USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=22 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= -0.577 X(o=-2.6,f=-2.8) USER MOD Set 1.2: A 421 CYS SG : rot -100:sc= 0.486 USER MOD Set 1.3: A 426 CYS SG : rot -140:sc= -1.32 USER MOD Set 1.4: A 429 CYS SG : rot 142:sc= -1.15 USER MOD Set 2.1: A 401 LYS NZ :NH3+ -176:sc= 1.01 (180deg=0) USER MOD Set 2.2: A 413 GLN : amide:sc= 0.639 K(o=1.7,f=-5.1!) USER MOD Set 2.3: A 416 SER OG : rot -120:sc= 0.0336 USER MOD Set 3.1: A 393 HIS :FLIP no HE2:sc= -0.432 F(o=-0.85,f=0.055) USER MOD Set 3.2: A 397 CYS SG : rot -179:sc= 0.0188 USER MOD Set 3.3: A 403 CYS SG : rot -60:sc= -0.0125 USER MOD Set 3.4: A 408 CYS SG : rot -146:sc= 0.481 USER MOD Set 4.1: A 392 ASN : amide:sc= 0 X(o=0.89,f=0.56) USER MOD Set 4.2: A 396 HIS : no HE2:sc= 0.892 K(o=0.89,f=-2.7!) USER MOD Set 5.1: A 394 MET CE :methyl 157:sc= -0.18 (180deg=-0.183) USER MOD Set 5.2: A 411 SER OG : rot -47:sc= 1.15 USER MOD Set 6.1: A 362 HIS : no HE2:sc= -0.879 X(o=1.9,f=1.8) USER MOD Set 6.2: A 366 CYS SG : rot -145:sc= 0.957 USER MOD Set 6.3: A 384 CYS SG : rot 116:sc= -0.631 USER MOD Set 6.4: A 388 LYS NZ :NH3+ 175:sc= 2.44 (180deg=0.981) USER MOD Set 7.1: A 356 GLN : amide:sc= -0.131 X(o=-0.25,f=-0.32) USER MOD Set 7.2: A 387 MET CE :methyl -143:sc= -0.114 (180deg=-1.05) USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 354 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 355 GLN : amide:sc= 0.22 X(o=0.22,f=-0.0084) 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= 0.602 K(o=0.6,f=-0.08) USER MOD Single : A 383 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 395 THR OG1 : rot 180:sc= 0 USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 404 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 407 HIS : no HD1:sc=-0.00773 X(o=-0.0077,f=-0.0077) USER MOD Single : A 410 SER OG : rot 83:sc= 0.812 USER MOD Single : A 419 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0111) USER MOD Single : A 420 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0.00318 USER MOD Single : A 424 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 84 N PRO A 347 5.506 -15.893 15.610 1.00 0.00 N ATOM 85 CA PRO A 347 4.468 -14.858 15.503 1.00 0.00 C ATOM 86 C PRO A 347 4.975 -13.507 14.983 1.00 0.00 C ATOM 87 O PRO A 347 4.224 -12.791 14.330 1.00 0.00 O ATOM 88 CB PRO A 347 3.872 -14.725 16.911 1.00 0.00 C ATOM 89 CG PRO A 347 4.238 -16.043 17.592 1.00 0.00 C ATOM 90 CD PRO A 347 5.601 -16.350 16.981 1.00 0.00 C ATOM 0 HA PRO A 347 3.729 -15.158 14.760 1.00 0.00 H new ATOM 0 HB2 PRO A 347 4.291 -13.871 17.443 1.00 0.00 H new ATOM 0 HB3 PRO A 347 2.792 -14.580 16.876 1.00 0.00 H new ATOM 0 HG2 PRO A 347 4.291 -15.941 18.676 1.00 0.00 H new ATOM 0 HG3 PRO A 347 3.511 -16.827 17.381 1.00 0.00 H new ATOM 0 HD2 PRO A 347 6.399 -15.834 17.515 1.00 0.00 H new ATOM 0 HD3 PRO A 347 5.824 -17.416 17.028 1.00 0.00 H new ATOM 98 N GLU A 348 6.247 -13.161 15.208 1.00 0.00 N ATOM 99 CA GLU A 348 6.866 -11.923 14.706 1.00 0.00 C ATOM 100 C GLU A 348 6.839 -11.858 13.173 1.00 0.00 C ATOM 101 O GLU A 348 6.561 -10.812 12.593 1.00 0.00 O ATOM 102 CB GLU A 348 8.291 -11.756 15.268 1.00 0.00 C ATOM 103 CG GLU A 348 9.266 -12.899 14.943 1.00 0.00 C ATOM 104 CD GLU A 348 10.646 -12.640 15.578 1.00 0.00 C ATOM 105 OE1 GLU A 348 10.856 -13.011 16.758 1.00 0.00 O ATOM 106 OE2 GLU A 348 11.534 -12.068 14.899 1.00 0.00 O ATOM 0 H GLU A 348 6.887 -13.740 15.752 1.00 0.00 H new ATOM 0 HA GLU A 348 6.272 -11.082 15.064 1.00 0.00 H new ATOM 0 HB2 GLU A 348 8.708 -10.825 14.884 1.00 0.00 H new ATOM 0 HB3 GLU A 348 8.226 -11.653 16.351 1.00 0.00 H new ATOM 0 HG2 GLU A 348 8.863 -13.842 15.311 1.00 0.00 H new ATOM 0 HG3 GLU A 348 9.371 -12.997 13.862 1.00 0.00 H new ATOM 113 N LYS A 349 7.035 -13.005 12.520 1.00 0.00 N ATOM 114 CA LYS A 349 6.985 -13.205 11.078 1.00 0.00 C ATOM 115 C LYS A 349 5.564 -12.999 10.576 1.00 0.00 C ATOM 116 O LYS A 349 5.390 -12.367 9.551 1.00 0.00 O ATOM 117 CB LYS A 349 7.495 -14.624 10.770 1.00 0.00 C ATOM 118 CG LYS A 349 7.952 -14.821 9.313 1.00 0.00 C ATOM 119 CD LYS A 349 9.193 -14.014 8.894 1.00 0.00 C ATOM 120 CE LYS A 349 10.422 -14.360 9.747 1.00 0.00 C ATOM 121 NZ LYS A 349 11.631 -13.622 9.297 1.00 0.00 N ATOM 0 H LYS A 349 7.246 -13.870 13.018 1.00 0.00 H new ATOM 0 HA LYS A 349 7.619 -12.481 10.565 1.00 0.00 H new ATOM 0 HB2 LYS A 349 8.327 -14.853 11.435 1.00 0.00 H new ATOM 0 HB3 LYS A 349 6.704 -15.340 10.992 1.00 0.00 H new ATOM 0 HG2 LYS A 349 8.158 -15.880 9.155 1.00 0.00 H new ATOM 0 HG3 LYS A 349 7.127 -14.555 8.652 1.00 0.00 H new ATOM 0 HD2 LYS A 349 9.414 -14.209 7.845 1.00 0.00 H new ATOM 0 HD3 LYS A 349 8.979 -12.949 8.982 1.00 0.00 H new ATOM 0 HE2 LYS A 349 10.219 -14.122 10.791 1.00 0.00 H new ATOM 0 HE3 LYS A 349 10.610 -15.432 9.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 12.440 -13.882 9.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 11.840 -13.868 8.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 11.460 -12.599 9.370 1.00 0.00 H new ATOM 135 N ARG A 350 4.553 -13.473 11.311 1.00 0.00 N ATOM 136 CA ARG A 350 3.114 -13.330 11.005 1.00 0.00 C ATOM 137 C ARG A 350 2.717 -11.864 10.881 1.00 0.00 C ATOM 138 O ARG A 350 2.299 -11.436 9.801 1.00 0.00 O ATOM 139 CB ARG A 350 2.268 -14.118 12.035 1.00 0.00 C ATOM 140 CG ARG A 350 2.764 -15.551 12.295 1.00 0.00 C ATOM 141 CD ARG A 350 2.671 -16.491 11.098 1.00 0.00 C ATOM 142 NE ARG A 350 3.435 -17.731 11.341 1.00 0.00 N ATOM 143 CZ ARG A 350 3.089 -18.967 11.040 1.00 0.00 C ATOM 144 NH1 ARG A 350 1.962 -19.273 10.460 1.00 0.00 N ATOM 145 NH2 ARG A 350 3.896 -19.932 11.345 1.00 0.00 N ATOM 0 H ARG A 350 4.716 -13.991 12.175 1.00 0.00 H new ATOM 0 HA ARG A 350 2.908 -13.770 10.029 1.00 0.00 H new ATOM 0 HB2 ARG A 350 2.262 -13.571 12.978 1.00 0.00 H new ATOM 0 HB3 ARG A 350 1.237 -14.161 11.685 1.00 0.00 H new ATOM 0 HG2 ARG A 350 3.802 -15.506 12.623 1.00 0.00 H new ATOM 0 HG3 ARG A 350 2.188 -15.976 13.117 1.00 0.00 H new ATOM 0 HD2 ARG A 350 1.627 -16.735 10.902 1.00 0.00 H new ATOM 0 HD3 ARG A 350 3.054 -15.992 10.208 1.00 0.00 H new ATOM 0 HE ARG A 350 4.340 -17.617 11.797 1.00 0.00 H new ATOM 0 HH11 ARG A 350 1.298 -18.538 10.217 1.00 0.00 H new ATOM 0 HH12 ARG A 350 1.745 -20.247 10.250 1.00 0.00 H new ATOM 0 HH21 ARG A 350 4.781 -19.729 11.810 1.00 0.00 H new ATOM 0 HH22 ARG A 350 3.647 -20.895 11.121 1.00 0.00 H new ATOM 159 N LYS A 351 2.931 -11.082 11.944 1.00 0.00 N ATOM 160 CA LYS A 351 2.695 -9.621 11.948 1.00 0.00 C ATOM 161 C LYS A 351 3.529 -8.926 10.870 1.00 0.00 C ATOM 162 O LYS A 351 2.999 -8.086 10.149 1.00 0.00 O ATOM 163 CB LYS A 351 2.927 -8.953 13.323 1.00 0.00 C ATOM 164 CG LYS A 351 3.644 -9.818 14.363 1.00 0.00 C ATOM 165 CD LYS A 351 4.131 -8.998 15.562 1.00 0.00 C ATOM 166 CE LYS A 351 4.310 -9.893 16.796 1.00 0.00 C ATOM 167 NZ LYS A 351 4.755 -9.113 17.981 1.00 0.00 N ATOM 0 H LYS A 351 3.275 -11.440 12.835 1.00 0.00 H new ATOM 0 HA LYS A 351 1.636 -9.496 11.722 1.00 0.00 H new ATOM 0 HB2 LYS A 351 3.506 -8.042 13.172 1.00 0.00 H new ATOM 0 HB3 LYS A 351 1.961 -8.653 13.729 1.00 0.00 H new ATOM 0 HG2 LYS A 351 2.969 -10.600 14.710 1.00 0.00 H new ATOM 0 HG3 LYS A 351 4.494 -10.315 13.896 1.00 0.00 H new ATOM 0 HD2 LYS A 351 5.077 -8.514 15.318 1.00 0.00 H new ATOM 0 HD3 LYS A 351 3.415 -8.206 15.782 1.00 0.00 H new ATOM 0 HE2 LYS A 351 3.368 -10.393 17.022 1.00 0.00 H new ATOM 0 HE3 LYS A 351 5.041 -10.672 16.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 4.865 -9.751 18.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 5.666 -8.656 17.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 4.046 -8.386 18.204 1.00 0.00 H new ATOM 181 N LEU A 352 4.809 -9.283 10.736 1.00 0.00 N ATOM 182 CA LEU A 352 5.706 -8.674 9.751 1.00 0.00 C ATOM 183 C LEU A 352 5.192 -8.931 8.322 1.00 0.00 C ATOM 184 O LEU A 352 5.142 -8.002 7.523 1.00 0.00 O ATOM 185 CB LEU A 352 7.122 -9.272 9.909 1.00 0.00 C ATOM 186 CG LEU A 352 8.111 -8.582 10.885 1.00 0.00 C ATOM 187 CD1 LEU A 352 9.469 -8.374 10.222 1.00 0.00 C ATOM 188 CD2 LEU A 352 7.642 -7.273 11.526 1.00 0.00 C ATOM 0 H LEU A 352 5.252 -10.002 11.307 1.00 0.00 H new ATOM 0 HA LEU A 352 5.739 -7.598 9.921 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.011 -10.309 10.227 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.587 -9.289 8.923 1.00 0.00 H new ATOM 0 HG LEU A 352 8.180 -9.285 11.715 1.00 0.00 H new ATOM 0 HD11 LEU A 352 10.146 -7.889 10.925 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.882 -9.339 9.928 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.351 -7.745 9.339 1.00 0.00 H new ATOM 0 HD21 LEU A 352 8.421 -6.891 12.186 1.00 0.00 H new ATOM 0 HD22 LEU A 352 7.435 -6.540 10.746 1.00 0.00 H new ATOM 0 HD23 LEU A 352 6.735 -7.455 12.103 1.00 0.00 H new ATOM 200 N ILE A 353 4.787 -10.164 7.990 1.00 0.00 N ATOM 201 CA ILE A 353 4.300 -10.522 6.642 1.00 0.00 C ATOM 202 C ILE A 353 2.995 -9.788 6.306 1.00 0.00 C ATOM 203 O ILE A 353 2.884 -9.163 5.246 1.00 0.00 O ATOM 204 CB ILE A 353 4.252 -12.069 6.469 1.00 0.00 C ATOM 205 CG1 ILE A 353 5.067 -12.520 5.241 1.00 0.00 C ATOM 206 CG2 ILE A 353 2.848 -12.702 6.475 1.00 0.00 C ATOM 207 CD1 ILE A 353 5.560 -13.970 5.346 1.00 0.00 C ATOM 0 H ILE A 353 4.786 -10.945 8.646 1.00 0.00 H new ATOM 0 HA ILE A 353 5.010 -10.171 5.893 1.00 0.00 H new ATOM 0 HB ILE A 353 4.720 -12.454 7.375 1.00 0.00 H new ATOM 0 HG12 ILE A 353 4.453 -12.415 4.346 1.00 0.00 H new ATOM 0 HG13 ILE A 353 5.925 -11.859 5.119 1.00 0.00 H new ATOM 0 HG21 ILE A 353 2.935 -13.781 6.348 1.00 0.00 H new ATOM 0 HG22 ILE A 353 2.356 -12.487 7.424 1.00 0.00 H new ATOM 0 HG23 ILE A 353 2.258 -12.287 5.658 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.127 -14.227 4.451 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.199 -14.074 6.223 1.00 0.00 H new ATOM 0 HD13 ILE A 353 4.705 -14.639 5.439 1.00 0.00 H new ATOM 219 N GLN A 354 2.027 -9.766 7.228 1.00 0.00 N ATOM 220 CA GLN A 354 0.803 -8.990 6.966 1.00 0.00 C ATOM 221 C GLN A 354 1.091 -7.478 6.903 1.00 0.00 C ATOM 222 O GLN A 354 0.448 -6.765 6.131 1.00 0.00 O ATOM 223 CB GLN A 354 -0.340 -9.338 7.932 1.00 0.00 C ATOM 224 CG GLN A 354 -0.048 -9.005 9.396 1.00 0.00 C ATOM 225 CD GLN A 354 -1.222 -9.350 10.308 1.00 0.00 C ATOM 226 OE1 GLN A 354 -2.027 -8.506 10.681 1.00 0.00 O ATOM 227 NE2 GLN A 354 -1.367 -10.598 10.702 1.00 0.00 N ATOM 0 H GLN A 354 2.057 -10.252 8.124 1.00 0.00 H new ATOM 0 HA GLN A 354 0.449 -9.284 5.978 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -1.238 -8.804 7.622 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -0.558 -10.403 7.850 1.00 0.00 H new ATOM 0 HG2 GLN A 354 0.837 -9.552 9.722 1.00 0.00 H new ATOM 0 HG3 GLN A 354 0.182 -7.943 9.487 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -0.702 -11.309 10.398 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -2.144 -10.853 11.312 1.00 0.00 H new ATOM 236 N GLN A 355 2.097 -6.978 7.635 1.00 0.00 N ATOM 237 CA GLN A 355 2.473 -5.565 7.602 1.00 0.00 C ATOM 238 C GLN A 355 3.177 -5.218 6.287 1.00 0.00 C ATOM 239 O GLN A 355 3.005 -4.106 5.791 1.00 0.00 O ATOM 240 CB GLN A 355 3.307 -5.219 8.836 1.00 0.00 C ATOM 241 CG GLN A 355 3.790 -3.761 8.929 1.00 0.00 C ATOM 242 CD GLN A 355 2.643 -2.764 9.090 1.00 0.00 C ATOM 243 OE1 GLN A 355 2.294 -2.345 10.186 1.00 0.00 O ATOM 244 NE2 GLN A 355 2.010 -2.350 8.013 1.00 0.00 N ATOM 0 H GLN A 355 2.669 -7.543 8.263 1.00 0.00 H new ATOM 0 HA GLN A 355 1.575 -4.949 7.637 1.00 0.00 H new ATOM 0 HB2 GLN A 355 2.718 -5.444 9.725 1.00 0.00 H new ATOM 0 HB3 GLN A 355 4.179 -5.873 8.857 1.00 0.00 H new ATOM 0 HG2 GLN A 355 4.472 -3.663 9.774 1.00 0.00 H new ATOM 0 HG3 GLN A 355 4.357 -3.513 8.032 1.00 0.00 H new ATOM 0 HE21 GLN A 355 2.291 -2.691 7.094 1.00 0.00 H new ATOM 0 HE22 GLN A 355 1.239 -1.688 8.098 1.00 0.00 H new ATOM 253 N GLN A 356 3.935 -6.157 5.708 1.00 0.00 N ATOM 254 CA GLN A 356 4.659 -5.985 4.447 1.00 0.00 C ATOM 255 C GLN A 356 3.602 -5.821 3.362 1.00 0.00 C ATOM 256 O GLN A 356 3.623 -4.838 2.632 1.00 0.00 O ATOM 257 CB GLN A 356 5.408 -7.275 4.097 1.00 0.00 C ATOM 258 CG GLN A 356 6.818 -7.308 4.690 1.00 0.00 C ATOM 259 CD GLN A 356 7.751 -6.262 4.082 1.00 0.00 C ATOM 260 OE1 GLN A 356 8.255 -6.410 2.977 1.00 0.00 O ATOM 261 NE2 GLN A 356 8.028 -5.176 4.773 1.00 0.00 N ATOM 0 H GLN A 356 4.064 -7.083 6.117 1.00 0.00 H new ATOM 0 HA GLN A 356 5.349 -5.145 4.525 1.00 0.00 H new ATOM 0 HB2 GLN A 356 4.842 -8.132 4.463 1.00 0.00 H new ATOM 0 HB3 GLN A 356 5.470 -7.374 3.013 1.00 0.00 H new ATOM 0 HG2 GLN A 356 6.756 -7.149 5.767 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.246 -8.299 4.539 1.00 0.00 H new ATOM 0 HE21 GLN A 356 7.615 -5.039 5.696 1.00 0.00 H new ATOM 0 HE22 GLN A 356 8.656 -4.471 4.386 1.00 0.00 H new ATOM 270 N LEU A 357 2.648 -6.762 3.296 1.00 0.00 N ATOM 271 CA LEU A 357 1.521 -6.718 2.361 1.00 0.00 C ATOM 272 C LEU A 357 0.790 -5.359 2.496 1.00 0.00 C ATOM 273 O LEU A 357 0.618 -4.644 1.512 1.00 0.00 O ATOM 274 CB LEU A 357 0.608 -7.922 2.711 1.00 0.00 C ATOM 275 CG LEU A 357 -0.227 -8.495 1.557 1.00 0.00 C ATOM 276 CD1 LEU A 357 -1.299 -9.457 2.054 1.00 0.00 C ATOM 277 CD2 LEU A 357 -0.883 -7.393 0.761 1.00 0.00 C ATOM 0 H LEU A 357 2.640 -7.584 3.900 1.00 0.00 H new ATOM 0 HA LEU A 357 1.839 -6.796 1.321 1.00 0.00 H new ATOM 0 HB2 LEU A 357 1.232 -8.720 3.112 1.00 0.00 H new ATOM 0 HB3 LEU A 357 -0.071 -7.617 3.507 1.00 0.00 H new ATOM 0 HG LEU A 357 0.464 -9.044 0.917 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.867 -9.839 1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -0.827 -10.288 2.579 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.971 -8.933 2.734 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -1.468 -7.828 -0.050 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.539 -6.815 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -0.117 -6.739 0.345 1.00 0.00 H new ATOM 289 N VAL A 358 0.418 -4.955 3.717 1.00 0.00 N ATOM 290 CA VAL A 358 -0.233 -3.654 3.975 1.00 0.00 C ATOM 291 C VAL A 358 0.627 -2.453 3.544 1.00 0.00 C ATOM 292 O VAL A 358 0.089 -1.471 3.039 1.00 0.00 O ATOM 293 CB VAL A 358 -0.639 -3.554 5.465 1.00 0.00 C ATOM 294 CG1 VAL A 358 -1.094 -2.151 5.894 1.00 0.00 C ATOM 295 CG2 VAL A 358 -1.791 -4.513 5.807 1.00 0.00 C ATOM 0 H VAL A 358 0.557 -5.517 4.557 1.00 0.00 H new ATOM 0 HA VAL A 358 -1.130 -3.611 3.357 1.00 0.00 H new ATOM 0 HB VAL A 358 0.273 -3.816 6.002 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -1.362 -2.163 6.951 1.00 0.00 H new ATOM 0 HG12 VAL A 358 -0.283 -1.440 5.733 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -1.960 -1.853 5.304 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -2.047 -4.413 6.862 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -2.661 -4.268 5.198 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -1.483 -5.539 5.604 1.00 0.00 H new ATOM 305 N LEU A 359 1.954 -2.524 3.681 1.00 0.00 N ATOM 306 CA LEU A 359 2.892 -1.454 3.304 1.00 0.00 C ATOM 307 C LEU A 359 3.096 -1.376 1.791 1.00 0.00 C ATOM 308 O LEU A 359 3.239 -0.289 1.246 1.00 0.00 O ATOM 309 CB LEU A 359 4.256 -1.668 3.984 1.00 0.00 C ATOM 310 CG LEU A 359 4.358 -1.123 5.416 1.00 0.00 C ATOM 311 CD1 LEU A 359 5.668 -1.595 6.049 1.00 0.00 C ATOM 312 CD2 LEU A 359 4.337 0.409 5.464 1.00 0.00 C ATOM 0 H LEU A 359 2.421 -3.345 4.066 1.00 0.00 H new ATOM 0 HA LEU A 359 2.451 -0.515 3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.473 -2.736 4.001 1.00 0.00 H new ATOM 0 HB3 LEU A 359 5.027 -1.196 3.375 1.00 0.00 H new ATOM 0 HG LEU A 359 3.491 -1.498 5.960 1.00 0.00 H new ATOM 0 HD11 LEU A 359 5.741 -1.208 7.066 1.00 0.00 H new ATOM 0 HD12 LEU A 359 5.689 -2.685 6.073 1.00 0.00 H new ATOM 0 HD13 LEU A 359 6.509 -1.229 5.460 1.00 0.00 H new ATOM 0 HD21 LEU A 359 4.412 0.742 6.499 1.00 0.00 H new ATOM 0 HD22 LEU A 359 5.179 0.802 4.895 1.00 0.00 H new ATOM 0 HD23 LEU A 359 3.405 0.774 5.032 1.00 0.00 H new ATOM 324 N LEU A 360 3.080 -2.516 1.115 1.00 0.00 N ATOM 325 CA LEU A 360 3.179 -2.681 -0.335 1.00 0.00 C ATOM 326 C LEU A 360 1.939 -2.117 -1.024 1.00 0.00 C ATOM 327 O LEU A 360 2.025 -1.376 -2.002 1.00 0.00 O ATOM 328 CB LEU A 360 3.297 -4.193 -0.577 1.00 0.00 C ATOM 329 CG LEU A 360 4.746 -4.705 -0.750 1.00 0.00 C ATOM 330 CD1 LEU A 360 5.816 -4.010 0.102 1.00 0.00 C ATOM 331 CD2 LEU A 360 4.791 -6.197 -0.420 1.00 0.00 C ATOM 0 H LEU A 360 2.992 -3.412 1.594 1.00 0.00 H new ATOM 0 HA LEU A 360 4.036 -2.145 -0.743 1.00 0.00 H new ATOM 0 HB2 LEU A 360 2.837 -4.719 0.260 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.725 -4.451 -1.469 1.00 0.00 H new ATOM 0 HG LEU A 360 4.993 -4.480 -1.787 1.00 0.00 H new ATOM 0 HD11 LEU A 360 6.790 -4.453 -0.105 1.00 0.00 H new ATOM 0 HD12 LEU A 360 5.842 -2.948 -0.141 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.577 -4.135 1.158 1.00 0.00 H new ATOM 0 HD21 LEU A 360 5.810 -6.566 -0.540 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.468 -6.352 0.609 1.00 0.00 H new ATOM 0 HD23 LEU A 360 4.128 -6.739 -1.094 1.00 0.00 H new ATOM 343 N LEU A 361 0.771 -2.441 -0.481 1.00 0.00 N ATOM 344 CA LEU A 361 -0.493 -1.933 -0.986 1.00 0.00 C ATOM 345 C LEU A 361 -0.676 -0.458 -0.619 1.00 0.00 C ATOM 346 O LEU A 361 -1.177 0.301 -1.451 1.00 0.00 O ATOM 347 CB LEU A 361 -1.598 -2.870 -0.510 1.00 0.00 C ATOM 348 CG LEU A 361 -1.451 -4.294 -1.097 1.00 0.00 C ATOM 349 CD1 LEU A 361 -2.727 -5.074 -0.798 1.00 0.00 C ATOM 350 CD2 LEU A 361 -1.255 -4.354 -2.616 1.00 0.00 C ATOM 0 H LEU A 361 0.677 -3.063 0.322 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.524 -1.932 -2.076 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.582 -2.924 0.579 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.567 -2.460 -0.794 1.00 0.00 H new ATOM 0 HG LEU A 361 -0.555 -4.706 -0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -2.641 -6.082 -1.205 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -2.875 -5.130 0.280 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -3.578 -4.569 -1.256 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -1.162 -5.394 -2.930 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -2.113 -3.900 -3.112 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -0.350 -3.811 -2.888 1.00 0.00 H new ATOM 362 N HIS A 362 -0.181 -0.019 0.549 1.00 0.00 N ATOM 363 CA HIS A 362 -0.121 1.407 0.873 1.00 0.00 C ATOM 364 C HIS A 362 0.809 2.091 -0.137 1.00 0.00 C ATOM 365 O HIS A 362 0.443 3.115 -0.692 1.00 0.00 O ATOM 366 CB HIS A 362 0.372 1.666 2.307 1.00 0.00 C ATOM 367 CG HIS A 362 0.460 3.146 2.611 1.00 0.00 C ATOM 368 ND1 HIS A 362 -0.490 3.900 3.263 1.00 0.00 N ATOM 369 CD2 HIS A 362 1.426 4.018 2.171 1.00 0.00 C ATOM 370 CE1 HIS A 362 -0.115 5.190 3.201 1.00 0.00 C ATOM 371 NE2 HIS A 362 1.037 5.313 2.526 1.00 0.00 N ATOM 0 H HIS A 362 0.181 -0.632 1.279 1.00 0.00 H new ATOM 0 HA HIS A 362 -1.129 1.817 0.813 1.00 0.00 H new ATOM 0 HB2 HIS A 362 -0.304 1.189 3.016 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.352 1.208 2.443 1.00 0.00 H new ATOM 0 HD1 HIS A 362 -1.332 3.542 3.714 1.00 0.00 H new ATOM 0 HD2 HIS A 362 2.329 3.750 1.643 1.00 0.00 H new ATOM 0 HE1 HIS A 362 -0.665 6.012 3.634 1.00 0.00 H new ATOM 379 N ALA A 363 1.987 1.526 -0.419 1.00 0.00 N ATOM 380 CA ALA A 363 2.935 2.052 -1.394 1.00 0.00 C ATOM 381 C ALA A 363 2.293 2.205 -2.783 1.00 0.00 C ATOM 382 O ALA A 363 2.514 3.223 -3.424 1.00 0.00 O ATOM 383 CB ALA A 363 4.190 1.173 -1.411 1.00 0.00 C ATOM 0 H ALA A 363 2.311 0.672 0.036 1.00 0.00 H new ATOM 0 HA ALA A 363 3.234 3.057 -1.098 1.00 0.00 H new ATOM 0 HB1 ALA A 363 4.899 1.566 -2.140 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.648 1.174 -0.422 1.00 0.00 H new ATOM 0 HB3 ALA A 363 3.917 0.154 -1.684 1.00 0.00 H new ATOM 389 N HIS A 364 1.468 1.255 -3.240 1.00 0.00 N ATOM 390 CA HIS A 364 0.745 1.350 -4.512 1.00 0.00 C ATOM 391 C HIS A 364 -0.267 2.521 -4.498 1.00 0.00 C ATOM 392 O HIS A 364 -0.204 3.453 -5.312 1.00 0.00 O ATOM 393 CB HIS A 364 0.052 0.000 -4.779 1.00 0.00 C ATOM 394 CG HIS A 364 -0.280 -0.240 -6.231 1.00 0.00 C ATOM 395 ND1 HIS A 364 -1.235 0.409 -6.984 1.00 0.00 N ATOM 396 CD2 HIS A 364 0.308 -1.170 -7.049 1.00 0.00 C ATOM 397 CE1 HIS A 364 -1.223 -0.117 -8.221 1.00 0.00 C ATOM 398 NE2 HIS A 364 -0.293 -1.085 -8.312 1.00 0.00 N ATOM 0 H HIS A 364 1.282 0.391 -2.731 1.00 0.00 H new ATOM 0 HA HIS A 364 1.446 1.562 -5.319 1.00 0.00 H new ATOM 0 HB2 HIS A 364 0.697 -0.805 -4.426 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.866 -0.048 -4.194 1.00 0.00 H new ATOM 0 HD2 HIS A 364 1.098 -1.851 -6.768 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -1.869 0.194 -9.029 1.00 0.00 H new ATOM 0 HE2 HIS A 364 -0.070 -1.645 -9.135 1.00 0.00 H new ATOM 406 N LYS A 365 -1.170 2.493 -3.505 1.00 0.00 N ATOM 407 CA LYS A 365 -2.207 3.502 -3.217 1.00 0.00 C ATOM 408 C LYS A 365 -1.627 4.908 -3.139 1.00 0.00 C ATOM 409 O LYS A 365 -2.179 5.842 -3.721 1.00 0.00 O ATOM 410 CB LYS A 365 -2.853 3.105 -1.876 1.00 0.00 C ATOM 411 CG LYS A 365 -3.755 4.148 -1.197 1.00 0.00 C ATOM 412 CD LYS A 365 -4.239 3.582 0.149 1.00 0.00 C ATOM 413 CE LYS A 365 -5.153 4.597 0.852 1.00 0.00 C ATOM 414 NZ LYS A 365 -5.636 4.096 2.166 1.00 0.00 N ATOM 0 H LYS A 365 -1.199 1.720 -2.841 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.943 3.522 -4.021 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.442 2.203 -2.039 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -2.055 2.844 -1.181 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -3.207 5.077 -1.041 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -4.606 4.384 -1.835 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -4.777 2.648 -0.013 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -3.383 3.351 0.784 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -4.612 5.532 0.997 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -6.007 4.819 0.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -6.249 4.811 2.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -6.175 3.217 2.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -4.823 3.908 2.786 1.00 0.00 H new ATOM 428 N CYS A 366 -0.536 5.038 -2.394 1.00 0.00 N ATOM 429 CA CYS A 366 0.171 6.269 -2.128 1.00 0.00 C ATOM 430 C CYS A 366 1.095 6.695 -3.269 1.00 0.00 C ATOM 431 O CYS A 366 1.214 7.888 -3.495 1.00 0.00 O ATOM 432 CB CYS A 366 0.818 6.161 -0.754 1.00 0.00 C ATOM 433 SG CYS A 366 1.583 7.683 -0.136 1.00 0.00 S ATOM 0 H CYS A 366 -0.102 4.236 -1.936 1.00 0.00 H new ATOM 0 HA CYS A 366 -0.528 7.104 -2.092 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.062 5.838 -0.039 1.00 0.00 H new ATOM 0 HB3 CYS A 366 1.578 5.380 -0.789 1.00 0.00 H new ATOM 0 HG CYS A 366 2.645 7.386 0.552 1.00 0.00 H new ATOM 438 N GLN A 367 1.676 5.786 -4.061 1.00 0.00 N ATOM 439 CA GLN A 367 2.400 6.179 -5.280 1.00 0.00 C ATOM 440 C GLN A 367 1.397 6.895 -6.197 1.00 0.00 C ATOM 441 O GLN A 367 1.683 7.987 -6.694 1.00 0.00 O ATOM 442 CB GLN A 367 3.059 4.962 -5.950 1.00 0.00 C ATOM 443 CG GLN A 367 3.889 5.345 -7.186 1.00 0.00 C ATOM 444 CD GLN A 367 4.614 4.136 -7.782 1.00 0.00 C ATOM 445 OE1 GLN A 367 4.031 3.097 -8.068 1.00 0.00 O ATOM 446 NE2 GLN A 367 5.911 4.214 -8.000 1.00 0.00 N ATOM 0 H GLN A 367 1.661 4.782 -3.884 1.00 0.00 H new ATOM 0 HA GLN A 367 3.220 6.857 -5.046 1.00 0.00 H new ATOM 0 HB2 GLN A 367 3.701 4.458 -5.228 1.00 0.00 H new ATOM 0 HB3 GLN A 367 2.287 4.250 -6.242 1.00 0.00 H new ATOM 0 HG2 GLN A 367 3.236 5.785 -7.940 1.00 0.00 H new ATOM 0 HG3 GLN A 367 4.618 6.107 -6.912 1.00 0.00 H new ATOM 0 HE21 GLN A 367 6.416 5.069 -7.769 1.00 0.00 H new ATOM 0 HE22 GLN A 367 6.410 3.419 -8.399 1.00 0.00 H new ATOM 455 N ARG A 368 0.174 6.347 -6.327 1.00 0.00 N ATOM 456 CA ARG A 368 -0.924 7.037 -7.018 1.00 0.00 C ATOM 457 C ARG A 368 -1.265 8.362 -6.347 1.00 0.00 C ATOM 458 O ARG A 368 -1.301 9.376 -7.036 1.00 0.00 O ATOM 459 CB ARG A 368 -2.117 6.076 -7.164 1.00 0.00 C ATOM 460 CG ARG A 368 -3.421 6.681 -7.724 1.00 0.00 C ATOM 461 CD ARG A 368 -4.246 7.602 -6.801 1.00 0.00 C ATOM 462 NE ARG A 368 -4.345 7.089 -5.421 1.00 0.00 N ATOM 463 CZ ARG A 368 -5.190 7.468 -4.482 1.00 0.00 C ATOM 464 NH1 ARG A 368 -6.105 8.375 -4.650 1.00 0.00 N ATOM 465 NH2 ARG A 368 -5.153 6.922 -3.310 1.00 0.00 N ATOM 0 H ARG A 368 -0.075 5.428 -5.961 1.00 0.00 H new ATOM 0 HA ARG A 368 -0.613 7.314 -8.025 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -1.816 5.254 -7.813 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -2.332 5.647 -6.185 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -3.169 7.246 -8.621 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -4.064 5.858 -8.036 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -3.792 8.593 -6.784 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -5.248 7.718 -7.213 1.00 0.00 H new ATOM 0 HE ARG A 368 -3.683 6.357 -5.164 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -6.201 8.841 -5.552 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -6.727 8.621 -3.880 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -4.468 6.194 -3.108 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -5.809 7.219 -2.588 1.00 0.00 H new ATOM 479 N ARG A 369 -1.511 8.387 -5.034 1.00 0.00 N ATOM 480 CA ARG A 369 -1.921 9.615 -4.317 1.00 0.00 C ATOM 481 C ARG A 369 -0.890 10.745 -4.418 1.00 0.00 C ATOM 482 O ARG A 369 -1.236 11.918 -4.535 1.00 0.00 O ATOM 483 CB ARG A 369 -2.338 9.285 -2.859 1.00 0.00 C ATOM 484 CG ARG A 369 -1.346 9.711 -1.752 1.00 0.00 C ATOM 485 CD ARG A 369 -1.526 9.011 -0.400 1.00 0.00 C ATOM 486 NE ARG A 369 -2.924 8.984 0.075 1.00 0.00 N ATOM 487 CZ ARG A 369 -3.329 8.544 1.252 1.00 0.00 C ATOM 488 NH1 ARG A 369 -2.498 8.061 2.129 1.00 0.00 N ATOM 489 NH2 ARG A 369 -4.590 8.589 1.576 1.00 0.00 N ATOM 0 H ARG A 369 -1.434 7.566 -4.434 1.00 0.00 H new ATOM 0 HA ARG A 369 -2.803 10.010 -4.821 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -3.298 9.762 -2.661 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -2.495 8.209 -2.783 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -0.332 9.525 -2.106 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -1.438 10.786 -1.600 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -1.159 7.988 -0.479 1.00 0.00 H new ATOM 0 HD3 ARG A 369 -0.909 9.514 0.344 1.00 0.00 H new ATOM 0 HE ARG A 369 -3.639 9.336 -0.562 1.00 0.00 H new ATOM 0 HH11 ARG A 369 -1.502 8.014 1.916 1.00 0.00 H new ATOM 0 HH12 ARG A 369 -2.843 7.729 3.030 1.00 0.00 H new ATOM 0 HH21 ARG A 369 -5.272 8.966 0.918 1.00 0.00 H new ATOM 0 HH22 ARG A 369 -4.895 8.247 2.487 1.00 0.00 H new ATOM 503 N GLU A 370 0.378 10.360 -4.379 1.00 0.00 N ATOM 504 CA GLU A 370 1.553 11.219 -4.438 1.00 0.00 C ATOM 505 C GLU A 370 1.692 11.847 -5.823 1.00 0.00 C ATOM 506 O GLU A 370 1.756 13.064 -5.965 1.00 0.00 O ATOM 507 CB GLU A 370 2.782 10.346 -4.157 1.00 0.00 C ATOM 508 CG GLU A 370 4.136 11.055 -4.192 1.00 0.00 C ATOM 509 CD GLU A 370 5.239 9.993 -4.108 1.00 0.00 C ATOM 510 OE1 GLU A 370 5.570 9.575 -2.970 1.00 0.00 O ATOM 511 OE2 GLU A 370 5.744 9.566 -5.174 1.00 0.00 O ATOM 0 H GLU A 370 0.630 9.375 -4.300 1.00 0.00 H new ATOM 0 HA GLU A 370 1.461 12.021 -3.705 1.00 0.00 H new ATOM 0 HB2 GLU A 370 2.660 9.889 -3.175 1.00 0.00 H new ATOM 0 HB3 GLU A 370 2.801 9.536 -4.886 1.00 0.00 H new ATOM 0 HG2 GLU A 370 4.237 11.635 -5.109 1.00 0.00 H new ATOM 0 HG3 GLU A 370 4.219 11.755 -3.361 1.00 0.00 H new ATOM 518 N GLN A 371 1.727 11.009 -6.860 1.00 0.00 N ATOM 519 CA GLN A 371 1.860 11.474 -8.244 1.00 0.00 C ATOM 520 C GLN A 371 0.596 12.212 -8.744 1.00 0.00 C ATOM 521 O GLN A 371 0.696 13.073 -9.621 1.00 0.00 O ATOM 522 CB GLN A 371 2.253 10.295 -9.151 1.00 0.00 C ATOM 523 CG GLN A 371 3.614 9.667 -8.775 1.00 0.00 C ATOM 524 CD GLN A 371 4.789 10.644 -8.850 1.00 0.00 C ATOM 525 OE1 GLN A 371 4.976 11.365 -9.822 1.00 0.00 O ATOM 526 NE2 GLN A 371 5.632 10.722 -7.838 1.00 0.00 N ATOM 0 H GLN A 371 1.665 9.995 -6.767 1.00 0.00 H new ATOM 0 HA GLN A 371 2.658 12.216 -8.282 1.00 0.00 H new ATOM 0 HB2 GLN A 371 1.479 9.529 -9.097 1.00 0.00 H new ATOM 0 HB3 GLN A 371 2.291 10.637 -10.185 1.00 0.00 H new ATOM 0 HG2 GLN A 371 3.551 9.266 -7.763 1.00 0.00 H new ATOM 0 HG3 GLN A 371 3.811 8.826 -9.439 1.00 0.00 H new ATOM 0 HE21 GLN A 371 5.499 10.132 -7.016 1.00 0.00 H new ATOM 0 HE22 GLN A 371 6.417 11.372 -7.877 1.00 0.00 H new ATOM 535 N ALA A 372 -0.584 11.910 -8.185 1.00 0.00 N ATOM 536 CA ALA A 372 -1.857 12.547 -8.538 1.00 0.00 C ATOM 537 C ALA A 372 -2.090 13.932 -7.888 1.00 0.00 C ATOM 538 O ALA A 372 -2.810 14.748 -8.469 1.00 0.00 O ATOM 539 CB ALA A 372 -3.008 11.591 -8.185 1.00 0.00 C ATOM 0 H ALA A 372 -0.680 11.200 -7.459 1.00 0.00 H new ATOM 0 HA ALA A 372 -1.819 12.741 -9.610 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -3.959 12.056 -8.444 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -2.894 10.662 -8.744 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -2.988 11.376 -7.117 1.00 0.00 H new ATOM 652 N LEU A 381 4.208 8.115 6.797 1.00 0.00 N ATOM 653 CA LEU A 381 4.907 6.880 7.203 1.00 0.00 C ATOM 654 C LEU A 381 6.398 6.946 6.794 1.00 0.00 C ATOM 655 O LEU A 381 6.688 7.308 5.649 1.00 0.00 O ATOM 656 CB LEU A 381 4.231 5.597 6.663 1.00 0.00 C ATOM 657 CG LEU A 381 2.706 5.614 6.446 1.00 0.00 C ATOM 658 CD1 LEU A 381 2.261 4.262 5.884 1.00 0.00 C ATOM 659 CD2 LEU A 381 1.940 5.855 7.750 1.00 0.00 C ATOM 0 HA LEU A 381 4.842 6.819 8.289 1.00 0.00 H new ATOM 0 HB2 LEU A 381 4.700 5.349 5.711 1.00 0.00 H new ATOM 0 HB3 LEU A 381 4.460 4.784 7.352 1.00 0.00 H new ATOM 0 HG LEU A 381 2.486 6.428 5.756 1.00 0.00 H new ATOM 0 HD11 LEU A 381 1.182 4.270 5.729 1.00 0.00 H new ATOM 0 HD12 LEU A 381 2.763 4.080 4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 381 2.521 3.472 6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 381 0.869 5.859 7.547 1.00 0.00 H new ATOM 0 HD22 LEU A 381 2.172 5.062 8.460 1.00 0.00 H new ATOM 0 HD23 LEU A 381 2.233 6.817 8.172 1.00 0.00 H new ATOM 671 N PRO A 382 7.361 6.597 7.673 1.00 0.00 N ATOM 672 CA PRO A 382 8.791 6.671 7.348 1.00 0.00 C ATOM 673 C PRO A 382 9.237 5.623 6.313 1.00 0.00 C ATOM 674 O PRO A 382 10.125 5.890 5.500 1.00 0.00 O ATOM 675 CB PRO A 382 9.514 6.490 8.688 1.00 0.00 C ATOM 676 CG PRO A 382 8.538 5.662 9.524 1.00 0.00 C ATOM 677 CD PRO A 382 7.169 6.145 9.045 1.00 0.00 C ATOM 0 HA PRO A 382 9.029 7.623 6.874 1.00 0.00 H new ATOM 0 HB2 PRO A 382 10.467 5.976 8.561 1.00 0.00 H new ATOM 0 HB3 PRO A 382 9.729 7.449 9.159 1.00 0.00 H new ATOM 0 HG2 PRO A 382 8.669 4.593 9.355 1.00 0.00 H new ATOM 0 HG3 PRO A 382 8.675 5.835 10.591 1.00 0.00 H new ATOM 0 HD2 PRO A 382 6.433 5.342 9.092 1.00 0.00 H new ATOM 0 HD3 PRO A 382 6.798 6.954 9.674 1.00 0.00 H new ATOM 685 N HIS A 383 8.624 4.435 6.327 1.00 0.00 N ATOM 686 CA HIS A 383 8.932 3.325 5.414 1.00 0.00 C ATOM 687 C HIS A 383 8.295 3.461 4.019 1.00 0.00 C ATOM 688 O HIS A 383 8.623 2.675 3.129 1.00 0.00 O ATOM 689 CB HIS A 383 8.459 2.014 6.067 1.00 0.00 C ATOM 690 CG HIS A 383 9.013 1.783 7.452 1.00 0.00 C ATOM 691 ND1 HIS A 383 8.279 1.609 8.607 1.00 0.00 N ATOM 692 CD2 HIS A 383 10.335 1.722 7.803 1.00 0.00 C ATOM 693 CE1 HIS A 383 9.137 1.447 9.628 1.00 0.00 C ATOM 694 NE2 HIS A 383 10.408 1.512 9.188 1.00 0.00 N ATOM 0 H HIS A 383 7.881 4.211 6.989 1.00 0.00 H new ATOM 0 HA HIS A 383 10.010 3.335 5.253 1.00 0.00 H new ATOM 0 HB2 HIS A 383 7.370 2.018 6.118 1.00 0.00 H new ATOM 0 HB3 HIS A 383 8.745 1.178 5.428 1.00 0.00 H new ATOM 0 HD2 HIS A 383 11.175 1.819 7.131 1.00 0.00 H new ATOM 0 HE1 HIS A 383 8.848 1.287 10.656 1.00 0.00 H new ATOM 0 HE2 HIS A 383 11.255 1.426 9.750 1.00 0.00 H new ATOM 702 N CYS A 384 7.382 4.421 3.818 1.00 0.00 N ATOM 703 CA CYS A 384 6.616 4.619 2.586 1.00 0.00 C ATOM 704 C CYS A 384 7.473 4.633 1.303 1.00 0.00 C ATOM 705 O CYS A 384 7.260 3.818 0.406 1.00 0.00 O ATOM 706 CB CYS A 384 5.777 5.895 2.762 1.00 0.00 C ATOM 707 SG CYS A 384 4.428 5.936 1.554 1.00 0.00 S ATOM 0 H CYS A 384 7.150 5.105 4.538 1.00 0.00 H new ATOM 0 HA CYS A 384 5.965 3.758 2.434 1.00 0.00 H new ATOM 0 HB2 CYS A 384 5.370 5.934 3.772 1.00 0.00 H new ATOM 0 HB3 CYS A 384 6.410 6.774 2.640 1.00 0.00 H new ATOM 0 HG CYS A 384 3.287 5.889 2.176 1.00 0.00 H new ATOM 712 N ARG A 385 8.472 5.521 1.214 1.00 0.00 N ATOM 713 CA ARG A 385 9.365 5.633 0.038 1.00 0.00 C ATOM 714 C ARG A 385 10.266 4.409 -0.164 1.00 0.00 C ATOM 715 O ARG A 385 10.504 4.005 -1.301 1.00 0.00 O ATOM 716 CB ARG A 385 10.154 6.955 0.096 1.00 0.00 C ATOM 717 CG ARG A 385 9.409 8.114 -0.597 1.00 0.00 C ATOM 718 CD ARG A 385 7.987 8.378 -0.074 1.00 0.00 C ATOM 719 NE ARG A 385 7.354 9.497 -0.794 1.00 0.00 N ATOM 720 CZ ARG A 385 7.359 10.778 -0.486 1.00 0.00 C ATOM 721 NH1 ARG A 385 7.984 11.264 0.549 1.00 0.00 N ATOM 722 NH2 ARG A 385 6.706 11.591 -1.258 1.00 0.00 N ATOM 0 H ARG A 385 8.690 6.187 1.955 1.00 0.00 H new ATOM 0 HA ARG A 385 8.734 5.653 -0.851 1.00 0.00 H new ATOM 0 HB2 ARG A 385 10.341 7.218 1.137 1.00 0.00 H new ATOM 0 HB3 ARG A 385 11.126 6.816 -0.378 1.00 0.00 H new ATOM 0 HG2 ARG A 385 9.997 9.024 -0.482 1.00 0.00 H new ATOM 0 HG3 ARG A 385 9.354 7.903 -1.665 1.00 0.00 H new ATOM 0 HD2 ARG A 385 7.382 7.479 -0.189 1.00 0.00 H new ATOM 0 HD3 ARG A 385 8.025 8.603 0.992 1.00 0.00 H new ATOM 0 HE ARG A 385 6.845 9.247 -1.642 1.00 0.00 H new ATOM 0 HH11 ARG A 385 8.504 10.643 1.169 1.00 0.00 H new ATOM 0 HH12 ARG A 385 7.954 12.266 0.739 1.00 0.00 H new ATOM 0 HH21 ARG A 385 6.210 11.232 -2.074 1.00 0.00 H new ATOM 0 HH22 ARG A 385 6.689 12.589 -1.049 1.00 0.00 H new ATOM 736 N THR A 386 10.701 3.767 0.919 1.00 0.00 N ATOM 737 CA THR A 386 11.492 2.524 0.880 1.00 0.00 C ATOM 738 C THR A 386 10.647 1.398 0.282 1.00 0.00 C ATOM 739 O THR A 386 11.066 0.723 -0.655 1.00 0.00 O ATOM 740 CB THR A 386 11.963 2.131 2.294 1.00 0.00 C ATOM 741 OG1 THR A 386 12.588 3.227 2.932 1.00 0.00 O ATOM 742 CG2 THR A 386 12.956 0.969 2.289 1.00 0.00 C ATOM 0 H THR A 386 10.514 4.096 1.866 1.00 0.00 H new ATOM 0 HA THR A 386 12.372 2.690 0.259 1.00 0.00 H new ATOM 0 HB THR A 386 11.065 1.823 2.830 1.00 0.00 H new ATOM 0 HG1 THR A 386 12.879 2.961 3.829 1.00 0.00 H new ATOM 0 HG21 THR A 386 13.251 0.738 3.313 1.00 0.00 H new ATOM 0 HG22 THR A 386 12.488 0.093 1.840 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.838 1.246 1.711 1.00 0.00 H new ATOM 750 N MET A 387 9.417 1.232 0.767 1.00 0.00 N ATOM 751 CA MET A 387 8.456 0.244 0.272 1.00 0.00 C ATOM 752 C MET A 387 8.002 0.547 -1.162 1.00 0.00 C ATOM 753 O MET A 387 7.876 -0.373 -1.962 1.00 0.00 O ATOM 754 CB MET A 387 7.270 0.214 1.233 1.00 0.00 C ATOM 755 CG MET A 387 7.645 -0.490 2.550 1.00 0.00 C ATOM 756 SD MET A 387 7.750 -2.309 2.474 1.00 0.00 S ATOM 757 CE MET A 387 9.542 -2.600 2.353 1.00 0.00 C ATOM 0 H MET A 387 9.051 1.795 1.535 1.00 0.00 H new ATOM 0 HA MET A 387 8.934 -0.735 0.234 1.00 0.00 H new ATOM 0 HB2 MET A 387 6.940 1.232 1.442 1.00 0.00 H new ATOM 0 HB3 MET A 387 6.432 -0.303 0.766 1.00 0.00 H new ATOM 0 HG2 MET A 387 8.607 -0.103 2.886 1.00 0.00 H new ATOM 0 HG3 MET A 387 6.910 -0.218 3.308 1.00 0.00 H new ATOM 0 HE1 MET A 387 9.730 -3.444 1.689 1.00 0.00 H new ATOM 0 HE2 MET A 387 10.029 -1.710 1.955 1.00 0.00 H new ATOM 0 HE3 MET A 387 9.942 -2.821 3.342 1.00 0.00 H new ATOM 767 N LYS A 388 7.824 1.818 -1.537 1.00 0.00 N ATOM 768 CA LYS A 388 7.563 2.229 -2.930 1.00 0.00 C ATOM 769 C LYS A 388 8.733 1.824 -3.833 1.00 0.00 C ATOM 770 O LYS A 388 8.503 1.343 -4.941 1.00 0.00 O ATOM 771 CB LYS A 388 7.345 3.744 -2.968 1.00 0.00 C ATOM 772 CG LYS A 388 5.926 4.158 -2.554 1.00 0.00 C ATOM 773 CD LYS A 388 5.880 5.653 -2.224 1.00 0.00 C ATOM 774 CE LYS A 388 4.464 6.088 -1.834 1.00 0.00 C ATOM 775 NZ LYS A 388 4.414 7.509 -1.409 1.00 0.00 N ATOM 0 H LYS A 388 7.856 2.599 -0.882 1.00 0.00 H new ATOM 0 HA LYS A 388 6.668 1.728 -3.300 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.065 4.226 -2.307 1.00 0.00 H new ATOM 0 HB3 LYS A 388 7.544 4.109 -3.976 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.226 3.935 -3.359 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.610 3.578 -1.687 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.568 5.870 -1.407 1.00 0.00 H new ATOM 0 HD3 LYS A 388 6.217 6.229 -3.086 1.00 0.00 H new ATOM 0 HE2 LYS A 388 3.793 5.939 -2.680 1.00 0.00 H new ATOM 0 HE3 LYS A 388 4.101 5.455 -1.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.426 7.785 -1.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 4.966 7.630 -0.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.815 8.110 -2.158 1.00 0.00 H new ATOM 789 N ASN A 389 9.978 1.945 -3.354 1.00 0.00 N ATOM 790 CA ASN A 389 11.152 1.487 -4.114 1.00 0.00 C ATOM 791 C ASN A 389 11.150 -0.052 -4.258 1.00 0.00 C ATOM 792 O ASN A 389 11.405 -0.575 -5.341 1.00 0.00 O ATOM 793 CB ASN A 389 12.442 2.019 -3.469 1.00 0.00 C ATOM 794 CG ASN A 389 13.667 1.696 -4.313 1.00 0.00 C ATOM 795 OD1 ASN A 389 13.719 1.963 -5.506 1.00 0.00 O ATOM 796 ND2 ASN A 389 14.689 1.107 -3.732 1.00 0.00 N ATOM 0 H ASN A 389 10.200 2.355 -2.447 1.00 0.00 H new ATOM 0 HA ASN A 389 11.104 1.893 -5.125 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.365 3.098 -3.337 1.00 0.00 H new ATOM 0 HB3 ASN A 389 12.559 1.584 -2.476 1.00 0.00 H new ATOM 0 HD21 ASN A 389 15.520 0.875 -4.276 1.00 0.00 H new ATOM 0 HD22 ASN A 389 14.651 0.882 -2.738 1.00 0.00 H new ATOM 803 N VAL A 390 10.789 -0.779 -3.194 1.00 0.00 N ATOM 804 CA VAL A 390 10.616 -2.248 -3.194 1.00 0.00 C ATOM 805 C VAL A 390 9.502 -2.659 -4.164 1.00 0.00 C ATOM 806 O VAL A 390 9.647 -3.656 -4.864 1.00 0.00 O ATOM 807 CB VAL A 390 10.303 -2.734 -1.766 1.00 0.00 C ATOM 808 CG1 VAL A 390 9.821 -4.186 -1.664 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.536 -2.604 -0.867 1.00 0.00 C ATOM 0 H VAL A 390 10.603 -0.358 -2.284 1.00 0.00 H new ATOM 0 HA VAL A 390 11.542 -2.715 -3.529 1.00 0.00 H new ATOM 0 HB VAL A 390 9.485 -2.090 -1.444 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.627 -4.433 -0.620 1.00 0.00 H new ATOM 0 HG12 VAL A 390 8.904 -4.306 -2.241 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.588 -4.853 -2.058 1.00 0.00 H new ATOM 0 HG21 VAL A 390 11.293 -2.953 0.137 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.348 -3.207 -1.274 1.00 0.00 H new ATOM 0 HG23 VAL A 390 11.846 -1.560 -0.823 1.00 0.00 H new ATOM 819 N LEU A 391 8.411 -1.894 -4.256 1.00 0.00 N ATOM 820 CA LEU A 391 7.308 -2.149 -5.191 1.00 0.00 C ATOM 821 C LEU A 391 7.775 -1.938 -6.644 1.00 0.00 C ATOM 822 O LEU A 391 7.598 -2.806 -7.500 1.00 0.00 O ATOM 823 CB LEU A 391 6.114 -1.248 -4.829 1.00 0.00 C ATOM 824 CG LEU A 391 4.740 -1.736 -5.326 1.00 0.00 C ATOM 825 CD1 LEU A 391 3.706 -0.680 -4.954 1.00 0.00 C ATOM 826 CD2 LEU A 391 4.616 -1.968 -6.834 1.00 0.00 C ATOM 0 H LEU A 391 8.265 -1.068 -3.676 1.00 0.00 H new ATOM 0 HA LEU A 391 6.985 -3.187 -5.109 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.073 -1.147 -3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.296 -0.253 -5.236 1.00 0.00 H new ATOM 0 HG LEU A 391 4.590 -2.706 -4.853 1.00 0.00 H new ATOM 0 HD11 LEU A 391 2.721 -0.999 -5.294 1.00 0.00 H new ATOM 0 HD12 LEU A 391 3.692 -0.550 -3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 391 3.965 0.266 -5.429 1.00 0.00 H new ATOM 0 HD21 LEU A 391 3.608 -2.309 -7.068 1.00 0.00 H new ATOM 0 HD22 LEU A 391 4.816 -1.036 -7.363 1.00 0.00 H new ATOM 0 HD23 LEU A 391 5.336 -2.724 -7.146 1.00 0.00 H new ATOM 838 N ASN A 392 8.442 -0.809 -6.915 1.00 0.00 N ATOM 839 CA ASN A 392 9.032 -0.501 -8.222 1.00 0.00 C ATOM 840 C ASN A 392 9.983 -1.636 -8.656 1.00 0.00 C ATOM 841 O ASN A 392 9.956 -2.110 -9.800 1.00 0.00 O ATOM 842 CB ASN A 392 9.742 0.859 -8.118 1.00 0.00 C ATOM 843 CG ASN A 392 10.423 1.256 -9.415 1.00 0.00 C ATOM 844 OD1 ASN A 392 9.824 1.262 -10.480 1.00 0.00 O ATOM 845 ND2 ASN A 392 11.694 1.588 -9.376 1.00 0.00 N ATOM 0 H ASN A 392 8.588 -0.074 -6.223 1.00 0.00 H new ATOM 0 HA ASN A 392 8.264 -0.432 -8.992 1.00 0.00 H new ATOM 0 HB2 ASN A 392 9.017 1.624 -7.842 1.00 0.00 H new ATOM 0 HB3 ASN A 392 10.483 0.819 -7.319 1.00 0.00 H new ATOM 0 HD21 ASN A 392 12.179 1.850 -10.234 1.00 0.00 H new ATOM 0 HD22 ASN A 392 12.195 1.583 -8.488 1.00 0.00 H new ATOM 852 N HIS A 393 10.768 -2.138 -7.701 1.00 0.00 N ATOM 853 CA HIS A 393 11.626 -3.286 -7.928 1.00 0.00 C ATOM 854 C HIS A 393 10.778 -4.526 -8.205 1.00 0.00 C ATOM 855 O HIS A 393 11.018 -5.157 -9.223 1.00 0.00 O ATOM 856 CB HIS A 393 12.574 -3.502 -6.751 1.00 0.00 C ATOM 857 CG HIS A 393 13.468 -4.698 -6.975 1.00 0.00 C ATOM 858 ND1 HIS A 393 13.106 -5.998 -6.753 1.00 0.00 N flip ATOM 859 CD2 HIS A 393 14.687 -4.723 -7.615 1.00 0.00 C flip ATOM 860 CE1 HIS A 393 14.099 -6.830 -7.285 1.00 0.00 C flip ATOM 861 NE2 HIS A 393 15.043 -6.012 -7.782 1.00 0.00 N flip ATOM 0 H HIS A 393 10.822 -1.758 -6.756 1.00 0.00 H new ATOM 0 HA HIS A 393 12.244 -3.095 -8.805 1.00 0.00 H new ATOM 0 HB2 HIS A 393 13.185 -2.611 -6.606 1.00 0.00 H new ATOM 0 HB3 HIS A 393 11.996 -3.644 -5.838 1.00 0.00 H new ATOM 0 HD1 HIS A 393 12.257 -6.309 -6.280 1.00 0.00 H new ATOM 0 HD2 HIS A 393 15.258 -3.861 -7.928 1.00 0.00 H new ATOM 0 HE1 HIS A 393 14.105 -7.910 -7.294 1.00 0.00 H new ATOM 869 N MET A 394 9.776 -4.867 -7.380 1.00 0.00 N ATOM 870 CA MET A 394 8.930 -6.050 -7.621 1.00 0.00 C ATOM 871 C MET A 394 8.276 -6.041 -9.006 1.00 0.00 C ATOM 872 O MET A 394 8.052 -7.117 -9.561 1.00 0.00 O ATOM 873 CB MET A 394 7.889 -6.337 -6.509 1.00 0.00 C ATOM 874 CG MET A 394 6.497 -5.684 -6.648 1.00 0.00 C ATOM 875 SD MET A 394 5.057 -6.650 -6.090 1.00 0.00 S ATOM 876 CE MET A 394 5.441 -6.920 -4.342 1.00 0.00 C ATOM 0 H MET A 394 9.531 -4.342 -6.541 1.00 0.00 H new ATOM 0 HA MET A 394 9.632 -6.883 -7.590 1.00 0.00 H new ATOM 0 HB2 MET A 394 7.749 -7.416 -6.450 1.00 0.00 H new ATOM 0 HB3 MET A 394 8.316 -6.018 -5.558 1.00 0.00 H new ATOM 0 HG2 MET A 394 6.508 -4.746 -6.093 1.00 0.00 H new ATOM 0 HG3 MET A 394 6.347 -5.432 -7.698 1.00 0.00 H new ATOM 0 HE1 MET A 394 4.520 -7.117 -3.793 1.00 0.00 H new ATOM 0 HE2 MET A 394 6.111 -7.774 -4.244 1.00 0.00 H new ATOM 0 HE3 MET A 394 5.923 -6.032 -3.934 1.00 0.00 H new ATOM 886 N THR A 395 7.977 -4.863 -9.575 1.00 0.00 N ATOM 887 CA THR A 395 7.393 -4.792 -10.928 1.00 0.00 C ATOM 888 C THR A 395 8.462 -4.950 -12.020 1.00 0.00 C ATOM 889 O THR A 395 8.198 -5.593 -13.038 1.00 0.00 O ATOM 890 CB THR A 395 6.444 -3.596 -11.132 1.00 0.00 C ATOM 891 OG1 THR A 395 5.615 -3.815 -12.256 1.00 0.00 O ATOM 892 CG2 THR A 395 7.093 -2.227 -11.300 1.00 0.00 C ATOM 0 H THR A 395 8.126 -3.958 -9.129 1.00 0.00 H new ATOM 0 HA THR A 395 6.736 -5.656 -11.030 1.00 0.00 H new ATOM 0 HB THR A 395 5.891 -3.556 -10.194 1.00 0.00 H new ATOM 0 HG1 THR A 395 5.015 -3.049 -12.374 1.00 0.00 H new ATOM 0 HG21 THR A 395 6.319 -1.472 -11.435 1.00 0.00 H new ATOM 0 HG22 THR A 395 7.679 -1.991 -10.412 1.00 0.00 H new ATOM 0 HG23 THR A 395 7.746 -2.238 -12.173 1.00 0.00 H new ATOM 900 N HIS A 396 9.686 -4.441 -11.809 1.00 0.00 N ATOM 901 CA HIS A 396 10.805 -4.656 -12.748 1.00 0.00 C ATOM 902 C HIS A 396 11.469 -6.052 -12.614 1.00 0.00 C ATOM 903 O HIS A 396 12.105 -6.527 -13.560 1.00 0.00 O ATOM 904 CB HIS A 396 11.853 -3.549 -12.564 1.00 0.00 C ATOM 905 CG HIS A 396 11.399 -2.215 -13.102 1.00 0.00 C ATOM 906 ND1 HIS A 396 10.691 -1.256 -12.417 1.00 0.00 N ATOM 907 CD2 HIS A 396 11.590 -1.741 -14.373 1.00 0.00 C ATOM 908 CE1 HIS A 396 10.458 -0.227 -13.249 1.00 0.00 C ATOM 909 NE2 HIS A 396 10.992 -0.475 -14.460 1.00 0.00 N ATOM 0 H HIS A 396 9.929 -3.876 -10.995 1.00 0.00 H new ATOM 0 HA HIS A 396 10.384 -4.617 -13.753 1.00 0.00 H new ATOM 0 HB2 HIS A 396 12.085 -3.448 -11.504 1.00 0.00 H new ATOM 0 HB3 HIS A 396 12.776 -3.842 -13.065 1.00 0.00 H new ATOM 0 HD1 HIS A 396 10.393 -1.316 -11.443 1.00 0.00 H new ATOM 0 HD2 HIS A 396 12.110 -2.253 -15.169 1.00 0.00 H new ATOM 0 HE1 HIS A 396 9.919 0.671 -12.984 1.00 0.00 H new ATOM 917 N CYS A 397 11.341 -6.700 -11.451 1.00 0.00 N ATOM 918 CA CYS A 397 11.905 -8.000 -11.087 1.00 0.00 C ATOM 919 C CYS A 397 11.405 -9.143 -11.992 1.00 0.00 C ATOM 920 O CYS A 397 10.248 -9.161 -12.428 1.00 0.00 O ATOM 921 CB CYS A 397 11.558 -8.234 -9.604 1.00 0.00 C ATOM 922 SG CYS A 397 12.440 -9.637 -8.873 1.00 0.00 S ATOM 0 H CYS A 397 10.800 -6.298 -10.685 1.00 0.00 H new ATOM 0 HA CYS A 397 12.985 -7.994 -11.233 1.00 0.00 H new ATOM 0 HB2 CYS A 397 11.791 -7.333 -9.037 1.00 0.00 H new ATOM 0 HB3 CYS A 397 10.485 -8.401 -9.511 1.00 0.00 H new ATOM 0 HG CYS A 397 12.079 -9.778 -7.632 1.00 0.00 H new ATOM 927 N GLN A 398 12.283 -10.116 -12.248 1.00 0.00 N ATOM 928 CA GLN A 398 12.000 -11.294 -13.081 1.00 0.00 C ATOM 929 C GLN A 398 12.167 -12.626 -12.333 1.00 0.00 C ATOM 930 O GLN A 398 11.606 -13.637 -12.761 1.00 0.00 O ATOM 931 CB GLN A 398 12.856 -11.253 -14.360 1.00 0.00 C ATOM 932 CG GLN A 398 12.523 -10.042 -15.252 1.00 0.00 C ATOM 933 CD GLN A 398 13.282 -10.027 -16.581 1.00 0.00 C ATOM 934 OE1 GLN A 398 14.229 -10.768 -16.823 1.00 0.00 O ATOM 935 NE2 GLN A 398 12.894 -9.174 -17.508 1.00 0.00 N ATOM 0 H GLN A 398 13.232 -10.109 -11.875 1.00 0.00 H new ATOM 0 HA GLN A 398 10.946 -11.246 -13.355 1.00 0.00 H new ATOM 0 HB2 GLN A 398 13.911 -11.220 -14.087 1.00 0.00 H new ATOM 0 HB3 GLN A 398 12.702 -12.171 -14.927 1.00 0.00 H new ATOM 0 HG2 GLN A 398 11.452 -10.036 -15.456 1.00 0.00 H new ATOM 0 HG3 GLN A 398 12.749 -9.127 -14.705 1.00 0.00 H new ATOM 0 HE21 GLN A 398 12.109 -8.548 -17.329 1.00 0.00 H new ATOM 0 HE22 GLN A 398 13.379 -9.140 -18.405 1.00 0.00 H new ATOM 944 N ALA A 399 12.874 -12.639 -11.196 1.00 0.00 N ATOM 945 CA ALA A 399 12.996 -13.829 -10.356 1.00 0.00 C ATOM 946 C ALA A 399 11.773 -14.000 -9.449 1.00 0.00 C ATOM 947 O ALA A 399 11.232 -15.101 -9.344 1.00 0.00 O ATOM 948 CB ALA A 399 14.243 -13.721 -9.470 1.00 0.00 C ATOM 0 H ALA A 399 13.375 -11.826 -10.837 1.00 0.00 H new ATOM 0 HA ALA A 399 13.072 -14.691 -11.019 1.00 0.00 H new ATOM 0 HB1 ALA A 399 14.325 -14.612 -8.848 1.00 0.00 H new ATOM 0 HB2 ALA A 399 15.129 -13.634 -10.098 1.00 0.00 H new ATOM 0 HB3 ALA A 399 14.162 -12.840 -8.833 1.00 0.00 H new ATOM 954 N PRO A 400 11.373 -12.912 -8.780 1.00 0.00 N ATOM 955 CA PRO A 400 10.294 -12.803 -7.790 1.00 0.00 C ATOM 956 C PRO A 400 10.449 -13.701 -6.551 1.00 0.00 C ATOM 957 O PRO A 400 10.634 -13.213 -5.438 1.00 0.00 O ATOM 961 N LYS A 401 10.414 -15.022 -6.754 1.00 0.00 N ATOM 962 CA LYS A 401 10.603 -16.075 -5.734 1.00 0.00 C ATOM 963 C LYS A 401 12.089 -16.294 -5.439 1.00 0.00 C ATOM 964 O LYS A 401 12.508 -16.379 -4.285 1.00 0.00 O ATOM 965 CB LYS A 401 9.948 -17.397 -6.186 1.00 0.00 C ATOM 966 CG LYS A 401 8.421 -17.468 -5.991 1.00 0.00 C ATOM 967 CD LYS A 401 7.604 -16.583 -6.948 1.00 0.00 C ATOM 968 CE LYS A 401 6.098 -16.896 -6.882 1.00 0.00 C ATOM 969 NZ LYS A 401 5.456 -16.383 -5.642 1.00 0.00 N ATOM 0 H LYS A 401 10.245 -15.413 -7.681 1.00 0.00 H new ATOM 0 HA LYS A 401 10.117 -15.741 -4.817 1.00 0.00 H new ATOM 0 HB2 LYS A 401 10.172 -17.554 -7.241 1.00 0.00 H new ATOM 0 HB3 LYS A 401 10.408 -18.219 -5.637 1.00 0.00 H new ATOM 0 HG2 LYS A 401 8.101 -18.503 -6.114 1.00 0.00 H new ATOM 0 HG3 LYS A 401 8.187 -17.182 -4.966 1.00 0.00 H new ATOM 0 HD2 LYS A 401 7.767 -15.534 -6.700 1.00 0.00 H new ATOM 0 HD3 LYS A 401 7.960 -16.728 -7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 401 5.603 -16.460 -7.749 1.00 0.00 H new ATOM 0 HE3 LYS A 401 5.953 -17.975 -6.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 4.460 -16.680 -5.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 5.951 -16.765 -4.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 5.508 -15.344 -5.628 1.00 0.00 H new ATOM 983 N ALA A 402 12.885 -16.354 -6.509 1.00 0.00 N ATOM 984 CA ALA A 402 14.340 -16.524 -6.504 1.00 0.00 C ATOM 985 C ALA A 402 15.094 -15.222 -6.148 1.00 0.00 C ATOM 986 O ALA A 402 16.306 -15.255 -5.930 1.00 0.00 O ATOM 987 CB ALA A 402 14.785 -17.156 -7.832 1.00 0.00 C ATOM 0 H ALA A 402 12.511 -16.281 -7.455 1.00 0.00 H new ATOM 0 HA ALA A 402 14.611 -17.211 -5.703 1.00 0.00 H new ATOM 0 HB1 ALA A 402 15.868 -17.283 -7.830 1.00 0.00 H new ATOM 0 HB2 ALA A 402 14.306 -18.128 -7.951 1.00 0.00 H new ATOM 0 HB3 ALA A 402 14.498 -16.506 -8.659 1.00 0.00 H new ATOM 993 N CYS A 403 14.391 -14.078 -6.086 1.00 0.00 N ATOM 994 CA CYS A 403 14.897 -12.755 -5.733 1.00 0.00 C ATOM 995 C CYS A 403 15.017 -12.622 -4.217 1.00 0.00 C ATOM 996 O CYS A 403 14.466 -11.721 -3.588 1.00 0.00 O ATOM 997 CB CYS A 403 14.062 -11.616 -6.297 1.00 0.00 C ATOM 998 SG CYS A 403 15.114 -10.131 -6.400 1.00 0.00 S ATOM 0 H CYS A 403 13.393 -14.059 -6.295 1.00 0.00 H new ATOM 0 HA CYS A 403 15.882 -12.670 -6.192 1.00 0.00 H new ATOM 0 HB2 CYS A 403 13.678 -11.879 -7.283 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.199 -11.426 -5.659 1.00 0.00 H new ATOM 0 HG CYS A 403 15.545 -9.822 -5.213 1.00 0.00 H new ATOM 1003 N GLN A 404 15.717 -13.600 -3.664 1.00 0.00 N ATOM 1004 CA GLN A 404 16.127 -13.845 -2.276 1.00 0.00 C ATOM 1005 C GLN A 404 16.477 -12.594 -1.439 1.00 0.00 C ATOM 1006 O GLN A 404 16.615 -12.722 -0.219 1.00 0.00 O ATOM 1007 CB GLN A 404 17.267 -14.882 -2.260 1.00 0.00 C ATOM 1008 CG GLN A 404 16.767 -16.304 -2.571 1.00 0.00 C ATOM 1009 CD GLN A 404 17.881 -17.354 -2.570 1.00 0.00 C ATOM 1010 OE1 GLN A 404 19.050 -17.089 -2.827 1.00 0.00 O ATOM 1011 NE2 GLN A 404 17.567 -18.600 -2.278 1.00 0.00 N ATOM 0 H GLN A 404 16.063 -14.352 -4.260 1.00 0.00 H new ATOM 0 HA GLN A 404 15.244 -14.235 -1.770 1.00 0.00 H new ATOM 0 HB2 GLN A 404 18.024 -14.598 -2.991 1.00 0.00 H new ATOM 0 HB3 GLN A 404 17.749 -14.874 -1.282 1.00 0.00 H new ATOM 0 HG2 GLN A 404 16.013 -16.585 -1.836 1.00 0.00 H new ATOM 0 HG3 GLN A 404 16.278 -16.304 -3.545 1.00 0.00 H new ATOM 0 HE21 GLN A 404 16.601 -18.845 -2.061 1.00 0.00 H new ATOM 0 HE22 GLN A 404 18.290 -19.319 -2.269 1.00 0.00 H new ATOM 1020 N VAL A 405 16.587 -11.398 -2.043 1.00 0.00 N ATOM 1021 CA VAL A 405 16.733 -10.123 -1.309 1.00 0.00 C ATOM 1022 C VAL A 405 15.551 -10.034 -0.333 1.00 0.00 C ATOM 1023 O VAL A 405 14.405 -10.064 -0.776 1.00 0.00 O ATOM 1024 CB VAL A 405 16.704 -8.907 -2.257 1.00 0.00 C ATOM 1025 CG1 VAL A 405 16.934 -7.600 -1.484 1.00 0.00 C ATOM 1026 CG2 VAL A 405 17.771 -8.999 -3.349 1.00 0.00 C ATOM 0 H VAL A 405 16.577 -11.285 -3.057 1.00 0.00 H new ATOM 0 HA VAL A 405 17.694 -10.106 -0.794 1.00 0.00 H new ATOM 0 HB VAL A 405 15.716 -8.910 -2.718 1.00 0.00 H new ATOM 0 HG11 VAL A 405 16.909 -6.759 -2.176 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.151 -7.478 -0.735 1.00 0.00 H new ATOM 0 HG13 VAL A 405 17.905 -7.635 -0.991 1.00 0.00 H new ATOM 0 HG21 VAL A 405 17.711 -8.120 -3.991 1.00 0.00 H new ATOM 0 HG22 VAL A 405 18.758 -9.046 -2.890 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.605 -9.896 -3.945 1.00 0.00 H new ATOM 1036 N ALA A 406 15.816 -9.992 0.977 1.00 0.00 N ATOM 1037 CA ALA A 406 14.811 -10.069 2.047 1.00 0.00 C ATOM 1038 C ALA A 406 13.447 -9.422 1.741 1.00 0.00 C ATOM 1039 O ALA A 406 12.427 -10.120 1.653 1.00 0.00 O ATOM 1040 CB ALA A 406 15.438 -9.533 3.341 1.00 0.00 C ATOM 0 H ALA A 406 16.767 -9.900 1.335 1.00 0.00 H new ATOM 0 HA ALA A 406 14.546 -11.121 2.154 1.00 0.00 H new ATOM 0 HB1 ALA A 406 14.706 -9.582 4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 406 16.307 -10.137 3.602 1.00 0.00 H new ATOM 0 HB3 ALA A 406 15.747 -8.498 3.194 1.00 0.00 H new ATOM 1046 N HIS A 407 13.428 -8.098 1.561 1.00 0.00 N ATOM 1047 CA HIS A 407 12.186 -7.374 1.293 1.00 0.00 C ATOM 1048 C HIS A 407 11.544 -7.749 -0.051 1.00 0.00 C ATOM 1049 O HIS A 407 10.325 -7.864 -0.071 1.00 0.00 O ATOM 1050 CB HIS A 407 12.339 -5.848 1.431 1.00 0.00 C ATOM 1051 CG HIS A 407 13.053 -5.405 2.686 1.00 0.00 C ATOM 1052 ND1 HIS A 407 12.592 -5.536 3.978 1.00 0.00 N ATOM 1053 CD2 HIS A 407 14.277 -4.795 2.755 1.00 0.00 C ATOM 1054 CE1 HIS A 407 13.517 -5.021 4.807 1.00 0.00 C ATOM 1055 NE2 HIS A 407 14.567 -4.556 4.106 1.00 0.00 N ATOM 0 H HIS A 407 14.259 -7.508 1.596 1.00 0.00 H new ATOM 0 HA HIS A 407 11.498 -7.700 2.073 1.00 0.00 H new ATOM 0 HB2 HIS A 407 12.882 -5.470 0.565 1.00 0.00 H new ATOM 0 HB3 HIS A 407 11.349 -5.392 1.410 1.00 0.00 H new ATOM 0 HD2 HIS A 407 14.908 -4.542 1.916 1.00 0.00 H new ATOM 0 HE1 HIS A 407 13.429 -4.986 5.883 1.00 0.00 H new ATOM 0 HE2 HIS A 407 15.407 -4.117 4.482 1.00 0.00 H new ATOM 1063 N CYS A 408 12.291 -7.994 -1.143 1.00 0.00 N ATOM 1064 CA CYS A 408 11.679 -8.369 -2.427 1.00 0.00 C ATOM 1065 C CYS A 408 11.097 -9.794 -2.399 1.00 0.00 C ATOM 1066 O CYS A 408 9.922 -9.969 -2.740 1.00 0.00 O ATOM 1067 CB CYS A 408 12.709 -8.229 -3.558 1.00 0.00 C ATOM 1068 SG CYS A 408 11.955 -8.684 -5.158 1.00 0.00 S ATOM 0 H CYS A 408 13.309 -7.939 -1.161 1.00 0.00 H new ATOM 0 HA CYS A 408 10.847 -7.689 -2.609 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.077 -7.204 -3.600 1.00 0.00 H new ATOM 0 HB3 CYS A 408 13.569 -8.868 -3.358 1.00 0.00 H new ATOM 0 HG CYS A 408 12.851 -9.241 -5.917 1.00 0.00 H new ATOM 1073 N ALA A 409 11.868 -10.792 -1.946 1.00 0.00 N ATOM 1074 CA ALA A 409 11.400 -12.173 -1.808 1.00 0.00 C ATOM 1075 C ALA A 409 10.116 -12.204 -0.961 1.00 0.00 C ATOM 1076 O ALA A 409 9.100 -12.781 -1.372 1.00 0.00 O ATOM 1077 CB ALA A 409 12.510 -13.046 -1.203 1.00 0.00 C ATOM 0 H ALA A 409 12.839 -10.660 -1.664 1.00 0.00 H new ATOM 0 HA ALA A 409 11.160 -12.582 -2.789 1.00 0.00 H new ATOM 0 HB1 ALA A 409 12.153 -14.071 -1.104 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.384 -13.027 -1.855 1.00 0.00 H new ATOM 0 HB3 ALA A 409 12.782 -12.660 -0.221 1.00 0.00 H new ATOM 1083 N SER A 410 10.135 -11.504 0.186 1.00 0.00 N ATOM 1084 CA SER A 410 8.944 -11.361 1.026 1.00 0.00 C ATOM 1085 C SER A 410 7.818 -10.688 0.237 1.00 0.00 C ATOM 1086 O SER A 410 6.744 -11.270 0.115 1.00 0.00 O ATOM 1087 CB SER A 410 9.237 -10.558 2.301 1.00 0.00 C ATOM 1088 OG SER A 410 10.230 -11.194 3.088 1.00 0.00 O ATOM 0 H SER A 410 10.963 -11.031 0.548 1.00 0.00 H new ATOM 0 HA SER A 410 8.633 -12.362 1.325 1.00 0.00 H new ATOM 0 HB2 SER A 410 9.568 -9.554 2.034 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.322 -10.448 2.883 1.00 0.00 H new ATOM 0 HG SER A 410 11.118 -10.952 2.752 1.00 0.00 H new ATOM 1094 N SER A 411 8.061 -9.501 -0.335 1.00 0.00 N ATOM 1095 CA SER A 411 7.075 -8.724 -1.097 1.00 0.00 C ATOM 1096 C SER A 411 6.316 -9.552 -2.123 1.00 0.00 C ATOM 1097 O SER A 411 5.086 -9.553 -2.126 1.00 0.00 O ATOM 1098 CB SER A 411 7.707 -7.475 -1.761 1.00 0.00 C ATOM 1099 OG SER A 411 8.321 -7.720 -3.011 1.00 0.00 O ATOM 0 H SER A 411 8.971 -9.044 -0.279 1.00 0.00 H new ATOM 0 HA SER A 411 6.344 -8.388 -0.362 1.00 0.00 H new ATOM 0 HB2 SER A 411 6.933 -6.719 -1.893 1.00 0.00 H new ATOM 0 HB3 SER A 411 8.450 -7.055 -1.082 1.00 0.00 H new ATOM 0 HG SER A 411 8.896 -8.511 -2.944 1.00 0.00 H new ATOM 1105 N ARG A 412 7.032 -10.298 -2.966 1.00 0.00 N ATOM 1106 CA ARG A 412 6.430 -11.139 -3.993 1.00 0.00 C ATOM 1107 C ARG A 412 5.695 -12.324 -3.389 1.00 0.00 C ATOM 1108 O ARG A 412 4.631 -12.656 -3.896 1.00 0.00 O ATOM 1109 CB ARG A 412 7.498 -11.567 -5.008 1.00 0.00 C ATOM 1110 CG ARG A 412 7.672 -10.507 -6.111 1.00 0.00 C ATOM 1111 CD ARG A 412 6.712 -10.726 -7.292 1.00 0.00 C ATOM 1112 NE ARG A 412 7.160 -9.987 -8.494 1.00 0.00 N ATOM 1113 CZ ARG A 412 7.520 -10.485 -9.666 1.00 0.00 C ATOM 1114 NH1 ARG A 412 7.428 -11.750 -9.963 1.00 0.00 N ATOM 1115 NH2 ARG A 412 7.993 -9.692 -10.576 1.00 0.00 N ATOM 0 H ARG A 412 8.051 -10.333 -2.952 1.00 0.00 H new ATOM 0 HA ARG A 412 5.676 -10.558 -4.524 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.448 -11.723 -4.497 1.00 0.00 H new ATOM 0 HB3 ARG A 412 7.217 -12.520 -5.456 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.504 -9.516 -5.689 1.00 0.00 H new ATOM 0 HG3 ARG A 412 8.700 -10.529 -6.473 1.00 0.00 H new ATOM 0 HD2 ARG A 412 6.649 -11.790 -7.519 1.00 0.00 H new ATOM 0 HD3 ARG A 412 5.710 -10.399 -7.014 1.00 0.00 H new ATOM 0 HE ARG A 412 7.195 -8.971 -8.408 1.00 0.00 H new ATOM 0 HH11 ARG A 412 7.064 -12.410 -9.276 1.00 0.00 H new ATOM 0 HH12 ARG A 412 7.720 -12.080 -10.883 1.00 0.00 H new ATOM 0 HH21 ARG A 412 8.085 -8.694 -10.385 1.00 0.00 H new ATOM 0 HH22 ARG A 412 8.273 -10.066 -11.483 1.00 0.00 H new ATOM 1129 N GLN A 413 6.182 -12.935 -2.305 1.00 0.00 N ATOM 1130 CA GLN A 413 5.432 -14.018 -1.647 1.00 0.00 C ATOM 1131 C GLN A 413 4.082 -13.523 -1.084 1.00 0.00 C ATOM 1132 O GLN A 413 3.043 -14.131 -1.368 1.00 0.00 O ATOM 1133 CB GLN A 413 6.298 -14.697 -0.572 1.00 0.00 C ATOM 1134 CG GLN A 413 7.376 -15.612 -1.186 1.00 0.00 C ATOM 1135 CD GLN A 413 6.784 -16.855 -1.850 1.00 0.00 C ATOM 1136 OE1 GLN A 413 6.418 -16.857 -3.020 1.00 0.00 O ATOM 1137 NE2 GLN A 413 6.651 -17.953 -1.139 1.00 0.00 N ATOM 0 H GLN A 413 7.075 -12.707 -1.868 1.00 0.00 H new ATOM 0 HA GLN A 413 5.190 -14.768 -2.400 1.00 0.00 H new ATOM 0 HB2 GLN A 413 6.778 -13.934 0.041 1.00 0.00 H new ATOM 0 HB3 GLN A 413 5.660 -15.283 0.089 1.00 0.00 H new ATOM 0 HG2 GLN A 413 7.948 -15.049 -1.923 1.00 0.00 H new ATOM 0 HG3 GLN A 413 8.074 -15.918 -0.407 1.00 0.00 H new ATOM 0 HE21 GLN A 413 6.950 -17.969 -0.164 1.00 0.00 H new ATOM 0 HE22 GLN A 413 6.248 -18.789 -1.562 1.00 0.00 H new ATOM 1146 N ILE A 414 4.051 -12.391 -0.368 1.00 0.00 N ATOM 1147 CA ILE A 414 2.784 -11.820 0.122 1.00 0.00 C ATOM 1148 C ILE A 414 1.823 -11.332 -0.955 1.00 0.00 C ATOM 1149 O ILE A 414 0.613 -11.523 -0.831 1.00 0.00 O ATOM 1150 CB ILE A 414 2.924 -10.778 1.252 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.177 -9.892 1.368 1.00 0.00 C ATOM 1152 CG2 ILE A 414 2.385 -11.390 2.554 1.00 0.00 C ATOM 1153 CD1 ILE A 414 5.181 -10.363 2.427 1.00 0.00 C ATOM 0 H ILE A 414 4.881 -11.854 -0.115 1.00 0.00 H new ATOM 0 HA ILE A 414 2.321 -12.701 0.567 1.00 0.00 H new ATOM 0 HB ILE A 414 2.299 -9.944 0.932 1.00 0.00 H new ATOM 0 HG12 ILE A 414 4.676 -9.858 0.399 1.00 0.00 H new ATOM 0 HG13 ILE A 414 3.868 -8.873 1.603 1.00 0.00 H new ATOM 0 HG21 ILE A 414 2.477 -10.665 3.362 1.00 0.00 H new ATOM 0 HG22 ILE A 414 1.336 -11.657 2.424 1.00 0.00 H new ATOM 0 HG23 ILE A 414 2.959 -12.283 2.801 1.00 0.00 H new ATOM 0 HD11 ILE A 414 6.035 -9.686 2.446 1.00 0.00 H new ATOM 0 HD12 ILE A 414 4.701 -10.369 3.406 1.00 0.00 H new ATOM 0 HD13 ILE A 414 5.522 -11.369 2.183 1.00 0.00 H new ATOM 1165 N ILE A 415 2.327 -10.704 -2.009 1.00 0.00 N ATOM 1166 CA ILE A 415 1.474 -10.213 -3.095 1.00 0.00 C ATOM 1167 C ILE A 415 1.029 -11.370 -4.000 1.00 0.00 C ATOM 1168 O ILE A 415 -0.076 -11.331 -4.529 1.00 0.00 O ATOM 1169 CB ILE A 415 2.182 -9.017 -3.748 1.00 0.00 C ATOM 1170 CG1 ILE A 415 1.756 -7.710 -3.035 1.00 0.00 C ATOM 1171 CG2 ILE A 415 1.927 -8.904 -5.253 1.00 0.00 C ATOM 1172 CD1 ILE A 415 1.977 -7.728 -1.528 1.00 0.00 C ATOM 0 H ILE A 415 3.322 -10.520 -2.140 1.00 0.00 H new ATOM 0 HA ILE A 415 0.519 -9.820 -2.748 1.00 0.00 H new ATOM 0 HB ILE A 415 3.253 -9.182 -3.632 1.00 0.00 H new ATOM 0 HG12 ILE A 415 2.312 -6.876 -3.464 1.00 0.00 H new ATOM 0 HG13 ILE A 415 0.700 -7.526 -3.235 1.00 0.00 H new ATOM 0 HG21 ILE A 415 2.457 -8.037 -5.648 1.00 0.00 H new ATOM 0 HG22 ILE A 415 2.283 -9.806 -5.751 1.00 0.00 H new ATOM 0 HG23 ILE A 415 0.858 -8.788 -5.433 1.00 0.00 H new ATOM 0 HD11 ILE A 415 1.654 -6.778 -1.102 1.00 0.00 H new ATOM 0 HD12 ILE A 415 1.399 -8.539 -1.085 1.00 0.00 H new ATOM 0 HD13 ILE A 415 3.036 -7.879 -1.317 1.00 0.00 H new ATOM 1184 N SER A 416 1.805 -12.456 -4.085 1.00 0.00 N ATOM 1185 CA SER A 416 1.404 -13.706 -4.744 1.00 0.00 C ATOM 1186 C SER A 416 0.225 -14.295 -3.959 1.00 0.00 C ATOM 1187 O SER A 416 -0.783 -14.657 -4.564 1.00 0.00 O ATOM 1188 CB SER A 416 2.585 -14.659 -4.848 1.00 0.00 C ATOM 1189 OG SER A 416 2.308 -15.870 -5.532 1.00 0.00 O ATOM 0 H SER A 416 2.745 -12.493 -3.691 1.00 0.00 H new ATOM 0 HA SER A 416 1.081 -13.523 -5.769 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.403 -14.149 -5.357 1.00 0.00 H new ATOM 0 HB3 SER A 416 2.933 -14.896 -3.843 1.00 0.00 H new ATOM 0 HG SER A 416 2.467 -16.628 -4.932 1.00 0.00 H new ATOM 1195 N HIS A 417 0.288 -14.294 -2.614 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.873 -14.624 -1.773 1.00 0.00 C ATOM 1197 C HIS A 417 -2.059 -13.708 -2.117 1.00 0.00 C ATOM 1198 O HIS A 417 -3.120 -14.217 -2.469 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.527 -14.567 -0.266 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.682 -14.181 0.631 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -1.846 -12.957 1.246 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.901 -14.786 0.638 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.142 -12.820 1.581 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.831 -13.916 1.227 1.00 0.00 N ATOM 0 H HIS A 417 1.132 -14.068 -2.088 1.00 0.00 H new ATOM 0 HA HIS A 417 -1.163 -15.653 -1.987 1.00 0.00 H new ATOM 0 HB2 HIS A 417 -0.153 -15.543 0.045 1.00 0.00 H new ATOM 0 HB3 HIS A 417 0.284 -13.853 -0.120 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -3.117 -15.772 0.254 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -3.567 -11.953 2.065 1.00 0.00 H new ATOM 0 HE2 HIS A 417 -4.829 -14.083 1.359 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.896 -12.382 -2.048 1.00 0.00 N ATOM 1213 CA TRP A 418 -2.979 -11.427 -2.326 1.00 0.00 C ATOM 1214 C TRP A 418 -3.632 -11.636 -3.706 1.00 0.00 C ATOM 1215 O TRP A 418 -4.854 -11.522 -3.839 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.465 -9.993 -2.147 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.546 -8.960 -2.039 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -4.435 -8.867 -1.024 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -3.891 -7.885 -2.969 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -5.308 -7.823 -1.261 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -5.024 -7.187 -2.449 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -3.366 -7.426 -4.198 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -5.614 -6.102 -3.115 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -3.944 -6.331 -4.873 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -5.067 -5.672 -4.338 1.00 0.00 C ATOM 0 H TRP A 418 -1.012 -11.939 -1.798 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.773 -11.611 -1.603 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -1.847 -9.950 -1.250 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -1.822 -9.742 -2.990 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -4.459 -9.512 -0.158 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -6.068 -7.557 -0.635 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -2.508 -7.922 -4.627 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -6.475 -5.604 -2.695 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -3.521 -5.995 -5.808 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -5.508 -4.839 -4.865 1.00 0.00 H new ATOM 1236 N LYS A 419 -2.837 -11.997 -4.725 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.313 -12.317 -6.083 1.00 0.00 C ATOM 1238 C LYS A 419 -4.079 -13.648 -6.140 1.00 0.00 C ATOM 1239 O LYS A 419 -5.148 -13.721 -6.750 1.00 0.00 O ATOM 1240 CB LYS A 419 -2.104 -12.390 -7.035 1.00 0.00 C ATOM 1241 CG LYS A 419 -1.520 -11.012 -7.381 1.00 0.00 C ATOM 1242 CD LYS A 419 -0.120 -11.173 -7.999 1.00 0.00 C ATOM 1243 CE LYS A 419 0.524 -9.837 -8.378 1.00 0.00 C ATOM 1244 NZ LYS A 419 -0.220 -9.121 -9.452 1.00 0.00 N ATOM 0 H LYS A 419 -1.825 -12.077 -4.628 1.00 0.00 H new ATOM 0 HA LYS A 419 -4.003 -11.529 -6.384 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.327 -13.002 -6.578 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.404 -12.891 -7.955 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -2.177 -10.494 -8.080 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -1.461 -10.397 -6.483 1.00 0.00 H new ATOM 0 HD2 LYS A 419 0.526 -11.693 -7.292 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -0.191 -11.801 -8.887 1.00 0.00 H new ATOM 0 HE2 LYS A 419 0.578 -9.201 -7.494 1.00 0.00 H new ATOM 0 HE3 LYS A 419 1.548 -10.013 -8.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 0.296 -8.258 -9.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -0.309 -9.739 -10.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -1.167 -8.866 -9.107 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.520 -14.704 -5.545 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.056 -16.071 -5.564 1.00 0.00 C ATOM 1260 C ASN A 420 -5.201 -16.366 -4.569 1.00 0.00 C ATOM 1261 O ASN A 420 -5.902 -17.365 -4.755 1.00 0.00 O ATOM 1262 CB ASN A 420 -2.893 -17.057 -5.329 1.00 0.00 C ATOM 1263 CG ASN A 420 -1.826 -17.055 -6.416 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -1.986 -16.533 -7.513 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -0.695 -17.676 -6.156 1.00 0.00 N ATOM 0 H ASN A 420 -2.650 -14.630 -5.017 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.514 -16.193 -6.545 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.421 -16.820 -4.375 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.301 -18.064 -5.241 1.00 0.00 H new ATOM 0 HD21 ASN A 420 0.038 -17.719 -6.864 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -0.551 -18.114 -5.246 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.369 -15.565 -3.509 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.345 -15.774 -2.434 1.00 0.00 C ATOM 1274 C CYS A 421 -7.768 -16.070 -2.955 1.00 0.00 C ATOM 1275 O CYS A 421 -8.398 -15.252 -3.634 1.00 0.00 O ATOM 1276 CB CYS A 421 -6.284 -14.591 -1.457 1.00 0.00 C ATOM 1277 SG CYS A 421 -6.987 -15.072 0.147 1.00 0.00 S ATOM 0 H CYS A 421 -4.809 -14.724 -3.372 1.00 0.00 H new ATOM 0 HA CYS A 421 -6.073 -16.678 -1.890 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -5.251 -14.268 -1.328 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -6.834 -13.743 -1.865 1.00 0.00 H new ATOM 0 HG CYS A 421 -8.208 -14.634 0.235 1.00 0.00 H new ATOM 1282 N THR A 422 -8.259 -17.272 -2.643 1.00 0.00 N ATOM 1283 CA THR A 422 -9.566 -17.808 -3.062 1.00 0.00 C ATOM 1284 C THR A 422 -10.769 -17.176 -2.353 1.00 0.00 C ATOM 1285 O THR A 422 -11.912 -17.437 -2.742 1.00 0.00 O ATOM 1286 CB THR A 422 -9.615 -19.330 -2.834 1.00 0.00 C ATOM 1287 OG1 THR A 422 -9.280 -19.635 -1.494 1.00 0.00 O ATOM 1288 CG2 THR A 422 -8.635 -20.079 -3.740 1.00 0.00 C ATOM 0 H THR A 422 -7.737 -17.931 -2.066 1.00 0.00 H new ATOM 0 HA THR A 422 -9.649 -17.557 -4.119 1.00 0.00 H new ATOM 0 HB THR A 422 -10.632 -19.647 -3.066 1.00 0.00 H new ATOM 0 HG1 THR A 422 -9.316 -20.605 -1.360 1.00 0.00 H new ATOM 0 HG21 THR A 422 -8.704 -21.149 -3.545 1.00 0.00 H new ATOM 0 HG22 THR A 422 -8.882 -19.884 -4.783 1.00 0.00 H new ATOM 0 HG23 THR A 422 -7.620 -19.738 -3.538 1.00 0.00 H new ATOM 1296 N ARG A 423 -10.538 -16.346 -1.325 1.00 0.00 N ATOM 1297 CA ARG A 423 -11.581 -15.688 -0.520 1.00 0.00 C ATOM 1298 C ARG A 423 -11.233 -14.231 -0.195 1.00 0.00 C ATOM 1299 O ARG A 423 -10.225 -13.946 0.443 1.00 0.00 O ATOM 1300 CB ARG A 423 -11.860 -16.541 0.740 1.00 0.00 C ATOM 1301 CG ARG A 423 -10.678 -16.719 1.715 1.00 0.00 C ATOM 1302 CD ARG A 423 -10.959 -17.774 2.794 1.00 0.00 C ATOM 1303 NE ARG A 423 -12.040 -17.372 3.715 1.00 0.00 N ATOM 1304 CZ ARG A 423 -12.384 -17.957 4.846 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -11.790 -19.025 5.303 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -13.360 -17.452 5.535 1.00 0.00 N ATOM 0 H ARG A 423 -9.594 -16.106 -1.021 1.00 0.00 H new ATOM 0 HA ARG A 423 -12.500 -15.630 -1.104 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -12.688 -16.088 1.284 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -12.192 -17.528 0.419 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -9.789 -17.006 1.154 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -10.459 -15.764 2.193 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -11.227 -18.716 2.315 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -10.049 -17.955 3.366 1.00 0.00 H new ATOM 0 HE ARG A 423 -12.581 -16.550 3.447 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -11.022 -19.445 4.779 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -12.094 -19.440 6.184 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -13.844 -16.619 5.199 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -13.643 -17.887 6.413 1.00 0.00 H new ATOM 1320 N HIS A 424 -12.076 -13.289 -0.624 1.00 0.00 N ATOM 1321 CA HIS A 424 -11.902 -11.857 -0.356 1.00 0.00 C ATOM 1322 C HIS A 424 -11.993 -11.507 1.144 1.00 0.00 C ATOM 1323 O HIS A 424 -11.460 -10.493 1.583 1.00 0.00 O ATOM 1324 CB HIS A 424 -12.962 -11.059 -1.135 1.00 0.00 C ATOM 1325 CG HIS A 424 -12.794 -11.015 -2.638 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -13.612 -10.324 -3.505 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -11.803 -11.586 -3.398 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -13.139 -10.477 -4.752 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -12.025 -11.232 -4.736 1.00 0.00 N ATOM 0 H HIS A 424 -12.909 -13.500 -1.174 1.00 0.00 H new ATOM 0 HA HIS A 424 -10.898 -11.590 -0.684 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -13.942 -11.482 -0.912 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -12.964 -10.035 -0.760 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -10.995 -12.200 -3.030 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -13.587 -10.055 -5.639 1.00 0.00 H new ATOM 0 HE2 HIS A 424 -11.454 -11.495 -5.540 1.00 0.00 H new ATOM 1337 N ASP A 425 -12.637 -12.370 1.930 1.00 0.00 N ATOM 1338 CA ASP A 425 -12.889 -12.300 3.374 1.00 0.00 C ATOM 1339 C ASP A 425 -11.724 -12.862 4.210 1.00 0.00 C ATOM 1340 O ASP A 425 -11.895 -13.404 5.305 1.00 0.00 O ATOM 1341 CB ASP A 425 -14.249 -12.952 3.681 1.00 0.00 C ATOM 1342 CG ASP A 425 -14.349 -14.390 3.154 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -14.667 -14.564 1.954 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -14.089 -15.345 3.922 1.00 0.00 O ATOM 0 H ASP A 425 -13.036 -13.221 1.534 1.00 0.00 H new ATOM 0 HA ASP A 425 -12.945 -11.254 3.676 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -14.412 -12.952 4.759 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -15.044 -12.351 3.238 1.00 0.00 H new ATOM 1349 N CYS A 426 -10.519 -12.695 3.672 1.00 0.00 N ATOM 1350 CA CYS A 426 -9.258 -13.103 4.295 1.00 0.00 C ATOM 1351 C CYS A 426 -8.943 -12.175 5.493 1.00 0.00 C ATOM 1352 O CYS A 426 -9.260 -10.981 5.414 1.00 0.00 O ATOM 1353 CB CYS A 426 -8.191 -13.021 3.200 1.00 0.00 C ATOM 1354 SG CYS A 426 -6.580 -13.728 3.668 1.00 0.00 S ATOM 0 H CYS A 426 -10.386 -12.258 2.760 1.00 0.00 H new ATOM 0 HA CYS A 426 -9.301 -14.117 4.694 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -8.557 -13.538 2.313 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -8.050 -11.976 2.925 1.00 0.00 H new ATOM 0 HG CYS A 426 -5.625 -12.976 3.207 1.00 0.00 H new ATOM 1359 N PRO A 427 -8.295 -12.659 6.575 1.00 0.00 N ATOM 1360 CA PRO A 427 -7.878 -11.847 7.727 1.00 0.00 C ATOM 1361 C PRO A 427 -6.973 -10.645 7.385 1.00 0.00 C ATOM 1362 O PRO A 427 -6.650 -9.858 8.276 1.00 0.00 O ATOM 1363 CB PRO A 427 -7.139 -12.800 8.677 1.00 0.00 C ATOM 1364 CG PRO A 427 -7.608 -14.190 8.263 1.00 0.00 C ATOM 1365 CD PRO A 427 -7.875 -14.036 6.770 1.00 0.00 C ATOM 0 HA PRO A 427 -8.769 -11.399 8.166 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -6.058 -12.700 8.578 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -7.385 -12.592 9.718 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -6.849 -14.947 8.461 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -8.505 -14.490 8.804 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -6.979 -14.256 6.189 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -8.648 -14.730 6.439 1.00 0.00 H new ATOM 1373 N VAL A 428 -6.546 -10.514 6.121 1.00 0.00 N ATOM 1374 CA VAL A 428 -5.676 -9.451 5.601 1.00 0.00 C ATOM 1375 C VAL A 428 -6.253 -8.805 4.323 1.00 0.00 C ATOM 1376 O VAL A 428 -6.348 -7.569 4.267 1.00 0.00 O ATOM 1377 CB VAL A 428 -4.267 -10.017 5.367 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -3.330 -8.857 5.036 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -3.701 -10.743 6.594 1.00 0.00 C ATOM 0 H VAL A 428 -6.812 -11.181 5.397 1.00 0.00 H new ATOM 0 HA VAL A 428 -5.618 -8.654 6.342 1.00 0.00 H new ATOM 0 HB VAL A 428 -4.339 -10.740 4.555 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -2.323 -9.239 4.866 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.682 -8.350 4.137 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -3.315 -8.153 5.868 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -2.704 -11.120 6.366 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -3.644 -10.049 7.433 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -4.353 -11.576 6.856 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.708 -9.598 3.335 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.392 -9.061 2.153 1.00 0.00 C ATOM 1391 C CYS A 429 -8.624 -8.206 2.484 1.00 0.00 C ATOM 1392 O CYS A 429 -8.679 -7.069 2.024 1.00 0.00 O ATOM 1393 CB CYS A 429 -7.662 -10.091 1.036 1.00 0.00 C ATOM 1394 SG CYS A 429 -6.440 -11.440 0.916 1.00 0.00 S ATOM 0 H CYS A 429 -6.612 -10.613 3.336 1.00 0.00 H new ATOM 0 HA CYS A 429 -6.658 -8.377 1.726 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.648 -10.528 1.196 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -7.697 -9.567 0.081 1.00 0.00 H new ATOM 0 HG CYS A 429 -7.049 -12.553 0.631 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.589 -8.692 3.276 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.767 -7.914 3.650 1.00 0.00 C ATOM 1401 C LEU A 430 -10.417 -6.552 4.294 1.00 0.00 C ATOM 1402 O LEU A 430 -10.866 -5.524 3.772 1.00 0.00 O ATOM 1403 CB LEU A 430 -11.724 -8.771 4.477 1.00 0.00 C ATOM 1404 CG LEU A 430 -13.172 -8.743 3.972 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -14.109 -9.337 5.031 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -13.731 -7.378 3.589 1.00 0.00 C ATOM 0 H LEU A 430 -9.571 -9.632 3.672 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.296 -7.637 2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -11.368 -9.801 4.476 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -11.703 -8.428 5.511 1.00 0.00 H new ATOM 0 HG LEU A 430 -13.132 -9.329 3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -15.135 -9.313 4.664 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -13.821 -10.368 5.235 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -14.038 -8.753 5.948 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -14.760 -7.489 3.248 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -13.705 -6.718 4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -13.128 -6.949 2.788 1.00 0.00 H new ATOM 1418 N PRO A 431 -9.578 -6.494 5.353 1.00 0.00 N ATOM 1419 CA PRO A 431 -9.063 -5.233 5.892 1.00 0.00 C ATOM 1420 C PRO A 431 -8.538 -4.280 4.814 1.00 0.00 C ATOM 1421 O PRO A 431 -8.964 -3.128 4.740 1.00 0.00 O ATOM 1422 CB PRO A 431 -7.902 -5.638 6.798 1.00 0.00 C ATOM 1423 CG PRO A 431 -8.324 -6.997 7.324 1.00 0.00 C ATOM 1424 CD PRO A 431 -9.024 -7.614 6.114 1.00 0.00 C ATOM 0 HA PRO A 431 -9.863 -4.696 6.402 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -6.963 -5.694 6.247 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -7.755 -4.922 7.607 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -7.469 -7.592 7.646 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -8.993 -6.911 8.180 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -8.323 -8.188 5.508 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -9.811 -8.300 6.427 1.00 0.00 H new ATOM 1432 N LEU A 432 -7.625 -4.756 3.957 1.00 0.00 N ATOM 1433 CA LEU A 432 -7.041 -3.942 2.879 1.00 0.00 C ATOM 1434 C LEU A 432 -8.023 -3.512 1.799 1.00 0.00 C ATOM 1435 O LEU A 432 -7.838 -2.464 1.170 1.00 0.00 O ATOM 1436 CB LEU A 432 -5.898 -4.722 2.231 1.00 0.00 C ATOM 1437 CG LEU A 432 -4.599 -4.382 2.978 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -3.652 -5.575 2.948 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -3.973 -3.130 2.358 1.00 0.00 C ATOM 0 H LEU A 432 -7.271 -5.712 3.990 1.00 0.00 H new ATOM 0 HA LEU A 432 -6.695 -3.023 3.351 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -6.094 -5.793 2.278 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -5.809 -4.460 1.177 1.00 0.00 H new ATOM 0 HG LEU A 432 -4.812 -4.167 4.025 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -2.734 -5.324 3.480 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.128 -6.430 3.429 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -3.415 -5.826 1.914 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -3.051 -2.885 2.885 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -3.752 -3.316 1.307 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -4.670 -2.296 2.440 1.00 0.00 H new