USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 537 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 369 ASN : amide:sc= -2.71! K(o=-2.7!,f=-1.1) USER MOD Single : A 371 LYS NZ :NH3+ -176:sc= 0.0702 (180deg=0.0267) USER MOD Single : A 373 GLN : amide:sc= -4.3! C(o=-4.3!,f=-3.6!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 87:sc= 0.56 USER MOD Single : A 380 TYR OH : rot -143:sc= 1.31 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 387 TYR OH : rot 37:sc= -4.07! USER MOD Single : A 389 THR OG1 : rot 100:sc= -2.64! USER MOD Single : A 399 ASN : amide:sc= -2.76! K(o=-2.8!,f=-1.2) USER MOD Single : A 400 SER OG : rot 180:sc= 0 USER MOD Single : A 404 CYS SG : rot 118:sc= 0.21 USER MOD Single : A 410 THR OG1 : rot 33:sc= 0.102 USER MOD Single : A 414 THR OG1 : rot 120:sc= -3.89! USER MOD Single : A 419 ASN : amide:sc= -2.88 K(o=-2.9,f=-20!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -1.4 X(o=-1.4,f=-0.91) USER MOD Single : A 435 LYS NZ :NH3+ -168:sc= -0.159 (180deg=-0.431) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl 159:sc= -0.388 (180deg=-1.45!) USER MOD Single : A 441 TYR OH : rot 30:sc= -1.38 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= 0.923 K(o=0.92,f=-0.021) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.034 -2.404 9.350 1.00 0.00 N ATOM 103 CA ASN A 369 -2.068 -1.644 10.134 1.00 0.00 C ATOM 104 C ASN A 369 -1.030 -0.986 9.230 1.00 0.00 C ATOM 105 O ASN A 369 -0.614 0.148 9.466 1.00 0.00 O ATOM 106 CB ASN A 369 -1.381 -2.550 11.159 1.00 0.00 C ATOM 107 CG ASN A 369 -0.456 -3.565 10.514 1.00 0.00 C ATOM 108 OD1 ASN A 369 -0.786 -4.746 10.412 1.00 0.00 O ATOM 109 ND2 ASN A 369 0.709 -3.106 10.075 1.00 0.00 N ATOM 0 HA ASN A 369 -2.606 -0.858 10.665 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -0.811 -1.936 11.856 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.139 -3.074 11.741 1.00 0.00 H new ATOM 0 HD21 ASN A 369 1.373 -3.741 9.632 1.00 0.00 H new ATOM 0 HD22 ASN A 369 0.941 -2.118 10.181 1.00 0.00 H new ATOM 116 N ALA A 370 -0.615 -1.706 8.195 1.00 0.00 N ATOM 117 CA ALA A 370 0.372 -1.190 7.254 1.00 0.00 C ATOM 118 C ALA A 370 -0.257 -0.160 6.323 1.00 0.00 C ATOM 119 O ALA A 370 0.416 0.757 5.852 1.00 0.00 O ATOM 120 CB ALA A 370 0.987 -2.327 6.452 1.00 0.00 C ATOM 0 H ALA A 370 -0.946 -2.648 7.986 1.00 0.00 H new ATOM 0 HA ALA A 370 1.162 -0.699 7.822 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.721 -1.924 5.754 1.00 0.00 H new ATOM 0 HB2 ALA A 370 1.476 -3.027 7.129 1.00 0.00 H new ATOM 0 HB3 ALA A 370 0.205 -2.845 5.897 1.00 0.00 H new ATOM 126 N LYS A 371 -1.552 -0.314 6.066 1.00 0.00 N ATOM 127 CA LYS A 371 -2.271 0.606 5.197 1.00 0.00 C ATOM 128 C LYS A 371 -2.592 1.899 5.934 1.00 0.00 C ATOM 129 O LYS A 371 -2.556 2.983 5.351 1.00 0.00 O ATOM 130 CB LYS A 371 -3.558 -0.044 4.680 1.00 0.00 C ATOM 131 CG LYS A 371 -3.555 -0.284 3.179 1.00 0.00 C ATOM 132 CD LYS A 371 -4.859 -0.912 2.713 1.00 0.00 C ATOM 133 CE LYS A 371 -5.922 0.141 2.448 1.00 0.00 C ATOM 134 NZ LYS A 371 -6.761 -0.200 1.266 1.00 0.00 N ATOM 0 H LYS A 371 -2.123 -1.068 6.448 1.00 0.00 H new ATOM 0 HA LYS A 371 -1.633 0.843 4.346 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.706 -0.995 5.192 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.405 0.592 4.937 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -3.399 0.661 2.659 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -2.722 -0.935 2.915 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -4.682 -1.488 1.805 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -5.218 -1.610 3.469 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.558 0.243 3.327 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.443 1.107 2.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -7.429 0.575 1.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -6.151 -0.339 0.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.291 -1.074 1.457 1.00 0.00 H new ATOM 148 N ARG A 372 -2.893 1.781 7.223 1.00 0.00 N ATOM 149 CA ARG A 372 -3.201 2.949 8.036 1.00 0.00 C ATOM 150 C ARG A 372 -1.940 3.774 8.243 1.00 0.00 C ATOM 151 O ARG A 372 -1.980 5.004 8.277 1.00 0.00 O ATOM 152 CB ARG A 372 -3.806 2.531 9.383 1.00 0.00 C ATOM 153 CG ARG A 372 -2.798 1.981 10.381 1.00 0.00 C ATOM 154 CD ARG A 372 -3.375 1.941 11.788 1.00 0.00 C ATOM 155 NE ARG A 372 -3.323 0.598 12.364 1.00 0.00 N ATOM 156 CZ ARG A 372 -4.367 -0.027 12.907 1.00 0.00 C ATOM 157 NH1 ARG A 372 -5.558 0.563 12.962 1.00 0.00 N ATOM 158 NH2 ARG A 372 -4.220 -1.249 13.401 1.00 0.00 N ATOM 0 H ARG A 372 -2.930 0.893 7.724 1.00 0.00 H new ATOM 0 HA ARG A 372 -3.940 3.558 7.515 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -4.305 3.393 9.826 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -4.572 1.776 9.205 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -2.497 0.977 10.081 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -1.900 2.599 10.372 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -2.822 2.631 12.426 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -4.409 2.286 11.766 1.00 0.00 H new ATOM 0 HE ARG A 372 -2.429 0.107 12.349 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -5.679 1.503 12.586 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -6.350 0.075 13.380 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -3.310 -1.708 13.365 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -5.017 -1.730 13.817 1.00 0.00 H new ATOM 170 N GLN A 373 -0.815 3.077 8.358 1.00 0.00 N ATOM 171 CA GLN A 373 0.475 3.722 8.536 1.00 0.00 C ATOM 172 C GLN A 373 0.790 4.590 7.324 1.00 0.00 C ATOM 173 O GLN A 373 1.065 5.783 7.453 1.00 0.00 O ATOM 174 CB GLN A 373 1.560 2.657 8.741 1.00 0.00 C ATOM 175 CG GLN A 373 2.977 3.157 8.510 1.00 0.00 C ATOM 176 CD GLN A 373 3.500 3.990 9.660 1.00 0.00 C ATOM 177 OE1 GLN A 373 2.887 4.056 10.726 1.00 0.00 O ATOM 178 NE2 GLN A 373 4.642 4.632 9.449 1.00 0.00 N ATOM 0 H GLN A 373 -0.774 2.058 8.330 1.00 0.00 H new ATOM 0 HA GLN A 373 0.445 4.361 9.418 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.485 2.269 9.757 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.367 1.823 8.066 1.00 0.00 H new ATOM 0 HG2 GLN A 373 3.638 2.304 8.355 1.00 0.00 H new ATOM 0 HG3 GLN A 373 3.004 3.750 7.596 1.00 0.00 H new ATOM 0 HE21 GLN A 373 5.116 4.548 8.549 1.00 0.00 H new ATOM 0 HE22 GLN A 373 5.046 5.209 10.186 1.00 0.00 H new ATOM 187 N LEU A 374 0.736 3.981 6.146 1.00 0.00 N ATOM 188 CA LEU A 374 1.007 4.691 4.905 1.00 0.00 C ATOM 189 C LEU A 374 0.019 5.834 4.713 1.00 0.00 C ATOM 190 O LEU A 374 0.403 6.954 4.379 1.00 0.00 O ATOM 191 CB LEU A 374 0.936 3.720 3.727 1.00 0.00 C ATOM 192 CG LEU A 374 1.531 4.237 2.418 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.999 4.592 2.602 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.361 3.201 1.316 1.00 0.00 C ATOM 0 H LEU A 374 0.506 2.995 6.025 1.00 0.00 H new ATOM 0 HA LEU A 374 2.010 5.115 4.955 1.00 0.00 H new ATOM 0 HB2 LEU A 374 1.452 2.801 4.004 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.108 3.460 3.554 1.00 0.00 H new ATOM 0 HG LEU A 374 0.997 5.141 2.126 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.406 4.958 1.659 1.00 0.00 H new ATOM 0 HD12 LEU A 374 3.093 5.366 3.363 1.00 0.00 H new ATOM 0 HD13 LEU A 374 3.551 3.706 2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.789 3.582 0.389 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.871 2.281 1.600 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.300 2.997 1.169 1.00 0.00 H new ATOM 206 N TYR A 375 -1.257 5.543 4.932 1.00 0.00 N ATOM 207 CA TYR A 375 -2.305 6.542 4.789 1.00 0.00 C ATOM 208 C TYR A 375 -2.155 7.644 5.830 1.00 0.00 C ATOM 209 O TYR A 375 -2.503 8.798 5.581 1.00 0.00 O ATOM 210 CB TYR A 375 -3.678 5.885 4.925 1.00 0.00 C ATOM 211 CG TYR A 375 -4.763 6.589 4.146 1.00 0.00 C ATOM 212 CD1 TYR A 375 -4.541 7.010 2.843 1.00 0.00 C ATOM 213 CD2 TYR A 375 -6.005 6.834 4.714 1.00 0.00 C ATOM 214 CE1 TYR A 375 -5.528 7.654 2.125 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.999 7.478 4.004 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.755 7.887 2.708 1.00 0.00 C ATOM 217 OH TYR A 375 -7.742 8.528 1.997 1.00 0.00 O ATOM 0 H TYR A 375 -1.590 4.620 5.210 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.214 6.989 3.799 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -3.612 4.851 4.587 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -3.957 5.859 5.978 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -3.580 6.831 2.383 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -6.197 6.516 5.728 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -5.340 7.974 1.111 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.961 7.661 4.459 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.544 8.612 2.554 1.00 0.00 H new ATOM 227 N SER A 376 -1.638 7.281 6.998 1.00 0.00 N ATOM 228 CA SER A 376 -1.448 8.242 8.077 1.00 0.00 C ATOM 229 C SER A 376 -0.095 8.945 7.968 1.00 0.00 C ATOM 230 O SER A 376 0.196 9.862 8.735 1.00 0.00 O ATOM 231 CB SER A 376 -1.560 7.543 9.433 1.00 0.00 C ATOM 232 OG SER A 376 -2.899 7.171 9.705 1.00 0.00 O ATOM 0 H SER A 376 -1.344 6.330 7.221 1.00 0.00 H new ATOM 0 HA SER A 376 -2.231 8.996 7.991 1.00 0.00 H new ATOM 0 HB2 SER A 376 -0.924 6.658 9.443 1.00 0.00 H new ATOM 0 HB3 SER A 376 -1.197 8.206 10.218 1.00 0.00 H new ATOM 0 HG SER A 376 -3.080 6.291 9.314 1.00 0.00 H new ATOM 238 N LEU A 377 0.735 8.510 7.022 1.00 0.00 N ATOM 239 CA LEU A 377 2.051 9.106 6.841 1.00 0.00 C ATOM 240 C LEU A 377 2.182 9.797 5.485 1.00 0.00 C ATOM 241 O LEU A 377 3.003 10.699 5.324 1.00 0.00 O ATOM 242 CB LEU A 377 3.144 8.045 6.989 1.00 0.00 C ATOM 243 CG LEU A 377 3.834 8.016 8.355 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.893 7.467 9.418 1.00 0.00 C ATOM 245 CD2 LEU A 377 5.110 7.191 8.288 1.00 0.00 C ATOM 0 H LEU A 377 0.519 7.752 6.374 1.00 0.00 H new ATOM 0 HA LEU A 377 2.172 9.862 7.616 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.707 7.065 6.798 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.899 8.212 6.221 1.00 0.00 H new ATOM 0 HG LEU A 377 4.100 9.037 8.630 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.401 7.454 10.382 1.00 0.00 H new ATOM 0 HD12 LEU A 377 2.008 8.100 9.483 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.595 6.453 9.151 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.588 7.181 9.267 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.868 6.170 7.991 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.789 7.630 7.557 1.00 0.00 H new ATOM 257 N ILE A 378 1.387 9.374 4.505 1.00 0.00 N ATOM 258 CA ILE A 378 1.459 9.975 3.178 1.00 0.00 C ATOM 259 C ILE A 378 0.078 10.296 2.604 1.00 0.00 C ATOM 260 O ILE A 378 -0.064 11.218 1.801 1.00 0.00 O ATOM 261 CB ILE A 378 2.236 9.074 2.193 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.470 7.779 1.907 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.617 8.760 2.748 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.763 7.199 0.540 1.00 0.00 C ATOM 0 H ILE A 378 0.696 8.630 4.602 1.00 0.00 H new ATOM 0 HA ILE A 378 1.997 10.915 3.301 1.00 0.00 H new ATOM 0 HB ILE A 378 2.346 9.614 1.253 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.721 7.041 2.669 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.400 7.972 1.991 1.00 0.00 H new ATOM 0 HG21 ILE A 378 4.156 8.124 2.045 1.00 0.00 H new ATOM 0 HG22 ILE A 378 4.170 9.688 2.895 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.517 8.242 3.702 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.188 6.283 0.402 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.486 7.921 -0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.827 6.975 0.460 1.00 0.00 H new ATOM 276 N GLY A 379 -0.935 9.540 3.013 1.00 0.00 N ATOM 277 CA GLY A 379 -2.279 9.778 2.517 1.00 0.00 C ATOM 278 C GLY A 379 -2.900 11.033 3.102 1.00 0.00 C ATOM 279 O GLY A 379 -3.335 11.038 4.253 1.00 0.00 O ATOM 0 H GLY A 379 -0.851 8.770 3.676 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.252 9.862 1.431 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -2.908 8.920 2.755 1.00 0.00 H new ATOM 283 N TYR A 380 -2.943 12.101 2.308 1.00 0.00 N ATOM 284 CA TYR A 380 -3.517 13.363 2.762 1.00 0.00 C ATOM 285 C TYR A 380 -4.830 13.667 2.044 1.00 0.00 C ATOM 286 O TYR A 380 -5.787 14.134 2.659 1.00 0.00 O ATOM 287 CB TYR A 380 -2.531 14.520 2.558 1.00 0.00 C ATOM 288 CG TYR A 380 -1.598 14.348 1.377 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.061 14.472 0.073 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.250 14.070 1.568 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.209 14.322 -1.005 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.608 13.919 0.499 1.00 0.00 C ATOM 293 CZ TYR A 380 0.125 14.046 -0.786 1.00 0.00 C ATOM 294 OH TYR A 380 0.977 13.897 -1.856 1.00 0.00 O ATOM 0 H TYR A 380 -2.589 12.117 1.352 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.723 13.260 3.827 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.095 15.443 2.428 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -1.934 14.636 3.463 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.104 14.689 -0.101 1.00 0.00 H new ATOM 0 HD2 TYR A 380 0.133 13.970 2.573 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.585 14.420 -2.013 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.653 13.702 0.668 1.00 0.00 H new ATOM 0 HH TYR A 380 1.630 13.193 -1.659 1.00 0.00 H new ATOM 304 N ALA A 381 -4.869 13.402 0.742 1.00 0.00 N ATOM 305 CA ALA A 381 -6.069 13.652 -0.052 1.00 0.00 C ATOM 306 C ALA A 381 -5.854 13.270 -1.512 1.00 0.00 C ATOM 307 O ALA A 381 -6.343 12.238 -1.971 1.00 0.00 O ATOM 308 CB ALA A 381 -6.482 15.113 0.055 1.00 0.00 C ATOM 0 H ALA A 381 -4.086 13.015 0.215 1.00 0.00 H new ATOM 0 HA ALA A 381 -6.870 13.029 0.346 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.378 15.283 -0.542 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -6.689 15.357 1.097 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -5.675 15.747 -0.313 1.00 0.00 H new ATOM 314 N SER A 382 -5.119 14.109 -2.237 1.00 0.00 N ATOM 315 CA SER A 382 -4.837 13.857 -3.648 1.00 0.00 C ATOM 316 C SER A 382 -4.292 12.446 -3.849 1.00 0.00 C ATOM 317 O SER A 382 -4.499 11.833 -4.896 1.00 0.00 O ATOM 318 CB SER A 382 -3.838 14.885 -4.181 1.00 0.00 C ATOM 319 OG SER A 382 -4.505 15.964 -4.812 1.00 0.00 O ATOM 0 H SER A 382 -4.708 14.968 -1.872 1.00 0.00 H new ATOM 0 HA SER A 382 -5.771 13.948 -4.203 1.00 0.00 H new ATOM 0 HB2 SER A 382 -3.226 15.261 -3.361 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.162 14.407 -4.890 1.00 0.00 H new ATOM 0 HG SER A 382 -3.845 16.608 -5.143 1.00 0.00 H new ATOM 325 N LEU A 383 -3.603 11.936 -2.835 1.00 0.00 N ATOM 326 CA LEU A 383 -3.034 10.596 -2.894 1.00 0.00 C ATOM 327 C LEU A 383 -4.071 9.554 -2.490 1.00 0.00 C ATOM 328 O LEU A 383 -4.049 9.042 -1.372 1.00 0.00 O ATOM 329 CB LEU A 383 -1.810 10.498 -1.979 1.00 0.00 C ATOM 330 CG LEU A 383 -0.782 9.440 -2.382 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.015 9.885 -3.618 1.00 0.00 C ATOM 332 CD2 LEU A 383 0.173 9.160 -1.232 1.00 0.00 C ATOM 0 H LEU A 383 -3.425 12.431 -1.961 1.00 0.00 H new ATOM 0 HA LEU A 383 -2.725 10.400 -3.921 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.317 11.470 -1.952 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.150 10.285 -0.965 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.312 8.518 -2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.712 9.120 -3.890 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.711 10.035 -4.444 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.504 10.820 -3.407 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.898 8.405 -1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.696 10.077 -0.962 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.390 8.797 -0.372 1.00 0.00 H new ATOM 344 N ARG A 384 -4.984 9.250 -3.408 1.00 0.00 N ATOM 345 CA ARG A 384 -6.036 8.273 -3.150 1.00 0.00 C ATOM 346 C ARG A 384 -5.447 6.889 -2.900 1.00 0.00 C ATOM 347 O ARG A 384 -5.429 6.040 -3.791 1.00 0.00 O ATOM 348 CB ARG A 384 -7.012 8.219 -4.326 1.00 0.00 C ATOM 349 CG ARG A 384 -8.022 9.355 -4.330 1.00 0.00 C ATOM 350 CD ARG A 384 -9.379 8.894 -4.837 1.00 0.00 C ATOM 351 NE ARG A 384 -10.469 9.353 -3.979 1.00 0.00 N ATOM 352 CZ ARG A 384 -10.795 10.632 -3.815 1.00 0.00 C ATOM 353 NH1 ARG A 384 -10.118 11.583 -4.448 1.00 0.00 N ATOM 354 NH2 ARG A 384 -11.801 10.964 -3.019 1.00 0.00 N ATOM 0 H ARG A 384 -5.016 9.667 -4.338 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.573 8.586 -2.255 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.447 8.243 -5.258 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.546 7.269 -4.301 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.126 9.754 -3.321 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -7.655 10.167 -4.958 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -9.533 9.267 -5.850 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.395 7.806 -4.892 1.00 0.00 H new ATOM 0 HE ARG A 384 -11.012 8.651 -3.476 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -9.344 11.334 -5.064 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -10.372 12.562 -4.319 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -12.326 10.238 -2.531 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -12.050 11.945 -2.894 1.00 0.00 H new ATOM 366 N LEU A 385 -4.967 6.668 -1.681 1.00 0.00 N ATOM 367 CA LEU A 385 -4.378 5.387 -1.312 1.00 0.00 C ATOM 368 C LEU A 385 -5.395 4.260 -1.452 1.00 0.00 C ATOM 369 O LEU A 385 -6.256 4.076 -0.592 1.00 0.00 O ATOM 370 CB LEU A 385 -3.852 5.441 0.123 1.00 0.00 C ATOM 371 CG LEU A 385 -3.242 4.134 0.638 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.934 4.404 1.364 1.00 0.00 C ATOM 373 CD2 LEU A 385 -4.223 3.412 1.551 1.00 0.00 C ATOM 0 H LEU A 385 -4.975 7.360 -0.932 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.548 5.187 -1.989 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.099 6.227 0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.670 5.728 0.784 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.032 3.492 -0.217 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.516 3.463 1.723 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.229 4.877 0.680 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -2.118 5.065 2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.773 2.485 1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -4.465 4.049 2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -5.134 3.184 0.998 1.00 0.00 H new ATOM 385 N HIS A 386 -5.287 3.506 -2.540 1.00 0.00 N ATOM 386 CA HIS A 386 -6.191 2.393 -2.794 1.00 0.00 C ATOM 387 C HIS A 386 -5.407 1.140 -3.164 1.00 0.00 C ATOM 388 O HIS A 386 -4.425 1.208 -3.902 1.00 0.00 O ATOM 389 CB HIS A 386 -7.173 2.745 -3.912 1.00 0.00 C ATOM 390 CG HIS A 386 -8.499 2.062 -3.781 1.00 0.00 C ATOM 391 ND1 HIS A 386 -9.527 2.557 -3.007 1.00 0.00 N ATOM 392 CD2 HIS A 386 -8.961 0.913 -4.329 1.00 0.00 C ATOM 393 CE1 HIS A 386 -10.565 1.741 -3.084 1.00 0.00 C ATOM 394 NE2 HIS A 386 -10.247 0.738 -3.880 1.00 0.00 N ATOM 0 H HIS A 386 -4.580 3.647 -3.262 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.754 2.197 -1.881 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.329 3.824 -3.921 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.729 2.478 -4.871 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -8.419 0.257 -4.995 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -11.512 1.873 -2.581 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -10.858 -0.042 -4.123 1.00 0.00 H new ATOM 403 N TYR A 387 -5.840 -0.001 -2.640 1.00 0.00 N ATOM 404 CA TYR A 387 -5.170 -1.265 -2.911 1.00 0.00 C ATOM 405 C TYR A 387 -6.007 -2.155 -3.819 1.00 0.00 C ATOM 406 O TYR A 387 -7.171 -2.437 -3.534 1.00 0.00 O ATOM 407 CB TYR A 387 -4.867 -1.994 -1.602 1.00 0.00 C ATOM 408 CG TYR A 387 -3.652 -1.455 -0.883 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.673 -0.196 -0.299 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.485 -2.201 -0.796 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.564 0.305 0.354 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.371 -1.708 -0.145 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.416 -0.454 0.429 1.00 0.00 C ATOM 414 OH TYR A 387 -0.310 0.042 1.078 1.00 0.00 O ATOM 0 H TYR A 387 -6.651 -0.076 -2.026 1.00 0.00 H new ATOM 0 HA TYR A 387 -4.235 -1.042 -3.425 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.733 -1.919 -0.944 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.716 -3.053 -1.811 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.571 0.401 -0.356 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.447 -3.183 -1.244 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.596 1.286 0.804 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.470 -2.301 -0.086 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.594 0.558 1.861 1.00 0.00 H new ATOM 424 N VAL A 388 -5.402 -2.600 -4.915 1.00 0.00 N ATOM 425 CA VAL A 388 -6.078 -3.462 -5.868 1.00 0.00 C ATOM 426 C VAL A 388 -5.457 -4.855 -5.875 1.00 0.00 C ATOM 427 O VAL A 388 -4.460 -5.097 -6.555 1.00 0.00 O ATOM 428 CB VAL A 388 -6.021 -2.873 -7.290 1.00 0.00 C ATOM 429 CG1 VAL A 388 -6.801 -3.743 -8.265 1.00 0.00 C ATOM 430 CG2 VAL A 388 -6.550 -1.447 -7.298 1.00 0.00 C ATOM 0 H VAL A 388 -4.439 -2.374 -5.163 1.00 0.00 H new ATOM 0 HA VAL A 388 -7.120 -3.534 -5.557 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.980 -2.854 -7.612 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -6.748 -3.309 -9.263 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -6.372 -4.745 -8.282 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -7.843 -3.799 -7.949 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -6.502 -1.047 -8.311 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -7.584 -1.441 -6.954 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.943 -0.830 -6.635 1.00 0.00 H new ATOM 440 N THR A 389 -6.051 -5.765 -5.111 1.00 0.00 N ATOM 441 CA THR A 389 -5.557 -7.135 -5.027 1.00 0.00 C ATOM 442 C THR A 389 -6.005 -7.941 -6.242 1.00 0.00 C ATOM 443 O THR A 389 -7.122 -8.459 -6.278 1.00 0.00 O ATOM 444 CB THR A 389 -6.059 -7.803 -3.744 1.00 0.00 C ATOM 445 OG1 THR A 389 -5.708 -7.052 -2.595 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.555 -9.222 -3.559 1.00 0.00 C ATOM 0 H THR A 389 -6.876 -5.579 -4.541 1.00 0.00 H new ATOM 0 HA THR A 389 -4.468 -7.106 -5.009 1.00 0.00 H new ATOM 0 HB THR A 389 -7.142 -7.840 -3.857 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.479 -6.523 -2.302 1.00 0.00 H new ATOM 0 HG21 THR A 389 -5.951 -9.631 -2.630 1.00 0.00 H new ATOM 0 HG22 THR A 389 -5.885 -9.837 -4.396 1.00 0.00 H new ATOM 0 HG23 THR A 389 -4.466 -9.219 -3.518 1.00 0.00 H new ATOM 594 N ASN A 399 0.804 -16.544 -5.837 1.00 0.00 N ATOM 595 CA ASN A 399 0.258 -16.019 -4.593 1.00 0.00 C ATOM 596 C ASN A 399 -0.743 -14.901 -4.873 1.00 0.00 C ATOM 597 O ASN A 399 -1.222 -14.750 -5.997 1.00 0.00 O ATOM 598 CB ASN A 399 1.382 -15.500 -3.687 1.00 0.00 C ATOM 599 CG ASN A 399 2.768 -15.775 -4.242 1.00 0.00 C ATOM 600 OD1 ASN A 399 3.533 -16.556 -3.678 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.094 -15.128 -5.354 1.00 0.00 N ATOM 0 HA ASN A 399 -0.259 -16.831 -4.082 1.00 0.00 H new ATOM 0 HB2 ASN A 399 1.260 -14.426 -3.546 1.00 0.00 H new ATOM 0 HB3 ASN A 399 1.292 -15.963 -2.704 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.012 -15.269 -5.776 1.00 0.00 H new ATOM 0 HD22 ASN A 399 2.427 -14.490 -5.787 1.00 0.00 H new ATOM 608 N SER A 400 -1.053 -14.117 -3.843 1.00 0.00 N ATOM 609 CA SER A 400 -1.991 -13.012 -3.982 1.00 0.00 C ATOM 610 C SER A 400 -1.248 -11.694 -4.174 1.00 0.00 C ATOM 611 O SER A 400 -0.770 -11.092 -3.213 1.00 0.00 O ATOM 612 CB SER A 400 -2.905 -12.932 -2.757 1.00 0.00 C ATOM 613 OG SER A 400 -4.254 -13.184 -3.109 1.00 0.00 O ATOM 0 H SER A 400 -0.668 -14.228 -2.905 1.00 0.00 H new ATOM 0 HA SER A 400 -2.604 -13.193 -4.865 1.00 0.00 H new ATOM 0 HB2 SER A 400 -2.580 -13.655 -2.009 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.823 -11.945 -2.302 1.00 0.00 H new ATOM 0 HG SER A 400 -4.817 -13.129 -2.309 1.00 0.00 H new ATOM 619 N ILE A 401 -1.149 -11.255 -5.424 1.00 0.00 N ATOM 620 CA ILE A 401 -0.456 -10.015 -5.750 1.00 0.00 C ATOM 621 C ILE A 401 -1.392 -8.809 -5.657 1.00 0.00 C ATOM 622 O ILE A 401 -2.466 -8.791 -6.260 1.00 0.00 O ATOM 623 CB ILE A 401 0.171 -10.083 -7.163 1.00 0.00 C ATOM 624 CG1 ILE A 401 1.369 -9.138 -7.263 1.00 0.00 C ATOM 625 CG2 ILE A 401 -0.858 -9.760 -8.241 1.00 0.00 C ATOM 626 CD1 ILE A 401 1.031 -7.694 -6.962 1.00 0.00 C ATOM 0 H ILE A 401 -1.541 -11.742 -6.230 1.00 0.00 H new ATOM 0 HA ILE A 401 0.340 -9.891 -5.016 1.00 0.00 H new ATOM 0 HB ILE A 401 0.517 -11.103 -7.327 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.143 -9.472 -6.572 1.00 0.00 H new ATOM 0 HG13 ILE A 401 1.788 -9.202 -8.267 1.00 0.00 H new ATOM 0 HG21 ILE A 401 -0.387 -9.816 -9.222 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -1.676 -10.478 -8.190 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -1.248 -8.754 -8.083 1.00 0.00 H new ATOM 0 HD11 ILE A 401 1.929 -7.084 -7.053 1.00 0.00 H new ATOM 0 HD12 ILE A 401 0.280 -7.341 -7.669 1.00 0.00 H new ATOM 0 HD13 ILE A 401 0.640 -7.616 -5.948 1.00 0.00 H new ATOM 638 N VAL A 402 -0.964 -7.799 -4.908 1.00 0.00 N ATOM 639 CA VAL A 402 -1.745 -6.584 -4.743 1.00 0.00 C ATOM 640 C VAL A 402 -0.898 -5.361 -5.071 1.00 0.00 C ATOM 641 O VAL A 402 0.328 -5.397 -4.967 1.00 0.00 O ATOM 642 CB VAL A 402 -2.305 -6.453 -3.313 1.00 0.00 C ATOM 643 CG1 VAL A 402 -3.089 -5.158 -3.154 1.00 0.00 C ATOM 644 CG2 VAL A 402 -3.176 -7.652 -2.971 1.00 0.00 C ATOM 0 H VAL A 402 -0.077 -7.800 -4.405 1.00 0.00 H new ATOM 0 HA VAL A 402 -2.586 -6.644 -5.433 1.00 0.00 H new ATOM 0 HB VAL A 402 -1.465 -6.427 -2.619 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -3.474 -5.088 -2.137 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -2.434 -4.310 -3.353 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.921 -5.147 -3.858 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -3.563 -7.543 -1.958 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -4.008 -7.710 -3.673 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -2.582 -8.564 -3.037 1.00 0.00 H new ATOM 654 N GLU A 403 -1.557 -4.282 -5.474 1.00 0.00 N ATOM 655 CA GLU A 403 -0.855 -3.055 -5.823 1.00 0.00 C ATOM 656 C GLU A 403 -1.607 -1.827 -5.324 1.00 0.00 C ATOM 657 O GLU A 403 -2.797 -1.664 -5.588 1.00 0.00 O ATOM 658 CB GLU A 403 -0.663 -2.966 -7.339 1.00 0.00 C ATOM 659 CG GLU A 403 0.487 -3.814 -7.858 1.00 0.00 C ATOM 660 CD GLU A 403 0.125 -4.582 -9.114 1.00 0.00 C ATOM 661 OE1 GLU A 403 -0.785 -4.135 -9.842 1.00 0.00 O ATOM 662 OE2 GLU A 403 0.752 -5.632 -9.369 1.00 0.00 O ATOM 0 H GLU A 403 -2.572 -4.232 -5.567 1.00 0.00 H new ATOM 0 HA GLU A 403 0.121 -3.079 -5.337 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -1.584 -3.277 -7.832 1.00 0.00 H new ATOM 0 HB3 GLU A 403 -0.489 -1.926 -7.614 1.00 0.00 H new ATOM 0 HG2 GLU A 403 1.343 -3.172 -8.064 1.00 0.00 H new ATOM 0 HG3 GLU A 403 0.794 -4.516 -7.083 1.00 0.00 H new ATOM 669 N CYS A 404 -0.898 -0.962 -4.606 1.00 0.00 N ATOM 670 CA CYS A 404 -1.491 0.257 -4.076 1.00 0.00 C ATOM 671 C CYS A 404 -1.363 1.393 -5.084 1.00 0.00 C ATOM 672 O CYS A 404 -0.269 1.905 -5.318 1.00 0.00 O ATOM 673 CB CYS A 404 -0.819 0.648 -2.759 1.00 0.00 C ATOM 674 SG CYS A 404 -1.490 2.146 -2.002 1.00 0.00 S ATOM 0 H CYS A 404 0.089 -1.084 -4.379 1.00 0.00 H new ATOM 0 HA CYS A 404 -2.549 0.071 -3.889 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.918 -0.178 -2.054 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.247 0.790 -2.936 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.994 1.856 -0.839 1.00 0.00 H new ATOM 680 N ARG A 405 -2.485 1.780 -5.680 1.00 0.00 N ATOM 681 CA ARG A 405 -2.493 2.851 -6.664 1.00 0.00 C ATOM 682 C ARG A 405 -3.082 4.120 -6.069 1.00 0.00 C ATOM 683 O ARG A 405 -4.058 4.073 -5.320 1.00 0.00 O ATOM 684 CB ARG A 405 -3.290 2.435 -7.900 1.00 0.00 C ATOM 685 CG ARG A 405 -2.799 1.143 -8.535 1.00 0.00 C ATOM 686 CD ARG A 405 -3.955 0.293 -9.036 1.00 0.00 C ATOM 687 NE ARG A 405 -3.493 -0.905 -9.733 1.00 0.00 N ATOM 688 CZ ARG A 405 -4.289 -1.707 -10.437 1.00 0.00 C ATOM 689 NH1 ARG A 405 -5.586 -1.443 -10.539 1.00 0.00 N ATOM 690 NH2 ARG A 405 -3.786 -2.774 -11.041 1.00 0.00 N ATOM 0 H ARG A 405 -3.400 1.367 -5.498 1.00 0.00 H new ATOM 0 HA ARG A 405 -1.463 3.049 -6.960 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -4.338 2.319 -7.624 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -3.242 3.235 -8.639 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -2.131 1.375 -9.364 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -2.218 0.576 -7.807 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -4.583 0.003 -8.194 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -4.576 0.886 -9.707 1.00 0.00 H new ATOM 0 HE ARG A 405 -2.502 -1.141 -9.677 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -5.977 -0.622 -10.077 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -6.191 -2.061 -11.080 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -2.790 -2.980 -10.966 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -4.395 -3.389 -11.581 1.00 0.00 H new ATOM 702 N VAL A 406 -2.482 5.254 -6.405 1.00 0.00 N ATOM 703 CA VAL A 406 -2.950 6.534 -5.900 1.00 0.00 C ATOM 704 C VAL A 406 -3.269 7.497 -7.039 1.00 0.00 C ATOM 705 O VAL A 406 -2.779 7.337 -8.156 1.00 0.00 O ATOM 706 CB VAL A 406 -1.912 7.185 -4.966 1.00 0.00 C ATOM 707 CG1 VAL A 406 -1.702 6.331 -3.726 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.598 7.407 -5.699 1.00 0.00 C ATOM 0 H VAL A 406 -1.673 5.312 -7.023 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.860 6.333 -5.335 1.00 0.00 H new ATOM 0 HB VAL A 406 -2.292 8.156 -4.650 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -0.966 6.806 -3.078 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -2.646 6.229 -3.190 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -1.344 5.344 -4.020 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.122 7.868 -5.023 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -0.209 6.450 -6.047 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -0.764 8.063 -6.554 1.00 0.00 H new ATOM 744 N THR A 410 -1.343 5.691 -10.249 1.00 0.00 N ATOM 745 CA THR A 410 0.081 5.490 -10.015 1.00 0.00 C ATOM 746 C THR A 410 0.313 4.570 -8.821 1.00 0.00 C ATOM 747 O THR A 410 -0.057 4.895 -7.694 1.00 0.00 O ATOM 748 CB THR A 410 0.774 6.833 -9.778 1.00 0.00 C ATOM 749 OG1 THR A 410 0.560 7.708 -10.872 1.00 0.00 O ATOM 750 CG2 THR A 410 2.269 6.710 -9.576 1.00 0.00 C ATOM 0 HA THR A 410 0.506 5.019 -10.902 1.00 0.00 H new ATOM 0 HB THR A 410 0.332 7.227 -8.863 1.00 0.00 H new ATOM 0 HG1 THR A 410 -0.323 7.536 -11.260 1.00 0.00 H new ATOM 0 HG21 THR A 410 2.697 7.699 -9.413 1.00 0.00 H new ATOM 0 HG22 THR A 410 2.468 6.081 -8.708 1.00 0.00 H new ATOM 0 HG23 THR A 410 2.720 6.261 -10.461 1.00 0.00 H new ATOM 758 N VAL A 411 0.928 3.420 -9.077 1.00 0.00 N ATOM 759 CA VAL A 411 1.209 2.454 -8.022 1.00 0.00 C ATOM 760 C VAL A 411 2.399 2.897 -7.177 1.00 0.00 C ATOM 761 O VAL A 411 3.515 3.032 -7.679 1.00 0.00 O ATOM 762 CB VAL A 411 1.492 1.052 -8.600 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.714 1.081 -9.506 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.671 0.037 -7.482 1.00 0.00 C ATOM 0 H VAL A 411 1.241 3.135 -10.005 1.00 0.00 H new ATOM 0 HA VAL A 411 0.320 2.403 -7.394 1.00 0.00 H new ATOM 0 HB VAL A 411 0.633 0.749 -9.199 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.896 0.082 -9.903 1.00 0.00 H new ATOM 0 HG12 VAL A 411 2.540 1.773 -10.330 1.00 0.00 H new ATOM 0 HG13 VAL A 411 3.583 1.408 -8.935 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.870 -0.945 -7.911 1.00 0.00 H new ATOM 0 HG22 VAL A 411 2.509 0.334 -6.852 1.00 0.00 H new ATOM 0 HG23 VAL A 411 0.763 -0.006 -6.881 1.00 0.00 H new ATOM 774 N LEU A 412 2.150 3.124 -5.893 1.00 0.00 N ATOM 775 CA LEU A 412 3.195 3.554 -4.976 1.00 0.00 C ATOM 776 C LEU A 412 3.657 2.404 -4.086 1.00 0.00 C ATOM 777 O LEU A 412 4.753 2.445 -3.525 1.00 0.00 O ATOM 778 CB LEU A 412 2.695 4.711 -4.109 1.00 0.00 C ATOM 779 CG LEU A 412 3.782 5.667 -3.617 1.00 0.00 C ATOM 780 CD1 LEU A 412 3.919 6.850 -4.562 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.473 6.143 -2.205 1.00 0.00 C ATOM 0 H LEU A 412 1.231 3.017 -5.464 1.00 0.00 H new ATOM 0 HA LEU A 412 4.044 3.889 -5.571 1.00 0.00 H new ATOM 0 HB2 LEU A 412 1.961 5.281 -4.679 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.176 4.299 -3.244 1.00 0.00 H new ATOM 0 HG LEU A 412 4.731 5.131 -3.599 1.00 0.00 H new ATOM 0 HD11 LEU A 412 4.697 7.520 -4.196 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.186 6.492 -5.556 1.00 0.00 H new ATOM 0 HD13 LEU A 412 2.972 7.387 -4.612 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.257 6.823 -1.870 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.515 6.663 -2.198 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.426 5.285 -1.534 1.00 0.00 H new ATOM 793 N GLY A 413 2.817 1.381 -3.953 1.00 0.00 N ATOM 794 CA GLY A 413 3.170 0.244 -3.120 1.00 0.00 C ATOM 795 C GLY A 413 2.678 -1.077 -3.682 1.00 0.00 C ATOM 796 O GLY A 413 1.483 -1.367 -3.647 1.00 0.00 O ATOM 0 H GLY A 413 1.904 1.319 -4.404 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.254 0.204 -3.009 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.752 0.387 -2.123 1.00 0.00 H new ATOM 800 N THR A 414 3.605 -1.879 -4.196 1.00 0.00 N ATOM 801 CA THR A 414 3.268 -3.177 -4.762 1.00 0.00 C ATOM 802 C THR A 414 3.890 -4.300 -3.936 1.00 0.00 C ATOM 803 O THR A 414 5.088 -4.281 -3.653 1.00 0.00 O ATOM 804 CB THR A 414 3.750 -3.258 -6.210 1.00 0.00 C ATOM 805 OG1 THR A 414 3.089 -2.295 -7.011 1.00 0.00 O ATOM 806 CG2 THR A 414 3.530 -4.614 -6.848 1.00 0.00 C ATOM 0 H THR A 414 4.598 -1.650 -4.231 1.00 0.00 H new ATOM 0 HA THR A 414 2.184 -3.294 -4.742 1.00 0.00 H new ATOM 0 HB THR A 414 4.823 -3.070 -6.165 1.00 0.00 H new ATOM 0 HG1 THR A 414 3.750 -1.685 -7.402 1.00 0.00 H new ATOM 0 HG21 THR A 414 3.896 -4.597 -7.875 1.00 0.00 H new ATOM 0 HG22 THR A 414 4.070 -5.374 -6.283 1.00 0.00 H new ATOM 0 HG23 THR A 414 2.466 -4.848 -6.846 1.00 0.00 H new ATOM 814 N GLY A 415 3.073 -5.277 -3.550 1.00 0.00 N ATOM 815 CA GLY A 415 3.572 -6.386 -2.759 1.00 0.00 C ATOM 816 C GLY A 415 2.712 -7.629 -2.880 1.00 0.00 C ATOM 817 O GLY A 415 1.490 -7.539 -2.998 1.00 0.00 O ATOM 0 H GLY A 415 2.078 -5.319 -3.771 1.00 0.00 H new ATOM 0 HA2 GLY A 415 4.589 -6.622 -3.073 1.00 0.00 H new ATOM 0 HA3 GLY A 415 3.623 -6.086 -1.712 1.00 0.00 H new ATOM 821 N VAL A 416 3.355 -8.792 -2.851 1.00 0.00 N ATOM 822 CA VAL A 416 2.655 -10.062 -2.957 1.00 0.00 C ATOM 823 C VAL A 416 2.400 -10.660 -1.577 1.00 0.00 C ATOM 824 O VAL A 416 3.024 -10.259 -0.594 1.00 0.00 O ATOM 825 CB VAL A 416 3.469 -11.060 -3.797 1.00 0.00 C ATOM 826 CG1 VAL A 416 2.683 -12.340 -4.033 1.00 0.00 C ATOM 827 CG2 VAL A 416 3.890 -10.432 -5.118 1.00 0.00 C ATOM 0 H VAL A 416 4.367 -8.878 -2.754 1.00 0.00 H new ATOM 0 HA VAL A 416 1.699 -9.872 -3.446 1.00 0.00 H new ATOM 0 HB VAL A 416 4.369 -11.317 -3.239 1.00 0.00 H new ATOM 0 HG11 VAL A 416 3.281 -13.029 -4.629 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.444 -12.802 -3.075 1.00 0.00 H new ATOM 0 HG13 VAL A 416 1.760 -12.107 -4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 416 4.465 -11.154 -5.697 1.00 0.00 H new ATOM 0 HG22 VAL A 416 3.003 -10.139 -5.680 1.00 0.00 H new ATOM 0 HG23 VAL A 416 4.504 -9.552 -4.923 1.00 0.00 H new ATOM 837 N GLY A 417 1.483 -11.619 -1.507 1.00 0.00 N ATOM 838 CA GLY A 417 1.169 -12.250 -0.238 1.00 0.00 C ATOM 839 C GLY A 417 0.280 -13.468 -0.397 1.00 0.00 C ATOM 840 O GLY A 417 -0.405 -13.616 -1.407 1.00 0.00 O ATOM 0 H GLY A 417 0.953 -11.970 -2.304 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.095 -12.543 0.257 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.675 -11.527 0.411 1.00 0.00 H new ATOM 844 N ARG A 418 0.292 -14.341 0.607 1.00 0.00 N ATOM 845 CA ARG A 418 -0.521 -15.553 0.577 1.00 0.00 C ATOM 846 C ARG A 418 -1.991 -15.219 0.336 1.00 0.00 C ATOM 847 O ARG A 418 -2.730 -16.008 -0.250 1.00 0.00 O ATOM 848 CB ARG A 418 -0.372 -16.325 1.891 1.00 0.00 C ATOM 849 CG ARG A 418 0.752 -17.349 1.871 1.00 0.00 C ATOM 850 CD ARG A 418 0.722 -18.231 3.108 1.00 0.00 C ATOM 851 NE ARG A 418 1.809 -19.207 3.111 1.00 0.00 N ATOM 852 CZ ARG A 418 1.796 -20.335 2.404 1.00 0.00 C ATOM 853 NH1 ARG A 418 0.755 -20.633 1.637 1.00 0.00 N ATOM 854 NH2 ARG A 418 2.828 -21.166 2.465 1.00 0.00 N ATOM 0 H ARG A 418 0.855 -14.232 1.450 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.169 -16.175 -0.246 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.193 -15.617 2.700 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -1.311 -16.832 2.113 1.00 0.00 H new ATOM 0 HG2 ARG A 418 0.666 -17.969 0.978 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.712 -16.836 1.811 1.00 0.00 H new ATOM 0 HD2 ARG A 418 0.792 -17.608 3.999 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -0.234 -18.753 3.158 1.00 0.00 H new ATOM 0 HE ARG A 418 2.627 -19.013 3.689 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -0.040 -19.996 1.587 1.00 0.00 H new ATOM 0 HH12 ARG A 418 0.750 -21.499 1.097 1.00 0.00 H new ATOM 0 HH21 ARG A 418 3.630 -20.940 3.053 1.00 0.00 H new ATOM 0 HH22 ARG A 418 2.819 -22.031 1.924 1.00 0.00 H new ATOM 866 N ASN A 419 -2.405 -14.042 0.794 1.00 0.00 N ATOM 867 CA ASN A 419 -3.784 -13.599 0.629 1.00 0.00 C ATOM 868 C ASN A 419 -3.865 -12.076 0.607 1.00 0.00 C ATOM 869 O ASN A 419 -2.842 -11.391 0.595 1.00 0.00 O ATOM 870 CB ASN A 419 -4.659 -14.155 1.755 1.00 0.00 C ATOM 871 CG ASN A 419 -4.230 -13.660 3.123 1.00 0.00 C ATOM 872 OD1 ASN A 419 -3.516 -12.663 3.241 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.663 -14.356 4.167 1.00 0.00 N ATOM 0 H ASN A 419 -1.805 -13.378 1.283 1.00 0.00 H new ATOM 0 HA ASN A 419 -4.151 -13.978 -0.325 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.696 -13.871 1.578 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -4.619 -15.244 1.737 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -4.406 -14.071 5.112 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -5.253 -15.176 4.024 1.00 0.00 H new ATOM 880 N ILE A 420 -5.086 -11.551 0.604 1.00 0.00 N ATOM 881 CA ILE A 420 -5.294 -10.109 0.584 1.00 0.00 C ATOM 882 C ILE A 420 -4.685 -9.451 1.818 1.00 0.00 C ATOM 883 O ILE A 420 -4.199 -8.321 1.756 1.00 0.00 O ATOM 884 CB ILE A 420 -6.794 -9.759 0.510 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.450 -10.479 -0.669 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.985 -8.254 0.391 1.00 0.00 C ATOM 887 CD1 ILE A 420 -8.127 -11.776 -0.284 1.00 0.00 C ATOM 0 H ILE A 420 -5.944 -12.102 0.615 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.798 -9.727 -0.308 1.00 0.00 H new ATOM 0 HB ILE A 420 -7.274 -10.093 1.430 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -8.185 -9.816 -1.125 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -6.693 -10.684 -1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.050 -8.025 0.340 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.549 -7.762 1.261 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.493 -7.895 -0.513 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.570 -12.232 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.392 -12.457 0.145 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.907 -11.575 0.450 1.00 0.00 H new ATOM 899 N LYS A 421 -4.712 -10.166 2.938 1.00 0.00 N ATOM 900 CA LYS A 421 -4.160 -9.656 4.188 1.00 0.00 C ATOM 901 C LYS A 421 -2.649 -9.485 4.083 1.00 0.00 C ATOM 902 O LYS A 421 -2.128 -8.370 4.155 1.00 0.00 O ATOM 903 CB LYS A 421 -4.498 -10.602 5.341 1.00 0.00 C ATOM 904 CG LYS A 421 -5.987 -10.708 5.624 1.00 0.00 C ATOM 905 CD LYS A 421 -6.556 -12.029 5.128 1.00 0.00 C ATOM 906 CE LYS A 421 -8.073 -11.987 5.046 1.00 0.00 C ATOM 907 NZ LYS A 421 -8.599 -12.933 4.023 1.00 0.00 N ATOM 0 H LYS A 421 -5.111 -11.102 3.006 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.606 -8.681 4.384 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.109 -11.594 5.112 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -3.989 -10.260 6.242 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.162 -10.615 6.696 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.510 -9.882 5.142 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.144 -12.258 4.145 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -6.249 -12.833 5.797 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -8.496 -12.233 6.020 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -8.396 -10.974 4.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -9.637 -12.875 3.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -8.215 -12.683 3.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -8.313 -13.903 4.267 1.00 0.00 H new ATOM 921 N ILE A 422 -1.954 -10.600 3.909 1.00 0.00 N ATOM 922 CA ILE A 422 -0.501 -10.592 3.791 1.00 0.00 C ATOM 923 C ILE A 422 -0.050 -9.698 2.641 1.00 0.00 C ATOM 924 O ILE A 422 0.799 -8.824 2.816 1.00 0.00 O ATOM 925 CB ILE A 422 0.052 -12.019 3.583 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.067 -12.825 4.878 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.502 -11.979 3.115 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.458 -13.360 5.134 1.00 0.00 C ATOM 0 H ILE A 422 -2.375 -11.527 3.846 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.104 -10.195 4.725 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.541 -12.506 2.808 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.633 -13.660 4.842 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.231 -12.195 5.716 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.868 -12.996 2.976 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.565 -11.439 2.170 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.112 -11.473 3.863 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.466 -13.920 6.069 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.160 -12.529 5.203 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.752 -14.016 4.315 1.00 0.00 H new ATOM 940 N ALA A 423 -0.621 -9.927 1.467 1.00 0.00 N ATOM 941 CA ALA A 423 -0.277 -9.146 0.285 1.00 0.00 C ATOM 942 C ALA A 423 -0.371 -7.653 0.572 1.00 0.00 C ATOM 943 O ALA A 423 0.498 -6.876 0.176 1.00 0.00 O ATOM 944 CB ALA A 423 -1.179 -9.523 -0.881 1.00 0.00 C ATOM 0 H ALA A 423 -1.325 -10.647 1.306 1.00 0.00 H new ATOM 0 HA ALA A 423 0.754 -9.374 0.015 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.909 -8.931 -1.756 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -1.057 -10.582 -1.108 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -2.218 -9.326 -0.616 1.00 0.00 H new ATOM 950 N GLY A 424 -1.427 -7.264 1.274 1.00 0.00 N ATOM 951 CA GLY A 424 -1.615 -5.867 1.617 1.00 0.00 C ATOM 952 C GLY A 424 -0.467 -5.327 2.445 1.00 0.00 C ATOM 953 O GLY A 424 -0.034 -4.192 2.255 1.00 0.00 O ATOM 0 H GLY A 424 -2.157 -7.891 1.612 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.712 -5.279 0.704 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.547 -5.752 2.170 1.00 0.00 H new ATOM 957 N ILE A 425 0.031 -6.149 3.367 1.00 0.00 N ATOM 958 CA ILE A 425 1.141 -5.752 4.221 1.00 0.00 C ATOM 959 C ILE A 425 2.413 -5.571 3.403 1.00 0.00 C ATOM 960 O ILE A 425 3.169 -4.622 3.611 1.00 0.00 O ATOM 961 CB ILE A 425 1.393 -6.789 5.335 1.00 0.00 C ATOM 962 CG1 ILE A 425 0.151 -6.936 6.214 1.00 0.00 C ATOM 963 CG2 ILE A 425 2.597 -6.393 6.180 1.00 0.00 C ATOM 964 CD1 ILE A 425 0.113 -8.231 6.996 1.00 0.00 C ATOM 0 H ILE A 425 -0.318 -7.092 3.539 1.00 0.00 H new ATOM 0 HA ILE A 425 0.870 -4.803 4.683 1.00 0.00 H new ATOM 0 HB ILE A 425 1.606 -7.750 4.867 1.00 0.00 H new ATOM 0 HG12 ILE A 425 0.108 -6.099 6.911 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -0.738 -6.874 5.586 1.00 0.00 H new ATOM 0 HG21 ILE A 425 2.756 -7.139 6.959 1.00 0.00 H new ATOM 0 HG22 ILE A 425 3.483 -6.335 5.547 1.00 0.00 H new ATOM 0 HG23 ILE A 425 2.415 -5.421 6.639 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -0.796 -8.267 7.597 1.00 0.00 H new ATOM 0 HD12 ILE A 425 0.124 -9.074 6.305 1.00 0.00 H new ATOM 0 HD13 ILE A 425 0.983 -8.287 7.650 1.00 0.00 H new ATOM 976 N ARG A 426 2.637 -6.485 2.468 1.00 0.00 N ATOM 977 CA ARG A 426 3.815 -6.427 1.611 1.00 0.00 C ATOM 978 C ARG A 426 3.740 -5.227 0.677 1.00 0.00 C ATOM 979 O ARG A 426 4.728 -4.522 0.472 1.00 0.00 O ATOM 980 CB ARG A 426 3.949 -7.719 0.800 1.00 0.00 C ATOM 981 CG ARG A 426 5.372 -8.254 0.741 1.00 0.00 C ATOM 982 CD ARG A 426 5.429 -9.734 1.087 1.00 0.00 C ATOM 983 NE ARG A 426 6.781 -10.164 1.437 1.00 0.00 N ATOM 984 CZ ARG A 426 7.170 -11.437 1.461 1.00 0.00 C ATOM 985 NH1 ARG A 426 6.315 -12.405 1.155 1.00 0.00 N ATOM 986 NH2 ARG A 426 8.418 -11.743 1.788 1.00 0.00 N ATOM 0 H ARG A 426 2.019 -7.275 2.283 1.00 0.00 H new ATOM 0 HA ARG A 426 4.695 -6.318 2.245 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.301 -8.480 1.234 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.594 -7.540 -0.215 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.779 -8.097 -0.258 1.00 0.00 H new ATOM 0 HG3 ARG A 426 6.001 -7.694 1.433 1.00 0.00 H new ATOM 0 HD2 ARG A 426 4.757 -9.937 1.921 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.071 -10.318 0.239 1.00 0.00 H new ATOM 0 HE ARG A 426 7.466 -9.447 1.677 1.00 0.00 H new ATOM 0 HH11 ARG A 426 5.355 -12.175 0.900 1.00 0.00 H new ATOM 0 HH12 ARG A 426 6.618 -13.379 1.175 1.00 0.00 H new ATOM 0 HH21 ARG A 426 9.080 -11.003 2.021 1.00 0.00 H new ATOM 0 HH22 ARG A 426 8.716 -12.718 1.806 1.00 0.00 H new ATOM 998 N ALA A 427 2.557 -4.994 0.119 1.00 0.00 N ATOM 999 CA ALA A 427 2.351 -3.871 -0.786 1.00 0.00 C ATOM 1000 C ALA A 427 2.594 -2.553 -0.065 1.00 0.00 C ATOM 1001 O ALA A 427 3.370 -1.714 -0.524 1.00 0.00 O ATOM 1002 CB ALA A 427 0.946 -3.910 -1.369 1.00 0.00 C ATOM 0 H ALA A 427 1.728 -5.567 0.277 1.00 0.00 H new ATOM 0 HA ALA A 427 3.066 -3.951 -1.604 1.00 0.00 H new ATOM 0 HB1 ALA A 427 0.808 -3.064 -2.043 1.00 0.00 H new ATOM 0 HB2 ALA A 427 0.807 -4.840 -1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.216 -3.854 -0.562 1.00 0.00 H new ATOM 1008 N ALA A 428 1.937 -2.386 1.073 1.00 0.00 N ATOM 1009 CA ALA A 428 2.090 -1.178 1.871 1.00 0.00 C ATOM 1010 C ALA A 428 3.525 -1.047 2.356 1.00 0.00 C ATOM 1011 O ALA A 428 4.097 0.044 2.352 1.00 0.00 O ATOM 1012 CB ALA A 428 1.127 -1.193 3.050 1.00 0.00 C ATOM 0 H ALA A 428 1.292 -3.072 1.465 1.00 0.00 H new ATOM 0 HA ALA A 428 1.854 -0.316 1.247 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.255 -0.283 3.636 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.102 -1.247 2.682 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.333 -2.060 3.677 1.00 0.00 H new ATOM 1018 N GLU A 429 4.107 -2.171 2.757 1.00 0.00 N ATOM 1019 CA GLU A 429 5.484 -2.184 3.229 1.00 0.00 C ATOM 1020 C GLU A 429 6.421 -1.757 2.106 1.00 0.00 C ATOM 1021 O GLU A 429 7.424 -1.085 2.341 1.00 0.00 O ATOM 1022 CB GLU A 429 5.866 -3.577 3.732 1.00 0.00 C ATOM 1023 CG GLU A 429 5.577 -3.788 5.209 1.00 0.00 C ATOM 1024 CD GLU A 429 5.941 -5.182 5.682 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.917 -6.115 4.852 1.00 0.00 O ATOM 1026 OE2 GLU A 429 6.250 -5.339 6.881 1.00 0.00 O ATOM 0 H GLU A 429 3.648 -3.082 2.764 1.00 0.00 H new ATOM 0 HA GLU A 429 5.576 -1.481 4.057 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.324 -4.325 3.153 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.928 -3.742 3.550 1.00 0.00 H new ATOM 0 HG2 GLU A 429 6.133 -3.054 5.792 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.518 -3.610 5.397 1.00 0.00 H new ATOM 1033 N ASN A 430 6.070 -2.140 0.882 1.00 0.00 N ATOM 1034 CA ASN A 430 6.863 -1.784 -0.285 1.00 0.00 C ATOM 1035 C ASN A 430 6.806 -0.279 -0.515 1.00 0.00 C ATOM 1036 O ASN A 430 7.765 0.326 -0.994 1.00 0.00 O ATOM 1037 CB ASN A 430 6.355 -2.529 -1.523 1.00 0.00 C ATOM 1038 CG ASN A 430 7.204 -3.740 -1.858 1.00 0.00 C ATOM 1039 OD1 ASN A 430 7.455 -4.591 -1.005 1.00 0.00 O ATOM 1040 ND2 ASN A 430 7.652 -3.823 -3.106 1.00 0.00 N ATOM 0 H ASN A 430 5.241 -2.697 0.675 1.00 0.00 H new ATOM 0 HA ASN A 430 7.898 -2.075 -0.107 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.325 -2.845 -1.356 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.345 -1.849 -2.375 1.00 0.00 H new ATOM 0 HD21 ASN A 430 8.228 -4.615 -3.389 1.00 0.00 H new ATOM 0 HD22 ASN A 430 7.419 -3.094 -3.781 1.00 0.00 H new ATOM 1047 N ALA A 431 5.675 0.319 -0.156 1.00 0.00 N ATOM 1048 CA ALA A 431 5.485 1.755 -0.306 1.00 0.00 C ATOM 1049 C ALA A 431 6.118 2.501 0.863 1.00 0.00 C ATOM 1050 O ALA A 431 6.612 3.618 0.707 1.00 0.00 O ATOM 1051 CB ALA A 431 4.003 2.085 -0.408 1.00 0.00 C ATOM 0 H ALA A 431 4.874 -0.172 0.242 1.00 0.00 H new ATOM 0 HA ALA A 431 5.975 2.075 -1.225 1.00 0.00 H new ATOM 0 HB1 ALA A 431 3.877 3.162 -0.520 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.576 1.578 -1.273 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.493 1.752 0.496 1.00 0.00 H new ATOM 1057 N LEU A 432 6.105 1.870 2.034 1.00 0.00 N ATOM 1058 CA LEU A 432 6.683 2.465 3.232 1.00 0.00 C ATOM 1059 C LEU A 432 8.202 2.308 3.237 1.00 0.00 C ATOM 1060 O LEU A 432 8.912 3.066 3.898 1.00 0.00 O ATOM 1061 CB LEU A 432 6.086 1.822 4.486 1.00 0.00 C ATOM 1062 CG LEU A 432 4.587 2.056 4.683 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.924 0.819 5.272 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.350 3.264 5.576 1.00 0.00 C ATOM 0 H LEU A 432 5.699 0.945 2.177 1.00 0.00 H new ATOM 0 HA LEU A 432 6.445 3.529 3.231 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.268 0.748 4.447 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.616 2.204 5.359 1.00 0.00 H new ATOM 0 HG LEU A 432 4.139 2.253 3.709 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.858 1.006 5.405 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.063 -0.025 4.597 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.375 0.589 6.237 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.278 3.416 5.706 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.813 3.094 6.548 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.789 4.149 5.115 1.00 0.00 H new ATOM 1076 N ARG A 433 8.697 1.317 2.496 1.00 0.00 N ATOM 1077 CA ARG A 433 10.131 1.064 2.417 1.00 0.00 C ATOM 1078 C ARG A 433 10.875 2.295 1.912 1.00 0.00 C ATOM 1079 O ARG A 433 11.951 2.631 2.407 1.00 0.00 O ATOM 1080 CB ARG A 433 10.410 -0.128 1.497 1.00 0.00 C ATOM 1081 CG ARG A 433 10.524 -1.452 2.234 1.00 0.00 C ATOM 1082 CD ARG A 433 11.008 -2.561 1.313 1.00 0.00 C ATOM 1083 NE ARG A 433 11.028 -3.859 1.983 1.00 0.00 N ATOM 1084 CZ ARG A 433 11.655 -4.931 1.503 1.00 0.00 C ATOM 1085 NH1 ARG A 433 12.314 -4.863 0.353 1.00 0.00 N ATOM 1086 NH2 ARG A 433 11.624 -6.073 2.175 1.00 0.00 N ATOM 0 H ARG A 433 8.125 0.678 1.943 1.00 0.00 H new ATOM 0 HA ARG A 433 10.489 0.832 3.420 1.00 0.00 H new ATOM 0 HB2 ARG A 433 9.612 -0.201 0.758 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.335 0.055 0.950 1.00 0.00 H new ATOM 0 HG2 ARG A 433 11.214 -1.346 3.071 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.554 -1.722 2.652 1.00 0.00 H new ATOM 0 HD2 ARG A 433 10.360 -2.614 0.438 1.00 0.00 H new ATOM 0 HD3 ARG A 433 12.009 -2.323 0.954 1.00 0.00 H new ATOM 0 HE ARG A 433 10.533 -3.949 2.870 1.00 0.00 H new ATOM 0 HH11 ARG A 433 12.342 -3.986 -0.168 1.00 0.00 H new ATOM 0 HH12 ARG A 433 12.793 -5.687 -0.010 1.00 0.00 H new ATOM 0 HH21 ARG A 433 11.120 -6.131 3.060 1.00 0.00 H new ATOM 0 HH22 ARG A 433 12.104 -6.894 1.807 1.00 0.00 H new ATOM 1098 N ASP A 434 10.293 2.963 0.923 1.00 0.00 N ATOM 1099 CA ASP A 434 10.897 4.159 0.348 1.00 0.00 C ATOM 1100 C ASP A 434 10.985 5.274 1.386 1.00 0.00 C ATOM 1101 O ASP A 434 10.144 6.171 1.422 1.00 0.00 O ATOM 1102 CB ASP A 434 10.090 4.635 -0.861 1.00 0.00 C ATOM 1103 CG ASP A 434 10.275 3.739 -2.070 1.00 0.00 C ATOM 1104 OD1 ASP A 434 9.716 2.622 -2.072 1.00 0.00 O ATOM 1105 OD2 ASP A 434 10.981 4.154 -3.014 1.00 0.00 O ATOM 0 H ASP A 434 9.403 2.697 0.502 1.00 0.00 H new ATOM 0 HA ASP A 434 11.906 3.906 0.024 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.033 4.671 -0.597 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.389 5.651 -1.117 1.00 0.00 H new ATOM 1110 N LYS A 435 12.010 5.206 2.230 1.00 0.00 N ATOM 1111 CA LYS A 435 12.212 6.207 3.274 1.00 0.00 C ATOM 1112 C LYS A 435 12.297 7.609 2.682 1.00 0.00 C ATOM 1113 O LYS A 435 11.927 8.589 3.329 1.00 0.00 O ATOM 1114 CB LYS A 435 13.479 5.893 4.071 1.00 0.00 C ATOM 1115 CG LYS A 435 13.218 5.613 5.542 1.00 0.00 C ATOM 1116 CD LYS A 435 13.682 4.220 5.938 1.00 0.00 C ATOM 1117 CE LYS A 435 15.134 4.223 6.386 1.00 0.00 C ATOM 1118 NZ LYS A 435 16.054 4.618 5.284 1.00 0.00 N ATOM 0 H LYS A 435 12.714 4.468 2.212 1.00 0.00 H new ATOM 0 HA LYS A 435 11.353 6.174 3.944 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.973 5.029 3.627 1.00 0.00 H new ATOM 0 HB3 LYS A 435 14.169 6.732 3.986 1.00 0.00 H new ATOM 0 HG2 LYS A 435 13.733 6.356 6.151 1.00 0.00 H new ATOM 0 HG3 LYS A 435 12.153 5.715 5.749 1.00 0.00 H new ATOM 0 HD2 LYS A 435 13.053 3.841 6.743 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.562 3.542 5.093 1.00 0.00 H new ATOM 0 HE2 LYS A 435 15.254 4.910 7.223 1.00 0.00 H new ATOM 0 HE3 LYS A 435 15.405 3.231 6.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 17.035 4.414 5.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 15.818 4.080 4.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 15.952 5.635 5.094 1.00 0.00 H new ATOM 1132 N LYS A 436 12.780 7.698 1.448 1.00 0.00 N ATOM 1133 CA LYS A 436 12.903 8.984 0.771 1.00 0.00 C ATOM 1134 C LYS A 436 11.542 9.456 0.287 1.00 0.00 C ATOM 1135 O LYS A 436 11.158 10.607 0.493 1.00 0.00 O ATOM 1136 CB LYS A 436 13.869 8.881 -0.410 1.00 0.00 C ATOM 1137 CG LYS A 436 15.287 8.515 -0.007 1.00 0.00 C ATOM 1138 CD LYS A 436 15.396 7.046 0.369 1.00 0.00 C ATOM 1139 CE LYS A 436 16.836 6.560 0.321 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.405 6.376 1.686 1.00 0.00 N ATOM 0 H LYS A 436 13.092 6.898 0.897 1.00 0.00 H new ATOM 0 HA LYS A 436 13.298 9.709 1.482 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.495 8.134 -1.110 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.885 9.834 -0.939 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.968 8.733 -0.830 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.598 9.132 0.836 1.00 0.00 H new ATOM 0 HD2 LYS A 436 14.994 6.896 1.371 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.788 6.450 -0.311 1.00 0.00 H new ATOM 0 HE2 LYS A 436 16.883 5.616 -0.222 1.00 0.00 H new ATOM 0 HE3 LYS A 436 17.443 7.277 -0.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 18.388 6.044 1.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.384 7.282 2.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 16.841 5.673 2.205 1.00 0.00 H new ATOM 1154 N MET A 437 10.813 8.550 -0.352 1.00 0.00 N ATOM 1155 CA MET A 437 9.485 8.861 -0.860 1.00 0.00 C ATOM 1156 C MET A 437 8.522 9.106 0.293 1.00 0.00 C ATOM 1157 O MET A 437 7.590 9.900 0.179 1.00 0.00 O ATOM 1158 CB MET A 437 8.971 7.720 -1.739 1.00 0.00 C ATOM 1159 CG MET A 437 7.661 8.039 -2.443 1.00 0.00 C ATOM 1160 SD MET A 437 7.831 9.352 -3.668 1.00 0.00 S ATOM 1161 CE MET A 437 9.264 8.784 -4.578 1.00 0.00 C ATOM 0 H MET A 437 11.120 7.594 -0.530 1.00 0.00 H new ATOM 0 HA MET A 437 9.549 9.767 -1.463 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.727 7.479 -2.487 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.836 6.830 -1.124 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.287 7.139 -2.931 1.00 0.00 H new ATOM 0 HG3 MET A 437 6.917 8.333 -1.702 1.00 0.00 H new ATOM 0 HE1 MET A 437 9.279 9.253 -5.562 1.00 0.00 H new ATOM 0 HE2 MET A 437 10.170 9.052 -4.034 1.00 0.00 H new ATOM 0 HE3 MET A 437 9.216 7.701 -4.693 1.00 0.00 H new ATOM 1171 N LEU A 438 8.757 8.424 1.410 1.00 0.00 N ATOM 1172 CA LEU A 438 7.910 8.578 2.586 1.00 0.00 C ATOM 1173 C LEU A 438 8.191 9.908 3.274 1.00 0.00 C ATOM 1174 O LEU A 438 7.295 10.521 3.855 1.00 0.00 O ATOM 1175 CB LEU A 438 8.132 7.421 3.562 1.00 0.00 C ATOM 1176 CG LEU A 438 6.853 6.743 4.056 1.00 0.00 C ATOM 1177 CD1 LEU A 438 6.002 7.723 4.848 1.00 0.00 C ATOM 1178 CD2 LEU A 438 6.064 6.177 2.885 1.00 0.00 C ATOM 0 H LEU A 438 9.524 7.762 1.525 1.00 0.00 H new ATOM 0 HA LEU A 438 6.869 8.565 2.263 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.760 6.672 3.079 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.685 7.793 4.424 1.00 0.00 H new ATOM 0 HG LEU A 438 7.132 5.920 4.714 1.00 0.00 H new ATOM 0 HD11 LEU A 438 5.096 7.223 5.192 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.567 8.083 5.708 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.732 8.567 4.213 1.00 0.00 H new ATOM 0 HD21 LEU A 438 5.157 5.698 3.255 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.796 6.984 2.203 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.673 5.443 2.357 1.00 0.00 H new ATOM 1190 N ASP A 439 9.441 10.354 3.198 1.00 0.00 N ATOM 1191 CA ASP A 439 9.838 11.616 3.806 1.00 0.00 C ATOM 1192 C ASP A 439 9.186 12.786 3.080 1.00 0.00 C ATOM 1193 O ASP A 439 8.763 13.760 3.703 1.00 0.00 O ATOM 1194 CB ASP A 439 11.361 11.765 3.779 1.00 0.00 C ATOM 1195 CG ASP A 439 12.017 11.218 5.032 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.493 11.474 6.136 1.00 0.00 O ATOM 1197 OD2 ASP A 439 13.055 10.535 4.907 1.00 0.00 O ATOM 0 H ASP A 439 10.195 9.859 2.721 1.00 0.00 H new ATOM 0 HA ASP A 439 9.503 11.618 4.843 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.759 11.245 2.907 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.619 12.818 3.667 1.00 0.00 H new ATOM 1202 N PHE A 440 9.105 12.678 1.759 1.00 0.00 N ATOM 1203 CA PHE A 440 8.500 13.724 0.942 1.00 0.00 C ATOM 1204 C PHE A 440 7.007 13.849 1.237 1.00 0.00 C ATOM 1205 O PHE A 440 6.466 14.953 1.288 1.00 0.00 O ATOM 1206 CB PHE A 440 8.717 13.430 -0.543 1.00 0.00 C ATOM 1207 CG PHE A 440 9.331 14.575 -1.297 1.00 0.00 C ATOM 1208 CD1 PHE A 440 8.536 15.582 -1.819 1.00 0.00 C ATOM 1209 CD2 PHE A 440 10.702 14.644 -1.483 1.00 0.00 C ATOM 1210 CE1 PHE A 440 9.097 16.638 -2.512 1.00 0.00 C ATOM 1211 CE2 PHE A 440 11.269 15.697 -2.176 1.00 0.00 C ATOM 1212 CZ PHE A 440 10.466 16.696 -2.691 1.00 0.00 C ATOM 0 H PHE A 440 9.451 11.877 1.231 1.00 0.00 H new ATOM 0 HA PHE A 440 8.981 14.670 1.191 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.359 12.554 -0.642 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.760 13.177 -0.999 1.00 0.00 H new ATOM 0 HD1 PHE A 440 7.465 15.542 -1.683 1.00 0.00 H new ATOM 0 HD2 PHE A 440 11.335 13.866 -1.082 1.00 0.00 H new ATOM 0 HE1 PHE A 440 8.466 17.417 -2.913 1.00 0.00 H new ATOM 0 HE2 PHE A 440 12.339 15.739 -2.315 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.907 17.520 -3.232 1.00 0.00 H new ATOM 1222 N TYR A 441 6.351 12.710 1.442 1.00 0.00 N ATOM 1223 CA TYR A 441 4.928 12.694 1.744 1.00 0.00 C ATOM 1224 C TYR A 441 4.705 13.006 3.210 1.00 0.00 C ATOM 1225 O TYR A 441 3.835 13.798 3.562 1.00 0.00 O ATOM 1226 CB TYR A 441 4.323 11.334 1.398 1.00 0.00 C ATOM 1227 CG TYR A 441 3.874 11.213 -0.040 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.765 10.837 -1.037 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.558 11.472 -0.400 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.359 10.722 -2.352 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.143 11.358 -1.714 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.047 10.984 -2.685 1.00 0.00 C ATOM 1233 OH TYR A 441 2.637 10.871 -3.994 1.00 0.00 O ATOM 0 H TYR A 441 6.785 11.788 1.404 1.00 0.00 H new ATOM 0 HA TYR A 441 4.435 13.456 1.140 1.00 0.00 H new ATOM 0 HB2 TYR A 441 5.058 10.557 1.606 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.470 11.149 2.052 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.793 10.631 -0.779 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.848 11.767 0.358 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.065 10.429 -3.115 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.116 11.561 -1.978 1.00 0.00 H new ATOM 0 HH TYR A 441 3.174 10.188 -4.447 1.00 0.00 H new ATOM 1243 N ALA A 442 5.508 12.388 4.064 1.00 0.00 N ATOM 1244 CA ALA A 442 5.405 12.612 5.498 1.00 0.00 C ATOM 1245 C ALA A 442 5.516 14.097 5.824 1.00 0.00 C ATOM 1246 O ALA A 442 4.930 14.577 6.794 1.00 0.00 O ATOM 1247 CB ALA A 442 6.470 11.819 6.240 1.00 0.00 C ATOM 0 H ALA A 442 6.236 11.729 3.789 1.00 0.00 H new ATOM 0 HA ALA A 442 4.426 12.265 5.827 1.00 0.00 H new ATOM 0 HB1 ALA A 442 6.377 11.999 7.311 1.00 0.00 H new ATOM 0 HB2 ALA A 442 6.339 10.756 6.038 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.458 12.133 5.903 1.00 0.00 H new ATOM 1253 N LYS A 443 6.261 14.826 4.996 1.00 0.00 N ATOM 1254 CA LYS A 443 6.435 16.261 5.189 1.00 0.00 C ATOM 1255 C LYS A 443 5.316 17.040 4.499 1.00 0.00 C ATOM 1256 O LYS A 443 5.266 18.268 4.571 1.00 0.00 O ATOM 1257 CB LYS A 443 7.797 16.709 4.656 1.00 0.00 C ATOM 1258 CG LYS A 443 8.579 17.570 5.635 1.00 0.00 C ATOM 1259 CD LYS A 443 8.940 16.796 6.892 1.00 0.00 C ATOM 1260 CE LYS A 443 9.798 15.580 6.575 1.00 0.00 C ATOM 1261 NZ LYS A 443 10.993 15.497 7.458 1.00 0.00 N ATOM 0 H LYS A 443 6.752 14.446 4.187 1.00 0.00 H new ATOM 0 HA LYS A 443 6.391 16.469 6.258 1.00 0.00 H new ATOM 0 HB2 LYS A 443 8.388 15.828 4.407 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.651 17.267 3.731 1.00 0.00 H new ATOM 0 HG2 LYS A 443 9.488 17.933 5.156 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.988 18.446 5.903 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.475 17.450 7.581 1.00 0.00 H new ATOM 0 HD3 LYS A 443 8.029 16.477 7.398 1.00 0.00 H new ATOM 0 HE2 LYS A 443 9.201 14.675 6.687 1.00 0.00 H new ATOM 0 HE3 LYS A 443 10.118 15.623 5.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 11.551 14.655 7.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 11.577 16.348 7.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 10.688 15.430 8.450 1.00 0.00 H new ATOM 1275 N GLN A 444 4.414 16.316 3.840 1.00 0.00 N ATOM 1276 CA GLN A 444 3.290 16.929 3.150 1.00 0.00 C ATOM 1277 C GLN A 444 1.985 16.534 3.826 1.00 0.00 C ATOM 1278 O GLN A 444 1.113 17.372 4.055 1.00 0.00 O ATOM 1279 CB GLN A 444 3.271 16.509 1.679 1.00 0.00 C ATOM 1280 CG GLN A 444 4.362 17.164 0.845 1.00 0.00 C ATOM 1281 CD GLN A 444 4.313 16.746 -0.611 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.651 17.383 -1.430 1.00 0.00 O ATOM 1283 NE2 GLN A 444 5.016 15.668 -0.942 1.00 0.00 N ATOM 0 H GLN A 444 4.444 15.299 3.771 1.00 0.00 H new ATOM 0 HA GLN A 444 3.400 18.012 3.199 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.379 15.426 1.617 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.300 16.757 1.251 1.00 0.00 H new ATOM 0 HG2 GLN A 444 4.264 18.248 0.912 1.00 0.00 H new ATOM 0 HG3 GLN A 444 5.336 16.906 1.261 1.00 0.00 H new ATOM 0 HE21 GLN A 444 5.551 15.170 -0.231 1.00 0.00 H new ATOM 0 HE22 GLN A 444 5.021 15.339 -1.907 1.00 0.00 H new ATOM 1292 N ARG A 445 1.863 15.252 4.153 1.00 0.00 N ATOM 1293 CA ARG A 445 0.670 14.743 4.818 1.00 0.00 C ATOM 1294 C ARG A 445 0.566 15.302 6.230 1.00 0.00 C ATOM 1295 O ARG A 445 -0.475 15.822 6.633 1.00 0.00 O ATOM 1296 CB ARG A 445 0.694 13.214 4.864 1.00 0.00 C ATOM 1297 CG ARG A 445 -0.650 12.593 5.212 1.00 0.00 C ATOM 1298 CD ARG A 445 -0.572 11.761 6.482 1.00 0.00 C ATOM 1299 NE ARG A 445 -0.982 12.520 7.661 1.00 0.00 N ATOM 1300 CZ ARG A 445 -2.251 12.735 8.001 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -3.237 12.248 7.257 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -2.536 13.439 9.090 1.00 0.00 N ATOM 0 H ARG A 445 2.576 14.547 3.968 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.201 15.065 4.248 1.00 0.00 H new ATOM 0 HB2 ARG A 445 1.020 12.835 3.895 1.00 0.00 H new ATOM 0 HB3 ARG A 445 1.434 12.893 5.597 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.393 13.380 5.338 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -0.986 11.966 4.386 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -1.207 10.881 6.378 1.00 0.00 H new ATOM 0 HD3 ARG A 445 0.448 11.403 6.618 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.253 12.908 8.259 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -3.024 11.706 6.420 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -4.207 12.416 7.523 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -1.783 13.815 9.666 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -3.508 13.604 9.351 1.00 0.00 H new ATOM 1314 N ALA A 446 1.659 15.196 6.973 1.00 0.00 N ATOM 1315 CA ALA A 446 1.709 15.692 8.342 1.00 0.00 C ATOM 1316 C ALA A 446 1.791 17.216 8.368 1.00 0.00 C ATOM 1317 O ALA A 446 1.411 17.852 9.351 1.00 0.00 O ATOM 1318 CB ALA A 446 2.897 15.088 9.076 1.00 0.00 C ATOM 0 H ALA A 446 2.527 14.769 6.649 1.00 0.00 H new ATOM 0 HA ALA A 446 0.791 15.393 8.847 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.924 15.466 10.098 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.800 14.002 9.093 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.819 15.362 8.563 1.00 0.00 H new