USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 635 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 417 HIS : no HD1:sc= -1.02 X(o=-3,f=-3.1) USER MOD Set 1.2: A 421 CYS SG : rot 100:sc= 0.631 USER MOD Set 1.3: A 426 CYS SG : rot 150:sc= -1.72! USER MOD Set 1.4: A 429 CYS SG : rot 167:sc= -0.922 USER MOD Set 2.1: A 393 HIS :FLIP no HD1:sc= 0.0374 F(o=-1.4,f=0.74) USER MOD Set 2.2: A 397 CYS SG : rot 153:sc= 0.145 USER MOD Set 2.3: A 403 CYS SG : rot 130:sc= -0.214 USER MOD Set 2.4: A 408 CYS SG : rot 118:sc= 0.772 USER MOD Set 3.1: A 394 MET CE :methyl -175:sc= -0.554 (180deg=-0.343) USER MOD Set 3.2: A 411 SER OG : rot -170:sc= -0.538 USER MOD Set 4.1: A 355 GLN : amide:sc= -0.441 X(o=-0.15,f=-0.49) USER MOD Set 4.2: A 356 GLN : amide:sc= 0.992 K(o=-0.15,f=-1.3) USER MOD Set 4.3: A 387 MET CE :methyl -148:sc= -0.697 (180deg=-0.708) USER MOD Set 5.1: A 362 HIS :FLIP no HD1:sc= 0.354 F(o=0.49,f=2.6) USER MOD Set 5.2: A 366 CYS SG : rot -150:sc= 2.24 USER MOD Set 5.3: A 384 CYS SG : rot 84:sc= -2.22! USER MOD Set 5.4: A 388 LYS NZ :NH3+ 175:sc= 2.22 (180deg=0.824) USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 351 LYS NZ :NH3+ 165:sc= -0.026 (180deg=-0.259) USER MOD Single : A 354 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 364 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 367 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 371 GLN : amide:sc=-0.00935 X(o=-0.0093,f=-0.17) USER MOD Single : A 383 HIS : no HE2:sc= 0.287 K(o=0.29,f=-1.1) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=-0.0098) USER MOD Single : A 392 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 395 THR OG1 : rot -20:sc= 1.22 USER MOD Single : A 396 HIS : no HE2:sc= 0.762 K(o=0.76,f=-2.4!) USER MOD Single : A 398 GLN : amide:sc= 0.759 K(o=0.76,f=0) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.18) USER MOD Single : A 407 HIS : no HD1:sc=-0.00814 X(o=-0.0081,f=-0.0081) USER MOD Single : A 410 SER OG : rot 86:sc= 0.744 USER MOD Single : A 413 GLN : amide:sc=-0.00152 X(o=-0.0015,f=-0.44) USER MOD Single : A 416 SER OG : rot 84:sc= 0.0221 USER MOD Single : A 419 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 420 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 HIS : no HE2:sc= 0.541 K(o=0.54,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 84 N PRO A 347 4.537 -16.336 14.701 1.00 0.00 N ATOM 85 CA PRO A 347 3.674 -15.162 14.700 1.00 0.00 C ATOM 86 C PRO A 347 4.324 -13.845 14.284 1.00 0.00 C ATOM 87 O PRO A 347 3.651 -13.027 13.670 1.00 0.00 O ATOM 88 CB PRO A 347 3.127 -15.037 16.116 1.00 0.00 C ATOM 89 CG PRO A 347 3.118 -16.486 16.601 1.00 0.00 C ATOM 90 CD PRO A 347 4.393 -17.044 15.962 1.00 0.00 C ATOM 0 HA PRO A 347 2.911 -15.323 13.938 1.00 0.00 H new ATOM 0 HB2 PRO A 347 3.759 -14.405 16.740 1.00 0.00 H new ATOM 0 HB3 PRO A 347 2.129 -14.600 16.127 1.00 0.00 H new ATOM 0 HG2 PRO A 347 3.144 -16.552 17.689 1.00 0.00 H new ATOM 0 HG3 PRO A 347 2.228 -17.021 16.270 1.00 0.00 H new ATOM 0 HD2 PRO A 347 5.258 -16.881 16.605 1.00 0.00 H new ATOM 0 HD3 PRO A 347 4.313 -18.119 15.802 1.00 0.00 H new ATOM 98 N GLU A 348 5.613 -13.626 14.556 1.00 0.00 N ATOM 99 CA GLU A 348 6.310 -12.393 14.160 1.00 0.00 C ATOM 100 C GLU A 348 6.395 -12.287 12.638 1.00 0.00 C ATOM 101 O GLU A 348 6.206 -11.211 12.072 1.00 0.00 O ATOM 102 CB GLU A 348 7.692 -12.325 14.816 1.00 0.00 C ATOM 103 CG GLU A 348 8.455 -11.033 14.496 1.00 0.00 C ATOM 104 CD GLU A 348 9.774 -10.961 15.290 1.00 0.00 C ATOM 105 OE1 GLU A 348 9.767 -10.467 16.444 1.00 0.00 O ATOM 106 OE2 GLU A 348 10.831 -11.390 14.764 1.00 0.00 O ATOM 0 H GLU A 348 6.203 -14.293 15.054 1.00 0.00 H new ATOM 0 HA GLU A 348 5.737 -11.536 14.513 1.00 0.00 H new ATOM 0 HB2 GLU A 348 7.578 -12.413 15.896 1.00 0.00 H new ATOM 0 HB3 GLU A 348 8.284 -13.179 14.488 1.00 0.00 H new ATOM 0 HG2 GLU A 348 8.666 -10.986 13.428 1.00 0.00 H new ATOM 0 HG3 GLU A 348 7.834 -10.170 14.736 1.00 0.00 H new ATOM 113 N LYS A 349 6.562 -13.423 11.957 1.00 0.00 N ATOM 114 CA LYS A 349 6.497 -13.480 10.501 1.00 0.00 C ATOM 115 C LYS A 349 5.077 -13.083 10.088 1.00 0.00 C ATOM 116 O LYS A 349 4.940 -12.187 9.275 1.00 0.00 O ATOM 117 CB LYS A 349 6.952 -14.862 9.998 1.00 0.00 C ATOM 118 CG LYS A 349 8.454 -15.135 10.199 1.00 0.00 C ATOM 119 CD LYS A 349 9.375 -14.193 9.408 1.00 0.00 C ATOM 120 CE LYS A 349 10.835 -14.630 9.583 1.00 0.00 C ATOM 121 NZ LYS A 349 11.769 -13.733 8.854 1.00 0.00 N ATOM 0 H LYS A 349 6.745 -14.323 12.400 1.00 0.00 H new ATOM 0 HA LYS A 349 7.185 -12.778 10.030 1.00 0.00 H new ATOM 0 HB2 LYS A 349 6.380 -15.632 10.515 1.00 0.00 H new ATOM 0 HB3 LYS A 349 6.716 -14.948 8.937 1.00 0.00 H new ATOM 0 HG2 LYS A 349 8.689 -15.049 11.260 1.00 0.00 H new ATOM 0 HG3 LYS A 349 8.667 -16.163 9.908 1.00 0.00 H new ATOM 0 HD2 LYS A 349 9.105 -14.207 8.352 1.00 0.00 H new ATOM 0 HD3 LYS A 349 9.248 -13.168 9.756 1.00 0.00 H new ATOM 0 HE2 LYS A 349 11.089 -14.635 10.643 1.00 0.00 H new ATOM 0 HE3 LYS A 349 10.955 -15.651 9.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 12.746 -14.060 8.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 11.543 -13.747 7.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 11.673 -12.763 9.216 1.00 0.00 H new ATOM 135 N ARG A 350 4.025 -13.638 10.700 1.00 0.00 N ATOM 136 CA ARG A 350 2.612 -13.254 10.454 1.00 0.00 C ATOM 137 C ARG A 350 2.362 -11.743 10.529 1.00 0.00 C ATOM 138 O ARG A 350 2.074 -11.132 9.499 1.00 0.00 O ATOM 139 CB ARG A 350 1.613 -14.048 11.330 1.00 0.00 C ATOM 140 CG ARG A 350 1.823 -15.570 11.443 1.00 0.00 C ATOM 141 CD ARG A 350 1.450 -16.399 10.202 1.00 0.00 C ATOM 142 NE ARG A 350 2.227 -16.073 8.988 1.00 0.00 N ATOM 143 CZ ARG A 350 3.459 -16.446 8.694 1.00 0.00 C ATOM 144 NH1 ARG A 350 4.216 -17.093 9.531 1.00 0.00 N ATOM 145 NH2 ARG A 350 3.963 -16.168 7.527 1.00 0.00 N ATOM 0 H ARG A 350 4.123 -14.380 11.393 1.00 0.00 H new ATOM 0 HA ARG A 350 2.422 -13.538 9.419 1.00 0.00 H new ATOM 0 HB2 ARG A 350 1.640 -13.629 12.336 1.00 0.00 H new ATOM 0 HB3 ARG A 350 0.610 -13.874 10.939 1.00 0.00 H new ATOM 0 HG2 ARG A 350 2.871 -15.755 11.677 1.00 0.00 H new ATOM 0 HG3 ARG A 350 1.239 -15.935 12.288 1.00 0.00 H new ATOM 0 HD2 ARG A 350 1.587 -17.456 10.432 1.00 0.00 H new ATOM 0 HD3 ARG A 350 0.391 -16.254 9.989 1.00 0.00 H new ATOM 0 HE ARG A 350 1.756 -15.491 8.295 1.00 0.00 H new ATOM 0 HH11 ARG A 350 3.863 -17.332 10.458 1.00 0.00 H new ATOM 0 HH12 ARG A 350 5.162 -17.361 9.261 1.00 0.00 H new ATOM 0 HH21 ARG A 350 3.406 -15.662 6.839 1.00 0.00 H new ATOM 0 HH22 ARG A 350 4.915 -16.456 7.301 1.00 0.00 H new ATOM 159 N LYS A 351 2.501 -11.133 11.711 1.00 0.00 N ATOM 160 CA LYS A 351 2.274 -9.684 11.922 1.00 0.00 C ATOM 161 C LYS A 351 3.168 -8.790 11.057 1.00 0.00 C ATOM 162 O LYS A 351 2.638 -7.932 10.346 1.00 0.00 O ATOM 163 CB LYS A 351 2.349 -9.278 13.405 1.00 0.00 C ATOM 164 CG LYS A 351 3.524 -9.928 14.134 1.00 0.00 C ATOM 165 CD LYS A 351 4.080 -9.112 15.307 1.00 0.00 C ATOM 166 CE LYS A 351 3.257 -9.235 16.598 1.00 0.00 C ATOM 167 NZ LYS A 351 3.217 -10.623 17.133 1.00 0.00 N ATOM 0 H LYS A 351 2.776 -11.627 12.560 1.00 0.00 H new ATOM 0 HA LYS A 351 1.250 -9.514 11.588 1.00 0.00 H new ATOM 0 HB2 LYS A 351 2.437 -8.194 13.477 1.00 0.00 H new ATOM 0 HB3 LYS A 351 1.419 -9.556 13.901 1.00 0.00 H new ATOM 0 HG2 LYS A 351 3.209 -10.904 14.504 1.00 0.00 H new ATOM 0 HG3 LYS A 351 4.327 -10.103 13.418 1.00 0.00 H new ATOM 0 HD2 LYS A 351 5.102 -9.433 15.508 1.00 0.00 H new ATOM 0 HD3 LYS A 351 4.127 -8.062 15.017 1.00 0.00 H new ATOM 0 HE2 LYS A 351 3.677 -8.572 17.354 1.00 0.00 H new ATOM 0 HE3 LYS A 351 2.239 -8.896 16.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 2.875 -10.607 18.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 2.575 -11.200 16.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 4.172 -11.033 17.106 1.00 0.00 H new ATOM 181 N LEU A 352 4.497 -8.975 11.056 1.00 0.00 N ATOM 182 CA LEU A 352 5.341 -8.164 10.184 1.00 0.00 C ATOM 183 C LEU A 352 5.125 -8.379 8.676 1.00 0.00 C ATOM 184 O LEU A 352 5.062 -7.381 7.959 1.00 0.00 O ATOM 185 CB LEU A 352 6.804 -8.041 10.642 1.00 0.00 C ATOM 186 CG LEU A 352 7.111 -8.089 12.154 1.00 0.00 C ATOM 187 CD1 LEU A 352 8.624 -8.085 12.373 1.00 0.00 C ATOM 188 CD2 LEU A 352 6.528 -6.860 12.855 1.00 0.00 C ATOM 0 H LEU A 352 4.992 -9.657 11.631 1.00 0.00 H new ATOM 0 HA LEU A 352 4.959 -7.153 10.324 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.369 -8.841 10.164 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.194 -7.100 10.255 1.00 0.00 H new ATOM 0 HG LEU A 352 6.667 -8.996 12.564 1.00 0.00 H new ATOM 0 HD11 LEU A 352 8.837 -8.119 13.441 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.064 -8.956 11.887 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.051 -7.177 11.947 1.00 0.00 H new ATOM 0 HD21 LEU A 352 6.753 -6.908 13.921 1.00 0.00 H new ATOM 0 HD22 LEU A 352 6.968 -5.957 12.432 1.00 0.00 H new ATOM 0 HD23 LEU A 352 5.448 -6.838 12.713 1.00 0.00 H new ATOM 200 N ILE A 353 4.940 -9.606 8.167 1.00 0.00 N ATOM 201 CA ILE A 353 4.687 -9.827 6.723 1.00 0.00 C ATOM 202 C ILE A 353 3.382 -9.159 6.283 1.00 0.00 C ATOM 203 O ILE A 353 3.354 -8.470 5.260 1.00 0.00 O ATOM 204 CB ILE A 353 4.777 -11.322 6.334 1.00 0.00 C ATOM 205 CG1 ILE A 353 5.513 -11.523 4.996 1.00 0.00 C ATOM 206 CG2 ILE A 353 3.443 -12.095 6.368 1.00 0.00 C ATOM 207 CD1 ILE A 353 5.900 -12.994 4.781 1.00 0.00 C ATOM 0 H ILE A 353 4.959 -10.460 8.724 1.00 0.00 H new ATOM 0 HA ILE A 353 5.486 -9.339 6.165 1.00 0.00 H new ATOM 0 HB ILE A 353 5.372 -11.769 7.130 1.00 0.00 H new ATOM 0 HG12 ILE A 353 4.877 -11.190 4.176 1.00 0.00 H new ATOM 0 HG13 ILE A 353 6.409 -10.903 4.976 1.00 0.00 H new ATOM 0 HG21 ILE A 353 3.616 -13.132 6.079 1.00 0.00 H new ATOM 0 HG22 ILE A 353 3.030 -12.063 7.376 1.00 0.00 H new ATOM 0 HG23 ILE A 353 2.739 -11.637 5.673 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.417 -13.098 3.827 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.557 -13.319 5.588 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.001 -13.610 4.775 1.00 0.00 H new ATOM 219 N GLN A 354 2.316 -9.293 7.082 1.00 0.00 N ATOM 220 CA GLN A 354 1.052 -8.611 6.766 1.00 0.00 C ATOM 221 C GLN A 354 1.194 -7.081 6.827 1.00 0.00 C ATOM 222 O GLN A 354 0.616 -6.388 5.989 1.00 0.00 O ATOM 223 CB GLN A 354 -0.136 -9.141 7.575 1.00 0.00 C ATOM 224 CG GLN A 354 -0.188 -8.769 9.059 1.00 0.00 C ATOM 225 CD GLN A 354 -1.443 -9.344 9.714 1.00 0.00 C ATOM 226 OE1 GLN A 354 -1.401 -10.319 10.454 1.00 0.00 O ATOM 227 NE2 GLN A 354 -2.603 -8.771 9.473 1.00 0.00 N ATOM 0 H GLN A 354 2.300 -9.854 7.934 1.00 0.00 H new ATOM 0 HA GLN A 354 0.819 -8.856 5.730 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -1.052 -8.785 7.104 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -0.140 -10.228 7.498 1.00 0.00 H new ATOM 0 HG2 GLN A 354 0.699 -9.148 9.566 1.00 0.00 H new ATOM 0 HG3 GLN A 354 -0.179 -7.685 9.168 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -2.653 -7.958 8.859 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -3.453 -9.140 9.901 1.00 0.00 H new ATOM 236 N GLN A 355 2.006 -6.547 7.752 1.00 0.00 N ATOM 237 CA GLN A 355 2.316 -5.112 7.789 1.00 0.00 C ATOM 238 C GLN A 355 3.005 -4.674 6.483 1.00 0.00 C ATOM 239 O GLN A 355 2.629 -3.636 5.932 1.00 0.00 O ATOM 240 CB GLN A 355 3.076 -4.768 9.069 1.00 0.00 C ATOM 241 CG GLN A 355 3.625 -3.331 9.164 1.00 0.00 C ATOM 242 CD GLN A 355 5.026 -3.157 8.571 1.00 0.00 C ATOM 243 OE1 GLN A 355 6.034 -3.466 9.191 1.00 0.00 O ATOM 244 NE2 GLN A 355 5.155 -2.653 7.361 1.00 0.00 N ATOM 0 H GLN A 355 2.460 -7.090 8.486 1.00 0.00 H new ATOM 0 HA GLN A 355 1.398 -4.527 7.833 1.00 0.00 H new ATOM 0 HB2 GLN A 355 2.414 -4.940 9.918 1.00 0.00 H new ATOM 0 HB3 GLN A 355 3.911 -5.462 9.170 1.00 0.00 H new ATOM 0 HG2 GLN A 355 2.939 -2.657 8.652 1.00 0.00 H new ATOM 0 HG3 GLN A 355 3.645 -3.030 10.211 1.00 0.00 H new ATOM 0 HE21 GLN A 355 4.327 -2.389 6.828 1.00 0.00 H new ATOM 0 HE22 GLN A 355 6.083 -2.527 6.957 1.00 0.00 H new ATOM 253 N GLN A 356 3.935 -5.469 5.922 1.00 0.00 N ATOM 254 CA GLN A 356 4.456 -5.176 4.582 1.00 0.00 C ATOM 255 C GLN A 356 3.392 -5.171 3.500 1.00 0.00 C ATOM 256 O GLN A 356 3.351 -4.228 2.730 1.00 0.00 O ATOM 257 CB GLN A 356 5.603 -6.069 4.123 1.00 0.00 C ATOM 258 CG GLN A 356 6.572 -6.646 5.155 1.00 0.00 C ATOM 259 CD GLN A 356 7.243 -5.546 5.980 1.00 0.00 C ATOM 260 OE1 GLN A 356 7.888 -4.643 5.467 1.00 0.00 O ATOM 261 NE2 GLN A 356 7.095 -5.567 7.284 1.00 0.00 N ATOM 0 H GLN A 356 4.330 -6.298 6.365 1.00 0.00 H new ATOM 0 HA GLN A 356 4.848 -4.167 4.712 1.00 0.00 H new ATOM 0 HB2 GLN A 356 5.166 -6.908 3.581 1.00 0.00 H new ATOM 0 HB3 GLN A 356 6.193 -5.499 3.405 1.00 0.00 H new ATOM 0 HG2 GLN A 356 6.035 -7.323 5.820 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.335 -7.236 4.647 1.00 0.00 H new ATOM 0 HE21 GLN A 356 6.559 -6.315 7.724 1.00 0.00 H new ATOM 0 HE22 GLN A 356 7.516 -4.835 7.857 1.00 0.00 H new ATOM 270 N LEU A 357 2.547 -6.197 3.438 1.00 0.00 N ATOM 271 CA LEU A 357 1.452 -6.295 2.459 1.00 0.00 C ATOM 272 C LEU A 357 0.579 -5.017 2.500 1.00 0.00 C ATOM 273 O LEU A 357 0.383 -4.349 1.486 1.00 0.00 O ATOM 274 CB LEU A 357 0.657 -7.591 2.729 1.00 0.00 C ATOM 275 CG LEU A 357 0.022 -8.191 1.463 1.00 0.00 C ATOM 276 CD1 LEU A 357 -0.772 -9.453 1.800 1.00 0.00 C ATOM 277 CD2 LEU A 357 -0.869 -7.207 0.728 1.00 0.00 C ATOM 0 H LEU A 357 2.598 -6.996 4.070 1.00 0.00 H new ATOM 0 HA LEU A 357 1.844 -6.357 1.444 1.00 0.00 H new ATOM 0 HB2 LEU A 357 1.321 -8.329 3.179 1.00 0.00 H new ATOM 0 HB3 LEU A 357 -0.127 -7.383 3.457 1.00 0.00 H new ATOM 0 HG LEU A 357 0.847 -8.444 0.798 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.212 -9.860 0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -0.107 -10.194 2.244 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.564 -9.207 2.507 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -1.289 -7.687 -0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.677 -6.887 1.385 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -0.282 -6.340 0.426 1.00 0.00 H new ATOM 289 N VAL A 358 0.121 -4.603 3.682 1.00 0.00 N ATOM 290 CA VAL A 358 -0.642 -3.352 3.860 1.00 0.00 C ATOM 291 C VAL A 358 0.165 -2.125 3.388 1.00 0.00 C ATOM 292 O VAL A 358 -0.376 -1.237 2.722 1.00 0.00 O ATOM 293 CB VAL A 358 -1.077 -3.233 5.337 1.00 0.00 C ATOM 294 CG1 VAL A 358 -1.658 -1.856 5.687 1.00 0.00 C ATOM 295 CG2 VAL A 358 -2.139 -4.297 5.672 1.00 0.00 C ATOM 0 H VAL A 358 0.265 -5.121 4.549 1.00 0.00 H new ATOM 0 HA VAL A 358 -1.535 -3.381 3.236 1.00 0.00 H new ATOM 0 HB VAL A 358 -0.172 -3.382 5.925 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -1.944 -1.838 6.739 1.00 0.00 H new ATOM 0 HG12 VAL A 358 -0.908 -1.087 5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -2.535 -1.663 5.069 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -2.435 -4.200 6.717 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -3.011 -4.155 5.033 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -1.724 -5.291 5.504 1.00 0.00 H new ATOM 305 N LEU A 359 1.473 -2.087 3.668 1.00 0.00 N ATOM 306 CA LEU A 359 2.375 -1.000 3.259 1.00 0.00 C ATOM 307 C LEU A 359 2.687 -1.022 1.750 1.00 0.00 C ATOM 308 O LEU A 359 2.931 0.023 1.162 1.00 0.00 O ATOM 309 CB LEU A 359 3.653 -1.055 4.119 1.00 0.00 C ATOM 310 CG LEU A 359 4.606 0.141 3.932 1.00 0.00 C ATOM 311 CD1 LEU A 359 3.966 1.471 4.331 1.00 0.00 C ATOM 312 CD2 LEU A 359 5.848 -0.054 4.800 1.00 0.00 C ATOM 0 H LEU A 359 1.944 -2.823 4.194 1.00 0.00 H new ATOM 0 HA LEU A 359 1.871 -0.049 3.431 1.00 0.00 H new ATOM 0 HB2 LEU A 359 3.366 -1.113 5.169 1.00 0.00 H new ATOM 0 HB3 LEU A 359 4.193 -1.973 3.885 1.00 0.00 H new ATOM 0 HG LEU A 359 4.856 0.179 2.872 1.00 0.00 H new ATOM 0 HD11 LEU A 359 4.682 2.279 4.179 1.00 0.00 H new ATOM 0 HD12 LEU A 359 3.083 1.648 3.717 1.00 0.00 H new ATOM 0 HD13 LEU A 359 3.677 1.435 5.381 1.00 0.00 H new ATOM 0 HD21 LEU A 359 6.521 0.793 4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 359 5.553 -0.122 5.847 1.00 0.00 H new ATOM 0 HD23 LEU A 359 6.357 -0.972 4.506 1.00 0.00 H new ATOM 324 N LEU A 360 2.641 -2.190 1.114 1.00 0.00 N ATOM 325 CA LEU A 360 2.817 -2.444 -0.320 1.00 0.00 C ATOM 326 C LEU A 360 1.631 -1.874 -1.093 1.00 0.00 C ATOM 327 O LEU A 360 1.793 -1.187 -2.102 1.00 0.00 O ATOM 328 CB LEU A 360 2.863 -3.975 -0.522 1.00 0.00 C ATOM 329 CG LEU A 360 4.200 -4.629 -0.923 1.00 0.00 C ATOM 330 CD1 LEU A 360 5.432 -3.972 -0.304 1.00 0.00 C ATOM 331 CD2 LEU A 360 4.195 -6.101 -0.493 1.00 0.00 C ATOM 0 H LEU A 360 2.466 -3.055 1.626 1.00 0.00 H new ATOM 0 HA LEU A 360 3.733 -1.975 -0.679 1.00 0.00 H new ATOM 0 HB2 LEU A 360 2.533 -4.441 0.406 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.128 -4.230 -1.286 1.00 0.00 H new ATOM 0 HG LEU A 360 4.273 -4.509 -2.004 1.00 0.00 H new ATOM 0 HD11 LEU A 360 6.329 -4.494 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 360 5.482 -2.928 -0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.365 -4.025 0.783 1.00 0.00 H new ATOM 0 HD21 LEU A 360 5.140 -6.566 -0.776 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.069 -6.164 0.588 1.00 0.00 H new ATOM 0 HD23 LEU A 360 3.373 -6.621 -0.985 1.00 0.00 H new ATOM 343 N LEU A 361 0.428 -2.140 -0.588 1.00 0.00 N ATOM 344 CA LEU A 361 -0.807 -1.607 -1.151 1.00 0.00 C ATOM 345 C LEU A 361 -0.821 -0.083 -0.985 1.00 0.00 C ATOM 346 O LEU A 361 -1.098 0.639 -1.950 1.00 0.00 O ATOM 347 CB LEU A 361 -1.987 -2.306 -0.469 1.00 0.00 C ATOM 348 CG LEU A 361 -2.007 -3.827 -0.740 1.00 0.00 C ATOM 349 CD1 LEU A 361 -3.157 -4.453 0.044 1.00 0.00 C ATOM 350 CD2 LEU A 361 -2.196 -4.177 -2.217 1.00 0.00 C ATOM 0 H LEU A 361 0.284 -2.735 0.228 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.884 -1.803 -2.220 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.937 -2.132 0.606 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.920 -1.865 -0.820 1.00 0.00 H new ATOM 0 HG LEU A 361 -1.037 -4.215 -0.430 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -3.181 -5.527 -0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -3.013 -4.270 1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -4.100 -4.009 -0.276 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -2.201 -5.260 -2.336 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -3.143 -3.769 -2.569 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -1.379 -3.751 -2.799 1.00 0.00 H new ATOM 362 N HIS A 362 -0.423 0.407 0.199 1.00 0.00 N ATOM 363 CA HIS A 362 -0.252 1.841 0.428 1.00 0.00 C ATOM 364 C HIS A 362 0.804 2.409 -0.534 1.00 0.00 C ATOM 365 O HIS A 362 0.581 3.462 -1.111 1.00 0.00 O ATOM 366 CB HIS A 362 0.108 2.142 1.891 1.00 0.00 C ATOM 367 CG HIS A 362 0.150 3.626 2.179 1.00 0.00 C ATOM 368 ND1 HIS A 362 1.122 4.509 1.787 1.00 0.00 N flip ATOM 369 CD2 HIS A 362 -0.811 4.360 2.840 1.00 0.00 C flip ATOM 370 CE1 HIS A 362 0.741 5.792 2.194 1.00 0.00 C flip ATOM 371 NE2 HIS A 362 -0.430 5.650 2.836 1.00 0.00 N flip ATOM 0 H HIS A 362 -0.214 -0.174 1.011 1.00 0.00 H new ATOM 0 HA HIS A 362 -1.204 2.333 0.227 1.00 0.00 H new ATOM 0 HB2 HIS A 362 -0.622 1.667 2.547 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.078 1.702 2.122 1.00 0.00 H new ATOM 0 HD2 HIS A 362 -1.714 3.967 3.284 1.00 0.00 H new ATOM 0 HE1 HIS A 362 1.280 6.712 2.026 1.00 0.00 H new ATOM 0 HE2 HIS A 362 -0.957 6.413 3.261 1.00 0.00 H new ATOM 379 N ALA A 363 1.930 1.724 -0.751 1.00 0.00 N ATOM 380 CA ALA A 363 2.977 2.151 -1.674 1.00 0.00 C ATOM 381 C ALA A 363 2.452 2.289 -3.111 1.00 0.00 C ATOM 382 O ALA A 363 2.717 3.307 -3.739 1.00 0.00 O ATOM 383 CB ALA A 363 4.169 1.194 -1.577 1.00 0.00 C ATOM 0 H ALA A 363 2.140 0.843 -0.281 1.00 0.00 H new ATOM 0 HA ALA A 363 3.315 3.146 -1.386 1.00 0.00 H new ATOM 0 HB1 ALA A 363 4.950 1.514 -2.267 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.559 1.201 -0.559 1.00 0.00 H new ATOM 0 HB3 ALA A 363 3.848 0.185 -1.836 1.00 0.00 H new ATOM 389 N HIS A 364 1.674 1.329 -3.627 1.00 0.00 N ATOM 390 CA HIS A 364 1.064 1.415 -4.958 1.00 0.00 C ATOM 391 C HIS A 364 0.178 2.671 -5.073 1.00 0.00 C ATOM 392 O HIS A 364 0.392 3.547 -5.923 1.00 0.00 O ATOM 393 CB HIS A 364 0.251 0.136 -5.219 1.00 0.00 C ATOM 394 CG HIS A 364 -0.214 0.010 -6.646 1.00 0.00 C ATOM 395 ND1 HIS A 364 -1.498 0.197 -7.109 1.00 0.00 N ATOM 396 CD2 HIS A 364 0.560 -0.315 -7.729 1.00 0.00 C ATOM 397 CE1 HIS A 364 -1.501 -0.009 -8.437 1.00 0.00 C ATOM 398 NE2 HIS A 364 -0.263 -0.325 -8.864 1.00 0.00 N ATOM 0 H HIS A 364 1.450 0.467 -3.130 1.00 0.00 H new ATOM 0 HA HIS A 364 1.846 1.501 -5.712 1.00 0.00 H new ATOM 0 HB2 HIS A 364 0.859 -0.732 -4.964 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.616 0.123 -4.559 1.00 0.00 H new ATOM 0 HD2 HIS A 364 1.619 -0.526 -7.711 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -2.372 0.068 -9.071 1.00 0.00 H new ATOM 0 HE2 HIS A 364 0.019 -0.531 -9.822 1.00 0.00 H new ATOM 406 N LYS A 365 -0.770 2.774 -4.129 1.00 0.00 N ATOM 407 CA LYS A 365 -1.685 3.912 -3.931 1.00 0.00 C ATOM 408 C LYS A 365 -0.959 5.255 -3.957 1.00 0.00 C ATOM 409 O LYS A 365 -1.267 6.145 -4.749 1.00 0.00 O ATOM 410 CB LYS A 365 -2.398 3.678 -2.575 1.00 0.00 C ATOM 411 CG LYS A 365 -2.832 4.924 -1.776 1.00 0.00 C ATOM 412 CD LYS A 365 -3.519 4.480 -0.475 1.00 0.00 C ATOM 413 CE LYS A 365 -4.343 5.638 0.099 1.00 0.00 C ATOM 414 NZ LYS A 365 -5.000 5.263 1.376 1.00 0.00 N ATOM 0 H LYS A 365 -0.928 2.030 -3.449 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.404 3.961 -4.749 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.285 3.072 -2.761 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -1.735 3.087 -1.943 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -1.965 5.545 -1.549 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -3.513 5.533 -2.371 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -4.164 3.623 -0.668 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -2.771 4.159 0.250 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -3.696 6.500 0.262 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -5.100 5.940 -0.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -5.548 6.071 1.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -5.637 4.456 1.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -4.276 4.999 2.074 1.00 0.00 H new ATOM 428 N CYS A 366 -0.018 5.384 -3.036 1.00 0.00 N ATOM 429 CA CYS A 366 0.710 6.589 -2.728 1.00 0.00 C ATOM 430 C CYS A 366 1.745 6.939 -3.802 1.00 0.00 C ATOM 431 O CYS A 366 1.975 8.115 -4.042 1.00 0.00 O ATOM 432 CB CYS A 366 1.214 6.392 -1.307 1.00 0.00 C ATOM 433 SG CYS A 366 1.852 7.896 -0.544 1.00 0.00 S ATOM 0 H CYS A 366 0.270 4.599 -2.452 1.00 0.00 H new ATOM 0 HA CYS A 366 0.097 7.490 -2.752 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.401 6.002 -0.694 1.00 0.00 H new ATOM 0 HB3 CYS A 366 2.000 5.637 -1.312 1.00 0.00 H new ATOM 0 HG CYS A 366 2.780 7.588 0.312 1.00 0.00 H new ATOM 438 N GLN A 367 2.314 5.962 -4.517 1.00 0.00 N ATOM 439 CA GLN A 367 3.196 6.221 -5.660 1.00 0.00 C ATOM 440 C GLN A 367 2.373 6.829 -6.803 1.00 0.00 C ATOM 441 O GLN A 367 2.774 7.852 -7.359 1.00 0.00 O ATOM 442 CB GLN A 367 3.906 4.928 -6.087 1.00 0.00 C ATOM 443 CG GLN A 367 4.938 5.128 -7.205 1.00 0.00 C ATOM 444 CD GLN A 367 5.775 3.863 -7.390 1.00 0.00 C ATOM 445 OE1 GLN A 367 5.384 2.912 -8.052 1.00 0.00 O ATOM 446 NE2 GLN A 367 6.957 3.798 -6.810 1.00 0.00 N ATOM 0 H GLN A 367 2.176 4.971 -4.320 1.00 0.00 H new ATOM 0 HA GLN A 367 3.971 6.935 -5.380 1.00 0.00 H new ATOM 0 HB2 GLN A 367 4.403 4.494 -5.220 1.00 0.00 H new ATOM 0 HB3 GLN A 367 3.159 4.207 -6.420 1.00 0.00 H new ATOM 0 HG2 GLN A 367 4.430 5.375 -8.137 1.00 0.00 H new ATOM 0 HG3 GLN A 367 5.587 5.969 -6.963 1.00 0.00 H new ATOM 0 HE21 GLN A 367 7.296 4.583 -6.255 1.00 0.00 H new ATOM 0 HE22 GLN A 367 7.532 2.962 -6.917 1.00 0.00 H new ATOM 455 N ARG A 368 1.192 6.266 -7.120 1.00 0.00 N ATOM 456 CA ARG A 368 0.296 6.848 -8.140 1.00 0.00 C ATOM 457 C ARG A 368 -0.169 8.250 -7.761 1.00 0.00 C ATOM 458 O ARG A 368 -0.164 9.148 -8.606 1.00 0.00 O ATOM 459 CB ARG A 368 -0.868 5.877 -8.424 1.00 0.00 C ATOM 460 CG ARG A 368 -1.773 6.319 -9.586 1.00 0.00 C ATOM 461 CD ARG A 368 -1.045 6.303 -10.940 1.00 0.00 C ATOM 462 NE ARG A 368 -1.847 6.935 -12.004 1.00 0.00 N ATOM 463 CZ ARG A 368 -1.876 8.219 -12.318 1.00 0.00 C ATOM 464 NH1 ARG A 368 -1.246 9.126 -11.623 1.00 0.00 N ATOM 465 NH2 ARG A 368 -2.551 8.622 -13.356 1.00 0.00 N ATOM 0 H ARG A 368 0.836 5.413 -6.688 1.00 0.00 H new ATOM 0 HA ARG A 368 0.853 6.976 -9.068 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -0.461 4.891 -8.647 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -1.473 5.775 -7.523 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -2.641 5.662 -9.636 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -2.146 7.324 -9.390 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -0.092 6.824 -10.846 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -0.819 5.274 -11.219 1.00 0.00 H new ATOM 0 HE ARG A 368 -2.442 6.317 -12.556 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -0.705 8.855 -10.802 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -1.295 10.106 -11.901 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -3.058 7.947 -13.928 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -2.573 9.613 -13.597 1.00 0.00 H new ATOM 479 N ARG A 369 -0.513 8.439 -6.489 1.00 0.00 N ATOM 480 CA ARG A 369 -0.931 9.715 -5.896 1.00 0.00 C ATOM 481 C ARG A 369 0.182 10.765 -5.942 1.00 0.00 C ATOM 482 O ARG A 369 -0.056 11.912 -6.308 1.00 0.00 O ATOM 483 CB ARG A 369 -1.357 9.389 -4.451 1.00 0.00 C ATOM 484 CG ARG A 369 -1.524 10.519 -3.419 1.00 0.00 C ATOM 485 CD ARG A 369 -0.893 10.090 -2.079 1.00 0.00 C ATOM 486 NE ARG A 369 -1.271 11.001 -0.979 1.00 0.00 N ATOM 487 CZ ARG A 369 -0.790 11.005 0.253 1.00 0.00 C ATOM 488 NH1 ARG A 369 0.115 10.160 0.655 1.00 0.00 N ATOM 489 NH2 ARG A 369 -1.218 11.875 1.121 1.00 0.00 N ATOM 0 H ARG A 369 -0.509 7.677 -5.811 1.00 0.00 H new ATOM 0 HA ARG A 369 -1.753 10.157 -6.459 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -2.308 8.859 -4.506 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -0.625 8.689 -4.048 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -1.048 11.430 -3.782 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -2.581 10.745 -3.279 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -1.210 9.076 -1.836 1.00 0.00 H new ATOM 0 HD3 ARG A 369 0.192 10.070 -2.178 1.00 0.00 H new ATOM 0 HE ARG A 369 -1.980 11.703 -1.193 1.00 0.00 H new ATOM 0 HH11 ARG A 369 0.481 9.459 0.010 1.00 0.00 H new ATOM 0 HH12 ARG A 369 0.458 10.199 1.615 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -1.927 12.557 0.852 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -0.844 11.875 2.070 1.00 0.00 H new ATOM 503 N GLU A 370 1.399 10.366 -5.591 1.00 0.00 N ATOM 504 CA GLU A 370 2.593 11.215 -5.592 1.00 0.00 C ATOM 505 C GLU A 370 2.911 11.703 -7.008 1.00 0.00 C ATOM 506 O GLU A 370 3.088 12.895 -7.254 1.00 0.00 O ATOM 507 CB GLU A 370 3.759 10.401 -5.024 1.00 0.00 C ATOM 508 CG GLU A 370 5.060 11.194 -4.907 1.00 0.00 C ATOM 509 CD GLU A 370 6.161 10.450 -4.120 1.00 0.00 C ATOM 510 OE1 GLU A 370 5.888 9.496 -3.349 1.00 0.00 O ATOM 511 OE2 GLU A 370 7.338 10.870 -4.215 1.00 0.00 O ATOM 0 H GLU A 370 1.592 9.412 -5.287 1.00 0.00 H new ATOM 0 HA GLU A 370 2.421 12.098 -4.976 1.00 0.00 H new ATOM 0 HB2 GLU A 370 3.483 10.025 -4.039 1.00 0.00 H new ATOM 0 HB3 GLU A 370 3.929 9.533 -5.660 1.00 0.00 H new ATOM 0 HG2 GLU A 370 5.429 11.422 -5.907 1.00 0.00 H new ATOM 0 HG3 GLU A 370 4.854 12.146 -4.418 1.00 0.00 H new ATOM 518 N GLN A 371 2.924 10.764 -7.955 1.00 0.00 N ATOM 519 CA GLN A 371 3.108 11.053 -9.383 1.00 0.00 C ATOM 520 C GLN A 371 1.978 11.951 -9.930 1.00 0.00 C ATOM 521 O GLN A 371 2.226 12.788 -10.803 1.00 0.00 O ATOM 522 CB GLN A 371 3.199 9.740 -10.180 1.00 0.00 C ATOM 523 CG GLN A 371 4.488 8.941 -9.911 1.00 0.00 C ATOM 524 CD GLN A 371 5.724 9.571 -10.552 1.00 0.00 C ATOM 525 OE1 GLN A 371 6.328 10.503 -10.034 1.00 0.00 O ATOM 526 NE2 GLN A 371 6.159 9.093 -11.701 1.00 0.00 N ATOM 0 H GLN A 371 2.806 9.771 -7.753 1.00 0.00 H new ATOM 0 HA GLN A 371 4.043 11.601 -9.500 1.00 0.00 H new ATOM 0 HB2 GLN A 371 2.338 9.117 -9.937 1.00 0.00 H new ATOM 0 HB3 GLN A 371 3.138 9.966 -11.244 1.00 0.00 H new ATOM 0 HG2 GLN A 371 4.643 8.863 -8.835 1.00 0.00 H new ATOM 0 HG3 GLN A 371 4.366 7.926 -10.290 1.00 0.00 H new ATOM 0 HE21 GLN A 371 5.670 8.318 -12.149 1.00 0.00 H new ATOM 0 HE22 GLN A 371 6.984 9.499 -12.142 1.00 0.00 H new ATOM 535 N ALA A 372 0.750 11.814 -9.412 1.00 0.00 N ATOM 536 CA ALA A 372 -0.397 12.646 -9.806 1.00 0.00 C ATOM 537 C ALA A 372 -0.324 14.097 -9.276 1.00 0.00 C ATOM 538 O ALA A 372 -0.900 15.001 -9.887 1.00 0.00 O ATOM 539 CB ALA A 372 -1.698 11.984 -9.331 1.00 0.00 C ATOM 0 H ALA A 372 0.522 11.118 -8.702 1.00 0.00 H new ATOM 0 HA ALA A 372 -0.373 12.715 -10.894 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -2.548 12.601 -9.623 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -1.792 10.998 -9.786 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -1.679 11.882 -8.246 1.00 0.00 H new ATOM 652 N LEU A 381 4.173 8.210 7.199 1.00 0.00 N ATOM 653 CA LEU A 381 5.084 7.162 7.682 1.00 0.00 C ATOM 654 C LEU A 381 6.344 7.067 6.786 1.00 0.00 C ATOM 655 O LEU A 381 6.209 6.766 5.600 1.00 0.00 O ATOM 656 CB LEU A 381 4.323 5.821 7.850 1.00 0.00 C ATOM 657 CG LEU A 381 3.803 5.051 6.611 1.00 0.00 C ATOM 658 CD1 LEU A 381 3.038 3.814 7.098 1.00 0.00 C ATOM 659 CD2 LEU A 381 2.847 5.836 5.711 1.00 0.00 C ATOM 0 HA LEU A 381 5.452 7.426 8.673 1.00 0.00 H new ATOM 0 HB2 LEU A 381 4.980 5.145 8.396 1.00 0.00 H new ATOM 0 HB3 LEU A 381 3.463 6.017 8.491 1.00 0.00 H new ATOM 0 HG LEU A 381 4.688 4.822 6.017 1.00 0.00 H new ATOM 0 HD11 LEU A 381 2.663 3.257 6.240 1.00 0.00 H new ATOM 0 HD12 LEU A 381 3.706 3.178 7.679 1.00 0.00 H new ATOM 0 HD13 LEU A 381 2.201 4.126 7.722 1.00 0.00 H new ATOM 0 HD21 LEU A 381 2.540 5.210 4.873 1.00 0.00 H new ATOM 0 HD22 LEU A 381 1.968 6.132 6.284 1.00 0.00 H new ATOM 0 HD23 LEU A 381 3.351 6.726 5.334 1.00 0.00 H new ATOM 671 N PRO A 382 7.570 7.326 7.296 1.00 0.00 N ATOM 672 CA PRO A 382 8.812 7.301 6.501 1.00 0.00 C ATOM 673 C PRO A 382 9.059 6.031 5.670 1.00 0.00 C ATOM 674 O PRO A 382 9.618 6.106 4.573 1.00 0.00 O ATOM 675 CB PRO A 382 9.951 7.506 7.506 1.00 0.00 C ATOM 676 CG PRO A 382 9.294 8.281 8.642 1.00 0.00 C ATOM 677 CD PRO A 382 7.872 7.722 8.666 1.00 0.00 C ATOM 0 HA PRO A 382 8.741 8.082 5.744 1.00 0.00 H new ATOM 0 HB2 PRO A 382 10.356 6.555 7.852 1.00 0.00 H new ATOM 0 HB3 PRO A 382 10.778 8.064 7.066 1.00 0.00 H new ATOM 0 HG2 PRO A 382 9.807 8.119 9.590 1.00 0.00 H new ATOM 0 HG3 PRO A 382 9.302 9.355 8.455 1.00 0.00 H new ATOM 0 HD2 PRO A 382 7.799 6.871 9.343 1.00 0.00 H new ATOM 0 HD3 PRO A 382 7.164 8.472 9.020 1.00 0.00 H new ATOM 685 N HIS A 383 8.642 4.863 6.174 1.00 0.00 N ATOM 686 CA HIS A 383 8.811 3.559 5.514 1.00 0.00 C ATOM 687 C HIS A 383 8.062 3.435 4.165 1.00 0.00 C ATOM 688 O HIS A 383 8.364 2.544 3.365 1.00 0.00 O ATOM 689 CB HIS A 383 8.404 2.453 6.506 1.00 0.00 C ATOM 690 CG HIS A 383 9.148 1.152 6.320 1.00 0.00 C ATOM 691 ND1 HIS A 383 9.310 0.451 5.146 1.00 0.00 N ATOM 692 CD2 HIS A 383 9.816 0.457 7.294 1.00 0.00 C ATOM 693 CE1 HIS A 383 10.057 -0.636 5.402 1.00 0.00 C ATOM 694 NE2 HIS A 383 10.393 -0.677 6.704 1.00 0.00 N ATOM 0 H HIS A 383 8.166 4.795 7.074 1.00 0.00 H new ATOM 0 HA HIS A 383 9.862 3.452 5.245 1.00 0.00 H new ATOM 0 HB2 HIS A 383 8.570 2.812 7.522 1.00 0.00 H new ATOM 0 HB3 HIS A 383 7.335 2.265 6.405 1.00 0.00 H new ATOM 0 HD1 HIS A 383 8.928 0.712 4.237 1.00 0.00 H new ATOM 0 HD2 HIS A 383 9.886 0.734 8.335 1.00 0.00 H new ATOM 0 HE1 HIS A 383 10.347 -1.372 4.667 1.00 0.00 H new ATOM 702 N CYS A 384 7.112 4.340 3.895 1.00 0.00 N ATOM 703 CA CYS A 384 6.326 4.427 2.667 1.00 0.00 C ATOM 704 C CYS A 384 7.224 4.502 1.414 1.00 0.00 C ATOM 705 O CYS A 384 7.102 3.676 0.508 1.00 0.00 O ATOM 706 CB CYS A 384 5.418 5.653 2.852 1.00 0.00 C ATOM 707 SG CYS A 384 4.228 5.860 1.513 1.00 0.00 S ATOM 0 H CYS A 384 6.862 5.067 4.565 1.00 0.00 H new ATOM 0 HA CYS A 384 5.725 3.534 2.497 1.00 0.00 H new ATOM 0 HB2 CYS A 384 4.881 5.561 3.796 1.00 0.00 H new ATOM 0 HB3 CYS A 384 6.036 6.548 2.923 1.00 0.00 H new ATOM 0 HG CYS A 384 3.189 5.112 1.737 1.00 0.00 H new ATOM 712 N ARG A 385 8.189 5.434 1.383 1.00 0.00 N ATOM 713 CA ARG A 385 9.166 5.586 0.282 1.00 0.00 C ATOM 714 C ARG A 385 10.048 4.346 0.088 1.00 0.00 C ATOM 715 O ARG A 385 10.343 3.972 -1.046 1.00 0.00 O ATOM 716 CB ARG A 385 10.015 6.856 0.491 1.00 0.00 C ATOM 717 CG ARG A 385 9.612 8.007 -0.447 1.00 0.00 C ATOM 718 CD ARG A 385 8.167 8.500 -0.264 1.00 0.00 C ATOM 719 NE ARG A 385 7.900 9.679 -1.114 1.00 0.00 N ATOM 720 CZ ARG A 385 8.221 10.933 -0.847 1.00 0.00 C ATOM 721 NH1 ARG A 385 8.726 11.318 0.291 1.00 0.00 N ATOM 722 NH2 ARG A 385 8.054 11.856 -1.739 1.00 0.00 N ATOM 0 H ARG A 385 8.318 6.116 2.131 1.00 0.00 H new ATOM 0 HA ARG A 385 8.596 5.693 -0.641 1.00 0.00 H new ATOM 0 HB2 ARG A 385 9.917 7.186 1.525 1.00 0.00 H new ATOM 0 HB3 ARG A 385 11.066 6.615 0.331 1.00 0.00 H new ATOM 0 HG2 ARG A 385 10.291 8.844 -0.287 1.00 0.00 H new ATOM 0 HG3 ARG A 385 9.744 7.682 -1.479 1.00 0.00 H new ATOM 0 HD2 ARG A 385 7.471 7.700 -0.516 1.00 0.00 H new ATOM 0 HD3 ARG A 385 7.995 8.754 0.782 1.00 0.00 H new ATOM 0 HE ARG A 385 7.419 9.507 -1.997 1.00 0.00 H new ATOM 0 HH11 ARG A 385 8.893 10.637 1.032 1.00 0.00 H new ATOM 0 HH12 ARG A 385 8.955 12.301 0.441 1.00 0.00 H new ATOM 0 HH21 ARG A 385 7.673 11.617 -2.654 1.00 0.00 H new ATOM 0 HH22 ARG A 385 8.304 12.822 -1.526 1.00 0.00 H new ATOM 736 N THR A 386 10.422 3.675 1.174 1.00 0.00 N ATOM 737 CA THR A 386 11.213 2.434 1.145 1.00 0.00 C ATOM 738 C THR A 386 10.414 1.326 0.464 1.00 0.00 C ATOM 739 O THR A 386 10.917 0.677 -0.451 1.00 0.00 O ATOM 740 CB THR A 386 11.631 2.004 2.563 1.00 0.00 C ATOM 741 OG1 THR A 386 12.246 3.090 3.226 1.00 0.00 O ATOM 742 CG2 THR A 386 12.630 0.847 2.551 1.00 0.00 C ATOM 0 H THR A 386 10.183 3.978 2.118 1.00 0.00 H new ATOM 0 HA THR A 386 12.123 2.621 0.575 1.00 0.00 H new ATOM 0 HB THR A 386 10.724 1.681 3.073 1.00 0.00 H new ATOM 0 HG1 THR A 386 12.510 2.815 4.129 1.00 0.00 H new ATOM 0 HG21 THR A 386 12.892 0.582 3.575 1.00 0.00 H new ATOM 0 HG22 THR A 386 12.182 -0.015 2.057 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.529 1.148 2.012 1.00 0.00 H new ATOM 750 N MET A 387 9.144 1.136 0.839 1.00 0.00 N ATOM 751 CA MET A 387 8.285 0.136 0.194 1.00 0.00 C ATOM 752 C MET A 387 7.912 0.519 -1.241 1.00 0.00 C ATOM 753 O MET A 387 7.842 -0.366 -2.087 1.00 0.00 O ATOM 754 CB MET A 387 7.063 -0.174 1.065 1.00 0.00 C ATOM 755 CG MET A 387 7.172 -1.611 1.601 1.00 0.00 C ATOM 756 SD MET A 387 8.703 -2.034 2.485 1.00 0.00 S ATOM 757 CE MET A 387 8.818 -3.812 2.114 1.00 0.00 C ATOM 0 H MET A 387 8.688 1.661 1.585 1.00 0.00 H new ATOM 0 HA MET A 387 8.861 -0.785 0.105 1.00 0.00 H new ATOM 0 HB2 MET A 387 7.004 0.532 1.893 1.00 0.00 H new ATOM 0 HB3 MET A 387 6.149 -0.059 0.483 1.00 0.00 H new ATOM 0 HG2 MET A 387 6.331 -1.790 2.271 1.00 0.00 H new ATOM 0 HG3 MET A 387 7.062 -2.297 0.761 1.00 0.00 H new ATOM 0 HE1 MET A 387 9.288 -4.329 2.951 1.00 0.00 H new ATOM 0 HE2 MET A 387 7.818 -4.216 1.953 1.00 0.00 H new ATOM 0 HE3 MET A 387 9.417 -3.958 1.215 1.00 0.00 H new ATOM 767 N LYS A 388 7.759 1.808 -1.575 1.00 0.00 N ATOM 768 CA LYS A 388 7.595 2.254 -2.968 1.00 0.00 C ATOM 769 C LYS A 388 8.831 1.891 -3.800 1.00 0.00 C ATOM 770 O LYS A 388 8.690 1.457 -4.946 1.00 0.00 O ATOM 771 CB LYS A 388 7.372 3.766 -2.965 1.00 0.00 C ATOM 772 CG LYS A 388 5.949 4.166 -2.550 1.00 0.00 C ATOM 773 CD LYS A 388 5.913 5.683 -2.381 1.00 0.00 C ATOM 774 CE LYS A 388 4.590 6.218 -1.825 1.00 0.00 C ATOM 775 NZ LYS A 388 4.650 7.691 -1.653 1.00 0.00 N ATOM 0 H LYS A 388 7.745 2.567 -0.894 1.00 0.00 H new ATOM 0 HA LYS A 388 6.738 1.754 -3.419 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.086 4.231 -2.285 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.577 4.159 -3.961 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.229 3.850 -3.305 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.671 3.673 -1.619 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.722 5.983 -1.716 1.00 0.00 H new ATOM 0 HD3 LYS A 388 6.104 6.150 -3.347 1.00 0.00 H new ATOM 0 HE2 LYS A 388 3.775 5.959 -2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 388 4.374 5.744 -0.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.718 8.044 -1.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 5.357 7.927 -0.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.917 8.135 -2.555 1.00 0.00 H new ATOM 789 N ASN A 389 10.032 2.004 -3.218 1.00 0.00 N ATOM 790 CA ASN A 389 11.274 1.597 -3.887 1.00 0.00 C ATOM 791 C ASN A 389 11.314 0.068 -4.082 1.00 0.00 C ATOM 792 O ASN A 389 11.652 -0.409 -5.163 1.00 0.00 O ATOM 793 CB ASN A 389 12.488 2.122 -3.101 1.00 0.00 C ATOM 794 CG ASN A 389 13.794 1.864 -3.838 1.00 0.00 C ATOM 795 OD1 ASN A 389 13.977 2.252 -4.983 1.00 0.00 O ATOM 796 ND2 ASN A 389 14.744 1.203 -3.216 1.00 0.00 N ATOM 0 H ASN A 389 10.170 2.377 -2.279 1.00 0.00 H new ATOM 0 HA ASN A 389 11.311 2.039 -4.883 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.374 3.192 -2.928 1.00 0.00 H new ATOM 0 HB3 ASN A 389 12.522 1.643 -2.123 1.00 0.00 H new ATOM 0 HD21 ASN A 389 15.628 1.016 -3.688 1.00 0.00 H new ATOM 0 HD22 ASN A 389 14.597 0.877 -2.261 1.00 0.00 H new ATOM 803 N VAL A 390 10.898 -0.703 -3.068 1.00 0.00 N ATOM 804 CA VAL A 390 10.764 -2.173 -3.134 1.00 0.00 C ATOM 805 C VAL A 390 9.749 -2.577 -4.204 1.00 0.00 C ATOM 806 O VAL A 390 9.977 -3.549 -4.916 1.00 0.00 O ATOM 807 CB VAL A 390 10.321 -2.734 -1.769 1.00 0.00 C ATOM 808 CG1 VAL A 390 9.837 -4.191 -1.820 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.455 -2.647 -0.742 1.00 0.00 C ATOM 0 H VAL A 390 10.639 -0.319 -2.159 1.00 0.00 H new ATOM 0 HA VAL A 390 11.738 -2.588 -3.395 1.00 0.00 H new ATOM 0 HB VAL A 390 9.478 -2.109 -1.474 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.543 -4.512 -0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 390 8.982 -4.267 -2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.642 -4.829 -2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 390 11.114 -3.050 0.212 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.310 -3.224 -1.095 1.00 0.00 H new ATOM 0 HG23 VAL A 390 11.749 -1.605 -0.612 1.00 0.00 H new ATOM 819 N LEU A 391 8.642 -1.844 -4.345 1.00 0.00 N ATOM 820 CA LEU A 391 7.610 -2.120 -5.345 1.00 0.00 C ATOM 821 C LEU A 391 8.181 -1.901 -6.755 1.00 0.00 C ATOM 822 O LEU A 391 8.150 -2.800 -7.593 1.00 0.00 O ATOM 823 CB LEU A 391 6.367 -1.257 -5.043 1.00 0.00 C ATOM 824 CG LEU A 391 5.041 -1.835 -5.570 1.00 0.00 C ATOM 825 CD1 LEU A 391 3.893 -0.941 -5.108 1.00 0.00 C ATOM 826 CD2 LEU A 391 4.962 -1.941 -7.093 1.00 0.00 C ATOM 0 H LEU A 391 8.436 -1.033 -3.761 1.00 0.00 H new ATOM 0 HA LEU A 391 7.293 -3.162 -5.300 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.287 -1.124 -3.964 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.514 -0.268 -5.476 1.00 0.00 H new ATOM 0 HG LEU A 391 4.976 -2.847 -5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 391 2.949 -1.342 -5.476 1.00 0.00 H new ATOM 0 HD12 LEU A 391 3.873 -0.908 -4.019 1.00 0.00 H new ATOM 0 HD13 LEU A 391 4.036 0.066 -5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 391 3.996 -2.357 -7.379 1.00 0.00 H new ATOM 0 HD22 LEU A 391 5.075 -0.950 -7.533 1.00 0.00 H new ATOM 0 HD23 LEU A 391 5.759 -2.591 -7.454 1.00 0.00 H new ATOM 838 N ASN A 392 8.796 -0.742 -7.000 1.00 0.00 N ATOM 839 CA ASN A 392 9.453 -0.445 -8.277 1.00 0.00 C ATOM 840 C ASN A 392 10.544 -1.490 -8.587 1.00 0.00 C ATOM 841 O ASN A 392 10.643 -1.971 -9.722 1.00 0.00 O ATOM 842 CB ASN A 392 9.997 0.991 -8.200 1.00 0.00 C ATOM 843 CG ASN A 392 10.609 1.456 -9.510 1.00 0.00 C ATOM 844 OD1 ASN A 392 11.757 1.173 -9.819 1.00 0.00 O ATOM 845 ND2 ASN A 392 9.867 2.174 -10.321 1.00 0.00 N ATOM 0 H ASN A 392 8.853 0.017 -6.321 1.00 0.00 H new ATOM 0 HA ASN A 392 8.747 -0.507 -9.105 1.00 0.00 H new ATOM 0 HB2 ASN A 392 9.189 1.667 -7.921 1.00 0.00 H new ATOM 0 HB3 ASN A 392 10.748 1.049 -7.412 1.00 0.00 H new ATOM 0 HD21 ASN A 392 10.249 2.496 -11.210 1.00 0.00 H new ATOM 0 HD22 ASN A 392 8.909 2.409 -10.062 1.00 0.00 H new ATOM 852 N HIS A 393 11.295 -1.927 -7.571 1.00 0.00 N ATOM 853 CA HIS A 393 12.253 -3.012 -7.737 1.00 0.00 C ATOM 854 C HIS A 393 11.517 -4.294 -8.122 1.00 0.00 C ATOM 855 O HIS A 393 11.902 -4.904 -9.108 1.00 0.00 O ATOM 856 CB HIS A 393 13.108 -3.233 -6.485 1.00 0.00 C ATOM 857 CG HIS A 393 14.046 -4.409 -6.654 1.00 0.00 C ATOM 858 ND1 HIS A 393 13.705 -5.727 -6.505 1.00 0.00 N flip ATOM 859 CD2 HIS A 393 15.325 -4.388 -7.167 1.00 0.00 C flip ATOM 860 CE1 HIS A 393 14.770 -6.521 -6.953 1.00 0.00 C flip ATOM 861 NE2 HIS A 393 15.733 -5.661 -7.330 1.00 0.00 N flip ATOM 0 H HIS A 393 11.254 -1.543 -6.627 1.00 0.00 H new ATOM 0 HA HIS A 393 12.938 -2.731 -8.537 1.00 0.00 H new ATOM 0 HB2 HIS A 393 13.686 -2.333 -6.274 1.00 0.00 H new ATOM 0 HB3 HIS A 393 12.459 -3.404 -5.626 1.00 0.00 H new ATOM 0 HD2 HIS A 393 15.900 -3.504 -7.398 1.00 0.00 H new ATOM 0 HE1 HIS A 393 14.809 -7.600 -6.988 1.00 0.00 H new ATOM 0 HE2 HIS A 393 16.647 -5.935 -7.690 1.00 0.00 H new ATOM 869 N MET A 394 10.447 -4.689 -7.416 1.00 0.00 N ATOM 870 CA MET A 394 9.675 -5.896 -7.752 1.00 0.00 C ATOM 871 C MET A 394 9.145 -5.858 -9.199 1.00 0.00 C ATOM 872 O MET A 394 8.965 -6.920 -9.799 1.00 0.00 O ATOM 873 CB MET A 394 8.563 -6.225 -6.722 1.00 0.00 C ATOM 874 CG MET A 394 7.177 -5.603 -6.982 1.00 0.00 C ATOM 875 SD MET A 394 5.786 -6.758 -6.881 1.00 0.00 S ATOM 876 CE MET A 394 5.790 -6.990 -5.092 1.00 0.00 C ATOM 0 H MET A 394 10.094 -4.186 -6.602 1.00 0.00 H new ATOM 0 HA MET A 394 10.379 -6.726 -7.691 1.00 0.00 H new ATOM 0 HB2 MET A 394 8.448 -7.308 -6.679 1.00 0.00 H new ATOM 0 HB3 MET A 394 8.903 -5.901 -5.738 1.00 0.00 H new ATOM 0 HG2 MET A 394 7.015 -4.800 -6.263 1.00 0.00 H new ATOM 0 HG3 MET A 394 7.180 -5.148 -7.972 1.00 0.00 H new ATOM 0 HE1 MET A 394 5.053 -7.747 -4.822 1.00 0.00 H new ATOM 0 HE2 MET A 394 6.779 -7.315 -4.769 1.00 0.00 H new ATOM 0 HE3 MET A 394 5.540 -6.049 -4.602 1.00 0.00 H new ATOM 886 N THR A 395 8.920 -4.659 -9.767 1.00 0.00 N ATOM 887 CA THR A 395 8.499 -4.516 -11.181 1.00 0.00 C ATOM 888 C THR A 395 9.677 -4.720 -12.144 1.00 0.00 C ATOM 889 O THR A 395 9.519 -5.388 -13.168 1.00 0.00 O ATOM 890 CB THR A 395 7.778 -3.192 -11.517 1.00 0.00 C ATOM 891 OG1 THR A 395 8.601 -2.049 -11.481 1.00 0.00 O ATOM 892 CG2 THR A 395 6.565 -2.919 -10.637 1.00 0.00 C ATOM 0 H THR A 395 9.022 -3.773 -9.272 1.00 0.00 H new ATOM 0 HA THR A 395 7.762 -5.307 -11.319 1.00 0.00 H new ATOM 0 HB THR A 395 7.459 -3.359 -12.546 1.00 0.00 H new ATOM 0 HG1 THR A 395 9.398 -2.237 -10.942 1.00 0.00 H new ATOM 0 HG21 THR A 395 6.109 -1.973 -10.929 1.00 0.00 H new ATOM 0 HG22 THR A 395 5.840 -3.724 -10.757 1.00 0.00 H new ATOM 0 HG23 THR A 395 6.877 -2.864 -9.594 1.00 0.00 H new ATOM 900 N HIS A 396 10.864 -4.188 -11.819 1.00 0.00 N ATOM 901 CA HIS A 396 12.085 -4.364 -12.627 1.00 0.00 C ATOM 902 C HIS A 396 12.804 -5.719 -12.414 1.00 0.00 C ATOM 903 O HIS A 396 13.654 -6.108 -13.223 1.00 0.00 O ATOM 904 CB HIS A 396 13.053 -3.205 -12.344 1.00 0.00 C ATOM 905 CG HIS A 396 12.556 -1.884 -12.873 1.00 0.00 C ATOM 906 ND1 HIS A 396 11.739 -0.999 -12.213 1.00 0.00 N ATOM 907 CD2 HIS A 396 12.794 -1.363 -14.118 1.00 0.00 C ATOM 908 CE1 HIS A 396 11.483 0.031 -13.035 1.00 0.00 C ATOM 909 NE2 HIS A 396 12.111 -0.141 -14.214 1.00 0.00 N ATOM 0 H HIS A 396 11.007 -3.620 -10.984 1.00 0.00 H new ATOM 0 HA HIS A 396 11.766 -4.363 -13.669 1.00 0.00 H new ATOM 0 HB2 HIS A 396 13.210 -3.124 -11.268 1.00 0.00 H new ATOM 0 HB3 HIS A 396 14.021 -3.429 -12.792 1.00 0.00 H new ATOM 0 HD1 HIS A 396 11.387 -1.106 -11.262 1.00 0.00 H new ATOM 0 HD2 HIS A 396 13.401 -1.814 -14.890 1.00 0.00 H new ATOM 0 HE1 HIS A 396 10.861 0.878 -12.786 1.00 0.00 H new ATOM 917 N CYS A 397 12.500 -6.413 -11.314 1.00 0.00 N ATOM 918 CA CYS A 397 13.089 -7.674 -10.878 1.00 0.00 C ATOM 919 C CYS A 397 12.984 -8.791 -11.933 1.00 0.00 C ATOM 920 O CYS A 397 12.008 -8.880 -12.686 1.00 0.00 O ATOM 921 CB CYS A 397 12.431 -8.049 -9.542 1.00 0.00 C ATOM 922 SG CYS A 397 13.355 -9.374 -8.737 1.00 0.00 S ATOM 0 H CYS A 397 11.787 -6.083 -10.663 1.00 0.00 H new ATOM 0 HA CYS A 397 14.163 -7.549 -10.742 1.00 0.00 H new ATOM 0 HB2 CYS A 397 12.392 -7.176 -8.891 1.00 0.00 H new ATOM 0 HB3 CYS A 397 11.402 -8.366 -9.712 1.00 0.00 H new ATOM 0 HG CYS A 397 13.188 -9.299 -7.450 1.00 0.00 H new ATOM 927 N GLN A 398 14.006 -9.652 -11.970 1.00 0.00 N ATOM 928 CA GLN A 398 14.149 -10.764 -12.922 1.00 0.00 C ATOM 929 C GLN A 398 14.268 -12.145 -12.248 1.00 0.00 C ATOM 930 O GLN A 398 14.650 -13.133 -12.882 1.00 0.00 O ATOM 931 CB GLN A 398 15.310 -10.442 -13.885 1.00 0.00 C ATOM 932 CG GLN A 398 15.001 -9.254 -14.819 1.00 0.00 C ATOM 933 CD GLN A 398 16.196 -8.317 -14.982 1.00 0.00 C ATOM 934 OE1 GLN A 398 17.233 -8.668 -15.533 1.00 0.00 O ATOM 935 NE2 GLN A 398 16.106 -7.090 -14.510 1.00 0.00 N ATOM 0 H GLN A 398 14.786 -9.594 -11.315 1.00 0.00 H new ATOM 0 HA GLN A 398 13.229 -10.850 -13.500 1.00 0.00 H new ATOM 0 HB2 GLN A 398 16.206 -10.219 -13.305 1.00 0.00 H new ATOM 0 HB3 GLN A 398 15.532 -11.323 -14.487 1.00 0.00 H new ATOM 0 HG2 GLN A 398 14.703 -9.632 -15.797 1.00 0.00 H new ATOM 0 HG3 GLN A 398 14.155 -8.694 -14.422 1.00 0.00 H new ATOM 0 HE21 GLN A 398 15.250 -6.783 -14.049 1.00 0.00 H new ATOM 0 HE22 GLN A 398 16.893 -6.448 -14.606 1.00 0.00 H new ATOM 944 N ALA A 399 13.879 -12.219 -10.975 1.00 0.00 N ATOM 945 CA ALA A 399 13.798 -13.451 -10.188 1.00 0.00 C ATOM 946 C ALA A 399 12.534 -13.506 -9.328 1.00 0.00 C ATOM 947 O ALA A 399 11.921 -14.567 -9.215 1.00 0.00 O ATOM 948 CB ALA A 399 15.012 -13.583 -9.264 1.00 0.00 C ATOM 0 H ALA A 399 13.602 -11.393 -10.444 1.00 0.00 H new ATOM 0 HA ALA A 399 13.773 -14.272 -10.905 1.00 0.00 H new ATOM 0 HB1 ALA A 399 14.932 -14.505 -8.688 1.00 0.00 H new ATOM 0 HB2 ALA A 399 15.923 -13.606 -9.862 1.00 0.00 H new ATOM 0 HB3 ALA A 399 15.046 -12.732 -8.584 1.00 0.00 H new ATOM 954 N PRO A 400 12.168 -12.375 -8.717 1.00 0.00 N ATOM 955 CA PRO A 400 11.039 -12.188 -7.796 1.00 0.00 C ATOM 956 C PRO A 400 11.064 -13.068 -6.534 1.00 0.00 C ATOM 957 O PRO A 400 11.255 -12.576 -5.425 1.00 0.00 O ATOM 961 N LYS A 401 10.896 -14.382 -6.711 1.00 0.00 N ATOM 962 CA LYS A 401 10.927 -15.424 -5.665 1.00 0.00 C ATOM 963 C LYS A 401 12.360 -15.804 -5.288 1.00 0.00 C ATOM 964 O LYS A 401 12.706 -15.897 -4.111 1.00 0.00 O ATOM 965 CB LYS A 401 10.129 -16.657 -6.126 1.00 0.00 C ATOM 966 CG LYS A 401 8.631 -16.340 -6.293 1.00 0.00 C ATOM 967 CD LYS A 401 7.786 -17.582 -6.616 1.00 0.00 C ATOM 968 CE LYS A 401 8.147 -18.191 -7.979 1.00 0.00 C ATOM 969 NZ LYS A 401 7.302 -19.374 -8.289 1.00 0.00 N ATOM 0 H LYS A 401 10.725 -14.775 -7.637 1.00 0.00 H new ATOM 0 HA LYS A 401 10.459 -15.019 -4.768 1.00 0.00 H new ATOM 0 HB2 LYS A 401 10.532 -17.017 -7.073 1.00 0.00 H new ATOM 0 HB3 LYS A 401 10.252 -17.461 -5.401 1.00 0.00 H new ATOM 0 HG2 LYS A 401 8.258 -15.882 -5.377 1.00 0.00 H new ATOM 0 HG3 LYS A 401 8.507 -15.606 -7.089 1.00 0.00 H new ATOM 0 HD2 LYS A 401 7.930 -18.330 -5.836 1.00 0.00 H new ATOM 0 HD3 LYS A 401 6.730 -17.313 -6.609 1.00 0.00 H new ATOM 0 HE2 LYS A 401 8.023 -17.440 -8.759 1.00 0.00 H new ATOM 0 HE3 LYS A 401 9.197 -18.482 -7.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 7.572 -19.760 -9.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 7.440 -20.100 -7.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 6.302 -19.090 -8.311 1.00 0.00 H new ATOM 983 N ALA A 402 13.194 -15.980 -6.313 1.00 0.00 N ATOM 984 CA ALA A 402 14.621 -16.290 -6.214 1.00 0.00 C ATOM 985 C ALA A 402 15.462 -15.042 -5.855 1.00 0.00 C ATOM 986 O ALA A 402 16.643 -15.168 -5.537 1.00 0.00 O ATOM 987 CB ALA A 402 15.083 -17.018 -7.485 1.00 0.00 C ATOM 0 H ALA A 402 12.879 -15.907 -7.280 1.00 0.00 H new ATOM 0 HA ALA A 402 14.785 -16.974 -5.381 1.00 0.00 H new ATOM 0 HB1 ALA A 402 16.146 -17.247 -7.407 1.00 0.00 H new ATOM 0 HB2 ALA A 402 14.520 -17.944 -7.599 1.00 0.00 H new ATOM 0 HB3 ALA A 402 14.912 -16.380 -8.352 1.00 0.00 H new ATOM 993 N CYS A 403 14.850 -13.845 -5.881 1.00 0.00 N ATOM 994 CA CYS A 403 15.406 -12.549 -5.505 1.00 0.00 C ATOM 995 C CYS A 403 15.372 -12.421 -3.984 1.00 0.00 C ATOM 996 O CYS A 403 14.742 -11.537 -3.404 1.00 0.00 O ATOM 997 CB CYS A 403 14.682 -11.370 -6.140 1.00 0.00 C ATOM 998 SG CYS A 403 15.737 -9.886 -6.030 1.00 0.00 S ATOM 0 H CYS A 403 13.882 -13.761 -6.190 1.00 0.00 H new ATOM 0 HA CYS A 403 16.429 -12.514 -5.879 1.00 0.00 H new ATOM 0 HB2 CYS A 403 14.450 -11.589 -7.182 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.733 -11.195 -5.633 1.00 0.00 H new ATOM 0 HG CYS A 403 15.817 -9.323 -7.199 1.00 0.00 H new ATOM 1003 N GLN A 404 16.006 -13.408 -3.373 1.00 0.00 N ATOM 1004 CA GLN A 404 16.254 -13.658 -1.951 1.00 0.00 C ATOM 1005 C GLN A 404 16.520 -12.415 -1.073 1.00 0.00 C ATOM 1006 O GLN A 404 16.522 -12.549 0.154 1.00 0.00 O ATOM 1007 CB GLN A 404 17.346 -14.735 -1.790 1.00 0.00 C ATOM 1008 CG GLN A 404 18.800 -14.261 -1.986 1.00 0.00 C ATOM 1009 CD GLN A 404 19.113 -13.773 -3.401 1.00 0.00 C ATOM 1010 OE1 GLN A 404 18.996 -12.599 -3.724 1.00 0.00 O ATOM 1011 NE2 GLN A 404 19.537 -14.644 -4.293 1.00 0.00 N ATOM 0 H GLN A 404 16.416 -14.155 -3.933 1.00 0.00 H new ATOM 0 HA GLN A 404 15.308 -14.026 -1.555 1.00 0.00 H new ATOM 0 HB2 GLN A 404 17.257 -15.167 -0.793 1.00 0.00 H new ATOM 0 HB3 GLN A 404 17.147 -15.535 -2.503 1.00 0.00 H new ATOM 0 HG2 GLN A 404 19.006 -13.455 -1.282 1.00 0.00 H new ATOM 0 HG3 GLN A 404 19.474 -15.081 -1.739 1.00 0.00 H new ATOM 0 HE21 GLN A 404 19.639 -15.626 -4.038 1.00 0.00 H new ATOM 0 HE22 GLN A 404 19.763 -14.336 -5.239 1.00 0.00 H new ATOM 1020 N VAL A 405 16.710 -11.222 -1.661 1.00 0.00 N ATOM 1021 CA VAL A 405 16.782 -9.941 -0.932 1.00 0.00 C ATOM 1022 C VAL A 405 15.524 -9.861 -0.060 1.00 0.00 C ATOM 1023 O VAL A 405 14.417 -9.930 -0.593 1.00 0.00 O ATOM 1024 CB VAL A 405 16.817 -8.743 -1.904 1.00 0.00 C ATOM 1025 CG1 VAL A 405 16.905 -7.410 -1.149 1.00 0.00 C ATOM 1026 CG2 VAL A 405 18.009 -8.821 -2.860 1.00 0.00 C ATOM 0 H VAL A 405 16.820 -11.117 -2.670 1.00 0.00 H new ATOM 0 HA VAL A 405 17.693 -9.898 -0.335 1.00 0.00 H new ATOM 0 HB VAL A 405 15.888 -8.790 -2.472 1.00 0.00 H new ATOM 0 HG11 VAL A 405 16.928 -6.588 -1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.037 -7.302 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 405 17.813 -7.392 -0.547 1.00 0.00 H new ATOM 0 HG21 VAL A 405 17.997 -7.959 -3.527 1.00 0.00 H new ATOM 0 HG22 VAL A 405 18.936 -8.823 -2.286 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.944 -9.736 -3.448 1.00 0.00 H new ATOM 1036 N ALA A 406 15.683 -9.787 1.266 1.00 0.00 N ATOM 1037 CA ALA A 406 14.593 -9.870 2.247 1.00 0.00 C ATOM 1038 C ALA A 406 13.270 -9.212 1.822 1.00 0.00 C ATOM 1039 O ALA A 406 12.247 -9.894 1.681 1.00 0.00 O ATOM 1040 CB ALA A 406 15.105 -9.341 3.594 1.00 0.00 C ATOM 0 H ALA A 406 16.598 -9.664 1.699 1.00 0.00 H new ATOM 0 HA ALA A 406 14.320 -10.922 2.332 1.00 0.00 H new ATOM 0 HB1 ALA A 406 14.306 -9.396 4.334 1.00 0.00 H new ATOM 0 HB2 ALA A 406 15.949 -9.946 3.925 1.00 0.00 H new ATOM 0 HB3 ALA A 406 15.424 -8.305 3.481 1.00 0.00 H new ATOM 1046 N HIS A 407 13.292 -7.897 1.591 1.00 0.00 N ATOM 1047 CA HIS A 407 12.094 -7.154 1.200 1.00 0.00 C ATOM 1048 C HIS A 407 11.550 -7.540 -0.183 1.00 0.00 C ATOM 1049 O HIS A 407 10.333 -7.580 -0.320 1.00 0.00 O ATOM 1050 CB HIS A 407 12.311 -5.636 1.290 1.00 0.00 C ATOM 1051 CG HIS A 407 12.922 -5.158 2.586 1.00 0.00 C ATOM 1052 ND1 HIS A 407 12.378 -5.282 3.846 1.00 0.00 N ATOM 1053 CD2 HIS A 407 14.119 -4.509 2.726 1.00 0.00 C ATOM 1054 CE1 HIS A 407 13.229 -4.725 4.725 1.00 0.00 C ATOM 1055 NE2 HIS A 407 14.311 -4.239 4.089 1.00 0.00 N ATOM 0 H HIS A 407 14.132 -7.323 1.669 1.00 0.00 H new ATOM 0 HA HIS A 407 11.331 -7.442 1.924 1.00 0.00 H new ATOM 0 HB2 HIS A 407 12.953 -5.326 0.466 1.00 0.00 H new ATOM 0 HB3 HIS A 407 11.352 -5.137 1.152 1.00 0.00 H new ATOM 0 HD2 HIS A 407 14.797 -4.250 1.926 1.00 0.00 H new ATOM 0 HE1 HIS A 407 13.067 -4.675 5.792 1.00 0.00 H new ATOM 0 HE2 HIS A 407 15.110 -3.769 4.513 1.00 0.00 H new ATOM 1063 N CYS A 408 12.383 -7.858 -1.189 1.00 0.00 N ATOM 1064 CA CYS A 408 11.893 -8.245 -2.519 1.00 0.00 C ATOM 1065 C CYS A 408 11.244 -9.641 -2.513 1.00 0.00 C ATOM 1066 O CYS A 408 10.076 -9.777 -2.897 1.00 0.00 O ATOM 1067 CB CYS A 408 13.043 -8.168 -3.530 1.00 0.00 C ATOM 1068 SG CYS A 408 12.396 -8.514 -5.195 1.00 0.00 S ATOM 0 H CYS A 408 13.399 -7.854 -1.104 1.00 0.00 H new ATOM 0 HA CYS A 408 11.111 -7.545 -2.814 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.502 -7.180 -3.503 1.00 0.00 H new ATOM 0 HB3 CYS A 408 13.820 -8.888 -3.271 1.00 0.00 H new ATOM 0 HG CYS A 408 12.580 -7.476 -5.956 1.00 0.00 H new ATOM 1073 N ALA A 409 11.967 -10.655 -2.020 1.00 0.00 N ATOM 1074 CA ALA A 409 11.460 -12.020 -1.893 1.00 0.00 C ATOM 1075 C ALA A 409 10.143 -12.021 -1.094 1.00 0.00 C ATOM 1076 O ALA A 409 9.139 -12.591 -1.540 1.00 0.00 O ATOM 1077 CB ALA A 409 12.528 -12.920 -1.257 1.00 0.00 C ATOM 0 H ALA A 409 12.928 -10.546 -1.696 1.00 0.00 H new ATOM 0 HA ALA A 409 11.241 -12.425 -2.881 1.00 0.00 H new ATOM 0 HB1 ALA A 409 12.141 -13.935 -1.166 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.419 -12.926 -1.884 1.00 0.00 H new ATOM 0 HB3 ALA A 409 12.783 -12.539 -0.268 1.00 0.00 H new ATOM 1083 N SER A 410 10.125 -11.316 0.050 1.00 0.00 N ATOM 1084 CA SER A 410 8.909 -11.187 0.858 1.00 0.00 C ATOM 1085 C SER A 410 7.812 -10.481 0.063 1.00 0.00 C ATOM 1086 O SER A 410 6.781 -11.098 -0.183 1.00 0.00 O ATOM 1087 CB SER A 410 9.156 -10.455 2.183 1.00 0.00 C ATOM 1088 OG SER A 410 10.084 -11.165 2.984 1.00 0.00 O ATOM 0 H SER A 410 10.937 -10.830 0.431 1.00 0.00 H new ATOM 0 HA SER A 410 8.585 -12.198 1.105 1.00 0.00 H new ATOM 0 HB2 SER A 410 9.533 -9.452 1.985 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.215 -10.342 2.722 1.00 0.00 H new ATOM 0 HG SER A 410 10.996 -10.908 2.734 1.00 0.00 H new ATOM 1094 N SER A 411 8.032 -9.238 -0.390 1.00 0.00 N ATOM 1095 CA SER A 411 7.072 -8.430 -1.162 1.00 0.00 C ATOM 1096 C SER A 411 6.373 -9.227 -2.266 1.00 0.00 C ATOM 1097 O SER A 411 5.146 -9.274 -2.312 1.00 0.00 O ATOM 1098 CB SER A 411 7.781 -7.201 -1.771 1.00 0.00 C ATOM 1099 OG SER A 411 6.887 -6.357 -2.452 1.00 0.00 O ATOM 0 H SER A 411 8.912 -8.750 -0.224 1.00 0.00 H new ATOM 0 HA SER A 411 6.300 -8.108 -0.464 1.00 0.00 H new ATOM 0 HB2 SER A 411 8.276 -6.640 -0.979 1.00 0.00 H new ATOM 0 HB3 SER A 411 8.558 -7.535 -2.459 1.00 0.00 H new ATOM 0 HG SER A 411 7.391 -5.682 -2.953 1.00 0.00 H new ATOM 1105 N ARG A 412 7.130 -9.925 -3.117 1.00 0.00 N ATOM 1106 CA ARG A 412 6.575 -10.769 -4.189 1.00 0.00 C ATOM 1107 C ARG A 412 5.791 -11.964 -3.647 1.00 0.00 C ATOM 1108 O ARG A 412 4.722 -12.238 -4.185 1.00 0.00 O ATOM 1109 CB ARG A 412 7.672 -11.208 -5.176 1.00 0.00 C ATOM 1110 CG ARG A 412 8.173 -10.021 -6.023 1.00 0.00 C ATOM 1111 CD ARG A 412 8.024 -10.202 -7.541 1.00 0.00 C ATOM 1112 NE ARG A 412 6.613 -10.250 -7.975 1.00 0.00 N ATOM 1113 CZ ARG A 412 6.071 -9.662 -9.029 1.00 0.00 C ATOM 1114 NH1 ARG A 412 6.706 -8.814 -9.789 1.00 0.00 N ATOM 1115 NH2 ARG A 412 4.840 -9.935 -9.356 1.00 0.00 N ATOM 0 H ARG A 412 8.149 -9.923 -3.085 1.00 0.00 H new ATOM 0 HA ARG A 412 5.859 -10.156 -4.737 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.507 -11.642 -4.625 1.00 0.00 H new ATOM 0 HB3 ARG A 412 7.283 -11.987 -5.832 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.630 -9.125 -5.723 1.00 0.00 H new ATOM 0 HG3 ARG A 412 9.224 -9.848 -5.794 1.00 0.00 H new ATOM 0 HD2 ARG A 412 8.529 -9.382 -8.052 1.00 0.00 H new ATOM 0 HD3 ARG A 412 8.524 -11.122 -7.844 1.00 0.00 H new ATOM 0 HE ARG A 412 5.982 -10.802 -7.394 1.00 0.00 H new ATOM 0 HH11 ARG A 412 7.675 -8.572 -9.584 1.00 0.00 H new ATOM 0 HH12 ARG A 412 6.234 -8.393 -10.589 1.00 0.00 H new ATOM 0 HH21 ARG A 412 4.300 -10.599 -8.801 1.00 0.00 H new ATOM 0 HH22 ARG A 412 4.416 -9.485 -10.167 1.00 0.00 H new ATOM 1129 N GLN A 413 6.253 -12.644 -2.593 1.00 0.00 N ATOM 1130 CA GLN A 413 5.498 -13.770 -2.002 1.00 0.00 C ATOM 1131 C GLN A 413 4.123 -13.346 -1.435 1.00 0.00 C ATOM 1132 O GLN A 413 3.097 -13.944 -1.774 1.00 0.00 O ATOM 1133 CB GLN A 413 6.340 -14.478 -0.925 1.00 0.00 C ATOM 1134 CG GLN A 413 7.463 -15.355 -1.511 1.00 0.00 C ATOM 1135 CD GLN A 413 6.990 -16.653 -2.170 1.00 0.00 C ATOM 1136 OE1 GLN A 413 5.813 -16.985 -2.242 1.00 0.00 O ATOM 1137 NE2 GLN A 413 7.903 -17.455 -2.679 1.00 0.00 N ATOM 0 H GLN A 413 7.139 -12.442 -2.129 1.00 0.00 H new ATOM 0 HA GLN A 413 5.293 -14.470 -2.812 1.00 0.00 H new ATOM 0 HB2 GLN A 413 6.779 -13.729 -0.266 1.00 0.00 H new ATOM 0 HB3 GLN A 413 5.686 -15.098 -0.312 1.00 0.00 H new ATOM 0 HG2 GLN A 413 8.014 -14.770 -2.248 1.00 0.00 H new ATOM 0 HG3 GLN A 413 8.163 -15.604 -0.714 1.00 0.00 H new ATOM 0 HE21 GLN A 413 8.889 -17.200 -2.631 1.00 0.00 H new ATOM 0 HE22 GLN A 413 7.623 -18.331 -3.121 1.00 0.00 H new ATOM 1146 N ILE A 414 4.060 -12.281 -0.626 1.00 0.00 N ATOM 1147 CA ILE A 414 2.789 -11.743 -0.096 1.00 0.00 C ATOM 1148 C ILE A 414 1.852 -11.164 -1.144 1.00 0.00 C ATOM 1149 O ILE A 414 0.653 -11.437 -1.114 1.00 0.00 O ATOM 1150 CB ILE A 414 2.972 -10.733 1.052 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.270 -9.937 0.987 1.00 0.00 C ATOM 1152 CG2 ILE A 414 2.673 -11.379 2.413 1.00 0.00 C ATOM 1153 CD1 ILE A 414 4.365 -8.752 1.935 1.00 0.00 C ATOM 0 H ILE A 414 4.884 -11.765 -0.318 1.00 0.00 H new ATOM 0 HA ILE A 414 2.309 -12.635 0.305 1.00 0.00 H new ATOM 0 HB ILE A 414 2.219 -9.957 0.915 1.00 0.00 H new ATOM 0 HG12 ILE A 414 5.100 -10.613 1.195 1.00 0.00 H new ATOM 0 HG13 ILE A 414 4.402 -9.575 -0.033 1.00 0.00 H new ATOM 0 HG21 ILE A 414 2.811 -10.642 3.204 1.00 0.00 H new ATOM 0 HG22 ILE A 414 1.644 -11.738 2.427 1.00 0.00 H new ATOM 0 HG23 ILE A 414 3.352 -12.216 2.575 1.00 0.00 H new ATOM 0 HD11 ILE A 414 5.328 -8.258 1.805 1.00 0.00 H new ATOM 0 HD12 ILE A 414 3.563 -8.047 1.717 1.00 0.00 H new ATOM 0 HD13 ILE A 414 4.272 -9.101 2.964 1.00 0.00 H new ATOM 1165 N ILE A 415 2.375 -10.390 -2.088 1.00 0.00 N ATOM 1166 CA ILE A 415 1.542 -9.862 -3.172 1.00 0.00 C ATOM 1167 C ILE A 415 1.089 -11.004 -4.093 1.00 0.00 C ATOM 1168 O ILE A 415 -0.006 -10.936 -4.642 1.00 0.00 O ATOM 1169 CB ILE A 415 2.255 -8.681 -3.847 1.00 0.00 C ATOM 1170 CG1 ILE A 415 1.841 -7.381 -3.116 1.00 0.00 C ATOM 1171 CG2 ILE A 415 2.034 -8.625 -5.364 1.00 0.00 C ATOM 1172 CD1 ILE A 415 2.318 -6.083 -3.780 1.00 0.00 C ATOM 0 H ILE A 415 3.356 -10.115 -2.129 1.00 0.00 H new ATOM 0 HA ILE A 415 0.611 -9.439 -2.794 1.00 0.00 H new ATOM 0 HB ILE A 415 3.333 -8.813 -3.752 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.754 -7.355 -3.041 1.00 0.00 H new ATOM 0 HG13 ILE A 415 2.230 -7.415 -2.098 1.00 0.00 H new ATOM 0 HG21 ILE A 415 2.565 -7.768 -5.778 1.00 0.00 H new ATOM 0 HG22 ILE A 415 2.411 -9.540 -5.821 1.00 0.00 H new ATOM 0 HG23 ILE A 415 0.969 -8.528 -5.573 1.00 0.00 H new ATOM 0 HD11 ILE A 415 1.979 -5.229 -3.194 1.00 0.00 H new ATOM 0 HD12 ILE A 415 3.407 -6.079 -3.830 1.00 0.00 H new ATOM 0 HD13 ILE A 415 1.908 -6.018 -4.788 1.00 0.00 H new ATOM 1184 N SER A 416 1.860 -12.091 -4.209 1.00 0.00 N ATOM 1185 CA SER A 416 1.442 -13.277 -4.974 1.00 0.00 C ATOM 1186 C SER A 416 0.258 -13.939 -4.254 1.00 0.00 C ATOM 1187 O SER A 416 -0.739 -14.271 -4.903 1.00 0.00 O ATOM 1188 CB SER A 416 2.579 -14.296 -5.118 1.00 0.00 C ATOM 1189 OG SER A 416 3.327 -14.022 -6.289 1.00 0.00 O ATOM 0 H SER A 416 2.782 -12.176 -3.781 1.00 0.00 H new ATOM 0 HA SER A 416 1.157 -12.953 -5.975 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.228 -14.255 -4.243 1.00 0.00 H new ATOM 0 HB3 SER A 416 2.170 -15.305 -5.165 1.00 0.00 H new ATOM 0 HG SER A 416 4.001 -13.337 -6.094 1.00 0.00 H new ATOM 1195 N HIS A 417 0.318 -14.066 -2.916 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.823 -14.540 -2.121 1.00 0.00 C ATOM 1197 C HIS A 417 -2.035 -13.632 -2.387 1.00 0.00 C ATOM 1198 O HIS A 417 -3.090 -14.123 -2.773 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.497 -14.598 -0.610 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.746 -14.707 0.247 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -2.483 -15.851 0.461 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.514 -13.654 0.684 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.680 -15.495 0.961 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.756 -14.159 1.086 1.00 0.00 N ATOM 0 H HIS A 417 1.147 -13.846 -2.364 1.00 0.00 H new ATOM 0 HA HIS A 417 -1.055 -15.560 -2.427 1.00 0.00 H new ATOM 0 HB2 HIS A 417 0.151 -15.452 -0.413 1.00 0.00 H new ATOM 0 HB3 HIS A 417 0.058 -13.704 -0.326 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -2.212 -12.618 0.712 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -4.468 -16.185 1.225 1.00 0.00 H new ATOM 0 HE2 HIS A 417 -4.559 -13.620 1.410 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.880 -12.311 -2.234 1.00 0.00 N ATOM 1213 CA TRP A 418 -2.941 -11.321 -2.462 1.00 0.00 C ATOM 1214 C TRP A 418 -3.558 -11.408 -3.871 1.00 0.00 C ATOM 1215 O TRP A 418 -4.779 -11.296 -4.014 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.376 -9.927 -2.173 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.336 -8.790 -2.313 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -4.282 -8.435 -1.414 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -3.458 -7.842 -3.419 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -4.983 -7.342 -1.887 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -4.520 -6.936 -3.121 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -2.776 -7.657 -4.642 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -4.893 -5.903 -3.995 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -3.138 -6.621 -5.525 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -4.194 -5.746 -5.205 1.00 0.00 C ATOM 0 H TRP A 418 -0.997 -11.892 -1.943 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.765 -11.535 -1.781 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -1.981 -9.920 -1.157 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -1.535 -9.751 -2.844 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -4.462 -8.930 -0.471 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -5.748 -6.891 -1.385 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -1.965 -8.320 -4.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -5.705 -5.238 -3.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -2.602 -6.497 -6.454 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -4.467 -4.955 -5.888 1.00 0.00 H new ATOM 1236 N LYS A 419 -2.741 -11.652 -4.909 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.206 -11.832 -6.299 1.00 0.00 C ATOM 1238 C LYS A 419 -4.037 -13.110 -6.473 1.00 0.00 C ATOM 1239 O LYS A 419 -5.053 -13.088 -7.169 1.00 0.00 O ATOM 1240 CB LYS A 419 -1.999 -11.868 -7.254 1.00 0.00 C ATOM 1241 CG LYS A 419 -1.417 -10.473 -7.528 1.00 0.00 C ATOM 1242 CD LYS A 419 -0.054 -10.591 -8.232 1.00 0.00 C ATOM 1243 CE LYS A 419 0.589 -9.228 -8.512 1.00 0.00 C ATOM 1244 NZ LYS A 419 -0.157 -8.437 -9.529 1.00 0.00 N ATOM 0 H LYS A 419 -1.729 -11.731 -4.808 1.00 0.00 H new ATOM 0 HA LYS A 419 -3.849 -10.985 -6.538 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.223 -12.504 -6.828 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.301 -12.323 -8.197 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -2.106 -9.900 -8.148 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -1.304 -9.928 -6.591 1.00 0.00 H new ATOM 0 HD2 LYS A 419 0.619 -11.185 -7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -0.181 -11.128 -9.172 1.00 0.00 H new ATOM 0 HE2 LYS A 419 0.643 -8.659 -7.584 1.00 0.00 H new ATOM 0 HE3 LYS A 419 1.613 -9.378 -8.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 0.321 -7.526 -9.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -0.187 -8.964 -10.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -1.127 -8.268 -9.194 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.605 -14.222 -5.870 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.283 -15.522 -5.977 1.00 0.00 C ATOM 1260 C ASN A 420 -5.515 -15.695 -5.058 1.00 0.00 C ATOM 1261 O ASN A 420 -6.476 -16.367 -5.441 1.00 0.00 O ATOM 1262 CB ASN A 420 -3.253 -16.637 -5.714 1.00 0.00 C ATOM 1263 CG ASN A 420 -2.334 -16.859 -6.905 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -2.616 -17.650 -7.796 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -1.218 -16.171 -6.976 1.00 0.00 N ATOM 0 H ASN A 420 -2.768 -14.247 -5.288 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.685 -15.581 -6.988 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.656 -16.380 -4.839 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.775 -17.565 -5.482 1.00 0.00 H new ATOM 0 HD21 ASN A 420 -0.591 -16.297 -7.771 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -0.978 -15.511 -6.237 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.477 -15.137 -3.849 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.496 -15.263 -2.814 1.00 0.00 C ATOM 1274 C CYS A 421 -7.825 -14.548 -3.127 1.00 0.00 C ATOM 1275 O CYS A 421 -7.863 -13.407 -3.601 1.00 0.00 O ATOM 1276 CB CYS A 421 -5.893 -14.748 -1.502 1.00 0.00 C ATOM 1277 SG CYS A 421 -6.938 -15.155 -0.069 1.00 0.00 S ATOM 0 H CYS A 421 -4.693 -14.555 -3.552 1.00 0.00 H new ATOM 0 HA CYS A 421 -6.769 -16.316 -2.746 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -4.902 -15.181 -1.363 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -5.763 -13.667 -1.562 1.00 0.00 H new ATOM 0 HG CYS A 421 -6.456 -16.199 0.537 1.00 0.00 H new ATOM 1282 N THR A 422 -8.920 -15.240 -2.815 1.00 0.00 N ATOM 1283 CA THR A 422 -10.321 -14.799 -2.952 1.00 0.00 C ATOM 1284 C THR A 422 -11.133 -15.034 -1.665 1.00 0.00 C ATOM 1285 O THR A 422 -12.351 -14.825 -1.646 1.00 0.00 O ATOM 1286 CB THR A 422 -10.997 -15.531 -4.127 1.00 0.00 C ATOM 1287 OG1 THR A 422 -11.064 -16.921 -3.863 1.00 0.00 O ATOM 1288 CG2 THR A 422 -10.220 -15.359 -5.431 1.00 0.00 C ATOM 0 H THR A 422 -8.856 -16.184 -2.435 1.00 0.00 H new ATOM 0 HA THR A 422 -10.302 -13.726 -3.144 1.00 0.00 H new ATOM 0 HB THR A 422 -11.991 -15.096 -4.232 1.00 0.00 H new ATOM 0 HG1 THR A 422 -11.497 -17.376 -4.615 1.00 0.00 H new ATOM 0 HG21 THR A 422 -10.732 -15.891 -6.233 1.00 0.00 H new ATOM 0 HG22 THR A 422 -10.158 -14.300 -5.681 1.00 0.00 H new ATOM 0 HG23 THR A 422 -9.215 -15.763 -5.312 1.00 0.00 H new ATOM 1296 N ARG A 423 -10.475 -15.479 -0.581 1.00 0.00 N ATOM 1297 CA ARG A 423 -11.086 -15.817 0.716 1.00 0.00 C ATOM 1298 C ARG A 423 -11.814 -14.647 1.380 1.00 0.00 C ATOM 1299 O ARG A 423 -11.302 -13.532 1.478 1.00 0.00 O ATOM 1300 CB ARG A 423 -10.020 -16.369 1.679 1.00 0.00 C ATOM 1301 CG ARG A 423 -9.450 -17.722 1.234 1.00 0.00 C ATOM 1302 CD ARG A 423 -8.458 -18.253 2.278 1.00 0.00 C ATOM 1303 NE ARG A 423 -7.931 -19.581 1.900 1.00 0.00 N ATOM 1304 CZ ARG A 423 -8.500 -20.757 2.104 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -9.645 -20.884 2.717 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -7.922 -21.848 1.686 1.00 0.00 N ATOM 0 H ARG A 423 -9.465 -15.618 -0.584 1.00 0.00 H new ATOM 0 HA ARG A 423 -11.839 -16.575 0.502 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -9.206 -15.648 1.763 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -10.456 -16.474 2.672 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -10.260 -18.438 1.096 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -8.952 -17.615 0.271 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -7.632 -17.550 2.387 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -8.950 -18.319 3.248 1.00 0.00 H new ATOM 0 HE ARG A 423 -7.026 -19.592 1.429 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -10.135 -20.057 3.059 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -10.050 -21.810 2.854 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -7.027 -21.797 1.199 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -8.365 -22.753 1.846 1.00 0.00 H new ATOM 1320 N HIS A 424 -13.004 -14.947 1.892 1.00 0.00 N ATOM 1321 CA HIS A 424 -13.878 -14.052 2.640 1.00 0.00 C ATOM 1322 C HIS A 424 -13.443 -13.798 4.101 1.00 0.00 C ATOM 1323 O HIS A 424 -14.043 -12.958 4.770 1.00 0.00 O ATOM 1324 CB HIS A 424 -15.329 -14.560 2.543 1.00 0.00 C ATOM 1325 CG HIS A 424 -15.573 -16.033 2.802 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -14.900 -16.883 3.658 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -16.553 -16.780 2.201 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -15.459 -18.101 3.571 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -16.474 -18.091 2.690 1.00 0.00 N ATOM 0 H HIS A 424 -13.407 -15.878 1.789 1.00 0.00 H new ATOM 0 HA HIS A 424 -13.801 -13.069 2.175 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -15.933 -13.990 3.249 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -15.701 -14.328 1.545 1.00 0.00 H new ATOM 0 HD1 HIS A 424 -14.113 -16.629 4.255 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -17.265 -16.419 1.474 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -15.138 -18.967 4.131 1.00 0.00 H new ATOM 1337 N ASP A 425 -12.457 -14.543 4.623 1.00 0.00 N ATOM 1338 CA ASP A 425 -12.007 -14.505 6.024 1.00 0.00 C ATOM 1339 C ASP A 425 -10.505 -14.828 6.215 1.00 0.00 C ATOM 1340 O ASP A 425 -10.131 -15.633 7.073 1.00 0.00 O ATOM 1341 CB ASP A 425 -12.932 -15.385 6.892 1.00 0.00 C ATOM 1342 CG ASP A 425 -12.818 -16.900 6.622 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -12.762 -17.308 5.436 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -12.849 -17.692 7.594 1.00 0.00 O ATOM 0 H ASP A 425 -11.932 -15.213 4.061 1.00 0.00 H new ATOM 0 HA ASP A 425 -12.091 -13.473 6.365 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -12.708 -15.199 7.942 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -13.964 -15.077 6.727 1.00 0.00 H new ATOM 1349 N CYS A 426 -9.626 -14.200 5.421 1.00 0.00 N ATOM 1350 CA CYS A 426 -8.168 -14.417 5.496 1.00 0.00 C ATOM 1351 C CYS A 426 -7.574 -13.489 6.599 1.00 0.00 C ATOM 1352 O CYS A 426 -8.149 -12.426 6.846 1.00 0.00 O ATOM 1353 CB CYS A 426 -7.634 -14.126 4.090 1.00 0.00 C ATOM 1354 SG CYS A 426 -6.151 -15.082 3.649 1.00 0.00 S ATOM 0 H CYS A 426 -9.903 -13.526 4.707 1.00 0.00 H new ATOM 0 HA CYS A 426 -7.887 -15.431 5.780 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -8.419 -14.337 3.364 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -7.405 -13.063 4.012 1.00 0.00 H new ATOM 0 HG CYS A 426 -6.131 -15.285 2.365 1.00 0.00 H new ATOM 1359 N PRO A 427 -6.446 -13.802 7.272 1.00 0.00 N ATOM 1360 CA PRO A 427 -5.904 -12.977 8.363 1.00 0.00 C ATOM 1361 C PRO A 427 -5.333 -11.615 7.926 1.00 0.00 C ATOM 1362 O PRO A 427 -4.876 -10.843 8.771 1.00 0.00 O ATOM 1363 CB PRO A 427 -4.867 -13.862 9.066 1.00 0.00 C ATOM 1364 CG PRO A 427 -4.386 -14.801 7.965 1.00 0.00 C ATOM 1365 CD PRO A 427 -5.602 -14.962 7.054 1.00 0.00 C ATOM 0 HA PRO A 427 -6.708 -12.677 9.035 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -4.047 -13.271 9.474 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -5.308 -14.412 9.897 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -3.537 -14.381 7.426 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -4.063 -15.759 8.372 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -5.297 -15.027 6.010 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -6.140 -15.881 7.287 1.00 0.00 H new ATOM 1373 N VAL A 428 -5.369 -11.309 6.624 1.00 0.00 N ATOM 1374 CA VAL A 428 -4.894 -10.054 6.015 1.00 0.00 C ATOM 1375 C VAL A 428 -5.955 -9.466 5.071 1.00 0.00 C ATOM 1376 O VAL A 428 -6.281 -8.275 5.163 1.00 0.00 O ATOM 1377 CB VAL A 428 -3.564 -10.282 5.278 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -2.960 -8.915 4.928 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -2.562 -11.084 6.114 1.00 0.00 C ATOM 0 H VAL A 428 -5.746 -11.956 5.932 1.00 0.00 H new ATOM 0 HA VAL A 428 -4.721 -9.331 6.812 1.00 0.00 H new ATOM 0 HB VAL A 428 -3.770 -10.863 4.379 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -2.015 -9.058 4.404 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.650 -8.365 4.288 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -2.785 -8.349 5.843 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -1.640 -11.217 5.548 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -2.346 -10.547 7.038 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -2.986 -12.060 6.352 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.562 -10.314 4.232 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.694 -9.942 3.391 1.00 0.00 C ATOM 1391 C CYS A 429 -8.899 -9.438 4.194 1.00 0.00 C ATOM 1392 O CYS A 429 -9.383 -8.361 3.868 1.00 0.00 O ATOM 1393 CB CYS A 429 -8.043 -11.024 2.354 1.00 0.00 C ATOM 1394 SG CYS A 429 -6.569 -11.974 1.834 1.00 0.00 S ATOM 0 H CYS A 429 -6.274 -11.286 4.121 1.00 0.00 H new ATOM 0 HA CYS A 429 -7.370 -9.080 2.807 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.783 -11.705 2.775 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.500 -10.556 1.482 1.00 0.00 H new ATOM 0 HG CYS A 429 -6.944 -13.040 1.191 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.370 -10.125 5.249 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.476 -9.618 6.067 1.00 0.00 C ATOM 1401 C LEU A 430 -10.202 -8.205 6.630 1.00 0.00 C ATOM 1402 O LEU A 430 -11.004 -7.305 6.363 1.00 0.00 O ATOM 1403 CB LEU A 430 -10.904 -10.628 7.131 1.00 0.00 C ATOM 1404 CG LEU A 430 -12.389 -10.978 7.075 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -12.759 -11.837 8.290 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -13.367 -9.810 7.020 1.00 0.00 C ATOM 0 H LEU A 430 -9.002 -11.027 5.551 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.334 -9.496 5.405 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -10.319 -11.540 7.011 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -10.670 -10.226 8.117 1.00 0.00 H new ATOM 0 HG LEU A 430 -12.497 -11.500 6.124 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -13.819 -12.087 8.250 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -12.170 -12.754 8.280 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -12.551 -11.282 9.205 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -14.387 -10.191 6.983 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -13.243 -9.190 7.908 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -13.171 -9.213 6.130 1.00 0.00 H new ATOM 1418 N PRO A 431 -9.071 -7.958 7.332 1.00 0.00 N ATOM 1419 CA PRO A 431 -8.663 -6.610 7.724 1.00 0.00 C ATOM 1420 C PRO A 431 -8.782 -5.581 6.595 1.00 0.00 C ATOM 1421 O PRO A 431 -9.450 -4.565 6.766 1.00 0.00 O ATOM 1422 CB PRO A 431 -7.196 -6.742 8.127 1.00 0.00 C ATOM 1423 CG PRO A 431 -7.118 -8.149 8.698 1.00 0.00 C ATOM 1424 CD PRO A 431 -8.078 -8.925 7.794 1.00 0.00 C ATOM 0 HA PRO A 431 -9.312 -6.248 8.521 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -6.531 -6.617 7.273 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -6.912 -5.992 8.865 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -6.105 -8.550 8.654 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -7.428 -8.181 9.742 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -7.547 -9.370 6.953 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -8.553 -9.741 8.339 1.00 0.00 H new ATOM 1432 N LEU A 432 -8.161 -5.836 5.436 1.00 0.00 N ATOM 1433 CA LEU A 432 -8.191 -4.917 4.282 1.00 0.00 C ATOM 1434 C LEU A 432 -9.581 -4.760 3.652 1.00 0.00 C ATOM 1435 O LEU A 432 -9.890 -3.715 3.077 1.00 0.00 O ATOM 1436 CB LEU A 432 -7.212 -5.425 3.217 1.00 0.00 C ATOM 1437 CG LEU A 432 -5.825 -4.806 3.467 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -4.733 -5.735 2.941 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -5.689 -3.437 2.796 1.00 0.00 C ATOM 0 H LEU A 432 -7.622 -6.685 5.268 1.00 0.00 H new ATOM 0 HA LEU A 432 -7.906 -3.933 4.655 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -7.150 -6.513 3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -7.568 -5.159 2.222 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.714 -4.674 4.543 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -3.756 -5.288 3.123 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.794 -6.695 3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -4.869 -5.887 1.870 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -4.697 -3.031 2.995 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -5.829 -3.544 1.720 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.444 -2.760 3.195 1.00 0.00 H new