631 -1.816 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -4.235 -8.462 -0.702 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -3.920 -7.594 -2.751 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -5.092 -7.391 -0.876 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -4.939 -6.816 -2.120 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -3.558 -7.230 -4.068 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -5.559 -5.730 -2.756 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -4.176 -6.143 -4.717 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -5.173 -5.393 -4.065 1.00 0.00 C ATOM 0 H TRP A 418 -0.990 -11.628 -2.024 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.726 -11.374 -1.585 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -1.841 -9.752 -1.107 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -1.782 -9.380 -2.818 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -4.172 -9.071 0.188 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -5.755 -7.067 -0.172 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -2.796 -7.794 -4.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -6.322 -5.161 -2.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -3.882 -5.883 -5.723 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -5.640 -4.560 -4.569 1.00 0.00 H new ATOM 1236 N LYS A 419 -3.022 -11.302 -4.797 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.622 -11.414 -6.140 1.00 0.00 C ATOM 1238 C LYS A 419 -4.393 -12.725 -6.355 1.00 0.00 C ATOM 1239 O LYS A 419 -5.496 -12.704 -6.904 1.00 0.00 O ATOM 1240 CB LYS A 419 -2.517 -11.290 -7.202 1.00 0.00 C ATOM 1241 CG LYS A 419 -2.046 -9.839 -7.367 1.00 0.00 C ATOM 1242 CD LYS A 419 -0.766 -9.779 -8.214 1.00 0.00 C ATOM 1243 CE LYS A 419 -0.260 -8.342 -8.376 1.00 0.00 C ATOM 1244 NZ LYS A 419 -1.173 -7.498 -9.195 1.00 0.00 N ATOM 0 H LYS A 419 -2.005 -11.379 -4.798 1.00 0.00 H new ATOM 0 HA LYS A 419 -4.346 -10.605 -6.233 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.671 -11.917 -6.921 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.887 -11.663 -8.157 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -2.830 -9.248 -7.841 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -1.862 -9.397 -6.388 1.00 0.00 H new ATOM 0 HD2 LYS A 419 0.009 -10.387 -7.746 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -0.959 -10.210 -9.197 1.00 0.00 H new ATOM 0 HE2 LYS A 419 -0.141 -7.890 -7.391 1.00 0.00 H new ATOM 0 HE3 LYS A 419 0.726 -8.359 -8.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 -0.758 -6.552 -9.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -1.308 -7.937 -10.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -2.092 -7.414 -8.715 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.812 -13.862 -5.964 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.390 -15.200 -6.160 1.00 0.00 C ATOM 1260 C ASN A 420 -5.475 -15.622 -5.146 1.00 0.00 C ATOM 1261 O ASN A 420 -6.324 -16.451 -5.481 1.00 0.00 O ATOM 1262 CB ASN A 420 -3.247 -16.232 -6.188 1.00 0.00 C ATOM 1263 CG ASN A 420 -2.461 -16.186 -7.489 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -2.798 -16.837 -8.468 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -1.403 -15.412 -7.553 1.00 0.00 N ATOM 0 H ASN A 420 -2.908 -13.882 -5.492 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.922 -15.159 -7.110 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.573 -16.047 -5.352 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.659 -17.232 -6.050 1.00 0.00 H new ATOM 0 HD21 ASN A 420 -0.865 -15.355 -8.417 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -1.119 -14.868 -6.738 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.430 -15.115 -3.911 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.321 -15.495 -2.816 1.00 0.00 C ATOM 1274 C CYS A 421 -7.821 -15.235 -3.071 1.00 0.00 C ATOM 1275 O CYS A 421 -8.229 -14.178 -3.563 1.00 0.00 O ATOM 1276 CB CYS A 421 -5.838 -14.790 -1.542 1.00 0.00 C ATOM 1277 SG CYS A 421 -6.637 -15.486 -0.067 1.00 0.00 S ATOM 0 H CYS A 421 -4.749 -14.406 -3.639 1.00 0.00 H new ATOM 0 HA CYS A 421 -6.263 -16.579 -2.714 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -4.756 -14.890 -1.455 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -6.055 -13.724 -1.608 1.00 0.00 H new ATOM 1282 N THR A 422 -8.634 -16.223 -2.691 1.00 0.00 N ATOM 1283 CA THR A 422 -10.107 -16.250 -2.777 1.00 0.00 C ATOM 1284 C THR A 422 -10.772 -16.588 -1.431 1.00 0.00 C ATOM 1285 O THR A 422 -12.002 -16.661 -1.345 1.00 0.00 O ATOM 1286 CB THR A 422 -10.558 -17.282 -3.829 1.00 0.00 C ATOM 1287 OG1 THR A 422 -10.130 -18.579 -3.453 1.00 0.00 O ATOM 1288 CG2 THR A 422 -9.964 -16.994 -5.206 1.00 0.00 C ATOM 0 H THR A 422 -8.263 -17.084 -2.288 1.00 0.00 H new ATOM 0 HA THR A 422 -10.422 -15.247 -3.065 1.00 0.00 H new ATOM 0 HB THR A 422 -11.645 -17.219 -3.880 1.00 0.00 H new ATOM 0 HG1 THR A 422 -10.423 -19.228 -4.126 1.00 0.00 H new ATOM 0 HG21 THR A 422 -10.309 -17.746 -5.916 1.00 0.00 H new ATOM 0 HG22 THR A 422 -10.283 -16.007 -5.540 1.00 0.00 H new ATOM 0 HG23 THR A 422 -8.876 -17.023 -5.146 1.00 0.00 H new ATOM 1296 N ARG A 423 -9.977 -16.801 -0.370 1.00 0.00 N ATOM 1297 CA ARG A 423 -10.427 -17.173 0.981 1.00 0.00 C ATOM 1298 C ARG A 423 -11.327 -16.108 1.630 1.00 0.00 C ATOM 1299 O ARG A 423 -10.979 -14.931 1.710 1.00 0.00 O ATOM 1300 CB ARG A 423 -9.185 -17.509 1.832 1.00 0.00 C ATOM 1301 CG ARG A 423 -9.539 -17.851 3.284 1.00 0.00 C ATOM 1302 CD ARG A 423 -8.355 -18.384 4.099 1.00 0.00 C ATOM 1303 NE ARG A 423 -8.117 -19.820 3.858 1.00 0.00 N ATOM 1304 CZ ARG A 423 -8.743 -20.831 4.438 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -9.736 -20.668 5.268 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -8.376 -22.056 4.185 1.00 0.00 N ATOM 0 H ARG A 423 -8.963 -16.715 -0.433 1.00 0.00 H new ATOM 0 HA ARG A 423 -11.064 -18.055 0.913 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -8.658 -18.351 1.383 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -8.500 -16.661 1.819 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -9.932 -16.959 3.772 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -10.336 -18.595 3.289 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -7.457 -17.820 3.845 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -8.543 -18.221 5.160 1.00 0.00 H new ATOM 0 HE ARG A 423 -7.397 -20.057 3.175 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -10.062 -19.729 5.495 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -10.187 -21.480 5.690 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -7.606 -22.235 3.540 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -8.858 -22.836 4.632 1.00 0.00 H new ATOM 1320 N HIS A 424 -12.480 -16.559 2.126 1.00 0.00 N ATOM 1321 CA HIS A 424 -13.513 -15.785 2.819 1.00 0.00 C ATOM 1322 C HIS A 424 -13.125 -15.274 4.227 1.00 0.00 C ATOM 1323 O HIS A 424 -13.888 -14.527 4.841 1.00 0.00 O ATOM 1324 CB HIS A 424 -14.814 -16.607 2.863 1.00 0.00 C ATOM 1325 CG HIS A 424 -14.790 -17.773 3.824 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -14.426 -19.072 3.539 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -15.155 -17.739 5.143 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -14.554 -19.799 4.664 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -15.002 -19.028 5.672 1.00 0.00 N ATOM 0 H HIS A 424 -12.735 -17.544 2.049 1.00 0.00 H new ATOM 0 HA HIS A 424 -13.651 -14.873 2.239 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -15.637 -15.946 3.135 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -15.025 -16.983 1.862 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -15.501 -16.870 5.682 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -14.329 -20.852 4.746 1.00 0.00 H new ATOM 0 HE2 HIS A 424 -15.192 -19.323 6.630 1.00 0.00 H new ATOM 1337 N ASP A 425 -11.995 -15.729 4.777 1.00 0.00 N ATOM 1338 CA ASP A 425 -11.509 -15.462 6.136 1.00 0.00 C ATOM 1339 C ASP A 425 -9.971 -15.431 6.240 1.00 0.00 C ATOM 1340 O ASP A 425 -9.396 -16.030 7.155 1.00 0.00 O ATOM 1341 CB ASP A 425 -12.157 -16.476 7.103 1.00 0.00 C ATOM 1342 CG ASP A 425 -11.639 -17.930 6.995 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -11.173 -18.364 5.913 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -11.707 -18.660 8.015 1.00 0.00 O ATOM 0 H ASP A 425 -11.357 -16.329 4.255 1.00 0.00 H new ATOM 0 HA ASP A 425 -11.812 -14.455 6.421 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -12.000 -16.128 8.124 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -13.233 -16.479 6.930 1.00 0.00 H new ATOM 1349 N CYS A 426 -9.272 -14.750 5.313 1.00 0.00 N ATOM 1350 CA CYS A 426 -7.807 -14.766 5.341 1.00 0.00 C ATOM 1351 C CYS A 426 -7.274 -13.770 6.405 1.00 0.00 C ATOM 1352 O CYS A 426 -7.872 -12.701 6.575 1.00 0.00 O ATOM 1353 CB CYS A 426 -7.313 -14.478 3.929 1.00 0.00 C ATOM 1354 SG CYS A 426 -5.715 -15.294 3.615 1.00 0.00 S ATOM 0 H CYS A 426 -9.686 -14.200 4.560 1.00 0.00 H new ATOM 0 HA CYS A 426 -7.423 -15.740 5.642 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -8.050 -14.824 3.205 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -7.209 -13.402 3.789 1.00 0.00 H new ATOM 1359 N PRO A 427 -6.167 -14.073 7.115 1.00 0.00 N ATOM 1360 CA PRO A 427 -5.566 -13.233 8.162 1.00 0.00 C ATOM 1361 C PRO A 427 -5.138 -11.816 7.748 1.00 0.00 C ATOM 1362 O PRO A 427 -4.725 -11.042 8.614 1.00 0.00 O ATOM 1363 CB PRO A 427 -4.336 -14.001 8.667 1.00 0.00 C ATOM 1364 CG PRO A 427 -4.596 -15.442 8.253 1.00 0.00 C ATOM 1365 CD PRO A 427 -5.386 -15.285 6.964 1.00 0.00 C ATOM 0 HA PRO A 427 -6.338 -13.061 8.912 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -3.418 -13.619 8.221 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -4.227 -13.911 9.748 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -3.668 -15.991 8.094 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -5.162 -15.985 9.010 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -4.719 -15.214 6.105 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -6.032 -16.146 6.796 1.00 0.00 H new ATOM 1373 N VAL A 428 -5.182 -11.480 6.452 1.00 0.00 N ATOM 1374 CA VAL A 428 -4.752 -10.183 5.900 1.00 0.00 C ATOM 1375 C VAL A 428 -5.764 -9.606 4.892 1.00 0.00 C ATOM 1376 O VAL A 428 -6.115 -8.424 4.985 1.00 0.00 O ATOM 1377 CB VAL A 428 -3.357 -10.324 5.272 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -2.835 -8.917 4.952 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -2.358 -11.028 6.197 1.00 0.00 C ATOM 0 H VAL A 428 -5.527 -12.119 5.736 1.00 0.00 H new ATOM 0 HA VAL A 428 -4.703 -9.469 6.723 1.00 0.00 H new ATOM 0 HB VAL A 428 -3.451 -10.937 4.375 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -1.844 -8.990 4.504 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.514 -8.427 4.254 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -2.776 -8.333 5.871 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -1.390 -11.099 5.701 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -2.252 -10.457 7.119 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -2.721 -12.029 6.430 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.308 -10.450 4.005 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.406 -10.121 3.098 1.00 0.00 C ATOM 1391 C CYS A 429 -8.631 -9.530 3.789 1.00 0.00 C ATOM 1392 O CYS A 429 -8.983 -8.386 3.508 1.00 0.00 O ATOM 1393 CB CYS A 429 -7.734 -11.293 2.148 1.00 0.00 C ATOM 1394 SG CYS A 429 -6.239 -12.276 1.789 1.00 0.00 S ATOM 0 H CYS A 429 -5.982 -11.411 3.899 1.00 0.00 H new ATOM 0 HA CYS A 429 -7.045 -9.305 2.472 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.494 -11.931 2.599 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.153 -10.907 1.218 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.274 -10.270 4.694 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.443 -9.794 5.415 1.00 0.00 C ATOM 1401 C LEU A 430 -10.186 -8.492 6.197 1.00 0.00 C ATOM 1402 O LEU A 430 -10.951 -7.547 5.987 1.00 0.00 O ATOM 1403 CB LEU A 430 -11.026 -10.969 6.198 1.00 0.00 C ATOM 1404 CG LEU A 430 -12.066 -11.742 5.377 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -13.401 -11.008 5.267 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -11.616 -12.169 3.976 1.00 0.00 C ATOM 0 H LEU A 430 -8.993 -11.218 4.944 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.219 -9.463 4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -10.222 -11.643 6.493 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -11.487 -10.602 7.115 1.00 0.00 H new ATOM 0 HG LEU A 430 -12.192 -12.654 5.960 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -14.096 -11.604 4.675 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -13.814 -10.853 6.264 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -13.247 -10.043 4.784 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -12.425 -12.707 3.482 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -11.358 -11.286 3.392 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -10.744 -12.818 4.056 1.00 0.00 H new ATOM 1418 N PRO A 431 -9.113 -8.363 7.007 1.00 0.00 N ATOM 1419 CA PRO A 431 -8.720 -7.087 7.602 1.00 0.00 C ATOM 1420 C PRO A 431 -8.705 -5.920 6.609 1.00 0.00 C ATOM 1421 O PRO A 431 -9.404 -4.937 6.836 1.00 0.00 O ATOM 1422 CB PRO A 431 -7.311 -7.313 8.138 1.00 0.00 C ATOM 1423 CG PRO A 431 -7.358 -8.772 8.558 1.00 0.00 C ATOM 1424 CD PRO A 431 -8.164 -9.392 7.417 1.00 0.00 C ATOM 0 HA PRO A 431 -9.443 -6.805 8.367 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -6.552 -7.133 7.377 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -7.084 -6.655 8.977 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -6.362 -9.207 8.640 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -7.845 -8.905 9.524 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -7.515 -9.680 6.590 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -8.680 -10.294 7.746 1.00 0.00 H new ATOM 1432 N LEU A 432 -7.955 -6.016 5.501 1.00 0.00 N ATOM 1433 CA LEU A 432 -7.899 -4.953 4.479 1.00 0.00 C ATOM 1434 C LEU A 432 -9.238 -4.698 3.792 1.00 0.00 C ATOM 1435 O LEU A 432 -9.547 -3.561 3.433 1.00 0.00 O ATOM 1436 CB LEU A 432 -6.870 -5.309 3.400 1.00 0.00 C ATOM 1437 CG LEU A 432 -5.490 -4.759 3.783 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -4.411 -5.614 3.125 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -5.333 -3.308 3.315 1.00 0.00 C ATOM 0 H LEU A 432 -7.373 -6.826 5.286 1.00 0.00 H new ATOM 0 HA LEU A 432 -7.617 -4.045 5.012 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -6.818 -6.391 3.280 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -7.181 -4.896 2.440 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.391 -4.790 4.868 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -3.427 -5.228 3.393 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.503 -6.644 3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -4.531 -5.581 2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -4.347 -2.939 3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -5.441 -3.262 2.231 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.099 -2.690 3.783 1.00 0.00 H new ATOM 1451 N LYS A 433 -10.027 -5.754 3.601 1.00 0.00 N ATOM 1452 CA LYS A 433 -11.330 -5.667 2.929 1.00 0.00 C ATOM 1453 C LYS A 433 -12.286 -4.827 3.793 1.00 0.00 C ATOM 1454 O LYS A 433 -13.022 -3.988 3.274 1.00 0.00 O ATOM 1455 CB LYS A 433 -11.836 -7.098 2.685 1.00 0.00 C ATOM 1456 CG LYS A 433 -11.331 -7.589 1.319 1.00 0.00 C ATOM 1457 CD LYS A 433 -11.626 -9.080 1.098 1.00 0.00 C ATOM 1458 CE LYS A 433 -11.257 -9.483 -0.335 1.00 0.00 C ATOM 1459 NZ LYS A 433 -11.521 -10.925 -0.587 1.00 0.00 N ATOM 0 H LYS A 433 -9.784 -6.696 3.907 1.00 0.00 H new ATOM 0 HA LYS A 433 -11.259 -5.168 1.962 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -11.483 -7.760 3.476 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -12.925 -7.121 2.712 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -11.801 -7.005 0.528 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -10.257 -7.417 1.247 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -11.060 -9.680 1.810 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -12.682 -9.281 1.280 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -11.828 -8.880 -1.041 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -10.203 -9.270 -0.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -11.259 -11.160 -1.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -10.957 -11.501 0.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -12.531 -11.123 -0.442 1.00 0.00 H new ATOM 1473 N ASN A 434 -12.229 -5.015 5.117 1.00 0.00 N ATOM 1474 CA ASN A 434 -12.963 -4.243 6.124 1.00 0.00 C ATOM 1475 C ASN A 434 -12.316 -2.874 6.463 1.00 0.00 C ATOM 1476 O ASN A 434 -13.018 -1.967 6.909 1.00 0.00 O ATOM 1477 CB ASN A 434 -13.088 -5.129 7.377 1.00 0.00 C ATOM 1478 CG ASN A 434 -13.930 -4.489 8.471 1.00 0.00 C ATOM 1479 OD1 ASN A 434 -13.425 -3.968 9.456 1.00 0.00 O ATOM 1480 ND2 ASN A 434 -15.239 -4.516 8.343 1.00 0.00 N ATOM 0 H ASN A 434 -11.645 -5.741 5.532 1.00 0.00 H new ATOM 0 HA ASN A 434 -13.942 -3.986 5.720 1.00 0.00 H new ATOM 0 HB2 ASN A 434 -13.530 -6.085 7.097 1.00 0.00 H new ATOM 0 HB3 ASN A 434 -12.093 -5.340 7.768 1.00 0.00 H new ATOM 0 HD21 ASN A 434 -15.831 -4.103 9.064 1.00 0.00 H new ATOM 0 HD22 ASN A 434 -15.662 -4.950 7.523 1.00 0.00 H new ATOM 1487 N ALA A 435 -10.996 -2.719 6.291 1.00 0.00 N ATOM 1488 CA ALA A 435 -10.193 -1.541 6.665 1.00 0.00 C ATOM 1489 C ALA A 435 -10.743 -0.165 6.219 1.00 0.00 C ATOM 1490 O ALA A 435 -10.480 0.835 6.892 1.00 0.00 O ATOM 1491 CB ALA A 435 -8.732 -1.746 6.206 1.00 0.00 C ATOM 0 H ALA A 435 -10.427 -3.450 5.864 1.00 0.00 H new ATOM 0 HA ALA A 435 -10.252 -1.486 7.752 1.00 0.00 H new ATOM 0 HB1 ALA A 435 -8.138 -0.875 6.483 1.00 0.00 H new ATOM 0 HB2 ALA A 435 -8.321 -2.633 6.687 1.00 0.00 H new ATOM 0 HB3 ALA A 435 -8.705 -1.875 5.124 1.00 0.00 H new ATOM 1497 N SER A 436 -11.514 -0.093 5.128 1.00 0.00 N ATOM 1498 CA SER A 436 -12.115 1.150 4.608 1.00 0.00 C ATOM 1499 C SER A 436 -13.568 1.395 5.031 1.00 0.00 C ATOM 1500 O SER A 436 -14.110 2.468 4.752 1.00 0.00 O ATOM 1501 CB SER A 436 -11.975 1.197 3.082 1.00 0.00 C ATOM 1502 OG SER A 436 -12.640 0.091 2.485 1.00 0.00 O ATOM 0 H SER A 436 -11.745 -0.913 4.567 1.00 0.00 H new ATOM 0 HA SER A 436 -11.554 1.964 5.066 1.00 0.00 H new ATOM 0 HB2 SER A 436 -12.393 2.129 2.701 1.00 0.00 H new ATOM 0 HB3 SER A 436 -10.920 1.186 2.807 1.00 0.00 H new ATOM 0 HG SER A 436 -12.542 0.137 1.511 1.00 0.00 H new ATOM 1508 N ASP A 437 -14.189 0.472 5.773 1.00 0.00 N ATOM 1509 CA ASP A 437 -15.509 0.698 6.384 1.00 0.00 C ATOM 1510 C ASP A 437 -15.418 1.835 7.426 1.00 0.00 C ATOM 1511 O ASP A 437 -16.379 2.571 7.661 1.00 0.00 O ATOM 1512 CB ASP A 437 -15.975 -0.596 7.059 1.00 0.00 C ATOM 1513 CG ASP A 437 -17.416 -0.486 7.585 1.00 0.00 C ATOM 1514 OD1 ASP A 437 -18.360 -0.448 6.759 1.00 0.00 O ATOM 1515 OD2 ASP A 437 -17.614 -0.461 8.823 1.00 0.00 O ATOM 0 H ASP A 437 -13.796 -0.449 5.968 1.00 0.00 H new ATOM 0 HA ASP A 437 -16.225 0.986 5.615 1.00 0.00 H new ATOM 0 HB2 ASP A 437 -15.911 -1.419 6.347 1.00 0.00 H new ATOM 0 HB3 ASP A 437 -15.305 -0.835 7.885 1.00 0.00 H new ATOM 1520 N LYS A 438 -14.223 1.982 8.023 1.00 0.00 N ATOM 1521 CA LYS A 438 -13.839 3.008 8.996 1.00 0.00 C ATOM 1522 C LYS A 438 -13.794 4.418 8.378 1.00 0.00 C ATOM 1523 O LYS A 438 -12.780 4.824 7.800 1.00 0.00 O ATOM 1524 CB LYS A 438 -12.523 2.598 9.685 1.00 0.00 C ATOM 1525 CG LYS A 438 -12.195 3.513 10.880 1.00 0.00 C ATOM 1526 CD LYS A 438 -10.921 3.096 11.631 1.00 0.00 C ATOM 1527 CE LYS A 438 -11.094 1.766 12.379 1.00 0.00 C ATOM 1528 NZ LYS A 438 -9.877 1.419 13.161 1.00 0.00 N ATOM 0 H LYS A 438 -13.453 1.344 7.823 1.00 0.00 H new ATOM 0 HA LYS A 438 -14.610 3.071 9.764 1.00 0.00 H new ATOM 0 HB2 LYS A 438 -12.598 1.566 10.027 1.00 0.00 H new ATOM 0 HB3 LYS A 438 -11.707 2.636 8.963 1.00 0.00 H new ATOM 0 HG2 LYS A 438 -12.080 4.537 10.524 1.00 0.00 H new ATOM 0 HG3 LYS A 438 -13.036 3.509 11.574 1.00 0.00 H new ATOM 0 HD2 LYS A 438 -10.097 3.007 10.923 1.00 0.00 H new ATOM 0 HD3 LYS A 438 -10.649 3.877 12.341 1.00 0.00 H new ATOM 0 HE2 LYS A 438 -11.951 1.833 13.049 1.00 0.00 H new ATOM 0 HE3 LYS A 438 -11.308 0.971 11.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 -10.027 0.516 13.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 -9.064 1.332 12.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 -9.688 2.167 13.859 1.00 0.00 H new ATOM 1542 N ARG A 439 -14.907 5.150 8.502 1.00 0.00 N ATOM 1543 CA ARG A 439 -15.100 6.536 8.028 1.00 0.00 C ATOM 1544 C ARG A 439 -14.163 7.534 8.725 1.00 0.00 C ATOM 1545 O ARG A 439 -13.619 8.420 8.027 1.00 0.00 O ATOM 1546 CB ARG A 439 -16.573 6.945 8.214 1.00 0.00 C ATOM 1547 CG ARG A 439 -17.505 6.211 7.234 1.00 0.00 C ATOM 1548 CD ARG A 439 -18.988 6.548 7.460 1.00 0.00 C ATOM 1549 NE ARG A 439 -19.485 6.097 8.775 1.00 0.00 N ATOM 1550 CZ ARG A 439 -19.826 4.871 9.129 1.00 0.00 C ATOM 1551 NH1 ARG A 439 -19.738 3.856 8.318 1.00 0.00 N ATOM 1552 NH2 ARG A 439 -20.270 4.636 10.329 1.00 0.00 N ATOM 1553 OXT ARG A 439 -13.992 7.444 9.964 1.00 0.00 O ATOM 0 H ARG A 439 -15.741 4.779 8.957 1.00 0.00 H new ATOM 0 HA ARG A 439 -14.845 6.563 6.969 1.00 0.00 H new ATOM 0 HB2 ARG A 439 -16.882 6.731 9.237 1.00 0.00 H new ATOM 0 HB3 ARG A 439 -16.671 8.021 8.070 1.00 0.00 H new ATOM 0 HG2 ARG A 439 -17.229 6.472 6.212 1.00 0.00 H new ATOM 0 HG3 ARG A 439 -17.361 5.136 7.338 1.00 0.00 H new ATOM 0 HD2 ARG A 439 -19.128 7.626 7.374 1.00 0.00 H new ATOM 0 HD3 ARG A 439 -19.585 6.086 6.674 1.00 0.00 H new ATOM 0 HE ARG A 439 -19.576 6.815 9.493 1.00 0.00 H new ATOM 0 HH11 ARG A 439 -19.395 3.991 7.367 1.00 0.00 H new ATOM 0 HH12 ARG A 439 -20.012 2.926 8.634 1.00 0.00 H new ATOM 0 HH21 ARG A 439 -20.356 5.400 11.000 1.00 0.00 H new ATOM 0 HH22 ARG A 439 -20.532 3.688 10.599 1.00 0.00 H new TER 1567 ARG A 439 HETATM 1568 ZN ZN A 440 2.654 7.067 1.351 1.00 0.00 ZN HETATM 1569 ZN ZN A 441 13.742 -8.283 -7.363 1.00 0.00 ZN HETATM 1570 ZN ZN A 442 -5.424 -14.390 1.542 1.00 0.00 ZN