USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=21 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= -0.856 X(o=-2.2,f=-2.7) USER MOD Set 1.2: A 421 CYS SG : rot 100:sc= 0.564 USER MOD Set 1.3: A 426 CYS SG : rot 148:sc= -0.765 USER MOD Set 1.4: A 429 CYS SG : rot 164:sc= -1.16! USER MOD Set 2.1: A 416 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 420 ASN : amide:sc= 0.931 K(o=0.93,f=0) USER MOD Set 3.1: A 393 HIS : no HD1:sc= -0.984 X(o=-0.46,f=-0.13) USER MOD Set 3.2: A 397 CYS SG : rot 160:sc= 0.233 USER MOD Set 3.3: A 403 CYS SG : rot -121:sc= 0.16 USER MOD Set 3.4: A 408 CYS SG : rot -6:sc= 0.132 USER MOD Set 4.1: A 362 HIS :FLIP no HD1:sc= -0.259 F(o=0.93,f=2.4) USER MOD Set 4.2: A 366 CYS SG : rot -154:sc= 0.416 USER MOD Set 4.3: A 367 GLN : amide:sc= 0.25 K(o=2.4,f=-4.6) USER MOD Set 4.4: A 384 CYS SG : rot -3:sc= 0.724 USER MOD Set 4.5: A 388 LYS NZ :NH3+ 171:sc= 1.26 (180deg=0.744) USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 351 LYS NZ :NH3+ 172:sc= 1.12 (180deg=0.941) USER MOD Single : A 354 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 355 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 356 GLN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 364 HIS : no HE2:sc= 0.696 K(o=0.7,f=-3.6!) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 371 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 383 HIS : no HD1:sc= -0.027 X(o=-0.027,f=-0.027) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 MET CE :methyl 166:sc= -0.391 (180deg=-1.01) USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 394 MET CE :methyl 176:sc= -0.501 (180deg=-0.536) USER MOD Single : A 395 THR OG1 : rot -35:sc= 1.26 USER MOD Single : A 396 HIS : no HD1:sc= -0.958 X(o=-0.96,f=-1.3) USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 407 HIS : no HD1:sc= -0.394 X(o=-0.39,f=-0.029) USER MOD Single : A 410 SER OG : rot 86:sc= 0.57 USER MOD Single : A 411 SER OG : rot 91:sc= 0.644 USER MOD Single : A 413 GLN : amide:sc= 0.495 X(o=0.49,f=0) USER MOD Single : A 419 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0156) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 HIS : no HD1:sc=-0.00323 X(o=-0.0032,f=-0.0032) USER MOD ----------------------------------------------------------------- ATOM 84 N PRO A 347 4.493 -16.415 15.083 1.00 0.00 N ATOM 85 CA PRO A 347 3.647 -15.218 15.088 1.00 0.00 C ATOM 86 C PRO A 347 4.347 -13.925 14.660 1.00 0.00 C ATOM 87 O PRO A 347 3.682 -13.029 14.152 1.00 0.00 O ATOM 88 CB PRO A 347 3.108 -15.099 16.520 1.00 0.00 C ATOM 89 CG PRO A 347 3.239 -16.511 17.087 1.00 0.00 C ATOM 90 CD PRO A 347 4.494 -17.036 16.395 1.00 0.00 C ATOM 0 HA PRO A 347 2.862 -15.339 14.341 1.00 0.00 H new ATOM 0 HB2 PRO A 347 3.683 -14.380 17.104 1.00 0.00 H new ATOM 0 HB3 PRO A 347 2.072 -14.761 16.529 1.00 0.00 H new ATOM 0 HG2 PRO A 347 3.348 -16.503 18.172 1.00 0.00 H new ATOM 0 HG3 PRO A 347 2.365 -17.122 16.859 1.00 0.00 H new ATOM 0 HD2 PRO A 347 5.392 -16.773 16.955 1.00 0.00 H new ATOM 0 HD3 PRO A 347 4.475 -18.123 16.316 1.00 0.00 H new ATOM 98 N GLU A 348 5.671 -13.810 14.800 1.00 0.00 N ATOM 99 CA GLU A 348 6.428 -12.624 14.367 1.00 0.00 C ATOM 100 C GLU A 348 6.358 -12.471 12.843 1.00 0.00 C ATOM 101 O GLU A 348 6.204 -11.368 12.319 1.00 0.00 O ATOM 102 CB GLU A 348 7.901 -12.696 14.806 1.00 0.00 C ATOM 103 CG GLU A 348 8.123 -13.008 16.295 1.00 0.00 C ATOM 104 CD GLU A 348 7.375 -12.039 17.228 1.00 0.00 C ATOM 105 OE1 GLU A 348 7.476 -10.801 17.050 1.00 0.00 O ATOM 106 OE2 GLU A 348 6.654 -12.499 18.143 1.00 0.00 O ATOM 0 H GLU A 348 6.253 -14.537 15.217 1.00 0.00 H new ATOM 0 HA GLU A 348 5.970 -11.757 14.844 1.00 0.00 H new ATOM 0 HB2 GLU A 348 8.404 -13.459 14.212 1.00 0.00 H new ATOM 0 HB3 GLU A 348 8.380 -11.745 14.575 1.00 0.00 H new ATOM 0 HG2 GLU A 348 7.796 -14.027 16.500 1.00 0.00 H new ATOM 0 HG3 GLU A 348 9.190 -12.965 16.515 1.00 0.00 H new ATOM 113 N LYS A 349 6.379 -13.599 12.126 1.00 0.00 N ATOM 114 CA LYS A 349 6.221 -13.633 10.675 1.00 0.00 C ATOM 115 C LYS A 349 4.824 -13.148 10.322 1.00 0.00 C ATOM 116 O LYS A 349 4.717 -12.274 9.481 1.00 0.00 O ATOM 117 CB LYS A 349 6.529 -15.031 10.117 1.00 0.00 C ATOM 118 CG LYS A 349 8.044 -15.296 10.130 1.00 0.00 C ATOM 119 CD LYS A 349 8.425 -16.670 9.560 1.00 0.00 C ATOM 120 CE LYS A 349 8.156 -16.761 8.051 1.00 0.00 C ATOM 121 NZ LYS A 349 8.558 -18.084 7.504 1.00 0.00 N ATOM 0 H LYS A 349 6.508 -14.521 12.544 1.00 0.00 H new ATOM 0 HA LYS A 349 6.941 -12.963 10.205 1.00 0.00 H new ATOM 0 HB2 LYS A 349 6.017 -15.787 10.712 1.00 0.00 H new ATOM 0 HB3 LYS A 349 6.148 -15.114 9.099 1.00 0.00 H new ATOM 0 HG2 LYS A 349 8.547 -14.519 9.554 1.00 0.00 H new ATOM 0 HG3 LYS A 349 8.410 -15.221 11.154 1.00 0.00 H new ATOM 0 HD2 LYS A 349 9.480 -16.862 9.752 1.00 0.00 H new ATOM 0 HD3 LYS A 349 7.860 -17.446 10.076 1.00 0.00 H new ATOM 0 HE2 LYS A 349 7.096 -16.594 7.859 1.00 0.00 H new ATOM 0 HE3 LYS A 349 8.702 -15.972 7.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 8.363 -18.111 6.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 9.575 -18.232 7.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 8.018 -18.835 7.980 1.00 0.00 H new ATOM 135 N ARG A 350 3.765 -13.619 10.992 1.00 0.00 N ATOM 136 CA ARG A 350 2.378 -13.151 10.766 1.00 0.00 C ATOM 137 C ARG A 350 2.279 -11.622 10.739 1.00 0.00 C ATOM 138 O ARG A 350 1.947 -11.062 9.691 1.00 0.00 O ATOM 139 CB ARG A 350 1.396 -13.806 11.763 1.00 0.00 C ATOM 140 CG ARG A 350 1.391 -15.348 11.776 1.00 0.00 C ATOM 141 CD ARG A 350 1.325 -16.011 10.396 1.00 0.00 C ATOM 142 NE ARG A 350 0.129 -15.591 9.636 1.00 0.00 N ATOM 143 CZ ARG A 350 -0.030 -15.605 8.324 1.00 0.00 C ATOM 144 NH1 ARG A 350 0.902 -16.012 7.511 1.00 0.00 N ATOM 145 NH2 ARG A 350 -1.150 -15.200 7.799 1.00 0.00 N ATOM 0 H ARG A 350 3.839 -14.339 11.711 1.00 0.00 H new ATOM 0 HA ARG A 350 2.077 -13.480 9.771 1.00 0.00 H new ATOM 0 HB2 ARG A 350 1.635 -13.453 12.766 1.00 0.00 H new ATOM 0 HB3 ARG A 350 0.388 -13.459 11.534 1.00 0.00 H new ATOM 0 HG2 ARG A 350 2.290 -15.694 12.285 1.00 0.00 H new ATOM 0 HG3 ARG A 350 0.540 -15.688 12.366 1.00 0.00 H new ATOM 0 HD2 ARG A 350 2.221 -15.759 9.830 1.00 0.00 H new ATOM 0 HD3 ARG A 350 1.317 -17.095 10.514 1.00 0.00 H new ATOM 0 HE ARG A 350 -0.661 -15.253 10.185 1.00 0.00 H new ATOM 0 HH11 ARG A 350 1.796 -16.336 7.881 1.00 0.00 H new ATOM 0 HH12 ARG A 350 0.739 -16.007 6.504 1.00 0.00 H new ATOM 0 HH21 ARG A 350 -1.906 -14.872 8.400 1.00 0.00 H new ATOM 0 HH22 ARG A 350 -1.272 -15.211 6.786 1.00 0.00 H new ATOM 159 N LYS A 351 2.633 -10.957 11.844 1.00 0.00 N ATOM 160 CA LYS A 351 2.623 -9.480 11.975 1.00 0.00 C ATOM 161 C LYS A 351 3.522 -8.768 10.962 1.00 0.00 C ATOM 162 O LYS A 351 3.019 -7.929 10.210 1.00 0.00 O ATOM 163 CB LYS A 351 2.928 -8.980 13.404 1.00 0.00 C ATOM 164 CG LYS A 351 3.538 -10.023 14.342 1.00 0.00 C ATOM 165 CD LYS A 351 4.137 -9.397 15.604 1.00 0.00 C ATOM 166 CE LYS A 351 4.091 -10.398 16.765 1.00 0.00 C ATOM 167 NZ LYS A 351 4.951 -9.967 17.894 1.00 0.00 N ATOM 0 H LYS A 351 2.942 -11.431 12.693 1.00 0.00 H new ATOM 0 HA LYS A 351 1.592 -9.210 11.747 1.00 0.00 H new ATOM 0 HB2 LYS A 351 3.609 -8.132 13.337 1.00 0.00 H new ATOM 0 HB3 LYS A 351 2.003 -8.612 13.848 1.00 0.00 H new ATOM 0 HG2 LYS A 351 2.771 -10.744 14.627 1.00 0.00 H new ATOM 0 HG3 LYS A 351 4.313 -10.575 13.811 1.00 0.00 H new ATOM 0 HD2 LYS A 351 5.167 -9.095 15.415 1.00 0.00 H new ATOM 0 HD3 LYS A 351 3.584 -8.496 15.869 1.00 0.00 H new ATOM 0 HE2 LYS A 351 3.063 -10.507 17.111 1.00 0.00 H new ATOM 0 HE3 LYS A 351 4.415 -11.378 16.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 4.792 -10.592 18.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 5.950 -10.017 17.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 4.715 -8.989 18.156 1.00 0.00 H new ATOM 181 N LEU A 352 4.825 -9.072 10.899 1.00 0.00 N ATOM 182 CA LEU A 352 5.686 -8.401 9.925 1.00 0.00 C ATOM 183 C LEU A 352 5.364 -8.683 8.448 1.00 0.00 C ATOM 184 O LEU A 352 5.405 -7.744 7.654 1.00 0.00 O ATOM 185 CB LEU A 352 7.182 -8.415 10.284 1.00 0.00 C ATOM 186 CG LEU A 352 7.582 -8.421 11.774 1.00 0.00 C ATOM 187 CD1 LEU A 352 9.077 -8.704 11.918 1.00 0.00 C ATOM 188 CD2 LEU A 352 7.291 -7.056 12.401 1.00 0.00 C ATOM 0 H LEU A 352 5.292 -9.757 11.493 1.00 0.00 H new ATOM 0 HA LEU A 352 5.405 -7.352 10.024 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.626 -9.295 9.818 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.642 -7.542 9.821 1.00 0.00 H new ATOM 0 HG LEU A 352 7.005 -9.197 12.278 1.00 0.00 H new ATOM 0 HD11 LEU A 352 9.347 -8.706 12.974 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.307 -9.677 11.483 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.645 -7.932 11.399 1.00 0.00 H new ATOM 0 HD21 LEU A 352 7.577 -7.070 13.453 1.00 0.00 H new ATOM 0 HD22 LEU A 352 7.862 -6.287 11.880 1.00 0.00 H new ATOM 0 HD23 LEU A 352 6.227 -6.837 12.317 1.00 0.00 H new ATOM 200 N ILE A 353 4.992 -9.907 8.058 1.00 0.00 N ATOM 201 CA ILE A 353 4.632 -10.229 6.660 1.00 0.00 C ATOM 202 C ILE A 353 3.363 -9.470 6.233 1.00 0.00 C ATOM 203 O ILE A 353 3.349 -8.810 5.183 1.00 0.00 O ATOM 204 CB ILE A 353 4.590 -11.766 6.437 1.00 0.00 C ATOM 205 CG1 ILE A 353 5.296 -12.181 5.134 1.00 0.00 C ATOM 206 CG2 ILE A 353 3.196 -12.413 6.543 1.00 0.00 C ATOM 207 CD1 ILE A 353 5.720 -13.657 5.127 1.00 0.00 C ATOM 0 H ILE A 353 4.930 -10.703 8.693 1.00 0.00 H new ATOM 0 HA ILE A 353 5.412 -9.872 5.988 1.00 0.00 H new ATOM 0 HB ILE A 353 5.149 -12.166 7.283 1.00 0.00 H new ATOM 0 HG12 ILE A 353 4.630 -11.996 4.291 1.00 0.00 H new ATOM 0 HG13 ILE A 353 6.176 -11.555 4.988 1.00 0.00 H new ATOM 0 HG21 ILE A 353 3.279 -13.486 6.371 1.00 0.00 H new ATOM 0 HG22 ILE A 353 2.787 -12.235 7.538 1.00 0.00 H new ATOM 0 HG23 ILE A 353 2.534 -11.976 5.795 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.212 -13.890 4.183 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.410 -13.841 5.951 1.00 0.00 H new ATOM 0 HD13 ILE A 353 4.840 -14.289 5.243 1.00 0.00 H new ATOM 219 N GLN A 354 2.323 -9.481 7.086 1.00 0.00 N ATOM 220 CA GLN A 354 1.114 -8.696 6.794 1.00 0.00 C ATOM 221 C GLN A 354 1.431 -7.194 6.724 1.00 0.00 C ATOM 222 O GLN A 354 0.889 -6.497 5.867 1.00 0.00 O ATOM 223 CB GLN A 354 -0.066 -9.017 7.728 1.00 0.00 C ATOM 224 CG GLN A 354 0.015 -8.479 9.162 1.00 0.00 C ATOM 225 CD GLN A 354 -1.272 -8.750 9.938 1.00 0.00 C ATOM 226 OE1 GLN A 354 -1.403 -9.729 10.661 1.00 0.00 O ATOM 227 NE2 GLN A 354 -2.272 -7.900 9.827 1.00 0.00 N ATOM 0 H GLN A 354 2.295 -10.009 7.958 1.00 0.00 H new ATOM 0 HA GLN A 354 0.774 -9.002 5.805 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -0.976 -8.627 7.271 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -0.173 -10.101 7.778 1.00 0.00 H new ATOM 0 HG2 GLN A 354 0.856 -8.942 9.678 1.00 0.00 H new ATOM 0 HG3 GLN A 354 0.207 -7.406 9.138 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -2.180 -7.079 9.229 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -3.139 -8.063 10.339 1.00 0.00 H new ATOM 236 N GLN A 355 2.348 -6.699 7.569 1.00 0.00 N ATOM 237 CA GLN A 355 2.802 -5.309 7.520 1.00 0.00 C ATOM 238 C GLN A 355 3.480 -4.986 6.173 1.00 0.00 C ATOM 239 O GLN A 355 3.156 -3.944 5.602 1.00 0.00 O ATOM 240 CB GLN A 355 3.652 -4.988 8.745 1.00 0.00 C ATOM 241 CG GLN A 355 4.264 -3.579 8.734 1.00 0.00 C ATOM 242 CD GLN A 355 5.023 -3.274 10.026 1.00 0.00 C ATOM 243 OE1 GLN A 355 5.911 -4.003 10.448 1.00 0.00 O ATOM 244 NE2 GLN A 355 4.710 -2.191 10.708 1.00 0.00 N ATOM 0 H GLN A 355 2.792 -7.252 8.302 1.00 0.00 H new ATOM 0 HA GLN A 355 1.940 -4.643 7.566 1.00 0.00 H new ATOM 0 HB2 GLN A 355 3.038 -5.098 9.639 1.00 0.00 H new ATOM 0 HB3 GLN A 355 4.456 -5.721 8.818 1.00 0.00 H new ATOM 0 HG2 GLN A 355 4.941 -3.484 7.885 1.00 0.00 H new ATOM 0 HG3 GLN A 355 3.474 -2.841 8.595 1.00 0.00 H new ATOM 0 HE21 GLN A 355 3.973 -1.572 10.372 1.00 0.00 H new ATOM 0 HE22 GLN A 355 5.205 -1.972 11.572 1.00 0.00 H new ATOM 253 N GLN A 356 4.322 -5.870 5.597 1.00 0.00 N ATOM 254 CA GLN A 356 4.818 -5.649 4.233 1.00 0.00 C ATOM 255 C GLN A 356 3.690 -5.517 3.221 1.00 0.00 C ATOM 256 O GLN A 356 3.645 -4.519 2.515 1.00 0.00 O ATOM 257 CB GLN A 356 5.809 -6.698 3.717 1.00 0.00 C ATOM 258 CG GLN A 356 6.742 -7.427 4.683 1.00 0.00 C ATOM 259 CD GLN A 356 7.726 -6.478 5.365 1.00 0.00 C ATOM 260 OE1 GLN A 356 8.633 -5.930 4.753 1.00 0.00 O ATOM 261 NE2 GLN A 356 7.594 -6.248 6.653 1.00 0.00 N ATOM 0 H GLN A 356 4.662 -6.721 6.046 1.00 0.00 H new ATOM 0 HA GLN A 356 5.362 -4.709 4.325 1.00 0.00 H new ATOM 0 HB2 GLN A 356 5.229 -7.459 3.195 1.00 0.00 H new ATOM 0 HB3 GLN A 356 6.436 -6.208 2.972 1.00 0.00 H new ATOM 0 HG2 GLN A 356 6.149 -7.938 5.441 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.296 -8.193 4.141 1.00 0.00 H new ATOM 0 HE21 GLN A 356 6.843 -6.697 7.177 1.00 0.00 H new ATOM 0 HE22 GLN A 356 8.243 -5.620 7.128 1.00 0.00 H new ATOM 270 N LEU A 357 2.783 -6.497 3.164 1.00 0.00 N ATOM 271 CA LEU A 357 1.630 -6.465 2.243 1.00 0.00 C ATOM 272 C LEU A 357 0.855 -5.127 2.367 1.00 0.00 C ATOM 273 O LEU A 357 0.669 -4.415 1.381 1.00 0.00 O ATOM 274 CB LEU A 357 0.737 -7.692 2.530 1.00 0.00 C ATOM 275 CG LEU A 357 -0.042 -8.230 1.314 1.00 0.00 C ATOM 276 CD1 LEU A 357 -1.015 -9.321 1.758 1.00 0.00 C ATOM 277 CD2 LEU A 357 -0.811 -7.150 0.577 1.00 0.00 C ATOM 0 H LEU A 357 2.822 -7.332 3.749 1.00 0.00 H new ATOM 0 HA LEU A 357 1.974 -6.519 1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 357 1.362 -8.493 2.925 1.00 0.00 H new ATOM 0 HB3 LEU A 357 0.024 -7.429 3.312 1.00 0.00 H new ATOM 0 HG LEU A 357 0.700 -8.633 0.624 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.561 -9.696 0.892 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -0.460 -10.138 2.218 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.719 -8.909 2.481 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -1.338 -7.592 -0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.531 -6.690 1.254 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -0.117 -6.391 0.216 1.00 0.00 H new ATOM 289 N VAL A 358 0.451 -4.729 3.577 1.00 0.00 N ATOM 290 CA VAL A 358 -0.267 -3.460 3.825 1.00 0.00 C ATOM 291 C VAL A 358 0.540 -2.226 3.384 1.00 0.00 C ATOM 292 O VAL A 358 -0.024 -1.294 2.805 1.00 0.00 O ATOM 293 CB VAL A 358 -0.664 -3.366 5.314 1.00 0.00 C ATOM 294 CG1 VAL A 358 -1.236 -1.997 5.705 1.00 0.00 C ATOM 295 CG2 VAL A 358 -1.732 -4.414 5.663 1.00 0.00 C ATOM 0 H VAL A 358 0.611 -5.277 4.422 1.00 0.00 H new ATOM 0 HA VAL A 358 -1.169 -3.466 3.213 1.00 0.00 H new ATOM 0 HB VAL A 358 0.261 -3.536 5.865 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -1.494 -2.000 6.764 1.00 0.00 H new ATOM 0 HG12 VAL A 358 -0.492 -1.224 5.515 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -2.129 -1.794 5.114 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -1.995 -4.328 6.717 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -2.619 -4.246 5.052 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -1.340 -5.412 5.467 1.00 0.00 H new ATOM 305 N LEU A 359 1.859 -2.212 3.597 1.00 0.00 N ATOM 306 CA LEU A 359 2.734 -1.097 3.209 1.00 0.00 C ATOM 307 C LEU A 359 3.044 -1.092 1.703 1.00 0.00 C ATOM 308 O LEU A 359 3.243 -0.030 1.121 1.00 0.00 O ATOM 309 CB LEU A 359 4.024 -1.117 4.040 1.00 0.00 C ATOM 310 CG LEU A 359 3.867 -0.731 5.524 1.00 0.00 C ATOM 311 CD1 LEU A 359 5.206 -0.930 6.234 1.00 0.00 C ATOM 312 CD2 LEU A 359 3.456 0.733 5.710 1.00 0.00 C ATOM 0 H LEU A 359 2.356 -2.980 4.048 1.00 0.00 H new ATOM 0 HA LEU A 359 2.196 -0.172 3.418 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.454 -2.117 3.987 1.00 0.00 H new ATOM 0 HB3 LEU A 359 4.741 -0.437 3.580 1.00 0.00 H new ATOM 0 HG LEU A 359 3.084 -1.365 5.940 1.00 0.00 H new ATOM 0 HD11 LEU A 359 5.104 -0.659 7.285 1.00 0.00 H new ATOM 0 HD12 LEU A 359 5.508 -1.975 6.156 1.00 0.00 H new ATOM 0 HD13 LEU A 359 5.962 -0.298 5.768 1.00 0.00 H new ATOM 0 HD21 LEU A 359 3.360 0.952 6.774 1.00 0.00 H new ATOM 0 HD22 LEU A 359 4.215 1.382 5.274 1.00 0.00 H new ATOM 0 HD23 LEU A 359 2.501 0.908 5.215 1.00 0.00 H new ATOM 324 N LEU A 360 3.016 -2.254 1.052 1.00 0.00 N ATOM 325 CA LEU A 360 3.140 -2.436 -0.396 1.00 0.00 C ATOM 326 C LEU A 360 1.923 -1.830 -1.090 1.00 0.00 C ATOM 327 O LEU A 360 2.038 -1.114 -2.086 1.00 0.00 O ATOM 328 CB LEU A 360 3.191 -3.949 -0.686 1.00 0.00 C ATOM 329 CG LEU A 360 4.556 -4.510 -1.129 1.00 0.00 C ATOM 330 CD1 LEU A 360 5.766 -3.928 -0.401 1.00 0.00 C ATOM 331 CD2 LEU A 360 4.569 -6.016 -0.878 1.00 0.00 C ATOM 0 H LEU A 360 2.900 -3.140 1.544 1.00 0.00 H new ATOM 0 HA LEU A 360 4.042 -1.947 -0.764 1.00 0.00 H new ATOM 0 HB2 LEU A 360 2.877 -4.481 0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.460 -4.174 -1.462 1.00 0.00 H new ATOM 0 HG LEU A 360 4.652 -4.237 -2.180 1.00 0.00 H new ATOM 0 HD11 LEU A 360 6.677 -4.387 -0.785 1.00 0.00 H new ATOM 0 HD12 LEU A 360 5.806 -2.851 -0.565 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.680 -4.130 0.667 1.00 0.00 H new ATOM 0 HD21 LEU A 360 5.530 -6.428 -1.187 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.416 -6.209 0.184 1.00 0.00 H new ATOM 0 HD23 LEU A 360 3.771 -6.487 -1.451 1.00 0.00 H new ATOM 343 N LEU A 361 0.745 -2.095 -0.533 1.00 0.00 N ATOM 344 CA LEU A 361 -0.498 -1.532 -1.029 1.00 0.00 C ATOM 345 C LEU A 361 -0.542 -0.027 -0.754 1.00 0.00 C ATOM 346 O LEU A 361 -0.933 0.719 -1.653 1.00 0.00 O ATOM 347 CB LEU A 361 -1.666 -2.309 -0.430 1.00 0.00 C ATOM 348 CG LEU A 361 -1.657 -3.787 -0.877 1.00 0.00 C ATOM 349 CD1 LEU A 361 -2.832 -4.483 -0.201 1.00 0.00 C ATOM 350 CD2 LEU A 361 -1.814 -3.978 -2.389 1.00 0.00 C ATOM 0 H LEU A 361 0.630 -2.707 0.275 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.571 -1.634 -2.112 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.618 -2.257 0.658 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.605 -1.844 -0.730 1.00 0.00 H new ATOM 0 HG LEU A 361 -0.688 -4.201 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -2.853 -5.532 -0.497 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -2.722 -4.414 0.881 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -3.762 -4.002 -0.503 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -1.798 -5.042 -2.625 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -2.762 -3.548 -2.714 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -0.994 -3.480 -2.906 1.00 0.00 H new ATOM 362 N HIS A 362 -0.053 0.434 0.410 1.00 0.00 N ATOM 363 CA HIS A 362 0.111 1.870 0.660 1.00 0.00 C ATOM 364 C HIS A 362 1.052 2.463 -0.397 1.00 0.00 C ATOM 365 O HIS A 362 0.743 3.503 -0.959 1.00 0.00 O ATOM 366 CB HIS A 362 0.635 2.180 2.073 1.00 0.00 C ATOM 367 CG HIS A 362 0.776 3.671 2.317 1.00 0.00 C ATOM 368 ND1 HIS A 362 1.733 4.505 1.791 1.00 0.00 N flip ATOM 369 CD2 HIS A 362 -0.094 4.470 3.026 1.00 0.00 C flip ATOM 370 CE1 HIS A 362 1.418 5.820 2.149 1.00 0.00 C flip ATOM 371 NE2 HIS A 362 0.315 5.746 2.911 1.00 0.00 N flip ATOM 0 H HIS A 362 0.233 -0.164 1.185 1.00 0.00 H new ATOM 0 HA HIS A 362 -0.876 2.328 0.591 1.00 0.00 H new ATOM 0 HB2 HIS A 362 -0.044 1.755 2.812 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.602 1.697 2.214 1.00 0.00 H new ATOM 0 HD2 HIS A 362 -0.957 4.130 3.579 1.00 0.00 H new ATOM 0 HE1 HIS A 362 1.954 6.715 1.869 1.00 0.00 H new ATOM 0 HE2 HIS A 362 -0.148 6.546 3.342 1.00 0.00 H new ATOM 379 N ALA A 363 2.176 1.811 -0.707 1.00 0.00 N ATOM 380 CA ALA A 363 3.114 2.269 -1.723 1.00 0.00 C ATOM 381 C ALA A 363 2.450 2.407 -3.107 1.00 0.00 C ATOM 382 O ALA A 363 2.629 3.443 -3.739 1.00 0.00 O ATOM 383 CB ALA A 363 4.339 1.351 -1.729 1.00 0.00 C ATOM 0 H ALA A 363 2.459 0.943 -0.253 1.00 0.00 H new ATOM 0 HA ALA A 363 3.449 3.276 -1.473 1.00 0.00 H new ATOM 0 HB1 ALA A 363 5.044 1.690 -2.488 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.819 1.378 -0.751 1.00 0.00 H new ATOM 0 HB3 ALA A 363 4.028 0.331 -1.953 1.00 0.00 H new ATOM 389 N HIS A 364 1.650 1.435 -3.569 1.00 0.00 N ATOM 390 CA HIS A 364 0.915 1.523 -4.840 1.00 0.00 C ATOM 391 C HIS A 364 -0.030 2.739 -4.857 1.00 0.00 C ATOM 392 O HIS A 364 0.068 3.626 -5.714 1.00 0.00 O ATOM 393 CB HIS A 364 0.114 0.231 -5.064 1.00 0.00 C ATOM 394 CG HIS A 364 -0.653 0.222 -6.366 1.00 0.00 C ATOM 395 ND1 HIS A 364 -1.992 -0.062 -6.511 1.00 0.00 N ATOM 396 CD2 HIS A 364 -0.174 0.542 -7.611 1.00 0.00 C ATOM 397 CE1 HIS A 364 -2.315 0.080 -7.807 1.00 0.00 C ATOM 398 NE2 HIS A 364 -1.239 0.460 -8.522 1.00 0.00 N ATOM 0 H HIS A 364 1.494 0.560 -3.068 1.00 0.00 H new ATOM 0 HA HIS A 364 1.638 1.650 -5.646 1.00 0.00 H new ATOM 0 HB2 HIS A 364 0.796 -0.619 -5.046 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.584 0.097 -4.238 1.00 0.00 H new ATOM 0 HD1 HIS A 364 -2.630 -0.334 -5.763 1.00 0.00 H new ATOM 0 HD2 HIS A 364 0.845 0.810 -7.849 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -3.300 -0.087 -8.218 1.00 0.00 H new ATOM 406 N LYS A 365 -0.892 2.794 -3.834 1.00 0.00 N ATOM 407 CA LYS A 365 -1.817 3.895 -3.516 1.00 0.00 C ATOM 408 C LYS A 365 -1.138 5.253 -3.618 1.00 0.00 C ATOM 409 O LYS A 365 -1.558 6.132 -4.369 1.00 0.00 O ATOM 410 CB LYS A 365 -2.354 3.635 -2.088 1.00 0.00 C ATOM 411 CG LYS A 365 -2.726 4.870 -1.246 1.00 0.00 C ATOM 412 CD LYS A 365 -3.274 4.408 0.114 1.00 0.00 C ATOM 413 CE LYS A 365 -3.988 5.574 0.809 1.00 0.00 C ATOM 414 NZ LYS A 365 -4.562 5.169 2.119 1.00 0.00 N ATOM 0 H LYS A 365 -0.969 2.027 -3.165 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.635 3.921 -4.236 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.237 3.001 -2.168 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -1.602 3.066 -1.541 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -1.851 5.504 -1.103 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -3.472 5.469 -1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -3.966 3.577 -0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -2.460 4.043 0.740 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -3.285 6.393 0.958 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -4.783 5.949 0.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -5.036 5.984 2.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -5.252 4.404 1.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -3.800 4.835 2.743 1.00 0.00 H new ATOM 428 N CYS A 366 -0.089 5.401 -2.823 1.00 0.00 N ATOM 429 CA CYS A 366 0.675 6.606 -2.642 1.00 0.00 C ATOM 430 C CYS A 366 1.513 6.941 -3.886 1.00 0.00 C ATOM 431 O CYS A 366 1.799 8.109 -4.123 1.00 0.00 O ATOM 432 CB CYS A 366 1.408 6.420 -1.318 1.00 0.00 C ATOM 433 SG CYS A 366 2.263 7.908 -0.756 1.00 0.00 S ATOM 0 H CYS A 366 0.265 4.630 -2.257 1.00 0.00 H new ATOM 0 HA CYS A 366 0.072 7.510 -2.560 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.693 6.111 -0.556 1.00 0.00 H new ATOM 0 HB3 CYS A 366 2.132 5.612 -1.422 1.00 0.00 H new ATOM 0 HG CYS A 366 3.260 7.573 0.008 1.00 0.00 H new ATOM 438 N GLN A 367 1.872 5.971 -4.736 1.00 0.00 N ATOM 439 CA GLN A 367 2.541 6.239 -6.015 1.00 0.00 C ATOM 440 C GLN A 367 1.544 6.872 -6.996 1.00 0.00 C ATOM 441 O GLN A 367 1.860 7.893 -7.606 1.00 0.00 O ATOM 442 CB GLN A 367 3.171 4.954 -6.586 1.00 0.00 C ATOM 443 CG GLN A 367 4.255 5.244 -7.638 1.00 0.00 C ATOM 444 CD GLN A 367 5.517 5.888 -7.055 1.00 0.00 C ATOM 445 OE1 GLN A 367 5.669 6.085 -5.855 1.00 0.00 O ATOM 446 NE2 GLN A 367 6.472 6.251 -7.884 1.00 0.00 N ATOM 0 H GLN A 367 1.707 4.980 -4.557 1.00 0.00 H new ATOM 0 HA GLN A 367 3.355 6.946 -5.853 1.00 0.00 H new ATOM 0 HB2 GLN A 367 3.606 4.374 -5.772 1.00 0.00 H new ATOM 0 HB3 GLN A 367 2.390 4.339 -7.034 1.00 0.00 H new ATOM 0 HG2 GLN A 367 4.528 4.312 -8.133 1.00 0.00 H new ATOM 0 HG3 GLN A 367 3.841 5.902 -8.402 1.00 0.00 H new ATOM 0 HE21 GLN A 367 6.364 6.095 -8.886 1.00 0.00 H new ATOM 0 HE22 GLN A 367 7.321 6.688 -7.524 1.00 0.00 H new ATOM 455 N ARG A 368 0.320 6.329 -7.097 1.00 0.00 N ATOM 456 CA ARG A 368 -0.762 6.906 -7.924 1.00 0.00 C ATOM 457 C ARG A 368 -1.159 8.298 -7.441 1.00 0.00 C ATOM 458 O ARG A 368 -1.304 9.233 -8.232 1.00 0.00 O ATOM 459 CB ARG A 368 -1.956 5.928 -7.944 1.00 0.00 C ATOM 460 CG ARG A 368 -2.804 6.052 -9.219 1.00 0.00 C ATOM 461 CD ARG A 368 -2.129 5.427 -10.452 1.00 0.00 C ATOM 462 NE ARG A 368 -2.080 3.949 -10.367 1.00 0.00 N ATOM 463 CZ ARG A 368 -2.860 3.080 -10.987 1.00 0.00 C ATOM 464 NH1 ARG A 368 -3.815 3.448 -11.795 1.00 0.00 N ATOM 465 NH2 ARG A 368 -2.698 1.802 -10.801 1.00 0.00 N ATOM 0 H ARG A 368 0.048 5.476 -6.608 1.00 0.00 H new ATOM 0 HA ARG A 368 -0.404 7.038 -8.945 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -1.585 4.907 -7.857 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -2.586 6.113 -7.074 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -3.768 5.570 -9.056 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -3.003 7.105 -9.415 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -2.672 5.721 -11.351 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -1.116 5.819 -10.549 1.00 0.00 H new ATOM 0 HE ARG A 368 -1.361 3.556 -9.760 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -3.983 4.439 -11.969 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -4.394 2.745 -12.254 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -1.966 1.467 -10.174 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -3.303 1.136 -11.282 1.00 0.00 H new ATOM 479 N ARG A 369 -1.264 8.447 -6.124 1.00 0.00 N ATOM 480 CA ARG A 369 -1.569 9.703 -5.440 1.00 0.00 C ATOM 481 C ARG A 369 -0.493 10.750 -5.702 1.00 0.00 C ATOM 482 O ARG A 369 -0.813 11.875 -6.065 1.00 0.00 O ATOM 483 CB ARG A 369 -1.678 9.360 -3.948 1.00 0.00 C ATOM 484 CG ARG A 369 -1.724 10.492 -2.905 1.00 0.00 C ATOM 485 CD ARG A 369 -0.897 10.035 -1.690 1.00 0.00 C ATOM 486 NE ARG A 369 -1.157 10.824 -0.472 1.00 0.00 N ATOM 487 CZ ARG A 369 -0.621 10.597 0.716 1.00 0.00 C ATOM 488 NH1 ARG A 369 0.253 9.653 0.912 1.00 0.00 N ATOM 489 NH2 ARG A 369 -0.953 11.322 1.745 1.00 0.00 N ATOM 0 H ARG A 369 -1.134 7.668 -5.478 1.00 0.00 H new ATOM 0 HA ARG A 369 -2.499 10.139 -5.806 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -2.579 8.760 -3.817 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -0.831 8.722 -3.698 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -1.317 11.414 -3.321 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -2.753 10.702 -2.612 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -1.113 8.986 -1.487 1.00 0.00 H new ATOM 0 HD3 ARG A 369 0.163 10.100 -1.936 1.00 0.00 H new ATOM 0 HE ARG A 369 -1.803 11.609 -0.552 1.00 0.00 H new ATOM 0 HH11 ARG A 369 0.546 9.060 0.136 1.00 0.00 H new ATOM 0 HH12 ARG A 369 0.646 9.507 1.842 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -1.633 12.075 1.640 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -0.533 11.137 2.656 1.00 0.00 H new ATOM 503 N GLU A 370 0.776 10.376 -5.553 1.00 0.00 N ATOM 504 CA GLU A 370 1.922 11.261 -5.792 1.00 0.00 C ATOM 505 C GLU A 370 1.976 11.727 -7.250 1.00 0.00 C ATOM 506 O GLU A 370 2.118 12.914 -7.540 1.00 0.00 O ATOM 507 CB GLU A 370 3.209 10.515 -5.439 1.00 0.00 C ATOM 508 CG GLU A 370 4.460 11.385 -5.610 1.00 0.00 C ATOM 509 CD GLU A 370 5.721 10.800 -4.942 1.00 0.00 C ATOM 510 OE1 GLU A 370 5.718 9.639 -4.470 1.00 0.00 O ATOM 511 OE2 GLU A 370 6.726 11.548 -4.846 1.00 0.00 O ATOM 0 H GLU A 370 1.045 9.437 -5.259 1.00 0.00 H new ATOM 0 HA GLU A 370 1.814 12.146 -5.164 1.00 0.00 H new ATOM 0 HB2 GLU A 370 3.151 10.166 -4.408 1.00 0.00 H new ATOM 0 HB3 GLU A 370 3.297 9.631 -6.070 1.00 0.00 H new ATOM 0 HG2 GLU A 370 4.654 11.521 -6.674 1.00 0.00 H new ATOM 0 HG3 GLU A 370 4.264 12.373 -5.193 1.00 0.00 H new ATOM 518 N GLN A 371 1.817 10.767 -8.164 1.00 0.00 N ATOM 519 CA GLN A 371 1.730 10.996 -9.611 1.00 0.00 C ATOM 520 C GLN A 371 0.597 11.992 -9.940 1.00 0.00 C ATOM 521 O GLN A 371 0.758 12.836 -10.825 1.00 0.00 O ATOM 522 CB GLN A 371 1.543 9.641 -10.317 1.00 0.00 C ATOM 523 CG GLN A 371 1.414 9.745 -11.846 1.00 0.00 C ATOM 524 CD GLN A 371 1.219 8.386 -12.527 1.00 0.00 C ATOM 525 OE1 GLN A 371 0.741 7.414 -11.953 1.00 0.00 O ATOM 526 NE2 GLN A 371 1.575 8.262 -13.789 1.00 0.00 N ATOM 0 H GLN A 371 1.743 9.781 -7.913 1.00 0.00 H new ATOM 0 HA GLN A 371 2.652 11.449 -9.975 1.00 0.00 H new ATOM 0 HB2 GLN A 371 2.390 8.998 -10.077 1.00 0.00 H new ATOM 0 HB3 GLN A 371 0.652 9.156 -9.920 1.00 0.00 H new ATOM 0 HG2 GLN A 371 0.571 10.391 -12.090 1.00 0.00 H new ATOM 0 HG3 GLN A 371 2.308 10.221 -12.248 1.00 0.00 H new ATOM 0 HE21 GLN A 371 1.975 9.058 -14.287 1.00 0.00 H new ATOM 0 HE22 GLN A 371 1.451 7.370 -14.269 1.00 0.00 H new ATOM 535 N ALA A 372 -0.528 11.927 -9.214 1.00 0.00 N ATOM 536 CA ALA A 372 -1.644 12.868 -9.379 1.00 0.00 C ATOM 537 C ALA A 372 -1.320 14.262 -8.784 1.00 0.00 C ATOM 538 O ALA A 372 -1.565 15.284 -9.431 1.00 0.00 O ATOM 539 CB ALA A 372 -2.912 12.261 -8.763 1.00 0.00 C ATOM 0 H ALA A 372 -0.690 11.221 -8.496 1.00 0.00 H new ATOM 0 HA ALA A 372 -1.813 13.030 -10.444 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -3.743 12.956 -8.883 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -3.148 11.323 -9.266 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -2.747 12.073 -7.702 1.00 0.00 H new ATOM 652 N LEU A 381 4.405 8.902 7.026 1.00 0.00 N ATOM 653 CA LEU A 381 4.778 7.484 7.157 1.00 0.00 C ATOM 654 C LEU A 381 6.249 7.273 6.702 1.00 0.00 C ATOM 655 O LEU A 381 6.549 7.508 5.528 1.00 0.00 O ATOM 656 CB LEU A 381 3.752 6.659 6.343 1.00 0.00 C ATOM 657 CG LEU A 381 3.555 5.195 6.785 1.00 0.00 C ATOM 658 CD1 LEU A 381 2.405 4.570 5.995 1.00 0.00 C ATOM 659 CD2 LEU A 381 4.780 4.305 6.575 1.00 0.00 C ATOM 0 HA LEU A 381 4.743 7.148 8.193 1.00 0.00 H new ATOM 0 HB2 LEU A 381 2.788 7.165 6.393 1.00 0.00 H new ATOM 0 HB3 LEU A 381 4.060 6.663 5.298 1.00 0.00 H new ATOM 0 HG LEU A 381 3.354 5.242 7.855 1.00 0.00 H new ATOM 0 HD11 LEU A 381 2.268 3.535 6.309 1.00 0.00 H new ATOM 0 HD12 LEU A 381 1.489 5.130 6.181 1.00 0.00 H new ATOM 0 HD13 LEU A 381 2.637 4.598 4.930 1.00 0.00 H new ATOM 0 HD21 LEU A 381 4.556 3.293 6.912 1.00 0.00 H new ATOM 0 HD22 LEU A 381 5.039 4.286 5.516 1.00 0.00 H new ATOM 0 HD23 LEU A 381 5.619 4.700 7.147 1.00 0.00 H new ATOM 671 N PRO A 382 7.188 6.863 7.584 1.00 0.00 N ATOM 672 CA PRO A 382 8.612 6.741 7.234 1.00 0.00 C ATOM 673 C PRO A 382 8.948 5.592 6.268 1.00 0.00 C ATOM 674 O PRO A 382 9.765 5.764 5.361 1.00 0.00 O ATOM 675 CB PRO A 382 9.340 6.572 8.574 1.00 0.00 C ATOM 676 CG PRO A 382 8.291 5.952 9.496 1.00 0.00 C ATOM 677 CD PRO A 382 6.983 6.561 8.996 1.00 0.00 C ATOM 0 HA PRO A 382 8.926 7.626 6.681 1.00 0.00 H new ATOM 0 HB2 PRO A 382 10.213 5.927 8.474 1.00 0.00 H new ATOM 0 HB3 PRO A 382 9.693 7.529 8.959 1.00 0.00 H new ATOM 0 HG2 PRO A 382 8.283 4.865 9.423 1.00 0.00 H new ATOM 0 HG3 PRO A 382 8.477 6.200 10.541 1.00 0.00 H new ATOM 0 HD2 PRO A 382 6.154 5.866 9.129 1.00 0.00 H new ATOM 0 HD3 PRO A 382 6.735 7.463 9.555 1.00 0.00 H new ATOM 685 N HIS A 383 8.336 4.418 6.450 1.00 0.00 N ATOM 686 CA HIS A 383 8.580 3.213 5.638 1.00 0.00 C ATOM 687 C HIS A 383 8.082 3.313 4.182 1.00 0.00 C ATOM 688 O HIS A 383 8.497 2.527 3.329 1.00 0.00 O ATOM 689 CB HIS A 383 7.911 2.013 6.331 1.00 0.00 C ATOM 690 CG HIS A 383 8.243 1.878 7.800 1.00 0.00 C ATOM 691 ND1 HIS A 383 9.502 1.786 8.352 1.00 0.00 N ATOM 692 CD2 HIS A 383 7.348 1.859 8.837 1.00 0.00 C ATOM 693 CE1 HIS A 383 9.372 1.716 9.688 1.00 0.00 C ATOM 694 NE2 HIS A 383 8.072 1.758 10.033 1.00 0.00 N ATOM 0 H HIS A 383 7.641 4.271 7.182 1.00 0.00 H new ATOM 0 HA HIS A 383 9.661 3.093 5.571 1.00 0.00 H new ATOM 0 HB2 HIS A 383 6.830 2.101 6.221 1.00 0.00 H new ATOM 0 HB3 HIS A 383 8.210 1.099 5.818 1.00 0.00 H new ATOM 0 HD2 HIS A 383 6.273 1.912 8.749 1.00 0.00 H new ATOM 0 HE1 HIS A 383 10.193 1.637 10.385 1.00 0.00 H new ATOM 0 HE2 HIS A 383 7.689 1.723 10.978 1.00 0.00 H new ATOM 702 N CYS A 384 7.187 4.266 3.902 1.00 0.00 N ATOM 703 CA CYS A 384 6.527 4.485 2.619 1.00 0.00 C ATOM 704 C CYS A 384 7.479 4.565 1.413 1.00 0.00 C ATOM 705 O CYS A 384 7.336 3.786 0.471 1.00 0.00 O ATOM 706 CB CYS A 384 5.664 5.740 2.797 1.00 0.00 C ATOM 707 SG CYS A 384 4.839 6.200 1.254 1.00 0.00 S ATOM 0 H CYS A 384 6.890 4.941 4.607 1.00 0.00 H new ATOM 0 HA CYS A 384 5.916 3.619 2.365 1.00 0.00 H new ATOM 0 HB2 CYS A 384 4.918 5.563 3.571 1.00 0.00 H new ATOM 0 HB3 CYS A 384 6.287 6.566 3.138 1.00 0.00 H new ATOM 0 HG CYS A 384 5.214 5.395 0.305 1.00 0.00 H new ATOM 712 N ARG A 385 8.467 5.472 1.418 1.00 0.00 N ATOM 713 CA ARG A 385 9.399 5.641 0.279 1.00 0.00 C ATOM 714 C ARG A 385 10.314 4.432 0.057 1.00 0.00 C ATOM 715 O ARG A 385 10.608 4.085 -1.087 1.00 0.00 O ATOM 716 CB ARG A 385 10.146 6.984 0.370 1.00 0.00 C ATOM 717 CG ARG A 385 9.338 8.124 -0.289 1.00 0.00 C ATOM 718 CD ARG A 385 7.980 8.434 0.367 1.00 0.00 C ATOM 719 NE ARG A 385 8.154 9.101 1.671 1.00 0.00 N ATOM 720 CZ ARG A 385 7.198 9.423 2.525 1.00 0.00 C ATOM 721 NH1 ARG A 385 5.963 9.057 2.370 1.00 0.00 N ATOM 722 NH2 ARG A 385 7.461 10.142 3.572 1.00 0.00 N ATOM 0 H ARG A 385 8.646 6.104 2.198 1.00 0.00 H new ATOM 0 HA ARG A 385 8.797 5.682 -0.629 1.00 0.00 H new ATOM 0 HB2 ARG A 385 10.335 7.227 1.416 1.00 0.00 H new ATOM 0 HB3 ARG A 385 11.117 6.896 -0.117 1.00 0.00 H new ATOM 0 HG2 ARG A 385 9.944 9.030 -0.277 1.00 0.00 H new ATOM 0 HG3 ARG A 385 9.168 7.868 -1.335 1.00 0.00 H new ATOM 0 HD2 ARG A 385 7.392 9.071 -0.294 1.00 0.00 H new ATOM 0 HD3 ARG A 385 7.419 7.509 0.501 1.00 0.00 H new ATOM 0 HE ARG A 385 9.109 9.338 1.941 1.00 0.00 H new ATOM 0 HH11 ARG A 385 5.695 8.496 1.561 1.00 0.00 H new ATOM 0 HH12 ARG A 385 5.260 9.330 3.057 1.00 0.00 H new ATOM 0 HH21 ARG A 385 8.413 10.465 3.743 1.00 0.00 H new ATOM 0 HH22 ARG A 385 6.715 10.385 4.224 1.00 0.00 H new ATOM 736 N THR A 386 10.682 3.728 1.124 1.00 0.00 N ATOM 737 CA THR A 386 11.444 2.471 1.047 1.00 0.00 C ATOM 738 C THR A 386 10.575 1.402 0.385 1.00 0.00 C ATOM 739 O THR A 386 11.007 0.749 -0.559 1.00 0.00 O ATOM 740 CB THR A 386 11.895 2.001 2.442 1.00 0.00 C ATOM 741 OG1 THR A 386 12.597 3.043 3.088 1.00 0.00 O ATOM 742 CG2 THR A 386 12.835 0.795 2.372 1.00 0.00 C ATOM 0 H THR A 386 10.461 4.011 2.079 1.00 0.00 H new ATOM 0 HA THR A 386 12.342 2.642 0.453 1.00 0.00 H new ATOM 0 HB THR A 386 10.994 1.720 2.987 1.00 0.00 H new ATOM 0 HG1 THR A 386 12.882 2.744 3.976 1.00 0.00 H new ATOM 0 HG21 THR A 386 13.125 0.501 3.381 1.00 0.00 H new ATOM 0 HG22 THR A 386 12.325 -0.036 1.884 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.725 1.060 1.801 1.00 0.00 H new ATOM 750 N MET A 387 9.319 1.260 0.816 1.00 0.00 N ATOM 751 CA MET A 387 8.361 0.315 0.233 1.00 0.00 C ATOM 752 C MET A 387 8.015 0.659 -1.223 1.00 0.00 C ATOM 753 O MET A 387 7.934 -0.240 -2.054 1.00 0.00 O ATOM 754 CB MET A 387 7.104 0.284 1.104 1.00 0.00 C ATOM 755 CG MET A 387 7.364 -0.419 2.448 1.00 0.00 C ATOM 756 SD MET A 387 6.996 -2.198 2.554 1.00 0.00 S ATOM 757 CE MET A 387 8.328 -2.950 1.580 1.00 0.00 C ATOM 0 H MET A 387 8.934 1.804 1.588 1.00 0.00 H new ATOM 0 HA MET A 387 8.820 -0.673 0.211 1.00 0.00 H new ATOM 0 HB2 MET A 387 6.761 1.303 1.286 1.00 0.00 H new ATOM 0 HB3 MET A 387 6.304 -0.231 0.572 1.00 0.00 H new ATOM 0 HG2 MET A 387 8.414 -0.277 2.703 1.00 0.00 H new ATOM 0 HG3 MET A 387 6.778 0.091 3.213 1.00 0.00 H new ATOM 0 HE1 MET A 387 8.359 -4.022 1.773 1.00 0.00 H new ATOM 0 HE2 MET A 387 8.145 -2.777 0.519 1.00 0.00 H new ATOM 0 HE3 MET A 387 9.281 -2.503 1.862 1.00 0.00 H new ATOM 767 N LYS A 388 7.885 1.943 -1.574 1.00 0.00 N ATOM 768 CA LYS A 388 7.719 2.429 -2.959 1.00 0.00 C ATOM 769 C LYS A 388 8.921 2.006 -3.812 1.00 0.00 C ATOM 770 O LYS A 388 8.736 1.532 -4.934 1.00 0.00 O ATOM 771 CB LYS A 388 7.584 3.960 -2.937 1.00 0.00 C ATOM 772 CG LYS A 388 6.175 4.511 -2.640 1.00 0.00 C ATOM 773 CD LYS A 388 6.294 5.967 -2.152 1.00 0.00 C ATOM 774 CE LYS A 388 4.985 6.765 -2.133 1.00 0.00 C ATOM 775 NZ LYS A 388 4.657 7.310 -3.471 1.00 0.00 N ATOM 0 H LYS A 388 7.892 2.698 -0.888 1.00 0.00 H new ATOM 0 HA LYS A 388 6.821 1.995 -3.398 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.272 4.355 -2.189 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.907 4.347 -3.903 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.557 4.465 -3.536 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.684 3.900 -1.882 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.711 5.961 -1.145 1.00 0.00 H new ATOM 0 HD3 LYS A 388 7.008 6.488 -2.789 1.00 0.00 H new ATOM 0 HE2 LYS A 388 4.172 6.123 -1.792 1.00 0.00 H new ATOM 0 HE3 LYS A 388 5.067 7.583 -1.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.697 7.711 -3.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 5.339 8.054 -3.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.704 6.548 -4.177 1.00 0.00 H new ATOM 789 N ASN A 389 10.143 2.109 -3.272 1.00 0.00 N ATOM 790 CA ASN A 389 11.353 1.658 -3.977 1.00 0.00 C ATOM 791 C ASN A 389 11.351 0.125 -4.161 1.00 0.00 C ATOM 792 O ASN A 389 11.641 -0.373 -5.247 1.00 0.00 O ATOM 793 CB ASN A 389 12.600 2.155 -3.226 1.00 0.00 C ATOM 794 CG ASN A 389 13.884 1.752 -3.934 1.00 0.00 C ATOM 795 OD1 ASN A 389 14.143 2.131 -5.068 1.00 0.00 O ATOM 796 ND2 ASN A 389 14.728 0.968 -3.300 1.00 0.00 N ATOM 0 H ASN A 389 10.321 2.501 -2.347 1.00 0.00 H new ATOM 0 HA ASN A 389 11.368 2.087 -4.979 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.561 3.240 -3.135 1.00 0.00 H new ATOM 0 HB3 ASN A 389 12.600 1.750 -2.214 1.00 0.00 H new ATOM 0 HD21 ASN A 389 15.594 0.678 -3.754 1.00 0.00 H new ATOM 0 HD22 ASN A 389 14.516 0.649 -2.354 1.00 0.00 H new ATOM 803 N VAL A 390 10.961 -0.622 -3.122 1.00 0.00 N ATOM 804 CA VAL A 390 10.810 -2.091 -3.133 1.00 0.00 C ATOM 805 C VAL A 390 9.746 -2.526 -4.149 1.00 0.00 C ATOM 806 O VAL A 390 9.924 -3.529 -4.836 1.00 0.00 O ATOM 807 CB VAL A 390 10.433 -2.575 -1.720 1.00 0.00 C ATOM 808 CG1 VAL A 390 10.000 -4.043 -1.651 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.589 -2.413 -0.728 1.00 0.00 C ATOM 0 H VAL A 390 10.733 -0.211 -2.217 1.00 0.00 H new ATOM 0 HA VAL A 390 11.757 -2.541 -3.430 1.00 0.00 H new ATOM 0 HB VAL A 390 9.588 -1.940 -1.455 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.752 -4.301 -0.621 1.00 0.00 H new ATOM 0 HG12 VAL A 390 9.125 -4.194 -2.284 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.814 -4.679 -1.999 1.00 0.00 H new ATOM 0 HG21 VAL A 390 11.277 -2.767 0.255 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.445 -2.995 -1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 390 11.868 -1.361 -0.663 1.00 0.00 H new ATOM 819 N LEU A 391 8.650 -1.771 -4.284 1.00 0.00 N ATOM 820 CA LEU A 391 7.581 -2.047 -5.244 1.00 0.00 C ATOM 821 C LEU A 391 8.103 -1.830 -6.675 1.00 0.00 C ATOM 822 O LEU A 391 8.003 -2.730 -7.505 1.00 0.00 O ATOM 823 CB LEU A 391 6.353 -1.177 -4.906 1.00 0.00 C ATOM 824 CG LEU A 391 5.004 -1.701 -5.439 1.00 0.00 C ATOM 825 CD1 LEU A 391 3.902 -0.734 -5.016 1.00 0.00 C ATOM 826 CD2 LEU A 391 4.922 -1.842 -6.958 1.00 0.00 C ATOM 0 H LEU A 391 8.480 -0.939 -3.719 1.00 0.00 H new ATOM 0 HA LEU A 391 7.262 -3.087 -5.180 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.284 -1.082 -3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.518 -0.176 -5.304 1.00 0.00 H new ATOM 0 HG LEU A 391 4.892 -2.700 -5.018 1.00 0.00 H new ATOM 0 HD11 LEU A 391 2.942 -1.092 -5.386 1.00 0.00 H new ATOM 0 HD12 LEU A 391 3.871 -0.671 -3.928 1.00 0.00 H new ATOM 0 HD13 LEU A 391 4.105 0.253 -5.431 1.00 0.00 H new ATOM 0 HD21 LEU A 391 3.937 -2.217 -7.236 1.00 0.00 H new ATOM 0 HD22 LEU A 391 5.085 -0.870 -7.423 1.00 0.00 H new ATOM 0 HD23 LEU A 391 5.686 -2.541 -7.300 1.00 0.00 H new ATOM 838 N ASN A 392 8.740 -0.689 -6.959 1.00 0.00 N ATOM 839 CA ASN A 392 9.352 -0.434 -8.272 1.00 0.00 C ATOM 840 C ASN A 392 10.381 -1.529 -8.617 1.00 0.00 C ATOM 841 O ASN A 392 10.407 -2.043 -9.743 1.00 0.00 O ATOM 842 CB ASN A 392 9.980 0.970 -8.265 1.00 0.00 C ATOM 843 CG ASN A 392 10.620 1.305 -9.603 1.00 0.00 C ATOM 844 OD1 ASN A 392 11.808 1.114 -9.817 1.00 0.00 O ATOM 845 ND2 ASN A 392 9.854 1.804 -10.548 1.00 0.00 N ATOM 0 H ASN A 392 8.847 0.078 -6.295 1.00 0.00 H new ATOM 0 HA ASN A 392 8.590 -0.468 -9.050 1.00 0.00 H new ATOM 0 HB2 ASN A 392 9.215 1.710 -8.032 1.00 0.00 H new ATOM 0 HB3 ASN A 392 10.731 1.029 -7.477 1.00 0.00 H new ATOM 0 HD21 ASN A 392 10.251 2.032 -11.459 1.00 0.00 H new ATOM 0 HD22 ASN A 392 8.862 1.963 -10.370 1.00 0.00 H new ATOM 852 N HIS A 393 11.158 -1.963 -7.616 1.00 0.00 N ATOM 853 CA HIS A 393 12.071 -3.083 -7.783 1.00 0.00 C ATOM 854 C HIS A 393 11.282 -4.330 -8.168 1.00 0.00 C ATOM 855 O HIS A 393 11.607 -4.937 -9.180 1.00 0.00 O ATOM 856 CB HIS A 393 12.929 -3.322 -6.539 1.00 0.00 C ATOM 857 CG HIS A 393 13.799 -4.547 -6.696 1.00 0.00 C ATOM 858 ND1 HIS A 393 15.053 -4.603 -7.260 1.00 0.00 N ATOM 859 CD2 HIS A 393 13.397 -5.841 -6.491 1.00 0.00 C ATOM 860 CE1 HIS A 393 15.390 -5.899 -7.403 1.00 0.00 C ATOM 861 NE2 HIS A 393 14.402 -6.696 -6.962 1.00 0.00 N ATOM 0 H HIS A 393 11.167 -1.550 -6.684 1.00 0.00 H new ATOM 0 HA HIS A 393 12.766 -2.840 -8.587 1.00 0.00 H new ATOM 0 HB2 HIS A 393 13.556 -2.450 -6.355 1.00 0.00 H new ATOM 0 HB3 HIS A 393 12.284 -3.441 -5.668 1.00 0.00 H new ATOM 0 HD2 HIS A 393 12.464 -6.149 -6.043 1.00 0.00 H new ATOM 0 HE1 HIS A 393 16.325 -6.249 -7.815 1.00 0.00 H new ATOM 0 HE2 HIS A 393 14.387 -7.716 -6.969 1.00 0.00 H new ATOM 869 N MET A 394 10.219 -4.685 -7.432 1.00 0.00 N ATOM 870 CA MET A 394 9.401 -5.855 -7.776 1.00 0.00 C ATOM 871 C MET A 394 8.790 -5.749 -9.182 1.00 0.00 C ATOM 872 O MET A 394 8.544 -6.787 -9.798 1.00 0.00 O ATOM 873 CB MET A 394 8.347 -6.224 -6.709 1.00 0.00 C ATOM 874 CG MET A 394 6.952 -5.587 -6.820 1.00 0.00 C ATOM 875 SD MET A 394 5.597 -6.601 -6.157 1.00 0.00 S ATOM 876 CE MET A 394 6.135 -6.805 -4.441 1.00 0.00 C ATOM 0 H MET A 394 9.908 -4.182 -6.601 1.00 0.00 H new ATOM 0 HA MET A 394 10.099 -6.692 -7.790 1.00 0.00 H new ATOM 0 HB2 MET A 394 8.222 -7.307 -6.724 1.00 0.00 H new ATOM 0 HB3 MET A 394 8.756 -5.964 -5.732 1.00 0.00 H new ATOM 0 HG2 MET A 394 6.962 -4.631 -6.296 1.00 0.00 H new ATOM 0 HG3 MET A 394 6.748 -5.374 -7.869 1.00 0.00 H new ATOM 0 HE1 MET A 394 5.372 -7.347 -3.882 1.00 0.00 H new ATOM 0 HE2 MET A 394 7.069 -7.366 -4.417 1.00 0.00 H new ATOM 0 HE3 MET A 394 6.289 -5.825 -3.989 1.00 0.00 H new ATOM 886 N THR A 395 8.568 -4.532 -9.709 1.00 0.00 N ATOM 887 CA THR A 395 8.068 -4.370 -11.092 1.00 0.00 C ATOM 888 C THR A 395 9.159 -4.714 -12.109 1.00 0.00 C ATOM 889 O THR A 395 8.875 -5.434 -13.069 1.00 0.00 O ATOM 890 CB THR A 395 7.447 -2.998 -11.433 1.00 0.00 C ATOM 891 OG1 THR A 395 8.366 -1.931 -11.499 1.00 0.00 O ATOM 892 CG2 THR A 395 6.307 -2.590 -10.505 1.00 0.00 C ATOM 0 H THR A 395 8.723 -3.656 -9.210 1.00 0.00 H new ATOM 0 HA THR A 395 7.241 -5.077 -11.155 1.00 0.00 H new ATOM 0 HB THR A 395 7.054 -3.172 -12.435 1.00 0.00 H new ATOM 0 HG1 THR A 395 9.066 -2.060 -10.825 1.00 0.00 H new ATOM 0 HG21 THR A 395 5.922 -1.616 -10.808 1.00 0.00 H new ATOM 0 HG22 THR A 395 5.508 -3.330 -10.563 1.00 0.00 H new ATOM 0 HG23 THR A 395 6.675 -2.533 -9.480 1.00 0.00 H new ATOM 900 N HIS A 396 10.407 -4.254 -11.909 1.00 0.00 N ATOM 901 CA HIS A 396 11.519 -4.610 -12.812 1.00 0.00 C ATOM 902 C HIS A 396 12.137 -6.010 -12.555 1.00 0.00 C ATOM 903 O HIS A 396 12.846 -6.537 -13.419 1.00 0.00 O ATOM 904 CB HIS A 396 12.566 -3.485 -12.878 1.00 0.00 C ATOM 905 CG HIS A 396 13.586 -3.434 -11.767 1.00 0.00 C ATOM 906 ND1 HIS A 396 14.603 -4.339 -11.552 1.00 0.00 N ATOM 907 CD2 HIS A 396 13.788 -2.395 -10.899 1.00 0.00 C ATOM 908 CE1 HIS A 396 15.385 -3.870 -10.567 1.00 0.00 C ATOM 909 NE2 HIS A 396 14.928 -2.682 -10.133 1.00 0.00 N ATOM 0 H HIS A 396 10.671 -3.641 -11.138 1.00 0.00 H new ATOM 0 HA HIS A 396 11.079 -4.705 -13.805 1.00 0.00 H new ATOM 0 HB2 HIS A 396 13.100 -3.574 -13.824 1.00 0.00 H new ATOM 0 HB3 HIS A 396 12.038 -2.531 -12.898 1.00 0.00 H new ATOM 0 HD2 HIS A 396 13.176 -1.509 -10.818 1.00 0.00 H new ATOM 0 HE1 HIS A 396 16.257 -4.375 -10.178 1.00 0.00 H new ATOM 0 HE2 HIS A 396 15.330 -2.105 -9.394 1.00 0.00 H new ATOM 917 N CYS A 397 11.901 -6.600 -11.377 1.00 0.00 N ATOM 918 CA CYS A 397 12.400 -7.904 -10.929 1.00 0.00 C ATOM 919 C CYS A 397 11.960 -9.054 -11.859 1.00 0.00 C ATOM 920 O CYS A 397 10.873 -9.020 -12.447 1.00 0.00 O ATOM 921 CB CYS A 397 11.918 -8.107 -9.483 1.00 0.00 C ATOM 922 SG CYS A 397 12.775 -9.469 -8.657 1.00 0.00 S ATOM 0 H CYS A 397 11.321 -6.151 -10.668 1.00 0.00 H new ATOM 0 HA CYS A 397 13.489 -7.918 -10.966 1.00 0.00 H new ATOM 0 HB2 CYS A 397 12.073 -7.188 -8.918 1.00 0.00 H new ATOM 0 HB3 CYS A 397 10.846 -8.303 -9.484 1.00 0.00 H new ATOM 0 HG CYS A 397 12.668 -9.331 -7.369 1.00 0.00 H new ATOM 927 N GLN A 398 12.808 -10.082 -11.979 1.00 0.00 N ATOM 928 CA GLN A 398 12.583 -11.236 -12.862 1.00 0.00 C ATOM 929 C GLN A 398 12.417 -12.574 -12.130 1.00 0.00 C ATOM 930 O GLN A 398 11.672 -13.435 -12.603 1.00 0.00 O ATOM 931 CB GLN A 398 13.713 -11.312 -13.904 1.00 0.00 C ATOM 932 CG GLN A 398 13.712 -10.109 -14.867 1.00 0.00 C ATOM 933 CD GLN A 398 14.859 -10.151 -15.879 1.00 0.00 C ATOM 934 OE1 GLN A 398 15.294 -11.196 -16.347 1.00 0.00 O ATOM 935 NE2 GLN A 398 15.402 -9.012 -16.262 1.00 0.00 N ATOM 0 H GLN A 398 13.683 -10.138 -11.458 1.00 0.00 H new ATOM 0 HA GLN A 398 11.625 -11.068 -13.354 1.00 0.00 H new ATOM 0 HB2 GLN A 398 14.673 -11.361 -13.390 1.00 0.00 H new ATOM 0 HB3 GLN A 398 13.611 -12.233 -14.478 1.00 0.00 H new ATOM 0 HG2 GLN A 398 12.763 -10.081 -15.403 1.00 0.00 H new ATOM 0 HG3 GLN A 398 13.779 -9.188 -14.288 1.00 0.00 H new ATOM 0 HE21 GLN A 398 15.056 -8.130 -15.885 1.00 0.00 H new ATOM 0 HE22 GLN A 398 16.168 -9.013 -16.935 1.00 0.00 H new ATOM 944 N ALA A 399 13.050 -12.751 -10.967 1.00 0.00 N ATOM 945 CA ALA A 399 12.889 -13.958 -10.156 1.00 0.00 C ATOM 946 C ALA A 399 11.705 -13.853 -9.190 1.00 0.00 C ATOM 947 O ALA A 399 11.007 -14.838 -8.946 1.00 0.00 O ATOM 948 CB ALA A 399 14.143 -14.179 -9.307 1.00 0.00 C ATOM 0 H ALA A 399 13.686 -12.063 -10.563 1.00 0.00 H new ATOM 0 HA ALA A 399 12.717 -14.781 -10.849 1.00 0.00 H new ATOM 0 HB1 ALA A 399 14.020 -15.079 -8.704 1.00 0.00 H new ATOM 0 HB2 ALA A 399 15.008 -14.295 -9.960 1.00 0.00 H new ATOM 0 HB3 ALA A 399 14.295 -13.321 -8.652 1.00 0.00 H new ATOM 954 N PRO A 400 11.527 -12.664 -8.609 1.00 0.00 N ATOM 955 CA PRO A 400 10.558 -12.327 -7.568 1.00 0.00 C ATOM 956 C PRO A 400 10.751 -13.105 -6.257 1.00 0.00 C ATOM 957 O PRO A 400 11.156 -12.539 -5.246 1.00 0.00 O ATOM 961 N LYS A 401 10.499 -14.419 -6.280 1.00 0.00 N ATOM 962 CA LYS A 401 10.658 -15.357 -5.149 1.00 0.00 C ATOM 963 C LYS A 401 12.115 -15.790 -4.952 1.00 0.00 C ATOM 964 O LYS A 401 12.627 -15.794 -3.834 1.00 0.00 O ATOM 965 CB LYS A 401 9.714 -16.554 -5.360 1.00 0.00 C ATOM 966 CG LYS A 401 9.689 -17.503 -4.147 1.00 0.00 C ATOM 967 CD LYS A 401 8.563 -18.550 -4.229 1.00 0.00 C ATOM 968 CE LYS A 401 8.675 -19.528 -5.411 1.00 0.00 C ATOM 969 NZ LYS A 401 9.778 -20.512 -5.236 1.00 0.00 N ATOM 0 H LYS A 401 10.163 -14.884 -7.123 1.00 0.00 H new ATOM 0 HA LYS A 401 10.384 -14.849 -4.225 1.00 0.00 H new ATOM 0 HB2 LYS A 401 8.705 -16.188 -5.553 1.00 0.00 H new ATOM 0 HB3 LYS A 401 10.027 -17.108 -6.245 1.00 0.00 H new ATOM 0 HG2 LYS A 401 10.649 -18.014 -4.072 1.00 0.00 H new ATOM 0 HG3 LYS A 401 9.568 -16.917 -3.236 1.00 0.00 H new ATOM 0 HD2 LYS A 401 8.551 -19.123 -3.302 1.00 0.00 H new ATOM 0 HD3 LYS A 401 7.607 -18.030 -4.295 1.00 0.00 H new ATOM 0 HE2 LYS A 401 7.732 -20.062 -5.527 1.00 0.00 H new ATOM 0 HE3 LYS A 401 8.838 -18.965 -6.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 9.810 -21.147 -6.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 10.683 -20.007 -5.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 9.612 -21.070 -4.374 1.00 0.00 H new ATOM 983 N ALA A 402 12.783 -16.122 -6.059 1.00 0.00 N ATOM 984 CA ALA A 402 14.192 -16.530 -6.117 1.00 0.00 C ATOM 985 C ALA A 402 15.163 -15.328 -6.015 1.00 0.00 C ATOM 986 O ALA A 402 16.361 -15.517 -5.801 1.00 0.00 O ATOM 987 CB ALA A 402 14.430 -17.474 -7.307 1.00 0.00 C ATOM 0 H ALA A 402 12.341 -16.114 -6.978 1.00 0.00 H new ATOM 0 HA ALA A 402 14.429 -17.115 -5.228 1.00 0.00 H new ATOM 0 HB1 ALA A 402 15.480 -17.767 -7.335 1.00 0.00 H new ATOM 0 HB2 ALA A 402 13.808 -18.363 -7.197 1.00 0.00 H new ATOM 0 HB3 ALA A 402 14.171 -16.963 -8.234 1.00 0.00 H new ATOM 993 N CYS A 403 14.640 -14.093 -6.094 1.00 0.00 N ATOM 994 CA CYS A 403 15.315 -12.816 -5.852 1.00 0.00 C ATOM 995 C CYS A 403 15.363 -12.624 -4.312 1.00 0.00 C ATOM 996 O CYS A 403 14.817 -11.693 -3.724 1.00 0.00 O ATOM 997 CB CYS A 403 14.639 -11.650 -6.589 1.00 0.00 C ATOM 998 SG CYS A 403 15.401 -10.040 -6.189 1.00 0.00 S ATOM 0 H CYS A 403 13.662 -13.956 -6.348 1.00 0.00 H new ATOM 0 HA CYS A 403 16.327 -12.829 -6.256 1.00 0.00 H new ATOM 0 HB2 CYS A 403 14.698 -11.820 -7.664 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.581 -11.623 -6.328 1.00 0.00 H new ATOM 0 HG CYS A 403 14.504 -9.251 -5.676 1.00 0.00 H new ATOM 1003 N GLN A 404 15.935 -13.640 -3.676 1.00 0.00 N ATOM 1004 CA GLN A 404 16.185 -13.954 -2.258 1.00 0.00 C ATOM 1005 C GLN A 404 16.464 -12.774 -1.294 1.00 0.00 C ATOM 1006 O GLN A 404 16.447 -12.978 -0.078 1.00 0.00 O ATOM 1007 CB GLN A 404 17.301 -15.021 -2.231 1.00 0.00 C ATOM 1008 CG GLN A 404 17.510 -15.719 -0.874 1.00 0.00 C ATOM 1009 CD GLN A 404 18.482 -16.898 -0.953 1.00 0.00 C ATOM 1010 OE1 GLN A 404 19.483 -16.886 -1.661 1.00 0.00 O ATOM 1011 NE2 GLN A 404 18.237 -17.969 -0.225 1.00 0.00 N ATOM 0 H GLN A 404 16.302 -14.403 -4.244 1.00 0.00 H new ATOM 0 HA GLN A 404 15.245 -14.318 -1.844 1.00 0.00 H new ATOM 0 HB2 GLN A 404 17.074 -15.780 -2.980 1.00 0.00 H new ATOM 0 HB3 GLN A 404 18.238 -14.550 -2.527 1.00 0.00 H new ATOM 0 HG2 GLN A 404 17.885 -14.993 -0.152 1.00 0.00 H new ATOM 0 HG3 GLN A 404 16.549 -16.072 -0.501 1.00 0.00 H new ATOM 0 HE21 GLN A 404 17.410 -18.002 0.372 1.00 0.00 H new ATOM 0 HE22 GLN A 404 18.874 -18.765 -0.258 1.00 0.00 H new ATOM 1020 N VAL A 405 16.671 -11.545 -1.787 1.00 0.00 N ATOM 1021 CA VAL A 405 16.811 -10.324 -0.972 1.00 0.00 C ATOM 1022 C VAL A 405 15.583 -10.238 -0.063 1.00 0.00 C ATOM 1023 O VAL A 405 14.461 -10.184 -0.563 1.00 0.00 O ATOM 1024 CB VAL A 405 16.886 -9.048 -1.838 1.00 0.00 C ATOM 1025 CG1 VAL A 405 17.306 -7.855 -0.972 1.00 0.00 C ATOM 1026 CG2 VAL A 405 17.884 -9.154 -2.994 1.00 0.00 C ATOM 0 H VAL A 405 16.748 -11.365 -2.788 1.00 0.00 H new ATOM 0 HA VAL A 405 17.739 -10.384 -0.404 1.00 0.00 H new ATOM 0 HB VAL A 405 15.890 -8.915 -2.259 1.00 0.00 H new ATOM 0 HG11 VAL A 405 17.357 -6.958 -1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.575 -7.708 -0.177 1.00 0.00 H new ATOM 0 HG13 VAL A 405 18.285 -8.050 -0.534 1.00 0.00 H new ATOM 0 HG21 VAL A 405 17.885 -8.223 -3.560 1.00 0.00 H new ATOM 0 HG22 VAL A 405 18.882 -9.338 -2.597 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.596 -9.977 -3.649 1.00 0.00 H new ATOM 1036 N ALA A 406 15.786 -10.288 1.257 1.00 0.00 N ATOM 1037 CA ALA A 406 14.732 -10.368 2.274 1.00 0.00 C ATOM 1038 C ALA A 406 13.436 -9.607 1.948 1.00 0.00 C ATOM 1039 O ALA A 406 12.359 -10.208 1.852 1.00 0.00 O ATOM 1040 CB ALA A 406 15.326 -9.895 3.602 1.00 0.00 C ATOM 0 H ALA A 406 16.722 -10.273 1.662 1.00 0.00 H new ATOM 0 HA ALA A 406 14.412 -11.409 2.319 1.00 0.00 H new ATOM 0 HB1 ALA A 406 14.564 -9.943 4.379 1.00 0.00 H new ATOM 0 HB2 ALA A 406 16.164 -10.537 3.875 1.00 0.00 H new ATOM 0 HB3 ALA A 406 15.675 -8.867 3.499 1.00 0.00 H new ATOM 1046 N HIS A 407 13.561 -8.291 1.762 1.00 0.00 N ATOM 1047 CA HIS A 407 12.433 -7.415 1.470 1.00 0.00 C ATOM 1048 C HIS A 407 11.678 -7.806 0.196 1.00 0.00 C ATOM 1049 O HIS A 407 10.468 -7.972 0.288 1.00 0.00 O ATOM 1050 CB HIS A 407 12.860 -5.935 1.479 1.00 0.00 C ATOM 1051 CG HIS A 407 13.998 -5.551 0.560 1.00 0.00 C ATOM 1052 ND1 HIS A 407 15.280 -5.232 0.952 1.00 0.00 N ATOM 1053 CD2 HIS A 407 13.929 -5.328 -0.790 1.00 0.00 C ATOM 1054 CE1 HIS A 407 15.965 -4.833 -0.133 1.00 0.00 C ATOM 1055 NE2 HIS A 407 15.183 -4.883 -1.225 1.00 0.00 N ATOM 0 H HIS A 407 14.456 -7.804 1.811 1.00 0.00 H new ATOM 0 HA HIS A 407 11.713 -7.550 2.277 1.00 0.00 H new ATOM 0 HB2 HIS A 407 11.992 -5.329 1.218 1.00 0.00 H new ATOM 0 HB3 HIS A 407 13.140 -5.668 2.498 1.00 0.00 H new ATOM 0 HD2 HIS A 407 13.057 -5.471 -1.412 1.00 0.00 H new ATOM 0 HE1 HIS A 407 16.998 -4.517 -0.128 1.00 0.00 H new ATOM 0 HE2 HIS A 407 15.450 -4.644 -2.180 1.00 0.00 H new ATOM 1063 N CYS A 408 12.349 -7.993 -0.949 1.00 0.00 N ATOM 1064 CA CYS A 408 11.724 -8.338 -2.240 1.00 0.00 C ATOM 1065 C CYS A 408 11.185 -9.779 -2.278 1.00 0.00 C ATOM 1066 O CYS A 408 10.039 -9.984 -2.681 1.00 0.00 O ATOM 1067 CB CYS A 408 12.783 -8.124 -3.338 1.00 0.00 C ATOM 1068 SG CYS A 408 12.152 -8.589 -4.984 1.00 0.00 S ATOM 0 H CYS A 408 13.364 -7.907 -1.008 1.00 0.00 H new ATOM 0 HA CYS A 408 10.857 -7.696 -2.397 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.090 -7.078 -3.348 1.00 0.00 H new ATOM 0 HB3 CYS A 408 13.670 -8.715 -3.108 1.00 0.00 H new ATOM 0 HG CYS A 408 10.978 -9.133 -4.861 1.00 0.00 H new ATOM 1073 N ALA A 409 11.956 -10.769 -1.816 1.00 0.00 N ATOM 1074 CA ALA A 409 11.507 -12.161 -1.758 1.00 0.00 C ATOM 1075 C ALA A 409 10.218 -12.274 -0.918 1.00 0.00 C ATOM 1076 O ALA A 409 9.229 -12.884 -1.353 1.00 0.00 O ATOM 1077 CB ALA A 409 12.649 -13.049 -1.241 1.00 0.00 C ATOM 0 H ALA A 409 12.906 -10.627 -1.473 1.00 0.00 H new ATOM 0 HA ALA A 409 11.252 -12.517 -2.756 1.00 0.00 H new ATOM 0 HB1 ALA A 409 12.313 -14.085 -1.198 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.503 -12.972 -1.914 1.00 0.00 H new ATOM 0 HB3 ALA A 409 12.942 -12.721 -0.244 1.00 0.00 H new ATOM 1083 N SER A 410 10.191 -11.626 0.257 1.00 0.00 N ATOM 1084 CA SER A 410 8.980 -11.583 1.089 1.00 0.00 C ATOM 1085 C SER A 410 7.870 -10.830 0.351 1.00 0.00 C ATOM 1086 O SER A 410 6.799 -11.385 0.135 1.00 0.00 O ATOM 1087 CB SER A 410 9.250 -10.934 2.452 1.00 0.00 C ATOM 1088 OG SER A 410 10.234 -11.661 3.169 1.00 0.00 O ATOM 0 H SER A 410 10.989 -11.128 0.650 1.00 0.00 H new ATOM 0 HA SER A 410 8.662 -12.609 1.274 1.00 0.00 H new ATOM 0 HB2 SER A 410 9.582 -9.905 2.311 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.327 -10.894 3.030 1.00 0.00 H new ATOM 0 HG SER A 410 11.126 -11.355 2.902 1.00 0.00 H new ATOM 1094 N SER A 411 8.144 -9.600 -0.096 1.00 0.00 N ATOM 1095 CA SER A 411 7.252 -8.710 -0.861 1.00 0.00 C ATOM 1096 C SER A 411 6.516 -9.409 -2.004 1.00 0.00 C ATOM 1097 O SER A 411 5.289 -9.345 -2.079 1.00 0.00 O ATOM 1098 CB SER A 411 8.114 -7.550 -1.388 1.00 0.00 C ATOM 1099 OG SER A 411 8.202 -6.539 -0.408 1.00 0.00 O ATOM 0 H SER A 411 9.052 -9.168 0.076 1.00 0.00 H new ATOM 0 HA SER A 411 6.461 -8.355 -0.200 1.00 0.00 H new ATOM 0 HB2 SER A 411 9.111 -7.911 -1.642 1.00 0.00 H new ATOM 0 HB3 SER A 411 7.678 -7.147 -2.302 1.00 0.00 H new ATOM 0 HG SER A 411 8.985 -6.700 0.159 1.00 0.00 H new ATOM 1105 N ARG A 412 7.232 -10.127 -2.873 1.00 0.00 N ATOM 1106 CA ARG A 412 6.631 -10.902 -3.966 1.00 0.00 C ATOM 1107 C ARG A 412 5.843 -12.095 -3.434 1.00 0.00 C ATOM 1108 O ARG A 412 4.765 -12.344 -3.962 1.00 0.00 O ATOM 1109 CB ARG A 412 7.711 -11.336 -4.967 1.00 0.00 C ATOM 1110 CG ARG A 412 7.942 -10.267 -6.051 1.00 0.00 C ATOM 1111 CD ARG A 412 6.999 -10.429 -7.256 1.00 0.00 C ATOM 1112 NE ARG A 412 7.517 -9.725 -8.453 1.00 0.00 N ATOM 1113 CZ ARG A 412 7.912 -10.255 -9.600 1.00 0.00 C ATOM 1114 NH1 ARG A 412 7.814 -11.528 -9.865 1.00 0.00 N ATOM 1115 NH2 ARG A 412 8.423 -9.496 -10.522 1.00 0.00 N ATOM 0 H ARG A 412 8.250 -10.189 -2.840 1.00 0.00 H new ATOM 0 HA ARG A 412 5.921 -10.263 -4.491 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.644 -11.525 -4.437 1.00 0.00 H new ATOM 0 HB3 ARG A 412 7.416 -12.274 -5.437 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.802 -9.278 -5.615 1.00 0.00 H new ATOM 0 HG3 ARG A 412 8.975 -10.321 -6.394 1.00 0.00 H new ATOM 0 HD2 ARG A 412 6.875 -11.488 -7.482 1.00 0.00 H new ATOM 0 HD3 ARG A 412 6.013 -10.039 -7.002 1.00 0.00 H new ATOM 0 HE ARG A 412 7.576 -8.709 -8.385 1.00 0.00 H new ATOM 0 HH11 ARG A 412 7.418 -12.164 -9.173 1.00 0.00 H new ATOM 0 HH12 ARG A 412 8.133 -11.888 -10.765 1.00 0.00 H new ATOM 0 HH21 ARG A 412 8.519 -8.493 -10.362 1.00 0.00 H new ATOM 0 HH22 ARG A 412 8.728 -9.903 -11.406 1.00 0.00 H new ATOM 1129 N GLN A 413 6.299 -12.800 -2.390 1.00 0.00 N ATOM 1130 CA GLN A 413 5.487 -13.890 -1.812 1.00 0.00 C ATOM 1131 C GLN A 413 4.143 -13.385 -1.236 1.00 0.00 C ATOM 1132 O GLN A 413 3.094 -13.950 -1.561 1.00 0.00 O ATOM 1133 CB GLN A 413 6.293 -14.673 -0.766 1.00 0.00 C ATOM 1134 CG GLN A 413 7.302 -15.613 -1.442 1.00 0.00 C ATOM 1135 CD GLN A 413 8.258 -16.229 -0.426 1.00 0.00 C ATOM 1136 OE1 GLN A 413 8.108 -17.360 0.017 1.00 0.00 O ATOM 1137 NE2 GLN A 413 9.273 -15.498 -0.020 1.00 0.00 N ATOM 0 H GLN A 413 7.199 -12.646 -1.936 1.00 0.00 H new ATOM 0 HA GLN A 413 5.234 -14.571 -2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 413 6.819 -13.978 -0.112 1.00 0.00 H new ATOM 0 HB3 GLN A 413 5.616 -15.251 -0.138 1.00 0.00 H new ATOM 0 HG2 GLN A 413 6.768 -16.405 -1.968 1.00 0.00 H new ATOM 0 HG3 GLN A 413 7.871 -15.061 -2.190 1.00 0.00 H new ATOM 0 HE21 GLN A 413 9.401 -14.555 -0.387 1.00 0.00 H new ATOM 0 HE22 GLN A 413 9.932 -15.874 0.662 1.00 0.00 H new ATOM 1146 N ILE A 414 4.132 -12.294 -0.451 1.00 0.00 N ATOM 1147 CA ILE A 414 2.873 -11.710 0.054 1.00 0.00 C ATOM 1148 C ILE A 414 1.958 -11.187 -1.048 1.00 0.00 C ATOM 1149 O ILE A 414 0.753 -11.433 -1.015 1.00 0.00 O ATOM 1150 CB ILE A 414 3.025 -10.645 1.168 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.285 -9.761 1.232 1.00 0.00 C ATOM 1152 CG2 ILE A 414 2.529 -11.229 2.499 1.00 0.00 C ATOM 1153 CD1 ILE A 414 5.276 -10.100 2.350 1.00 0.00 C ATOM 0 H ILE A 414 4.973 -11.800 -0.153 1.00 0.00 H new ATOM 0 HA ILE A 414 2.397 -12.572 0.522 1.00 0.00 H new ATOM 0 HB ILE A 414 2.371 -9.831 0.857 1.00 0.00 H new ATOM 0 HG12 ILE A 414 4.805 -9.831 0.277 1.00 0.00 H new ATOM 0 HG13 ILE A 414 3.973 -8.723 1.350 1.00 0.00 H new ATOM 0 HG21 ILE A 414 2.634 -10.482 3.286 1.00 0.00 H new ATOM 0 HG22 ILE A 414 1.480 -11.511 2.404 1.00 0.00 H new ATOM 0 HG23 ILE A 414 3.120 -12.109 2.753 1.00 0.00 H new ATOM 0 HD11 ILE A 414 6.125 -9.418 2.303 1.00 0.00 H new ATOM 0 HD12 ILE A 414 4.782 -9.999 3.317 1.00 0.00 H new ATOM 0 HD13 ILE A 414 5.627 -11.125 2.227 1.00 0.00 H new ATOM 1165 N ILE A 415 2.507 -10.488 -2.038 1.00 0.00 N ATOM 1166 CA ILE A 415 1.690 -10.000 -3.153 1.00 0.00 C ATOM 1167 C ILE A 415 1.226 -11.150 -4.062 1.00 0.00 C ATOM 1168 O ILE A 415 0.131 -11.077 -4.607 1.00 0.00 O ATOM 1169 CB ILE A 415 2.373 -8.798 -3.826 1.00 0.00 C ATOM 1170 CG1 ILE A 415 1.806 -7.513 -3.171 1.00 0.00 C ATOM 1171 CG2 ILE A 415 2.225 -8.816 -5.352 1.00 0.00 C ATOM 1172 CD1 ILE A 415 2.293 -6.202 -3.799 1.00 0.00 C ATOM 0 H ILE A 415 3.497 -10.248 -2.095 1.00 0.00 H new ATOM 0 HA ILE A 415 0.745 -9.596 -2.791 1.00 0.00 H new ATOM 0 HB ILE A 415 3.450 -8.840 -3.666 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.718 -7.544 -3.226 1.00 0.00 H new ATOM 0 HG13 ILE A 415 2.071 -7.514 -2.114 1.00 0.00 H new ATOM 0 HG21 ILE A 415 2.725 -7.946 -5.776 1.00 0.00 H new ATOM 0 HG22 ILE A 415 2.677 -9.724 -5.751 1.00 0.00 H new ATOM 0 HG23 ILE A 415 1.168 -8.791 -5.615 1.00 0.00 H new ATOM 0 HD11 ILE A 415 1.843 -5.359 -3.275 1.00 0.00 H new ATOM 0 HD12 ILE A 415 3.378 -6.142 -3.720 1.00 0.00 H new ATOM 0 HD13 ILE A 415 2.004 -6.172 -4.850 1.00 0.00 H new ATOM 1184 N SER A 416 1.974 -12.250 -4.171 1.00 0.00 N ATOM 1185 CA SER A 416 1.532 -13.450 -4.889 1.00 0.00 C ATOM 1186 C SER A 416 0.328 -14.066 -4.166 1.00 0.00 C ATOM 1187 O SER A 416 -0.668 -14.395 -4.817 1.00 0.00 O ATOM 1188 CB SER A 416 2.662 -14.454 -5.052 1.00 0.00 C ATOM 1189 OG SER A 416 2.225 -15.574 -5.804 1.00 0.00 O ATOM 0 H SER A 416 2.905 -12.335 -3.764 1.00 0.00 H new ATOM 0 HA SER A 416 1.226 -13.163 -5.895 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.508 -13.981 -5.551 1.00 0.00 H new ATOM 0 HB3 SER A 416 3.011 -14.780 -4.072 1.00 0.00 H new ATOM 0 HG SER A 416 2.964 -16.211 -5.902 1.00 0.00 H new ATOM 1195 N HIS A 417 0.353 -14.131 -2.820 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.831 -14.528 -2.046 1.00 0.00 C ATOM 1197 C HIS A 417 -1.992 -13.576 -2.383 1.00 0.00 C ATOM 1198 O HIS A 417 -3.056 -14.034 -2.788 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.562 -14.550 -0.523 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.847 -14.616 0.282 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -2.637 -15.733 0.456 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.594 -13.537 0.690 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.840 -15.334 0.906 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.869 -13.998 1.044 1.00 0.00 N ATOM 0 H HIS A 417 1.174 -13.915 -2.254 1.00 0.00 H new ATOM 0 HA HIS A 417 -1.094 -15.548 -2.325 1.00 0.00 H new ATOM 0 HB2 HIS A 417 0.063 -15.408 -0.278 1.00 0.00 H new ATOM 0 HB3 HIS A 417 -0.003 -13.658 -0.241 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -2.257 -12.512 0.731 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -4.666 -15.994 1.125 1.00 0.00 H new ATOM 0 HE2 HIS A 417 -4.662 -13.432 1.346 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.781 -12.258 -2.273 1.00 0.00 N ATOM 1213 CA TRP A 418 -2.792 -11.233 -2.566 1.00 0.00 C ATOM 1214 C TRP A 418 -3.402 -11.352 -3.977 1.00 0.00 C ATOM 1215 O TRP A 418 -4.613 -11.190 -4.143 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.169 -9.850 -2.345 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.131 -8.707 -2.335 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -3.995 -8.419 -1.336 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -3.340 -7.683 -3.356 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -4.723 -7.291 -1.665 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -4.361 -6.796 -2.900 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -2.768 -7.413 -4.621 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -4.793 -5.696 -3.656 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -3.198 -6.312 -5.389 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -4.205 -5.455 -4.911 1.00 0.00 C ATOM 0 H TRP A 418 -0.888 -11.867 -1.973 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.628 -11.385 -1.883 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -1.633 -9.859 -1.396 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -1.430 -9.674 -3.127 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -4.100 -8.984 -0.421 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -5.439 -6.876 -1.068 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -1.992 -8.059 -5.004 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -5.567 -5.043 -3.280 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -2.750 -6.125 -6.354 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -4.526 -4.613 -5.506 1.00 0.00 H new ATOM 1236 N LYS A 419 -2.581 -11.670 -4.991 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.011 -11.874 -6.386 1.00 0.00 C ATOM 1238 C LYS A 419 -3.871 -13.133 -6.557 1.00 0.00 C ATOM 1239 O LYS A 419 -4.881 -13.095 -7.262 1.00 0.00 O ATOM 1240 CB LYS A 419 -1.773 -11.988 -7.294 1.00 0.00 C ATOM 1241 CG LYS A 419 -1.112 -10.633 -7.588 1.00 0.00 C ATOM 1242 CD LYS A 419 0.260 -10.855 -8.247 1.00 0.00 C ATOM 1243 CE LYS A 419 0.979 -9.551 -8.610 1.00 0.00 C ATOM 1244 NZ LYS A 419 0.249 -8.754 -9.633 1.00 0.00 N ATOM 0 H LYS A 419 -1.577 -11.795 -4.862 1.00 0.00 H new ATOM 0 HA LYS A 419 -3.620 -11.014 -6.665 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.043 -12.646 -6.822 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.062 -12.456 -8.235 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -1.750 -10.042 -8.245 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -0.995 -10.067 -6.664 1.00 0.00 H new ATOM 0 HD2 LYS A 419 0.890 -11.433 -7.571 1.00 0.00 H new ATOM 0 HD3 LYS A 419 0.129 -11.452 -9.149 1.00 0.00 H new ATOM 0 HE2 LYS A 419 1.106 -8.949 -7.710 1.00 0.00 H new ATOM 0 HE3 LYS A 419 1.977 -9.783 -8.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 0.813 -7.918 -9.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 0.090 -9.337 -10.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -0.667 -8.448 -9.246 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.463 -14.246 -5.943 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.150 -15.539 -6.049 1.00 0.00 C ATOM 1260 C ASN A 420 -5.395 -15.684 -5.146 1.00 0.00 C ATOM 1261 O ASN A 420 -6.330 -16.405 -5.503 1.00 0.00 O ATOM 1262 CB ASN A 420 -3.126 -16.654 -5.772 1.00 0.00 C ATOM 1263 CG ASN A 420 -2.180 -16.868 -6.945 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -2.502 -17.540 -7.915 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -0.995 -16.302 -6.912 1.00 0.00 N ATOM 0 H ASN A 420 -2.634 -14.277 -5.349 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.546 -15.615 -7.062 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.548 -16.402 -4.883 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.653 -17.584 -5.557 1.00 0.00 H new ATOM 0 HD21 ASN A 420 -0.350 -16.424 -7.692 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -0.720 -15.740 -6.106 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.409 -15.035 -3.979 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.471 -15.097 -2.983 1.00 0.00 C ATOM 1274 C CYS A 421 -7.776 -14.399 -3.415 1.00 0.00 C ATOM 1275 O CYS A 421 -7.780 -13.280 -3.940 1.00 0.00 O ATOM 1276 CB CYS A 421 -5.927 -14.499 -1.678 1.00 0.00 C ATOM 1277 SG CYS A 421 -7.037 -14.799 -0.267 1.00 0.00 S ATOM 0 H CYS A 421 -4.643 -14.425 -3.694 1.00 0.00 H new ATOM 0 HA CYS A 421 -6.750 -16.142 -2.849 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -4.948 -14.927 -1.465 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -5.785 -13.426 -1.804 1.00 0.00 H new ATOM 0 HG CYS A 421 -6.592 -15.802 0.430 1.00 0.00 H new ATOM 1282 N THR A 422 -8.891 -15.077 -3.149 1.00 0.00 N ATOM 1283 CA THR A 422 -10.278 -14.639 -3.402 1.00 0.00 C ATOM 1284 C THR A 422 -11.154 -14.745 -2.141 1.00 0.00 C ATOM 1285 O THR A 422 -12.361 -14.491 -2.188 1.00 0.00 O ATOM 1286 CB THR A 422 -10.904 -15.475 -4.535 1.00 0.00 C ATOM 1287 OG1 THR A 422 -10.978 -16.837 -4.152 1.00 0.00 O ATOM 1288 CG2 THR A 422 -10.073 -15.413 -5.816 1.00 0.00 C ATOM 0 H THR A 422 -8.857 -16.004 -2.725 1.00 0.00 H new ATOM 0 HA THR A 422 -10.236 -13.590 -3.697 1.00 0.00 H new ATOM 0 HB THR A 422 -11.894 -15.058 -4.720 1.00 0.00 H new ATOM 0 HG1 THR A 422 -11.379 -17.360 -4.878 1.00 0.00 H new ATOM 0 HG21 THR A 422 -10.550 -16.016 -6.589 1.00 0.00 H new ATOM 0 HG22 THR A 422 -10.003 -14.379 -6.154 1.00 0.00 H new ATOM 0 HG23 THR A 422 -9.073 -15.800 -5.620 1.00 0.00 H new ATOM 1296 N ARG A 423 -10.555 -15.128 -1.001 1.00 0.00 N ATOM 1297 CA ARG A 423 -11.215 -15.350 0.293 1.00 0.00 C ATOM 1298 C ARG A 423 -11.856 -14.079 0.878 1.00 0.00 C ATOM 1299 O ARG A 423 -11.249 -13.006 0.929 1.00 0.00 O ATOM 1300 CB ARG A 423 -10.191 -16.005 1.244 1.00 0.00 C ATOM 1301 CG ARG A 423 -10.826 -16.462 2.561 1.00 0.00 C ATOM 1302 CD ARG A 423 -9.849 -17.188 3.488 1.00 0.00 C ATOM 1303 NE ARG A 423 -10.514 -17.479 4.770 1.00 0.00 N ATOM 1304 CZ ARG A 423 -9.975 -17.965 5.871 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -8.724 -18.329 5.931 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -10.701 -18.100 6.942 1.00 0.00 N ATOM 0 H ARG A 423 -9.550 -15.299 -0.956 1.00 0.00 H new ATOM 0 HA ARG A 423 -12.062 -16.022 0.152 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -9.734 -16.861 0.748 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -9.391 -15.296 1.456 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -11.231 -15.594 3.081 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -11.665 -17.122 2.341 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -9.510 -18.114 3.023 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -8.965 -16.573 3.656 1.00 0.00 H new ATOM 0 HE ARG A 423 -11.514 -17.280 4.811 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -8.127 -18.242 5.108 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -8.342 -18.701 6.801 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -11.685 -17.830 6.929 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -10.287 -18.476 7.795 1.00 0.00 H new ATOM 1320 N HIS A 424 -13.098 -14.227 1.339 1.00 0.00 N ATOM 1321 CA HIS A 424 -13.935 -13.193 1.950 1.00 0.00 C ATOM 1322 C HIS A 424 -13.600 -12.902 3.434 1.00 0.00 C ATOM 1323 O HIS A 424 -14.133 -11.958 4.015 1.00 0.00 O ATOM 1324 CB HIS A 424 -15.400 -13.644 1.790 1.00 0.00 C ATOM 1325 CG HIS A 424 -16.433 -12.577 2.066 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -16.882 -11.627 1.174 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -17.139 -12.403 3.227 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -17.832 -10.895 1.783 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -18.025 -11.331 3.042 1.00 0.00 N ATOM 0 H HIS A 424 -13.576 -15.127 1.293 1.00 0.00 H new ATOM 0 HA HIS A 424 -13.746 -12.248 1.441 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -15.542 -14.011 0.773 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -15.580 -14.484 2.460 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -17.032 -12.989 4.128 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -18.365 -10.074 1.327 1.00 0.00 H new ATOM 0 HE2 HIS A 424 -18.684 -10.957 3.725 1.00 0.00 H new ATOM 1337 N ASP A 425 -12.757 -13.727 4.067 1.00 0.00 N ATOM 1338 CA ASP A 425 -12.406 -13.696 5.496 1.00 0.00 C ATOM 1339 C ASP A 425 -10.942 -14.092 5.796 1.00 0.00 C ATOM 1340 O ASP A 425 -10.665 -14.853 6.725 1.00 0.00 O ATOM 1341 CB ASP A 425 -13.429 -14.536 6.289 1.00 0.00 C ATOM 1342 CG ASP A 425 -13.284 -16.057 6.072 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -13.178 -16.515 4.910 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -13.224 -16.820 7.065 1.00 0.00 O ATOM 0 H ASP A 425 -12.274 -14.476 3.571 1.00 0.00 H new ATOM 0 HA ASP A 425 -12.463 -12.659 5.828 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -13.320 -14.317 7.351 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -14.436 -14.231 6.003 1.00 0.00 H new ATOM 1349 N CYS A 426 -9.987 -13.579 5.010 1.00 0.00 N ATOM 1350 CA CYS A 426 -8.562 -13.905 5.173 1.00 0.00 C ATOM 1351 C CYS A 426 -7.942 -13.058 6.316 1.00 0.00 C ATOM 1352 O CYS A 426 -8.362 -11.912 6.499 1.00 0.00 O ATOM 1353 CB CYS A 426 -7.897 -13.653 3.818 1.00 0.00 C ATOM 1354 SG CYS A 426 -6.466 -14.733 3.509 1.00 0.00 S ATOM 0 H CYS A 426 -10.177 -12.930 4.247 1.00 0.00 H new ATOM 0 HA CYS A 426 -8.412 -14.945 5.463 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -8.632 -13.800 3.027 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -7.576 -12.612 3.766 1.00 0.00 H new ATOM 0 HG CYS A 426 -6.380 -14.986 2.237 1.00 0.00 H new ATOM 1359 N PRO A 427 -6.939 -13.554 7.073 1.00 0.00 N ATOM 1360 CA PRO A 427 -6.279 -12.834 8.176 1.00 0.00 C ATOM 1361 C PRO A 427 -5.711 -11.444 7.836 1.00 0.00 C ATOM 1362 O PRO A 427 -5.393 -10.674 8.742 1.00 0.00 O ATOM 1363 CB PRO A 427 -5.142 -13.750 8.651 1.00 0.00 C ATOM 1364 CG PRO A 427 -5.572 -15.142 8.204 1.00 0.00 C ATOM 1365 CD PRO A 427 -6.343 -14.866 6.917 1.00 0.00 C ATOM 0 HA PRO A 427 -7.036 -12.625 8.932 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -4.189 -13.465 8.205 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -5.016 -13.700 9.733 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -4.715 -15.793 8.029 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -6.196 -15.631 8.952 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -5.679 -14.891 6.053 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -7.109 -15.624 6.752 1.00 0.00 H new ATOM 1373 N VAL A 428 -5.560 -11.133 6.543 1.00 0.00 N ATOM 1374 CA VAL A 428 -4.992 -9.881 6.015 1.00 0.00 C ATOM 1375 C VAL A 428 -5.931 -9.220 4.989 1.00 0.00 C ATOM 1376 O VAL A 428 -6.171 -8.005 5.055 1.00 0.00 O ATOM 1377 CB VAL A 428 -3.604 -10.173 5.423 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -2.927 -8.852 5.038 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -2.693 -10.906 6.416 1.00 0.00 C ATOM 0 H VAL A 428 -5.842 -11.774 5.801 1.00 0.00 H new ATOM 0 HA VAL A 428 -4.884 -9.164 6.829 1.00 0.00 H new ATOM 0 HB VAL A 428 -3.751 -10.812 4.552 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -1.942 -9.057 4.618 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.536 -8.333 4.298 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -2.820 -8.226 5.924 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -1.724 -11.090 5.953 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -2.559 -10.293 7.307 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -3.149 -11.856 6.695 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.538 -10.018 4.100 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.567 -9.540 3.182 1.00 0.00 C ATOM 1391 C CYS A 429 -8.791 -8.947 3.886 1.00 0.00 C ATOM 1392 O CYS A 429 -9.184 -7.858 3.496 1.00 0.00 O ATOM 1393 CB CYS A 429 -7.939 -10.558 2.092 1.00 0.00 C ATOM 1394 SG CYS A 429 -6.537 -11.635 1.638 1.00 0.00 S ATOM 0 H CYS A 429 -6.326 -11.011 4.001 1.00 0.00 H new ATOM 0 HA CYS A 429 -7.102 -8.706 2.657 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.768 -11.173 2.441 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.287 -10.027 1.206 1.00 0.00 H new ATOM 0 HG CYS A 429 -6.978 -12.669 0.984 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.382 -9.577 4.912 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.510 -8.989 5.639 1.00 0.00 C ATOM 1401 C LEU A 430 -10.187 -7.577 6.189 1.00 0.00 C ATOM 1402 O LEU A 430 -10.900 -6.631 5.836 1.00 0.00 O ATOM 1403 CB LEU A 430 -11.053 -9.963 6.685 1.00 0.00 C ATOM 1404 CG LEU A 430 -12.557 -10.193 6.572 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -13.040 -11.049 7.748 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -13.439 -8.955 6.519 1.00 0.00 C ATOM 0 H LEU A 430 -9.095 -10.494 5.255 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.322 -8.823 4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -10.538 -10.918 6.584 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -10.825 -9.581 7.680 1.00 0.00 H new ATOM 0 HG LEU A 430 -12.666 -10.681 5.603 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -14.115 -11.211 7.663 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -12.526 -12.010 7.734 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -12.823 -10.536 8.685 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -14.484 -9.256 6.439 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -13.298 -8.369 7.427 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -13.168 -8.352 5.653 1.00 0.00 H new ATOM 1418 N PRO A 431 -9.095 -7.387 6.965 1.00 0.00 N ATOM 1419 CA PRO A 431 -8.618 -6.057 7.348 1.00 0.00 C ATOM 1420 C PRO A 431 -8.575 -5.064 6.179 1.00 0.00 C ATOM 1421 O PRO A 431 -9.173 -3.992 6.259 1.00 0.00 O ATOM 1422 CB PRO A 431 -7.195 -6.281 7.861 1.00 0.00 C ATOM 1423 CG PRO A 431 -7.243 -7.680 8.458 1.00 0.00 C ATOM 1424 CD PRO A 431 -8.208 -8.408 7.523 1.00 0.00 C ATOM 0 HA PRO A 431 -9.294 -5.621 8.083 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -6.464 -6.214 7.055 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -6.916 -5.537 8.607 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -6.259 -8.149 8.471 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -7.605 -7.670 9.486 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -7.665 -8.925 6.732 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -8.778 -9.163 8.065 1.00 0.00 H new ATOM 1432 N LEU A 432 -7.889 -5.413 5.082 1.00 0.00 N ATOM 1433 CA LEU A 432 -7.769 -4.533 3.904 1.00 0.00 C ATOM 1434 C LEU A 432 -9.101 -4.286 3.184 1.00 0.00 C ATOM 1435 O LEU A 432 -9.310 -3.217 2.613 1.00 0.00 O ATOM 1436 CB LEU A 432 -6.766 -5.142 2.919 1.00 0.00 C ATOM 1437 CG LEU A 432 -5.353 -4.622 3.247 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -4.312 -5.656 2.829 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -5.061 -3.293 2.545 1.00 0.00 C ATOM 0 H LEU A 432 -7.404 -6.305 4.983 1.00 0.00 H new ATOM 0 HA LEU A 432 -7.426 -3.565 4.269 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -6.790 -6.230 2.983 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -7.036 -4.877 1.897 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.303 -4.454 4.323 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -3.315 -5.283 3.063 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.487 -6.587 3.368 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -4.389 -5.837 1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -4.055 -2.959 2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -5.135 -3.428 1.466 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -5.785 -2.545 2.867 1.00 0.00 H new