USER MOD reduce.3.24.130724 H: found=0, std=0, add=498, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 498 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 Single : A 411 MET CE :methyl -108:sc= -1.14 (180deg=-3.23!) USER MOD Single : A 413 LYS NZ :NH3+ -149:sc= -0.579 (180deg=-1.1) USER MOD Single : A 415 GLN : amide:sc= -6.15! K(o=-6.1!,f=-2.3) USER MOD Single : A 417 GLN : amide:sc= -2.51! C(o=-2.5!,f=-2!) USER MOD Single : A 418 HIS : no HD1:sc= -0.675 X(o=-0.67,f=-0.42) USER MOD Single : A 420 TYR OH : rot -174:sc= 0.028 USER MOD Single : A 421 THR OG1 : rot 180:sc= 0 USER MOD Single : A 423 THR OG1 : rot 45:sc= 0.536 USER MOD Single : A 425 THR OG1 : rot -38:sc= 0.545 USER MOD Single : A 429 GLN : amide:sc= -0.046 X(o=-0.046,f=-0.023) USER MOD Single : A 431 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.00202) USER MOD Single : A 442 GLN : amide:sc= -0.0021 X(o=-0.0021,f=0) USER MOD Single : A 443 ASN : amide:sc= -1.98! K(o=-2!,f=0.29) USER MOD Single : A 447 GLN : amide:sc= -1.37! C(o=-1.4!,f=-4!) USER MOD Single : A 453 MET CE :methyl 149:sc= -3.17 (180deg=-5.24!) USER MOD Single : A 456 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.535) USER MOD Single : A 458 SER OG : rot 180:sc= 0 USER MOD Single : A 476 ASN : amide:sc= -1.23 K(o=-1.2,f=-0.32) USER MOD Single : A 478 THR OG1 : rot -87:sc= -0.632 USER MOD ----------------------------------------------------------------- ATOM 82 N PRO A 407 -4.244 -1.317 -10.616 1.00 0.00 N ATOM 83 CA PRO A 407 -4.045 -1.550 -12.037 1.00 0.00 C ATOM 84 C PRO A 407 -5.385 -1.644 -12.769 1.00 0.00 C ATOM 85 O PRO A 407 -6.303 -2.321 -12.309 1.00 0.00 O ATOM 86 CB PRO A 407 -3.234 -2.833 -12.115 1.00 0.00 C ATOM 87 CG PRO A 407 -3.405 -3.518 -10.769 1.00 0.00 C ATOM 88 CD PRO A 407 -4.001 -2.506 -9.804 1.00 0.00 C ATOM 0 HA PRO A 407 -3.519 -0.732 -12.529 1.00 0.00 H new ATOM 0 HB2 PRO A 407 -3.589 -3.470 -12.925 1.00 0.00 H new ATOM 0 HB3 PRO A 407 -2.184 -2.619 -12.314 1.00 0.00 H new ATOM 0 HG2 PRO A 407 -4.057 -4.386 -10.863 1.00 0.00 H new ATOM 0 HG3 PRO A 407 -2.445 -3.879 -10.399 1.00 0.00 H new ATOM 0 HD2 PRO A 407 -4.925 -2.878 -9.361 1.00 0.00 H new ATOM 0 HD3 PRO A 407 -3.317 -2.292 -8.983 1.00 0.00 H new ATOM 96 N PRO A 408 -5.457 -0.937 -13.929 1.00 0.00 N ATOM 97 CA PRO A 408 -6.669 -0.934 -14.730 1.00 0.00 C ATOM 98 C PRO A 408 -6.830 -2.254 -15.485 1.00 0.00 C ATOM 99 O PRO A 408 -5.850 -2.822 -15.965 1.00 0.00 O ATOM 100 CB PRO A 408 -6.528 0.266 -15.653 1.00 0.00 C ATOM 101 CG PRO A 408 -5.049 0.614 -15.660 1.00 0.00 C ATOM 102 CD PRO A 408 -4.390 -0.123 -14.505 1.00 0.00 C ATOM 0 HA PRO A 408 -7.572 -0.850 -14.126 1.00 0.00 H new ATOM 0 HB2 PRO A 408 -6.878 0.029 -16.658 1.00 0.00 H new ATOM 0 HB3 PRO A 408 -7.125 1.105 -15.297 1.00 0.00 H new ATOM 0 HG2 PRO A 408 -4.593 0.324 -16.607 1.00 0.00 H new ATOM 0 HG3 PRO A 408 -4.910 1.690 -15.555 1.00 0.00 H new ATOM 0 HD2 PRO A 408 -3.562 -0.742 -14.851 1.00 0.00 H new ATOM 0 HD3 PRO A 408 -3.983 0.573 -13.772 1.00 0.00 H new ATOM 110 N GLY A 409 -8.074 -2.704 -15.568 1.00 0.00 N ATOM 111 CA GLY A 409 -8.375 -3.947 -16.257 1.00 0.00 C ATOM 112 C GLY A 409 -8.256 -5.143 -15.310 1.00 0.00 C ATOM 113 O GLY A 409 -8.807 -6.209 -15.578 1.00 0.00 O ATOM 0 H GLY A 409 -8.884 -2.230 -15.170 1.00 0.00 H new ATOM 0 HA2 GLY A 409 -9.383 -3.904 -16.668 1.00 0.00 H new ATOM 0 HA3 GLY A 409 -7.693 -4.075 -17.098 1.00 0.00 H new ATOM 117 N PHE A 410 -7.533 -4.924 -14.221 1.00 0.00 N ATOM 118 CA PHE A 410 -7.334 -5.970 -13.233 1.00 0.00 C ATOM 119 C PHE A 410 -8.592 -6.827 -13.080 1.00 0.00 C ATOM 120 O PHE A 410 -9.699 -6.366 -13.355 1.00 0.00 O ATOM 121 CB PHE A 410 -7.040 -5.277 -11.901 1.00 0.00 C ATOM 122 CG PHE A 410 -7.219 -6.178 -10.677 1.00 0.00 C ATOM 123 CD1 PHE A 410 -6.300 -7.141 -10.401 1.00 0.00 C ATOM 124 CD2 PHE A 410 -8.299 -6.015 -9.866 1.00 0.00 C ATOM 125 CE1 PHE A 410 -6.466 -7.977 -9.265 1.00 0.00 C ATOM 126 CE2 PHE A 410 -8.465 -6.851 -8.730 1.00 0.00 C ATOM 127 CZ PHE A 410 -7.546 -7.814 -8.454 1.00 0.00 C ATOM 0 H PHE A 410 -7.078 -4.038 -14.002 1.00 0.00 H new ATOM 0 HA PHE A 410 -6.517 -6.622 -13.542 1.00 0.00 H new ATOM 0 HB2 PHE A 410 -6.017 -4.902 -11.917 1.00 0.00 H new ATOM 0 HB3 PHE A 410 -7.695 -4.412 -11.801 1.00 0.00 H new ATOM 0 HD1 PHE A 410 -5.443 -7.270 -11.046 1.00 0.00 H new ATOM 0 HD2 PHE A 410 -9.030 -5.251 -10.086 1.00 0.00 H new ATOM 0 HE1 PHE A 410 -5.735 -8.741 -9.045 1.00 0.00 H new ATOM 0 HE2 PHE A 410 -9.322 -6.722 -8.085 1.00 0.00 H new ATOM 0 HZ PHE A 410 -7.673 -8.450 -7.590 1.00 0.00 H new ATOM 137 N MET A 411 -8.381 -8.060 -12.644 1.00 0.00 N ATOM 138 CA MET A 411 -9.484 -8.986 -12.452 1.00 0.00 C ATOM 139 C MET A 411 -9.621 -9.378 -10.979 1.00 0.00 C ATOM 140 O MET A 411 -10.581 -8.987 -10.316 1.00 0.00 O ATOM 141 CB MET A 411 -9.250 -10.241 -13.295 1.00 0.00 C ATOM 142 CG MET A 411 -9.103 -9.887 -14.776 1.00 0.00 C ATOM 143 SD MET A 411 -9.466 -11.315 -15.784 1.00 0.00 S ATOM 144 CE MET A 411 -8.064 -11.280 -16.888 1.00 0.00 C ATOM 0 H MET A 411 -7.462 -8.440 -12.418 1.00 0.00 H new ATOM 0 HA MET A 411 -10.405 -8.494 -12.765 1.00 0.00 H new ATOM 0 HB2 MET A 411 -8.352 -10.754 -12.949 1.00 0.00 H new ATOM 0 HB3 MET A 411 -10.082 -10.932 -13.164 1.00 0.00 H new ATOM 0 HG2 MET A 411 -9.778 -9.070 -15.032 1.00 0.00 H new ATOM 0 HG3 MET A 411 -8.090 -9.538 -14.976 1.00 0.00 H new ATOM 0 HE1 MET A 411 -8.390 -10.967 -17.880 1.00 0.00 H new ATOM 0 HE2 MET A 411 -7.322 -10.577 -16.511 1.00 0.00 H new ATOM 0 HE3 MET A 411 -7.623 -12.275 -16.948 1.00 0.00 H new ATOM 154 N PHE A 412 -8.648 -10.145 -10.511 1.00 0.00 N ATOM 155 CA PHE A 412 -8.648 -10.594 -9.129 1.00 0.00 C ATOM 156 C PHE A 412 -7.268 -11.113 -8.721 1.00 0.00 C ATOM 157 O PHE A 412 -6.351 -11.160 -9.540 1.00 0.00 O ATOM 158 CB PHE A 412 -9.659 -11.738 -9.031 1.00 0.00 C ATOM 159 CG PHE A 412 -9.509 -12.797 -10.125 1.00 0.00 C ATOM 160 CD1 PHE A 412 -8.543 -13.749 -10.022 1.00 0.00 C ATOM 161 CD2 PHE A 412 -10.342 -12.787 -11.200 1.00 0.00 C ATOM 162 CE1 PHE A 412 -8.403 -14.731 -11.038 1.00 0.00 C ATOM 163 CE2 PHE A 412 -10.202 -13.770 -12.215 1.00 0.00 C ATOM 164 CZ PHE A 412 -9.236 -14.721 -12.113 1.00 0.00 C ATOM 0 H PHE A 412 -7.854 -10.467 -11.064 1.00 0.00 H new ATOM 0 HA PHE A 412 -8.905 -9.766 -8.469 1.00 0.00 H new ATOM 0 HB2 PHE A 412 -9.555 -12.218 -8.058 1.00 0.00 H new ATOM 0 HB3 PHE A 412 -10.666 -11.324 -9.076 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -7.883 -13.758 -9.168 1.00 0.00 H new ATOM 0 HD2 PHE A 412 -11.110 -12.032 -11.282 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -7.635 -15.486 -10.957 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -10.863 -13.762 -13.069 1.00 0.00 H new ATOM 0 HZ PHE A 412 -9.130 -15.468 -12.885 1.00 0.00 H new ATOM 174 N LYS A 413 -7.162 -11.489 -7.455 1.00 0.00 N ATOM 175 CA LYS A 413 -5.909 -12.002 -6.928 1.00 0.00 C ATOM 176 C LYS A 413 -5.930 -13.531 -6.974 1.00 0.00 C ATOM 177 O LYS A 413 -6.981 -14.147 -6.802 1.00 0.00 O ATOM 178 CB LYS A 413 -5.641 -11.432 -5.534 1.00 0.00 C ATOM 179 CG LYS A 413 -4.309 -10.679 -5.496 1.00 0.00 C ATOM 180 CD LYS A 413 -3.130 -11.653 -5.450 1.00 0.00 C ATOM 181 CE LYS A 413 -3.335 -12.711 -4.364 1.00 0.00 C ATOM 182 NZ LYS A 413 -3.795 -12.081 -3.107 1.00 0.00 N ATOM 0 H LYS A 413 -7.924 -11.449 -6.778 1.00 0.00 H new ATOM 0 HA LYS A 413 -5.073 -11.675 -7.546 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -6.451 -10.760 -5.250 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -5.627 -12.241 -4.803 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -4.223 -10.040 -6.375 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -4.281 -10.027 -4.623 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -3.017 -12.139 -6.419 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -2.208 -11.104 -5.259 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -4.067 -13.446 -4.698 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -2.402 -13.247 -4.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -3.446 -12.630 -2.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -3.429 -11.109 -3.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -4.835 -12.060 -3.089 1.00 0.00 H new ATOM 196 N VAL A 414 -4.756 -14.100 -7.206 1.00 0.00 N ATOM 197 CA VAL A 414 -4.626 -15.546 -7.277 1.00 0.00 C ATOM 198 C VAL A 414 -3.527 -16.002 -6.316 1.00 0.00 C ATOM 199 O VAL A 414 -2.739 -15.188 -5.837 1.00 0.00 O ATOM 200 CB VAL A 414 -4.375 -15.979 -8.723 1.00 0.00 C ATOM 201 CG1 VAL A 414 -5.046 -15.019 -9.707 1.00 0.00 C ATOM 202 CG2 VAL A 414 -2.876 -16.096 -9.007 1.00 0.00 C ATOM 0 H VAL A 414 -3.886 -13.586 -7.347 1.00 0.00 H new ATOM 0 HA VAL A 414 -5.552 -16.029 -6.964 1.00 0.00 H new ATOM 0 HB VAL A 414 -4.820 -16.964 -8.860 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -4.852 -15.350 -10.727 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -6.121 -15.007 -9.528 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -4.644 -14.016 -9.568 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -2.725 -16.405 -10.041 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -2.398 -15.130 -8.843 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -2.436 -16.836 -8.339 1.00 0.00 H new ATOM 212 N GLN A 415 -3.508 -17.303 -6.064 1.00 0.00 N ATOM 213 CA GLN A 415 -2.517 -17.877 -5.169 1.00 0.00 C ATOM 214 C GLN A 415 -1.826 -19.068 -5.837 1.00 0.00 C ATOM 215 O GLN A 415 -2.478 -20.049 -6.192 1.00 0.00 O ATOM 216 CB GLN A 415 -3.152 -18.287 -3.839 1.00 0.00 C ATOM 217 CG GLN A 415 -2.136 -18.994 -2.941 1.00 0.00 C ATOM 218 CD GLN A 415 -1.392 -17.989 -2.058 1.00 0.00 C ATOM 219 OE1 GLN A 415 -1.966 -17.321 -1.214 1.00 0.00 O ATOM 220 NE2 GLN A 415 -0.085 -17.921 -2.299 1.00 0.00 N ATOM 0 H GLN A 415 -4.163 -17.976 -6.464 1.00 0.00 H new ATOM 0 HA GLN A 415 -1.765 -17.118 -4.956 1.00 0.00 H new ATOM 0 HB2 GLN A 415 -3.540 -17.405 -3.330 1.00 0.00 H new ATOM 0 HB3 GLN A 415 -4.000 -18.947 -4.025 1.00 0.00 H new ATOM 0 HG2 GLN A 415 -2.646 -19.726 -2.315 1.00 0.00 H new ATOM 0 HG3 GLN A 415 -1.422 -19.542 -3.555 1.00 0.00 H new ATOM 0 HE21 GLN A 415 0.332 -18.509 -3.021 1.00 0.00 H new ATOM 0 HE22 GLN A 415 0.500 -17.281 -1.762 1.00 0.00 H new ATOM 229 N ALA A 416 -0.516 -18.942 -5.987 1.00 0.00 N ATOM 230 CA ALA A 416 0.271 -19.996 -6.606 1.00 0.00 C ATOM 231 C ALA A 416 0.282 -21.222 -5.691 1.00 0.00 C ATOM 232 O ALA A 416 0.269 -21.088 -4.468 1.00 0.00 O ATOM 233 CB ALA A 416 1.679 -19.475 -6.901 1.00 0.00 C ATOM 0 H ALA A 416 0.021 -18.127 -5.691 1.00 0.00 H new ATOM 0 HA ALA A 416 -0.170 -20.298 -7.556 1.00 0.00 H new ATOM 0 HB1 ALA A 416 2.269 -20.265 -7.365 1.00 0.00 H new ATOM 0 HB2 ALA A 416 1.617 -18.623 -7.578 1.00 0.00 H new ATOM 0 HB3 ALA A 416 2.155 -19.165 -5.970 1.00 0.00 H new ATOM 239 N GLN A 417 0.307 -22.389 -6.318 1.00 0.00 N ATOM 240 CA GLN A 417 0.321 -23.637 -5.575 1.00 0.00 C ATOM 241 C GLN A 417 1.623 -24.396 -5.836 1.00 0.00 C ATOM 242 O GLN A 417 1.858 -25.453 -5.252 1.00 0.00 O ATOM 243 CB GLN A 417 -0.895 -24.498 -5.926 1.00 0.00 C ATOM 244 CG GLN A 417 -2.101 -23.625 -6.277 1.00 0.00 C ATOM 245 CD GLN A 417 -3.381 -24.460 -6.346 1.00 0.00 C ATOM 246 OE1 GLN A 417 -3.755 -25.148 -5.410 1.00 0.00 O ATOM 247 NE2 GLN A 417 -4.029 -24.363 -7.503 1.00 0.00 N ATOM 0 H GLN A 417 0.318 -22.496 -7.332 1.00 0.00 H new ATOM 0 HA GLN A 417 0.266 -23.404 -4.512 1.00 0.00 H new ATOM 0 HB2 GLN A 417 -0.654 -25.148 -6.768 1.00 0.00 H new ATOM 0 HB3 GLN A 417 -1.142 -25.145 -5.084 1.00 0.00 H new ATOM 0 HG2 GLN A 417 -2.215 -22.839 -5.530 1.00 0.00 H new ATOM 0 HG3 GLN A 417 -1.932 -23.133 -7.235 1.00 0.00 H new ATOM 0 HE21 GLN A 417 -3.661 -23.769 -8.246 1.00 0.00 H new ATOM 0 HE22 GLN A 417 -4.894 -24.883 -7.648 1.00 0.00 H new ATOM 256 N HIS A 418 2.436 -23.827 -6.715 1.00 0.00 N ATOM 257 CA HIS A 418 3.709 -24.437 -7.060 1.00 0.00 C ATOM 258 C HIS A 418 4.742 -23.344 -7.343 1.00 0.00 C ATOM 259 O HIS A 418 4.393 -22.169 -7.452 1.00 0.00 O ATOM 260 CB HIS A 418 3.545 -25.413 -8.227 1.00 0.00 C ATOM 261 CG HIS A 418 2.664 -26.599 -7.915 1.00 0.00 C ATOM 262 ND1 HIS A 418 3.162 -27.797 -7.432 1.00 0.00 N ATOM 263 CD2 HIS A 418 1.313 -26.759 -8.022 1.00 0.00 C ATOM 264 CE1 HIS A 418 2.148 -28.633 -7.261 1.00 0.00 C ATOM 265 NE2 HIS A 418 1.003 -27.988 -7.627 1.00 0.00 N ATOM 0 H HIS A 418 2.238 -22.951 -7.198 1.00 0.00 H new ATOM 0 HA HIS A 418 4.074 -25.025 -6.218 1.00 0.00 H new ATOM 0 HB2 HIS A 418 3.128 -24.877 -9.080 1.00 0.00 H new ATOM 0 HB3 HIS A 418 4.529 -25.773 -8.527 1.00 0.00 H new ATOM 0 HD2 HIS A 418 0.614 -26.012 -8.369 1.00 0.00 H new ATOM 0 HE1 HIS A 418 2.216 -29.647 -6.896 1.00 0.00 H new ATOM 0 HE2 HIS A 418 0.064 -28.385 -7.601 1.00 0.00 H new ATOM 273 N ASP A 419 5.991 -23.769 -7.453 1.00 0.00 N ATOM 274 CA ASP A 419 7.077 -22.842 -7.721 1.00 0.00 C ATOM 275 C ASP A 419 7.519 -22.988 -9.179 1.00 0.00 C ATOM 276 O ASP A 419 8.235 -23.926 -9.523 1.00 0.00 O ATOM 277 CB ASP A 419 8.285 -23.135 -6.829 1.00 0.00 C ATOM 278 CG ASP A 419 8.512 -24.615 -6.514 1.00 0.00 C ATOM 279 OD1 ASP A 419 9.238 -25.258 -7.302 1.00 0.00 O ATOM 280 OD2 ASP A 419 7.954 -25.069 -5.492 1.00 0.00 O ATOM 0 H ASP A 419 6.276 -24.744 -7.361 1.00 0.00 H new ATOM 0 HA ASP A 419 6.716 -21.833 -7.519 1.00 0.00 H new ATOM 0 HB2 ASP A 419 9.179 -22.741 -7.312 1.00 0.00 H new ATOM 0 HB3 ASP A 419 8.165 -22.594 -5.891 1.00 0.00 H new ATOM 285 N TYR A 420 7.073 -22.045 -9.996 1.00 0.00 N ATOM 286 CA TYR A 420 7.414 -22.057 -11.409 1.00 0.00 C ATOM 287 C TYR A 420 8.427 -20.958 -11.738 1.00 0.00 C ATOM 288 O TYR A 420 8.070 -19.784 -11.821 1.00 0.00 O ATOM 289 CB TYR A 420 6.111 -21.774 -12.159 1.00 0.00 C ATOM 290 CG TYR A 420 6.304 -21.027 -13.480 1.00 0.00 C ATOM 291 CD1 TYR A 420 6.973 -21.632 -14.524 1.00 0.00 C ATOM 292 CD2 TYR A 420 5.808 -19.747 -13.628 1.00 0.00 C ATOM 293 CE1 TYR A 420 7.154 -20.929 -15.768 1.00 0.00 C ATOM 294 CE2 TYR A 420 5.989 -19.044 -14.871 1.00 0.00 C ATOM 295 CZ TYR A 420 6.653 -19.669 -15.880 1.00 0.00 C ATOM 296 OH TYR A 420 6.824 -19.005 -17.054 1.00 0.00 O ATOM 0 H TYR A 420 6.479 -21.268 -9.707 1.00 0.00 H new ATOM 0 HA TYR A 420 7.859 -23.012 -11.689 1.00 0.00 H new ATOM 0 HB2 TYR A 420 5.606 -22.719 -12.358 1.00 0.00 H new ATOM 0 HB3 TYR A 420 5.453 -21.190 -11.516 1.00 0.00 H new ATOM 0 HD1 TYR A 420 7.361 -22.633 -14.408 1.00 0.00 H new ATOM 0 HD2 TYR A 420 5.284 -19.273 -12.811 1.00 0.00 H new ATOM 0 HE1 TYR A 420 7.675 -21.391 -16.593 1.00 0.00 H new ATOM 0 HE2 TYR A 420 5.606 -18.042 -14.999 1.00 0.00 H new ATOM 0 HH TYR A 420 6.500 -18.085 -16.960 1.00 0.00 H new ATOM 306 N THR A 421 9.671 -21.378 -11.916 1.00 0.00 N ATOM 307 CA THR A 421 10.738 -20.445 -12.234 1.00 0.00 C ATOM 308 C THR A 421 10.668 -20.037 -13.707 1.00 0.00 C ATOM 309 O THR A 421 10.895 -20.860 -14.593 1.00 0.00 O ATOM 310 CB THR A 421 12.067 -21.095 -11.845 1.00 0.00 C ATOM 311 OG1 THR A 421 12.208 -20.796 -10.459 1.00 0.00 O ATOM 312 CG2 THR A 421 13.268 -20.409 -12.499 1.00 0.00 C ATOM 0 H THR A 421 9.964 -22.353 -11.846 1.00 0.00 H new ATOM 0 HA THR A 421 10.636 -19.519 -11.668 1.00 0.00 H new ATOM 0 HB THR A 421 12.052 -22.148 -12.128 1.00 0.00 H new ATOM 0 HG1 THR A 421 13.044 -21.182 -10.124 1.00 0.00 H new ATOM 0 HG21 THR A 421 14.186 -20.909 -12.190 1.00 0.00 H new ATOM 0 HG22 THR A 421 13.172 -20.464 -13.583 1.00 0.00 H new ATOM 0 HG23 THR A 421 13.303 -19.364 -12.190 1.00 0.00 H new ATOM 320 N ALA A 422 10.354 -18.769 -13.923 1.00 0.00 N ATOM 321 CA ALA A 422 10.252 -18.242 -15.273 1.00 0.00 C ATOM 322 C ALA A 422 11.369 -17.222 -15.504 1.00 0.00 C ATOM 323 O ALA A 422 11.431 -16.200 -14.823 1.00 0.00 O ATOM 324 CB ALA A 422 8.861 -17.642 -15.484 1.00 0.00 C ATOM 0 H ALA A 422 10.167 -18.090 -13.185 1.00 0.00 H new ATOM 0 HA ALA A 422 10.377 -19.039 -16.006 1.00 0.00 H new ATOM 0 HB1 ALA A 422 8.785 -17.247 -16.497 1.00 0.00 H new ATOM 0 HB2 ALA A 422 8.106 -18.414 -15.338 1.00 0.00 H new ATOM 0 HB3 ALA A 422 8.700 -16.837 -14.767 1.00 0.00 H new ATOM 330 N THR A 423 12.223 -17.535 -16.467 1.00 0.00 N ATOM 331 CA THR A 423 13.334 -16.658 -16.796 1.00 0.00 C ATOM 332 C THR A 423 13.206 -16.151 -18.234 1.00 0.00 C ATOM 333 O THR A 423 13.623 -16.827 -19.174 1.00 0.00 O ATOM 334 CB THR A 423 14.633 -17.422 -16.534 1.00 0.00 C ATOM 335 OG1 THR A 423 14.468 -18.643 -17.250 1.00 0.00 O ATOM 336 CG2 THR A 423 14.771 -17.860 -15.075 1.00 0.00 C ATOM 0 H THR A 423 12.168 -18.384 -17.030 1.00 0.00 H new ATOM 0 HA THR A 423 13.333 -15.766 -16.169 1.00 0.00 H new ATOM 0 HB THR A 423 15.483 -16.796 -16.806 1.00 0.00 H new ATOM 0 HG1 THR A 423 14.109 -18.453 -18.142 1.00 0.00 H new ATOM 0 HG21 THR A 423 15.710 -18.398 -14.944 1.00 0.00 H new ATOM 0 HG22 THR A 423 14.762 -16.982 -14.429 1.00 0.00 H new ATOM 0 HG23 THR A 423 13.939 -18.513 -14.811 1.00 0.00 H new ATOM 344 N ASP A 424 12.627 -14.966 -18.361 1.00 0.00 N ATOM 345 CA ASP A 424 12.439 -14.362 -19.669 1.00 0.00 C ATOM 346 C ASP A 424 12.708 -12.859 -19.575 1.00 0.00 C ATOM 347 O ASP A 424 13.106 -12.361 -18.523 1.00 0.00 O ATOM 348 CB ASP A 424 11.004 -14.555 -20.164 1.00 0.00 C ATOM 349 CG ASP A 424 10.850 -14.641 -21.684 1.00 0.00 C ATOM 350 OD1 ASP A 424 10.932 -15.777 -22.199 1.00 0.00 O ATOM 351 OD2 ASP A 424 10.654 -13.569 -22.296 1.00 0.00 O ATOM 0 H ASP A 424 12.282 -14.408 -17.580 1.00 0.00 H new ATOM 0 HA ASP A 424 13.128 -14.842 -20.364 1.00 0.00 H new ATOM 0 HB2 ASP A 424 10.602 -15.466 -19.721 1.00 0.00 H new ATOM 0 HB3 ASP A 424 10.395 -13.728 -19.798 1.00 0.00 H new ATOM 356 N THR A 425 12.481 -12.178 -20.689 1.00 0.00 N ATOM 357 CA THR A 425 12.694 -10.742 -20.745 1.00 0.00 C ATOM 358 C THR A 425 11.496 -10.001 -20.148 1.00 0.00 C ATOM 359 O THR A 425 11.514 -8.777 -20.033 1.00 0.00 O ATOM 360 CB THR A 425 12.980 -10.363 -22.199 1.00 0.00 C ATOM 361 OG1 THR A 425 13.364 -8.992 -22.132 1.00 0.00 O ATOM 362 CG2 THR A 425 11.716 -10.354 -23.061 1.00 0.00 C ATOM 0 H THR A 425 12.152 -12.595 -21.560 1.00 0.00 H new ATOM 0 HA THR A 425 13.552 -10.446 -20.142 1.00 0.00 H new ATOM 0 HB THR A 425 13.702 -11.062 -22.621 1.00 0.00 H new ATOM 0 HG1 THR A 425 12.813 -8.530 -21.466 1.00 0.00 H new ATOM 0 HG21 THR A 425 11.975 -10.079 -24.083 1.00 0.00 H new ATOM 0 HG22 THR A 425 11.265 -11.346 -23.055 1.00 0.00 H new ATOM 0 HG23 THR A 425 11.007 -9.631 -22.659 1.00 0.00 H new ATOM 370 N ASP A 426 10.484 -10.775 -19.785 1.00 0.00 N ATOM 371 CA ASP A 426 9.279 -10.207 -19.203 1.00 0.00 C ATOM 372 C ASP A 426 8.385 -11.337 -18.690 1.00 0.00 C ATOM 373 O ASP A 426 7.176 -11.329 -18.918 1.00 0.00 O ATOM 374 CB ASP A 426 8.487 -9.412 -20.243 1.00 0.00 C ATOM 375 CG ASP A 426 7.782 -8.166 -19.704 1.00 0.00 C ATOM 376 OD1 ASP A 426 8.075 -7.806 -18.543 1.00 0.00 O ATOM 377 OD2 ASP A 426 6.967 -7.601 -20.465 1.00 0.00 O ATOM 0 H ASP A 426 10.473 -11.790 -19.882 1.00 0.00 H new ATOM 0 HA ASP A 426 9.577 -9.543 -18.392 1.00 0.00 H new ATOM 0 HB2 ASP A 426 9.165 -9.111 -21.042 1.00 0.00 H new ATOM 0 HB3 ASP A 426 7.741 -10.069 -20.689 1.00 0.00 H new ATOM 382 N GLU A 427 9.013 -12.283 -18.007 1.00 0.00 N ATOM 383 CA GLU A 427 8.289 -13.418 -17.460 1.00 0.00 C ATOM 384 C GLU A 427 7.837 -13.119 -16.029 1.00 0.00 C ATOM 385 O GLU A 427 8.249 -12.121 -15.440 1.00 0.00 O ATOM 386 CB GLU A 427 9.140 -14.688 -17.513 1.00 0.00 C ATOM 387 CG GLU A 427 8.484 -15.751 -18.397 1.00 0.00 C ATOM 388 CD GLU A 427 7.012 -15.942 -18.025 1.00 0.00 C ATOM 389 OE1 GLU A 427 6.755 -16.159 -16.821 1.00 0.00 O ATOM 390 OE2 GLU A 427 6.178 -15.867 -18.952 1.00 0.00 O ATOM 0 H GLU A 427 10.016 -12.287 -17.820 1.00 0.00 H new ATOM 0 HA GLU A 427 7.403 -13.589 -18.072 1.00 0.00 H new ATOM 0 HB2 GLU A 427 10.131 -14.450 -17.899 1.00 0.00 H new ATOM 0 HB3 GLU A 427 9.276 -15.081 -16.506 1.00 0.00 H new ATOM 0 HG2 GLU A 427 8.563 -15.458 -19.444 1.00 0.00 H new ATOM 0 HG3 GLU A 427 9.015 -16.697 -18.290 1.00 0.00 H new ATOM 397 N LEU A 428 6.998 -14.003 -15.510 1.00 0.00 N ATOM 398 CA LEU A 428 6.486 -13.847 -14.160 1.00 0.00 C ATOM 399 C LEU A 428 6.864 -15.075 -13.330 1.00 0.00 C ATOM 400 O LEU A 428 6.405 -16.182 -13.608 1.00 0.00 O ATOM 401 CB LEU A 428 4.983 -13.562 -14.186 1.00 0.00 C ATOM 402 CG LEU A 428 4.446 -12.689 -13.049 1.00 0.00 C ATOM 403 CD1 LEU A 428 4.809 -11.219 -13.269 1.00 0.00 C ATOM 404 CD2 LEU A 428 2.940 -12.887 -12.871 1.00 0.00 C ATOM 0 H LEU A 428 6.660 -14.831 -16.001 1.00 0.00 H new ATOM 0 HA LEU A 428 6.943 -12.983 -13.678 1.00 0.00 H new ATOM 0 HB2 LEU A 428 4.741 -13.080 -15.133 1.00 0.00 H new ATOM 0 HB3 LEU A 428 4.452 -14.514 -14.168 1.00 0.00 H new ATOM 0 HG LEU A 428 4.924 -13.003 -12.121 1.00 0.00 H new ATOM 0 HD11 LEU A 428 4.416 -10.620 -12.447 1.00 0.00 H new ATOM 0 HD12 LEU A 428 5.893 -11.114 -13.308 1.00 0.00 H new ATOM 0 HD13 LEU A 428 4.377 -10.874 -14.208 1.00 0.00 H new ATOM 0 HD21 LEU A 428 2.584 -12.256 -12.057 1.00 0.00 H new ATOM 0 HD22 LEU A 428 2.426 -12.615 -13.793 1.00 0.00 H new ATOM 0 HD23 LEU A 428 2.736 -13.932 -12.636 1.00 0.00 H new ATOM 416 N GLN A 429 7.698 -14.839 -12.328 1.00 0.00 N ATOM 417 CA GLN A 429 8.144 -15.913 -11.456 1.00 0.00 C ATOM 418 C GLN A 429 7.169 -16.089 -10.290 1.00 0.00 C ATOM 419 O GLN A 429 6.765 -15.113 -9.660 1.00 0.00 O ATOM 420 CB GLN A 429 9.564 -15.654 -10.949 1.00 0.00 C ATOM 421 CG GLN A 429 10.224 -16.952 -10.480 1.00 0.00 C ATOM 422 CD GLN A 429 11.746 -16.871 -10.608 1.00 0.00 C ATOM 423 OE1 GLN A 429 12.483 -16.972 -9.641 1.00 0.00 O ATOM 424 NE2 GLN A 429 12.175 -16.683 -11.853 1.00 0.00 N ATOM 0 H GLN A 429 8.077 -13.920 -12.100 1.00 0.00 H new ATOM 0 HA GLN A 429 8.163 -16.838 -12.032 1.00 0.00 H new ATOM 0 HB2 GLN A 429 10.161 -15.204 -11.743 1.00 0.00 H new ATOM 0 HB3 GLN A 429 9.536 -14.939 -10.127 1.00 0.00 H new ATOM 0 HG2 GLN A 429 9.953 -17.148 -9.443 1.00 0.00 H new ATOM 0 HG3 GLN A 429 9.850 -17.788 -11.071 1.00 0.00 H new ATOM 0 HE21 GLN A 429 11.504 -16.607 -12.618 1.00 0.00 H new ATOM 0 HE22 GLN A 429 13.175 -16.615 -12.043 1.00 0.00 H new ATOM 433 N LEU A 430 6.818 -17.342 -10.038 1.00 0.00 N ATOM 434 CA LEU A 430 5.898 -17.658 -8.959 1.00 0.00 C ATOM 435 C LEU A 430 6.532 -18.709 -8.045 1.00 0.00 C ATOM 436 O LEU A 430 7.347 -19.515 -8.492 1.00 0.00 O ATOM 437 CB LEU A 430 4.536 -18.074 -9.520 1.00 0.00 C ATOM 438 CG LEU A 430 3.529 -16.943 -9.741 1.00 0.00 C ATOM 439 CD1 LEU A 430 3.375 -16.629 -11.231 1.00 0.00 C ATOM 440 CD2 LEU A 430 2.187 -17.268 -9.082 1.00 0.00 C ATOM 0 H LEU A 430 7.154 -18.150 -10.562 1.00 0.00 H new ATOM 0 HA LEU A 430 5.710 -16.775 -8.349 1.00 0.00 H new ATOM 0 HB2 LEU A 430 4.697 -18.582 -10.471 1.00 0.00 H new ATOM 0 HB3 LEU A 430 4.092 -18.802 -8.841 1.00 0.00 H new ATOM 0 HG LEU A 430 3.914 -16.044 -9.261 1.00 0.00 H new ATOM 0 HD11 LEU A 430 2.654 -15.822 -11.360 1.00 0.00 H new ATOM 0 HD12 LEU A 430 4.338 -16.324 -11.640 1.00 0.00 H new ATOM 0 HD13 LEU A 430 3.023 -17.517 -11.756 1.00 0.00 H new ATOM 0 HD21 LEU A 430 1.489 -16.448 -9.254 1.00 0.00 H new ATOM 0 HD22 LEU A 430 1.783 -18.185 -9.512 1.00 0.00 H new ATOM 0 HD23 LEU A 430 2.331 -17.403 -8.010 1.00 0.00 H new ATOM 452 N LYS A 431 6.135 -18.665 -6.782 1.00 0.00 N ATOM 453 CA LYS A 431 6.654 -19.603 -5.801 1.00 0.00 C ATOM 454 C LYS A 431 5.487 -20.276 -5.077 1.00 0.00 C ATOM 455 O LYS A 431 4.537 -19.609 -4.669 1.00 0.00 O ATOM 456 CB LYS A 431 7.641 -18.906 -4.863 1.00 0.00 C ATOM 457 CG LYS A 431 6.935 -17.842 -4.018 1.00 0.00 C ATOM 458 CD LYS A 431 6.937 -16.488 -4.729 1.00 0.00 C ATOM 459 CE LYS A 431 8.335 -15.867 -4.724 1.00 0.00 C ATOM 460 NZ LYS A 431 8.622 -15.246 -3.412 1.00 0.00 N ATOM 0 H LYS A 431 5.460 -17.994 -6.415 1.00 0.00 H new ATOM 0 HA LYS A 431 7.222 -20.393 -6.293 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.110 -19.642 -4.210 1.00 0.00 H new ATOM 0 HB3 LYS A 431 8.438 -18.443 -5.446 1.00 0.00 H new ATOM 0 HG2 LYS A 431 5.909 -18.151 -3.820 1.00 0.00 H new ATOM 0 HG3 LYS A 431 7.432 -17.751 -3.052 1.00 0.00 H new ATOM 0 HD2 LYS A 431 6.594 -16.612 -5.756 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.235 -15.815 -4.238 1.00 0.00 H new ATOM 0 HE2 LYS A 431 9.080 -16.632 -4.941 1.00 0.00 H new ATOM 0 HE3 LYS A 431 8.409 -15.117 -5.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.185 -14.383 -3.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 7.728 -15.003 -2.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 9.155 -15.915 -2.821 1.00 0.00 H new ATOM 474 N ALA A 432 5.595 -21.589 -4.939 1.00 0.00 N ATOM 475 CA ALA A 432 4.560 -22.360 -4.270 1.00 0.00 C ATOM 476 C ALA A 432 4.039 -21.570 -3.068 1.00 0.00 C ATOM 477 O ALA A 432 4.675 -21.543 -2.016 1.00 0.00 O ATOM 478 CB ALA A 432 5.118 -23.727 -3.872 1.00 0.00 C ATOM 0 H ALA A 432 6.384 -22.139 -5.279 1.00 0.00 H new ATOM 0 HA ALA A 432 3.718 -22.535 -4.940 1.00 0.00 H new ATOM 0 HB1 ALA A 432 4.342 -24.305 -3.370 1.00 0.00 H new ATOM 0 HB2 ALA A 432 5.447 -24.259 -4.764 1.00 0.00 H new ATOM 0 HB3 ALA A 432 5.963 -23.592 -3.197 1.00 0.00 H new ATOM 484 N GLY A 433 2.887 -20.946 -3.265 1.00 0.00 N ATOM 485 CA GLY A 433 2.273 -20.158 -2.210 1.00 0.00 C ATOM 486 C GLY A 433 2.570 -18.669 -2.394 1.00 0.00 C ATOM 487 O GLY A 433 2.903 -17.975 -1.435 1.00 0.00 O ATOM 0 H GLY A 433 2.363 -20.970 -4.140 1.00 0.00 H new ATOM 0 HA2 GLY A 433 1.195 -20.320 -2.211 1.00 0.00 H new ATOM 0 HA3 GLY A 433 2.645 -20.489 -1.240 1.00 0.00 H new ATOM 491 N ASP A 434 2.439 -18.221 -3.634 1.00 0.00 N ATOM 492 CA ASP A 434 2.690 -16.826 -3.957 1.00 0.00 C ATOM 493 C ASP A 434 1.365 -16.141 -4.301 1.00 0.00 C ATOM 494 O ASP A 434 0.347 -16.807 -4.483 1.00 0.00 O ATOM 495 CB ASP A 434 3.616 -16.699 -5.168 1.00 0.00 C ATOM 496 CG ASP A 434 3.882 -15.265 -5.631 1.00 0.00 C ATOM 497 OD1 ASP A 434 4.287 -14.456 -4.768 1.00 0.00 O ATOM 498 OD2 ASP A 434 3.674 -15.011 -6.837 1.00 0.00 O ATOM 0 H ASP A 434 2.162 -18.799 -4.427 1.00 0.00 H new ATOM 0 HA ASP A 434 3.161 -16.359 -3.092 1.00 0.00 H new ATOM 0 HB2 ASP A 434 4.569 -17.170 -4.929 1.00 0.00 H new ATOM 0 HB3 ASP A 434 3.183 -17.258 -5.998 1.00 0.00 H new ATOM 503 N VAL A 435 1.422 -14.820 -4.378 1.00 0.00 N ATOM 504 CA VAL A 435 0.240 -14.037 -4.697 1.00 0.00 C ATOM 505 C VAL A 435 0.446 -13.334 -6.040 1.00 0.00 C ATOM 506 O VAL A 435 1.444 -12.641 -6.236 1.00 0.00 O ATOM 507 CB VAL A 435 -0.068 -13.067 -3.555 1.00 0.00 C ATOM 508 CG1 VAL A 435 -0.860 -13.760 -2.445 1.00 0.00 C ATOM 509 CG2 VAL A 435 1.216 -12.442 -3.005 1.00 0.00 C ATOM 0 H VAL A 435 2.268 -14.272 -4.225 1.00 0.00 H new ATOM 0 HA VAL A 435 -0.631 -14.684 -4.800 1.00 0.00 H new ATOM 0 HB VAL A 435 -0.686 -12.264 -3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 435 -1.066 -13.048 -1.646 1.00 0.00 H new ATOM 0 HG12 VAL A 435 -1.801 -14.134 -2.849 1.00 0.00 H new ATOM 0 HG13 VAL A 435 -0.279 -14.593 -2.049 1.00 0.00 H new ATOM 0 HG21 VAL A 435 0.969 -11.757 -2.194 1.00 0.00 H new ATOM 0 HG22 VAL A 435 1.871 -13.228 -2.629 1.00 0.00 H new ATOM 0 HG23 VAL A 435 1.724 -11.896 -3.800 1.00 0.00 H new ATOM 519 N VAL A 436 -0.513 -13.537 -6.931 1.00 0.00 N ATOM 520 CA VAL A 436 -0.450 -12.931 -8.250 1.00 0.00 C ATOM 521 C VAL A 436 -1.833 -12.397 -8.629 1.00 0.00 C ATOM 522 O VAL A 436 -2.844 -13.050 -8.376 1.00 0.00 O ATOM 523 CB VAL A 436 0.100 -13.938 -9.263 1.00 0.00 C ATOM 524 CG1 VAL A 436 -0.253 -13.525 -10.693 1.00 0.00 C ATOM 525 CG2 VAL A 436 1.611 -14.111 -9.099 1.00 0.00 C ATOM 0 H VAL A 436 -1.338 -14.113 -6.765 1.00 0.00 H new ATOM 0 HA VAL A 436 0.236 -12.084 -8.248 1.00 0.00 H new ATOM 0 HB VAL A 436 -0.370 -14.902 -9.067 1.00 0.00 H new ATOM 0 HG11 VAL A 436 0.149 -14.257 -11.393 1.00 0.00 H new ATOM 0 HG12 VAL A 436 -1.337 -13.477 -10.801 1.00 0.00 H new ATOM 0 HG13 VAL A 436 0.176 -12.546 -10.905 1.00 0.00 H new ATOM 0 HG21 VAL A 436 1.976 -14.832 -9.831 1.00 0.00 H new ATOM 0 HG22 VAL A 436 2.106 -13.153 -9.255 1.00 0.00 H new ATOM 0 HG23 VAL A 436 1.829 -14.472 -8.094 1.00 0.00 H new ATOM 535 N LEU A 437 -1.832 -11.215 -9.228 1.00 0.00 N ATOM 536 CA LEU A 437 -3.074 -10.586 -9.644 1.00 0.00 C ATOM 537 C LEU A 437 -3.287 -10.828 -11.139 1.00 0.00 C ATOM 538 O LEU A 437 -2.370 -10.645 -11.938 1.00 0.00 O ATOM 539 CB LEU A 437 -3.083 -9.107 -9.252 1.00 0.00 C ATOM 540 CG LEU A 437 -1.746 -8.529 -8.784 1.00 0.00 C ATOM 541 CD1 LEU A 437 -1.813 -7.004 -8.684 1.00 0.00 C ATOM 542 CD2 LEU A 437 -1.302 -9.171 -7.468 1.00 0.00 C ATOM 0 H LEU A 437 -0.991 -10.676 -9.435 1.00 0.00 H new ATOM 0 HA LEU A 437 -3.921 -11.034 -9.125 1.00 0.00 H new ATOM 0 HB2 LEU A 437 -3.427 -8.527 -10.108 1.00 0.00 H new ATOM 0 HB3 LEU A 437 -3.815 -8.967 -8.457 1.00 0.00 H new ATOM 0 HG LEU A 437 -0.989 -8.770 -9.531 1.00 0.00 H new ATOM 0 HD11 LEU A 437 -0.850 -6.619 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU A 437 -2.051 -6.585 -9.662 1.00 0.00 H new ATOM 0 HD13 LEU A 437 -2.586 -6.720 -7.970 1.00 0.00 H new ATOM 0 HD21 LEU A 437 -0.349 -8.743 -7.157 1.00 0.00 H new ATOM 0 HD22 LEU A 437 -2.052 -8.983 -6.700 1.00 0.00 H new ATOM 0 HD23 LEU A 437 -1.188 -10.246 -7.608 1.00 0.00 H new ATOM 554 N VAL A 438 -4.504 -11.234 -11.473 1.00 0.00 N ATOM 555 CA VAL A 438 -4.849 -11.502 -12.859 1.00 0.00 C ATOM 556 C VAL A 438 -5.261 -10.195 -13.539 1.00 0.00 C ATOM 557 O VAL A 438 -6.305 -9.628 -13.222 1.00 0.00 O ATOM 558 CB VAL A 438 -5.932 -12.580 -12.929 1.00 0.00 C ATOM 559 CG1 VAL A 438 -6.549 -12.647 -14.328 1.00 0.00 C ATOM 560 CG2 VAL A 438 -5.378 -13.942 -12.508 1.00 0.00 C ATOM 0 H VAL A 438 -5.263 -11.384 -10.808 1.00 0.00 H new ATOM 0 HA VAL A 438 -3.986 -11.891 -13.399 1.00 0.00 H new ATOM 0 HB VAL A 438 -6.721 -12.308 -12.228 1.00 0.00 H new ATOM 0 HG11 VAL A 438 -7.316 -13.421 -14.351 1.00 0.00 H new ATOM 0 HG12 VAL A 438 -6.998 -11.685 -14.574 1.00 0.00 H new ATOM 0 HG13 VAL A 438 -5.774 -12.883 -15.057 1.00 0.00 H new ATOM 0 HG21 VAL A 438 -6.168 -14.690 -12.567 1.00 0.00 H new ATOM 0 HG22 VAL A 438 -4.561 -14.224 -13.173 1.00 0.00 H new ATOM 0 HG23 VAL A 438 -5.009 -13.884 -11.484 1.00 0.00 H new ATOM 570 N ILE A 439 -4.419 -9.755 -14.463 1.00 0.00 N ATOM 571 CA ILE A 439 -4.683 -8.525 -15.191 1.00 0.00 C ATOM 572 C ILE A 439 -4.735 -8.826 -16.690 1.00 0.00 C ATOM 573 O ILE A 439 -4.112 -9.778 -17.158 1.00 0.00 O ATOM 574 CB ILE A 439 -3.661 -7.450 -14.815 1.00 0.00 C ATOM 575 CG1 ILE A 439 -2.270 -7.806 -15.344 1.00 0.00 C ATOM 576 CG2 ILE A 439 -3.654 -7.205 -13.305 1.00 0.00 C ATOM 577 CD1 ILE A 439 -1.403 -8.414 -14.239 1.00 0.00 C ATOM 0 H ILE A 439 -3.554 -10.228 -14.724 1.00 0.00 H new ATOM 0 HA ILE A 439 -5.656 -8.119 -14.913 1.00 0.00 H new ATOM 0 HB ILE A 439 -3.957 -6.516 -15.292 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -2.361 -8.511 -16.170 1.00 0.00 H new ATOM 0 HG13 ILE A 439 -1.788 -6.912 -15.740 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -2.919 -6.437 -13.064 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -4.642 -6.875 -12.985 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -3.396 -8.129 -12.788 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -0.420 -8.658 -14.641 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -1.295 -7.697 -13.425 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -1.876 -9.321 -13.863 1.00 0.00 H new ATOM 589 N PRO A 440 -5.503 -7.975 -17.421 1.00 0.00 N ATOM 590 CA PRO A 440 -5.644 -8.140 -18.858 1.00 0.00 C ATOM 591 C PRO A 440 -4.381 -7.683 -19.589 1.00 0.00 C ATOM 592 O PRO A 440 -4.016 -6.510 -19.532 1.00 0.00 O ATOM 593 CB PRO A 440 -6.873 -7.326 -19.228 1.00 0.00 C ATOM 594 CG PRO A 440 -7.100 -6.365 -18.073 1.00 0.00 C ATOM 595 CD PRO A 440 -6.255 -6.836 -16.901 1.00 0.00 C ATOM 0 HA PRO A 440 -5.770 -9.182 -19.152 1.00 0.00 H new ATOM 0 HB2 PRO A 440 -6.717 -6.785 -20.161 1.00 0.00 H new ATOM 0 HB3 PRO A 440 -7.739 -7.971 -19.375 1.00 0.00 H new ATOM 0 HG2 PRO A 440 -6.823 -5.351 -18.360 1.00 0.00 H new ATOM 0 HG3 PRO A 440 -8.154 -6.341 -17.798 1.00 0.00 H new ATOM 0 HD2 PRO A 440 -5.588 -6.048 -16.551 1.00 0.00 H new ATOM 0 HD3 PRO A 440 -6.878 -7.126 -16.055 1.00 0.00 H new ATOM 603 N PHE A 441 -3.748 -8.634 -20.261 1.00 0.00 N ATOM 604 CA PHE A 441 -2.533 -8.343 -21.003 1.00 0.00 C ATOM 605 C PHE A 441 -2.766 -7.226 -22.022 1.00 0.00 C ATOM 606 O PHE A 441 -3.833 -6.613 -22.043 1.00 0.00 O ATOM 607 CB PHE A 441 -2.146 -9.623 -21.746 1.00 0.00 C ATOM 608 CG PHE A 441 -3.340 -10.439 -22.244 1.00 0.00 C ATOM 609 CD1 PHE A 441 -4.485 -9.808 -22.621 1.00 0.00 C ATOM 610 CD2 PHE A 441 -3.258 -11.795 -22.310 1.00 0.00 C ATOM 611 CE1 PHE A 441 -5.594 -10.565 -23.083 1.00 0.00 C ATOM 612 CE2 PHE A 441 -4.367 -12.552 -22.772 1.00 0.00 C ATOM 613 CZ PHE A 441 -5.512 -11.921 -23.149 1.00 0.00 C ATOM 0 H PHE A 441 -4.054 -9.606 -20.307 1.00 0.00 H new ATOM 0 HA PHE A 441 -1.749 -8.016 -20.320 1.00 0.00 H new ATOM 0 HB2 PHE A 441 -1.518 -9.361 -22.597 1.00 0.00 H new ATOM 0 HB3 PHE A 441 -1.543 -10.246 -21.085 1.00 0.00 H new ATOM 0 HD1 PHE A 441 -4.550 -8.731 -22.569 1.00 0.00 H new ATOM 0 HD2 PHE A 441 -2.349 -12.296 -22.011 1.00 0.00 H new ATOM 0 HE1 PHE A 441 -6.503 -10.064 -23.382 1.00 0.00 H new ATOM 0 HE2 PHE A 441 -4.302 -13.629 -22.824 1.00 0.00 H new ATOM 0 HZ PHE A 441 -6.355 -12.497 -23.501 1.00 0.00 H new ATOM 623 N GLN A 442 -1.752 -6.996 -22.843 1.00 0.00 N ATOM 624 CA GLN A 442 -1.834 -5.964 -23.862 1.00 0.00 C ATOM 625 C GLN A 442 -2.388 -6.546 -25.164 1.00 0.00 C ATOM 626 O GLN A 442 -2.674 -5.808 -26.106 1.00 0.00 O ATOM 627 CB GLN A 442 -0.470 -5.310 -24.091 1.00 0.00 C ATOM 628 CG GLN A 442 0.556 -6.335 -24.578 1.00 0.00 C ATOM 629 CD GLN A 442 1.857 -5.651 -25.001 1.00 0.00 C ATOM 630 OE1 GLN A 442 1.933 -4.975 -26.014 1.00 0.00 O ATOM 631 NE2 GLN A 442 2.874 -5.864 -24.171 1.00 0.00 N ATOM 0 H GLN A 442 -0.869 -7.507 -22.823 1.00 0.00 H new ATOM 0 HA GLN A 442 -2.518 -5.190 -23.513 1.00 0.00 H new ATOM 0 HB2 GLN A 442 -0.565 -4.509 -24.824 1.00 0.00 H new ATOM 0 HB3 GLN A 442 -0.122 -4.854 -23.164 1.00 0.00 H new ATOM 0 HG2 GLN A 442 0.761 -7.055 -23.785 1.00 0.00 H new ATOM 0 HG3 GLN A 442 0.145 -6.895 -25.418 1.00 0.00 H new ATOM 0 HE21 GLN A 442 2.742 -6.441 -23.340 1.00 0.00 H new ATOM 0 HE22 GLN A 442 3.786 -5.451 -24.365 1.00 0.00 H new ATOM 640 N ASN A 443 -2.522 -7.864 -25.176 1.00 0.00 N ATOM 641 CA ASN A 443 -3.036 -8.554 -26.346 1.00 0.00 C ATOM 642 C ASN A 443 -3.067 -10.059 -26.074 1.00 0.00 C ATOM 643 O ASN A 443 -2.228 -10.578 -25.339 1.00 0.00 O ATOM 644 CB ASN A 443 -2.143 -8.313 -27.565 1.00 0.00 C ATOM 645 CG ASN A 443 -2.906 -7.575 -28.667 1.00 0.00 C ATOM 646 OD1 ASN A 443 -3.129 -6.377 -28.607 1.00 0.00 O ATOM 647 ND2 ASN A 443 -3.291 -8.354 -29.673 1.00 0.00 N ATOM 0 H ASN A 443 -2.283 -8.473 -24.393 1.00 0.00 H new ATOM 0 HA ASN A 443 -4.036 -8.171 -26.550 1.00 0.00 H new ATOM 0 HB2 ASN A 443 -1.269 -7.731 -27.271 1.00 0.00 H new ATOM 0 HB3 ASN A 443 -1.778 -9.266 -27.947 1.00 0.00 H new ATOM 0 HD21 ASN A 443 -3.806 -7.956 -30.458 1.00 0.00 H new ATOM 0 HD22 ASN A 443 -3.071 -9.350 -29.660 1.00 0.00 H new ATOM 654 N PRO A 444 -4.070 -10.735 -26.696 1.00 0.00 N ATOM 655 CA PRO A 444 -4.221 -12.171 -26.527 1.00 0.00 C ATOM 656 C PRO A 444 -3.164 -12.931 -27.329 1.00 0.00 C ATOM 657 O PRO A 444 -2.911 -14.107 -27.072 1.00 0.00 O ATOM 658 CB PRO A 444 -5.641 -12.472 -26.980 1.00 0.00 C ATOM 659 CG PRO A 444 -6.073 -11.280 -27.817 1.00 0.00 C ATOM 660 CD PRO A 444 -5.082 -10.154 -27.572 1.00 0.00 C ATOM 0 HA PRO A 444 -4.069 -12.492 -25.497 1.00 0.00 H new ATOM 0 HB2 PRO A 444 -5.678 -13.392 -27.563 1.00 0.00 H new ATOM 0 HB3 PRO A 444 -6.303 -12.609 -26.125 1.00 0.00 H new ATOM 0 HG2 PRO A 444 -6.096 -11.544 -28.874 1.00 0.00 H new ATOM 0 HG3 PRO A 444 -7.081 -10.967 -27.544 1.00 0.00 H new ATOM 0 HD2 PRO A 444 -4.643 -9.803 -28.506 1.00 0.00 H new ATOM 0 HD3 PRO A 444 -5.565 -9.296 -27.104 1.00 0.00 H new ATOM 668 N GLU A 445 -2.574 -12.229 -28.286 1.00 0.00 N ATOM 669 CA GLU A 445 -1.550 -12.824 -29.128 1.00 0.00 C ATOM 670 C GLU A 445 -0.277 -13.077 -28.316 1.00 0.00 C ATOM 671 O GLU A 445 0.490 -13.987 -28.627 1.00 0.00 O ATOM 672 CB GLU A 445 -1.258 -11.941 -30.343 1.00 0.00 C ATOM 673 CG GLU A 445 -2.530 -11.687 -31.154 1.00 0.00 C ATOM 674 CD GLU A 445 -2.509 -12.471 -32.467 1.00 0.00 C ATOM 675 OE1 GLU A 445 -2.474 -13.718 -32.383 1.00 0.00 O ATOM 676 OE2 GLU A 445 -2.529 -11.806 -33.525 1.00 0.00 O ATOM 0 H GLU A 445 -2.786 -11.254 -28.497 1.00 0.00 H new ATOM 0 HA GLU A 445 -1.920 -13.781 -29.496 1.00 0.00 H new ATOM 0 HB2 GLU A 445 -0.836 -10.991 -30.014 1.00 0.00 H new ATOM 0 HB3 GLU A 445 -0.510 -12.420 -30.974 1.00 0.00 H new ATOM 0 HG2 GLU A 445 -3.403 -11.975 -30.568 1.00 0.00 H new ATOM 0 HG3 GLU A 445 -2.625 -10.622 -31.364 1.00 0.00 H new ATOM 683 N GLU A 446 -0.094 -12.257 -27.292 1.00 0.00 N ATOM 684 CA GLU A 446 1.072 -12.381 -26.434 1.00 0.00 C ATOM 685 C GLU A 446 0.811 -13.406 -25.329 1.00 0.00 C ATOM 686 O GLU A 446 1.720 -13.762 -24.580 1.00 0.00 O ATOM 687 CB GLU A 446 1.465 -11.025 -25.843 1.00 0.00 C ATOM 688 CG GLU A 446 0.608 -10.693 -24.619 1.00 0.00 C ATOM 689 CD GLU A 446 1.420 -10.828 -23.329 1.00 0.00 C ATOM 690 OE1 GLU A 446 1.542 -11.977 -22.853 1.00 0.00 O ATOM 691 OE2 GLU A 446 1.900 -9.779 -22.848 1.00 0.00 O ATOM 0 H GLU A 446 -0.733 -11.504 -27.037 1.00 0.00 H new ATOM 0 HA GLU A 446 1.908 -12.733 -27.039 1.00 0.00 H new ATOM 0 HB2 GLU A 446 2.518 -11.038 -25.562 1.00 0.00 H new ATOM 0 HB3 GLU A 446 1.346 -10.247 -26.597 1.00 0.00 H new ATOM 0 HG2 GLU A 446 0.222 -9.677 -24.705 1.00 0.00 H new ATOM 0 HG3 GLU A 446 -0.254 -11.360 -24.582 1.00 0.00 H new ATOM 698 N GLN A 447 -0.435 -13.853 -25.262 1.00 0.00 N ATOM 699 CA GLN A 447 -0.827 -14.830 -24.261 1.00 0.00 C ATOM 700 C GLN A 447 -0.550 -16.247 -24.766 1.00 0.00 C ATOM 701 O GLN A 447 -0.617 -16.507 -25.967 1.00 0.00 O ATOM 702 CB GLN A 447 -2.298 -14.662 -23.877 1.00 0.00 C ATOM 703 CG GLN A 447 -2.573 -15.245 -22.490 1.00 0.00 C ATOM 704 CD GLN A 447 -3.914 -15.981 -22.460 1.00 0.00 C ATOM 705 OE1 GLN A 447 -4.678 -15.973 -23.412 1.00 0.00 O ATOM 706 NE2 GLN A 447 -4.157 -16.618 -21.318 1.00 0.00 N ATOM 0 H GLN A 447 -1.186 -13.556 -25.885 1.00 0.00 H new ATOM 0 HA GLN A 447 -0.231 -14.662 -23.364 1.00 0.00 H new ATOM 0 HB2 GLN A 447 -2.562 -13.605 -23.890 1.00 0.00 H new ATOM 0 HB3 GLN A 447 -2.929 -15.157 -24.615 1.00 0.00 H new ATOM 0 HG2 GLN A 447 -1.772 -15.931 -22.215 1.00 0.00 H new ATOM 0 HG3 GLN A 447 -2.577 -14.445 -21.750 1.00 0.00 H new ATOM 0 HE21 GLN A 447 -3.475 -16.584 -20.560 1.00 0.00 H new ATOM 0 HE22 GLN A 447 -5.025 -17.140 -21.200 1.00 0.00 H new ATOM 715 N ASP A 448 -0.244 -17.128 -23.824 1.00 0.00 N ATOM 716 CA ASP A 448 0.043 -18.512 -24.159 1.00 0.00 C ATOM 717 C ASP A 448 -1.106 -19.399 -23.674 1.00 0.00 C ATOM 718 O ASP A 448 -1.867 -19.007 -22.790 1.00 0.00 O ATOM 719 CB ASP A 448 1.327 -18.989 -23.478 1.00 0.00 C ATOM 720 CG ASP A 448 1.966 -20.232 -24.100 1.00 0.00 C ATOM 721 OD1 ASP A 448 1.518 -20.608 -25.204 1.00 0.00 O ATOM 722 OD2 ASP A 448 2.890 -20.777 -23.457 1.00 0.00 O ATOM 0 H ASP A 448 -0.189 -16.910 -22.829 1.00 0.00 H new ATOM 0 HA ASP A 448 0.162 -18.579 -25.240 1.00 0.00 H new ATOM 0 HB2 ASP A 448 2.054 -18.177 -23.498 1.00 0.00 H new ATOM 0 HB3 ASP A 448 1.109 -19.197 -22.430 1.00 0.00 H new ATOM 727 N GLU A 449 -1.196 -20.577 -24.273 1.00 0.00 N ATOM 728 CA GLU A 449 -2.240 -21.522 -23.914 1.00 0.00 C ATOM 729 C GLU A 449 -1.944 -22.145 -22.548 1.00 0.00 C ATOM 730 O GLU A 449 -1.040 -22.969 -22.420 1.00 0.00 O ATOM 731 CB GLU A 449 -2.395 -22.601 -24.986 1.00 0.00 C ATOM 732 CG GLU A 449 -3.872 -22.888 -25.266 1.00 0.00 C ATOM 733 CD GLU A 449 -4.066 -23.433 -26.682 1.00 0.00 C ATOM 734 OE1 GLU A 449 -3.129 -24.104 -27.166 1.00 0.00 O ATOM 735 OE2 GLU A 449 -5.148 -23.167 -27.250 1.00 0.00 O ATOM 0 H GLU A 449 -0.563 -20.899 -25.005 1.00 0.00 H new ATOM 0 HA GLU A 449 -3.185 -20.983 -23.849 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -1.903 -22.280 -25.904 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -1.898 -23.515 -24.661 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -4.250 -23.608 -24.540 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -4.454 -21.975 -25.141 1.00 0.00 H new ATOM 742 N GLY A 450 -2.723 -21.727 -21.561 1.00 0.00 N ATOM 743 CA GLY A 450 -2.556 -22.233 -20.209 1.00 0.00 C ATOM 744 C GLY A 450 -1.784 -21.237 -19.342 1.00 0.00 C ATOM 745 O GLY A 450 -1.455 -21.532 -18.194 1.00 0.00 O ATOM 0 H GLY A 450 -3.472 -21.043 -21.671 1.00 0.00 H new ATOM 0 HA2 GLY A 450 -3.533 -22.425 -19.766 1.00 0.00 H new ATOM 0 HA3 GLY A 450 -2.025 -23.185 -20.236 1.00 0.00 H new ATOM 749 N TRP A 451 -1.517 -20.077 -19.924 1.00 0.00 N ATOM 750 CA TRP A 451 -0.790 -19.035 -19.219 1.00 0.00 C ATOM 751 C TRP A 451 -1.454 -17.694 -19.540 1.00 0.00 C ATOM 752 O TRP A 451 -1.911 -17.477 -20.662 1.00 0.00 O ATOM 753 CB TRP A 451 0.697 -19.066 -19.576 1.00 0.00 C ATOM 754 CG TRP A 451 1.254 -20.474 -19.797 1.00 0.00 C ATOM 755 CD1 TRP A 451 0.776 -21.434 -20.601 1.00 0.00 C ATOM 756 CD2 TRP A 451 2.422 -21.044 -19.170 1.00 0.00 C ATOM 757 NE1 TRP A 451 1.547 -22.576 -20.538 1.00 0.00 N ATOM 758 CE2 TRP A 451 2.580 -22.332 -19.641 1.00 0.00 C ATOM 759 CE3 TRP A 451 3.316 -20.491 -18.237 1.00 0.00 C ATOM 760 CZ2 TRP A 451 3.622 -23.174 -19.234 1.00 0.00 C ATOM 761 CZ3 TRP A 451 4.352 -21.345 -17.840 1.00 0.00 C ATOM 762 CH2 TRP A 451 4.524 -22.644 -18.304 1.00 0.00 C ATOM 0 H TRP A 451 -1.791 -19.836 -20.876 1.00 0.00 H new ATOM 0 HA TRP A 451 -0.834 -19.196 -18.142 1.00 0.00 H new ATOM 0 HB2 TRP A 451 0.856 -18.477 -20.480 1.00 0.00 H new ATOM 0 HB3 TRP A 451 1.262 -18.584 -18.778 1.00 0.00 H new ATOM 0 HD1 TRP A 451 -0.102 -21.327 -21.220 1.00 0.00 H new ATOM 0 HE1 TRP A 451 1.388 -23.441 -21.055 1.00 0.00 H new ATOM 0 HE3 TRP A 451 3.212 -19.486 -17.856 1.00 0.00 H new ATOM 0 HZ2 TRP A 451 3.724 -24.179 -19.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 451 5.067 -20.968 -17.124 1.00 0.00 H new ATOM 0 HH2 TRP A 451 5.350 -23.242 -17.948 1.00 0.00 H new ATOM 773 N LEU A 452 -1.487 -16.831 -18.536 1.00 0.00 N ATOM 774 CA LEU A 452 -2.087 -15.517 -18.698 1.00 0.00 C ATOM 775 C LEU A 452 -1.139 -14.455 -18.139 1.00 0.00 C ATOM 776 O LEU A 452 -0.130 -14.784 -17.517 1.00 0.00 O ATOM 777 CB LEU A 452 -3.483 -15.486 -18.073 1.00 0.00 C ATOM 778 CG LEU A 452 -3.852 -16.682 -17.194 1.00 0.00 C ATOM 779 CD1 LEU A 452 -4.828 -16.271 -16.089 1.00 0.00 C ATOM 780 CD2 LEU A 452 -4.395 -17.837 -18.038 1.00 0.00 C ATOM 0 H LEU A 452 -1.108 -17.015 -17.607 1.00 0.00 H new ATOM 0 HA LEU A 452 -2.230 -15.291 -19.755 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -3.571 -14.580 -17.474 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -4.217 -15.410 -18.875 1.00 0.00 H new ATOM 0 HG LEU A 452 -2.945 -17.039 -16.706 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -5.074 -17.140 -15.479 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -4.368 -15.507 -15.463 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -5.738 -15.873 -16.537 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -4.649 -18.674 -17.388 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -5.286 -17.509 -18.573 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -3.637 -18.152 -18.755 1.00 0.00 H new ATOM 792 N MET A 453 -1.496 -13.202 -18.379 1.00 0.00 N ATOM 793 CA MET A 453 -0.690 -12.090 -17.907 1.00 0.00 C ATOM 794 C MET A 453 -1.122 -11.655 -16.505 1.00 0.00 C ATOM 795 O MET A 453 -2.231 -11.157 -16.320 1.00 0.00 O ATOM 796 CB MET A 453 -0.830 -10.911 -18.873 1.00 0.00 C ATOM 797 CG MET A 453 -0.298 -9.622 -18.245 1.00 0.00 C ATOM 798 SD MET A 453 0.787 -8.787 -19.390 1.00 0.00 S ATOM 799 CE MET A 453 2.098 -9.991 -19.510 1.00 0.00 C ATOM 0 H MET A 453 -2.334 -12.932 -18.895 1.00 0.00 H new ATOM 0 HA MET A 453 0.350 -12.413 -17.862 1.00 0.00 H new ATOM 0 HB2 MET A 453 -0.285 -11.123 -19.793 1.00 0.00 H new ATOM 0 HB3 MET A 453 -1.877 -10.782 -19.145 1.00 0.00 H new ATOM 0 HG2 MET A 453 -1.128 -8.969 -17.976 1.00 0.00 H new ATOM 0 HG3 MET A 453 0.238 -9.851 -17.324 1.00 0.00 H new ATOM 0 HE1 MET A 453 2.545 -9.944 -20.503 1.00 0.00 H new ATOM 0 HE2 MET A 453 2.859 -9.777 -18.759 1.00 0.00 H new ATOM 0 HE3 MET A 453 1.692 -10.989 -19.341 1.00 0.00 H new ATOM 809 N GLY A 454 -0.223 -11.860 -15.554 1.00 0.00 N ATOM 810 CA GLY A 454 -0.497 -11.496 -14.174 1.00 0.00 C ATOM 811 C GLY A 454 0.725 -10.844 -13.525 1.00 0.00 C ATOM 812 O GLY A 454 1.806 -10.820 -14.114 1.00 0.00 O ATOM 0 H GLY A 454 0.696 -12.274 -15.712 1.00 0.00 H new ATOM 0 HA2 GLY A 454 -1.343 -10.809 -14.137 1.00 0.00 H new ATOM 0 HA3 GLY A 454 -0.782 -12.384 -13.610 1.00 0.00 H new ATOM 816 N VAL A 455 0.515 -10.332 -12.322 1.00 0.00 N ATOM 817 CA VAL A 455 1.586 -9.682 -11.587 1.00 0.00 C ATOM 818 C VAL A 455 1.542 -10.131 -10.125 1.00 0.00 C ATOM 819 O VAL A 455 0.466 -10.367 -9.577 1.00 0.00 O ATOM 820 CB VAL A 455 1.487 -8.164 -11.749 1.00 0.00 C ATOM 821 CG1 VAL A 455 0.098 -7.660 -11.351 1.00 0.00 C ATOM 822 CG2 VAL A 455 2.578 -7.454 -10.946 1.00 0.00 C ATOM 0 H VAL A 455 -0.382 -10.354 -11.837 1.00 0.00 H new ATOM 0 HA VAL A 455 2.556 -9.975 -11.988 1.00 0.00 H new ATOM 0 HB VAL A 455 1.640 -7.929 -12.802 1.00 0.00 H new ATOM 0 HG11 VAL A 455 0.054 -6.578 -11.475 1.00 0.00 H new ATOM 0 HG12 VAL A 455 -0.655 -8.129 -11.985 1.00 0.00 H new ATOM 0 HG13 VAL A 455 -0.096 -7.914 -10.309 1.00 0.00 H new ATOM 0 HG21 VAL A 455 2.485 -6.376 -11.079 1.00 0.00 H new ATOM 0 HG22 VAL A 455 2.471 -7.700 -9.890 1.00 0.00 H new ATOM 0 HG23 VAL A 455 3.558 -7.779 -11.296 1.00 0.00 H new ATOM 832 N LYS A 456 2.723 -10.236 -9.535 1.00 0.00 N ATOM 833 CA LYS A 456 2.833 -10.653 -8.147 1.00 0.00 C ATOM 834 C LYS A 456 2.392 -9.504 -7.238 1.00 0.00 C ATOM 835 O LYS A 456 2.307 -8.358 -7.677 1.00 0.00 O ATOM 836 CB LYS A 456 4.244 -11.165 -7.851 1.00 0.00 C ATOM 837 CG LYS A 456 4.406 -12.617 -8.304 1.00 0.00 C ATOM 838 CD LYS A 456 5.643 -13.255 -7.667 1.00 0.00 C ATOM 839 CE LYS A 456 6.921 -12.789 -8.367 1.00 0.00 C ATOM 840 NZ LYS A 456 7.475 -11.594 -7.693 1.00 0.00 N ATOM 0 H LYS A 456 3.613 -10.039 -9.993 1.00 0.00 H new ATOM 0 HA LYS A 456 2.167 -11.492 -7.947 1.00 0.00 H new ATOM 0 HB2 LYS A 456 4.976 -10.538 -8.359 1.00 0.00 H new ATOM 0 HB3 LYS A 456 4.446 -11.089 -6.783 1.00 0.00 H new ATOM 0 HG2 LYS A 456 3.518 -13.188 -8.033 1.00 0.00 H new ATOM 0 HG3 LYS A 456 4.491 -12.656 -9.390 1.00 0.00 H new ATOM 0 HD2 LYS A 456 5.687 -12.994 -6.610 1.00 0.00 H new ATOM 0 HD3 LYS A 456 5.567 -14.341 -7.725 1.00 0.00 H new ATOM 0 HE2 LYS A 456 7.659 -13.591 -8.362 1.00 0.00 H new ATOM 0 HE3 LYS A 456 6.708 -12.559 -9.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 456 7.639 -10.844 -8.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 456 6.801 -11.256 -6.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 456 8.374 -11.841 -7.233 1.00 0.00 H new ATOM 854 N GLU A 457 2.124 -9.850 -5.988 1.00 0.00 N ATOM 855 CA GLU A 457 1.695 -8.862 -5.013 1.00 0.00 C ATOM 856 C GLU A 457 2.785 -7.808 -4.810 1.00 0.00 C ATOM 857 O GLU A 457 2.502 -6.610 -4.805 1.00 0.00 O ATOM 858 CB GLU A 457 1.321 -9.526 -3.686 1.00 0.00 C ATOM 859 CG GLU A 457 1.121 -8.481 -2.587 1.00 0.00 C ATOM 860 CD GLU A 457 0.017 -8.910 -1.617 1.00 0.00 C ATOM 861 OE1 GLU A 457 -0.908 -9.610 -2.084 1.00 0.00 O ATOM 862 OE2 GLU A 457 0.124 -8.529 -0.432 1.00 0.00 O ATOM 0 H GLU A 457 2.196 -10.801 -5.628 1.00 0.00 H new ATOM 0 HA GLU A 457 0.804 -8.366 -5.397 1.00 0.00 H new ATOM 0 HB2 GLU A 457 0.407 -10.107 -3.811 1.00 0.00 H new ATOM 0 HB3 GLU A 457 2.105 -10.224 -3.391 1.00 0.00 H new ATOM 0 HG2 GLU A 457 2.054 -8.338 -2.042 1.00 0.00 H new ATOM 0 HG3 GLU A 457 0.864 -7.521 -3.035 1.00 0.00 H new ATOM 869 N SER A 458 4.008 -8.291 -4.648 1.00 0.00 N ATOM 870 CA SER A 458 5.141 -7.405 -4.445 1.00 0.00 C ATOM 871 C SER A 458 5.257 -6.427 -5.616 1.00 0.00 C ATOM 872 O SER A 458 5.584 -5.257 -5.422 1.00 0.00 O ATOM 873 CB SER A 458 6.440 -8.199 -4.287 1.00 0.00 C ATOM 874 OG SER A 458 7.285 -7.646 -3.281 1.00 0.00 O ATOM 0 H SER A 458 4.239 -9.285 -4.653 1.00 0.00 H new ATOM 0 HA SER A 458 4.975 -6.844 -3.525 1.00 0.00 H new ATOM 0 HB2 SER A 458 6.204 -9.233 -4.034 1.00 0.00 H new ATOM 0 HB3 SER A 458 6.972 -8.216 -5.238 1.00 0.00 H new ATOM 0 HG SER A 458 8.102 -8.182 -3.210 1.00 0.00 H new ATOM 880 N ASP A 459 4.983 -6.942 -6.805 1.00 0.00 N ATOM 881 CA ASP A 459 5.052 -6.129 -8.007 1.00 0.00 C ATOM 882 C ASP A 459 3.957 -5.061 -7.959 1.00 0.00 C ATOM 883 O ASP A 459 4.147 -3.950 -8.451 1.00 0.00 O ATOM 884 CB ASP A 459 4.830 -6.978 -9.260 1.00 0.00 C ATOM 885 CG ASP A 459 6.062 -7.741 -9.751 1.00 0.00 C ATOM 886 OD1 ASP A 459 7.180 -7.272 -9.443 1.00 0.00 O ATOM 887 OD2 ASP A 459 5.859 -8.775 -10.423 1.00 0.00 O ATOM 0 H ASP A 459 4.713 -7.913 -6.962 1.00 0.00 H new ATOM 0 HA ASP A 459 6.042 -5.675 -8.050 1.00 0.00 H new ATOM 0 HB2 ASP A 459 4.034 -7.695 -9.059 1.00 0.00 H new ATOM 0 HB3 ASP A 459 4.479 -6.329 -10.063 1.00 0.00 H new ATOM 892 N TRP A 460 2.836 -5.436 -7.362 1.00 0.00 N ATOM 893 CA TRP A 460 1.710 -4.525 -7.243 1.00 0.00 C ATOM 894 C TRP A 460 2.219 -3.224 -6.620 1.00 0.00 C ATOM 895 O TRP A 460 1.917 -2.137 -7.110 1.00 0.00 O ATOM 896 CB TRP A 460 0.570 -5.163 -6.447 1.00 0.00 C ATOM 897 CG TRP A 460 -0.755 -4.402 -6.539 1.00 0.00 C ATOM 898 CD1 TRP A 460 -0.957 -3.147 -6.962 1.00 0.00 C ATOM 899 CD2 TRP A 460 -2.060 -4.902 -6.179 1.00 0.00 C ATOM 900 NE1 TRP A 460 -2.292 -2.803 -6.903 1.00 0.00 N ATOM 901 CE2 TRP A 460 -2.984 -3.904 -6.411 1.00 0.00 C ATOM 902 CE3 TRP A 460 -2.447 -6.156 -5.674 1.00 0.00 C ATOM 903 CZ2 TRP A 460 -4.354 -4.056 -6.167 1.00 0.00 C ATOM 904 CZ3 TRP A 460 -3.819 -6.292 -5.436 1.00 0.00 C ATOM 905 CH2 TRP A 460 -4.763 -5.297 -5.664 1.00 0.00 C ATOM 0 H TRP A 460 2.683 -6.359 -6.955 1.00 0.00 H new ATOM 0 HA TRP A 460 1.290 -4.301 -8.223 1.00 0.00 H new ATOM 0 HB2 TRP A 460 0.418 -6.182 -6.803 1.00 0.00 H new ATOM 0 HB3 TRP A 460 0.866 -5.232 -5.400 1.00 0.00 H new ATOM 0 HD1 TRP A 460 -0.174 -2.488 -7.306 1.00 0.00 H new ATOM 0 HE1 TRP A 460 -2.697 -1.906 -7.171 1.00 0.00 H new ATOM 0 HE3 TRP A 460 -1.741 -6.951 -5.485 1.00 0.00 H new ATOM 0 HZ2 TRP A 460 -5.058 -3.259 -6.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 460 -4.170 -7.237 -5.048 1.00 0.00 H new ATOM 0 HH2 TRP A 460 -5.806 -5.480 -5.454 1.00 0.00 H new ATOM 1075 N ARG A 470 4.678 -6.315 -15.672 1.00 0.00 N ATOM 1076 CA ARG A 470 3.877 -7.234 -16.464 1.00 0.00 C ATOM 1077 C ARG A 470 4.660 -8.520 -16.737 1.00 0.00 C ATOM 1078 O ARG A 470 5.832 -8.471 -17.107 1.00 0.00 O ATOM 1079 CB ARG A 470 3.469 -6.601 -17.796 1.00 0.00 C ATOM 1080 CG ARG A 470 2.831 -5.228 -17.578 1.00 0.00 C ATOM 1081 CD ARG A 470 1.456 -5.151 -18.246 1.00 0.00 C ATOM 1082 NE ARG A 470 1.568 -4.477 -19.559 1.00 0.00 N ATOM 1083 CZ ARG A 470 0.520 -4.055 -20.279 1.00 0.00 C ATOM 1084 NH1 ARG A 470 -0.725 -4.234 -19.817 1.00 0.00 N ATOM 1085 NH2 ARG A 470 0.717 -3.454 -21.460 1.00 0.00 N ATOM 0 HA ARG A 470 2.977 -7.466 -15.894 1.00 0.00 H new ATOM 0 HB2 ARG A 470 4.344 -6.502 -18.438 1.00 0.00 H new ATOM 0 HB3 ARG A 470 2.766 -7.254 -18.313 1.00 0.00 H new ATOM 0 HG2 ARG A 470 2.732 -5.034 -16.510 1.00 0.00 H new ATOM 0 HG3 ARG A 470 3.481 -4.452 -17.984 1.00 0.00 H new ATOM 0 HD2 ARG A 470 1.049 -6.154 -18.376 1.00 0.00 H new ATOM 0 HD3 ARG A 470 0.762 -4.606 -17.606 1.00 0.00 H new ATOM 0 HE ARG A 470 2.502 -4.324 -19.940 1.00 0.00 H new ATOM 0 HH11 ARG A 470 -0.874 -4.691 -18.918 1.00 0.00 H new ATOM 0 HH12 ARG A 470 -1.523 -3.913 -20.365 1.00 0.00 H new ATOM 0 HH21 ARG A 470 1.665 -3.318 -21.811 1.00 0.00 H new ATOM 0 HH22 ARG A 470 -0.081 -3.133 -22.008 1.00 0.00 H new ATOM 1099 N GLY A 471 3.980 -9.641 -16.542 1.00 0.00 N ATOM 1100 CA GLY A 471 4.597 -10.938 -16.763 1.00 0.00 C ATOM 1101 C GLY A 471 3.552 -11.981 -17.164 1.00 0.00 C ATOM 1102 O GLY A 471 2.368 -11.667 -17.275 1.00 0.00 O ATOM 0 H GLY A 471 3.008 -9.678 -16.234 1.00 0.00 H new ATOM 0 HA2 GLY A 471 5.353 -10.857 -17.544 1.00 0.00 H new ATOM 0 HA3 GLY A 471 5.109 -11.261 -15.856 1.00 0.00 H new ATOM 1106 N VAL A 472 4.029 -13.200 -17.371 1.00 0.00 N ATOM 1107 CA VAL A 472 3.150 -14.291 -17.758 1.00 0.00 C ATOM 1108 C VAL A 472 3.341 -15.460 -16.790 1.00 0.00 C ATOM 1109 O VAL A 472 4.433 -15.661 -16.261 1.00 0.00 O ATOM 1110 CB VAL A 472 3.404 -14.675 -19.217 1.00 0.00 C ATOM 1111 CG1 VAL A 472 3.081 -16.150 -19.460 1.00 0.00 C ATOM 1112 CG2 VAL A 472 2.610 -13.776 -20.167 1.00 0.00 C ATOM 0 H VAL A 472 5.012 -13.456 -17.278 1.00 0.00 H new ATOM 0 HA VAL A 472 2.106 -13.983 -17.694 1.00 0.00 H new ATOM 0 HB VAL A 472 4.464 -14.526 -19.423 1.00 0.00 H new ATOM 0 HG11 VAL A 472 3.270 -16.397 -20.505 1.00 0.00 H new ATOM 0 HG12 VAL A 472 3.710 -16.770 -18.821 1.00 0.00 H new ATOM 0 HG13 VAL A 472 2.032 -16.336 -19.228 1.00 0.00 H new ATOM 0 HG21 VAL A 472 2.809 -14.070 -21.198 1.00 0.00 H new ATOM 0 HG22 VAL A 472 1.545 -13.878 -19.959 1.00 0.00 H new ATOM 0 HG23 VAL A 472 2.910 -12.738 -20.022 1.00 0.00 H new ATOM 1122 N PHE A 473 2.261 -16.201 -16.588 1.00 0.00 N ATOM 1123 CA PHE A 473 2.295 -17.346 -15.693 1.00 0.00 C ATOM 1124 C PHE A 473 1.162 -18.323 -16.010 1.00 0.00 C ATOM 1125 O PHE A 473 0.098 -17.916 -16.474 1.00 0.00 O ATOM 1126 CB PHE A 473 2.108 -16.809 -14.273 1.00 0.00 C ATOM 1127 CG PHE A 473 0.692 -16.309 -13.978 1.00 0.00 C ATOM 1128 CD1 PHE A 473 0.226 -15.187 -14.589 1.00 0.00 C ATOM 1129 CD2 PHE A 473 -0.100 -16.988 -13.105 1.00 0.00 C ATOM 1130 CE1 PHE A 473 -1.088 -14.723 -14.315 1.00 0.00 C ATOM 1131 CE2 PHE A 473 -1.414 -16.524 -12.832 1.00 0.00 C ATOM 1132 CZ PHE A 473 -1.880 -15.402 -13.442 1.00 0.00 C ATOM 0 H PHE A 473 1.357 -16.031 -17.029 1.00 0.00 H new ATOM 0 HA PHE A 473 3.239 -17.879 -15.805 1.00 0.00 H new ATOM 0 HB2 PHE A 473 2.360 -17.596 -13.562 1.00 0.00 H new ATOM 0 HB3 PHE A 473 2.812 -15.993 -14.108 1.00 0.00 H new ATOM 0 HD1 PHE A 473 0.855 -14.649 -15.283 1.00 0.00 H new ATOM 0 HD2 PHE A 473 0.270 -17.879 -12.620 1.00 0.00 H new ATOM 0 HE1 PHE A 473 -1.458 -13.832 -14.799 1.00 0.00 H new ATOM 0 HE2 PHE A 473 -2.044 -17.063 -12.139 1.00 0.00 H new ATOM 0 HZ PHE A 473 -2.879 -15.050 -13.233 1.00 0.00 H new ATOM 1142 N PRO A 474 1.435 -19.628 -15.739 1.00 0.00 N ATOM 1143 CA PRO A 474 0.451 -20.666 -15.990 1.00 0.00 C ATOM 1144 C PRO A 474 -0.653 -20.642 -14.931 1.00 0.00 C ATOM 1145 O PRO A 474 -0.388 -20.845 -13.747 1.00 0.00 O ATOM 1146 CB PRO A 474 1.241 -21.965 -15.995 1.00 0.00 C ATOM 1147 CG PRO A 474 2.552 -21.657 -15.289 1.00 0.00 C ATOM 1148 CD PRO A 474 2.684 -20.146 -15.189 1.00 0.00 C ATOM 0 HA PRO A 474 -0.072 -20.530 -16.937 1.00 0.00 H new ATOM 0 HB2 PRO A 474 0.696 -22.756 -15.480 1.00 0.00 H new ATOM 0 HB3 PRO A 474 1.418 -22.311 -17.013 1.00 0.00 H new ATOM 0 HG2 PRO A 474 2.566 -22.108 -14.297 1.00 0.00 H new ATOM 0 HG3 PRO A 474 3.392 -22.078 -15.842 1.00 0.00 H new ATOM 0 HD2 PRO A 474 2.824 -19.828 -14.156 1.00 0.00 H new ATOM 0 HD3 PRO A 474 3.545 -19.785 -15.753 1.00 0.00 H new ATOM 1156 N GLU A 475 -1.869 -20.394 -15.396 1.00 0.00 N ATOM 1157 CA GLU A 475 -3.015 -20.341 -14.503 1.00 0.00 C ATOM 1158 C GLU A 475 -3.304 -21.729 -13.928 1.00 0.00 C ATOM 1159 O GLU A 475 -3.746 -21.852 -12.787 1.00 0.00 O ATOM 1160 CB GLU A 475 -4.243 -19.778 -15.221 1.00 0.00 C ATOM 1161 CG GLU A 475 -5.518 -20.049 -14.420 1.00 0.00 C ATOM 1162 CD GLU A 475 -6.387 -18.793 -14.330 1.00 0.00 C ATOM 1163 OE1 GLU A 475 -6.134 -17.993 -13.403 1.00 0.00 O ATOM 1164 OE2 GLU A 475 -7.284 -18.660 -15.190 1.00 0.00 O ATOM 0 H GLU A 475 -2.086 -20.228 -16.379 1.00 0.00 H new ATOM 0 HA GLU A 475 -2.778 -19.670 -13.678 1.00 0.00 H new ATOM 0 HB2 GLU A 475 -4.123 -18.705 -15.368 1.00 0.00 H new ATOM 0 HB3 GLU A 475 -4.328 -20.227 -16.210 1.00 0.00 H new ATOM 0 HG2 GLU A 475 -6.083 -20.853 -14.891 1.00 0.00 H new ATOM 0 HG3 GLU A 475 -5.257 -20.387 -13.417 1.00 0.00 H new ATOM 1171 N ASN A 476 -3.043 -22.739 -14.745 1.00 0.00 N ATOM 1172 CA ASN A 476 -3.270 -24.113 -14.331 1.00 0.00 C ATOM 1173 C ASN A 476 -2.272 -24.482 -13.232 1.00 0.00 C ATOM 1174 O ASN A 476 -2.385 -25.540 -12.615 1.00 0.00 O ATOM 1175 CB ASN A 476 -3.067 -25.080 -15.499 1.00 0.00 C ATOM 1176 CG ASN A 476 -1.762 -24.779 -16.239 1.00 0.00 C ATOM 1177 OD1 ASN A 476 -0.686 -25.206 -15.853 1.00 0.00 O ATOM 1178 ND2 ASN A 476 -1.916 -24.023 -17.322 1.00 0.00 N ATOM 0 H ASN A 476 -2.677 -22.633 -15.691 1.00 0.00 H new ATOM 0 HA ASN A 476 -4.296 -24.192 -13.971 1.00 0.00 H new ATOM 0 HB2 ASN A 476 -3.051 -26.105 -15.129 1.00 0.00 H new ATOM 0 HB3 ASN A 476 -3.907 -25.003 -16.190 1.00 0.00 H new ATOM 0 HD21 ASN A 476 -1.105 -23.767 -17.885 1.00 0.00 H new ATOM 0 HD22 ASN A 476 -2.845 -23.699 -17.590 1.00 0.00 H new ATOM 1185 N PHE A 477 -1.316 -23.589 -13.022 1.00 0.00 N ATOM 1186 CA PHE A 477 -0.298 -23.808 -12.008 1.00 0.00 C ATOM 1187 C PHE A 477 -0.542 -22.920 -10.786 1.00 0.00 C ATOM 1188 O PHE A 477 0.254 -22.916 -9.848 1.00 0.00 O ATOM 1189 CB PHE A 477 1.046 -23.433 -12.635 1.00 0.00 C ATOM 1190 CG PHE A 477 2.004 -22.723 -11.677 1.00 0.00 C ATOM 1191 CD1 PHE A 477 1.855 -21.394 -11.426 1.00 0.00 C ATOM 1192 CD2 PHE A 477 3.005 -23.420 -11.075 1.00 0.00 C ATOM 1193 CE1 PHE A 477 2.744 -20.735 -10.536 1.00 0.00 C ATOM 1194 CE2 PHE A 477 3.894 -22.761 -10.185 1.00 0.00 C ATOM 1195 CZ PHE A 477 3.745 -21.433 -9.935 1.00 0.00 C ATOM 0 H PHE A 477 -1.225 -22.713 -13.536 1.00 0.00 H new ATOM 0 HA PHE A 477 -0.318 -24.847 -11.679 1.00 0.00 H new ATOM 0 HB2 PHE A 477 1.526 -24.338 -13.008 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.866 -22.789 -13.496 1.00 0.00 H new ATOM 0 HD1 PHE A 477 1.060 -20.840 -11.904 1.00 0.00 H new ATOM 0 HD2 PHE A 477 3.124 -24.475 -11.274 1.00 0.00 H new ATOM 0 HE1 PHE A 477 2.625 -19.680 -10.336 1.00 0.00 H new ATOM 0 HE2 PHE A 477 4.688 -23.315 -9.707 1.00 0.00 H new ATOM 0 HZ PHE A 477 4.422 -20.932 -9.259 1.00 0.00 H new ATOM 1205 N THR A 478 -1.646 -22.189 -10.836 1.00 0.00 N ATOM 1206 CA THR A 478 -2.005 -21.300 -9.745 1.00 0.00 C ATOM 1207 C THR A 478 -3.451 -21.546 -9.309 1.00 0.00 C ATOM 1208 O THR A 478 -4.131 -22.410 -9.861 1.00 0.00 O ATOM 1209 CB THR A 478 -1.745 -19.863 -10.201 1.00 0.00 C ATOM 1210 OG1 THR A 478 -2.082 -19.872 -11.585 1.00 0.00 O ATOM 1211 CG2 THR A 478 -0.258 -19.503 -10.182 1.00 0.00 C ATOM 0 H THR A 478 -2.304 -22.195 -11.616 1.00 0.00 H new ATOM 0 HA THR A 478 -1.395 -21.492 -8.862 1.00 0.00 H new ATOM 0 HB THR A 478 -2.294 -19.174 -9.559 1.00 0.00 H new ATOM 0 HG1 THR A 478 -1.300 -20.143 -12.110 1.00 0.00 H new ATOM 0 HG21 THR A 478 -0.129 -18.473 -10.514 1.00 0.00 H new ATOM 0 HG22 THR A 478 0.129 -19.609 -9.169 1.00 0.00 H new ATOM 0 HG23 THR A 478 0.287 -20.171 -10.850 1.00 0.00 H new ATOM 1219 N GLU A 479 -3.878 -20.772 -8.322 1.00 0.00 N ATOM 1220 CA GLU A 479 -5.230 -20.896 -7.806 1.00 0.00 C ATOM 1221 C GLU A 479 -5.878 -19.515 -7.677 1.00 0.00 C ATOM 1222 O GLU A 479 -5.198 -18.532 -7.387 1.00 0.00 O ATOM 1223 CB GLU A 479 -5.240 -21.633 -6.465 1.00 0.00 C ATOM 1224 CG GLU A 479 -6.496 -22.495 -6.323 1.00 0.00 C ATOM 1225 CD GLU A 479 -6.575 -23.124 -4.930 1.00 0.00 C ATOM 1226 OE1 GLU A 479 -6.609 -22.341 -3.956 1.00 0.00 O ATOM 1227 OE2 GLU A 479 -6.600 -24.372 -4.871 1.00 0.00 O ATOM 0 H GLU A 479 -3.311 -20.057 -7.866 1.00 0.00 H new ATOM 0 HA GLU A 479 -5.814 -21.486 -8.512 1.00 0.00 H new ATOM 0 HB2 GLU A 479 -4.353 -22.261 -6.384 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -5.195 -20.912 -5.649 1.00 0.00 H new ATOM 0 HG2 GLU A 479 -7.382 -21.885 -6.501 1.00 0.00 H new ATOM 0 HG3 GLU A 479 -6.491 -23.279 -7.080 1.00 0.00 H new ATOM 1234 N ARG A 480 -7.183 -19.486 -7.899 1.00 0.00 N ATOM 1235 CA ARG A 480 -7.930 -18.243 -7.811 1.00 0.00 C ATOM 1236 C ARG A 480 -8.299 -17.947 -6.356 1.00 0.00 C ATOM 1237 O ARG A 480 -8.764 -18.831 -5.638 1.00 0.00 O ATOM 1238 CB ARG A 480 -9.207 -18.306 -8.652 1.00 0.00 C ATOM 1239 CG ARG A 480 -8.880 -18.544 -10.128 1.00 0.00 C ATOM 1240 CD ARG A 480 -9.853 -17.785 -11.033 1.00 0.00 C ATOM 1241 NE ARG A 480 -10.552 -18.732 -11.930 1.00 0.00 N ATOM 1242 CZ ARG A 480 -11.614 -18.410 -12.682 1.00 0.00 C ATOM 1243 NH1 ARG A 480 -12.105 -17.163 -12.648 1.00 0.00 N ATOM 1244 NH2 ARG A 480 -12.185 -19.334 -13.466 1.00 0.00 N ATOM 0 H ARG A 480 -7.743 -20.304 -8.140 1.00 0.00 H new ATOM 0 HA ARG A 480 -7.294 -17.446 -8.197 1.00 0.00 H new ATOM 0 HB2 ARG A 480 -9.850 -19.106 -8.285 1.00 0.00 H new ATOM 0 HB3 ARG A 480 -9.764 -17.375 -8.545 1.00 0.00 H new ATOM 0 HG2 ARG A 480 -7.859 -18.223 -10.335 1.00 0.00 H new ATOM 0 HG3 ARG A 480 -8.929 -19.610 -10.348 1.00 0.00 H new ATOM 0 HD2 ARG A 480 -10.578 -17.242 -10.427 1.00 0.00 H new ATOM 0 HD3 ARG A 480 -9.312 -17.044 -11.622 1.00 0.00 H new ATOM 0 HE ARG A 480 -10.204 -19.690 -11.979 1.00 0.00 H new ATOM 0 HH11 ARG A 480 -11.671 -16.460 -12.050 1.00 0.00 H new ATOM 0 HH12 ARG A 480 -12.913 -16.917 -13.220 1.00 0.00 H new ATOM 0 HH21 ARG A 480 -11.812 -20.283 -13.491 1.00 0.00 H new ATOM 0 HH22 ARG A 480 -12.993 -19.089 -14.038 1.00 0.00 H new ATOM 1258 N VAL A 481 -8.079 -16.700 -5.965 1.00 0.00 N ATOM 1259 CA VAL A 481 -8.383 -16.277 -4.609 1.00 0.00 C ATOM 1260 C VAL A 481 -9.527 -15.262 -4.641 1.00 0.00 C ATOM 1261 O VAL A 481 -9.593 -14.422 -5.537 1.00 0.00 O ATOM 1262 CB VAL A 481 -7.121 -15.734 -3.935 1.00 0.00 C ATOM 1263 CG1 VAL A 481 -7.427 -15.232 -2.522 1.00 0.00 C ATOM 1264 CG2 VAL A 481 -6.014 -16.790 -3.914 1.00 0.00 C ATOM 0 H VAL A 481 -7.694 -15.969 -6.564 1.00 0.00 H new ATOM 0 HA VAL A 481 -8.716 -17.124 -4.010 1.00 0.00 H new ATOM 0 HB VAL A 481 -6.765 -14.887 -4.522 1.00 0.00 H new ATOM 0 HG11 VAL A 481 -6.513 -14.851 -2.065 1.00 0.00 H new ATOM 0 HG12 VAL A 481 -8.167 -14.434 -2.572 1.00 0.00 H new ATOM 0 HG13 VAL A 481 -7.818 -16.053 -1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 481 -5.128 -16.379 -3.430 1.00 0.00 H new ATOM 0 HG22 VAL A 481 -6.356 -17.665 -3.362 1.00 0.00 H new ATOM 0 HG23 VAL A 481 -5.768 -17.079 -4.936 1.00 0.00 H new