USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 581 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 426 ASN : amide:sc= -0.59 K(o=-2.2,f=-3.6!) USER MOD Set 1.2: A 427 THR OG1 : rot 13:sc= 0.632 USER MOD Set 1.3: A 428 ASN : amide:sc= -2.2 K(o=-2.2,f=-3.6!) USER MOD Set 2.1: A 396 HIS : no HD1:sc= 0.174 K(o=0.44,f=-3.5) USER MOD Set 2.2: A 405 THR OG1 : rot 27:sc= 0.264 USER MOD Set 3.1: A 377 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 380 SER OG : rot -39:sc= -1.12! USER MOD Set 4.1: A 373 GLN : amide:sc= -0.71! K(o=-0.19!,f=1) USER MOD Set 4.2: A 391 SER OG : rot 180:sc= 0.521 USER MOD Single : A 355 SER OG : rot -137:sc= 0.274 USER MOD Single : A 356 HIS : no HE2:sc= -0.75 K(o=-0.75,f=-5.1!) USER MOD Single : A 357 MET CE :methyl 159:sc= -0.182 (180deg=-0.767) USER MOD Single : A 362 THR OG1 : rot 27:sc= 0.278 USER MOD Single : A 363 GLN : amide:sc= -1.1 K(o=-1.1,f=0) USER MOD Single : A 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 365 HIS : no HD1:sc= -2.5! C(o=-2.5!,f=-5.9!) USER MOD Single : A 366 LYS NZ :NH3+ -151:sc= 1.89 (180deg=0.693) USER MOD Single : A 370 SER OG : rot 24:sc= 0.199 USER MOD Single : A 371 GLN : amide:sc= -2.85! C(o=-2.9!,f=-2.2!) USER MOD Single : A 372 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 382 ASN : amide:sc= -5.18! K(o=-5.2!,f=-1.6) USER MOD Single : A 383 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 384 LYS NZ :NH3+ -116:sc= -0.523 (180deg=-3.48!) USER MOD Single : A 386 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 387 ASN : amide:sc=-0.00294 X(o=-0.0029,f=0) USER MOD Single : A 390 LYS NZ :NH3+ 165:sc= -0.0525 (180deg=-0.299) USER MOD Single : A 394 LYS NZ :NH3+ -166:sc= -0.0237 (180deg=-0.183) USER MOD Single : A 397 ASN : amide:sc= -1.41 K(o=-1.4,f=0.35) USER MOD Single : A 401 ASN : amide:sc= -4.52! K(o=-4.5!,f=-0.7) USER MOD Single : A 402 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.0528) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 412 LYS NZ :NH3+ 169:sc= -0.017 (180deg=-0.199) USER MOD Single : A 413 LYS NZ :NH3+ 165:sc= -0.0448 (180deg=-0.301) USER MOD Single : A 418 THR OG1 : rot 66:sc= 0.12 USER MOD Single : A 420 LYS NZ :NH3+ -146:sc= 0.00312 (180deg=0) USER MOD Single : A 423 LYS NZ :NH3+ -164:sc= -0.0471 (180deg=-0.267) USER MOD Single : A 424 THR OG1 : rot 180:sc= 0 USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 THR OG1 : rot 11:sc= 0.711 USER MOD Single : A 432 SER OG : rot -80:sc= 1.17 USER MOD Single : A 433 SER OG : rot -12:sc= 0.74 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 6.865 -24.064 5.731 1.00 0.00 N ATOM 2 CA GLY A 354 6.473 -22.722 5.219 1.00 0.00 C ATOM 3 C GLY A 354 7.649 -21.948 4.658 1.00 0.00 C ATOM 4 O GLY A 354 8.474 -22.502 3.930 1.00 0.00 O ATOM 0 HA2 GLY A 354 5.716 -22.840 4.443 1.00 0.00 H new ATOM 0 HA3 GLY A 354 6.016 -22.148 6.025 1.00 0.00 H new ATOM 10 N SER A 355 7.726 -20.664 4.998 1.00 0.00 N ATOM 11 CA SER A 355 8.808 -19.807 4.525 1.00 0.00 C ATOM 12 C SER A 355 8.758 -18.446 5.222 1.00 0.00 C ATOM 13 O SER A 355 8.607 -18.377 6.443 1.00 0.00 O ATOM 14 CB SER A 355 8.721 -19.641 3.005 1.00 0.00 C ATOM 15 OG SER A 355 9.834 -18.923 2.501 1.00 0.00 O ATOM 0 H SER A 355 7.050 -20.194 5.600 1.00 0.00 H new ATOM 0 HA SER A 355 9.760 -20.278 4.769 1.00 0.00 H new ATOM 0 HB2 SER A 355 8.674 -20.622 2.532 1.00 0.00 H new ATOM 0 HB3 SER A 355 7.800 -19.118 2.746 1.00 0.00 H new ATOM 0 HG SER A 355 9.529 -18.273 1.834 1.00 0.00 H new ATOM 21 N HIS A 356 8.885 -17.366 4.453 1.00 0.00 N ATOM 22 CA HIS A 356 8.853 -16.021 5.015 1.00 0.00 C ATOM 23 C HIS A 356 7.504 -15.747 5.673 1.00 0.00 C ATOM 24 O HIS A 356 6.452 -15.992 5.081 1.00 0.00 O ATOM 25 CB HIS A 356 9.127 -14.987 3.920 1.00 0.00 C ATOM 26 CG HIS A 356 9.261 -13.586 4.430 1.00 0.00 C ATOM 27 ND1 HIS A 356 8.241 -12.916 5.069 1.00 0.00 N ATOM 28 CD2 HIS A 356 10.308 -12.728 4.395 1.00 0.00 C ATOM 29 CE1 HIS A 356 8.653 -11.706 5.405 1.00 0.00 C ATOM 30 NE2 HIS A 356 9.904 -11.568 5.008 1.00 0.00 N ATOM 0 H HIS A 356 9.011 -17.398 3.441 1.00 0.00 H new ATOM 0 HA HIS A 356 9.630 -15.944 5.776 1.00 0.00 H new ATOM 0 HB2 HIS A 356 10.042 -15.261 3.395 1.00 0.00 H new ATOM 0 HB3 HIS A 356 8.318 -15.022 3.190 1.00 0.00 H new ATOM 0 HD1 HIS A 356 7.312 -13.295 5.254 1.00 0.00 H new ATOM 0 HD2 HIS A 356 11.280 -12.920 3.965 1.00 0.00 H new ATOM 0 HE1 HIS A 356 8.066 -10.958 5.917 1.00 0.00 H new ATOM 39 N MET A 357 7.541 -15.247 6.904 1.00 0.00 N ATOM 40 CA MET A 357 6.319 -14.950 7.645 1.00 0.00 C ATOM 41 C MET A 357 5.501 -13.872 6.942 1.00 0.00 C ATOM 42 O MET A 357 6.025 -12.814 6.593 1.00 0.00 O ATOM 43 CB MET A 357 6.659 -14.503 9.069 1.00 0.00 C ATOM 44 CG MET A 357 7.431 -15.545 9.863 1.00 0.00 C ATOM 45 SD MET A 357 7.831 -14.993 11.532 1.00 0.00 S ATOM 46 CE MET A 357 6.193 -14.719 12.204 1.00 0.00 C ATOM 0 H MET A 357 8.402 -15.039 7.409 1.00 0.00 H new ATOM 0 HA MET A 357 5.721 -15.860 7.689 1.00 0.00 H new ATOM 0 HB2 MET A 357 7.245 -13.585 9.023 1.00 0.00 H new ATOM 0 HB3 MET A 357 5.736 -14.266 9.597 1.00 0.00 H new ATOM 0 HG2 MET A 357 6.844 -16.462 9.919 1.00 0.00 H new ATOM 0 HG3 MET A 357 8.353 -15.789 9.335 1.00 0.00 H new ATOM 0 HE1 MET A 357 6.238 -14.741 13.293 1.00 0.00 H new ATOM 0 HE2 MET A 357 5.823 -13.748 11.876 1.00 0.00 H new ATOM 0 HE3 MET A 357 5.520 -15.501 11.853 1.00 0.00 H new ATOM 56 N LEU A 358 4.211 -14.155 6.742 1.00 0.00 N ATOM 57 CA LEU A 358 3.294 -13.224 6.081 1.00 0.00 C ATOM 58 C LEU A 358 3.548 -13.156 4.575 1.00 0.00 C ATOM 59 O LEU A 358 2.624 -12.936 3.794 1.00 0.00 O ATOM 60 CB LEU A 358 3.399 -11.822 6.695 1.00 0.00 C ATOM 61 CG LEU A 358 3.073 -11.737 8.189 1.00 0.00 C ATOM 62 CD1 LEU A 358 3.272 -10.316 8.694 1.00 0.00 C ATOM 63 CD2 LEU A 358 1.648 -12.199 8.455 1.00 0.00 C ATOM 0 H LEU A 358 3.775 -15.031 7.032 1.00 0.00 H new ATOM 0 HA LEU A 358 2.284 -13.603 6.238 1.00 0.00 H new ATOM 0 HB2 LEU A 358 4.411 -11.450 6.539 1.00 0.00 H new ATOM 0 HB3 LEU A 358 2.727 -11.155 6.155 1.00 0.00 H new ATOM 0 HG LEU A 358 3.754 -12.397 8.727 1.00 0.00 H new ATOM 0 HD11 LEU A 358 3.036 -10.271 9.757 1.00 0.00 H new ATOM 0 HD12 LEU A 358 4.309 -10.017 8.539 1.00 0.00 H new ATOM 0 HD13 LEU A 358 2.614 -9.640 8.148 1.00 0.00 H new ATOM 0 HD21 LEU A 358 1.437 -12.131 9.522 1.00 0.00 H new ATOM 0 HD22 LEU A 358 0.952 -11.565 7.906 1.00 0.00 H new ATOM 0 HD23 LEU A 358 1.533 -13.232 8.128 1.00 0.00 H new ATOM 75 N GLU A 359 4.803 -13.344 4.180 1.00 0.00 N ATOM 76 CA GLU A 359 5.186 -13.306 2.770 1.00 0.00 C ATOM 77 C GLU A 359 4.854 -11.952 2.151 1.00 0.00 C ATOM 78 O GLU A 359 4.321 -11.878 1.043 1.00 0.00 O ATOM 79 CB GLU A 359 4.486 -14.424 1.993 1.00 0.00 C ATOM 80 CG GLU A 359 4.839 -15.820 2.480 1.00 0.00 C ATOM 81 CD GLU A 359 4.144 -16.909 1.687 1.00 0.00 C ATOM 82 OE1 GLU A 359 2.896 -16.924 1.666 1.00 0.00 O ATOM 83 OE2 GLU A 359 4.849 -17.749 1.089 1.00 0.00 O ATOM 0 H GLU A 359 5.577 -13.525 4.819 1.00 0.00 H new ATOM 0 HA GLU A 359 6.264 -13.457 2.711 1.00 0.00 H new ATOM 0 HB2 GLU A 359 3.407 -14.285 2.066 1.00 0.00 H new ATOM 0 HB3 GLU A 359 4.747 -14.340 0.938 1.00 0.00 H new ATOM 0 HG2 GLU A 359 5.918 -15.961 2.415 1.00 0.00 H new ATOM 0 HG3 GLU A 359 4.568 -15.913 3.532 1.00 0.00 H new ATOM 90 N VAL A 360 5.176 -10.882 2.872 1.00 0.00 N ATOM 91 CA VAL A 360 4.915 -9.530 2.394 1.00 0.00 C ATOM 92 C VAL A 360 5.719 -9.224 1.133 1.00 0.00 C ATOM 93 O VAL A 360 6.916 -9.501 1.068 1.00 0.00 O ATOM 94 CB VAL A 360 5.243 -8.478 3.474 1.00 0.00 C ATOM 95 CG1 VAL A 360 4.342 -8.661 4.685 1.00 0.00 C ATOM 96 CG2 VAL A 360 6.707 -8.558 3.879 1.00 0.00 C ATOM 0 H VAL A 360 5.618 -10.926 3.790 1.00 0.00 H new ATOM 0 HA VAL A 360 3.852 -9.478 2.160 1.00 0.00 H new ATOM 0 HB VAL A 360 5.061 -7.489 3.054 1.00 0.00 H new ATOM 0 HG11 VAL A 360 4.587 -7.911 5.437 1.00 0.00 H new ATOM 0 HG12 VAL A 360 3.301 -8.547 4.384 1.00 0.00 H new ATOM 0 HG13 VAL A 360 4.492 -9.656 5.103 1.00 0.00 H new ATOM 0 HG21 VAL A 360 6.915 -7.807 4.641 1.00 0.00 H new ATOM 0 HG22 VAL A 360 6.920 -9.549 4.278 1.00 0.00 H new ATOM 0 HG23 VAL A 360 7.336 -8.375 3.008 1.00 0.00 H new ATOM 106 N LEU A 361 5.047 -8.648 0.137 1.00 0.00 N ATOM 107 CA LEU A 361 5.681 -8.292 -1.129 1.00 0.00 C ATOM 108 C LEU A 361 6.210 -9.523 -1.862 1.00 0.00 C ATOM 109 O LEU A 361 6.806 -10.415 -1.257 1.00 0.00 O ATOM 110 CB LEU A 361 6.819 -7.293 -0.905 1.00 0.00 C ATOM 111 CG LEU A 361 6.391 -5.893 -0.450 1.00 0.00 C ATOM 112 CD1 LEU A 361 5.780 -5.934 0.943 1.00 0.00 C ATOM 113 CD2 LEU A 361 7.576 -4.941 -0.483 1.00 0.00 C ATOM 0 H LEU A 361 4.055 -8.417 0.185 1.00 0.00 H new ATOM 0 HA LEU A 361 4.916 -7.828 -1.752 1.00 0.00 H new ATOM 0 HB2 LEU A 361 7.499 -7.706 -0.160 1.00 0.00 H new ATOM 0 HB3 LEU A 361 7.383 -7.197 -1.833 1.00 0.00 H new ATOM 0 HG LEU A 361 5.630 -5.530 -1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 361 5.485 -4.928 1.241 1.00 0.00 H new ATOM 0 HD12 LEU A 361 4.904 -6.582 0.937 1.00 0.00 H new ATOM 0 HD13 LEU A 361 6.513 -6.322 1.651 1.00 0.00 H new ATOM 0 HD21 LEU A 361 7.257 -3.951 -0.157 1.00 0.00 H new ATOM 0 HD22 LEU A 361 8.356 -5.308 0.184 1.00 0.00 H new ATOM 0 HD23 LEU A 361 7.966 -4.880 -1.499 1.00 0.00 H new ATOM 125 N THR A 362 5.995 -9.557 -3.175 1.00 0.00 N ATOM 126 CA THR A 362 6.452 -10.667 -4.002 1.00 0.00 C ATOM 127 C THR A 362 6.821 -10.180 -5.399 1.00 0.00 C ATOM 128 O THR A 362 6.009 -9.561 -6.087 1.00 0.00 O ATOM 129 CB THR A 362 5.379 -11.767 -4.126 1.00 0.00 C ATOM 130 OG1 THR A 362 4.169 -11.214 -4.658 1.00 0.00 O ATOM 131 CG2 THR A 362 5.099 -12.412 -2.777 1.00 0.00 C ATOM 0 H THR A 362 5.505 -8.825 -3.689 1.00 0.00 H new ATOM 0 HA THR A 362 7.330 -11.087 -3.511 1.00 0.00 H new ATOM 0 HB THR A 362 5.757 -12.534 -4.802 1.00 0.00 H new ATOM 0 HG1 THR A 362 4.381 -10.428 -5.204 1.00 0.00 H new ATOM 0 HG21 THR A 362 4.339 -13.184 -2.894 1.00 0.00 H new ATOM 0 HG22 THR A 362 6.015 -12.860 -2.391 1.00 0.00 H new ATOM 0 HG23 THR A 362 4.743 -11.655 -2.079 1.00 0.00 H new ATOM 139 N GLN A 363 8.053 -10.460 -5.809 1.00 0.00 N ATOM 140 CA GLN A 363 8.538 -10.050 -7.120 1.00 0.00 C ATOM 141 C GLN A 363 7.916 -10.895 -8.226 1.00 0.00 C ATOM 142 O GLN A 363 7.767 -12.108 -8.084 1.00 0.00 O ATOM 143 CB GLN A 363 10.062 -10.156 -7.175 1.00 0.00 C ATOM 144 CG GLN A 363 10.769 -9.303 -6.135 1.00 0.00 C ATOM 145 CD GLN A 363 12.280 -9.389 -6.239 1.00 0.00 C ATOM 146 OE1 GLN A 363 12.863 -10.465 -6.100 1.00 0.00 O ATOM 147 NE2 GLN A 363 12.922 -8.253 -6.484 1.00 0.00 N ATOM 0 H GLN A 363 8.736 -10.971 -5.249 1.00 0.00 H new ATOM 0 HA GLN A 363 8.244 -9.012 -7.279 1.00 0.00 H new ATOM 0 HB2 GLN A 363 10.351 -11.198 -7.035 1.00 0.00 H new ATOM 0 HB3 GLN A 363 10.403 -9.861 -8.167 1.00 0.00 H new ATOM 0 HG2 GLN A 363 10.459 -8.264 -6.251 1.00 0.00 H new ATOM 0 HG3 GLN A 363 10.458 -9.619 -5.139 1.00 0.00 H new ATOM 0 HE21 GLN A 363 12.398 -7.384 -6.592 1.00 0.00 H new ATOM 0 HE22 GLN A 363 13.939 -8.249 -6.564 1.00 0.00 H new ATOM 156 N LYS A 364 7.560 -10.244 -9.332 1.00 0.00 N ATOM 157 CA LYS A 364 6.958 -10.934 -10.468 1.00 0.00 C ATOM 158 C LYS A 364 7.365 -10.275 -11.782 1.00 0.00 C ATOM 159 O LYS A 364 7.047 -9.110 -12.027 1.00 0.00 O ATOM 160 CB LYS A 364 5.432 -10.937 -10.343 1.00 0.00 C ATOM 161 CG LYS A 364 4.914 -11.729 -9.152 1.00 0.00 C ATOM 162 CD LYS A 364 3.395 -11.692 -9.071 1.00 0.00 C ATOM 163 CE LYS A 364 2.750 -12.314 -10.301 1.00 0.00 C ATOM 164 NZ LYS A 364 1.264 -12.266 -10.234 1.00 0.00 N ATOM 0 H LYS A 364 7.679 -9.240 -9.464 1.00 0.00 H new ATOM 0 HA LYS A 364 7.319 -11.962 -10.467 1.00 0.00 H new ATOM 0 HB2 LYS A 364 5.082 -9.908 -10.263 1.00 0.00 H new ATOM 0 HB3 LYS A 364 5.003 -11.350 -11.256 1.00 0.00 H new ATOM 0 HG2 LYS A 364 5.250 -12.763 -9.229 1.00 0.00 H new ATOM 0 HG3 LYS A 364 5.338 -11.324 -8.233 1.00 0.00 H new ATOM 0 HD2 LYS A 364 3.065 -12.224 -8.179 1.00 0.00 H new ATOM 0 HD3 LYS A 364 3.061 -10.660 -8.968 1.00 0.00 H new ATOM 0 HE2 LYS A 364 3.090 -11.789 -11.194 1.00 0.00 H new ATOM 0 HE3 LYS A 364 3.076 -13.350 -10.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 0.864 -12.700 -11.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 0.937 -12.789 -9.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 0.951 -11.276 -10.168 1.00 0.00 H new ATOM 178 N HIS A 365 8.066 -11.042 -12.620 1.00 0.00 N ATOM 179 CA HIS A 365 8.537 -10.575 -13.928 1.00 0.00 C ATOM 180 C HIS A 365 8.962 -9.106 -13.904 1.00 0.00 C ATOM 181 O HIS A 365 8.797 -8.392 -14.893 1.00 0.00 O ATOM 182 CB HIS A 365 7.470 -10.798 -15.007 1.00 0.00 C ATOM 183 CG HIS A 365 6.176 -10.084 -14.758 1.00 0.00 C ATOM 184 ND1 HIS A 365 5.323 -10.406 -13.722 1.00 0.00 N ATOM 185 CD2 HIS A 365 5.589 -9.059 -15.421 1.00 0.00 C ATOM 186 CE1 HIS A 365 4.269 -9.611 -13.760 1.00 0.00 C ATOM 187 NE2 HIS A 365 4.406 -8.785 -14.780 1.00 0.00 N ATOM 0 H HIS A 365 8.324 -12.006 -12.411 1.00 0.00 H new ATOM 0 HA HIS A 365 9.419 -11.168 -14.172 1.00 0.00 H new ATOM 0 HB2 HIS A 365 7.870 -10.474 -15.968 1.00 0.00 H new ATOM 0 HB3 HIS A 365 7.271 -11.867 -15.088 1.00 0.00 H new ATOM 0 HD2 HIS A 365 5.979 -8.552 -16.291 1.00 0.00 H new ATOM 0 HE1 HIS A 365 3.436 -9.633 -13.073 1.00 0.00 H new ATOM 0 HE2 HIS A 365 3.741 -8.060 -15.049 1.00 0.00 H new ATOM 196 N LYS A 366 9.525 -8.668 -12.777 1.00 0.00 N ATOM 197 CA LYS A 366 9.990 -7.290 -12.629 1.00 0.00 C ATOM 198 C LYS A 366 10.511 -7.058 -11.210 1.00 0.00 C ATOM 199 O LYS A 366 9.788 -7.267 -10.236 1.00 0.00 O ATOM 200 CB LYS A 366 8.854 -6.307 -12.946 1.00 0.00 C ATOM 201 CG LYS A 366 9.328 -4.978 -13.520 1.00 0.00 C ATOM 202 CD LYS A 366 9.976 -4.092 -12.467 1.00 0.00 C ATOM 203 CE LYS A 366 8.954 -3.588 -11.461 1.00 0.00 C ATOM 204 NZ LYS A 366 9.546 -2.612 -10.506 1.00 0.00 N ATOM 0 H LYS A 366 9.670 -9.250 -11.952 1.00 0.00 H new ATOM 0 HA LYS A 366 10.804 -7.119 -13.333 1.00 0.00 H new ATOM 0 HB2 LYS A 366 8.170 -6.774 -13.655 1.00 0.00 H new ATOM 0 HB3 LYS A 366 8.287 -6.116 -12.035 1.00 0.00 H new ATOM 0 HG2 LYS A 366 10.041 -5.165 -14.323 1.00 0.00 H new ATOM 0 HG3 LYS A 366 8.481 -4.453 -13.962 1.00 0.00 H new ATOM 0 HD2 LYS A 366 10.755 -4.651 -11.948 1.00 0.00 H new ATOM 0 HD3 LYS A 366 10.461 -3.244 -12.951 1.00 0.00 H new ATOM 0 HE2 LYS A 366 8.125 -3.119 -11.991 1.00 0.00 H new ATOM 0 HE3 LYS A 366 8.543 -4.432 -10.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 9.038 -2.661 -9.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 10.549 -2.840 -10.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 9.465 -1.651 -10.897 1.00 0.00 H new ATOM 218 N PRO A 367 11.781 -6.631 -11.071 1.00 0.00 N ATOM 219 CA PRO A 367 12.397 -6.385 -9.762 1.00 0.00 C ATOM 220 C PRO A 367 11.887 -5.113 -9.094 1.00 0.00 C ATOM 221 O PRO A 367 11.668 -4.099 -9.756 1.00 0.00 O ATOM 222 CB PRO A 367 13.883 -6.250 -10.093 1.00 0.00 C ATOM 223 CG PRO A 367 13.915 -5.758 -11.492 1.00 0.00 C ATOM 224 CD PRO A 367 12.723 -6.367 -12.179 1.00 0.00 C ATOM 0 HA PRO A 367 12.167 -7.182 -9.055 1.00 0.00 H new ATOM 0 HB2 PRO A 367 14.377 -5.553 -9.417 1.00 0.00 H new ATOM 0 HB3 PRO A 367 14.398 -7.206 -9.998 1.00 0.00 H new ATOM 0 HG2 PRO A 367 13.868 -4.669 -11.523 1.00 0.00 H new ATOM 0 HG3 PRO A 367 14.841 -6.051 -11.987 1.00 0.00 H new ATOM 0 HD2 PRO A 367 12.295 -5.688 -12.916 1.00 0.00 H new ATOM 0 HD3 PRO A 367 12.989 -7.283 -12.706 1.00 0.00 H new ATOM 232 N ALA A 368 11.714 -5.174 -7.773 1.00 0.00 N ATOM 233 CA ALA A 368 11.245 -4.027 -6.998 1.00 0.00 C ATOM 234 C ALA A 368 9.831 -3.615 -7.398 1.00 0.00 C ATOM 235 O ALA A 368 9.602 -2.478 -7.814 1.00 0.00 O ATOM 236 CB ALA A 368 12.206 -2.855 -7.150 1.00 0.00 C ATOM 0 H ALA A 368 11.893 -6.010 -7.216 1.00 0.00 H new ATOM 0 HA ALA A 368 11.215 -4.326 -5.950 1.00 0.00 H new ATOM 0 HB1 ALA A 368 11.843 -2.009 -6.567 1.00 0.00 H new ATOM 0 HB2 ALA A 368 13.194 -3.145 -6.792 1.00 0.00 H new ATOM 0 HB3 ALA A 368 12.270 -2.571 -8.200 1.00 0.00 H new ATOM 242 N GLU A 369 8.887 -4.543 -7.265 1.00 0.00 N ATOM 243 CA GLU A 369 7.493 -4.275 -7.609 1.00 0.00 C ATOM 244 C GLU A 369 6.994 -3.014 -6.914 1.00 0.00 C ATOM 245 O GLU A 369 6.315 -2.184 -7.519 1.00 0.00 O ATOM 246 CB GLU A 369 6.613 -5.465 -7.218 1.00 0.00 C ATOM 247 CG GLU A 369 6.987 -6.763 -7.920 1.00 0.00 C ATOM 248 CD GLU A 369 6.740 -6.715 -9.417 1.00 0.00 C ATOM 249 OE1 GLU A 369 7.374 -5.882 -10.099 1.00 0.00 O ATOM 250 OE2 GLU A 369 5.913 -7.512 -9.906 1.00 0.00 O ATOM 0 H GLU A 369 9.062 -5.487 -6.921 1.00 0.00 H new ATOM 0 HA GLU A 369 7.434 -4.123 -8.687 1.00 0.00 H new ATOM 0 HB2 GLU A 369 6.678 -5.614 -6.140 1.00 0.00 H new ATOM 0 HB3 GLU A 369 5.574 -5.227 -7.445 1.00 0.00 H new ATOM 0 HG2 GLU A 369 8.039 -6.979 -7.737 1.00 0.00 H new ATOM 0 HG3 GLU A 369 6.413 -7.583 -7.488 1.00 0.00 H new ATOM 257 N SER A 370 7.346 -2.881 -5.644 1.00 0.00 N ATOM 258 CA SER A 370 6.950 -1.723 -4.847 1.00 0.00 C ATOM 259 C SER A 370 7.601 -1.769 -3.469 1.00 0.00 C ATOM 260 O SER A 370 7.512 -2.774 -2.763 1.00 0.00 O ATOM 261 CB SER A 370 5.429 -1.671 -4.699 1.00 0.00 C ATOM 262 OG SER A 370 4.938 -2.825 -4.039 1.00 0.00 O ATOM 0 H SER A 370 7.909 -3.564 -5.138 1.00 0.00 H new ATOM 0 HA SER A 370 7.288 -0.825 -5.365 1.00 0.00 H new ATOM 0 HB2 SER A 370 5.146 -0.780 -4.138 1.00 0.00 H new ATOM 0 HB3 SER A 370 4.968 -1.588 -5.683 1.00 0.00 H new ATOM 0 HG SER A 370 5.652 -3.220 -3.497 1.00 0.00 H new ATOM 268 N GLN A 371 8.255 -0.675 -3.091 1.00 0.00 N ATOM 269 CA GLN A 371 8.923 -0.590 -1.798 1.00 0.00 C ATOM 270 C GLN A 371 7.913 -0.441 -0.665 1.00 0.00 C ATOM 271 O GLN A 371 8.003 -1.130 0.352 1.00 0.00 O ATOM 272 CB GLN A 371 9.905 0.585 -1.775 1.00 0.00 C ATOM 273 CG GLN A 371 11.054 0.446 -2.763 1.00 0.00 C ATOM 274 CD GLN A 371 10.593 0.485 -4.207 1.00 0.00 C ATOM 275 OE1 GLN A 371 10.026 1.479 -4.663 1.00 0.00 O ATOM 276 NE2 GLN A 371 10.832 -0.599 -4.935 1.00 0.00 N ATOM 0 H GLN A 371 8.336 0.166 -3.663 1.00 0.00 H new ATOM 0 HA GLN A 371 9.475 -1.518 -1.650 1.00 0.00 H new ATOM 0 HB2 GLN A 371 9.361 1.505 -1.992 1.00 0.00 H new ATOM 0 HB3 GLN A 371 10.313 0.685 -0.769 1.00 0.00 H new ATOM 0 HG2 GLN A 371 11.772 1.248 -2.594 1.00 0.00 H new ATOM 0 HG3 GLN A 371 11.575 -0.493 -2.578 1.00 0.00 H new ATOM 0 HE21 GLN A 371 11.305 -1.400 -4.517 1.00 0.00 H new ATOM 0 HE22 GLN A 371 10.543 -0.631 -5.913 1.00 0.00 H new ATOM 285 N GLN A 372 6.957 0.466 -0.842 1.00 0.00 N ATOM 286 CA GLN A 372 5.936 0.706 0.172 1.00 0.00 C ATOM 287 C GLN A 372 4.672 1.295 -0.446 1.00 0.00 C ATOM 288 O GLN A 372 4.738 2.109 -1.368 1.00 0.00 O ATOM 289 CB GLN A 372 6.477 1.642 1.255 1.00 0.00 C ATOM 290 CG GLN A 372 5.462 1.974 2.336 1.00 0.00 C ATOM 291 CD GLN A 372 6.047 2.830 3.442 1.00 0.00 C ATOM 292 OE1 GLN A 372 6.536 3.933 3.198 1.00 0.00 O ATOM 293 NE2 GLN A 372 5.998 2.324 4.669 1.00 0.00 N ATOM 0 H GLN A 372 6.868 1.046 -1.676 1.00 0.00 H new ATOM 0 HA GLN A 372 5.678 -0.252 0.623 1.00 0.00 H new ATOM 0 HB2 GLN A 372 7.350 1.182 1.718 1.00 0.00 H new ATOM 0 HB3 GLN A 372 6.814 2.568 0.788 1.00 0.00 H new ATOM 0 HG2 GLN A 372 4.616 2.495 1.887 1.00 0.00 H new ATOM 0 HG3 GLN A 372 5.076 1.049 2.763 1.00 0.00 H new ATOM 0 HE21 GLN A 372 5.583 1.405 4.826 1.00 0.00 H new ATOM 0 HE22 GLN A 372 6.375 2.854 5.455 1.00 0.00 H new ATOM 302 N GLN A 373 3.521 0.872 0.071 1.00 0.00 N ATOM 303 CA GLN A 373 2.232 1.346 -0.419 1.00 0.00 C ATOM 304 C GLN A 373 2.138 2.864 -0.391 1.00 0.00 C ATOM 305 O GLN A 373 2.667 3.519 0.508 1.00 0.00 O ATOM 306 CB GLN A 373 1.095 0.743 0.405 1.00 0.00 C ATOM 307 CG GLN A 373 0.853 -0.725 0.110 1.00 0.00 C ATOM 308 CD GLN A 373 -0.213 -1.345 1.000 1.00 0.00 C ATOM 309 OE1 GLN A 373 -0.523 -2.530 0.876 1.00 0.00 O ATOM 310 NE2 GLN A 373 -0.779 -0.550 1.903 1.00 0.00 N ATOM 0 H GLN A 373 3.456 0.198 0.834 1.00 0.00 H new ATOM 0 HA GLN A 373 2.141 1.023 -1.456 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.321 0.861 1.465 1.00 0.00 H new ATOM 0 HB3 GLN A 373 0.179 1.301 0.211 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.556 -0.836 -0.933 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.787 -1.273 0.236 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -0.493 0.427 1.973 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -1.499 -0.917 2.526 1.00 0.00 H new ATOM 319 N ALA A 374 1.451 3.412 -1.385 1.00 0.00 N ATOM 320 CA ALA A 374 1.266 4.853 -1.494 1.00 0.00 C ATOM 321 C ALA A 374 -0.214 5.199 -1.601 1.00 0.00 C ATOM 322 O ALA A 374 -0.975 4.495 -2.265 1.00 0.00 O ATOM 323 CB ALA A 374 2.028 5.396 -2.696 1.00 0.00 C ATOM 0 H ALA A 374 1.010 2.876 -2.132 1.00 0.00 H new ATOM 0 HA ALA A 374 1.662 5.319 -0.592 1.00 0.00 H new ATOM 0 HB1 ALA A 374 1.880 6.474 -2.764 1.00 0.00 H new ATOM 0 HB2 ALA A 374 3.091 5.182 -2.580 1.00 0.00 H new ATOM 0 HB3 ALA A 374 1.660 4.921 -3.605 1.00 0.00 H new ATOM 329 N ALA A 375 -0.615 6.282 -0.939 1.00 0.00 N ATOM 330 CA ALA A 375 -2.006 6.719 -0.956 1.00 0.00 C ATOM 331 C ALA A 375 -2.546 6.777 -2.380 1.00 0.00 C ATOM 332 O ALA A 375 -2.277 7.719 -3.124 1.00 0.00 O ATOM 333 CB ALA A 375 -2.136 8.076 -0.280 1.00 0.00 C ATOM 0 H ALA A 375 0.005 6.872 -0.384 1.00 0.00 H new ATOM 0 HA ALA A 375 -2.600 5.991 -0.403 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -3.179 8.393 -0.298 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -1.797 8.002 0.753 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -1.525 8.807 -0.810 1.00 0.00 H new ATOM 339 N GLU A 376 -3.309 5.754 -2.747 1.00 0.00 N ATOM 340 CA GLU A 376 -3.898 5.659 -4.075 1.00 0.00 C ATOM 341 C GLU A 376 -5.000 6.696 -4.254 1.00 0.00 C ATOM 342 O GLU A 376 -4.927 7.795 -3.703 1.00 0.00 O ATOM 343 CB GLU A 376 -4.442 4.244 -4.291 1.00 0.00 C ATOM 344 CG GLU A 376 -3.417 3.153 -4.018 1.00 0.00 C ATOM 345 CD GLU A 376 -2.235 3.203 -4.969 1.00 0.00 C ATOM 346 OE1 GLU A 376 -2.237 4.056 -5.882 1.00 0.00 O ATOM 347 OE2 GLU A 376 -1.308 2.381 -4.804 1.00 0.00 O ATOM 0 H GLU A 376 -3.535 4.971 -2.134 1.00 0.00 H new ATOM 0 HA GLU A 376 -3.129 5.862 -4.821 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.305 4.092 -3.643 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -4.795 4.152 -5.318 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -3.057 3.248 -2.993 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -3.900 2.179 -4.098 1.00 0.00 H new ATOM 354 N THR A 377 -6.016 6.344 -5.030 1.00 0.00 N ATOM 355 CA THR A 377 -7.129 7.243 -5.290 1.00 0.00 C ATOM 356 C THR A 377 -8.433 6.467 -5.380 1.00 0.00 C ATOM 357 O THR A 377 -8.434 5.278 -5.699 1.00 0.00 O ATOM 358 CB THR A 377 -6.911 8.040 -6.586 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.848 7.150 -7.708 1.00 0.00 O ATOM 360 CG2 THR A 377 -5.626 8.849 -6.503 1.00 0.00 C ATOM 0 H THR A 377 -6.091 5.438 -5.492 1.00 0.00 H new ATOM 0 HA THR A 377 -7.186 7.945 -4.458 1.00 0.00 H new ATOM 0 HB THR A 377 -7.751 8.723 -6.715 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.711 7.668 -8.529 1.00 0.00 H new ATOM 0 HG21 THR A 377 -5.487 9.407 -7.429 1.00 0.00 H new ATOM 0 HG22 THR A 377 -5.687 9.544 -5.666 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.781 8.176 -6.355 1.00 0.00 H new ATOM 368 N GLU A 378 -9.537 7.141 -5.081 1.00 0.00 N ATOM 369 CA GLU A 378 -10.850 6.507 -5.112 1.00 0.00 C ATOM 370 C GLU A 378 -11.022 5.690 -6.383 1.00 0.00 C ATOM 371 O GLU A 378 -11.590 4.600 -6.362 1.00 0.00 O ATOM 372 CB GLU A 378 -11.952 7.563 -5.020 1.00 0.00 C ATOM 373 CG GLU A 378 -13.348 6.975 -4.900 1.00 0.00 C ATOM 374 CD GLU A 378 -14.430 8.037 -4.889 1.00 0.00 C ATOM 375 OE1 GLU A 378 -14.403 8.901 -3.988 1.00 0.00 O ATOM 376 OE2 GLU A 378 -15.303 8.005 -5.781 1.00 0.00 O ATOM 0 H GLU A 378 -9.550 8.125 -4.815 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.926 5.838 -4.254 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.760 8.202 -4.158 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.909 8.199 -5.904 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.523 6.292 -5.731 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.413 6.386 -3.985 1.00 0.00 H new ATOM 383 N GLY A 379 -10.527 6.230 -7.487 1.00 0.00 N ATOM 384 CA GLY A 379 -10.633 5.547 -8.759 1.00 0.00 C ATOM 385 C GLY A 379 -9.887 4.230 -8.795 1.00 0.00 C ATOM 386 O GLY A 379 -10.386 3.247 -9.343 1.00 0.00 O ATOM 0 H GLY A 379 -10.052 7.132 -7.524 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -11.685 5.367 -8.980 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -10.248 6.196 -9.545 1.00 0.00 H new ATOM 390 N SER A 380 -8.689 4.203 -8.223 1.00 0.00 N ATOM 391 CA SER A 380 -7.890 2.983 -8.213 1.00 0.00 C ATOM 392 C SER A 380 -8.516 1.922 -7.314 1.00 0.00 C ATOM 393 O SER A 380 -8.683 0.773 -7.720 1.00 0.00 O ATOM 394 CB SER A 380 -6.463 3.281 -7.747 1.00 0.00 C ATOM 395 OG SER A 380 -6.453 3.752 -6.413 1.00 0.00 O ATOM 0 H SER A 380 -8.253 5.003 -7.764 1.00 0.00 H new ATOM 0 HA SER A 380 -7.860 2.598 -9.232 1.00 0.00 H new ATOM 0 HB2 SER A 380 -5.856 2.379 -7.822 1.00 0.00 H new ATOM 0 HB3 SER A 380 -6.011 4.025 -8.403 1.00 0.00 H new ATOM 0 HG SER A 380 -7.215 4.352 -6.272 1.00 0.00 H new ATOM 401 N CYS A 381 -8.855 2.315 -6.090 1.00 0.00 N ATOM 402 CA CYS A 381 -9.452 1.400 -5.120 1.00 0.00 C ATOM 403 C CYS A 381 -10.679 0.688 -5.683 1.00 0.00 C ATOM 404 O CYS A 381 -10.838 -0.520 -5.503 1.00 0.00 O ATOM 405 CB CYS A 381 -9.832 2.162 -3.851 1.00 0.00 C ATOM 406 SG CYS A 381 -8.424 2.957 -3.015 1.00 0.00 S ATOM 0 H CYS A 381 -8.726 3.266 -5.744 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.708 0.639 -4.886 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.569 2.924 -4.104 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.312 1.473 -3.156 1.00 0.00 H new ATOM 411 N ASN A 382 -11.542 1.439 -6.359 1.00 0.00 N ATOM 412 CA ASN A 382 -12.756 0.872 -6.942 1.00 0.00 C ATOM 413 C ASN A 382 -12.436 -0.325 -7.828 1.00 0.00 C ATOM 414 O ASN A 382 -13.238 -1.251 -7.953 1.00 0.00 O ATOM 415 CB ASN A 382 -13.502 1.928 -7.761 1.00 0.00 C ATOM 416 CG ASN A 382 -13.955 3.114 -6.928 1.00 0.00 C ATOM 417 OD1 ASN A 382 -14.573 4.045 -7.445 1.00 0.00 O ATOM 418 ND2 ASN A 382 -13.651 3.091 -5.635 1.00 0.00 N ATOM 0 H ASN A 382 -11.425 2.440 -6.517 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.389 0.538 -6.120 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -12.855 2.281 -8.564 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.371 1.468 -8.231 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -13.931 3.864 -5.031 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -13.137 2.300 -5.246 1.00 0.00 H new ATOM 425 N LYS A 383 -11.264 -0.295 -8.449 1.00 0.00 N ATOM 426 CA LYS A 383 -10.839 -1.368 -9.333 1.00 0.00 C ATOM 427 C LYS A 383 -10.265 -2.531 -8.535 1.00 0.00 C ATOM 428 O LYS A 383 -10.430 -3.695 -8.904 1.00 0.00 O ATOM 429 CB LYS A 383 -9.800 -0.843 -10.324 1.00 0.00 C ATOM 430 CG LYS A 383 -10.182 0.490 -10.955 1.00 0.00 C ATOM 431 CD LYS A 383 -11.541 0.428 -11.639 1.00 0.00 C ATOM 432 CE LYS A 383 -11.548 -0.561 -12.797 1.00 0.00 C ATOM 433 NZ LYS A 383 -12.880 -0.628 -13.461 1.00 0.00 N ATOM 0 H LYS A 383 -10.590 0.465 -8.355 1.00 0.00 H new ATOM 0 HA LYS A 383 -11.708 -1.729 -9.883 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -8.844 -0.733 -9.812 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.656 -1.581 -11.113 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -10.197 1.264 -10.187 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.423 0.778 -11.682 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -12.301 0.141 -10.912 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -11.809 1.419 -12.006 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -10.792 -0.271 -13.527 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -11.274 -1.551 -12.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -12.844 -1.312 -14.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -13.597 -0.929 -12.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -13.130 0.311 -13.833 1.00 0.00 H new ATOM 447 N LYS A 384 -9.581 -2.205 -7.446 1.00 0.00 N ATOM 448 CA LYS A 384 -8.967 -3.207 -6.592 1.00 0.00 C ATOM 449 C LYS A 384 -10.012 -4.082 -5.908 1.00 0.00 C ATOM 450 O LYS A 384 -10.913 -3.580 -5.235 1.00 0.00 O ATOM 451 CB LYS A 384 -8.096 -2.512 -5.547 1.00 0.00 C ATOM 452 CG LYS A 384 -6.728 -2.069 -6.058 1.00 0.00 C ATOM 453 CD LYS A 384 -6.794 -1.384 -7.415 1.00 0.00 C ATOM 454 CE LYS A 384 -6.513 -2.355 -8.552 1.00 0.00 C ATOM 455 NZ LYS A 384 -6.551 -1.680 -9.879 1.00 0.00 N ATOM 0 H LYS A 384 -9.438 -1.245 -7.133 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.353 -3.859 -7.214 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -8.629 -1.639 -5.170 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -7.954 -3.187 -4.703 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -6.279 -1.388 -5.335 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -6.073 -2.938 -6.127 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -7.781 -0.941 -7.551 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.071 -0.569 -7.446 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -5.535 -2.813 -8.405 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.248 -3.160 -8.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -7.331 -2.070 -10.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -6.697 -0.659 -9.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.651 -1.838 -10.375 1.00 0.00 H new ATOM 469 N ASP A 385 -9.873 -5.396 -6.072 1.00 0.00 N ATOM 470 CA ASP A 385 -10.792 -6.345 -5.456 1.00 0.00 C ATOM 471 C ASP A 385 -10.554 -6.403 -3.952 1.00 0.00 C ATOM 472 O ASP A 385 -9.753 -5.640 -3.421 1.00 0.00 O ATOM 473 CB ASP A 385 -10.620 -7.734 -6.071 1.00 0.00 C ATOM 474 CG ASP A 385 -10.914 -7.751 -7.558 1.00 0.00 C ATOM 475 OD1 ASP A 385 -10.219 -7.034 -8.309 1.00 0.00 O ATOM 476 OD2 ASP A 385 -11.840 -8.480 -7.972 1.00 0.00 O ATOM 0 H ASP A 385 -9.132 -5.826 -6.626 1.00 0.00 H new ATOM 0 HA ASP A 385 -11.813 -6.010 -5.640 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -9.600 -8.079 -5.902 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -11.282 -8.436 -5.565 1.00 0.00 H new ATOM 481 N GLN A 386 -11.248 -7.312 -3.272 1.00 0.00 N ATOM 482 CA GLN A 386 -11.103 -7.459 -1.825 1.00 0.00 C ATOM 483 C GLN A 386 -9.632 -7.538 -1.424 1.00 0.00 C ATOM 484 O GLN A 386 -9.160 -6.757 -0.597 1.00 0.00 O ATOM 485 CB GLN A 386 -11.840 -8.710 -1.343 1.00 0.00 C ATOM 486 CG GLN A 386 -11.725 -8.950 0.154 1.00 0.00 C ATOM 487 CD GLN A 386 -12.449 -10.205 0.599 1.00 0.00 C ATOM 488 OE1 GLN A 386 -12.141 -11.308 0.146 1.00 0.00 O ATOM 489 NE2 GLN A 386 -13.418 -10.044 1.492 1.00 0.00 N ATOM 0 H GLN A 386 -11.915 -7.956 -3.697 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.541 -6.579 -1.353 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.894 -8.625 -1.608 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.448 -9.578 -1.872 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.672 -9.026 0.426 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -12.131 -8.091 0.688 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -13.640 -9.112 1.841 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -13.940 -10.853 1.829 1.00 0.00 H new ATOM 498 N ASN A 387 -8.912 -8.480 -2.022 1.00 0.00 N ATOM 499 CA ASN A 387 -7.498 -8.665 -1.736 1.00 0.00 C ATOM 500 C ASN A 387 -6.676 -7.471 -2.216 1.00 0.00 C ATOM 501 O ASN A 387 -5.652 -7.132 -1.621 1.00 0.00 O ATOM 502 CB ASN A 387 -6.999 -9.948 -2.399 1.00 0.00 C ATOM 503 CG ASN A 387 -5.508 -10.138 -2.241 1.00 0.00 C ATOM 504 OD1 ASN A 387 -4.994 -10.227 -1.126 1.00 0.00 O ATOM 505 ND2 ASN A 387 -4.807 -10.203 -3.363 1.00 0.00 N ATOM 0 H ASN A 387 -9.289 -9.130 -2.712 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.375 -8.744 -0.656 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.519 -10.803 -1.966 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -7.249 -9.926 -3.460 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -3.796 -10.332 -3.326 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -5.278 -10.124 -4.264 1.00 0.00 H new ATOM 512 N GLU A 388 -7.125 -6.845 -3.299 1.00 0.00 N ATOM 513 CA GLU A 388 -6.426 -5.697 -3.865 1.00 0.00 C ATOM 514 C GLU A 388 -6.752 -4.415 -3.111 1.00 0.00 C ATOM 515 O GLU A 388 -6.064 -3.406 -3.273 1.00 0.00 O ATOM 516 CB GLU A 388 -6.773 -5.542 -5.346 1.00 0.00 C ATOM 517 CG GLU A 388 -6.368 -6.736 -6.196 1.00 0.00 C ATOM 518 CD GLU A 388 -6.725 -6.562 -7.660 1.00 0.00 C ATOM 519 OE1 GLU A 388 -7.275 -5.498 -8.018 1.00 0.00 O ATOM 520 OE2 GLU A 388 -6.451 -7.489 -8.451 1.00 0.00 O ATOM 0 H GLU A 388 -7.970 -7.114 -3.803 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.356 -5.879 -3.766 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.847 -5.385 -5.444 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.283 -4.648 -5.733 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.293 -6.894 -6.105 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.855 -7.632 -5.812 1.00 0.00 H new ATOM 527 N CYS A 389 -7.798 -4.449 -2.288 1.00 0.00 N ATOM 528 CA CYS A 389 -8.187 -3.274 -1.523 1.00 0.00 C ATOM 529 C CYS A 389 -7.023 -2.845 -0.637 1.00 0.00 C ATOM 530 O CYS A 389 -6.773 -3.436 0.414 1.00 0.00 O ATOM 531 CB CYS A 389 -9.432 -3.569 -0.682 1.00 0.00 C ATOM 532 SG CYS A 389 -10.331 -2.082 -0.127 1.00 0.00 S ATOM 0 H CYS A 389 -8.384 -5.270 -2.137 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.433 -2.461 -2.207 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.110 -4.193 -1.264 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.137 -4.149 0.193 1.00 0.00 H new ATOM 537 N LYS A 390 -6.297 -1.831 -1.094 1.00 0.00 N ATOM 538 CA LYS A 390 -5.129 -1.330 -0.379 1.00 0.00 C ATOM 539 C LYS A 390 -5.513 -0.606 0.909 1.00 0.00 C ATOM 540 O LYS A 390 -6.674 -0.259 1.116 1.00 0.00 O ATOM 541 CB LYS A 390 -4.322 -0.418 -1.297 1.00 0.00 C ATOM 542 CG LYS A 390 -3.765 -1.142 -2.516 1.00 0.00 C ATOM 543 CD LYS A 390 -2.934 -0.212 -3.386 1.00 0.00 C ATOM 544 CE LYS A 390 -2.397 -0.929 -4.614 1.00 0.00 C ATOM 545 NZ LYS A 390 -3.492 -1.461 -5.471 1.00 0.00 N ATOM 0 H LYS A 390 -6.499 -1.337 -1.963 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.516 -2.183 -0.088 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -4.954 0.406 -1.628 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.498 0.019 -0.733 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -3.152 -1.983 -2.192 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -4.586 -1.553 -3.103 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -3.542 0.638 -3.696 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -2.103 0.187 -2.804 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -1.782 -0.242 -5.196 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -1.750 -1.749 -4.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -3.111 -1.712 -6.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -3.902 -2.307 -5.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -4.230 -0.736 -5.582 1.00 0.00 H new ATOM 559 N SER A 391 -4.522 -0.403 1.781 1.00 0.00 N ATOM 560 CA SER A 391 -4.738 0.253 3.061 1.00 0.00 C ATOM 561 C SER A 391 -5.466 1.589 2.897 1.00 0.00 C ATOM 562 O SER A 391 -6.520 1.791 3.501 1.00 0.00 O ATOM 563 CB SER A 391 -3.403 0.446 3.779 1.00 0.00 C ATOM 564 OG SER A 391 -2.778 -0.799 4.037 1.00 0.00 O ATOM 0 H SER A 391 -3.557 -0.688 1.616 1.00 0.00 H new ATOM 0 HA SER A 391 -5.378 -0.389 3.667 1.00 0.00 H new ATOM 0 HB2 SER A 391 -2.746 1.067 3.171 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.565 0.977 4.717 1.00 0.00 H new ATOM 0 HG SER A 391 -1.925 -0.648 4.495 1.00 0.00 H new ATOM 570 N PRO A 392 -4.937 2.526 2.075 1.00 0.00 N ATOM 571 CA PRO A 392 -5.580 3.820 1.855 1.00 0.00 C ATOM 572 C PRO A 392 -7.046 3.649 1.478 1.00 0.00 C ATOM 573 O PRO A 392 -7.878 4.518 1.732 1.00 0.00 O ATOM 574 CB PRO A 392 -4.789 4.428 0.686 1.00 0.00 C ATOM 575 CG PRO A 392 -3.961 3.321 0.138 1.00 0.00 C ATOM 576 CD PRO A 392 -3.698 2.416 1.293 1.00 0.00 C ATOM 0 HA PRO A 392 -5.572 4.446 2.747 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.460 4.828 -0.074 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.163 5.254 1.025 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.485 2.797 -0.661 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.030 3.699 -0.285 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.512 1.391 0.971 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -2.827 2.733 1.867 1.00 0.00 H new ATOM 584 N CYS A 393 -7.351 2.511 0.871 1.00 0.00 N ATOM 585 CA CYS A 393 -8.713 2.210 0.464 1.00 0.00 C ATOM 586 C CYS A 393 -9.533 1.733 1.654 1.00 0.00 C ATOM 587 O CYS A 393 -9.015 1.082 2.562 1.00 0.00 O ATOM 588 CB CYS A 393 -8.725 1.140 -0.619 1.00 0.00 C ATOM 589 SG CYS A 393 -7.562 1.440 -1.987 1.00 0.00 S ATOM 0 H CYS A 393 -6.673 1.782 0.650 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.154 3.124 0.068 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.491 0.177 -0.164 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.733 1.064 -1.026 1.00 0.00 H new ATOM 594 N LYS A 394 -10.816 2.049 1.631 1.00 0.00 N ATOM 595 CA LYS A 394 -11.729 1.646 2.693 1.00 0.00 C ATOM 596 C LYS A 394 -12.601 0.491 2.225 1.00 0.00 C ATOM 597 O LYS A 394 -13.339 0.614 1.248 1.00 0.00 O ATOM 598 CB LYS A 394 -12.603 2.827 3.123 1.00 0.00 C ATOM 599 CG LYS A 394 -13.628 2.474 4.191 1.00 0.00 C ATOM 600 CD LYS A 394 -14.504 3.666 4.547 1.00 0.00 C ATOM 601 CE LYS A 394 -13.694 4.783 5.178 1.00 0.00 C ATOM 602 NZ LYS A 394 -13.106 4.373 6.483 1.00 0.00 N ATOM 0 H LYS A 394 -11.254 2.587 0.884 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.141 1.318 3.551 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -11.961 3.625 3.498 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.123 3.220 2.249 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.254 1.655 3.838 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -13.115 2.120 5.085 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -14.999 4.036 3.649 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -15.288 3.350 5.235 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -12.896 5.082 4.498 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -14.331 5.655 5.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -12.767 5.215 6.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -13.830 3.892 7.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -12.310 3.725 6.317 1.00 0.00 H new ATOM 616 N TRP A 395 -12.506 -0.633 2.924 1.00 0.00 N ATOM 617 CA TRP A 395 -13.284 -1.810 2.568 1.00 0.00 C ATOM 618 C TRP A 395 -14.716 -1.693 3.084 1.00 0.00 C ATOM 619 O TRP A 395 -14.944 -1.600 4.290 1.00 0.00 O ATOM 620 CB TRP A 395 -12.618 -3.067 3.133 1.00 0.00 C ATOM 621 CG TRP A 395 -13.251 -4.342 2.664 1.00 0.00 C ATOM 622 CD1 TRP A 395 -13.711 -5.362 3.446 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.483 -4.737 1.306 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.219 -6.366 2.659 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.091 -6.007 1.342 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.241 -4.143 0.062 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.455 -6.691 0.187 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.604 -4.824 -1.083 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.206 -6.086 -1.014 1.00 0.00 C ATOM 0 H TRP A 395 -11.901 -0.753 3.736 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.320 -1.883 1.481 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.565 -3.068 2.851 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.657 -3.031 4.222 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -13.680 -5.377 4.525 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.626 -7.237 2.999 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.778 -3.169 -0.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -14.918 -7.665 0.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.420 -4.375 -2.048 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.479 -6.592 -1.928 1.00 0.00 H new ATOM 640 N HIS A 396 -15.678 -1.707 2.164 1.00 0.00 N ATOM 641 CA HIS A 396 -17.086 -1.610 2.531 1.00 0.00 C ATOM 642 C HIS A 396 -17.716 -2.989 2.654 1.00 0.00 C ATOM 643 O HIS A 396 -18.120 -3.582 1.650 1.00 0.00 O ATOM 644 CB HIS A 396 -17.858 -0.785 1.498 1.00 0.00 C ATOM 645 CG HIS A 396 -17.540 0.676 1.540 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.739 1.458 2.658 1.00 0.00 N ATOM 647 CD2 HIS A 396 -17.033 1.500 0.592 1.00 0.00 C ATOM 648 CE1 HIS A 396 -17.372 2.700 2.395 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.940 2.751 1.150 1.00 0.00 N ATOM 0 H HIS A 396 -15.507 -1.784 1.161 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.140 -1.113 3.499 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.638 -1.168 0.501 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -18.927 -0.921 1.662 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.754 1.225 -0.414 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -17.418 3.532 3.083 1.00 0.00 H new ATOM 0 HE2 HIS A 396 -16.593 3.586 0.678 1.00 0.00 H new ATOM 658 N ASN A 397 -17.817 -3.490 3.884 1.00 0.00 N ATOM 659 CA ASN A 397 -18.424 -4.791 4.116 1.00 0.00 C ATOM 660 C ASN A 397 -19.941 -4.675 4.033 1.00 0.00 C ATOM 661 O ASN A 397 -20.622 -4.501 5.044 1.00 0.00 O ATOM 662 CB ASN A 397 -17.992 -5.347 5.478 1.00 0.00 C ATOM 663 CG ASN A 397 -18.079 -4.315 6.588 1.00 0.00 C ATOM 664 OD1 ASN A 397 -19.154 -3.808 6.903 1.00 0.00 O ATOM 665 ND2 ASN A 397 -16.938 -3.999 7.189 1.00 0.00 N ATOM 0 H ASN A 397 -17.488 -3.017 4.726 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.086 -5.485 3.347 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -18.619 -6.201 5.732 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -16.968 -5.713 5.408 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -16.932 -3.312 7.943 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -16.068 -4.443 6.897 1.00 0.00 H new ATOM 672 N ASP A 398 -20.448 -4.771 2.805 1.00 0.00 N ATOM 673 CA ASP A 398 -21.877 -4.674 2.519 1.00 0.00 C ATOM 674 C ASP A 398 -22.069 -4.457 1.019 1.00 0.00 C ATOM 675 O ASP A 398 -21.755 -5.337 0.220 1.00 0.00 O ATOM 676 CB ASP A 398 -22.526 -3.530 3.312 1.00 0.00 C ATOM 677 CG ASP A 398 -24.032 -3.473 3.136 1.00 0.00 C ATOM 678 OD1 ASP A 398 -24.582 -4.334 2.417 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.663 -2.566 3.720 1.00 0.00 O ATOM 0 H ASP A 398 -19.874 -4.919 1.975 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.363 -5.601 2.824 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -22.293 -3.649 4.370 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -22.092 -2.582 2.995 1.00 0.00 H new ATOM 684 N ALA A 399 -22.569 -3.277 0.641 1.00 0.00 N ATOM 685 CA ALA A 399 -22.779 -2.946 -0.764 1.00 0.00 C ATOM 686 C ALA A 399 -23.546 -4.055 -1.484 1.00 0.00 C ATOM 687 O ALA A 399 -24.126 -4.935 -0.847 1.00 0.00 O ATOM 688 CB ALA A 399 -21.432 -2.686 -1.439 1.00 0.00 C ATOM 0 H ALA A 399 -22.835 -2.538 1.291 1.00 0.00 H new ATOM 0 HA ALA A 399 -23.384 -2.041 -0.823 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.593 -2.439 -2.488 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.931 -1.855 -0.943 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.811 -3.579 -1.367 1.00 0.00 H new ATOM 694 N GLU A 400 -23.534 -4.020 -2.814 1.00 0.00 N ATOM 695 CA GLU A 400 -24.217 -5.037 -3.607 1.00 0.00 C ATOM 696 C GLU A 400 -23.448 -6.350 -3.528 1.00 0.00 C ATOM 697 O GLU A 400 -24.020 -7.436 -3.627 1.00 0.00 O ATOM 698 CB GLU A 400 -24.347 -4.585 -5.062 1.00 0.00 C ATOM 699 CG GLU A 400 -25.103 -5.571 -5.940 1.00 0.00 C ATOM 700 CD GLU A 400 -25.249 -5.086 -7.370 1.00 0.00 C ATOM 701 OE1 GLU A 400 -24.214 -4.899 -8.042 1.00 0.00 O ATOM 702 OE2 GLU A 400 -26.400 -4.893 -7.816 1.00 0.00 O ATOM 0 H GLU A 400 -23.061 -3.302 -3.363 1.00 0.00 H new ATOM 0 HA GLU A 400 -25.219 -5.185 -3.205 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -24.856 -3.621 -5.090 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -23.351 -4.432 -5.477 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -24.582 -6.528 -5.936 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -26.092 -5.745 -5.516 1.00 0.00 H new ATOM 709 N ASN A 401 -22.139 -6.224 -3.339 1.00 0.00 N ATOM 710 CA ASN A 401 -21.245 -7.368 -3.233 1.00 0.00 C ATOM 711 C ASN A 401 -19.878 -6.902 -2.745 1.00 0.00 C ATOM 712 O ASN A 401 -18.842 -7.270 -3.303 1.00 0.00 O ATOM 713 CB ASN A 401 -21.116 -8.084 -4.583 1.00 0.00 C ATOM 714 CG ASN A 401 -20.624 -7.178 -5.704 1.00 0.00 C ATOM 715 OD1 ASN A 401 -20.456 -7.623 -6.839 1.00 0.00 O ATOM 716 ND2 ASN A 401 -20.392 -5.906 -5.398 1.00 0.00 N ATOM 0 H ASN A 401 -21.668 -5.323 -3.255 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.661 -8.076 -2.516 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -20.429 -8.923 -4.476 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -22.085 -8.499 -4.860 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -20.063 -5.261 -6.116 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -20.543 -5.575 -4.445 1.00 0.00 H new ATOM 723 N LYS A 402 -19.901 -6.064 -1.708 1.00 0.00 N ATOM 724 CA LYS A 402 -18.686 -5.499 -1.126 1.00 0.00 C ATOM 725 C LYS A 402 -18.036 -4.528 -2.104 1.00 0.00 C ATOM 726 O LYS A 402 -17.904 -4.830 -3.292 1.00 0.00 O ATOM 727 CB LYS A 402 -17.695 -6.599 -0.725 1.00 0.00 C ATOM 728 CG LYS A 402 -18.155 -7.450 0.452 1.00 0.00 C ATOM 729 CD LYS A 402 -19.310 -8.370 0.081 1.00 0.00 C ATOM 730 CE LYS A 402 -18.880 -9.431 -0.921 1.00 0.00 C ATOM 731 NZ LYS A 402 -20.003 -10.340 -1.287 1.00 0.00 N ATOM 0 H LYS A 402 -20.760 -5.759 -1.250 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.966 -4.958 -0.222 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.522 -7.248 -1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.739 -6.139 -0.475 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -17.319 -8.048 0.814 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -18.460 -6.799 1.271 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -19.695 -8.852 0.980 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -20.125 -7.781 -0.339 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -18.497 -8.947 -1.820 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -18.062 -10.016 -0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -19.620 -11.242 -1.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -20.595 -10.515 -0.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -20.579 -9.898 -2.032 1.00 0.00 H new ATOM 745 N LYS A 403 -17.643 -3.355 -1.613 1.00 0.00 N ATOM 746 CA LYS A 403 -17.027 -2.351 -2.476 1.00 0.00 C ATOM 747 C LYS A 403 -15.835 -1.666 -1.810 1.00 0.00 C ATOM 748 O LYS A 403 -15.923 -1.203 -0.674 1.00 0.00 O ATOM 749 CB LYS A 403 -18.058 -1.295 -2.886 1.00 0.00 C ATOM 750 CG LYS A 403 -19.210 -1.853 -3.708 1.00 0.00 C ATOM 751 CD LYS A 403 -20.152 -0.752 -4.176 1.00 0.00 C ATOM 752 CE LYS A 403 -19.458 0.222 -5.117 1.00 0.00 C ATOM 753 NZ LYS A 403 -20.374 1.307 -5.568 1.00 0.00 N ATOM 0 H LYS A 403 -17.738 -3.079 -0.636 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.661 -2.875 -3.359 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.458 -0.823 -1.989 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.558 -0.515 -3.460 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -18.815 -2.386 -4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.765 -2.578 -3.112 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -21.009 -1.197 -4.681 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -20.537 -0.211 -3.312 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -18.596 0.660 -4.614 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -19.080 -0.318 -5.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -19.863 1.949 -6.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -21.184 0.891 -6.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -20.715 1.839 -4.742 1.00 0.00 H new ATOM 767 N CYS A 404 -14.724 -1.588 -2.539 1.00 0.00 N ATOM 768 CA CYS A 404 -13.516 -0.939 -2.040 1.00 0.00 C ATOM 769 C CYS A 404 -13.431 0.487 -2.584 1.00 0.00 C ATOM 770 O CYS A 404 -13.500 0.696 -3.795 1.00 0.00 O ATOM 771 CB CYS A 404 -12.276 -1.740 -2.456 1.00 0.00 C ATOM 772 SG CYS A 404 -10.698 -1.058 -1.850 1.00 0.00 S ATOM 0 H CYS A 404 -14.636 -1.968 -3.481 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.557 -0.901 -0.951 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.380 -2.762 -2.091 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.241 -1.792 -3.544 1.00 0.00 H new ATOM 777 N THR A 405 -13.293 1.469 -1.692 1.00 0.00 N ATOM 778 CA THR A 405 -13.217 2.867 -2.114 1.00 0.00 C ATOM 779 C THR A 405 -12.249 3.671 -1.251 1.00 0.00 C ATOM 780 O THR A 405 -12.296 3.614 -0.024 1.00 0.00 O ATOM 781 CB THR A 405 -14.597 3.546 -2.066 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.085 3.567 -0.720 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.591 2.817 -2.956 1.00 0.00 C ATOM 0 H THR A 405 -13.232 1.324 -0.684 1.00 0.00 H new ATOM 0 HA THR A 405 -12.852 2.853 -3.141 1.00 0.00 H new ATOM 0 HB THR A 405 -14.487 4.567 -2.431 1.00 0.00 H new ATOM 0 HG1 THR A 405 -14.328 3.555 -0.097 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.559 3.316 -2.905 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.232 2.825 -3.985 1.00 0.00 H new ATOM 0 HG23 THR A 405 -15.696 1.786 -2.617 1.00 0.00 H new ATOM 791 N LEU A 406 -11.378 4.423 -1.915 1.00 0.00 N ATOM 792 CA LEU A 406 -10.382 5.253 -1.247 1.00 0.00 C ATOM 793 C LEU A 406 -11.038 6.275 -0.331 1.00 0.00 C ATOM 794 O LEU A 406 -12.071 6.855 -0.666 1.00 0.00 O ATOM 795 CB LEU A 406 -9.528 5.964 -2.298 1.00 0.00 C ATOM 796 CG LEU A 406 -8.253 6.642 -1.796 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.563 7.898 -1.002 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.425 5.669 -0.978 1.00 0.00 C ATOM 0 H LEU A 406 -11.343 4.474 -2.933 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.752 4.610 -0.632 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.250 5.237 -3.061 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.146 6.718 -2.786 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.670 6.947 -2.665 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.632 8.352 -0.662 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.102 8.604 -1.634 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.178 7.641 -0.139 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.520 6.166 -0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.006 5.327 -0.122 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.153 4.814 -1.596 1.00 0.00 H new ATOM 810 N ASP A 407 -10.416 6.505 0.819 1.00 0.00 N ATOM 811 CA ASP A 407 -10.920 7.471 1.775 1.00 0.00 C ATOM 812 C ASP A 407 -9.990 8.679 1.849 1.00 0.00 C ATOM 813 O ASP A 407 -8.777 8.533 1.988 1.00 0.00 O ATOM 814 CB ASP A 407 -11.073 6.815 3.144 1.00 0.00 C ATOM 815 CG ASP A 407 -9.825 6.093 3.598 1.00 0.00 C ATOM 816 OD1 ASP A 407 -8.766 6.289 2.973 1.00 0.00 O ATOM 817 OD2 ASP A 407 -9.906 5.342 4.593 1.00 0.00 O ATOM 0 H ASP A 407 -9.560 6.032 1.108 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.900 7.820 1.448 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.332 7.577 3.879 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -11.903 6.109 3.111 1.00 0.00 H new ATOM 822 N LYS A 408 -10.559 9.870 1.732 1.00 0.00 N ATOM 823 CA LYS A 408 -9.771 11.100 1.763 1.00 0.00 C ATOM 824 C LYS A 408 -9.092 11.309 3.113 1.00 0.00 C ATOM 825 O LYS A 408 -7.944 11.749 3.175 1.00 0.00 O ATOM 826 CB LYS A 408 -10.657 12.301 1.431 1.00 0.00 C ATOM 827 CG LYS A 408 -11.270 12.234 0.043 1.00 0.00 C ATOM 828 CD LYS A 408 -12.105 13.467 -0.259 1.00 0.00 C ATOM 829 CE LYS A 408 -12.693 13.414 -1.659 1.00 0.00 C ATOM 830 NZ LYS A 408 -13.501 14.625 -1.969 1.00 0.00 N ATOM 0 H LYS A 408 -11.562 10.014 1.615 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.987 11.006 1.011 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.456 12.369 2.170 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -10.066 13.213 1.515 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.479 12.138 -0.701 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.893 11.343 -0.038 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -12.910 13.550 0.471 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -11.488 14.359 -0.156 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -11.888 13.319 -2.387 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.318 12.526 -1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -13.884 14.549 -2.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -14.285 14.702 -1.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -12.899 15.471 -1.901 1.00 0.00 H new ATOM 844 N GLU A 409 -9.809 11.011 4.191 1.00 0.00 N ATOM 845 CA GLU A 409 -9.278 11.187 5.539 1.00 0.00 C ATOM 846 C GLU A 409 -8.038 10.328 5.785 1.00 0.00 C ATOM 847 O GLU A 409 -6.995 10.833 6.199 1.00 0.00 O ATOM 848 CB GLU A 409 -10.357 10.848 6.569 1.00 0.00 C ATOM 849 CG GLU A 409 -9.909 11.046 8.005 1.00 0.00 C ATOM 850 CD GLU A 409 -11.003 10.729 9.006 1.00 0.00 C ATOM 851 OE1 GLU A 409 -11.466 9.569 9.031 1.00 0.00 O ATOM 852 OE2 GLU A 409 -11.397 11.641 9.764 1.00 0.00 O ATOM 0 H GLU A 409 -10.761 10.646 4.158 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.980 12.231 5.642 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -11.234 11.468 6.382 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -10.665 9.811 6.433 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -9.045 10.411 8.203 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -9.584 12.078 8.142 1.00 0.00 H new ATOM 859 N GLU A 410 -8.158 9.029 5.541 1.00 0.00 N ATOM 860 CA GLU A 410 -7.048 8.108 5.753 1.00 0.00 C ATOM 861 C GLU A 410 -5.933 8.343 4.742 1.00 0.00 C ATOM 862 O GLU A 410 -4.757 8.282 5.087 1.00 0.00 O ATOM 863 CB GLU A 410 -7.532 6.659 5.682 1.00 0.00 C ATOM 864 CG GLU A 410 -6.428 5.629 5.871 1.00 0.00 C ATOM 865 CD GLU A 410 -5.795 5.686 7.249 1.00 0.00 C ATOM 866 OE1 GLU A 410 -6.249 6.499 8.082 1.00 0.00 O ATOM 867 OE2 GLU A 410 -4.847 4.910 7.498 1.00 0.00 O ATOM 0 H GLU A 410 -9.012 8.590 5.197 1.00 0.00 H new ATOM 0 HA GLU A 410 -6.646 8.296 6.748 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.295 6.503 6.445 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -8.009 6.493 4.716 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -6.836 4.632 5.706 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -5.658 5.787 5.116 1.00 0.00 H new ATOM 874 N ALA A 411 -6.306 8.602 3.492 1.00 0.00 N ATOM 875 CA ALA A 411 -5.323 8.835 2.441 1.00 0.00 C ATOM 876 C ALA A 411 -4.385 9.984 2.794 1.00 0.00 C ATOM 877 O ALA A 411 -3.168 9.860 2.657 1.00 0.00 O ATOM 878 CB ALA A 411 -6.014 9.108 1.115 1.00 0.00 C ATOM 0 H ALA A 411 -7.277 8.655 3.184 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.722 7.930 2.347 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -5.264 9.280 0.343 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.628 8.250 0.841 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.646 9.991 1.209 1.00 0.00 H new ATOM 884 N LYS A 412 -4.947 11.102 3.246 1.00 0.00 N ATOM 885 CA LYS A 412 -4.136 12.257 3.608 1.00 0.00 C ATOM 886 C LYS A 412 -3.266 11.953 4.825 1.00 0.00 C ATOM 887 O LYS A 412 -2.126 12.409 4.908 1.00 0.00 O ATOM 888 CB LYS A 412 -5.018 13.496 3.839 1.00 0.00 C ATOM 889 CG LYS A 412 -6.076 13.339 4.924 1.00 0.00 C ATOM 890 CD LYS A 412 -5.507 13.535 6.321 1.00 0.00 C ATOM 891 CE LYS A 412 -4.911 14.925 6.494 1.00 0.00 C ATOM 892 NZ LYS A 412 -5.921 15.996 6.265 1.00 0.00 N ATOM 0 H LYS A 412 -5.951 11.231 3.369 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.469 12.479 2.775 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -4.376 14.338 4.098 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -5.514 13.750 2.902 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -6.875 14.061 4.756 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -6.522 12.347 4.852 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -6.294 13.381 7.060 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -4.740 12.784 6.511 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -4.501 15.022 7.499 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -4.082 15.053 5.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -5.532 16.911 6.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -6.156 16.041 5.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -6.780 15.785 6.811 1.00 0.00 H new ATOM 906 N LYS A 413 -3.801 11.174 5.762 1.00 0.00 N ATOM 907 CA LYS A 413 -3.053 10.808 6.962 1.00 0.00 C ATOM 908 C LYS A 413 -1.874 9.909 6.609 1.00 0.00 C ATOM 909 O LYS A 413 -0.757 10.115 7.085 1.00 0.00 O ATOM 910 CB LYS A 413 -3.959 10.099 7.972 1.00 0.00 C ATOM 911 CG LYS A 413 -5.077 10.974 8.515 1.00 0.00 C ATOM 912 CD LYS A 413 -5.912 10.240 9.552 1.00 0.00 C ATOM 913 CE LYS A 413 -5.098 9.911 10.795 1.00 0.00 C ATOM 914 NZ LYS A 413 -4.577 11.139 11.458 1.00 0.00 N ATOM 0 H LYS A 413 -4.743 10.786 5.715 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.675 11.726 7.412 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.396 9.220 7.499 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -3.351 9.744 8.804 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -4.652 11.873 8.960 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -5.718 11.297 7.694 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -6.770 10.853 9.830 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -6.304 9.320 9.119 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -5.717 9.354 11.498 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -4.264 9.264 10.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -4.253 10.904 12.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -3.781 11.520 10.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -5.333 11.852 11.512 1.00 0.00 H new ATOM 928 N VAL A 414 -2.130 8.912 5.768 1.00 0.00 N ATOM 929 CA VAL A 414 -1.095 7.978 5.344 1.00 0.00 C ATOM 930 C VAL A 414 -0.008 8.693 4.551 1.00 0.00 C ATOM 931 O VAL A 414 1.182 8.484 4.784 1.00 0.00 O ATOM 932 CB VAL A 414 -1.685 6.839 4.490 1.00 0.00 C ATOM 933 CG1 VAL A 414 -0.586 5.914 3.989 1.00 0.00 C ATOM 934 CG2 VAL A 414 -2.723 6.062 5.283 1.00 0.00 C ATOM 0 H VAL A 414 -3.050 8.730 5.366 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.658 7.551 6.246 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.176 7.281 3.623 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -1.026 5.118 3.389 1.00 0.00 H new ATOM 0 HG12 VAL A 414 0.117 6.481 3.380 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -0.061 5.479 4.839 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -3.129 5.262 4.665 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -2.257 5.634 6.171 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -3.528 6.733 5.583 1.00 0.00 H new ATOM 944 N ALA A 415 -0.428 9.541 3.618 1.00 0.00 N ATOM 945 CA ALA A 415 0.505 10.296 2.792 1.00 0.00 C ATOM 946 C ALA A 415 1.376 11.201 3.654 1.00 0.00 C ATOM 947 O ALA A 415 2.575 11.341 3.413 1.00 0.00 O ATOM 948 CB ALA A 415 -0.249 11.116 1.756 1.00 0.00 C ATOM 0 H ALA A 415 -1.411 9.722 3.415 1.00 0.00 H new ATOM 0 HA ALA A 415 1.153 9.590 2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 415 0.462 11.674 1.147 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -0.830 10.450 1.118 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.920 11.812 2.260 1.00 0.00 H new ATOM 954 N ASP A 416 0.761 11.811 4.662 1.00 0.00 N ATOM 955 CA ASP A 416 1.473 12.704 5.571 1.00 0.00 C ATOM 956 C ASP A 416 2.228 11.903 6.631 1.00 0.00 C ATOM 957 O ASP A 416 2.317 12.309 7.790 1.00 0.00 O ATOM 958 CB ASP A 416 0.488 13.666 6.238 1.00 0.00 C ATOM 959 CG ASP A 416 1.177 14.755 7.039 1.00 0.00 C ATOM 960 OD1 ASP A 416 2.424 14.808 7.023 1.00 0.00 O ATOM 961 OD2 ASP A 416 0.467 15.560 7.678 1.00 0.00 O ATOM 0 H ASP A 416 -0.232 11.703 4.871 1.00 0.00 H new ATOM 0 HA ASP A 416 2.197 13.280 4.995 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -0.138 14.125 5.473 1.00 0.00 H new ATOM 0 HB3 ASP A 416 -0.174 13.102 6.895 1.00 0.00 H new ATOM 966 N GLU A 417 2.772 10.764 6.219 1.00 0.00 N ATOM 967 CA GLU A 417 3.523 9.891 7.118 1.00 0.00 C ATOM 968 C GLU A 417 4.543 9.064 6.343 1.00 0.00 C ATOM 969 O GLU A 417 5.671 8.873 6.797 1.00 0.00 O ATOM 970 CB GLU A 417 2.580 8.954 7.882 1.00 0.00 C ATOM 971 CG GLU A 417 1.651 9.666 8.851 1.00 0.00 C ATOM 972 CD GLU A 417 0.750 8.708 9.606 1.00 0.00 C ATOM 973 OE1 GLU A 417 1.282 7.830 10.318 1.00 0.00 O ATOM 974 OE2 GLU A 417 -0.486 8.835 9.483 1.00 0.00 O ATOM 0 H GLU A 417 2.707 10.420 5.261 1.00 0.00 H new ATOM 0 HA GLU A 417 4.048 10.526 7.832 1.00 0.00 H new ATOM 0 HB2 GLU A 417 1.980 8.395 7.164 1.00 0.00 H new ATOM 0 HB3 GLU A 417 3.176 8.227 8.434 1.00 0.00 H new ATOM 0 HG2 GLU A 417 2.245 10.238 9.564 1.00 0.00 H new ATOM 0 HG3 GLU A 417 1.037 10.380 8.302 1.00 0.00 H new ATOM 981 N THR A 418 4.135 8.570 5.177 1.00 0.00 N ATOM 982 CA THR A 418 5.008 7.759 4.335 1.00 0.00 C ATOM 983 C THR A 418 6.016 8.623 3.579 1.00 0.00 C ATOM 984 O THR A 418 6.160 8.507 2.361 1.00 0.00 O ATOM 985 CB THR A 418 4.196 6.928 3.323 1.00 0.00 C ATOM 986 OG1 THR A 418 3.415 7.794 2.491 1.00 0.00 O ATOM 987 CG2 THR A 418 3.281 5.947 4.042 1.00 0.00 C ATOM 0 H THR A 418 3.202 8.718 4.793 1.00 0.00 H new ATOM 0 HA THR A 418 5.547 7.085 5.000 1.00 0.00 H new ATOM 0 HB THR A 418 4.895 6.365 2.704 1.00 0.00 H new ATOM 0 HG1 THR A 418 4.011 8.341 1.938 1.00 0.00 H new ATOM 0 HG21 THR A 418 2.717 5.371 3.308 1.00 0.00 H new ATOM 0 HG22 THR A 418 3.880 5.271 4.652 1.00 0.00 H new ATOM 0 HG23 THR A 418 2.590 6.496 4.681 1.00 0.00 H new ATOM 995 N ALA A 419 6.715 9.488 4.308 1.00 0.00 N ATOM 996 CA ALA A 419 7.711 10.369 3.711 1.00 0.00 C ATOM 997 C ALA A 419 8.622 10.964 4.778 1.00 0.00 C ATOM 998 O ALA A 419 9.844 10.976 4.629 1.00 0.00 O ATOM 999 CB ALA A 419 7.028 11.478 2.921 1.00 0.00 C ATOM 0 H ALA A 419 6.609 9.597 5.317 1.00 0.00 H new ATOM 0 HA ALA A 419 8.325 9.778 3.031 1.00 0.00 H new ATOM 0 HB1 ALA A 419 7.783 12.129 2.480 1.00 0.00 H new ATOM 0 HB2 ALA A 419 6.420 11.040 2.129 1.00 0.00 H new ATOM 0 HB3 ALA A 419 6.391 12.060 3.587 1.00 0.00 H new ATOM 1005 N LYS A 420 8.019 11.450 5.859 1.00 0.00 N ATOM 1006 CA LYS A 420 8.775 12.039 6.958 1.00 0.00 C ATOM 1007 C LYS A 420 9.524 10.962 7.734 1.00 0.00 C ATOM 1008 O LYS A 420 10.686 11.140 8.102 1.00 0.00 O ATOM 1009 CB LYS A 420 7.841 12.803 7.897 1.00 0.00 C ATOM 1010 CG LYS A 420 7.087 13.936 7.218 1.00 0.00 C ATOM 1011 CD LYS A 420 6.164 14.655 8.191 1.00 0.00 C ATOM 1012 CE LYS A 420 5.098 13.722 8.748 1.00 0.00 C ATOM 1013 NZ LYS A 420 4.196 14.416 9.708 1.00 0.00 N ATOM 0 H LYS A 420 7.008 11.447 5.997 1.00 0.00 H new ATOM 0 HA LYS A 420 9.501 12.734 6.537 1.00 0.00 H new ATOM 0 HB2 LYS A 420 7.122 12.106 8.327 1.00 0.00 H new ATOM 0 HB3 LYS A 420 8.424 13.210 8.723 1.00 0.00 H new ATOM 0 HG2 LYS A 420 7.798 14.647 6.797 1.00 0.00 H new ATOM 0 HG3 LYS A 420 6.503 13.539 6.387 1.00 0.00 H new ATOM 0 HD2 LYS A 420 6.751 15.069 9.011 1.00 0.00 H new ATOM 0 HD3 LYS A 420 5.686 15.494 7.686 1.00 0.00 H new ATOM 0 HE2 LYS A 420 4.509 13.314 7.927 1.00 0.00 H new ATOM 0 HE3 LYS A 420 5.578 12.879 9.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 3.905 13.752 10.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 4.698 15.220 10.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 3.354 14.762 9.205 1.00 0.00 H new ATOM 1027 N ASP A 421 8.844 9.848 7.979 1.00 0.00 N ATOM 1028 CA ASP A 421 9.429 8.731 8.713 1.00 0.00 C ATOM 1029 C ASP A 421 10.701 8.240 8.030 1.00 0.00 C ATOM 1030 O ASP A 421 10.787 8.206 6.803 1.00 0.00 O ATOM 1031 CB ASP A 421 8.417 7.588 8.832 1.00 0.00 C ATOM 1032 CG ASP A 421 8.940 6.427 9.658 1.00 0.00 C ATOM 1033 OD1 ASP A 421 9.937 5.800 9.242 1.00 0.00 O ATOM 1034 OD2 ASP A 421 8.352 6.148 10.724 1.00 0.00 O ATOM 0 H ASP A 421 7.882 9.693 7.678 1.00 0.00 H new ATOM 0 HA ASP A 421 9.690 9.078 9.713 1.00 0.00 H new ATOM 0 HB2 ASP A 421 7.500 7.966 9.284 1.00 0.00 H new ATOM 0 HB3 ASP A 421 8.158 7.232 7.835 1.00 0.00 H new ATOM 1039 N GLY A 422 11.689 7.860 8.837 1.00 0.00 N ATOM 1040 CA GLY A 422 12.945 7.377 8.296 1.00 0.00 C ATOM 1041 C GLY A 422 13.794 6.672 9.336 1.00 0.00 C ATOM 1042 O GLY A 422 13.287 5.857 10.107 1.00 0.00 O ATOM 0 H GLY A 422 11.640 7.879 9.856 1.00 0.00 H new ATOM 0 HA2 GLY A 422 12.742 6.692 7.472 1.00 0.00 H new ATOM 0 HA3 GLY A 422 13.505 8.216 7.883 1.00 0.00 H new ATOM 1046 N LYS A 423 15.087 6.985 9.356 1.00 0.00 N ATOM 1047 CA LYS A 423 16.010 6.373 10.307 1.00 0.00 C ATOM 1048 C LYS A 423 17.390 7.019 10.230 1.00 0.00 C ATOM 1049 O LYS A 423 17.897 7.300 9.144 1.00 0.00 O ATOM 1050 CB LYS A 423 16.129 4.869 10.041 1.00 0.00 C ATOM 1051 CG LYS A 423 17.176 4.182 10.903 1.00 0.00 C ATOM 1052 CD LYS A 423 17.292 2.705 10.570 1.00 0.00 C ATOM 1053 CE LYS A 423 18.412 2.045 11.358 1.00 0.00 C ATOM 1054 NZ LYS A 423 19.735 2.663 11.065 1.00 0.00 N ATOM 0 H LYS A 423 15.519 7.659 8.724 1.00 0.00 H new ATOM 0 HA LYS A 423 15.610 6.532 11.308 1.00 0.00 H new ATOM 0 HB2 LYS A 423 15.161 4.399 10.216 1.00 0.00 H new ATOM 0 HB3 LYS A 423 16.375 4.712 8.991 1.00 0.00 H new ATOM 0 HG2 LYS A 423 18.142 4.665 10.758 1.00 0.00 H new ATOM 0 HG3 LYS A 423 16.916 4.299 11.955 1.00 0.00 H new ATOM 0 HD2 LYS A 423 16.348 2.206 10.789 1.00 0.00 H new ATOM 0 HD3 LYS A 423 17.476 2.585 9.502 1.00 0.00 H new ATOM 0 HE2 LYS A 423 18.202 2.125 12.425 1.00 0.00 H new ATOM 0 HE3 LYS A 423 18.447 0.982 11.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 20.493 2.033 11.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 19.830 2.810 10.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 19.807 3.578 11.554 1.00 0.00 H new ATOM 1068 N THR A 424 17.995 7.242 11.394 1.00 0.00 N ATOM 1069 CA THR A 424 19.321 7.846 11.468 1.00 0.00 C ATOM 1070 C THR A 424 20.357 6.971 10.769 1.00 0.00 C ATOM 1071 O THR A 424 20.305 5.744 10.853 1.00 0.00 O ATOM 1072 CB THR A 424 19.753 8.070 12.930 1.00 0.00 C ATOM 1073 OG1 THR A 424 18.801 8.909 13.599 1.00 0.00 O ATOM 1074 CG2 THR A 424 21.131 8.710 13.000 1.00 0.00 C ATOM 0 H THR A 424 17.586 7.013 12.300 1.00 0.00 H new ATOM 0 HA THR A 424 19.263 8.811 10.964 1.00 0.00 H new ATOM 0 HB THR A 424 19.796 7.099 13.423 1.00 0.00 H new ATOM 0 HG1 THR A 424 19.081 9.046 14.528 1.00 0.00 H new ATOM 0 HG21 THR A 424 21.411 8.857 14.043 1.00 0.00 H new ATOM 0 HG22 THR A 424 21.859 8.059 12.517 1.00 0.00 H new ATOM 0 HG23 THR A 424 21.111 9.673 12.491 1.00 0.00 H new ATOM 1082 N GLY A 425 21.296 7.609 10.076 1.00 0.00 N ATOM 1083 CA GLY A 425 22.329 6.872 9.372 1.00 0.00 C ATOM 1084 C GLY A 425 23.465 7.764 8.915 1.00 0.00 C ATOM 1085 O GLY A 425 24.635 7.407 9.047 1.00 0.00 O ATOM 0 H GLY A 425 21.359 8.623 9.990 1.00 0.00 H new ATOM 0 HA2 GLY A 425 22.723 6.092 10.023 1.00 0.00 H new ATOM 0 HA3 GLY A 425 21.891 6.374 8.507 1.00 0.00 H new ATOM 1089 N ASN A 426 23.120 8.929 8.376 1.00 0.00 N ATOM 1090 CA ASN A 426 24.120 9.878 7.902 1.00 0.00 C ATOM 1091 C ASN A 426 25.026 10.328 9.043 1.00 0.00 C ATOM 1092 O ASN A 426 24.573 10.488 10.175 1.00 0.00 O ATOM 1093 CB ASN A 426 23.443 11.090 7.258 1.00 0.00 C ATOM 1094 CG ASN A 426 22.511 11.814 8.211 1.00 0.00 C ATOM 1095 OD1 ASN A 426 22.934 12.315 9.252 1.00 0.00 O ATOM 1096 ND2 ASN A 426 21.233 11.874 7.855 1.00 0.00 N ATOM 0 H ASN A 426 22.155 9.238 8.257 1.00 0.00 H new ATOM 0 HA ASN A 426 24.733 9.377 7.153 1.00 0.00 H new ATOM 0 HB2 ASN A 426 24.207 11.783 6.906 1.00 0.00 H new ATOM 0 HB3 ASN A 426 22.880 10.765 6.383 1.00 0.00 H new ATOM 0 HD21 ASN A 426 20.558 12.350 8.454 1.00 0.00 H new ATOM 0 HD22 ASN A 426 20.926 11.444 6.982 1.00 0.00 H new ATOM 1103 N THR A 427 26.305 10.522 8.731 1.00 0.00 N ATOM 1104 CA THR A 427 27.296 10.953 9.716 1.00 0.00 C ATOM 1105 C THR A 427 27.345 10.010 10.917 1.00 0.00 C ATOM 1106 O THR A 427 27.371 10.451 12.066 1.00 0.00 O ATOM 1107 CB THR A 427 27.036 12.391 10.210 1.00 0.00 C ATOM 1108 OG1 THR A 427 25.798 12.460 10.927 1.00 0.00 O ATOM 1109 CG2 THR A 427 27.003 13.366 9.043 1.00 0.00 C ATOM 0 H THR A 427 26.683 10.386 7.794 1.00 0.00 H new ATOM 0 HA THR A 427 28.258 10.929 9.205 1.00 0.00 H new ATOM 0 HB THR A 427 27.852 12.667 10.878 1.00 0.00 H new ATOM 0 HG1 THR A 427 25.482 11.553 11.122 1.00 0.00 H new ATOM 0 HG21 THR A 427 26.818 14.373 9.416 1.00 0.00 H new ATOM 0 HG22 THR A 427 27.960 13.342 8.521 1.00 0.00 H new ATOM 0 HG23 THR A 427 26.207 13.082 8.354 1.00 0.00 H new ATOM 1117 N ASN A 428 27.374 8.709 10.640 1.00 0.00 N ATOM 1118 CA ASN A 428 27.437 7.701 11.685 1.00 0.00 C ATOM 1119 C ASN A 428 28.204 6.471 11.199 1.00 0.00 C ATOM 1120 O ASN A 428 29.199 6.597 10.486 1.00 0.00 O ATOM 1121 CB ASN A 428 26.030 7.299 12.146 1.00 0.00 C ATOM 1122 CG ASN A 428 25.334 8.385 12.945 1.00 0.00 C ATOM 1123 OD1 ASN A 428 25.034 9.460 12.430 1.00 0.00 O ATOM 1124 ND2 ASN A 428 25.074 8.107 14.217 1.00 0.00 N ATOM 0 H ASN A 428 27.355 8.330 9.693 1.00 0.00 H new ATOM 0 HA ASN A 428 27.966 8.131 12.535 1.00 0.00 H new ATOM 0 HB2 ASN A 428 25.424 7.053 11.274 1.00 0.00 H new ATOM 0 HB3 ASN A 428 26.097 6.396 12.753 1.00 0.00 H new ATOM 0 HD21 ASN A 428 24.609 8.798 14.805 1.00 0.00 H new ATOM 0 HD22 ASN A 428 25.340 7.202 14.606 1.00 0.00 H new ATOM 1131 N THR A 429 27.742 5.285 11.587 1.00 0.00 N ATOM 1132 CA THR A 429 28.394 4.046 11.185 1.00 0.00 C ATOM 1133 C THR A 429 28.345 3.861 9.671 1.00 0.00 C ATOM 1134 O THR A 429 27.302 4.058 9.048 1.00 0.00 O ATOM 1135 CB THR A 429 27.749 2.824 11.867 1.00 0.00 C ATOM 1136 OG1 THR A 429 28.384 1.622 11.419 1.00 0.00 O ATOM 1137 CG2 THR A 429 26.259 2.760 11.569 1.00 0.00 C ATOM 0 H THR A 429 26.920 5.158 12.178 1.00 0.00 H new ATOM 0 HA THR A 429 29.434 4.120 11.502 1.00 0.00 H new ATOM 0 HB THR A 429 27.882 2.925 12.944 1.00 0.00 H new ATOM 0 HG1 THR A 429 27.970 0.850 11.858 1.00 0.00 H new ATOM 0 HG21 THR A 429 25.827 1.889 12.061 1.00 0.00 H new ATOM 0 HG22 THR A 429 25.775 3.664 11.939 1.00 0.00 H new ATOM 0 HG23 THR A 429 26.106 2.681 10.493 1.00 0.00 H new ATOM 1145 N THR A 430 29.483 3.479 9.092 1.00 0.00 N ATOM 1146 CA THR A 430 29.585 3.259 7.651 1.00 0.00 C ATOM 1147 C THR A 430 29.001 4.427 6.858 1.00 0.00 C ATOM 1148 O THR A 430 28.176 4.233 5.964 1.00 0.00 O ATOM 1149 CB THR A 430 28.882 1.954 7.225 1.00 0.00 C ATOM 1150 OG1 THR A 430 27.485 2.020 7.533 1.00 0.00 O ATOM 1151 CG2 THR A 430 29.502 0.753 7.924 1.00 0.00 C ATOM 0 H THR A 430 30.351 3.315 9.602 1.00 0.00 H new ATOM 0 HA THR A 430 30.649 3.178 7.427 1.00 0.00 H new ATOM 0 HB THR A 430 29.009 1.837 6.149 1.00 0.00 H new ATOM 0 HG1 THR A 430 27.250 2.935 7.792 1.00 0.00 H new ATOM 0 HG21 THR A 430 28.990 -0.156 7.608 1.00 0.00 H new ATOM 0 HG22 THR A 430 30.558 0.685 7.662 1.00 0.00 H new ATOM 0 HG23 THR A 430 29.403 0.869 9.003 1.00 0.00 H new ATOM 1159 N GLY A 431 29.434 5.641 7.190 1.00 0.00 N ATOM 1160 CA GLY A 431 28.941 6.818 6.497 1.00 0.00 C ATOM 1161 C GLY A 431 29.729 8.067 6.839 1.00 0.00 C ATOM 1162 O GLY A 431 30.123 8.821 5.949 1.00 0.00 O ATOM 0 H GLY A 431 30.116 5.830 7.925 1.00 0.00 H new ATOM 0 HA2 GLY A 431 28.986 6.647 5.421 1.00 0.00 H new ATOM 0 HA3 GLY A 431 27.893 6.973 6.752 1.00 0.00 H new ATOM 1166 N SER A 432 29.962 8.285 8.128 1.00 0.00 N ATOM 1167 CA SER A 432 30.713 9.451 8.581 1.00 0.00 C ATOM 1168 C SER A 432 32.146 9.404 8.063 1.00 0.00 C ATOM 1169 O SER A 432 32.819 8.378 8.168 1.00 0.00 O ATOM 1170 CB SER A 432 30.710 9.527 10.110 1.00 0.00 C ATOM 1171 OG SER A 432 31.306 8.373 10.678 1.00 0.00 O ATOM 0 H SER A 432 29.643 7.671 8.877 1.00 0.00 H new ATOM 0 HA SER A 432 30.229 10.343 8.183 1.00 0.00 H new ATOM 0 HB2 SER A 432 31.250 10.416 10.434 1.00 0.00 H new ATOM 0 HB3 SER A 432 29.686 9.627 10.471 1.00 0.00 H new ATOM 0 HG SER A 432 30.658 7.637 10.679 1.00 0.00 H new ATOM 1177 N SER A 433 32.607 10.520 7.505 1.00 0.00 N ATOM 1178 CA SER A 433 33.962 10.610 6.967 1.00 0.00 C ATOM 1179 C SER A 433 34.366 12.065 6.757 1.00 0.00 C ATOM 1180 O SER A 433 33.681 12.954 7.306 1.00 0.00 O ATOM 1181 CB SER A 433 34.066 9.849 5.642 1.00 0.00 C ATOM 1182 OG SER A 433 33.788 8.470 5.815 1.00 0.00 O ATOM 1183 OXT SER A 433 35.365 12.305 6.047 1.00 0.00 O ATOM 0 H SER A 433 32.061 11.377 7.413 1.00 0.00 H new ATOM 0 HA SER A 433 34.640 10.158 7.691 1.00 0.00 H new ATOM 0 HB2 SER A 433 33.369 10.275 4.920 1.00 0.00 H new ATOM 0 HB3 SER A 433 35.067 9.971 5.228 1.00 0.00 H new ATOM 0 HG SER A 433 33.778 8.256 6.771 1.00 0.00 H new TER 1189 SER A 433