USER MOD reduce.3.24.130724 H: found=0, std=0, add=560, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 563 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 423 LYS NZ :NH3+ 168:sc= 1.24 (180deg=0) USER MOD Set 1.2: A 439 ASN : amide:sc= 1.89 K(o=3.1,f=-5.3) USER MOD Set 2.1: A 411 SER OG : rot 168:sc= 1.79 USER MOD Set 2.2: A 413 LYS NZ :NH3+ -138:sc= 1.06 (180deg=-0.00393) USER MOD Set 3.1: A 382 ASN : amide:sc= -0.65 K(o=-0.65,f=-1.5) USER MOD Set 3.2: A 383 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 372 SER OG : rot 49:sc= 0.0504 USER MOD Single : A 373 LYS NZ :NH3+ 155:sc= 0.00257 (180deg=0) USER MOD Single : A 374 LYS NZ :NH3+ 162:sc= -0.0518 (180deg=-0.31) USER MOD Single : A 375 GLN : amide:sc= -0.285 K(o=-0.28,f=-0.84) USER MOD Single : A 376 GLN : amide:sc= -0.56 X(o=-0.56,f=-0.38) USER MOD Single : A 377 THR OG1 : rot 180:sc= 0 USER MOD Single : A 379 SER OG : rot 180:sc=-0.00139 USER MOD Single : A 385 LYS NZ :NH3+ -171:sc=-0.00625 (180deg=-0.0934) USER MOD Single : A 388 ASN : amide:sc= -0.294 X(o=-0.29,f=-0.48) USER MOD Single : A 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 393 ASN : amide:sc= 0.595 K(o=0.59,f=-4.6!) USER MOD Single : A 394 GLN : amide:sc= 0.156 X(o=0.16,f=-0.29) USER MOD Single : A 395 LYS NZ :NH3+ 134:sc= -0.213 (180deg=-0.782) USER MOD Single : A 399 ASN : amide:sc= -0.408 X(o=-0.41,f=-0.36) USER MOD Single : A 401 LYS NZ :NH3+ 160:sc= -0.145 (180deg=-0.57) USER MOD Single : A 403 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0367) USER MOD Single : A 408 ASN : amide:sc= -1.45 X(o=-1.4,f=-1.8) USER MOD Single : A 409 THR OG1 : rot 180:sc= 0.064 USER MOD Single : A 412 ASN : amide:sc= -0.597 X(o=-0.6,f=-0.22) USER MOD Single : A 417 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 LYS NZ :NH3+ 150:sc= 0.553 (180deg=-0.253) USER MOD Single : A 421 LYS NZ :NH3+ 162:sc= -0.126 (180deg=-0.57) USER MOD Single : A 426 LYS NZ :NH3+ 161:sc= 1.05 (180deg=0.482) USER MOD Single : A 428 SER OG : rot 100:sc= 0.0467 USER MOD Single : A 429 LYS NZ :NH3+ -169:sc= -0.0336 (180deg=-0.181) USER MOD Single : A 431 THR OG1 : rot -41:sc= 1.04 USER MOD Single : A 434 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 LYS NZ :NH3+ -163:sc= -0.0708 (180deg=-0.396) USER MOD Single : A 440 THR OG1 : rot 180:sc= 0 USER MOD Single : A 441 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 SER OG : rot -1:sc= 0.115 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 371 10.698 3.510 2.400 1.00 0.00 N ATOM 2 CA GLY A 371 12.049 2.907 2.508 1.00 0.00 C ATOM 3 C GLY A 371 12.541 2.371 1.178 1.00 0.00 C ATOM 4 O GLY A 371 12.270 2.956 0.126 1.00 0.00 O ATOM 0 HA2 GLY A 371 12.751 3.654 2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 371 12.028 2.099 3.239 1.00 0.00 H new ATOM 10 N SER A 372 13.245 1.250 1.221 1.00 0.00 N ATOM 11 CA SER A 372 13.758 0.614 0.020 1.00 0.00 C ATOM 12 C SER A 372 13.653 -0.910 0.118 1.00 0.00 C ATOM 13 O SER A 372 14.482 -1.559 0.760 1.00 0.00 O ATOM 14 CB SER A 372 15.210 1.038 -0.208 1.00 0.00 C ATOM 15 OG SER A 372 15.950 1.001 1.004 1.00 0.00 O ATOM 0 H SER A 372 13.475 0.759 2.085 1.00 0.00 H new ATOM 0 HA SER A 372 13.154 0.935 -0.829 1.00 0.00 H new ATOM 0 HB2 SER A 372 15.674 0.378 -0.941 1.00 0.00 H new ATOM 0 HB3 SER A 372 15.237 2.045 -0.624 1.00 0.00 H new ATOM 0 HG SER A 372 15.793 0.147 1.457 1.00 0.00 H new ATOM 21 N LYS A 373 12.618 -1.473 -0.497 1.00 0.00 N ATOM 22 CA LYS A 373 12.419 -2.919 -0.490 1.00 0.00 C ATOM 23 C LYS A 373 13.346 -3.597 -1.492 1.00 0.00 C ATOM 24 O LYS A 373 13.784 -2.977 -2.465 1.00 0.00 O ATOM 25 CB LYS A 373 10.961 -3.288 -0.816 1.00 0.00 C ATOM 26 CG LYS A 373 10.586 -3.158 -2.292 1.00 0.00 C ATOM 27 CD LYS A 373 10.199 -1.740 -2.676 1.00 0.00 C ATOM 28 CE LYS A 373 8.875 -1.331 -2.053 1.00 0.00 C ATOM 29 NZ LYS A 373 8.494 0.056 -2.429 1.00 0.00 N ATOM 0 H LYS A 373 11.905 -0.951 -1.006 1.00 0.00 H new ATOM 0 HA LYS A 373 12.652 -3.271 0.515 1.00 0.00 H new ATOM 0 HB2 LYS A 373 10.780 -4.315 -0.498 1.00 0.00 H new ATOM 0 HB3 LYS A 373 10.299 -2.651 -0.229 1.00 0.00 H new ATOM 0 HG2 LYS A 373 11.427 -3.480 -2.906 1.00 0.00 H new ATOM 0 HG3 LYS A 373 9.756 -3.829 -2.512 1.00 0.00 H new ATOM 0 HD2 LYS A 373 10.980 -1.050 -2.356 1.00 0.00 H new ATOM 0 HD3 LYS A 373 10.130 -1.663 -3.761 1.00 0.00 H new ATOM 0 HE2 LYS A 373 8.094 -2.022 -2.372 1.00 0.00 H new ATOM 0 HE3 LYS A 373 8.945 -1.408 -0.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 373 7.461 0.161 -2.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 373 8.950 0.729 -1.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 373 8.804 0.249 -3.403 1.00 0.00 H new ATOM 43 N LYS A 374 13.636 -4.868 -1.252 1.00 0.00 N ATOM 44 CA LYS A 374 14.436 -5.650 -2.179 1.00 0.00 C ATOM 45 C LYS A 374 13.596 -6.781 -2.769 1.00 0.00 C ATOM 46 O LYS A 374 13.371 -7.804 -2.117 1.00 0.00 O ATOM 47 CB LYS A 374 15.677 -6.211 -1.485 1.00 0.00 C ATOM 48 CG LYS A 374 16.693 -6.801 -2.451 1.00 0.00 C ATOM 49 CD LYS A 374 17.931 -7.312 -1.732 1.00 0.00 C ATOM 50 CE LYS A 374 19.003 -7.756 -2.720 1.00 0.00 C ATOM 51 NZ LYS A 374 19.501 -6.625 -3.551 1.00 0.00 N ATOM 0 H LYS A 374 13.329 -5.378 -0.424 1.00 0.00 H new ATOM 0 HA LYS A 374 14.767 -4.998 -2.987 1.00 0.00 H new ATOM 0 HB2 LYS A 374 16.152 -5.417 -0.909 1.00 0.00 H new ATOM 0 HB3 LYS A 374 15.371 -6.980 -0.776 1.00 0.00 H new ATOM 0 HG2 LYS A 374 16.233 -7.618 -3.007 1.00 0.00 H new ATOM 0 HG3 LYS A 374 16.983 -6.044 -3.179 1.00 0.00 H new ATOM 0 HD2 LYS A 374 18.330 -6.528 -1.088 1.00 0.00 H new ATOM 0 HD3 LYS A 374 17.660 -8.148 -1.087 1.00 0.00 H new ATOM 0 HE2 LYS A 374 19.836 -8.200 -2.175 1.00 0.00 H new ATOM 0 HE3 LYS A 374 18.598 -8.532 -3.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 20.412 -6.884 -3.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 18.812 -6.416 -4.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 19.627 -5.784 -2.953 1.00 0.00 H new ATOM 65 N GLN A 375 13.096 -6.549 -3.982 1.00 0.00 N ATOM 66 CA GLN A 375 12.272 -7.512 -4.722 1.00 0.00 C ATOM 67 C GLN A 375 10.891 -7.683 -4.078 1.00 0.00 C ATOM 68 O GLN A 375 10.074 -8.488 -4.529 1.00 0.00 O ATOM 69 CB GLN A 375 12.979 -8.867 -4.842 1.00 0.00 C ATOM 70 CG GLN A 375 12.455 -9.725 -5.983 1.00 0.00 C ATOM 71 CD GLN A 375 12.683 -9.090 -7.345 1.00 0.00 C ATOM 72 OE1 GLN A 375 13.652 -8.356 -7.550 1.00 0.00 O ATOM 73 NE2 GLN A 375 11.788 -9.352 -8.280 1.00 0.00 N ATOM 0 H GLN A 375 13.252 -5.677 -4.487 1.00 0.00 H new ATOM 0 HA GLN A 375 12.127 -7.110 -5.725 1.00 0.00 H new ATOM 0 HB2 GLN A 375 14.047 -8.700 -4.984 1.00 0.00 H new ATOM 0 HB3 GLN A 375 12.864 -9.412 -3.905 1.00 0.00 H new ATOM 0 HG2 GLN A 375 12.943 -10.699 -5.954 1.00 0.00 H new ATOM 0 HG3 GLN A 375 11.388 -9.899 -5.841 1.00 0.00 H new ATOM 0 HE21 GLN A 375 10.999 -9.964 -8.073 1.00 0.00 H new ATOM 0 HE22 GLN A 375 11.886 -8.942 -9.209 1.00 0.00 H new ATOM 82 N GLN A 376 10.627 -6.913 -3.032 1.00 0.00 N ATOM 83 CA GLN A 376 9.323 -6.920 -2.387 1.00 0.00 C ATOM 84 C GLN A 376 8.353 -6.053 -3.190 1.00 0.00 C ATOM 85 O GLN A 376 8.063 -4.913 -2.832 1.00 0.00 O ATOM 86 CB GLN A 376 9.440 -6.415 -0.943 1.00 0.00 C ATOM 87 CG GLN A 376 8.112 -6.311 -0.208 1.00 0.00 C ATOM 88 CD GLN A 376 8.233 -5.607 1.132 1.00 0.00 C ATOM 89 OE1 GLN A 376 7.311 -4.921 1.566 1.00 0.00 O ATOM 90 NE2 GLN A 376 9.365 -5.778 1.804 1.00 0.00 N ATOM 0 H GLN A 376 11.301 -6.274 -2.611 1.00 0.00 H new ATOM 0 HA GLN A 376 8.940 -7.940 -2.356 1.00 0.00 H new ATOM 0 HB2 GLN A 376 10.098 -7.084 -0.388 1.00 0.00 H new ATOM 0 HB3 GLN A 376 9.916 -5.434 -0.951 1.00 0.00 H new ATOM 0 HG2 GLN A 376 7.398 -5.774 -0.832 1.00 0.00 H new ATOM 0 HG3 GLN A 376 7.709 -7.312 -0.052 1.00 0.00 H new ATOM 0 HE21 GLN A 376 10.109 -6.355 1.412 1.00 0.00 H new ATOM 0 HE22 GLN A 376 9.491 -5.332 2.713 1.00 0.00 H new ATOM 99 N THR A 377 7.901 -6.579 -4.313 1.00 0.00 N ATOM 100 CA THR A 377 7.019 -5.830 -5.191 1.00 0.00 C ATOM 101 C THR A 377 5.705 -6.578 -5.449 1.00 0.00 C ATOM 102 O THR A 377 4.717 -5.978 -5.877 1.00 0.00 O ATOM 103 CB THR A 377 7.732 -5.502 -6.527 1.00 0.00 C ATOM 104 OG1 THR A 377 6.895 -4.693 -7.359 1.00 0.00 O ATOM 105 CG2 THR A 377 8.121 -6.775 -7.268 1.00 0.00 C ATOM 0 H THR A 377 8.128 -7.518 -4.639 1.00 0.00 H new ATOM 0 HA THR A 377 6.770 -4.895 -4.688 1.00 0.00 H new ATOM 0 HB THR A 377 8.640 -4.948 -6.290 1.00 0.00 H new ATOM 0 HG1 THR A 377 7.362 -4.494 -8.198 1.00 0.00 H new ATOM 0 HG21 THR A 377 8.619 -6.515 -8.202 1.00 0.00 H new ATOM 0 HG22 THR A 377 8.796 -7.365 -6.648 1.00 0.00 H new ATOM 0 HG23 THR A 377 7.226 -7.358 -7.485 1.00 0.00 H new ATOM 113 N GLU A 378 5.678 -7.879 -5.154 1.00 0.00 N ATOM 114 CA GLU A 378 4.482 -8.685 -5.378 1.00 0.00 C ATOM 115 C GLU A 378 3.355 -8.215 -4.470 1.00 0.00 C ATOM 116 O GLU A 378 2.218 -8.029 -4.911 1.00 0.00 O ATOM 117 CB GLU A 378 4.779 -10.161 -5.117 1.00 0.00 C ATOM 118 CG GLU A 378 3.603 -11.087 -5.392 1.00 0.00 C ATOM 119 CD GLU A 378 3.212 -11.124 -6.855 1.00 0.00 C ATOM 120 OE1 GLU A 378 3.906 -11.802 -7.642 1.00 0.00 O ATOM 121 OE2 GLU A 378 2.207 -10.482 -7.225 1.00 0.00 O ATOM 0 H GLU A 378 6.467 -8.392 -4.762 1.00 0.00 H new ATOM 0 HA GLU A 378 4.174 -8.567 -6.417 1.00 0.00 H new ATOM 0 HB2 GLU A 378 5.622 -10.467 -5.737 1.00 0.00 H new ATOM 0 HB3 GLU A 378 5.088 -10.281 -4.078 1.00 0.00 H new ATOM 0 HG2 GLU A 378 3.856 -12.095 -5.063 1.00 0.00 H new ATOM 0 HG3 GLU A 378 2.747 -10.764 -4.800 1.00 0.00 H new ATOM 128 N SER A 379 3.687 -8.016 -3.202 1.00 0.00 N ATOM 129 CA SER A 379 2.726 -7.542 -2.220 1.00 0.00 C ATOM 130 C SER A 379 2.136 -6.207 -2.647 1.00 0.00 C ATOM 131 O SER A 379 0.920 -6.032 -2.660 1.00 0.00 O ATOM 132 CB SER A 379 3.403 -7.409 -0.855 1.00 0.00 C ATOM 133 OG SER A 379 4.599 -6.658 -0.960 1.00 0.00 O ATOM 0 H SER A 379 4.622 -8.177 -2.829 1.00 0.00 H new ATOM 0 HA SER A 379 1.914 -8.266 -2.148 1.00 0.00 H new ATOM 0 HB2 SER A 379 2.724 -6.925 -0.153 1.00 0.00 H new ATOM 0 HB3 SER A 379 3.623 -8.399 -0.455 1.00 0.00 H new ATOM 0 HG SER A 379 5.016 -6.582 -0.077 1.00 0.00 H new ATOM 139 N ALA A 380 3.008 -5.280 -3.019 1.00 0.00 N ATOM 140 CA ALA A 380 2.587 -3.961 -3.462 1.00 0.00 C ATOM 141 C ALA A 380 1.638 -4.057 -4.649 1.00 0.00 C ATOM 142 O ALA A 380 0.608 -3.393 -4.683 1.00 0.00 O ATOM 143 CB ALA A 380 3.801 -3.117 -3.821 1.00 0.00 C ATOM 0 H ALA A 380 4.018 -5.420 -3.022 1.00 0.00 H new ATOM 0 HA ALA A 380 2.052 -3.482 -2.642 1.00 0.00 H new ATOM 0 HB1 ALA A 380 3.474 -2.131 -4.151 1.00 0.00 H new ATOM 0 HB2 ALA A 380 4.443 -3.012 -2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 380 4.357 -3.602 -4.623 1.00 0.00 H new ATOM 149 N GLU A 381 1.985 -4.904 -5.604 1.00 0.00 N ATOM 150 CA GLU A 381 1.195 -5.065 -6.815 1.00 0.00 C ATOM 151 C GLU A 381 -0.195 -5.633 -6.511 1.00 0.00 C ATOM 152 O GLU A 381 -1.212 -5.019 -6.844 1.00 0.00 O ATOM 153 CB GLU A 381 1.943 -5.981 -7.788 1.00 0.00 C ATOM 154 CG GLU A 381 1.221 -6.237 -9.102 1.00 0.00 C ATOM 155 CD GLU A 381 1.028 -4.985 -9.930 1.00 0.00 C ATOM 156 OE1 GLU A 381 -0.138 -4.632 -10.215 1.00 0.00 O ATOM 157 OE2 GLU A 381 2.034 -4.352 -10.307 1.00 0.00 O ATOM 0 H GLU A 381 2.815 -5.495 -5.564 1.00 0.00 H new ATOM 0 HA GLU A 381 1.053 -4.083 -7.267 1.00 0.00 H new ATOM 0 HB2 GLU A 381 2.917 -5.541 -8.004 1.00 0.00 H new ATOM 0 HB3 GLU A 381 2.126 -6.937 -7.298 1.00 0.00 H new ATOM 0 HG2 GLU A 381 1.786 -6.966 -9.683 1.00 0.00 H new ATOM 0 HG3 GLU A 381 0.247 -6.681 -8.894 1.00 0.00 H new ATOM 164 N ASN A 382 -0.239 -6.787 -5.858 1.00 0.00 N ATOM 165 CA ASN A 382 -1.500 -7.503 -5.678 1.00 0.00 C ATOM 166 C ASN A 382 -2.361 -6.875 -4.580 1.00 0.00 C ATOM 167 O ASN A 382 -3.582 -6.828 -4.710 1.00 0.00 O ATOM 168 CB ASN A 382 -1.258 -8.993 -5.388 1.00 0.00 C ATOM 169 CG ASN A 382 -1.035 -9.300 -3.918 1.00 0.00 C ATOM 170 OD1 ASN A 382 -1.957 -9.694 -3.203 1.00 0.00 O ATOM 171 ND2 ASN A 382 0.179 -9.090 -3.452 1.00 0.00 N ATOM 0 H ASN A 382 0.574 -7.246 -5.447 1.00 0.00 H new ATOM 0 HA ASN A 382 -2.048 -7.420 -6.616 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -2.113 -9.567 -5.744 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -0.390 -9.328 -5.956 1.00 0.00 H new ATOM 0 HD21 ASN A 382 0.382 -9.254 -2.466 1.00 0.00 H new ATOM 0 HD22 ASN A 382 0.916 -8.763 -4.077 1.00 0.00 H new ATOM 178 N LYS A 383 -1.736 -6.377 -3.512 1.00 0.00 N ATOM 179 CA LYS A 383 -2.491 -5.782 -2.410 1.00 0.00 C ATOM 180 C LYS A 383 -3.127 -4.473 -2.848 1.00 0.00 C ATOM 181 O LYS A 383 -4.289 -4.203 -2.541 1.00 0.00 O ATOM 182 CB LYS A 383 -1.603 -5.546 -1.186 1.00 0.00 C ATOM 183 CG LYS A 383 -1.860 -6.502 -0.028 1.00 0.00 C ATOM 184 CD LYS A 383 -1.567 -7.948 -0.396 1.00 0.00 C ATOM 185 CE LYS A 383 -1.753 -8.872 0.799 1.00 0.00 C ATOM 186 NZ LYS A 383 -1.493 -10.294 0.452 1.00 0.00 N ATOM 0 H LYS A 383 -0.724 -6.373 -3.387 1.00 0.00 H new ATOM 0 HA LYS A 383 -3.275 -6.486 -2.130 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -0.559 -5.632 -1.488 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -1.750 -4.524 -0.837 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -1.242 -6.214 0.822 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -2.899 -6.414 0.289 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -2.227 -8.260 -1.206 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -0.545 -8.031 -0.767 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -1.081 -8.566 1.601 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -2.770 -8.772 1.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -1.631 -10.888 1.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -2.151 -10.595 -0.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -0.515 -10.396 0.114 1.00 0.00 H new ATOM 200 N GLU A 384 -2.366 -3.666 -3.578 1.00 0.00 N ATOM 201 CA GLU A 384 -2.896 -2.441 -4.147 1.00 0.00 C ATOM 202 C GLU A 384 -4.058 -2.759 -5.072 1.00 0.00 C ATOM 203 O GLU A 384 -5.093 -2.115 -5.007 1.00 0.00 O ATOM 204 CB GLU A 384 -1.814 -1.686 -4.909 1.00 0.00 C ATOM 205 CG GLU A 384 -1.178 -0.551 -4.121 1.00 0.00 C ATOM 206 CD GLU A 384 -2.160 0.562 -3.801 1.00 0.00 C ATOM 207 OE1 GLU A 384 -2.665 1.208 -4.747 1.00 0.00 O ATOM 208 OE2 GLU A 384 -2.409 0.817 -2.605 1.00 0.00 O ATOM 0 H GLU A 384 -1.383 -3.840 -3.787 1.00 0.00 H new ATOM 0 HA GLU A 384 -3.248 -1.807 -3.333 1.00 0.00 H new ATOM 0 HB2 GLU A 384 -1.036 -2.389 -5.206 1.00 0.00 H new ATOM 0 HB3 GLU A 384 -2.244 -1.282 -5.825 1.00 0.00 H new ATOM 0 HG2 GLU A 384 -0.766 -0.945 -3.192 1.00 0.00 H new ATOM 0 HG3 GLU A 384 -0.344 -0.141 -4.691 1.00 0.00 H new ATOM 215 N LYS A 385 -3.890 -3.784 -5.905 1.00 0.00 N ATOM 216 CA LYS A 385 -4.932 -4.186 -6.847 1.00 0.00 C ATOM 217 C LYS A 385 -6.227 -4.531 -6.116 1.00 0.00 C ATOM 218 O LYS A 385 -7.320 -4.271 -6.615 1.00 0.00 O ATOM 219 CB LYS A 385 -4.471 -5.381 -7.683 1.00 0.00 C ATOM 220 CG LYS A 385 -4.442 -5.102 -9.179 1.00 0.00 C ATOM 221 CD LYS A 385 -5.801 -4.641 -9.685 1.00 0.00 C ATOM 222 CE LYS A 385 -5.797 -4.396 -11.185 1.00 0.00 C ATOM 223 NZ LYS A 385 -4.852 -3.319 -11.583 1.00 0.00 N ATOM 0 H LYS A 385 -3.043 -4.351 -5.947 1.00 0.00 H new ATOM 0 HA LYS A 385 -5.123 -3.343 -7.511 1.00 0.00 H new ATOM 0 HB2 LYS A 385 -3.474 -5.679 -7.358 1.00 0.00 H new ATOM 0 HB3 LYS A 385 -5.134 -6.225 -7.492 1.00 0.00 H new ATOM 0 HG2 LYS A 385 -3.694 -4.339 -9.394 1.00 0.00 H new ATOM 0 HG3 LYS A 385 -4.140 -6.003 -9.713 1.00 0.00 H new ATOM 0 HD2 LYS A 385 -6.552 -5.393 -9.442 1.00 0.00 H new ATOM 0 HD3 LYS A 385 -6.088 -3.725 -9.169 1.00 0.00 H new ATOM 0 HE2 LYS A 385 -5.529 -5.319 -11.700 1.00 0.00 H new ATOM 0 HE3 LYS A 385 -6.803 -4.130 -11.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 385 -4.995 -3.085 -12.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 385 -5.025 -2.474 -11.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 385 -3.875 -3.644 -11.439 1.00 0.00 H new ATOM 237 N ILE A 386 -6.096 -5.089 -4.918 1.00 0.00 N ATOM 238 CA ILE A 386 -7.253 -5.441 -4.108 1.00 0.00 C ATOM 239 C ILE A 386 -7.994 -4.172 -3.695 1.00 0.00 C ATOM 240 O ILE A 386 -9.225 -4.114 -3.709 1.00 0.00 O ATOM 241 CB ILE A 386 -6.830 -6.237 -2.851 1.00 0.00 C ATOM 242 CG1 ILE A 386 -6.183 -7.561 -3.256 1.00 0.00 C ATOM 243 CG2 ILE A 386 -8.022 -6.491 -1.942 1.00 0.00 C ATOM 244 CD1 ILE A 386 -5.634 -8.359 -2.091 1.00 0.00 C ATOM 0 H ILE A 386 -5.198 -5.307 -4.487 1.00 0.00 H new ATOM 0 HA ILE A 386 -7.912 -6.073 -4.704 1.00 0.00 H new ATOM 0 HB ILE A 386 -6.102 -5.641 -2.300 1.00 0.00 H new ATOM 0 HG12 ILE A 386 -6.919 -8.167 -3.784 1.00 0.00 H new ATOM 0 HG13 ILE A 386 -5.374 -7.359 -3.958 1.00 0.00 H new ATOM 0 HG21 ILE A 386 -7.698 -7.052 -1.066 1.00 0.00 H new ATOM 0 HG22 ILE A 386 -8.448 -5.539 -1.626 1.00 0.00 H new ATOM 0 HG23 ILE A 386 -8.776 -7.064 -2.482 1.00 0.00 H new ATOM 0 HD11 ILE A 386 -5.192 -9.284 -2.460 1.00 0.00 H new ATOM 0 HD12 ILE A 386 -4.873 -7.773 -1.575 1.00 0.00 H new ATOM 0 HD13 ILE A 386 -6.442 -8.594 -1.398 1.00 0.00 H new ATOM 256 N CYS A 387 -7.224 -3.153 -3.356 1.00 0.00 N ATOM 257 CA CYS A 387 -7.774 -1.862 -2.976 1.00 0.00 C ATOM 258 C CYS A 387 -8.290 -1.100 -4.197 1.00 0.00 C ATOM 259 O CYS A 387 -9.389 -0.543 -4.180 1.00 0.00 O ATOM 260 CB CYS A 387 -6.706 -1.031 -2.268 1.00 0.00 C ATOM 261 SG CYS A 387 -6.077 -1.772 -0.730 1.00 0.00 S ATOM 0 H CYS A 387 -6.205 -3.195 -3.336 1.00 0.00 H new ATOM 0 HA CYS A 387 -8.612 -2.037 -2.301 1.00 0.00 H new ATOM 0 HB2 CYS A 387 -5.871 -0.877 -2.951 1.00 0.00 H new ATOM 0 HB3 CYS A 387 -7.118 -0.048 -2.041 1.00 0.00 H new ATOM 266 N ASN A 388 -7.497 -1.098 -5.263 1.00 0.00 N ATOM 267 CA ASN A 388 -7.811 -0.321 -6.460 1.00 0.00 C ATOM 268 C ASN A 388 -9.054 -0.869 -7.155 1.00 0.00 C ATOM 269 O ASN A 388 -9.787 -0.126 -7.804 1.00 0.00 O ATOM 270 CB ASN A 388 -6.635 -0.318 -7.448 1.00 0.00 C ATOM 271 CG ASN A 388 -5.315 0.144 -6.845 1.00 0.00 C ATOM 272 OD1 ASN A 388 -4.244 -0.247 -7.315 1.00 0.00 O ATOM 273 ND2 ASN A 388 -5.369 0.962 -5.803 1.00 0.00 N ATOM 0 H ASN A 388 -6.628 -1.628 -5.324 1.00 0.00 H new ATOM 0 HA ASN A 388 -8.002 0.703 -6.138 1.00 0.00 H new ATOM 0 HB2 ASN A 388 -6.507 -1.324 -7.846 1.00 0.00 H new ATOM 0 HB3 ASN A 388 -6.883 0.329 -8.289 1.00 0.00 H new ATOM 0 HD21 ASN A 388 -4.507 1.287 -5.365 1.00 0.00 H new ATOM 0 HD22 ASN A 388 -6.272 1.266 -5.440 1.00 0.00 H new ATOM 280 N ALA A 389 -9.291 -2.170 -7.012 1.00 0.00 N ATOM 281 CA ALA A 389 -10.467 -2.805 -7.605 1.00 0.00 C ATOM 282 C ALA A 389 -11.754 -2.321 -6.938 1.00 0.00 C ATOM 283 O ALA A 389 -12.849 -2.509 -7.467 1.00 0.00 O ATOM 284 CB ALA A 389 -10.360 -4.320 -7.503 1.00 0.00 C ATOM 0 H ALA A 389 -8.686 -2.805 -6.492 1.00 0.00 H new ATOM 0 HA ALA A 389 -10.505 -2.522 -8.657 1.00 0.00 H new ATOM 0 HB1 ALA A 389 -11.243 -4.778 -7.949 1.00 0.00 H new ATOM 0 HB2 ALA A 389 -9.469 -4.658 -8.032 1.00 0.00 H new ATOM 0 HB3 ALA A 389 -10.291 -4.610 -6.455 1.00 0.00 H new ATOM 290 N ALA A 390 -11.618 -1.707 -5.771 1.00 0.00 N ATOM 291 CA ALA A 390 -12.767 -1.166 -5.054 1.00 0.00 C ATOM 292 C ALA A 390 -12.901 0.326 -5.303 1.00 0.00 C ATOM 293 O ALA A 390 -13.996 0.887 -5.211 1.00 0.00 O ATOM 294 CB ALA A 390 -12.632 -1.434 -3.567 1.00 0.00 C ATOM 0 H ALA A 390 -10.724 -1.570 -5.300 1.00 0.00 H new ATOM 0 HA ALA A 390 -13.665 -1.661 -5.424 1.00 0.00 H new ATOM 0 HB1 ALA A 390 -13.496 -1.025 -3.044 1.00 0.00 H new ATOM 0 HB2 ALA A 390 -12.579 -2.509 -3.394 1.00 0.00 H new ATOM 0 HB3 ALA A 390 -11.724 -0.961 -3.193 1.00 0.00 H new ATOM 300 N LYS A 391 -11.767 0.952 -5.616 1.00 0.00 N ATOM 301 CA LYS A 391 -11.689 2.388 -5.869 1.00 0.00 C ATOM 302 C LYS A 391 -12.105 3.195 -4.640 1.00 0.00 C ATOM 303 O LYS A 391 -11.273 3.518 -3.791 1.00 0.00 O ATOM 304 CB LYS A 391 -12.545 2.783 -7.080 1.00 0.00 C ATOM 305 CG LYS A 391 -12.094 2.155 -8.390 1.00 0.00 C ATOM 306 CD LYS A 391 -13.040 2.512 -9.522 1.00 0.00 C ATOM 307 CE LYS A 391 -12.627 1.859 -10.833 1.00 0.00 C ATOM 308 NZ LYS A 391 -13.644 2.075 -11.896 1.00 0.00 N ATOM 0 H LYS A 391 -10.871 0.472 -5.701 1.00 0.00 H new ATOM 0 HA LYS A 391 -10.648 2.621 -6.091 1.00 0.00 H new ATOM 0 HB2 LYS A 391 -13.579 2.497 -6.889 1.00 0.00 H new ATOM 0 HB3 LYS A 391 -12.529 3.868 -7.185 1.00 0.00 H new ATOM 0 HG2 LYS A 391 -11.087 2.495 -8.632 1.00 0.00 H new ATOM 0 HG3 LYS A 391 -12.046 1.072 -8.280 1.00 0.00 H new ATOM 0 HD2 LYS A 391 -14.051 2.198 -9.263 1.00 0.00 H new ATOM 0 HD3 LYS A 391 -13.064 3.595 -9.647 1.00 0.00 H new ATOM 0 HE2 LYS A 391 -11.669 2.266 -11.157 1.00 0.00 H new ATOM 0 HE3 LYS A 391 -12.483 0.790 -10.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 -13.330 1.617 -12.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 -14.552 1.665 -11.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 -13.763 3.095 -12.061 1.00 0.00 H new ATOM 322 N ASP A 392 -13.395 3.487 -4.535 1.00 0.00 N ATOM 323 CA ASP A 392 -13.907 4.334 -3.463 1.00 0.00 C ATOM 324 C ASP A 392 -14.957 3.614 -2.623 1.00 0.00 C ATOM 325 O ASP A 392 -15.633 4.237 -1.802 1.00 0.00 O ATOM 326 CB ASP A 392 -14.506 5.624 -4.034 1.00 0.00 C ATOM 327 CG ASP A 392 -15.618 5.370 -5.039 1.00 0.00 C ATOM 328 OD1 ASP A 392 -15.363 5.493 -6.255 1.00 0.00 O ATOM 329 OD2 ASP A 392 -16.751 5.043 -4.628 1.00 0.00 O ATOM 0 H ASP A 392 -14.109 3.149 -5.181 1.00 0.00 H new ATOM 0 HA ASP A 392 -13.063 4.578 -2.818 1.00 0.00 H new ATOM 0 HB2 ASP A 392 -14.895 6.230 -3.216 1.00 0.00 H new ATOM 0 HB3 ASP A 392 -13.717 6.203 -4.513 1.00 0.00 H new ATOM 334 N ASN A 393 -15.097 2.308 -2.805 1.00 0.00 N ATOM 335 CA ASN A 393 -16.085 1.563 -2.030 1.00 0.00 C ATOM 336 C ASN A 393 -15.534 1.241 -0.647 1.00 0.00 C ATOM 337 O ASN A 393 -14.888 0.212 -0.447 1.00 0.00 O ATOM 338 CB ASN A 393 -16.520 0.271 -2.729 1.00 0.00 C ATOM 339 CG ASN A 393 -17.798 -0.288 -2.127 1.00 0.00 C ATOM 340 OD1 ASN A 393 -17.770 -1.053 -1.162 1.00 0.00 O ATOM 341 ND2 ASN A 393 -18.933 0.095 -2.694 1.00 0.00 N ATOM 0 H ASN A 393 -14.554 1.751 -3.465 1.00 0.00 H new ATOM 0 HA ASN A 393 -16.966 2.199 -1.938 1.00 0.00 H new ATOM 0 HB2 ASN A 393 -16.672 0.465 -3.791 1.00 0.00 H new ATOM 0 HB3 ASN A 393 -15.725 -0.471 -2.651 1.00 0.00 H new ATOM 0 HD21 ASN A 393 -19.824 -0.245 -2.332 1.00 0.00 H new ATOM 0 HD22 ASN A 393 -18.916 0.730 -3.492 1.00 0.00 H new ATOM 348 N GLN A 394 -15.784 2.143 0.294 1.00 0.00 N ATOM 349 CA GLN A 394 -15.299 2.009 1.659 1.00 0.00 C ATOM 350 C GLN A 394 -15.659 0.658 2.264 1.00 0.00 C ATOM 351 O GLN A 394 -14.796 -0.032 2.798 1.00 0.00 O ATOM 352 CB GLN A 394 -15.881 3.125 2.526 1.00 0.00 C ATOM 353 CG GLN A 394 -15.379 3.100 3.959 1.00 0.00 C ATOM 354 CD GLN A 394 -16.075 4.108 4.851 1.00 0.00 C ATOM 355 OE1 GLN A 394 -16.504 5.170 4.395 1.00 0.00 O ATOM 356 NE2 GLN A 394 -16.205 3.777 6.127 1.00 0.00 N ATOM 0 H GLN A 394 -16.330 2.989 0.130 1.00 0.00 H new ATOM 0 HA GLN A 394 -14.212 2.083 1.629 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -15.634 4.088 2.079 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -16.968 3.044 2.528 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -15.522 2.101 4.370 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -14.307 3.297 3.966 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -15.835 2.888 6.463 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -16.675 4.411 6.773 1.00 0.00 H new ATOM 365 N LYS A 395 -16.927 0.282 2.157 1.00 0.00 N ATOM 366 CA LYS A 395 -17.439 -0.898 2.843 1.00 0.00 C ATOM 367 C LYS A 395 -16.700 -2.166 2.420 1.00 0.00 C ATOM 368 O LYS A 395 -16.305 -2.973 3.264 1.00 0.00 O ATOM 369 CB LYS A 395 -18.937 -1.053 2.593 1.00 0.00 C ATOM 370 CG LYS A 395 -19.571 -2.125 3.458 1.00 0.00 C ATOM 371 CD LYS A 395 -21.080 -2.152 3.320 1.00 0.00 C ATOM 372 CE LYS A 395 -21.699 -3.016 4.402 1.00 0.00 C ATOM 373 NZ LYS A 395 -21.372 -2.507 5.762 1.00 0.00 N ATOM 0 H LYS A 395 -17.622 0.779 1.600 1.00 0.00 H new ATOM 0 HA LYS A 395 -17.268 -0.755 3.910 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -19.432 -0.101 2.782 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -19.102 -1.295 1.543 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -19.165 -3.099 3.183 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -19.306 -1.952 4.501 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -21.475 -1.138 3.386 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -21.354 -2.537 2.338 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -22.781 -3.042 4.273 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -21.341 -4.040 4.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -22.233 -2.496 6.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -20.663 -3.127 6.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -20.991 -1.542 5.689 1.00 0.00 H new ATOM 387 N ALA A 396 -16.489 -2.329 1.118 1.00 0.00 N ATOM 388 CA ALA A 396 -15.801 -3.504 0.602 1.00 0.00 C ATOM 389 C ALA A 396 -14.365 -3.535 1.107 1.00 0.00 C ATOM 390 O ALA A 396 -13.802 -4.594 1.390 1.00 0.00 O ATOM 391 CB ALA A 396 -15.827 -3.508 -0.917 1.00 0.00 C ATOM 0 H ALA A 396 -16.784 -1.663 0.404 1.00 0.00 H new ATOM 0 HA ALA A 396 -16.317 -4.395 0.959 1.00 0.00 H new ATOM 0 HB1 ALA A 396 -15.309 -4.392 -1.287 1.00 0.00 H new ATOM 0 HB2 ALA A 396 -16.860 -3.521 -1.263 1.00 0.00 H new ATOM 0 HB3 ALA A 396 -15.330 -2.613 -1.292 1.00 0.00 H new ATOM 397 N CYS A 397 -13.797 -2.356 1.248 1.00 0.00 N ATOM 398 CA CYS A 397 -12.428 -2.207 1.691 1.00 0.00 C ATOM 399 C CYS A 397 -12.310 -2.377 3.195 1.00 0.00 C ATOM 400 O CYS A 397 -11.278 -2.805 3.695 1.00 0.00 O ATOM 401 CB CYS A 397 -11.913 -0.854 1.250 1.00 0.00 C ATOM 402 SG CYS A 397 -11.844 -0.707 -0.561 1.00 0.00 S ATOM 0 H CYS A 397 -14.272 -1.474 1.058 1.00 0.00 H new ATOM 0 HA CYS A 397 -11.819 -2.989 1.238 1.00 0.00 H new ATOM 0 HB2 CYS A 397 -12.557 -0.072 1.653 1.00 0.00 H new ATOM 0 HB3 CYS A 397 -10.918 -0.692 1.665 1.00 0.00 H new ATOM 407 N GLU A 398 -13.365 -2.043 3.912 1.00 0.00 N ATOM 408 CA GLU A 398 -13.429 -2.330 5.341 1.00 0.00 C ATOM 409 C GLU A 398 -13.436 -3.839 5.573 1.00 0.00 C ATOM 410 O GLU A 398 -13.002 -4.322 6.617 1.00 0.00 O ATOM 411 CB GLU A 398 -14.659 -1.693 5.985 1.00 0.00 C ATOM 412 CG GLU A 398 -14.672 -0.179 5.884 1.00 0.00 C ATOM 413 CD GLU A 398 -15.704 0.458 6.786 1.00 0.00 C ATOM 414 OE1 GLU A 398 -16.892 0.091 6.696 1.00 0.00 O ATOM 415 OE2 GLU A 398 -15.325 1.337 7.587 1.00 0.00 O ATOM 0 H GLU A 398 -14.189 -1.574 3.535 1.00 0.00 H new ATOM 0 HA GLU A 398 -12.545 -1.898 5.810 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -15.556 -2.090 5.510 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -14.701 -1.981 7.036 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -13.685 0.206 6.140 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -14.870 0.110 4.852 1.00 0.00 H new ATOM 422 N ASN A 399 -13.930 -4.580 4.588 1.00 0.00 N ATOM 423 CA ASN A 399 -13.857 -6.037 4.620 1.00 0.00 C ATOM 424 C ASN A 399 -12.433 -6.482 4.314 1.00 0.00 C ATOM 425 O ASN A 399 -11.964 -7.511 4.798 1.00 0.00 O ATOM 426 CB ASN A 399 -14.816 -6.653 3.598 1.00 0.00 C ATOM 427 CG ASN A 399 -16.251 -6.206 3.786 1.00 0.00 C ATOM 428 OD1 ASN A 399 -16.696 -5.954 4.907 1.00 0.00 O ATOM 429 ND2 ASN A 399 -16.984 -6.100 2.686 1.00 0.00 N ATOM 0 H ASN A 399 -14.385 -4.198 3.759 1.00 0.00 H new ATOM 0 HA ASN A 399 -14.146 -6.377 5.615 1.00 0.00 H new ATOM 0 HB2 ASN A 399 -14.487 -6.387 2.593 1.00 0.00 H new ATOM 0 HB3 ASN A 399 -14.767 -7.739 3.672 1.00 0.00 H new ATOM 0 HD21 ASN A 399 -17.957 -5.800 2.748 1.00 0.00 H new ATOM 0 HD22 ASN A 399 -16.575 -6.319 1.778 1.00 0.00 H new ATOM 436 N LEU A 400 -11.752 -5.689 3.497 1.00 0.00 N ATOM 437 CA LEU A 400 -10.367 -5.952 3.117 1.00 0.00 C ATOM 438 C LEU A 400 -9.400 -5.311 4.114 1.00 0.00 C ATOM 439 O LEU A 400 -8.181 -5.421 3.975 1.00 0.00 O ATOM 440 CB LEU A 400 -10.100 -5.385 1.722 1.00 0.00 C ATOM 441 CG LEU A 400 -11.058 -5.856 0.625 1.00 0.00 C ATOM 442 CD1 LEU A 400 -10.905 -4.997 -0.620 1.00 0.00 C ATOM 443 CD2 LEU A 400 -10.805 -7.316 0.292 1.00 0.00 C ATOM 0 H LEU A 400 -12.143 -4.845 3.078 1.00 0.00 H new ATOM 0 HA LEU A 400 -10.209 -7.031 3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -10.144 -4.297 1.776 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -9.083 -5.649 1.430 1.00 0.00 H new ATOM 0 HG LEU A 400 -12.079 -5.755 0.993 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -11.593 -5.346 -1.390 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -11.130 -3.959 -0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -9.882 -5.070 -0.989 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -11.494 -7.636 -0.490 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -9.779 -7.437 -0.057 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -10.960 -7.924 1.183 1.00 0.00 H new ATOM 455 N LYS A 401 -9.962 -4.638 5.111 1.00 0.00 N ATOM 456 CA LYS A 401 -9.199 -3.875 6.086 1.00 0.00 C ATOM 457 C LYS A 401 -8.137 -4.723 6.781 1.00 0.00 C ATOM 458 O LYS A 401 -6.988 -4.300 6.925 1.00 0.00 O ATOM 459 CB LYS A 401 -10.159 -3.298 7.119 1.00 0.00 C ATOM 460 CG LYS A 401 -10.143 -1.782 7.210 1.00 0.00 C ATOM 461 CD LYS A 401 -8.816 -1.259 7.724 1.00 0.00 C ATOM 462 CE LYS A 401 -8.899 0.223 8.042 1.00 0.00 C ATOM 463 NZ LYS A 401 -9.918 0.512 9.088 1.00 0.00 N ATOM 0 H LYS A 401 -10.970 -4.608 5.265 1.00 0.00 H new ATOM 0 HA LYS A 401 -8.677 -3.076 5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 401 -11.171 -3.625 6.880 1.00 0.00 H new ATOM 0 HB3 LYS A 401 -9.913 -3.712 8.097 1.00 0.00 H new ATOM 0 HG2 LYS A 401 -10.344 -1.357 6.226 1.00 0.00 H new ATOM 0 HG3 LYS A 401 -10.944 -1.450 7.870 1.00 0.00 H new ATOM 0 HD2 LYS A 401 -8.526 -1.810 8.618 1.00 0.00 H new ATOM 0 HD3 LYS A 401 -8.040 -1.431 6.978 1.00 0.00 H new ATOM 0 HE2 LYS A 401 -7.924 0.577 8.378 1.00 0.00 H new ATOM 0 HE3 LYS A 401 -9.144 0.775 7.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 -9.722 1.439 9.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 -10.864 0.523 8.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 -9.880 -0.224 9.822 1.00 0.00 H new ATOM 477 N GLU A 402 -8.520 -5.924 7.189 1.00 0.00 N ATOM 478 CA GLU A 402 -7.627 -6.799 7.935 1.00 0.00 C ATOM 479 C GLU A 402 -6.491 -7.310 7.045 1.00 0.00 C ATOM 480 O GLU A 402 -5.476 -7.803 7.538 1.00 0.00 O ATOM 481 CB GLU A 402 -8.415 -7.973 8.520 1.00 0.00 C ATOM 482 CG GLU A 402 -7.769 -8.585 9.752 1.00 0.00 C ATOM 483 CD GLU A 402 -7.636 -7.590 10.887 1.00 0.00 C ATOM 484 OE1 GLU A 402 -6.499 -7.186 11.202 1.00 0.00 O ATOM 485 OE2 GLU A 402 -8.672 -7.203 11.475 1.00 0.00 O ATOM 0 H GLU A 402 -9.446 -6.316 7.016 1.00 0.00 H new ATOM 0 HA GLU A 402 -7.184 -6.226 8.750 1.00 0.00 H new ATOM 0 HB2 GLU A 402 -9.419 -7.634 8.777 1.00 0.00 H new ATOM 0 HB3 GLU A 402 -8.524 -8.743 7.756 1.00 0.00 H new ATOM 0 HG2 GLU A 402 -8.363 -9.436 10.086 1.00 0.00 H new ATOM 0 HG3 GLU A 402 -6.783 -8.968 9.490 1.00 0.00 H new ATOM 492 N LYS A 403 -6.659 -7.174 5.734 1.00 0.00 N ATOM 493 CA LYS A 403 -5.634 -7.590 4.783 1.00 0.00 C ATOM 494 C LYS A 403 -4.582 -6.500 4.606 1.00 0.00 C ATOM 495 O LYS A 403 -3.568 -6.705 3.938 1.00 0.00 O ATOM 496 CB LYS A 403 -6.259 -7.930 3.428 1.00 0.00 C ATOM 497 CG LYS A 403 -7.080 -9.207 3.439 1.00 0.00 C ATOM 498 CD LYS A 403 -7.646 -9.514 2.064 1.00 0.00 C ATOM 499 CE LYS A 403 -8.213 -10.922 1.993 1.00 0.00 C ATOM 500 NZ LYS A 403 -9.262 -11.165 3.017 1.00 0.00 N ATOM 0 H LYS A 403 -7.496 -6.779 5.305 1.00 0.00 H new ATOM 0 HA LYS A 403 -5.151 -8.481 5.184 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -6.895 -7.102 3.113 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -5.467 -8.024 2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -6.458 -10.038 3.772 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -7.895 -9.111 4.156 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -8.428 -8.794 1.823 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -6.864 -9.398 1.314 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -8.632 -11.092 1.001 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -7.406 -11.642 2.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -9.687 -12.101 2.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -8.836 -11.130 3.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -9.998 -10.434 2.941 1.00 0.00 H new ATOM 514 N GLY A 404 -4.828 -5.348 5.210 1.00 0.00 N ATOM 515 CA GLY A 404 -3.905 -4.238 5.090 1.00 0.00 C ATOM 516 C GLY A 404 -4.443 -3.151 4.186 1.00 0.00 C ATOM 517 O GLY A 404 -3.814 -2.107 4.012 1.00 0.00 O ATOM 0 H GLY A 404 -5.651 -5.161 5.782 1.00 0.00 H new ATOM 0 HA2 GLY A 404 -3.706 -3.823 6.078 1.00 0.00 H new ATOM 0 HA3 GLY A 404 -2.954 -4.598 4.698 1.00 0.00 H new ATOM 521 N CYS A 405 -5.613 -3.398 3.615 1.00 0.00 N ATOM 522 CA CYS A 405 -6.244 -2.437 2.729 1.00 0.00 C ATOM 523 C CYS A 405 -7.043 -1.428 3.544 1.00 0.00 C ATOM 524 O CYS A 405 -8.044 -1.773 4.171 1.00 0.00 O ATOM 525 CB CYS A 405 -7.153 -3.153 1.728 1.00 0.00 C ATOM 526 SG CYS A 405 -7.747 -2.090 0.376 1.00 0.00 S ATOM 0 H CYS A 405 -6.144 -4.258 3.751 1.00 0.00 H new ATOM 0 HA CYS A 405 -5.470 -1.908 2.173 1.00 0.00 H new ATOM 0 HB2 CYS A 405 -6.612 -3.998 1.301 1.00 0.00 H new ATOM 0 HB3 CYS A 405 -8.012 -3.561 2.260 1.00 0.00 H new ATOM 531 N VAL A 406 -6.585 -0.189 3.554 1.00 0.00 N ATOM 532 CA VAL A 406 -7.217 0.848 4.351 1.00 0.00 C ATOM 533 C VAL A 406 -7.883 1.874 3.451 1.00 0.00 C ATOM 534 O VAL A 406 -7.247 2.416 2.549 1.00 0.00 O ATOM 535 CB VAL A 406 -6.188 1.570 5.250 1.00 0.00 C ATOM 536 CG1 VAL A 406 -6.861 2.630 6.110 1.00 0.00 C ATOM 537 CG2 VAL A 406 -5.433 0.576 6.117 1.00 0.00 C ATOM 0 H VAL A 406 -5.776 0.124 3.018 1.00 0.00 H new ATOM 0 HA VAL A 406 -7.963 0.365 4.982 1.00 0.00 H new ATOM 0 HB VAL A 406 -5.470 2.069 4.599 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -6.114 3.122 6.732 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -7.341 3.368 5.468 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -7.611 2.160 6.747 1.00 0.00 H new ATOM 0 HG21 VAL A 406 -4.715 1.109 6.740 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -6.137 0.039 6.753 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -4.905 -0.134 5.481 1.00 0.00 H new ATOM 547 N PHE A 407 -9.164 2.128 3.661 1.00 0.00 N ATOM 548 CA PHE A 407 -9.792 3.227 2.982 1.00 0.00 C ATOM 549 C PHE A 407 -9.279 4.524 3.582 1.00 0.00 C ATOM 550 O PHE A 407 -9.446 4.782 4.775 1.00 0.00 O ATOM 551 CB PHE A 407 -11.308 3.164 3.089 1.00 0.00 C ATOM 552 CG PHE A 407 -11.970 4.118 2.152 1.00 0.00 C ATOM 553 CD1 PHE A 407 -12.154 5.444 2.501 1.00 0.00 C ATOM 554 CD2 PHE A 407 -12.392 3.691 0.912 1.00 0.00 C ATOM 555 CE1 PHE A 407 -12.752 6.325 1.626 1.00 0.00 C ATOM 556 CE2 PHE A 407 -12.991 4.563 0.033 1.00 0.00 C ATOM 557 CZ PHE A 407 -13.174 5.884 0.388 1.00 0.00 C ATOM 0 H PHE A 407 -9.771 1.596 4.284 1.00 0.00 H new ATOM 0 HA PHE A 407 -9.542 3.173 1.922 1.00 0.00 H new ATOM 0 HB2 PHE A 407 -11.646 2.150 2.874 1.00 0.00 H new ATOM 0 HB3 PHE A 407 -11.610 3.390 4.112 1.00 0.00 H new ATOM 0 HD1 PHE A 407 -11.826 5.792 3.469 1.00 0.00 H new ATOM 0 HD2 PHE A 407 -12.251 2.659 0.627 1.00 0.00 H new ATOM 0 HE1 PHE A 407 -12.890 7.358 1.908 1.00 0.00 H new ATOM 0 HE2 PHE A 407 -13.318 4.214 -0.935 1.00 0.00 H new ATOM 0 HZ PHE A 407 -13.646 6.570 -0.300 1.00 0.00 H new ATOM 567 N ASN A 408 -8.650 5.325 2.754 1.00 0.00 N ATOM 568 CA ASN A 408 -8.020 6.544 3.215 1.00 0.00 C ATOM 569 C ASN A 408 -8.826 7.743 2.753 1.00 0.00 C ATOM 570 O ASN A 408 -8.812 8.082 1.572 1.00 0.00 O ATOM 571 CB ASN A 408 -6.578 6.627 2.693 1.00 0.00 C ATOM 572 CG ASN A 408 -5.818 7.818 3.243 1.00 0.00 C ATOM 573 OD1 ASN A 408 -6.098 8.291 4.343 1.00 0.00 O ATOM 574 ND2 ASN A 408 -4.838 8.296 2.492 1.00 0.00 N ATOM 0 H ASN A 408 -8.560 5.155 1.752 1.00 0.00 H new ATOM 0 HA ASN A 408 -7.989 6.541 4.305 1.00 0.00 H new ATOM 0 HB2 ASN A 408 -6.048 5.711 2.957 1.00 0.00 H new ATOM 0 HB3 ASN A 408 -6.594 6.684 1.605 1.00 0.00 H new ATOM 0 HD21 ASN A 408 -4.283 9.086 2.820 1.00 0.00 H new ATOM 0 HD22 ASN A 408 -4.638 7.874 1.585 1.00 0.00 H new ATOM 581 N THR A 409 -9.542 8.370 3.678 1.00 0.00 N ATOM 582 CA THR A 409 -10.379 9.518 3.355 1.00 0.00 C ATOM 583 C THR A 409 -9.538 10.710 2.894 1.00 0.00 C ATOM 584 O THR A 409 -10.030 11.591 2.193 1.00 0.00 O ATOM 585 CB THR A 409 -11.261 9.915 4.555 1.00 0.00 C ATOM 586 OG1 THR A 409 -10.564 9.652 5.781 1.00 0.00 O ATOM 587 CG2 THR A 409 -12.575 9.149 4.539 1.00 0.00 C ATOM 0 H THR A 409 -9.559 8.101 4.662 1.00 0.00 H new ATOM 0 HA THR A 409 -11.030 9.225 2.531 1.00 0.00 H new ATOM 0 HB THR A 409 -11.480 10.980 4.481 1.00 0.00 H new ATOM 0 HG1 THR A 409 -11.129 9.908 6.540 1.00 0.00 H new ATOM 0 HG21 THR A 409 -13.180 9.446 5.396 1.00 0.00 H new ATOM 0 HG22 THR A 409 -13.115 9.372 3.619 1.00 0.00 H new ATOM 0 HG23 THR A 409 -12.373 8.079 4.591 1.00 0.00 H new ATOM 595 N GLU A 410 -8.267 10.721 3.286 1.00 0.00 N ATOM 596 CA GLU A 410 -7.313 11.701 2.777 1.00 0.00 C ATOM 597 C GLU A 410 -7.154 11.543 1.267 1.00 0.00 C ATOM 598 O GLU A 410 -7.012 12.519 0.532 1.00 0.00 O ATOM 599 CB GLU A 410 -5.957 11.508 3.454 1.00 0.00 C ATOM 600 CG GLU A 410 -4.871 12.440 2.937 1.00 0.00 C ATOM 601 CD GLU A 410 -3.518 12.170 3.563 1.00 0.00 C ATOM 602 OE1 GLU A 410 -3.084 10.997 3.585 1.00 0.00 O ATOM 603 OE2 GLU A 410 -2.868 13.137 4.014 1.00 0.00 O ATOM 0 H GLU A 410 -7.873 10.060 3.956 1.00 0.00 H new ATOM 0 HA GLU A 410 -7.688 12.701 2.996 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -6.073 11.661 4.527 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -5.635 10.476 3.312 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -4.793 12.334 1.855 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -5.159 13.472 3.137 1.00 0.00 H new ATOM 610 N SER A 411 -7.204 10.300 0.818 1.00 0.00 N ATOM 611 CA SER A 411 -6.996 9.978 -0.582 1.00 0.00 C ATOM 612 C SER A 411 -8.343 9.791 -1.286 1.00 0.00 C ATOM 613 O SER A 411 -8.413 9.740 -2.515 1.00 0.00 O ATOM 614 CB SER A 411 -6.145 8.703 -0.681 1.00 0.00 C ATOM 615 OG SER A 411 -5.688 8.457 -2.000 1.00 0.00 O ATOM 0 H SER A 411 -7.389 9.491 1.411 1.00 0.00 H new ATOM 0 HA SER A 411 -6.471 10.796 -1.075 1.00 0.00 H new ATOM 0 HB2 SER A 411 -5.288 8.789 -0.013 1.00 0.00 H new ATOM 0 HB3 SER A 411 -6.732 7.851 -0.338 1.00 0.00 H new ATOM 0 HG SER A 411 -5.001 7.758 -1.983 1.00 0.00 H new ATOM 621 N ASN A 412 -9.405 9.699 -0.477 1.00 0.00 N ATOM 622 CA ASN A 412 -10.774 9.454 -0.955 1.00 0.00 C ATOM 623 C ASN A 412 -10.823 8.171 -1.788 1.00 0.00 C ATOM 624 O ASN A 412 -11.568 8.062 -2.758 1.00 0.00 O ATOM 625 CB ASN A 412 -11.306 10.657 -1.755 1.00 0.00 C ATOM 626 CG ASN A 412 -12.820 10.619 -1.966 1.00 0.00 C ATOM 627 OD1 ASN A 412 -13.591 11.024 -1.092 1.00 0.00 O ATOM 628 ND2 ASN A 412 -13.257 10.161 -3.131 1.00 0.00 N ATOM 0 H ASN A 412 -9.340 9.793 0.537 1.00 0.00 H new ATOM 0 HA ASN A 412 -11.423 9.325 -0.089 1.00 0.00 H new ATOM 0 HB2 ASN A 412 -11.041 11.577 -1.234 1.00 0.00 H new ATOM 0 HB3 ASN A 412 -10.811 10.687 -2.726 1.00 0.00 H new ATOM 0 HD21 ASN A 412 -14.258 10.136 -3.326 1.00 0.00 H new ATOM 0 HD22 ASN A 412 -12.592 9.834 -3.832 1.00 0.00 H new ATOM 635 N LYS A 413 -10.025 7.191 -1.389 1.00 0.00 N ATOM 636 CA LYS A 413 -10.003 5.905 -2.065 1.00 0.00 C ATOM 637 C LYS A 413 -9.406 4.852 -1.151 1.00 0.00 C ATOM 638 O LYS A 413 -8.834 5.175 -0.106 1.00 0.00 O ATOM 639 CB LYS A 413 -9.187 5.979 -3.361 1.00 0.00 C ATOM 640 CG LYS A 413 -7.688 6.113 -3.141 1.00 0.00 C ATOM 641 CD LYS A 413 -6.930 6.072 -4.455 1.00 0.00 C ATOM 642 CE LYS A 413 -7.181 7.319 -5.286 1.00 0.00 C ATOM 643 NZ LYS A 413 -6.477 8.504 -4.731 1.00 0.00 N ATOM 0 H LYS A 413 -9.384 7.264 -0.599 1.00 0.00 H new ATOM 0 HA LYS A 413 -11.029 5.636 -2.316 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -9.379 5.083 -3.951 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -9.535 6.828 -3.949 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -7.477 7.050 -2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -7.340 5.308 -2.493 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -5.863 5.975 -4.257 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -7.230 5.190 -5.021 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -6.850 7.146 -6.310 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -8.252 7.519 -5.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -7.105 9.332 -4.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -6.212 8.319 -3.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -5.620 8.692 -5.290 1.00 0.00 H new ATOM 657 N CYS A 414 -9.557 3.599 -1.533 1.00 0.00 N ATOM 658 CA CYS A 414 -8.919 2.514 -0.818 1.00 0.00 C ATOM 659 C CYS A 414 -7.449 2.444 -1.199 1.00 0.00 C ATOM 660 O CYS A 414 -7.106 2.308 -2.375 1.00 0.00 O ATOM 661 CB CYS A 414 -9.606 1.196 -1.131 1.00 0.00 C ATOM 662 SG CYS A 414 -11.405 1.234 -0.909 1.00 0.00 S ATOM 0 H CYS A 414 -10.116 3.308 -2.335 1.00 0.00 H new ATOM 0 HA CYS A 414 -9.002 2.699 0.253 1.00 0.00 H new ATOM 0 HB2 CYS A 414 -9.383 0.917 -2.161 1.00 0.00 H new ATOM 0 HB3 CYS A 414 -9.187 0.419 -0.492 1.00 0.00 H new ATOM 667 N GLU A 415 -6.590 2.538 -0.205 1.00 0.00 N ATOM 668 CA GLU A 415 -5.163 2.609 -0.437 1.00 0.00 C ATOM 669 C GLU A 415 -4.452 1.668 0.532 1.00 0.00 C ATOM 670 O GLU A 415 -4.764 1.651 1.724 1.00 0.00 O ATOM 671 CB GLU A 415 -4.700 4.058 -0.237 1.00 0.00 C ATOM 672 CG GLU A 415 -3.384 4.398 -0.911 1.00 0.00 C ATOM 673 CD GLU A 415 -3.024 5.869 -0.776 1.00 0.00 C ATOM 674 OE1 GLU A 415 -3.669 6.714 -1.441 1.00 0.00 O ATOM 675 OE2 GLU A 415 -2.094 6.189 -0.006 1.00 0.00 O ATOM 0 H GLU A 415 -6.859 2.567 0.779 1.00 0.00 H new ATOM 0 HA GLU A 415 -4.923 2.302 -1.455 1.00 0.00 H new ATOM 0 HB2 GLU A 415 -5.471 4.728 -0.616 1.00 0.00 H new ATOM 0 HB3 GLU A 415 -4.607 4.252 0.832 1.00 0.00 H new ATOM 0 HG2 GLU A 415 -2.589 3.791 -0.476 1.00 0.00 H new ATOM 0 HG3 GLU A 415 -3.443 4.137 -1.968 1.00 0.00 H new ATOM 682 N LEU A 416 -3.528 0.859 0.021 1.00 0.00 N ATOM 683 CA LEU A 416 -2.776 -0.066 0.865 1.00 0.00 C ATOM 684 C LEU A 416 -2.059 0.708 1.967 1.00 0.00 C ATOM 685 O LEU A 416 -1.520 1.785 1.711 1.00 0.00 O ATOM 686 CB LEU A 416 -1.766 -0.854 0.024 1.00 0.00 C ATOM 687 CG LEU A 416 -0.913 -1.868 0.790 1.00 0.00 C ATOM 688 CD1 LEU A 416 -1.787 -2.949 1.410 1.00 0.00 C ATOM 689 CD2 LEU A 416 0.129 -2.485 -0.131 1.00 0.00 C ATOM 0 H LEU A 416 -3.282 0.825 -0.968 1.00 0.00 H new ATOM 0 HA LEU A 416 -3.469 -0.773 1.321 1.00 0.00 H new ATOM 0 HB2 LEU A 416 -2.308 -1.382 -0.761 1.00 0.00 H new ATOM 0 HB3 LEU A 416 -1.100 -0.146 -0.469 1.00 0.00 H new ATOM 0 HG LEU A 416 -0.398 -1.345 1.596 1.00 0.00 H new ATOM 0 HD11 LEU A 416 -1.160 -3.659 1.949 1.00 0.00 H new ATOM 0 HD12 LEU A 416 -2.495 -2.492 2.101 1.00 0.00 H new ATOM 0 HD13 LEU A 416 -2.332 -3.471 0.624 1.00 0.00 H new ATOM 0 HD21 LEU A 416 0.728 -3.204 0.428 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.370 -2.992 -0.957 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.776 -1.701 -0.525 1.00 0.00 H new ATOM 701 N LYS A 417 -2.075 0.166 3.187 1.00 0.00 N ATOM 702 CA LYS A 417 -1.509 0.844 4.345 1.00 0.00 C ATOM 703 C LYS A 417 -0.035 1.191 4.131 1.00 0.00 C ATOM 704 O LYS A 417 0.861 0.360 4.311 1.00 0.00 O ATOM 705 CB LYS A 417 -1.694 -0.018 5.592 1.00 0.00 C ATOM 706 CG LYS A 417 -1.499 0.731 6.898 1.00 0.00 C ATOM 707 CD LYS A 417 -2.085 -0.059 8.056 1.00 0.00 C ATOM 708 CE LYS A 417 -1.899 0.660 9.384 1.00 0.00 C ATOM 709 NZ LYS A 417 -2.531 -0.078 10.513 1.00 0.00 N ATOM 0 H LYS A 417 -2.478 -0.748 3.394 1.00 0.00 H new ATOM 0 HA LYS A 417 -2.041 1.785 4.484 1.00 0.00 H new ATOM 0 HB2 LYS A 417 -2.696 -0.448 5.578 1.00 0.00 H new ATOM 0 HB3 LYS A 417 -0.990 -0.849 5.554 1.00 0.00 H new ATOM 0 HG2 LYS A 417 -0.437 0.905 7.069 1.00 0.00 H new ATOM 0 HG3 LYS A 417 -1.977 1.709 6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 417 -3.147 -0.228 7.880 1.00 0.00 H new ATOM 0 HD3 LYS A 417 -1.610 -1.039 8.104 1.00 0.00 H new ATOM 0 HE2 LYS A 417 -0.834 0.784 9.583 1.00 0.00 H new ATOM 0 HE3 LYS A 417 -2.329 1.659 9.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 417 -2.380 0.447 11.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 417 -3.551 -0.174 10.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 417 -2.103 -1.022 10.593 1.00 0.00 H new ATOM 723 N LYS A 418 0.182 2.438 3.734 1.00 0.00 N ATOM 724 CA LYS A 418 1.505 2.980 3.441 1.00 0.00 C ATOM 725 C LYS A 418 2.479 2.788 4.596 1.00 0.00 C ATOM 726 O LYS A 418 3.660 2.516 4.395 1.00 0.00 O ATOM 727 CB LYS A 418 1.372 4.475 3.121 1.00 0.00 C ATOM 728 CG LYS A 418 0.588 5.240 4.183 1.00 0.00 C ATOM 729 CD LYS A 418 0.393 6.702 3.826 1.00 0.00 C ATOM 730 CE LYS A 418 -0.473 7.406 4.863 1.00 0.00 C ATOM 731 NZ LYS A 418 0.161 7.417 6.211 1.00 0.00 N ATOM 0 H LYS A 418 -0.570 3.115 3.604 1.00 0.00 H new ATOM 0 HA LYS A 418 1.908 2.437 2.586 1.00 0.00 H new ATOM 0 HB2 LYS A 418 2.366 4.911 3.026 1.00 0.00 H new ATOM 0 HB3 LYS A 418 0.878 4.593 2.156 1.00 0.00 H new ATOM 0 HG2 LYS A 418 -0.386 4.770 4.319 1.00 0.00 H new ATOM 0 HG3 LYS A 418 1.111 5.170 5.137 1.00 0.00 H new ATOM 0 HD2 LYS A 418 1.362 7.196 3.760 1.00 0.00 H new ATOM 0 HD3 LYS A 418 -0.073 6.781 2.844 1.00 0.00 H new ATOM 0 HE2 LYS A 418 -0.660 8.431 4.543 1.00 0.00 H new ATOM 0 HE3 LYS A 418 -1.441 6.909 4.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 -0.141 8.266 6.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 -0.129 6.568 6.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 1.196 7.424 6.108 1.00 0.00 H new ATOM 745 N ASP A 419 1.964 2.916 5.800 1.00 0.00 N ATOM 746 CA ASP A 419 2.780 2.891 7.006 1.00 0.00 C ATOM 747 C ASP A 419 3.294 1.481 7.282 1.00 0.00 C ATOM 748 O ASP A 419 4.377 1.297 7.841 1.00 0.00 O ATOM 749 CB ASP A 419 1.965 3.420 8.188 1.00 0.00 C ATOM 750 CG ASP A 419 1.303 4.747 7.861 1.00 0.00 C ATOM 751 OD1 ASP A 419 0.117 4.741 7.462 1.00 0.00 O ATOM 752 OD2 ASP A 419 1.968 5.797 7.963 1.00 0.00 O ATOM 0 H ASP A 419 0.967 3.041 5.976 1.00 0.00 H new ATOM 0 HA ASP A 419 3.648 3.535 6.862 1.00 0.00 H new ATOM 0 HB2 ASP A 419 1.203 2.690 8.461 1.00 0.00 H new ATOM 0 HB3 ASP A 419 2.615 3.541 9.054 1.00 0.00 H new ATOM 757 N VAL A 420 2.519 0.484 6.878 1.00 0.00 N ATOM 758 CA VAL A 420 2.954 -0.901 6.987 1.00 0.00 C ATOM 759 C VAL A 420 3.981 -1.200 5.906 1.00 0.00 C ATOM 760 O VAL A 420 4.990 -1.846 6.167 1.00 0.00 O ATOM 761 CB VAL A 420 1.773 -1.895 6.889 1.00 0.00 C ATOM 762 CG1 VAL A 420 2.271 -3.332 6.797 1.00 0.00 C ATOM 763 CG2 VAL A 420 0.852 -1.738 8.088 1.00 0.00 C ATOM 0 H VAL A 420 1.591 0.607 6.474 1.00 0.00 H new ATOM 0 HA VAL A 420 3.403 -1.031 7.972 1.00 0.00 H new ATOM 0 HB VAL A 420 1.217 -1.668 5.980 1.00 0.00 H new ATOM 0 HG11 VAL A 420 1.419 -4.009 6.729 1.00 0.00 H new ATOM 0 HG12 VAL A 420 2.895 -3.445 5.911 1.00 0.00 H new ATOM 0 HG13 VAL A 420 2.855 -3.572 7.685 1.00 0.00 H new ATOM 0 HG21 VAL A 420 0.025 -2.443 8.006 1.00 0.00 H new ATOM 0 HG22 VAL A 420 1.409 -1.937 9.003 1.00 0.00 H new ATOM 0 HG23 VAL A 420 0.460 -0.721 8.115 1.00 0.00 H new ATOM 773 N LYS A 421 3.732 -0.687 4.706 1.00 0.00 N ATOM 774 CA LYS A 421 4.666 -0.834 3.594 1.00 0.00 C ATOM 775 C LYS A 421 6.029 -0.266 3.972 1.00 0.00 C ATOM 776 O LYS A 421 7.065 -0.889 3.743 1.00 0.00 O ATOM 777 CB LYS A 421 4.125 -0.116 2.355 1.00 0.00 C ATOM 778 CG LYS A 421 5.058 -0.168 1.155 1.00 0.00 C ATOM 779 CD LYS A 421 5.095 -1.546 0.515 1.00 0.00 C ATOM 780 CE LYS A 421 3.783 -1.871 -0.183 1.00 0.00 C ATOM 781 NZ LYS A 421 3.425 -0.839 -1.197 1.00 0.00 N ATOM 0 H LYS A 421 2.887 -0.163 4.477 1.00 0.00 H new ATOM 0 HA LYS A 421 4.778 -1.895 3.368 1.00 0.00 H new ATOM 0 HB2 LYS A 421 3.169 -0.560 2.079 1.00 0.00 H new ATOM 0 HB3 LYS A 421 3.931 0.927 2.607 1.00 0.00 H new ATOM 0 HG2 LYS A 421 4.737 0.566 0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 421 6.064 0.113 1.467 1.00 0.00 H new ATOM 0 HD2 LYS A 421 5.913 -1.593 -0.204 1.00 0.00 H new ATOM 0 HD3 LYS A 421 5.299 -2.297 1.278 1.00 0.00 H new ATOM 0 HE2 LYS A 421 3.860 -2.845 -0.667 1.00 0.00 H new ATOM 0 HE3 LYS A 421 2.986 -1.945 0.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 2.716 -1.227 -1.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 3.033 -0.003 -0.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 4.276 -0.566 -1.730 1.00 0.00 H new ATOM 795 N GLU A 422 5.995 0.916 4.568 1.00 0.00 N ATOM 796 CA GLU A 422 7.195 1.603 5.037 1.00 0.00 C ATOM 797 C GLU A 422 8.016 0.699 5.957 1.00 0.00 C ATOM 798 O GLU A 422 9.202 0.456 5.720 1.00 0.00 O ATOM 799 CB GLU A 422 6.785 2.876 5.789 1.00 0.00 C ATOM 800 CG GLU A 422 7.945 3.753 6.235 1.00 0.00 C ATOM 801 CD GLU A 422 8.687 4.372 5.072 1.00 0.00 C ATOM 802 OE1 GLU A 422 8.113 5.252 4.398 1.00 0.00 O ATOM 803 OE2 GLU A 422 9.849 3.991 4.827 1.00 0.00 O ATOM 0 H GLU A 422 5.132 1.430 4.742 1.00 0.00 H new ATOM 0 HA GLU A 422 7.812 1.862 4.176 1.00 0.00 H new ATOM 0 HB2 GLU A 422 6.128 3.464 5.148 1.00 0.00 H new ATOM 0 HB3 GLU A 422 6.204 2.592 6.666 1.00 0.00 H new ATOM 0 HG2 GLU A 422 7.569 4.544 6.884 1.00 0.00 H new ATOM 0 HG3 GLU A 422 8.639 3.157 6.828 1.00 0.00 H new ATOM 810 N LYS A 423 7.368 0.191 6.998 1.00 0.00 N ATOM 811 CA LYS A 423 8.043 -0.639 7.989 1.00 0.00 C ATOM 812 C LYS A 423 8.422 -2.003 7.422 1.00 0.00 C ATOM 813 O LYS A 423 9.394 -2.616 7.857 1.00 0.00 O ATOM 814 CB LYS A 423 7.163 -0.818 9.225 1.00 0.00 C ATOM 815 CG LYS A 423 6.851 0.484 9.940 1.00 0.00 C ATOM 816 CD LYS A 423 5.987 0.255 11.170 1.00 0.00 C ATOM 817 CE LYS A 423 4.629 -0.326 10.804 1.00 0.00 C ATOM 818 NZ LYS A 423 3.805 -0.601 12.009 1.00 0.00 N ATOM 0 H LYS A 423 6.375 0.339 7.178 1.00 0.00 H new ATOM 0 HA LYS A 423 8.962 -0.125 8.271 1.00 0.00 H new ATOM 0 HB2 LYS A 423 6.228 -1.294 8.930 1.00 0.00 H new ATOM 0 HB3 LYS A 423 7.660 -1.495 9.920 1.00 0.00 H new ATOM 0 HG2 LYS A 423 7.781 0.970 10.234 1.00 0.00 H new ATOM 0 HG3 LYS A 423 6.339 1.161 9.256 1.00 0.00 H new ATOM 0 HD2 LYS A 423 6.500 -0.421 11.854 1.00 0.00 H new ATOM 0 HD3 LYS A 423 5.849 1.198 11.698 1.00 0.00 H new ATOM 0 HE2 LYS A 423 4.100 0.369 10.152 1.00 0.00 H new ATOM 0 HE3 LYS A 423 4.768 -1.248 10.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 2.826 -0.800 11.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 4.192 -1.424 12.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 3.820 0.228 12.636 1.00 0.00 H new ATOM 832 N LEU A 424 7.663 -2.464 6.443 1.00 0.00 N ATOM 833 CA LEU A 424 7.876 -3.787 5.868 1.00 0.00 C ATOM 834 C LEU A 424 9.078 -3.786 4.925 1.00 0.00 C ATOM 835 O LEU A 424 9.867 -4.732 4.907 1.00 0.00 O ATOM 836 CB LEU A 424 6.620 -4.256 5.128 1.00 0.00 C ATOM 837 CG LEU A 424 6.636 -5.717 4.672 1.00 0.00 C ATOM 838 CD1 LEU A 424 6.818 -6.647 5.861 1.00 0.00 C ATOM 839 CD2 LEU A 424 5.353 -6.056 3.929 1.00 0.00 C ATOM 0 H LEU A 424 6.891 -1.943 6.027 1.00 0.00 H new ATOM 0 HA LEU A 424 8.083 -4.481 6.683 1.00 0.00 H new ATOM 0 HB2 LEU A 424 5.758 -4.105 5.778 1.00 0.00 H new ATOM 0 HB3 LEU A 424 6.475 -3.621 4.254 1.00 0.00 H new ATOM 0 HG LEU A 424 7.478 -5.855 3.994 1.00 0.00 H new ATOM 0 HD11 LEU A 424 6.827 -7.681 5.516 1.00 0.00 H new ATOM 0 HD12 LEU A 424 7.762 -6.422 6.358 1.00 0.00 H new ATOM 0 HD13 LEU A 424 5.996 -6.506 6.563 1.00 0.00 H new ATOM 0 HD21 LEU A 424 5.381 -7.098 3.612 1.00 0.00 H new ATOM 0 HD22 LEU A 424 4.499 -5.900 4.588 1.00 0.00 H new ATOM 0 HD23 LEU A 424 5.258 -5.413 3.054 1.00 0.00 H new ATOM 851 N GLU A 425 9.225 -2.719 4.149 1.00 0.00 N ATOM 852 CA GLU A 425 10.358 -2.611 3.242 1.00 0.00 C ATOM 853 C GLU A 425 11.590 -2.113 3.994 1.00 0.00 C ATOM 854 O GLU A 425 12.707 -2.146 3.473 1.00 0.00 O ATOM 855 CB GLU A 425 10.039 -1.702 2.051 1.00 0.00 C ATOM 856 CG GLU A 425 9.913 -0.228 2.389 1.00 0.00 C ATOM 857 CD GLU A 425 9.741 0.627 1.151 1.00 0.00 C ATOM 858 OE1 GLU A 425 10.315 0.278 0.099 1.00 0.00 O ATOM 859 OE2 GLU A 425 9.058 1.667 1.225 1.00 0.00 O ATOM 0 H GLU A 425 8.583 -1.927 4.130 1.00 0.00 H new ATOM 0 HA GLU A 425 10.569 -3.604 2.845 1.00 0.00 H new ATOM 0 HB2 GLU A 425 10.821 -1.822 1.301 1.00 0.00 H new ATOM 0 HB3 GLU A 425 9.107 -2.037 1.596 1.00 0.00 H new ATOM 0 HG2 GLU A 425 9.061 -0.080 3.053 1.00 0.00 H new ATOM 0 HG3 GLU A 425 10.800 0.096 2.933 1.00 0.00 H new ATOM 866 N LYS A 426 11.379 -1.652 5.223 1.00 0.00 N ATOM 867 CA LYS A 426 12.479 -1.273 6.100 1.00 0.00 C ATOM 868 C LYS A 426 13.368 -2.484 6.385 1.00 0.00 C ATOM 869 O LYS A 426 14.594 -2.366 6.467 1.00 0.00 O ATOM 870 CB LYS A 426 11.945 -0.703 7.421 1.00 0.00 C ATOM 871 CG LYS A 426 13.038 -0.234 8.370 1.00 0.00 C ATOM 872 CD LYS A 426 12.487 0.093 9.749 1.00 0.00 C ATOM 873 CE LYS A 426 13.589 0.570 10.683 1.00 0.00 C ATOM 874 NZ LYS A 426 13.107 0.734 12.076 1.00 0.00 N ATOM 0 H LYS A 426 10.453 -1.532 5.634 1.00 0.00 H new ATOM 0 HA LYS A 426 13.067 -0.505 5.598 1.00 0.00 H new ATOM 0 HB2 LYS A 426 11.281 0.134 7.204 1.00 0.00 H new ATOM 0 HB3 LYS A 426 11.345 -1.465 7.919 1.00 0.00 H new ATOM 0 HG2 LYS A 426 13.800 -1.008 8.457 1.00 0.00 H new ATOM 0 HG3 LYS A 426 13.526 0.648 7.955 1.00 0.00 H new ATOM 0 HD2 LYS A 426 11.720 0.863 9.664 1.00 0.00 H new ATOM 0 HD3 LYS A 426 12.007 -0.790 10.170 1.00 0.00 H new ATOM 0 HE2 LYS A 426 14.412 -0.144 10.666 1.00 0.00 H new ATOM 0 HE3 LYS A 426 13.984 1.520 10.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 13.919 0.741 12.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 12.588 1.631 12.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 12.476 -0.056 12.320 1.00 0.00 H new ATOM 888 N GLU A 427 12.741 -3.655 6.509 1.00 0.00 N ATOM 889 CA GLU A 427 13.462 -4.889 6.818 1.00 0.00 C ATOM 890 C GLU A 427 14.346 -5.339 5.661 1.00 0.00 C ATOM 891 O GLU A 427 15.246 -6.155 5.847 1.00 0.00 O ATOM 892 CB GLU A 427 12.492 -6.015 7.183 1.00 0.00 C ATOM 893 CG GLU A 427 11.805 -5.824 8.523 1.00 0.00 C ATOM 894 CD GLU A 427 10.964 -7.022 8.910 1.00 0.00 C ATOM 895 OE1 GLU A 427 11.495 -7.946 9.566 1.00 0.00 O ATOM 896 OE2 GLU A 427 9.775 -7.063 8.545 1.00 0.00 O ATOM 0 H GLU A 427 11.734 -3.774 6.400 1.00 0.00 H new ATOM 0 HA GLU A 427 14.101 -4.670 7.673 1.00 0.00 H new ATOM 0 HB2 GLU A 427 11.733 -6.094 6.405 1.00 0.00 H new ATOM 0 HB3 GLU A 427 13.035 -6.960 7.196 1.00 0.00 H new ATOM 0 HG2 GLU A 427 12.556 -5.646 9.292 1.00 0.00 H new ATOM 0 HG3 GLU A 427 11.173 -4.937 8.482 1.00 0.00 H new ATOM 903 N SER A 428 14.103 -4.799 4.475 1.00 0.00 N ATOM 904 CA SER A 428 14.896 -5.151 3.300 1.00 0.00 C ATOM 905 C SER A 428 16.312 -4.580 3.385 1.00 0.00 C ATOM 906 O SER A 428 17.145 -4.837 2.517 1.00 0.00 O ATOM 907 CB SER A 428 14.205 -4.671 2.025 1.00 0.00 C ATOM 908 OG SER A 428 12.998 -5.383 1.807 1.00 0.00 O ATOM 0 H SER A 428 13.365 -4.117 4.299 1.00 0.00 H new ATOM 0 HA SER A 428 14.977 -6.238 3.270 1.00 0.00 H new ATOM 0 HB2 SER A 428 13.995 -3.604 2.100 1.00 0.00 H new ATOM 0 HB3 SER A 428 14.871 -4.806 1.173 1.00 0.00 H new ATOM 0 HG SER A 428 12.239 -4.840 2.106 1.00 0.00 H new ATOM 914 N LYS A 429 16.575 -3.796 4.425 1.00 0.00 N ATOM 915 CA LYS A 429 17.917 -3.282 4.678 1.00 0.00 C ATOM 916 C LYS A 429 18.548 -4.007 5.864 1.00 0.00 C ATOM 917 O LYS A 429 19.708 -3.764 6.200 1.00 0.00 O ATOM 918 CB LYS A 429 17.873 -1.779 4.960 1.00 0.00 C ATOM 919 CG LYS A 429 17.368 -0.947 3.791 1.00 0.00 C ATOM 920 CD LYS A 429 18.256 -1.095 2.562 1.00 0.00 C ATOM 921 CE LYS A 429 19.680 -0.620 2.824 1.00 0.00 C ATOM 922 NZ LYS A 429 19.727 0.806 3.241 1.00 0.00 N ATOM 0 H LYS A 429 15.876 -3.502 5.107 1.00 0.00 H new ATOM 0 HA LYS A 429 18.521 -3.457 3.788 1.00 0.00 H new ATOM 0 HB2 LYS A 429 17.233 -1.600 5.824 1.00 0.00 H new ATOM 0 HB3 LYS A 429 18.874 -1.440 5.229 1.00 0.00 H new ATOM 0 HG2 LYS A 429 16.351 -1.250 3.542 1.00 0.00 H new ATOM 0 HG3 LYS A 429 17.325 0.102 4.084 1.00 0.00 H new ATOM 0 HD2 LYS A 429 18.274 -2.140 2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 429 17.830 -0.525 1.737 1.00 0.00 H new ATOM 0 HE2 LYS A 429 20.131 -1.239 3.600 1.00 0.00 H new ATOM 0 HE3 LYS A 429 20.278 -0.753 1.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 20.712 1.139 3.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 19.159 1.379 2.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 19.343 0.899 4.203 1.00 0.00 H new ATOM 936 N GLU A 430 17.764 -4.901 6.470 1.00 0.00 N ATOM 937 CA GLU A 430 18.148 -5.634 7.680 1.00 0.00 C ATOM 938 C GLU A 430 18.590 -4.689 8.799 1.00 0.00 C ATOM 939 O GLU A 430 19.748 -4.278 8.883 1.00 0.00 O ATOM 940 CB GLU A 430 19.230 -6.678 7.397 1.00 0.00 C ATOM 941 CG GLU A 430 19.593 -7.516 8.615 1.00 0.00 C ATOM 942 CD GLU A 430 18.377 -8.132 9.292 1.00 0.00 C ATOM 943 OE1 GLU A 430 17.940 -9.220 8.867 1.00 0.00 O ATOM 944 OE2 GLU A 430 17.859 -7.529 10.260 1.00 0.00 O ATOM 0 H GLU A 430 16.832 -5.140 6.130 1.00 0.00 H new ATOM 0 HA GLU A 430 17.257 -6.162 8.019 1.00 0.00 H new ATOM 0 HB2 GLU A 430 18.888 -7.338 6.600 1.00 0.00 H new ATOM 0 HB3 GLU A 430 20.125 -6.174 7.032 1.00 0.00 H new ATOM 0 HG2 GLU A 430 20.276 -8.310 8.313 1.00 0.00 H new ATOM 0 HG3 GLU A 430 20.126 -6.893 9.333 1.00 0.00 H new ATOM 951 N THR A 431 17.645 -4.343 9.651 1.00 0.00 N ATOM 952 CA THR A 431 17.913 -3.495 10.794 1.00 0.00 C ATOM 953 C THR A 431 17.108 -4.005 11.984 1.00 0.00 C ATOM 954 O THR A 431 16.835 -3.268 12.935 1.00 0.00 O ATOM 955 CB THR A 431 17.557 -2.020 10.485 1.00 0.00 C ATOM 956 OG1 THR A 431 17.819 -1.190 11.624 1.00 0.00 O ATOM 957 CG2 THR A 431 16.096 -1.884 10.076 1.00 0.00 C ATOM 0 H THR A 431 16.673 -4.641 9.570 1.00 0.00 H new ATOM 0 HA THR A 431 18.977 -3.532 11.029 1.00 0.00 H new ATOM 0 HB THR A 431 18.183 -1.694 9.654 1.00 0.00 H new ATOM 0 HG1 THR A 431 17.539 -1.656 12.439 1.00 0.00 H new ATOM 0 HG21 THR A 431 15.873 -0.838 9.865 1.00 0.00 H new ATOM 0 HG22 THR A 431 15.911 -2.482 9.184 1.00 0.00 H new ATOM 0 HG23 THR A 431 15.457 -2.235 10.887 1.00 0.00 H new ATOM 965 N GLU A 432 16.758 -5.292 11.917 1.00 0.00 N ATOM 966 CA GLU A 432 15.906 -5.934 12.913 1.00 0.00 C ATOM 967 C GLU A 432 14.501 -5.334 12.892 1.00 0.00 C ATOM 968 O GLU A 432 14.183 -4.499 12.040 1.00 0.00 O ATOM 969 CB GLU A 432 16.520 -5.831 14.313 1.00 0.00 C ATOM 970 CG GLU A 432 17.927 -6.402 14.401 1.00 0.00 C ATOM 971 CD GLU A 432 18.431 -6.479 15.823 1.00 0.00 C ATOM 972 OE1 GLU A 432 18.457 -7.593 16.383 1.00 0.00 O ATOM 973 OE2 GLU A 432 18.789 -5.428 16.396 1.00 0.00 O ATOM 0 H GLU A 432 17.059 -5.916 11.169 1.00 0.00 H new ATOM 0 HA GLU A 432 15.830 -6.991 12.657 1.00 0.00 H new ATOM 0 HB2 GLU A 432 16.542 -4.784 14.616 1.00 0.00 H new ATOM 0 HB3 GLU A 432 15.879 -6.355 15.022 1.00 0.00 H new ATOM 0 HG2 GLU A 432 17.940 -7.399 13.960 1.00 0.00 H new ATOM 0 HG3 GLU A 432 18.604 -5.784 13.812 1.00 0.00 H new ATOM 980 N GLY A 433 13.659 -5.771 13.815 1.00 0.00 N ATOM 981 CA GLY A 433 12.301 -5.273 13.870 1.00 0.00 C ATOM 982 C GLY A 433 11.920 -4.819 15.259 1.00 0.00 C ATOM 983 O GLY A 433 11.816 -5.633 16.175 1.00 0.00 O ATOM 0 H GLY A 433 13.892 -6.462 14.528 1.00 0.00 H new ATOM 0 HA2 GLY A 433 12.192 -4.441 13.174 1.00 0.00 H new ATOM 0 HA3 GLY A 433 11.615 -6.054 13.543 1.00 0.00 H new ATOM 987 N LYS A 434 11.731 -3.518 15.421 1.00 0.00 N ATOM 988 CA LYS A 434 11.339 -2.953 16.703 1.00 0.00 C ATOM 989 C LYS A 434 10.063 -2.132 16.551 1.00 0.00 C ATOM 990 O LYS A 434 9.512 -2.015 15.451 1.00 0.00 O ATOM 991 CB LYS A 434 12.466 -2.082 17.275 1.00 0.00 C ATOM 992 CG LYS A 434 12.798 -0.869 16.420 1.00 0.00 C ATOM 993 CD LYS A 434 13.941 -0.062 17.016 1.00 0.00 C ATOM 994 CE LYS A 434 14.228 1.184 16.196 1.00 0.00 C ATOM 995 NZ LYS A 434 15.379 1.953 16.740 1.00 0.00 N ATOM 0 H LYS A 434 11.844 -2.831 14.676 1.00 0.00 H new ATOM 0 HA LYS A 434 11.149 -3.772 17.397 1.00 0.00 H new ATOM 0 HB2 LYS A 434 12.182 -1.745 18.272 1.00 0.00 H new ATOM 0 HB3 LYS A 434 13.362 -2.692 17.388 1.00 0.00 H new ATOM 0 HG2 LYS A 434 13.066 -1.194 15.415 1.00 0.00 H new ATOM 0 HG3 LYS A 434 11.915 -0.237 16.326 1.00 0.00 H new ATOM 0 HD2 LYS A 434 13.693 0.223 18.038 1.00 0.00 H new ATOM 0 HD3 LYS A 434 14.837 -0.680 17.066 1.00 0.00 H new ATOM 0 HE2 LYS A 434 14.436 0.900 15.165 1.00 0.00 H new ATOM 0 HE3 LYS A 434 13.342 1.819 16.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 434 15.542 2.795 16.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 434 15.170 2.246 17.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 434 16.230 1.356 16.733 1.00 0.00 H new ATOM 1009 N ASP A 435 9.589 -1.569 17.648 1.00 0.00 N ATOM 1010 CA ASP A 435 8.393 -0.750 17.621 1.00 0.00 C ATOM 1011 C ASP A 435 8.750 0.704 17.333 1.00 0.00 C ATOM 1012 O ASP A 435 9.292 1.410 18.180 1.00 0.00 O ATOM 1013 CB ASP A 435 7.601 -0.879 18.935 1.00 0.00 C ATOM 1014 CG ASP A 435 8.379 -0.438 20.163 1.00 0.00 C ATOM 1015 OD1 ASP A 435 9.469 -0.988 20.415 1.00 0.00 O ATOM 1016 OD2 ASP A 435 7.892 0.456 20.892 1.00 0.00 O ATOM 0 H ASP A 435 10.016 -1.665 18.570 1.00 0.00 H new ATOM 0 HA ASP A 435 7.751 -1.109 16.816 1.00 0.00 H new ATOM 0 HB2 ASP A 435 6.690 -0.285 18.860 1.00 0.00 H new ATOM 0 HB3 ASP A 435 7.294 -1.917 19.064 1.00 0.00 H new ATOM 1021 N GLU A 436 8.484 1.128 16.106 1.00 0.00 N ATOM 1022 CA GLU A 436 8.699 2.516 15.711 1.00 0.00 C ATOM 1023 C GLU A 436 7.836 3.420 16.579 1.00 0.00 C ATOM 1024 O GLU A 436 8.327 4.277 17.315 1.00 0.00 O ATOM 1025 CB GLU A 436 8.319 2.723 14.238 1.00 0.00 C ATOM 1026 CG GLU A 436 8.901 1.695 13.283 1.00 0.00 C ATOM 1027 CD GLU A 436 10.407 1.632 13.339 1.00 0.00 C ATOM 1028 OE1 GLU A 436 10.940 0.809 14.102 1.00 0.00 O ATOM 1029 OE2 GLU A 436 11.066 2.396 12.606 1.00 0.00 O ATOM 0 H GLU A 436 8.118 0.531 15.364 1.00 0.00 H new ATOM 0 HA GLU A 436 9.753 2.760 15.841 1.00 0.00 H new ATOM 0 HB2 GLU A 436 7.233 2.706 14.151 1.00 0.00 H new ATOM 0 HB3 GLU A 436 8.648 3.715 13.928 1.00 0.00 H new ATOM 0 HG2 GLU A 436 8.492 0.713 13.520 1.00 0.00 H new ATOM 0 HG3 GLU A 436 8.589 1.933 12.266 1.00 0.00 H new ATOM 1036 N LYS A 437 6.538 3.190 16.477 1.00 0.00 N ATOM 1037 CA LYS A 437 5.548 3.882 17.276 1.00 0.00 C ATOM 1038 C LYS A 437 4.291 3.033 17.331 1.00 0.00 C ATOM 1039 O LYS A 437 3.580 2.910 16.330 1.00 0.00 O ATOM 1040 CB LYS A 437 5.250 5.267 16.691 1.00 0.00 C ATOM 1041 CG LYS A 437 4.060 5.963 17.331 1.00 0.00 C ATOM 1042 CD LYS A 437 3.949 7.407 16.874 1.00 0.00 C ATOM 1043 CE LYS A 437 5.067 8.262 17.453 1.00 0.00 C ATOM 1044 NZ LYS A 437 5.002 8.331 18.939 1.00 0.00 N ATOM 0 H LYS A 437 6.140 2.510 15.829 1.00 0.00 H new ATOM 0 HA LYS A 437 5.930 4.032 18.286 1.00 0.00 H new ATOM 0 HB2 LYS A 437 6.132 5.897 16.807 1.00 0.00 H new ATOM 0 HB3 LYS A 437 5.068 5.167 15.621 1.00 0.00 H new ATOM 0 HG2 LYS A 437 3.145 5.428 17.077 1.00 0.00 H new ATOM 0 HG3 LYS A 437 4.158 5.930 18.416 1.00 0.00 H new ATOM 0 HD2 LYS A 437 3.984 7.449 15.785 1.00 0.00 H new ATOM 0 HD3 LYS A 437 2.984 7.813 17.178 1.00 0.00 H new ATOM 0 HE2 LYS A 437 6.031 7.852 17.151 1.00 0.00 H new ATOM 0 HE3 LYS A 437 5.005 9.269 17.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 437 5.578 9.129 19.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 437 4.015 8.466 19.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 437 5.368 7.446 19.344 1.00 0.00 H new ATOM 1058 N ALA A 438 4.062 2.397 18.480 1.00 0.00 N ATOM 1059 CA ALA A 438 2.904 1.528 18.678 1.00 0.00 C ATOM 1060 C ALA A 438 2.883 0.406 17.643 1.00 0.00 C ATOM 1061 O ALA A 438 1.817 -0.026 17.197 1.00 0.00 O ATOM 1062 CB ALA A 438 1.615 2.337 18.619 1.00 0.00 C ATOM 0 H ALA A 438 4.671 2.470 19.295 1.00 0.00 H new ATOM 0 HA ALA A 438 2.982 1.075 19.666 1.00 0.00 H new ATOM 0 HB1 ALA A 438 0.762 1.674 18.768 1.00 0.00 H new ATOM 0 HB2 ALA A 438 1.626 3.096 19.401 1.00 0.00 H new ATOM 0 HB3 ALA A 438 1.533 2.820 17.645 1.00 0.00 H new ATOM 1068 N ASN A 439 4.068 -0.071 17.277 1.00 0.00 N ATOM 1069 CA ASN A 439 4.200 -1.106 16.260 1.00 0.00 C ATOM 1070 C ASN A 439 3.913 -2.477 16.853 1.00 0.00 C ATOM 1071 O ASN A 439 4.805 -3.130 17.391 1.00 0.00 O ATOM 1072 CB ASN A 439 5.602 -1.090 15.645 1.00 0.00 C ATOM 1073 CG ASN A 439 5.756 -2.096 14.518 1.00 0.00 C ATOM 1074 OD1 ASN A 439 4.803 -2.372 13.789 1.00 0.00 O ATOM 1075 ND2 ASN A 439 6.951 -2.653 14.365 1.00 0.00 N ATOM 0 H ASN A 439 4.954 0.245 17.672 1.00 0.00 H new ATOM 0 HA ASN A 439 3.472 -0.900 15.475 1.00 0.00 H new ATOM 0 HB2 ASN A 439 5.818 -0.091 15.267 1.00 0.00 H new ATOM 0 HB3 ASN A 439 6.338 -1.303 16.421 1.00 0.00 H new ATOM 0 HD21 ASN A 439 7.104 -3.336 13.623 1.00 0.00 H new ATOM 0 HD22 ASN A 439 7.716 -2.398 14.990 1.00 0.00 H new ATOM 1082 N THR A 440 2.657 -2.888 16.785 1.00 0.00 N ATOM 1083 CA THR A 440 2.247 -4.184 17.297 1.00 0.00 C ATOM 1084 C THR A 440 2.420 -5.258 16.224 1.00 0.00 C ATOM 1085 O THR A 440 2.475 -6.453 16.516 1.00 0.00 O ATOM 1086 CB THR A 440 0.777 -4.138 17.760 1.00 0.00 C ATOM 1087 OG1 THR A 440 0.566 -2.957 18.549 1.00 0.00 O ATOM 1088 CG2 THR A 440 0.415 -5.365 18.586 1.00 0.00 C ATOM 0 H THR A 440 1.900 -2.339 16.378 1.00 0.00 H new ATOM 0 HA THR A 440 2.878 -4.432 18.150 1.00 0.00 H new ATOM 0 HB THR A 440 0.141 -4.123 16.875 1.00 0.00 H new ATOM 0 HG1 THR A 440 -0.368 -2.923 18.844 1.00 0.00 H new ATOM 0 HG21 THR A 440 -0.628 -5.300 18.896 1.00 0.00 H new ATOM 0 HG22 THR A 440 0.560 -6.263 17.986 1.00 0.00 H new ATOM 0 HG23 THR A 440 1.054 -5.411 19.468 1.00 0.00 H new ATOM 1096 N THR A 441 2.517 -4.821 14.977 1.00 0.00 N ATOM 1097 CA THR A 441 2.672 -5.739 13.864 1.00 0.00 C ATOM 1098 C THR A 441 4.131 -6.159 13.707 1.00 0.00 C ATOM 1099 O THR A 441 4.907 -5.493 13.017 1.00 0.00 O ATOM 1100 CB THR A 441 2.181 -5.106 12.549 1.00 0.00 C ATOM 1101 OG1 THR A 441 0.911 -4.468 12.760 1.00 0.00 O ATOM 1102 CG2 THR A 441 2.048 -6.155 11.454 1.00 0.00 C ATOM 0 H THR A 441 2.491 -3.836 14.713 1.00 0.00 H new ATOM 0 HA THR A 441 2.065 -6.618 14.081 1.00 0.00 H new ATOM 0 HB THR A 441 2.916 -4.366 12.232 1.00 0.00 H new ATOM 0 HG1 THR A 441 0.604 -4.065 11.921 1.00 0.00 H new ATOM 0 HG21 THR A 441 1.700 -5.681 10.536 1.00 0.00 H new ATOM 0 HG22 THR A 441 3.017 -6.621 11.277 1.00 0.00 H new ATOM 0 HG23 THR A 441 1.331 -6.916 11.764 1.00 0.00 H new ATOM 1110 N GLY A 442 4.506 -7.237 14.381 1.00 0.00 N ATOM 1111 CA GLY A 442 5.847 -7.766 14.244 1.00 0.00 C ATOM 1112 C GLY A 442 6.064 -8.369 12.876 1.00 0.00 C ATOM 1113 O GLY A 442 6.895 -7.895 12.099 1.00 0.00 O ATOM 0 H GLY A 442 3.904 -7.755 15.021 1.00 0.00 H new ATOM 0 HA2 GLY A 442 6.573 -6.970 14.412 1.00 0.00 H new ATOM 0 HA3 GLY A 442 6.021 -8.523 15.009 1.00 0.00 H new ATOM 1117 N SER A 443 5.304 -9.414 12.582 1.00 0.00 N ATOM 1118 CA SER A 443 5.330 -10.055 11.278 1.00 0.00 C ATOM 1119 C SER A 443 3.975 -10.693 10.996 1.00 0.00 C ATOM 1120 O SER A 443 3.843 -11.923 11.161 1.00 0.00 O ATOM 1121 CB SER A 443 6.436 -11.113 11.219 1.00 0.00 C ATOM 1122 OG SER A 443 7.716 -10.529 11.406 1.00 0.00 O ATOM 1123 OXT SER A 443 3.029 -9.954 10.659 1.00 0.00 O ATOM 0 H SER A 443 4.653 -9.840 13.241 1.00 0.00 H new ATOM 0 HA SER A 443 5.538 -9.302 10.518 1.00 0.00 H new ATOM 0 HB2 SER A 443 6.262 -11.868 11.986 1.00 0.00 H new ATOM 0 HB3 SER A 443 6.403 -11.624 10.256 1.00 0.00 H new ATOM 0 HG SER A 443 7.621 -9.560 11.514 1.00 0.00 H new TER 1129 SER A 443