USER MOD reduce.3.24.130724 H: found=0, std=0, add=624, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 624 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: A1964 GLN : amide:sc= 0.35 K(o=1.9,f=1.2) USER MOD Set 1.2: A2002 THR OG1 : rot 82:sc= 1.58 USER MOD Set 2.1: A1989 SER OG : rot 69:sc= 0.919 USER MOD Set 2.2: A2013 TYR OH : rot 30:sc= 0.808 USER MOD Set 3.1: A1953 ASN : amide:sc= -1.61 K(o=-1.5,f=-0.87) USER MOD Set 3.2: A1955 SER OG : rot 180:sc= 0.106 USER MOD Single : A1958 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1959 GLN : amide:sc= -0.809 K(o=-0.81,f=-2.5!) USER MOD Single : A1962 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1963 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1970 TYR OH : rot 180:sc= 0 USER MOD Single : A1971 THR OG1 : rot -161:sc= 1.33 USER MOD Single : A1974 SER OG : rot 180:sc= 0 USER MOD Single : A1980 GLN : amide:sc= -0.0842 X(o=-0.084,f=-0.0016) USER MOD Single : A1981 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00456) USER MOD Single : A1996 THR OG1 : rot 171:sc= 0.784 USER MOD Single : A1997 THR OG1 : rot 180:sc= 0 USER MOD Single : A1998 THR OG1 : rot 180:sc= 0.0361 USER MOD Single : A2000 ASN : amide:sc= 0.376 K(o=0.38,f=-6.6!) USER MOD Single : A2001 GLN : amide:sc= -0.0391 X(o=-0.039,f=0) USER MOD Single : A2003 TYR OH : rot 166:sc= -0.192 USER MOD Single : A2004 ASN : amide:sc= -0.068 K(o=-0.068,f=-0.87) USER MOD Single : A2006 ASN : amide:sc= -0.0144 X(o=-0.014,f=-0.5) USER MOD Single : A2008 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2010 THR OG1 : rot 180:sc= 0 USER MOD Single : A2011 LYS NZ :NH3+ 160:sc= 0.309 (180deg=0.0949) USER MOD Single : A2015 TYR OH : rot 180:sc= 0 USER MOD Single : A2017 THR OG1 : rot 180:sc= -0.254 USER MOD Single : A2022 SER OG : rot -97:sc= 1.14 USER MOD Single : A2024 TYR OH : rot 180:sc= 0 USER MOD Single : A2027 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.16) USER MOD Single : A2030 SER OG : rot -21:sc= 0.13 USER MOD ----------------------------------------------------------------- ATOM 252 N ASN A1953 11.924 -4.696 1.957 1.00 0.00 N ATOM 253 CA ASN A1953 11.773 -3.939 3.196 1.00 0.00 C ATOM 254 C ASN A1953 10.403 -3.272 3.271 1.00 0.00 C ATOM 255 O ASN A1953 9.826 -2.932 2.249 1.00 0.00 O ATOM 256 CB ASN A1953 12.834 -2.841 3.186 1.00 0.00 C ATOM 257 CG ASN A1953 12.631 -1.760 4.220 1.00 0.00 C ATOM 258 OD1 ASN A1953 12.458 -2.009 5.408 1.00 0.00 O ATOM 259 ND2 ASN A1953 12.587 -0.537 3.755 1.00 0.00 N ATOM 0 HA ASN A1953 11.878 -4.612 4.047 1.00 0.00 H new ATOM 0 HB2 ASN A1953 13.811 -3.297 3.344 1.00 0.00 H new ATOM 0 HB3 ASN A1953 12.853 -2.381 2.198 1.00 0.00 H new ATOM 0 HD21 ASN A1953 12.404 0.243 4.387 1.00 0.00 H new ATOM 0 HD22 ASN A1953 12.735 -0.364 2.761 1.00 0.00 H new ATOM 266 N LEU A1954 9.922 -2.993 4.481 1.00 0.00 N ATOM 267 CA LEU A1954 8.646 -2.338 4.747 1.00 0.00 C ATOM 268 C LEU A1954 8.483 -1.032 3.975 1.00 0.00 C ATOM 269 O LEU A1954 7.412 -0.770 3.426 1.00 0.00 O ATOM 270 CB LEU A1954 8.554 -2.027 6.254 1.00 0.00 C ATOM 271 CG LEU A1954 7.494 -2.853 6.996 1.00 0.00 C ATOM 272 CD1 LEU A1954 6.105 -2.497 6.464 1.00 0.00 C ATOM 273 CD2 LEU A1954 7.779 -4.354 6.949 1.00 0.00 C ATOM 0 H LEU A1954 10.431 -3.226 5.334 1.00 0.00 H new ATOM 0 HA LEU A1954 7.856 -3.017 4.424 1.00 0.00 H new ATOM 0 HB2 LEU A1954 9.527 -2.207 6.712 1.00 0.00 H new ATOM 0 HB3 LEU A1954 8.331 -0.968 6.384 1.00 0.00 H new ATOM 0 HG LEU A1954 7.532 -2.594 8.054 1.00 0.00 H new ATOM 0 HD11 LEU A1954 5.352 -3.084 6.991 1.00 0.00 H new ATOM 0 HD12 LEU A1954 5.915 -1.436 6.624 1.00 0.00 H new ATOM 0 HD13 LEU A1954 6.056 -2.718 5.398 1.00 0.00 H new ATOM 0 HD21 LEU A1954 6.998 -4.890 7.489 1.00 0.00 H new ATOM 0 HD22 LEU A1954 7.798 -4.689 5.912 1.00 0.00 H new ATOM 0 HD23 LEU A1954 8.745 -4.556 7.413 1.00 0.00 H new ATOM 285 N SER A1955 9.521 -0.189 3.965 1.00 0.00 N ATOM 286 CA SER A1955 9.482 1.089 3.275 1.00 0.00 C ATOM 287 C SER A1955 9.243 0.889 1.785 1.00 0.00 C ATOM 288 O SER A1955 8.566 1.744 1.216 1.00 0.00 O ATOM 289 CB SER A1955 10.732 1.937 3.538 1.00 0.00 C ATOM 290 OG SER A1955 11.057 1.906 4.920 1.00 0.00 O ATOM 0 H SER A1955 10.406 -0.380 4.436 1.00 0.00 H new ATOM 0 HA SER A1955 8.642 1.651 3.683 1.00 0.00 H new ATOM 0 HB2 SER A1955 11.569 1.559 2.951 1.00 0.00 H new ATOM 0 HB3 SER A1955 10.558 2.965 3.220 1.00 0.00 H new ATOM 0 HG SER A1955 11.857 2.448 5.080 1.00 0.00 H new ATOM 296 N GLU A1956 9.762 -0.189 1.172 1.00 0.00 N ATOM 297 CA GLU A1956 9.544 -0.401 -0.259 1.00 0.00 C ATOM 298 C GLU A1956 8.056 -0.473 -0.602 1.00 0.00 C ATOM 299 O GLU A1956 7.546 0.312 -1.393 1.00 0.00 O ATOM 300 CB GLU A1956 10.180 -1.734 -0.697 1.00 0.00 C ATOM 301 CG GLU A1956 11.708 -1.696 -0.645 1.00 0.00 C ATOM 302 CD GLU A1956 12.368 -2.607 -1.682 1.00 0.00 C ATOM 303 OE1 GLU A1956 11.879 -3.734 -1.896 1.00 0.00 O ATOM 304 OE2 GLU A1956 13.396 -2.222 -2.292 1.00 0.00 O ATOM 0 H GLU A1956 10.320 -0.906 1.635 1.00 0.00 H new ATOM 0 HA GLU A1956 9.997 0.445 -0.776 1.00 0.00 H new ATOM 0 HB2 GLU A1956 9.817 -2.535 -0.053 1.00 0.00 H new ATOM 0 HB3 GLU A1956 9.859 -1.970 -1.712 1.00 0.00 H new ATOM 0 HG2 GLU A1956 12.045 -0.672 -0.803 1.00 0.00 H new ATOM 0 HG3 GLU A1956 12.039 -1.990 0.351 1.00 0.00 H new ATOM 311 N ILE A1957 7.320 -1.345 0.079 1.00 0.00 N ATOM 312 CA ILE A1957 5.906 -1.535 -0.165 1.00 0.00 C ATOM 313 C ILE A1957 5.159 -0.306 0.318 1.00 0.00 C ATOM 314 O ILE A1957 4.263 0.151 -0.372 1.00 0.00 O ATOM 315 CB ILE A1957 5.400 -2.807 0.531 1.00 0.00 C ATOM 316 CG1 ILE A1957 6.324 -4.029 0.334 1.00 0.00 C ATOM 317 CG2 ILE A1957 3.964 -3.170 0.149 1.00 0.00 C ATOM 318 CD1 ILE A1957 6.963 -4.345 1.681 1.00 0.00 C ATOM 0 H ILE A1957 7.695 -1.940 0.818 1.00 0.00 H new ATOM 0 HA ILE A1957 5.730 -1.663 -1.233 1.00 0.00 H new ATOM 0 HB ILE A1957 5.414 -2.552 1.591 1.00 0.00 H new ATOM 0 HG12 ILE A1957 5.755 -4.885 -0.030 1.00 0.00 H new ATOM 0 HG13 ILE A1957 7.089 -3.814 -0.412 1.00 0.00 H new ATOM 0 HG21 ILE A1957 3.666 -4.078 0.674 1.00 0.00 H new ATOM 0 HG22 ILE A1957 3.296 -2.354 0.427 1.00 0.00 H new ATOM 0 HG23 ILE A1957 3.905 -3.337 -0.927 1.00 0.00 H new ATOM 0 HD11 ILE A1957 7.624 -5.206 1.577 1.00 0.00 H new ATOM 0 HD12 ILE A1957 7.539 -3.484 2.021 1.00 0.00 H new ATOM 0 HD13 ILE A1957 6.184 -4.571 2.409 1.00 0.00 H new ATOM 330 N LYS A1958 5.493 0.256 1.483 1.00 0.00 N ATOM 331 CA LYS A1958 4.792 1.430 1.982 1.00 0.00 C ATOM 332 C LYS A1958 4.871 2.574 0.977 1.00 0.00 C ATOM 333 O LYS A1958 3.844 3.176 0.667 1.00 0.00 O ATOM 334 CB LYS A1958 5.352 1.809 3.358 1.00 0.00 C ATOM 335 CG LYS A1958 4.986 3.240 3.795 1.00 0.00 C ATOM 336 CD LYS A1958 6.187 4.180 3.652 1.00 0.00 C ATOM 337 CE LYS A1958 7.068 4.012 4.887 1.00 0.00 C ATOM 338 NZ LYS A1958 8.215 4.940 4.867 1.00 0.00 N ATOM 0 H LYS A1958 6.239 -0.084 2.090 1.00 0.00 H new ATOM 0 HA LYS A1958 3.733 1.205 2.105 1.00 0.00 H new ATOM 0 HB2 LYS A1958 4.979 1.104 4.101 1.00 0.00 H new ATOM 0 HB3 LYS A1958 6.437 1.709 3.340 1.00 0.00 H new ATOM 0 HG2 LYS A1958 4.157 3.608 3.190 1.00 0.00 H new ATOM 0 HG3 LYS A1958 4.646 3.232 4.831 1.00 0.00 H new ATOM 0 HD2 LYS A1958 6.749 3.945 2.748 1.00 0.00 H new ATOM 0 HD3 LYS A1958 5.853 5.213 3.560 1.00 0.00 H new ATOM 0 HE2 LYS A1958 6.474 4.186 5.784 1.00 0.00 H new ATOM 0 HE3 LYS A1958 7.431 2.985 4.939 1.00 0.00 H new ATOM 0 HZ1 LYS A1958 8.791 4.798 5.721 1.00 0.00 H new ATOM 0 HZ2 LYS A1958 8.795 4.757 4.023 1.00 0.00 H new ATOM 0 HZ3 LYS A1958 7.868 5.920 4.843 1.00 0.00 H new ATOM 352 N GLN A1959 6.066 2.912 0.497 1.00 0.00 N ATOM 353 CA GLN A1959 6.186 4.014 -0.444 1.00 0.00 C ATOM 354 C GLN A1959 5.524 3.678 -1.785 1.00 0.00 C ATOM 355 O GLN A1959 4.970 4.570 -2.427 1.00 0.00 O ATOM 356 CB GLN A1959 7.630 4.511 -0.564 1.00 0.00 C ATOM 357 CG GLN A1959 8.539 3.733 -1.526 1.00 0.00 C ATOM 358 CD GLN A1959 8.428 4.169 -2.990 1.00 0.00 C ATOM 359 OE1 GLN A1959 8.351 3.345 -3.889 1.00 0.00 O ATOM 360 NE2 GLN A1959 8.430 5.463 -3.285 1.00 0.00 N ATOM 0 H GLN A1959 6.943 2.450 0.739 1.00 0.00 H new ATOM 0 HA GLN A1959 5.629 4.862 -0.046 1.00 0.00 H new ATOM 0 HB2 GLN A1959 7.608 5.553 -0.882 1.00 0.00 H new ATOM 0 HB3 GLN A1959 8.083 4.490 0.427 1.00 0.00 H new ATOM 0 HG2 GLN A1959 9.574 3.848 -1.202 1.00 0.00 H new ATOM 0 HG3 GLN A1959 8.299 2.672 -1.456 1.00 0.00 H new ATOM 0 HE21 GLN A1959 8.494 6.156 -2.539 1.00 0.00 H new ATOM 0 HE22 GLN A1959 8.367 5.764 -4.257 1.00 0.00 H new ATOM 369 N VAL A1960 5.554 2.413 -2.207 1.00 0.00 N ATOM 370 CA VAL A1960 4.930 1.993 -3.454 1.00 0.00 C ATOM 371 C VAL A1960 3.425 2.210 -3.263 1.00 0.00 C ATOM 372 O VAL A1960 2.772 2.897 -4.044 1.00 0.00 O ATOM 373 CB VAL A1960 5.349 0.539 -3.774 1.00 0.00 C ATOM 374 CG1 VAL A1960 4.346 -0.247 -4.618 1.00 0.00 C ATOM 375 CG2 VAL A1960 6.705 0.522 -4.493 1.00 0.00 C ATOM 0 H VAL A1960 6.010 1.658 -1.695 1.00 0.00 H new ATOM 0 HA VAL A1960 5.248 2.567 -4.325 1.00 0.00 H new ATOM 0 HB VAL A1960 5.401 0.045 -2.804 1.00 0.00 H new ATOM 0 HG11 VAL A1960 4.726 -1.254 -4.791 1.00 0.00 H new ATOM 0 HG12 VAL A1960 3.393 -0.304 -4.092 1.00 0.00 H new ATOM 0 HG13 VAL A1960 4.203 0.256 -5.575 1.00 0.00 H new ATOM 0 HG21 VAL A1960 6.988 -0.508 -4.712 1.00 0.00 H new ATOM 0 HG22 VAL A1960 6.630 1.084 -5.424 1.00 0.00 H new ATOM 0 HG23 VAL A1960 7.461 0.978 -3.854 1.00 0.00 H new ATOM 385 N LEU A1961 2.874 1.693 -2.163 1.00 0.00 N ATOM 386 CA LEU A1961 1.472 1.825 -1.808 1.00 0.00 C ATOM 387 C LEU A1961 1.084 3.303 -1.742 1.00 0.00 C ATOM 388 O LEU A1961 -0.074 3.592 -1.997 1.00 0.00 O ATOM 389 CB LEU A1961 1.161 1.138 -0.479 1.00 0.00 C ATOM 390 CG LEU A1961 1.146 -0.396 -0.502 1.00 0.00 C ATOM 391 CD1 LEU A1961 0.907 -0.857 0.933 1.00 0.00 C ATOM 392 CD2 LEU A1961 0.078 -0.966 -1.435 1.00 0.00 C ATOM 0 H LEU A1961 3.411 1.158 -1.481 1.00 0.00 H new ATOM 0 HA LEU A1961 0.884 1.332 -2.582 1.00 0.00 H new ATOM 0 HB2 LEU A1961 1.897 1.463 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A1961 0.188 1.486 -0.132 1.00 0.00 H new ATOM 0 HG LEU A1961 2.097 -0.761 -0.890 1.00 0.00 H new ATOM 0 HD11 LEU A1961 0.888 -1.946 0.967 1.00 0.00 H new ATOM 0 HD12 LEU A1961 1.709 -0.488 1.572 1.00 0.00 H new ATOM 0 HD13 LEU A1961 -0.047 -0.466 1.286 1.00 0.00 H new ATOM 0 HD21 LEU A1961 0.116 -2.055 -1.409 1.00 0.00 H new ATOM 0 HD22 LEU A1961 -0.906 -0.629 -1.110 1.00 0.00 H new ATOM 0 HD23 LEU A1961 0.262 -0.621 -2.452 1.00 0.00 H new ATOM 404 N LYS A1962 1.977 4.239 -1.383 1.00 0.00 N ATOM 405 CA LYS A1962 1.628 5.651 -1.340 1.00 0.00 C ATOM 406 C LYS A1962 1.276 6.102 -2.744 1.00 0.00 C ATOM 407 O LYS A1962 0.194 6.655 -2.923 1.00 0.00 O ATOM 408 CB LYS A1962 2.768 6.517 -0.774 1.00 0.00 C ATOM 409 CG LYS A1962 2.595 7.979 -1.210 1.00 0.00 C ATOM 410 CD LYS A1962 3.169 8.988 -0.223 1.00 0.00 C ATOM 411 CE LYS A1962 4.594 9.407 -0.557 1.00 0.00 C ATOM 412 NZ LYS A1962 5.622 8.358 -0.417 1.00 0.00 N ATOM 0 H LYS A1962 2.941 4.035 -1.121 1.00 0.00 H new ATOM 0 HA LYS A1962 0.777 5.777 -0.671 1.00 0.00 H new ATOM 0 HB2 LYS A1962 2.776 6.454 0.314 1.00 0.00 H new ATOM 0 HB3 LYS A1962 3.729 6.138 -1.122 1.00 0.00 H new ATOM 0 HG2 LYS A1962 3.075 8.119 -2.178 1.00 0.00 H new ATOM 0 HG3 LYS A1962 1.533 8.184 -1.348 1.00 0.00 H new ATOM 0 HD2 LYS A1962 2.532 9.872 -0.205 1.00 0.00 H new ATOM 0 HD3 LYS A1962 3.148 8.559 0.779 1.00 0.00 H new ATOM 0 HE2 LYS A1962 4.614 9.774 -1.583 1.00 0.00 H new ATOM 0 HE3 LYS A1962 4.866 10.244 0.086 1.00 0.00 H new ATOM 0 HZ1 LYS A1962 6.553 8.748 -0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A1962 5.642 8.021 0.567 1.00 0.00 H new ATOM 0 HZ3 LYS A1962 5.397 7.565 -1.051 1.00 0.00 H new ATOM 426 N GLN A1963 2.190 5.914 -3.699 1.00 0.00 N ATOM 427 CA GLN A1963 1.938 6.339 -5.069 1.00 0.00 C ATOM 428 C GLN A1963 0.631 5.756 -5.576 1.00 0.00 C ATOM 429 O GLN A1963 -0.166 6.492 -6.155 1.00 0.00 O ATOM 430 CB GLN A1963 3.138 6.066 -6.006 1.00 0.00 C ATOM 431 CG GLN A1963 3.196 4.750 -6.790 1.00 0.00 C ATOM 432 CD GLN A1963 4.357 4.762 -7.775 1.00 0.00 C ATOM 433 OE1 GLN A1963 5.520 4.612 -7.396 1.00 0.00 O ATOM 434 NE2 GLN A1963 4.097 4.928 -9.055 1.00 0.00 N ATOM 0 H GLN A1963 3.099 5.476 -3.548 1.00 0.00 H new ATOM 0 HA GLN A1963 1.826 7.423 -5.070 1.00 0.00 H new ATOM 0 HB2 GLN A1963 3.180 6.880 -6.730 1.00 0.00 H new ATOM 0 HB3 GLN A1963 4.044 6.128 -5.404 1.00 0.00 H new ATOM 0 HG2 GLN A1963 3.307 3.914 -6.099 1.00 0.00 H new ATOM 0 HG3 GLN A1963 2.259 4.599 -7.326 1.00 0.00 H new ATOM 0 HE21 GLN A1963 3.134 5.052 -9.368 1.00 0.00 H new ATOM 0 HE22 GLN A1963 4.858 4.932 -9.734 1.00 0.00 H new ATOM 443 N GLN A1964 0.442 4.470 -5.282 1.00 0.00 N ATOM 444 CA GLN A1964 -0.710 3.673 -5.667 1.00 0.00 C ATOM 445 C GLN A1964 -1.987 4.200 -5.012 1.00 0.00 C ATOM 446 O GLN A1964 -3.046 4.153 -5.621 1.00 0.00 O ATOM 447 CB GLN A1964 -0.474 2.202 -5.283 1.00 0.00 C ATOM 448 CG GLN A1964 0.741 1.543 -5.959 1.00 0.00 C ATOM 449 CD GLN A1964 0.333 0.541 -7.040 1.00 0.00 C ATOM 450 OE1 GLN A1964 -0.228 0.902 -8.064 1.00 0.00 O ATOM 451 NE2 GLN A1964 0.583 -0.743 -6.825 1.00 0.00 N ATOM 0 H GLN A1964 1.123 3.935 -4.743 1.00 0.00 H new ATOM 0 HA GLN A1964 -0.837 3.745 -6.747 1.00 0.00 H new ATOM 0 HB2 GLN A1964 -0.348 2.140 -4.202 1.00 0.00 H new ATOM 0 HB3 GLN A1964 -1.366 1.629 -5.534 1.00 0.00 H new ATOM 0 HG2 GLN A1964 1.370 2.315 -6.402 1.00 0.00 H new ATOM 0 HG3 GLN A1964 1.342 1.035 -5.205 1.00 0.00 H new ATOM 0 HE21 GLN A1964 1.052 -1.035 -5.967 1.00 0.00 H new ATOM 0 HE22 GLN A1964 0.307 -1.439 -7.517 1.00 0.00 H new ATOM 460 N LEU A1965 -1.914 4.671 -3.766 1.00 0.00 N ATOM 461 CA LEU A1965 -3.066 5.185 -3.047 1.00 0.00 C ATOM 462 C LEU A1965 -3.423 6.558 -3.570 1.00 0.00 C ATOM 463 O LEU A1965 -4.591 6.806 -3.842 1.00 0.00 O ATOM 464 CB LEU A1965 -2.792 5.233 -1.531 1.00 0.00 C ATOM 465 CG LEU A1965 -4.012 5.500 -0.623 1.00 0.00 C ATOM 466 CD1 LEU A1965 -4.324 6.963 -0.337 1.00 0.00 C ATOM 467 CD2 LEU A1965 -5.273 4.768 -1.070 1.00 0.00 C ATOM 0 H LEU A1965 -1.047 4.704 -3.230 1.00 0.00 H new ATOM 0 HA LEU A1965 -3.909 4.514 -3.210 1.00 0.00 H new ATOM 0 HB2 LEU A1965 -2.346 4.284 -1.234 1.00 0.00 H new ATOM 0 HB3 LEU A1965 -2.049 6.008 -1.342 1.00 0.00 H new ATOM 0 HG LEU A1965 -3.681 5.079 0.326 1.00 0.00 H new ATOM 0 HD11 LEU A1965 -5.199 7.029 0.309 1.00 0.00 H new ATOM 0 HD12 LEU A1965 -3.471 7.427 0.159 1.00 0.00 H new ATOM 0 HD13 LEU A1965 -4.525 7.482 -1.274 1.00 0.00 H new ATOM 0 HD21 LEU A1965 -6.090 5.001 -0.387 1.00 0.00 H new ATOM 0 HD22 LEU A1965 -5.540 5.086 -2.078 1.00 0.00 H new ATOM 0 HD23 LEU A1965 -5.091 3.693 -1.065 1.00 0.00 H new ATOM 479 N ALA A1966 -2.435 7.446 -3.724 1.00 0.00 N ATOM 480 CA ALA A1966 -2.729 8.781 -4.198 1.00 0.00 C ATOM 481 C ALA A1966 -3.367 8.733 -5.581 1.00 0.00 C ATOM 482 O ALA A1966 -4.336 9.444 -5.816 1.00 0.00 O ATOM 483 CB ALA A1966 -1.490 9.683 -4.207 1.00 0.00 C ATOM 0 H ALA A1966 -1.451 7.261 -3.530 1.00 0.00 H new ATOM 0 HA ALA A1966 -3.439 9.219 -3.496 1.00 0.00 H new ATOM 0 HB1 ALA A1966 -1.764 10.673 -4.571 1.00 0.00 H new ATOM 0 HB2 ALA A1966 -1.092 9.765 -3.195 1.00 0.00 H new ATOM 0 HB3 ALA A1966 -0.732 9.253 -4.861 1.00 0.00 H new ATOM 489 N GLU A1967 -2.848 7.902 -6.488 1.00 0.00 N ATOM 490 CA GLU A1967 -3.420 7.808 -7.826 1.00 0.00 C ATOM 491 C GLU A1967 -4.827 7.210 -7.779 1.00 0.00 C ATOM 492 O GLU A1967 -5.715 7.671 -8.495 1.00 0.00 O ATOM 493 CB GLU A1967 -2.483 7.068 -8.793 1.00 0.00 C ATOM 494 CG GLU A1967 -2.254 5.582 -8.501 1.00 0.00 C ATOM 495 CD GLU A1967 -1.080 4.989 -9.291 1.00 0.00 C ATOM 496 OE1 GLU A1967 -1.258 4.556 -10.451 1.00 0.00 O ATOM 497 OE2 GLU A1967 0.059 4.932 -8.764 1.00 0.00 O ATOM 0 H GLU A1967 -2.045 7.295 -6.321 1.00 0.00 H new ATOM 0 HA GLU A1967 -3.523 8.817 -8.224 1.00 0.00 H new ATOM 0 HB2 GLU A1967 -2.886 7.162 -9.801 1.00 0.00 H new ATOM 0 HB3 GLU A1967 -1.517 7.572 -8.788 1.00 0.00 H new ATOM 0 HG2 GLU A1967 -2.070 5.451 -7.435 1.00 0.00 H new ATOM 0 HG3 GLU A1967 -3.162 5.027 -8.738 1.00 0.00 H new ATOM 504 N ALA A1968 -5.056 6.225 -6.909 1.00 0.00 N ATOM 505 CA ALA A1968 -6.363 5.586 -6.765 1.00 0.00 C ATOM 506 C ALA A1968 -7.395 6.557 -6.188 1.00 0.00 C ATOM 507 O ALA A1968 -8.595 6.339 -6.370 1.00 0.00 O ATOM 508 CB ALA A1968 -6.257 4.349 -5.870 1.00 0.00 C ATOM 0 H ALA A1968 -4.341 5.849 -6.286 1.00 0.00 H new ATOM 0 HA ALA A1968 -6.695 5.283 -7.758 1.00 0.00 H new ATOM 0 HB1 ALA A1968 -7.238 3.885 -5.773 1.00 0.00 H new ATOM 0 HB2 ALA A1968 -5.561 3.637 -6.314 1.00 0.00 H new ATOM 0 HB3 ALA A1968 -5.896 4.643 -4.885 1.00 0.00 H new ATOM 514 N LEU A1969 -6.926 7.601 -5.495 1.00 0.00 N ATOM 515 CA LEU A1969 -7.734 8.639 -4.875 1.00 0.00 C ATOM 516 C LEU A1969 -7.686 9.951 -5.679 1.00 0.00 C ATOM 517 O LEU A1969 -8.220 10.952 -5.206 1.00 0.00 O ATOM 518 CB LEU A1969 -7.283 8.898 -3.422 1.00 0.00 C ATOM 519 CG LEU A1969 -7.465 7.740 -2.422 1.00 0.00 C ATOM 520 CD1 LEU A1969 -7.473 8.297 -1.007 1.00 0.00 C ATOM 521 CD2 LEU A1969 -8.753 6.949 -2.620 1.00 0.00 C ATOM 0 H LEU A1969 -5.927 7.745 -5.349 1.00 0.00 H new ATOM 0 HA LEU A1969 -8.763 8.280 -4.867 1.00 0.00 H new ATOM 0 HB2 LEU A1969 -6.228 9.171 -3.437 1.00 0.00 H new ATOM 0 HB3 LEU A1969 -7.831 9.762 -3.045 1.00 0.00 H new ATOM 0 HG LEU A1969 -6.632 7.058 -2.594 1.00 0.00 H new ATOM 0 HD11 LEU A1969 -7.602 7.481 -0.296 1.00 0.00 H new ATOM 0 HD12 LEU A1969 -6.529 8.804 -0.810 1.00 0.00 H new ATOM 0 HD13 LEU A1969 -8.295 9.005 -0.899 1.00 0.00 H new ATOM 0 HD21 LEU A1969 -8.808 6.152 -1.879 1.00 0.00 H new ATOM 0 HD22 LEU A1969 -9.609 7.613 -2.503 1.00 0.00 H new ATOM 0 HD23 LEU A1969 -8.764 6.516 -3.620 1.00 0.00 H new ATOM 533 N TYR A1970 -7.067 9.969 -6.867 1.00 0.00 N ATOM 534 CA TYR A1970 -6.930 11.144 -7.732 1.00 0.00 C ATOM 535 C TYR A1970 -6.250 12.332 -7.013 1.00 0.00 C ATOM 536 O TYR A1970 -6.670 13.480 -7.175 1.00 0.00 O ATOM 537 CB TYR A1970 -8.298 11.563 -8.307 1.00 0.00 C ATOM 538 CG TYR A1970 -9.210 10.506 -8.902 1.00 0.00 C ATOM 539 CD1 TYR A1970 -8.778 9.669 -9.949 1.00 0.00 C ATOM 540 CD2 TYR A1970 -10.553 10.465 -8.487 1.00 0.00 C ATOM 541 CE1 TYR A1970 -9.701 8.840 -10.615 1.00 0.00 C ATOM 542 CE2 TYR A1970 -11.487 9.667 -9.165 1.00 0.00 C ATOM 543 CZ TYR A1970 -11.067 8.863 -10.243 1.00 0.00 C ATOM 544 OH TYR A1970 -11.986 8.117 -10.911 1.00 0.00 O ATOM 0 H TYR A1970 -6.633 9.136 -7.264 1.00 0.00 H new ATOM 0 HA TYR A1970 -6.277 10.856 -8.556 1.00 0.00 H new ATOM 0 HB2 TYR A1970 -8.850 12.060 -7.509 1.00 0.00 H new ATOM 0 HB3 TYR A1970 -8.114 12.309 -9.080 1.00 0.00 H new ATOM 0 HD1 TYR A1970 -7.738 9.663 -10.241 1.00 0.00 H new ATOM 0 HD2 TYR A1970 -10.869 11.053 -7.638 1.00 0.00 H new ATOM 0 HE1 TYR A1970 -9.368 8.188 -11.408 1.00 0.00 H new ATOM 0 HE2 TYR A1970 -12.524 9.669 -8.862 1.00 0.00 H new ATOM 0 HH TYR A1970 -12.872 8.258 -10.516 1.00 0.00 H new ATOM 554 N THR A1971 -5.193 12.100 -6.227 1.00 0.00 N ATOM 555 CA THR A1971 -4.497 13.137 -5.488 1.00 0.00 C ATOM 556 C THR A1971 -2.983 12.964 -5.599 1.00 0.00 C ATOM 557 O THR A1971 -2.464 12.106 -6.326 1.00 0.00 O ATOM 558 CB THR A1971 -5.021 13.156 -4.038 1.00 0.00 C ATOM 559 OG1 THR A1971 -4.702 14.415 -3.475 1.00 0.00 O ATOM 560 CG2 THR A1971 -4.452 12.023 -3.168 1.00 0.00 C ATOM 0 H THR A1971 -4.798 11.170 -6.090 1.00 0.00 H new ATOM 0 HA THR A1971 -4.703 14.117 -5.919 1.00 0.00 H new ATOM 0 HB THR A1971 -6.099 12.994 -4.065 1.00 0.00 H new ATOM 0 HG1 THR A1971 -4.741 14.355 -2.498 1.00 0.00 H new ATOM 0 HG21 THR A1971 -4.862 12.096 -2.161 1.00 0.00 H new ATOM 0 HG22 THR A1971 -4.723 11.060 -3.601 1.00 0.00 H new ATOM 0 HG23 THR A1971 -3.366 12.108 -3.124 1.00 0.00 H new ATOM 568 N GLU A1972 -2.257 13.818 -4.890 1.00 0.00 N ATOM 569 CA GLU A1972 -0.817 13.845 -4.856 1.00 0.00 C ATOM 570 C GLU A1972 -0.271 13.077 -3.675 1.00 0.00 C ATOM 571 O GLU A1972 -0.815 13.044 -2.573 1.00 0.00 O ATOM 572 CB GLU A1972 -0.329 15.282 -4.665 1.00 0.00 C ATOM 573 CG GLU A1972 -0.793 16.231 -5.762 1.00 0.00 C ATOM 574 CD GLU A1972 -0.437 17.653 -5.335 1.00 0.00 C ATOM 575 OE1 GLU A1972 -1.208 18.263 -4.555 1.00 0.00 O ATOM 576 OE2 GLU A1972 0.642 18.149 -5.728 1.00 0.00 O ATOM 0 H GLU A1972 -2.681 14.536 -4.302 1.00 0.00 H new ATOM 0 HA GLU A1972 -0.478 13.407 -5.795 1.00 0.00 H new ATOM 0 HB2 GLU A1972 -0.681 15.652 -3.702 1.00 0.00 H new ATOM 0 HB3 GLU A1972 0.760 15.286 -4.629 1.00 0.00 H new ATOM 0 HG2 GLU A1972 -0.311 15.985 -6.708 1.00 0.00 H new ATOM 0 HG3 GLU A1972 -1.868 16.137 -5.918 1.00 0.00 H new ATOM 583 N GLU A1973 0.911 12.528 -3.874 1.00 0.00 N ATOM 584 CA GLU A1973 1.626 11.789 -2.857 1.00 0.00 C ATOM 585 C GLU A1973 2.040 12.743 -1.728 1.00 0.00 C ATOM 586 O GLU A1973 2.370 12.318 -0.623 1.00 0.00 O ATOM 587 CB GLU A1973 2.798 11.047 -3.495 1.00 0.00 C ATOM 588 CG GLU A1973 2.322 10.227 -4.700 1.00 0.00 C ATOM 589 CD GLU A1973 3.426 9.393 -5.330 1.00 0.00 C ATOM 590 OE1 GLU A1973 4.287 8.853 -4.598 1.00 0.00 O ATOM 591 OE2 GLU A1973 3.353 9.231 -6.566 1.00 0.00 O ATOM 0 H GLU A1973 1.408 12.585 -4.763 1.00 0.00 H new ATOM 0 HA GLU A1973 0.988 11.030 -2.404 1.00 0.00 H new ATOM 0 HB2 GLU A1973 3.559 11.760 -3.811 1.00 0.00 H new ATOM 0 HB3 GLU A1973 3.263 10.389 -2.761 1.00 0.00 H new ATOM 0 HG2 GLU A1973 1.512 9.569 -4.386 1.00 0.00 H new ATOM 0 HG3 GLU A1973 1.911 10.902 -5.451 1.00 0.00 H new ATOM 598 N SER A1974 2.050 14.048 -2.010 1.00 0.00 N ATOM 599 CA SER A1974 2.376 15.111 -1.083 1.00 0.00 C ATOM 600 C SER A1974 1.331 15.235 0.035 1.00 0.00 C ATOM 601 O SER A1974 1.611 15.894 1.040 1.00 0.00 O ATOM 602 CB SER A1974 2.530 16.425 -1.857 1.00 0.00 C ATOM 603 OG SER A1974 3.697 16.404 -2.665 1.00 0.00 O ATOM 0 H SER A1974 1.818 14.399 -2.939 1.00 0.00 H new ATOM 0 HA SER A1974 3.320 14.872 -0.594 1.00 0.00 H new ATOM 0 HB2 SER A1974 1.653 16.588 -2.483 1.00 0.00 H new ATOM 0 HB3 SER A1974 2.582 17.260 -1.158 1.00 0.00 H new ATOM 0 HG SER A1974 3.774 17.252 -3.151 1.00 0.00 H new ATOM 609 N GLU A1975 0.188 14.553 -0.074 1.00 0.00 N ATOM 610 CA GLU A1975 -0.863 14.597 0.936 1.00 0.00 C ATOM 611 C GLU A1975 -0.936 13.307 1.757 1.00 0.00 C ATOM 612 O GLU A1975 -1.371 13.308 2.907 1.00 0.00 O ATOM 613 CB GLU A1975 -2.213 14.921 0.269 1.00 0.00 C ATOM 614 CG GLU A1975 -2.994 13.764 -0.382 1.00 0.00 C ATOM 615 CD GLU A1975 -4.496 13.927 -0.117 1.00 0.00 C ATOM 616 OE1 GLU A1975 -4.983 13.506 0.951 1.00 0.00 O ATOM 617 OE2 GLU A1975 -5.187 14.552 -0.956 1.00 0.00 O ATOM 0 H GLU A1975 -0.032 13.954 -0.870 1.00 0.00 H new ATOM 0 HA GLU A1975 -0.619 15.391 1.642 1.00 0.00 H new ATOM 0 HB2 GLU A1975 -2.857 15.376 1.022 1.00 0.00 H new ATOM 0 HB3 GLU A1975 -2.034 15.676 -0.497 1.00 0.00 H new ATOM 0 HG2 GLU A1975 -2.806 13.747 -1.456 1.00 0.00 H new ATOM 0 HG3 GLU A1975 -2.648 12.811 0.018 1.00 0.00 H new ATOM 624 N ILE A1976 -0.436 12.204 1.200 1.00 0.00 N ATOM 625 CA ILE A1976 -0.514 10.891 1.826 1.00 0.00 C ATOM 626 C ILE A1976 0.452 10.731 2.983 1.00 0.00 C ATOM 627 O ILE A1976 1.577 11.222 2.949 1.00 0.00 O ATOM 628 CB ILE A1976 -0.334 9.770 0.785 1.00 0.00 C ATOM 629 CG1 ILE A1976 -0.935 10.061 -0.604 1.00 0.00 C ATOM 630 CG2 ILE A1976 -0.806 8.393 1.285 1.00 0.00 C ATOM 631 CD1 ILE A1976 -2.387 9.702 -0.884 1.00 0.00 C ATOM 0 H ILE A1976 0.037 12.200 0.296 1.00 0.00 H new ATOM 0 HA ILE A1976 -1.515 10.807 2.250 1.00 0.00 H new ATOM 0 HB ILE A1976 0.748 9.741 0.653 1.00 0.00 H new ATOM 0 HG12 ILE A1976 -0.821 11.129 -0.792 1.00 0.00 H new ATOM 0 HG13 ILE A1976 -0.322 9.541 -1.340 1.00 0.00 H new ATOM 0 HG21 ILE A1976 -0.651 7.649 0.503 1.00 0.00 H new ATOM 0 HG22 ILE A1976 -0.236 8.113 2.171 1.00 0.00 H new ATOM 0 HG23 ILE A1976 -1.866 8.441 1.536 1.00 0.00 H new ATOM 0 HD11 ILE A1976 -2.639 9.977 -1.908 1.00 0.00 H new ATOM 0 HD12 ILE A1976 -2.529 8.630 -0.751 1.00 0.00 H new ATOM 0 HD13 ILE A1976 -3.035 10.242 -0.194 1.00 0.00 H new ATOM 643 N ALA A1977 0.013 10.015 4.006 1.00 0.00 N ATOM 644 CA ALA A1977 0.803 9.718 5.188 1.00 0.00 C ATOM 645 C ALA A1977 0.883 8.205 5.291 1.00 0.00 C ATOM 646 O ALA A1977 0.035 7.492 4.756 1.00 0.00 O ATOM 647 CB ALA A1977 0.205 10.315 6.455 1.00 0.00 C ATOM 0 H ALA A1977 -0.925 9.615 4.037 1.00 0.00 H new ATOM 0 HA ALA A1977 1.792 10.165 5.092 1.00 0.00 H new ATOM 0 HB1 ALA A1977 0.835 10.063 7.308 1.00 0.00 H new ATOM 0 HB2 ALA A1977 0.147 11.399 6.354 1.00 0.00 H new ATOM 0 HB3 ALA A1977 -0.795 9.911 6.610 1.00 0.00 H new ATOM 653 N GLU A1978 1.843 7.720 6.056 1.00 0.00 N ATOM 654 CA GLU A1978 2.120 6.307 6.274 1.00 0.00 C ATOM 655 C GLU A1978 1.319 5.700 7.417 1.00 0.00 C ATOM 656 O GLU A1978 1.072 4.499 7.479 1.00 0.00 O ATOM 657 CB GLU A1978 3.624 6.214 6.586 1.00 0.00 C ATOM 658 CG GLU A1978 4.466 6.892 5.506 1.00 0.00 C ATOM 659 CD GLU A1978 4.933 8.319 5.798 1.00 0.00 C ATOM 660 OE1 GLU A1978 4.128 9.263 5.673 1.00 0.00 O ATOM 661 OE2 GLU A1978 6.147 8.515 6.043 1.00 0.00 O ATOM 0 H GLU A1978 2.483 8.327 6.568 1.00 0.00 H new ATOM 0 HA GLU A1978 1.832 5.743 5.387 1.00 0.00 H new ATOM 0 HB2 GLU A1978 3.825 6.680 7.551 1.00 0.00 H new ATOM 0 HB3 GLU A1978 3.914 5.167 6.671 1.00 0.00 H new ATOM 0 HG2 GLU A1978 5.346 6.276 5.323 1.00 0.00 H new ATOM 0 HG3 GLU A1978 3.889 6.905 4.582 1.00 0.00 H new ATOM 668 N ASP A1979 0.913 6.587 8.300 1.00 0.00 N ATOM 669 CA ASP A1979 0.172 6.406 9.539 1.00 0.00 C ATOM 670 C ASP A1979 -1.232 7.019 9.531 1.00 0.00 C ATOM 671 O ASP A1979 -1.909 6.988 10.561 1.00 0.00 O ATOM 672 CB ASP A1979 1.040 6.939 10.702 1.00 0.00 C ATOM 673 CG ASP A1979 1.807 8.245 10.432 1.00 0.00 C ATOM 674 OD1 ASP A1979 1.452 9.043 9.536 1.00 0.00 O ATOM 675 OD2 ASP A1979 2.883 8.408 11.057 1.00 0.00 O ATOM 0 H ASP A1979 1.118 7.575 8.151 1.00 0.00 H new ATOM 0 HA ASP A1979 -0.017 5.340 9.667 1.00 0.00 H new ATOM 0 HB2 ASP A1979 0.396 7.092 11.568 1.00 0.00 H new ATOM 0 HB3 ASP A1979 1.761 6.168 10.973 1.00 0.00 H new ATOM 680 N GLN A1980 -1.697 7.563 8.402 1.00 0.00 N ATOM 681 CA GLN A1980 -3.032 8.158 8.291 1.00 0.00 C ATOM 682 C GLN A1980 -3.973 7.171 7.619 1.00 0.00 C ATOM 683 O GLN A1980 -3.540 6.381 6.780 1.00 0.00 O ATOM 684 CB GLN A1980 -2.957 9.489 7.558 1.00 0.00 C ATOM 685 CG GLN A1980 -4.275 10.246 7.393 1.00 0.00 C ATOM 686 CD GLN A1980 -3.986 11.726 7.170 1.00 0.00 C ATOM 687 OE1 GLN A1980 -3.581 12.418 8.106 1.00 0.00 O ATOM 688 NE2 GLN A1980 -4.099 12.207 5.948 1.00 0.00 N ATOM 0 H GLN A1980 -1.157 7.603 7.538 1.00 0.00 H new ATOM 0 HA GLN A1980 -3.431 8.369 9.283 1.00 0.00 H new ATOM 0 HB2 GLN A1980 -2.256 10.133 8.089 1.00 0.00 H new ATOM 0 HB3 GLN A1980 -2.538 9.311 6.568 1.00 0.00 H new ATOM 0 HG2 GLN A1980 -4.835 9.843 6.549 1.00 0.00 H new ATOM 0 HG3 GLN A1980 -4.895 10.115 8.280 1.00 0.00 H new ATOM 0 HE21 GLN A1980 -4.437 11.609 5.194 1.00 0.00 H new ATOM 0 HE22 GLN A1980 -3.848 13.177 5.756 1.00 0.00 H new ATOM 697 N LYS A1981 -5.251 7.194 7.993 1.00 0.00 N ATOM 698 CA LYS A1981 -6.232 6.275 7.435 1.00 0.00 C ATOM 699 C LYS A1981 -6.559 6.669 6.013 1.00 0.00 C ATOM 700 O LYS A1981 -6.900 7.826 5.793 1.00 0.00 O ATOM 701 CB LYS A1981 -7.519 6.255 8.278 1.00 0.00 C ATOM 702 CG LYS A1981 -7.276 6.149 9.786 1.00 0.00 C ATOM 703 CD LYS A1981 -6.575 4.852 10.199 1.00 0.00 C ATOM 704 CE LYS A1981 -5.655 5.096 11.393 1.00 0.00 C ATOM 705 NZ LYS A1981 -6.404 5.480 12.606 1.00 0.00 N ATOM 0 H LYS A1981 -5.629 7.843 8.683 1.00 0.00 H new ATOM 0 HA LYS A1981 -5.801 5.274 7.446 1.00 0.00 H new ATOM 0 HB2 LYS A1981 -8.088 7.163 8.075 1.00 0.00 H new ATOM 0 HB3 LYS A1981 -8.136 5.415 7.960 1.00 0.00 H new ATOM 0 HG2 LYS A1981 -6.674 6.998 10.110 1.00 0.00 H new ATOM 0 HG3 LYS A1981 -8.231 6.219 10.306 1.00 0.00 H new ATOM 0 HD2 LYS A1981 -7.318 4.096 10.454 1.00 0.00 H new ATOM 0 HD3 LYS A1981 -5.997 4.462 9.361 1.00 0.00 H new ATOM 0 HE2 LYS A1981 -5.078 4.194 11.595 1.00 0.00 H new ATOM 0 HE3 LYS A1981 -4.941 5.882 11.145 1.00 0.00 H new ATOM 0 HZ1 LYS A1981 -5.740 5.619 13.394 1.00 0.00 H new ATOM 0 HZ2 LYS A1981 -6.921 6.365 12.429 1.00 0.00 H new ATOM 0 HZ3 LYS A1981 -7.079 4.727 12.850 1.00 0.00 H new ATOM 719 N PHE A1982 -6.560 5.718 5.078 1.00 0.00 N ATOM 720 CA PHE A1982 -6.877 5.955 3.679 1.00 0.00 C ATOM 721 C PHE A1982 -8.190 6.716 3.531 1.00 0.00 C ATOM 722 O PHE A1982 -8.298 7.551 2.641 1.00 0.00 O ATOM 723 CB PHE A1982 -6.950 4.631 2.921 1.00 0.00 C ATOM 724 CG PHE A1982 -5.723 3.761 2.992 1.00 0.00 C ATOM 725 CD1 PHE A1982 -4.459 4.324 2.762 1.00 0.00 C ATOM 726 CD2 PHE A1982 -5.845 2.389 3.265 1.00 0.00 C ATOM 727 CE1 PHE A1982 -3.314 3.523 2.856 1.00 0.00 C ATOM 728 CE2 PHE A1982 -4.699 1.581 3.319 1.00 0.00 C ATOM 729 CZ PHE A1982 -3.431 2.149 3.125 1.00 0.00 C ATOM 0 H PHE A1982 -6.335 4.744 5.281 1.00 0.00 H new ATOM 0 HA PHE A1982 -6.081 6.567 3.254 1.00 0.00 H new ATOM 0 HB2 PHE A1982 -7.797 4.062 3.304 1.00 0.00 H new ATOM 0 HB3 PHE A1982 -7.158 4.846 1.873 1.00 0.00 H new ATOM 0 HD1 PHE A1982 -4.369 5.371 2.513 1.00 0.00 H new ATOM 0 HD2 PHE A1982 -6.820 1.956 3.433 1.00 0.00 H new ATOM 0 HE1 PHE A1982 -2.337 3.963 2.721 1.00 0.00 H new ATOM 0 HE2 PHE A1982 -4.793 0.522 3.510 1.00 0.00 H new ATOM 0 HZ PHE A1982 -2.547 1.531 3.182 1.00 0.00 H new ATOM 739 N VAL A1983 -9.182 6.452 4.384 1.00 0.00 N ATOM 740 CA VAL A1983 -10.471 7.130 4.314 1.00 0.00 C ATOM 741 C VAL A1983 -10.307 8.648 4.451 1.00 0.00 C ATOM 742 O VAL A1983 -11.016 9.386 3.776 1.00 0.00 O ATOM 743 CB VAL A1983 -11.470 6.510 5.304 1.00 0.00 C ATOM 744 CG1 VAL A1983 -11.560 4.988 5.128 1.00 0.00 C ATOM 745 CG2 VAL A1983 -11.138 6.791 6.769 1.00 0.00 C ATOM 0 H VAL A1983 -9.112 5.767 5.136 1.00 0.00 H new ATOM 0 HA VAL A1983 -10.903 6.976 3.325 1.00 0.00 H new ATOM 0 HB VAL A1983 -12.422 6.986 5.069 1.00 0.00 H new ATOM 0 HG11 VAL A1983 -12.275 4.581 5.843 1.00 0.00 H new ATOM 0 HG12 VAL A1983 -11.889 4.758 4.115 1.00 0.00 H new ATOM 0 HG13 VAL A1983 -10.580 4.543 5.301 1.00 0.00 H new ATOM 0 HG21 VAL A1983 -11.886 6.322 7.408 1.00 0.00 H new ATOM 0 HG22 VAL A1983 -10.154 6.384 7.004 1.00 0.00 H new ATOM 0 HG23 VAL A1983 -11.136 7.867 6.942 1.00 0.00 H new ATOM 755 N ASP A1984 -9.352 9.117 5.265 1.00 0.00 N ATOM 756 CA ASP A1984 -9.091 10.546 5.455 1.00 0.00 C ATOM 757 C ASP A1984 -8.470 11.137 4.189 1.00 0.00 C ATOM 758 O ASP A1984 -8.636 12.319 3.889 1.00 0.00 O ATOM 759 CB ASP A1984 -8.191 10.762 6.682 1.00 0.00 C ATOM 760 CG ASP A1984 -7.981 12.236 7.042 1.00 0.00 C ATOM 761 OD1 ASP A1984 -7.064 12.879 6.492 1.00 0.00 O ATOM 762 OD2 ASP A1984 -8.653 12.719 7.985 1.00 0.00 O ATOM 0 H ASP A1984 -8.738 8.512 5.811 1.00 0.00 H new ATOM 0 HA ASP A1984 -10.032 11.064 5.639 1.00 0.00 H new ATOM 0 HB2 ASP A1984 -8.629 10.247 7.537 1.00 0.00 H new ATOM 0 HB3 ASP A1984 -7.221 10.301 6.495 1.00 0.00 H new ATOM 767 N LEU A1985 -7.745 10.311 3.429 1.00 0.00 N ATOM 768 CA LEU A1985 -7.144 10.722 2.165 1.00 0.00 C ATOM 769 C LEU A1985 -8.267 10.733 1.103 1.00 0.00 C ATOM 770 O LEU A1985 -8.098 11.355 0.060 1.00 0.00 O ATOM 771 CB LEU A1985 -5.970 9.809 1.736 1.00 0.00 C ATOM 772 CG LEU A1985 -4.675 9.803 2.576 1.00 0.00 C ATOM 773 CD1 LEU A1985 -3.975 11.154 2.628 1.00 0.00 C ATOM 774 CD2 LEU A1985 -4.835 9.298 3.999 1.00 0.00 C ATOM 0 H LEU A1985 -7.560 9.339 3.676 1.00 0.00 H new ATOM 0 HA LEU A1985 -6.708 11.715 2.277 1.00 0.00 H new ATOM 0 HB2 LEU A1985 -6.345 8.786 1.704 1.00 0.00 H new ATOM 0 HB3 LEU A1985 -5.698 10.081 0.716 1.00 0.00 H new ATOM 0 HG LEU A1985 -4.057 9.090 2.031 1.00 0.00 H new ATOM 0 HD11 LEU A1985 -3.074 11.074 3.235 1.00 0.00 H new ATOM 0 HD12 LEU A1985 -3.706 11.463 1.618 1.00 0.00 H new ATOM 0 HD13 LEU A1985 -4.644 11.894 3.068 1.00 0.00 H new ATOM 0 HD21 LEU A1985 -3.872 9.332 4.508 1.00 0.00 H new ATOM 0 HD22 LEU A1985 -5.548 9.928 4.531 1.00 0.00 H new ATOM 0 HD23 LEU A1985 -5.200 8.271 3.982 1.00 0.00 H new ATOM 786 N GLY A1986 -9.411 10.068 1.349 1.00 0.00 N ATOM 787 CA GLY A1986 -10.578 9.989 0.467 1.00 0.00 C ATOM 788 C GLY A1986 -10.996 8.568 0.072 1.00 0.00 C ATOM 789 O GLY A1986 -11.796 8.408 -0.846 1.00 0.00 O ATOM 0 H GLY A1986 -9.548 9.546 2.215 1.00 0.00 H new ATOM 0 HA2 GLY A1986 -11.420 10.476 0.959 1.00 0.00 H new ATOM 0 HA3 GLY A1986 -10.368 10.555 -0.440 1.00 0.00 H new ATOM 793 N LEU A1987 -10.489 7.527 0.735 1.00 0.00 N ATOM 794 CA LEU A1987 -10.807 6.121 0.427 1.00 0.00 C ATOM 795 C LEU A1987 -12.227 5.746 0.796 1.00 0.00 C ATOM 796 O LEU A1987 -12.574 5.616 1.971 1.00 0.00 O ATOM 797 CB LEU A1987 -9.788 5.210 1.125 1.00 0.00 C ATOM 798 CG LEU A1987 -9.557 3.753 0.686 1.00 0.00 C ATOM 799 CD1 LEU A1987 -10.725 2.841 1.038 1.00 0.00 C ATOM 800 CD2 LEU A1987 -9.161 3.659 -0.793 1.00 0.00 C ATOM 0 H LEU A1987 -9.837 7.632 1.512 1.00 0.00 H new ATOM 0 HA LEU A1987 -10.738 5.987 -0.653 1.00 0.00 H new ATOM 0 HB2 LEU A1987 -8.823 5.713 1.063 1.00 0.00 H new ATOM 0 HB3 LEU A1987 -10.064 5.180 2.179 1.00 0.00 H new ATOM 0 HG LEU A1987 -8.709 3.384 1.263 1.00 0.00 H new ATOM 0 HD11 LEU A1987 -10.507 1.826 0.705 1.00 0.00 H new ATOM 0 HD12 LEU A1987 -10.877 2.844 2.117 1.00 0.00 H new ATOM 0 HD13 LEU A1987 -11.628 3.199 0.544 1.00 0.00 H new ATOM 0 HD21 LEU A1987 -9.007 2.614 -1.063 1.00 0.00 H new ATOM 0 HD22 LEU A1987 -9.955 4.080 -1.410 1.00 0.00 H new ATOM 0 HD23 LEU A1987 -8.239 4.216 -0.959 1.00 0.00 H new ATOM 812 N ASP A1988 -13.053 5.558 -0.224 1.00 0.00 N ATOM 813 CA ASP A1988 -14.434 5.155 -0.044 1.00 0.00 C ATOM 814 C ASP A1988 -14.508 3.633 -0.142 1.00 0.00 C ATOM 815 O ASP A1988 -13.613 3.024 -0.733 1.00 0.00 O ATOM 816 CB ASP A1988 -15.318 5.664 -1.175 1.00 0.00 C ATOM 817 CG ASP A1988 -15.287 7.160 -1.433 1.00 0.00 C ATOM 818 OD1 ASP A1988 -15.864 7.933 -0.634 1.00 0.00 O ATOM 819 OD2 ASP A1988 -14.700 7.546 -2.463 1.00 0.00 O ATOM 0 H ASP A1988 -12.781 5.682 -1.199 1.00 0.00 H new ATOM 0 HA ASP A1988 -14.767 5.551 0.915 1.00 0.00 H new ATOM 0 HB2 ASP A1988 -15.027 5.153 -2.093 1.00 0.00 H new ATOM 0 HB3 ASP A1988 -16.347 5.375 -0.961 1.00 0.00 H new ATOM 824 N SER A1989 -15.616 3.026 0.300 1.00 0.00 N ATOM 825 CA SER A1989 -15.783 1.580 0.237 1.00 0.00 C ATOM 826 C SER A1989 -15.594 0.982 -1.162 1.00 0.00 C ATOM 827 O SER A1989 -15.267 -0.199 -1.269 1.00 0.00 O ATOM 828 CB SER A1989 -17.178 1.195 0.720 1.00 0.00 C ATOM 829 OG SER A1989 -17.076 -0.147 1.156 1.00 0.00 O ATOM 0 H SER A1989 -16.410 3.522 0.706 1.00 0.00 H new ATOM 0 HA SER A1989 -14.999 1.175 0.877 1.00 0.00 H new ATOM 0 HB2 SER A1989 -17.505 1.846 1.531 1.00 0.00 H new ATOM 0 HB3 SER A1989 -17.910 1.292 -0.082 1.00 0.00 H new ATOM 0 HG SER A1989 -16.533 -0.186 1.971 1.00 0.00 H new ATOM 834 N ILE A1990 -15.937 1.714 -2.228 1.00 0.00 N ATOM 835 CA ILE A1990 -15.814 1.230 -3.593 1.00 0.00 C ATOM 836 C ILE A1990 -14.345 1.319 -3.993 1.00 0.00 C ATOM 837 O ILE A1990 -13.751 0.339 -4.432 1.00 0.00 O ATOM 838 CB ILE A1990 -16.779 2.019 -4.504 1.00 0.00 C ATOM 839 CG1 ILE A1990 -18.224 1.620 -4.116 1.00 0.00 C ATOM 840 CG2 ILE A1990 -16.512 1.749 -5.994 1.00 0.00 C ATOM 841 CD1 ILE A1990 -19.302 2.502 -4.743 1.00 0.00 C ATOM 0 H ILE A1990 -16.308 2.662 -2.160 1.00 0.00 H new ATOM 0 HA ILE A1990 -16.108 0.185 -3.693 1.00 0.00 H new ATOM 0 HB ILE A1990 -16.627 3.088 -4.359 1.00 0.00 H new ATOM 0 HG12 ILE A1990 -18.397 0.586 -4.414 1.00 0.00 H new ATOM 0 HG13 ILE A1990 -18.322 1.660 -3.031 1.00 0.00 H new ATOM 0 HG21 ILE A1990 -17.213 2.324 -6.599 1.00 0.00 H new ATOM 0 HG22 ILE A1990 -15.492 2.045 -6.240 1.00 0.00 H new ATOM 0 HG23 ILE A1990 -16.641 0.686 -6.200 1.00 0.00 H new ATOM 0 HD11 ILE A1990 -20.285 2.158 -4.423 1.00 0.00 H new ATOM 0 HD12 ILE A1990 -19.158 3.535 -4.425 1.00 0.00 H new ATOM 0 HD13 ILE A1990 -19.233 2.444 -5.829 1.00 0.00 H new ATOM 853 N VAL A1991 -13.738 2.484 -3.780 1.00 0.00 N ATOM 854 CA VAL A1991 -12.346 2.731 -4.107 1.00 0.00 C ATOM 855 C VAL A1991 -11.441 1.723 -3.381 1.00 0.00 C ATOM 856 O VAL A1991 -10.477 1.217 -3.953 1.00 0.00 O ATOM 857 CB VAL A1991 -11.999 4.198 -3.818 1.00 0.00 C ATOM 858 CG1 VAL A1991 -10.630 4.519 -4.406 1.00 0.00 C ATOM 859 CG2 VAL A1991 -13.002 5.149 -4.483 1.00 0.00 C ATOM 0 H VAL A1991 -14.210 3.290 -3.370 1.00 0.00 H new ATOM 0 HA VAL A1991 -12.172 2.575 -5.172 1.00 0.00 H new ATOM 0 HB VAL A1991 -12.019 4.332 -2.736 1.00 0.00 H new ATOM 0 HG11 VAL A1991 -10.381 5.560 -4.202 1.00 0.00 H new ATOM 0 HG12 VAL A1991 -9.879 3.871 -3.954 1.00 0.00 H new ATOM 0 HG13 VAL A1991 -10.649 4.355 -5.483 1.00 0.00 H new ATOM 0 HG21 VAL A1991 -12.729 6.180 -4.259 1.00 0.00 H new ATOM 0 HG22 VAL A1991 -12.988 4.996 -5.562 1.00 0.00 H new ATOM 0 HG23 VAL A1991 -14.003 4.948 -4.101 1.00 0.00 H new ATOM 869 N GLY A1992 -11.772 1.363 -2.139 1.00 0.00 N ATOM 870 CA GLY A1992 -10.990 0.423 -1.363 1.00 0.00 C ATOM 871 C GLY A1992 -11.001 -0.978 -1.973 1.00 0.00 C ATOM 872 O GLY A1992 -9.966 -1.648 -2.017 1.00 0.00 O ATOM 0 H GLY A1992 -12.593 1.721 -1.650 1.00 0.00 H new ATOM 0 HA2 GLY A1992 -9.962 0.779 -1.293 1.00 0.00 H new ATOM 0 HA3 GLY A1992 -11.382 0.378 -0.347 1.00 0.00 H new ATOM 876 N VAL A1993 -12.165 -1.454 -2.418 1.00 0.00 N ATOM 877 CA VAL A1993 -12.272 -2.784 -3.002 1.00 0.00 C ATOM 878 C VAL A1993 -11.629 -2.863 -4.382 1.00 0.00 C ATOM 879 O VAL A1993 -11.088 -3.913 -4.723 1.00 0.00 O ATOM 880 CB VAL A1993 -13.735 -3.246 -2.985 1.00 0.00 C ATOM 881 CG1 VAL A1993 -14.704 -2.450 -3.852 1.00 0.00 C ATOM 882 CG2 VAL A1993 -13.887 -4.699 -3.401 1.00 0.00 C ATOM 0 H VAL A1993 -13.043 -0.936 -2.384 1.00 0.00 H new ATOM 0 HA VAL A1993 -11.702 -3.481 -2.388 1.00 0.00 H new ATOM 0 HB VAL A1993 -14.002 -3.083 -1.941 1.00 0.00 H new ATOM 0 HG11 VAL A1993 -15.706 -2.870 -3.758 1.00 0.00 H new ATOM 0 HG12 VAL A1993 -14.714 -1.410 -3.526 1.00 0.00 H new ATOM 0 HG13 VAL A1993 -14.386 -2.500 -4.893 1.00 0.00 H new ATOM 0 HG21 VAL A1993 -14.940 -4.977 -3.373 1.00 0.00 H new ATOM 0 HG22 VAL A1993 -13.504 -4.830 -4.413 1.00 0.00 H new ATOM 0 HG23 VAL A1993 -13.325 -5.334 -2.716 1.00 0.00 H new ATOM 892 N GLU A1994 -11.669 -1.798 -5.179 1.00 0.00 N ATOM 893 CA GLU A1994 -11.050 -1.841 -6.494 1.00 0.00 C ATOM 894 C GLU A1994 -9.526 -1.732 -6.358 1.00 0.00 C ATOM 895 O GLU A1994 -8.793 -2.455 -7.034 1.00 0.00 O ATOM 896 CB GLU A1994 -11.674 -0.788 -7.415 1.00 0.00 C ATOM 897 CG GLU A1994 -11.427 0.655 -6.979 1.00 0.00 C ATOM 898 CD GLU A1994 -11.692 1.678 -8.075 1.00 0.00 C ATOM 899 OE1 GLU A1994 -12.792 1.661 -8.666 1.00 0.00 O ATOM 900 OE2 GLU A1994 -10.751 2.467 -8.330 1.00 0.00 O ATOM 0 H GLU A1994 -12.115 -0.912 -4.941 1.00 0.00 H new ATOM 0 HA GLU A1994 -11.246 -2.801 -6.971 1.00 0.00 H new ATOM 0 HB2 GLU A1994 -11.279 -0.923 -8.422 1.00 0.00 H new ATOM 0 HB3 GLU A1994 -12.749 -0.960 -7.468 1.00 0.00 H new ATOM 0 HG2 GLU A1994 -12.062 0.880 -6.122 1.00 0.00 H new ATOM 0 HG3 GLU A1994 -10.394 0.753 -6.645 1.00 0.00 H new ATOM 907 N TRP A1995 -9.041 -0.897 -5.429 1.00 0.00 N ATOM 908 CA TRP A1995 -7.615 -0.692 -5.207 1.00 0.00 C ATOM 909 C TRP A1995 -6.944 -1.946 -4.660 1.00 0.00 C ATOM 910 O TRP A1995 -5.795 -2.220 -5.012 1.00 0.00 O ATOM 911 CB TRP A1995 -7.395 0.499 -4.279 1.00 0.00 C ATOM 912 CG TRP A1995 -5.981 0.977 -4.164 1.00 0.00 C ATOM 913 CD1 TRP A1995 -5.107 1.172 -5.175 1.00 0.00 C ATOM 914 CD2 TRP A1995 -5.243 1.282 -2.952 1.00 0.00 C ATOM 915 NE1 TRP A1995 -3.888 1.549 -4.653 1.00 0.00 N ATOM 916 CE2 TRP A1995 -3.879 1.516 -3.273 1.00 0.00 C ATOM 917 CE3 TRP A1995 -5.599 1.276 -1.594 1.00 0.00 C ATOM 918 CZ2 TRP A1995 -2.900 1.676 -2.276 1.00 0.00 C ATOM 919 CZ3 TRP A1995 -4.626 1.367 -0.582 1.00 0.00 C ATOM 920 CH2 TRP A1995 -3.276 1.572 -0.923 1.00 0.00 C ATOM 0 H TRP A1995 -9.635 -0.345 -4.811 1.00 0.00 H new ATOM 0 HA TRP A1995 -7.150 -0.476 -6.169 1.00 0.00 H new ATOM 0 HB2 TRP A1995 -8.012 1.327 -4.627 1.00 0.00 H new ATOM 0 HB3 TRP A1995 -7.751 0.232 -3.284 1.00 0.00 H new ATOM 0 HD1 TRP A1995 -5.328 1.052 -6.225 1.00 0.00 H new ATOM 0 HE1 TRP A1995 -3.085 1.821 -5.221 1.00 0.00 H new ATOM 0 HE3 TRP A1995 -6.641 1.200 -1.321 1.00 0.00 H new ATOM 0 HZ2 TRP A1995 -1.873 1.876 -2.545 1.00 0.00 H new ATOM 0 HZ3 TRP A1995 -4.915 1.280 0.455 1.00 0.00 H new ATOM 0 HH2 TRP A1995 -2.529 1.650 -0.147 1.00 0.00 H new ATOM 931 N THR A1996 -7.634 -2.747 -3.834 1.00 0.00 N ATOM 932 CA THR A1996 -7.036 -3.978 -3.315 1.00 0.00 C ATOM 933 C THR A1996 -6.560 -4.875 -4.481 1.00 0.00 C ATOM 934 O THR A1996 -5.611 -5.646 -4.328 1.00 0.00 O ATOM 935 CB THR A1996 -8.020 -4.654 -2.343 1.00 0.00 C ATOM 936 OG1 THR A1996 -7.335 -5.341 -1.309 1.00 0.00 O ATOM 937 CG2 THR A1996 -8.962 -5.633 -3.039 1.00 0.00 C ATOM 0 H THR A1996 -8.587 -2.567 -3.518 1.00 0.00 H new ATOM 0 HA THR A1996 -6.138 -3.762 -2.736 1.00 0.00 H new ATOM 0 HB THR A1996 -8.616 -3.844 -1.921 1.00 0.00 H new ATOM 0 HG1 THR A1996 -7.977 -5.629 -0.627 1.00 0.00 H new ATOM 0 HG21 THR A1996 -9.632 -6.078 -2.304 1.00 0.00 H new ATOM 0 HG22 THR A1996 -9.548 -5.103 -3.790 1.00 0.00 H new ATOM 0 HG23 THR A1996 -8.379 -6.418 -3.521 1.00 0.00 H new ATOM 945 N THR A1997 -7.209 -4.790 -5.649 1.00 0.00 N ATOM 946 CA THR A1997 -6.841 -5.587 -6.807 1.00 0.00 C ATOM 947 C THR A1997 -5.498 -5.140 -7.379 1.00 0.00 C ATOM 948 O THR A1997 -4.680 -5.995 -7.717 1.00 0.00 O ATOM 949 CB THR A1997 -7.936 -5.484 -7.878 1.00 0.00 C ATOM 950 OG1 THR A1997 -9.195 -5.822 -7.329 1.00 0.00 O ATOM 951 CG2 THR A1997 -7.656 -6.432 -9.041 1.00 0.00 C ATOM 0 H THR A1997 -8.000 -4.167 -5.809 1.00 0.00 H new ATOM 0 HA THR A1997 -6.742 -6.626 -6.492 1.00 0.00 H new ATOM 0 HB THR A1997 -7.943 -4.455 -8.237 1.00 0.00 H new ATOM 0 HG1 THR A1997 -9.884 -5.750 -8.022 1.00 0.00 H new ATOM 0 HG21 THR A1997 -8.447 -6.339 -9.785 1.00 0.00 H new ATOM 0 HG22 THR A1997 -6.698 -6.178 -9.495 1.00 0.00 H new ATOM 0 HG23 THR A1997 -7.622 -7.458 -8.674 1.00 0.00 H new ATOM 959 N THR A1998 -5.225 -3.836 -7.422 1.00 0.00 N ATOM 960 CA THR A1998 -3.999 -3.275 -7.975 1.00 0.00 C ATOM 961 C THR A1998 -2.793 -3.905 -7.291 1.00 0.00 C ATOM 962 O THR A1998 -1.841 -4.340 -7.935 1.00 0.00 O ATOM 963 CB THR A1998 -4.022 -1.748 -7.756 1.00 0.00 C ATOM 964 OG1 THR A1998 -5.286 -1.210 -8.091 1.00 0.00 O ATOM 965 CG2 THR A1998 -2.926 -1.034 -8.547 1.00 0.00 C ATOM 0 H THR A1998 -5.866 -3.127 -7.065 1.00 0.00 H new ATOM 0 HA THR A1998 -3.928 -3.485 -9.042 1.00 0.00 H new ATOM 0 HB THR A1998 -3.830 -1.580 -6.696 1.00 0.00 H new ATOM 0 HG1 THR A1998 -5.279 -0.241 -7.943 1.00 0.00 H new ATOM 0 HG21 THR A1998 -2.983 0.038 -8.361 1.00 0.00 H new ATOM 0 HG22 THR A1998 -1.950 -1.406 -8.234 1.00 0.00 H new ATOM 0 HG23 THR A1998 -3.062 -1.225 -9.611 1.00 0.00 H new ATOM 973 N ILE A1999 -2.853 -4.014 -5.969 1.00 0.00 N ATOM 974 CA ILE A1999 -1.806 -4.583 -5.140 1.00 0.00 C ATOM 975 C ILE A1999 -1.620 -6.065 -5.452 1.00 0.00 C ATOM 976 O ILE A1999 -0.484 -6.541 -5.487 1.00 0.00 O ATOM 977 CB ILE A1999 -2.200 -4.362 -3.674 1.00 0.00 C ATOM 978 CG1 ILE A1999 -2.231 -2.847 -3.389 1.00 0.00 C ATOM 979 CG2 ILE A1999 -1.243 -5.062 -2.703 1.00 0.00 C ATOM 980 CD1 ILE A1999 -2.884 -2.565 -2.048 1.00 0.00 C ATOM 0 H ILE A1999 -3.659 -3.697 -5.431 1.00 0.00 H new ATOM 0 HA ILE A1999 -0.851 -4.098 -5.341 1.00 0.00 H new ATOM 0 HB ILE A1999 -3.186 -4.799 -3.517 1.00 0.00 H new ATOM 0 HG12 ILE A1999 -1.216 -2.450 -3.395 1.00 0.00 H new ATOM 0 HG13 ILE A1999 -2.778 -2.334 -4.180 1.00 0.00 H new ATOM 0 HG21 ILE A1999 -1.564 -4.876 -1.678 1.00 0.00 H new ATOM 0 HG22 ILE A1999 -1.249 -6.135 -2.896 1.00 0.00 H new ATOM 0 HG23 ILE A1999 -0.234 -4.674 -2.843 1.00 0.00 H new ATOM 0 HD11 ILE A1999 -2.895 -1.490 -1.868 1.00 0.00 H new ATOM 0 HD12 ILE A1999 -3.907 -2.942 -2.055 1.00 0.00 H new ATOM 0 HD13 ILE A1999 -2.320 -3.060 -1.257 1.00 0.00 H new ATOM 992 N ASN A2000 -2.715 -6.802 -5.656 1.00 0.00 N ATOM 993 CA ASN A2000 -2.635 -8.221 -5.951 1.00 0.00 C ATOM 994 C ASN A2000 -1.869 -8.401 -7.234 1.00 0.00 C ATOM 995 O ASN A2000 -1.000 -9.256 -7.300 1.00 0.00 O ATOM 996 CB ASN A2000 -4.009 -8.864 -6.164 1.00 0.00 C ATOM 997 CG ASN A2000 -4.874 -8.827 -4.939 1.00 0.00 C ATOM 998 OD1 ASN A2000 -4.379 -8.799 -3.825 1.00 0.00 O ATOM 999 ND2 ASN A2000 -6.178 -8.862 -5.115 1.00 0.00 N ATOM 0 H ASN A2000 -3.665 -6.432 -5.621 1.00 0.00 H new ATOM 0 HA ASN A2000 -2.154 -8.696 -5.096 1.00 0.00 H new ATOM 0 HB2 ASN A2000 -4.521 -8.351 -6.978 1.00 0.00 H new ATOM 0 HB3 ASN A2000 -3.874 -9.900 -6.475 1.00 0.00 H new ATOM 0 HD21 ASN A2000 -6.802 -8.866 -4.308 1.00 0.00 H new ATOM 0 HD22 ASN A2000 -6.565 -8.885 -6.059 1.00 0.00 H new ATOM 1006 N GLN A2001 -2.201 -7.601 -8.241 1.00 0.00 N ATOM 1007 CA GLN A2001 -1.548 -7.654 -9.532 1.00 0.00 C ATOM 1008 C GLN A2001 -0.086 -7.241 -9.385 1.00 0.00 C ATOM 1009 O GLN A2001 0.801 -7.887 -9.944 1.00 0.00 O ATOM 1010 CB GLN A2001 -2.268 -6.728 -10.519 1.00 0.00 C ATOM 1011 CG GLN A2001 -3.756 -7.069 -10.687 1.00 0.00 C ATOM 1012 CD GLN A2001 -4.228 -6.805 -12.104 1.00 0.00 C ATOM 1013 OE1 GLN A2001 -5.045 -5.920 -12.351 1.00 0.00 O ATOM 1014 NE2 GLN A2001 -3.732 -7.558 -13.071 1.00 0.00 N ATOM 0 H GLN A2001 -2.935 -6.896 -8.179 1.00 0.00 H new ATOM 0 HA GLN A2001 -1.590 -8.673 -9.917 1.00 0.00 H new ATOM 0 HB2 GLN A2001 -2.174 -5.698 -10.176 1.00 0.00 H new ATOM 0 HB3 GLN A2001 -1.776 -6.788 -11.490 1.00 0.00 H new ATOM 0 HG2 GLN A2001 -3.921 -8.117 -10.436 1.00 0.00 H new ATOM 0 HG3 GLN A2001 -4.348 -6.477 -9.989 1.00 0.00 H new ATOM 0 HE21 GLN A2001 -3.055 -8.289 -12.852 1.00 0.00 H new ATOM 0 HE22 GLN A2001 -4.026 -7.408 -14.036 1.00 0.00 H new ATOM 1023 N THR A2002 0.176 -6.213 -8.575 1.00 0.00 N ATOM 1024 CA THR A2002 1.508 -5.690 -8.352 1.00 0.00 C ATOM 1025 C THR A2002 2.453 -6.749 -7.777 1.00 0.00 C ATOM 1026 O THR A2002 3.582 -6.877 -8.260 1.00 0.00 O ATOM 1027 CB THR A2002 1.448 -4.438 -7.452 1.00 0.00 C ATOM 1028 OG1 THR A2002 0.644 -3.424 -8.024 1.00 0.00 O ATOM 1029 CG2 THR A2002 2.825 -3.816 -7.205 1.00 0.00 C ATOM 0 H THR A2002 -0.548 -5.720 -8.052 1.00 0.00 H new ATOM 0 HA THR A2002 1.918 -5.400 -9.319 1.00 0.00 H new ATOM 0 HB THR A2002 1.027 -4.793 -6.511 1.00 0.00 H new ATOM 0 HG1 THR A2002 -0.300 -3.610 -7.836 1.00 0.00 H new ATOM 0 HG21 THR A2002 2.719 -2.939 -6.566 1.00 0.00 H new ATOM 0 HG22 THR A2002 3.471 -4.545 -6.717 1.00 0.00 H new ATOM 0 HG23 THR A2002 3.266 -3.520 -8.157 1.00 0.00 H new ATOM 1037 N TYR A2003 1.994 -7.555 -6.818 1.00 0.00 N ATOM 1038 CA TYR A2003 2.819 -8.571 -6.164 1.00 0.00 C ATOM 1039 C TYR A2003 2.489 -10.024 -6.494 1.00 0.00 C ATOM 1040 O TYR A2003 3.177 -10.921 -6.007 1.00 0.00 O ATOM 1041 CB TYR A2003 2.772 -8.284 -4.663 1.00 0.00 C ATOM 1042 CG TYR A2003 3.278 -6.895 -4.332 1.00 0.00 C ATOM 1043 CD1 TYR A2003 4.601 -6.547 -4.653 1.00 0.00 C ATOM 1044 CD2 TYR A2003 2.422 -5.943 -3.750 1.00 0.00 C ATOM 1045 CE1 TYR A2003 5.097 -5.281 -4.316 1.00 0.00 C ATOM 1046 CE2 TYR A2003 2.915 -4.670 -3.404 1.00 0.00 C ATOM 1047 CZ TYR A2003 4.269 -4.348 -3.658 1.00 0.00 C ATOM 1048 OH TYR A2003 4.783 -3.156 -3.250 1.00 0.00 O ATOM 0 H TYR A2003 1.035 -7.521 -6.472 1.00 0.00 H new ATOM 0 HA TYR A2003 3.830 -8.484 -6.561 1.00 0.00 H new ATOM 0 HB2 TYR A2003 1.748 -8.391 -4.306 1.00 0.00 H new ATOM 0 HB3 TYR A2003 3.373 -9.024 -4.134 1.00 0.00 H new ATOM 0 HD1 TYR A2003 5.237 -7.257 -5.161 1.00 0.00 H new ATOM 0 HD2 TYR A2003 1.386 -6.188 -3.568 1.00 0.00 H new ATOM 0 HE1 TYR A2003 6.116 -5.019 -4.561 1.00 0.00 H new ATOM 0 HE2 TYR A2003 2.262 -3.942 -2.946 1.00 0.00 H new ATOM 0 HH TYR A2003 4.051 -2.546 -3.018 1.00 0.00 H new ATOM 1058 N ASN A2004 1.510 -10.258 -7.366 1.00 0.00 N ATOM 1059 CA ASN A2004 1.029 -11.572 -7.802 1.00 0.00 C ATOM 1060 C ASN A2004 0.454 -12.357 -6.609 1.00 0.00 C ATOM 1061 O ASN A2004 0.747 -13.541 -6.407 1.00 0.00 O ATOM 1062 CB ASN A2004 2.153 -12.302 -8.561 1.00 0.00 C ATOM 1063 CG ASN A2004 1.631 -13.149 -9.716 1.00 0.00 C ATOM 1064 OD1 ASN A2004 0.449 -13.456 -9.825 1.00 0.00 O ATOM 1065 ND2 ASN A2004 2.493 -13.470 -10.666 1.00 0.00 N ATOM 0 H ASN A2004 1.002 -9.495 -7.813 1.00 0.00 H new ATOM 0 HA ASN A2004 0.201 -11.466 -8.503 1.00 0.00 H new ATOM 0 HB2 ASN A2004 2.862 -11.568 -8.945 1.00 0.00 H new ATOM 0 HB3 ASN A2004 2.700 -12.940 -7.866 1.00 0.00 H new ATOM 0 HD21 ASN A2004 2.175 -13.975 -11.493 1.00 0.00 H new ATOM 0 HD22 ASN A2004 3.475 -13.213 -10.571 1.00 0.00 H new ATOM 1072 N LEU A2005 -0.339 -11.658 -5.783 1.00 0.00 N ATOM 1073 CA LEU A2005 -0.978 -12.152 -4.558 1.00 0.00 C ATOM 1074 C LEU A2005 -2.499 -12.186 -4.669 1.00 0.00 C ATOM 1075 O LEU A2005 -3.051 -12.043 -5.755 1.00 0.00 O ATOM 1076 CB LEU A2005 -0.521 -11.278 -3.368 1.00 0.00 C ATOM 1077 CG LEU A2005 1.006 -11.243 -3.179 1.00 0.00 C ATOM 1078 CD1 LEU A2005 1.369 -10.404 -1.955 1.00 0.00 C ATOM 1079 CD2 LEU A2005 1.554 -12.671 -3.072 1.00 0.00 C ATOM 0 H LEU A2005 -0.563 -10.679 -5.963 1.00 0.00 H new ATOM 0 HA LEU A2005 -0.666 -13.184 -4.397 1.00 0.00 H new ATOM 0 HB2 LEU A2005 -0.884 -10.261 -3.515 1.00 0.00 H new ATOM 0 HB3 LEU A2005 -0.983 -11.652 -2.455 1.00 0.00 H new ATOM 0 HG LEU A2005 1.467 -10.773 -4.048 1.00 0.00 H new ATOM 0 HD11 LEU A2005 2.452 -10.388 -1.833 1.00 0.00 H new ATOM 0 HD12 LEU A2005 1.004 -9.386 -2.090 1.00 0.00 H new ATOM 0 HD13 LEU A2005 0.910 -10.839 -1.067 1.00 0.00 H new ATOM 0 HD21 LEU A2005 2.635 -12.637 -2.938 1.00 0.00 H new ATOM 0 HD22 LEU A2005 1.099 -13.172 -2.218 1.00 0.00 H new ATOM 0 HD23 LEU A2005 1.318 -13.220 -3.983 1.00 0.00 H new ATOM 1091 N ASN A2006 -3.195 -12.419 -3.552 1.00 0.00 N ATOM 1092 CA ASN A2006 -4.647 -12.472 -3.466 1.00 0.00 C ATOM 1093 C ASN A2006 -5.069 -11.857 -2.138 1.00 0.00 C ATOM 1094 O ASN A2006 -4.778 -12.398 -1.066 1.00 0.00 O ATOM 1095 CB ASN A2006 -5.163 -13.906 -3.583 1.00 0.00 C ATOM 1096 CG ASN A2006 -6.649 -13.975 -3.247 1.00 0.00 C ATOM 1097 OD1 ASN A2006 -7.416 -13.060 -3.534 1.00 0.00 O ATOM 1098 ND2 ASN A2006 -7.090 -15.024 -2.579 1.00 0.00 N ATOM 0 H ASN A2006 -2.741 -12.581 -2.653 1.00 0.00 H new ATOM 0 HA ASN A2006 -5.078 -11.911 -4.295 1.00 0.00 H new ATOM 0 HB2 ASN A2006 -4.997 -14.276 -4.595 1.00 0.00 H new ATOM 0 HB3 ASN A2006 -4.603 -14.555 -2.910 1.00 0.00 H new ATOM 0 HD21 ASN A2006 -8.070 -15.076 -2.300 1.00 0.00 H new ATOM 0 HD22 ASN A2006 -6.451 -15.783 -2.342 1.00 0.00 H new ATOM 1105 N LEU A2007 -5.767 -10.730 -2.232 1.00 0.00 N ATOM 1106 CA LEU A2007 -6.305 -9.890 -1.172 1.00 0.00 C ATOM 1107 C LEU A2007 -7.630 -9.345 -1.661 1.00 0.00 C ATOM 1108 O LEU A2007 -7.973 -9.422 -2.848 1.00 0.00 O ATOM 1109 CB LEU A2007 -5.353 -8.706 -0.898 1.00 0.00 C ATOM 1110 CG LEU A2007 -3.861 -9.063 -0.717 1.00 0.00 C ATOM 1111 CD1 LEU A2007 -2.981 -7.824 -0.827 1.00 0.00 C ATOM 1112 CD2 LEU A2007 -3.615 -9.746 0.620 1.00 0.00 C ATOM 0 H LEU A2007 -5.992 -10.344 -3.149 1.00 0.00 H new ATOM 0 HA LEU A2007 -6.422 -10.467 -0.255 1.00 0.00 H new ATOM 0 HB2 LEU A2007 -5.439 -7.998 -1.723 1.00 0.00 H new ATOM 0 HB3 LEU A2007 -5.694 -8.192 0.000 1.00 0.00 H new ATOM 0 HG LEU A2007 -3.598 -9.754 -1.518 1.00 0.00 H new ATOM 0 HD11 LEU A2007 -1.937 -8.107 -0.695 1.00 0.00 H new ATOM 0 HD12 LEU A2007 -3.113 -7.370 -1.809 1.00 0.00 H new ATOM 0 HD13 LEU A2007 -3.263 -7.108 -0.055 1.00 0.00 H new ATOM 0 HD21 LEU A2007 -2.556 -9.985 0.717 1.00 0.00 H new ATOM 0 HD22 LEU A2007 -3.913 -9.079 1.429 1.00 0.00 H new ATOM 0 HD23 LEU A2007 -4.200 -10.664 0.673 1.00 0.00 H new ATOM 1124 N LYS A2008 -8.402 -8.856 -0.698 1.00 0.00 N ATOM 1125 CA LYS A2008 -9.716 -8.288 -0.907 1.00 0.00 C ATOM 1126 C LYS A2008 -9.935 -7.025 -0.103 1.00 0.00 C ATOM 1127 O LYS A2008 -9.013 -6.571 0.578 1.00 0.00 O ATOM 1128 CB LYS A2008 -10.778 -9.366 -0.729 1.00 0.00 C ATOM 1129 CG LYS A2008 -10.591 -10.490 0.299 1.00 0.00 C ATOM 1130 CD LYS A2008 -11.717 -10.421 1.302 1.00 0.00 C ATOM 1131 CE LYS A2008 -13.104 -10.784 0.746 1.00 0.00 C ATOM 1132 NZ LYS A2008 -13.229 -12.226 0.443 1.00 0.00 N ATOM 0 H LYS A2008 -8.115 -8.847 0.281 1.00 0.00 H new ATOM 0 HA LYS A2008 -9.803 -7.943 -1.937 1.00 0.00 H new ATOM 0 HB2 LYS A2008 -11.711 -8.859 -0.483 1.00 0.00 H new ATOM 0 HB3 LYS A2008 -10.919 -9.840 -1.700 1.00 0.00 H new ATOM 0 HG2 LYS A2008 -10.587 -11.460 -0.198 1.00 0.00 H new ATOM 0 HG3 LYS A2008 -9.630 -10.386 0.802 1.00 0.00 H new ATOM 0 HD2 LYS A2008 -11.487 -11.091 2.131 1.00 0.00 H new ATOM 0 HD3 LYS A2008 -11.759 -9.411 1.711 1.00 0.00 H new ATOM 0 HE2 LYS A2008 -13.868 -10.500 1.469 1.00 0.00 H new ATOM 0 HE3 LYS A2008 -13.292 -10.207 -0.160 1.00 0.00 H new ATOM 0 HZ1 LYS A2008 -14.180 -12.421 0.071 1.00 0.00 H new ATOM 0 HZ2 LYS A2008 -12.518 -12.494 -0.267 1.00 0.00 H new ATOM 0 HZ3 LYS A2008 -13.077 -12.778 1.311 1.00 0.00 H new ATOM 1146 N ALA A2009 -11.140 -6.455 -0.165 1.00 0.00 N ATOM 1147 CA ALA A2009 -11.484 -5.240 0.564 1.00 0.00 C ATOM 1148 C ALA A2009 -11.258 -5.413 2.065 1.00 0.00 C ATOM 1149 O ALA A2009 -11.030 -4.422 2.749 1.00 0.00 O ATOM 1150 CB ALA A2009 -12.937 -4.852 0.320 1.00 0.00 C ATOM 0 H ALA A2009 -11.906 -6.828 -0.726 1.00 0.00 H new ATOM 0 HA ALA A2009 -10.832 -4.448 0.195 1.00 0.00 H new ATOM 0 HB1 ALA A2009 -13.169 -3.943 0.875 1.00 0.00 H new ATOM 0 HB2 ALA A2009 -13.093 -4.677 -0.745 1.00 0.00 H new ATOM 0 HB3 ALA A2009 -13.590 -5.658 0.655 1.00 0.00 H new ATOM 1156 N THR A2010 -11.280 -6.655 2.573 1.00 0.00 N ATOM 1157 CA THR A2010 -11.055 -6.927 3.992 1.00 0.00 C ATOM 1158 C THR A2010 -9.714 -6.307 4.409 1.00 0.00 C ATOM 1159 O THR A2010 -9.613 -5.768 5.509 1.00 0.00 O ATOM 1160 CB THR A2010 -11.155 -8.449 4.238 1.00 0.00 C ATOM 1161 OG1 THR A2010 -11.431 -8.811 5.566 1.00 0.00 O ATOM 1162 CG2 THR A2010 -9.912 -9.239 3.810 1.00 0.00 C ATOM 0 H THR A2010 -11.453 -7.490 2.013 1.00 0.00 H new ATOM 0 HA THR A2010 -11.818 -6.467 4.620 1.00 0.00 H new ATOM 0 HB THR A2010 -12.002 -8.714 3.605 1.00 0.00 H new ATOM 0 HG1 THR A2010 -11.479 -9.787 5.636 1.00 0.00 H new ATOM 0 HG21 THR A2010 -10.065 -10.298 4.017 1.00 0.00 H new ATOM 0 HG22 THR A2010 -9.741 -9.099 2.743 1.00 0.00 H new ATOM 0 HG23 THR A2010 -9.045 -8.882 4.366 1.00 0.00 H new ATOM 1170 N LYS A2011 -8.704 -6.316 3.517 1.00 0.00 N ATOM 1171 CA LYS A2011 -7.411 -5.716 3.857 1.00 0.00 C ATOM 1172 C LYS A2011 -7.554 -4.224 4.159 1.00 0.00 C ATOM 1173 O LYS A2011 -7.026 -3.757 5.160 1.00 0.00 O ATOM 1174 CB LYS A2011 -6.404 -5.880 2.715 1.00 0.00 C ATOM 1175 CG LYS A2011 -5.794 -7.271 2.585 1.00 0.00 C ATOM 1176 CD LYS A2011 -5.108 -7.760 3.866 1.00 0.00 C ATOM 1177 CE LYS A2011 -5.976 -8.803 4.568 1.00 0.00 C ATOM 1178 NZ LYS A2011 -5.418 -9.324 5.833 1.00 0.00 N ATOM 0 H LYS A2011 -8.759 -6.721 2.583 1.00 0.00 H new ATOM 0 HA LYS A2011 -7.049 -6.238 4.743 1.00 0.00 H new ATOM 0 HB2 LYS A2011 -6.898 -5.628 1.777 1.00 0.00 H new ATOM 0 HB3 LYS A2011 -5.599 -5.159 2.855 1.00 0.00 H new ATOM 0 HG2 LYS A2011 -6.576 -7.978 2.309 1.00 0.00 H new ATOM 0 HG3 LYS A2011 -5.068 -7.266 1.772 1.00 0.00 H new ATOM 0 HD2 LYS A2011 -4.136 -8.189 3.625 1.00 0.00 H new ATOM 0 HD3 LYS A2011 -4.928 -6.918 4.534 1.00 0.00 H new ATOM 0 HE2 LYS A2011 -6.953 -8.365 4.772 1.00 0.00 H new ATOM 0 HE3 LYS A2011 -6.137 -9.639 3.887 1.00 0.00 H new ATOM 0 HZ1 LYS A2011 -6.180 -9.745 6.401 1.00 0.00 H new ATOM 0 HZ2 LYS A2011 -4.701 -10.048 5.624 1.00 0.00 H new ATOM 0 HZ3 LYS A2011 -4.979 -8.546 6.365 1.00 0.00 H new ATOM 1192 N LEU A2012 -8.271 -3.480 3.317 1.00 0.00 N ATOM 1193 CA LEU A2012 -8.494 -2.033 3.443 1.00 0.00 C ATOM 1194 C LEU A2012 -9.230 -1.653 4.726 1.00 0.00 C ATOM 1195 O LEU A2012 -9.171 -0.493 5.137 1.00 0.00 O ATOM 1196 CB LEU A2012 -9.239 -1.511 2.191 1.00 0.00 C ATOM 1197 CG LEU A2012 -8.300 -1.150 1.025 1.00 0.00 C ATOM 1198 CD1 LEU A2012 -7.496 0.102 1.383 1.00 0.00 C ATOM 1199 CD2 LEU A2012 -7.399 -2.327 0.648 1.00 0.00 C ATOM 0 H LEU A2012 -8.730 -3.879 2.498 1.00 0.00 H new ATOM 0 HA LEU A2012 -7.517 -1.553 3.509 1.00 0.00 H new ATOM 0 HB2 LEU A2012 -9.947 -2.270 1.856 1.00 0.00 H new ATOM 0 HB3 LEU A2012 -9.821 -0.631 2.465 1.00 0.00 H new ATOM 0 HG LEU A2012 -8.899 -0.929 0.141 1.00 0.00 H new ATOM 0 HD11 LEU A2012 -6.832 0.356 0.557 1.00 0.00 H new ATOM 0 HD12 LEU A2012 -8.178 0.932 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A2012 -6.905 -0.089 2.278 1.00 0.00 H new ATOM 0 HD21 LEU A2012 -6.749 -2.038 -0.178 1.00 0.00 H new ATOM 0 HD22 LEU A2012 -6.790 -2.609 1.507 1.00 0.00 H new ATOM 0 HD23 LEU A2012 -8.015 -3.174 0.346 1.00 0.00 H new ATOM 1211 N TYR A2013 -9.903 -2.612 5.359 1.00 0.00 N ATOM 1212 CA TYR A2013 -10.643 -2.407 6.593 1.00 0.00 C ATOM 1213 C TYR A2013 -9.880 -2.915 7.817 1.00 0.00 C ATOM 1214 O TYR A2013 -10.266 -2.599 8.943 1.00 0.00 O ATOM 1215 CB TYR A2013 -12.028 -3.042 6.455 1.00 0.00 C ATOM 1216 CG TYR A2013 -12.987 -2.176 5.654 1.00 0.00 C ATOM 1217 CD1 TYR A2013 -13.415 -0.942 6.183 1.00 0.00 C ATOM 1218 CD2 TYR A2013 -13.431 -2.574 4.377 1.00 0.00 C ATOM 1219 CE1 TYR A2013 -14.270 -0.107 5.442 1.00 0.00 C ATOM 1220 CE2 TYR A2013 -14.285 -1.740 3.629 1.00 0.00 C ATOM 1221 CZ TYR A2013 -14.687 -0.491 4.152 1.00 0.00 C ATOM 1222 OH TYR A2013 -15.486 0.331 3.428 1.00 0.00 O ATOM 0 H TYR A2013 -9.947 -3.572 5.017 1.00 0.00 H new ATOM 0 HA TYR A2013 -10.767 -1.337 6.760 1.00 0.00 H new ATOM 0 HB2 TYR A2013 -11.932 -4.015 5.972 1.00 0.00 H new ATOM 0 HB3 TYR A2013 -12.444 -3.218 7.447 1.00 0.00 H new ATOM 0 HD1 TYR A2013 -13.084 -0.635 7.164 1.00 0.00 H new ATOM 0 HD2 TYR A2013 -13.115 -3.523 3.970 1.00 0.00 H new ATOM 0 HE1 TYR A2013 -14.607 0.829 5.862 1.00 0.00 H new ATOM 0 HE2 TYR A2013 -14.632 -2.055 2.656 1.00 0.00 H new ATOM 0 HH TYR A2013 -15.304 1.262 3.672 1.00 0.00 H new ATOM 1232 N ASP A2014 -8.803 -3.686 7.644 1.00 0.00 N ATOM 1233 CA ASP A2014 -8.001 -4.197 8.746 1.00 0.00 C ATOM 1234 C ASP A2014 -6.699 -3.416 8.840 1.00 0.00 C ATOM 1235 O ASP A2014 -6.168 -3.257 9.936 1.00 0.00 O ATOM 1236 CB ASP A2014 -7.698 -5.680 8.523 1.00 0.00 C ATOM 1237 CG ASP A2014 -8.652 -6.552 9.326 1.00 0.00 C ATOM 1238 OD1 ASP A2014 -8.629 -6.527 10.579 1.00 0.00 O ATOM 1239 OD2 ASP A2014 -9.461 -7.282 8.712 1.00 0.00 O ATOM 0 H ASP A2014 -8.465 -3.972 6.725 1.00 0.00 H new ATOM 0 HA ASP A2014 -8.557 -4.081 9.676 1.00 0.00 H new ATOM 0 HB2 ASP A2014 -7.785 -5.918 7.463 1.00 0.00 H new ATOM 0 HB3 ASP A2014 -6.670 -5.894 8.815 1.00 0.00 H new ATOM 1244 N TYR A2015 -6.221 -2.896 7.709 1.00 0.00 N ATOM 1245 CA TYR A2015 -5.000 -2.133 7.549 1.00 0.00 C ATOM 1246 C TYR A2015 -5.318 -0.851 6.778 1.00 0.00 C ATOM 1247 O TYR A2015 -5.035 -0.753 5.585 1.00 0.00 O ATOM 1248 CB TYR A2015 -3.992 -2.990 6.785 1.00 0.00 C ATOM 1249 CG TYR A2015 -3.698 -4.353 7.361 1.00 0.00 C ATOM 1250 CD1 TYR A2015 -3.612 -4.553 8.750 1.00 0.00 C ATOM 1251 CD2 TYR A2015 -3.609 -5.443 6.481 1.00 0.00 C ATOM 1252 CE1 TYR A2015 -3.515 -5.854 9.258 1.00 0.00 C ATOM 1253 CE2 TYR A2015 -3.481 -6.746 6.980 1.00 0.00 C ATOM 1254 CZ TYR A2015 -3.418 -6.950 8.376 1.00 0.00 C ATOM 1255 OH TYR A2015 -3.319 -8.203 8.884 1.00 0.00 O ATOM 0 H TYR A2015 -6.717 -3.009 6.825 1.00 0.00 H new ATOM 0 HA TYR A2015 -4.577 -1.863 8.516 1.00 0.00 H new ATOM 0 HB2 TYR A2015 -4.357 -3.121 5.766 1.00 0.00 H new ATOM 0 HB3 TYR A2015 -3.055 -2.438 6.719 1.00 0.00 H new ATOM 0 HD1 TYR A2015 -3.621 -3.707 9.422 1.00 0.00 H new ATOM 0 HD2 TYR A2015 -3.639 -5.277 5.414 1.00 0.00 H new ATOM 0 HE1 TYR A2015 -3.514 -6.018 10.325 1.00 0.00 H new ATOM 0 HE2 TYR A2015 -3.431 -7.586 6.303 1.00 0.00 H new ATOM 0 HH TYR A2015 -3.261 -8.850 8.150 1.00 0.00 H new ATOM 1265 N PRO A2016 -5.915 0.148 7.434 1.00 0.00 N ATOM 1266 CA PRO A2016 -6.258 1.416 6.804 1.00 0.00 C ATOM 1267 C PRO A2016 -5.053 2.333 6.566 1.00 0.00 C ATOM 1268 O PRO A2016 -5.263 3.443 6.092 1.00 0.00 O ATOM 1269 CB PRO A2016 -7.210 2.055 7.805 1.00 0.00 C ATOM 1270 CG PRO A2016 -6.748 1.544 9.164 1.00 0.00 C ATOM 1271 CD PRO A2016 -6.303 0.129 8.839 1.00 0.00 C ATOM 0 HA PRO A2016 -6.679 1.259 5.811 1.00 0.00 H new ATOM 0 HB2 PRO A2016 -7.164 3.143 7.755 1.00 0.00 H new ATOM 0 HB3 PRO A2016 -8.243 1.770 7.606 1.00 0.00 H new ATOM 0 HG2 PRO A2016 -5.933 2.144 9.569 1.00 0.00 H new ATOM 0 HG3 PRO A2016 -7.552 1.559 9.900 1.00 0.00 H new ATOM 0 HD2 PRO A2016 -5.468 -0.173 9.471 1.00 0.00 H new ATOM 0 HD3 PRO A2016 -7.109 -0.584 9.013 1.00 0.00 H new ATOM 1279 N THR A2017 -3.829 1.940 6.920 1.00 0.00 N ATOM 1280 CA THR A2017 -2.640 2.767 6.713 1.00 0.00 C ATOM 1281 C THR A2017 -1.632 2.030 5.840 1.00 0.00 C ATOM 1282 O THR A2017 -1.634 0.797 5.753 1.00 0.00 O ATOM 1283 CB THR A2017 -1.994 3.223 8.040 1.00 0.00 C ATOM 1284 OG1 THR A2017 -1.319 2.150 8.653 1.00 0.00 O ATOM 1285 CG2 THR A2017 -3.001 3.789 9.049 1.00 0.00 C ATOM 0 H THR A2017 -3.634 1.040 7.358 1.00 0.00 H new ATOM 0 HA THR A2017 -2.961 3.673 6.199 1.00 0.00 H new ATOM 0 HB THR A2017 -1.303 4.021 7.768 1.00 0.00 H new ATOM 0 HG1 THR A2017 -0.914 2.455 9.492 1.00 0.00 H new ATOM 0 HG21 THR A2017 -2.477 4.089 9.957 1.00 0.00 H new ATOM 0 HG22 THR A2017 -3.502 4.655 8.616 1.00 0.00 H new ATOM 0 HG23 THR A2017 -3.740 3.026 9.292 1.00 0.00 H new ATOM 1293 N LEU A2018 -0.727 2.776 5.205 1.00 0.00 N ATOM 1294 CA LEU A2018 0.305 2.219 4.349 1.00 0.00 C ATOM 1295 C LEU A2018 1.219 1.338 5.168 1.00 0.00 C ATOM 1296 O LEU A2018 1.654 0.329 4.637 1.00 0.00 O ATOM 1297 CB LEU A2018 1.192 3.299 3.710 1.00 0.00 C ATOM 1298 CG LEU A2018 0.504 4.327 2.801 1.00 0.00 C ATOM 1299 CD1 LEU A2018 1.537 5.372 2.384 1.00 0.00 C ATOM 1300 CD2 LEU A2018 -0.042 3.683 1.529 1.00 0.00 C ATOM 0 H LEU A2018 -0.695 3.793 5.275 1.00 0.00 H new ATOM 0 HA LEU A2018 -0.212 1.667 3.564 1.00 0.00 H new ATOM 0 HB2 LEU A2018 1.695 3.840 4.511 1.00 0.00 H new ATOM 0 HB3 LEU A2018 1.966 2.799 3.128 1.00 0.00 H new ATOM 0 HG LEU A2018 -0.324 4.767 3.356 1.00 0.00 H new ATOM 0 HD11 LEU A2018 1.066 6.112 1.737 1.00 0.00 H new ATOM 0 HD12 LEU A2018 1.933 5.866 3.271 1.00 0.00 H new ATOM 0 HD13 LEU A2018 2.350 4.885 1.846 1.00 0.00 H new ATOM 0 HD21 LEU A2018 -0.521 4.444 0.913 1.00 0.00 H new ATOM 0 HD22 LEU A2018 0.776 3.227 0.972 1.00 0.00 H new ATOM 0 HD23 LEU A2018 -0.772 2.917 1.793 1.00 0.00 H new ATOM 1312 N LEU A2019 1.554 1.688 6.415 1.00 0.00 N ATOM 1313 CA LEU A2019 2.454 0.884 7.243 1.00 0.00 C ATOM 1314 C LEU A2019 1.848 -0.477 7.557 1.00 0.00 C ATOM 1315 O LEU A2019 2.565 -1.474 7.624 1.00 0.00 O ATOM 1316 CB LEU A2019 2.829 1.653 8.516 1.00 0.00 C ATOM 1317 CG LEU A2019 3.734 2.853 8.236 1.00 0.00 C ATOM 1318 CD1 LEU A2019 3.930 3.668 9.518 1.00 0.00 C ATOM 1319 CD2 LEU A2019 5.105 2.515 7.635 1.00 0.00 C ATOM 0 H LEU A2019 1.210 2.531 6.874 1.00 0.00 H new ATOM 0 HA LEU A2019 3.370 0.697 6.682 1.00 0.00 H new ATOM 0 HB2 LEU A2019 1.920 1.996 9.009 1.00 0.00 H new ATOM 0 HB3 LEU A2019 3.332 0.978 9.208 1.00 0.00 H new ATOM 0 HG LEU A2019 3.212 3.428 7.472 1.00 0.00 H new ATOM 0 HD11 LEU A2019 4.576 4.521 9.311 1.00 0.00 H new ATOM 0 HD12 LEU A2019 2.963 4.023 9.875 1.00 0.00 H new ATOM 0 HD13 LEU A2019 4.391 3.041 10.281 1.00 0.00 H new ATOM 0 HD21 LEU A2019 5.669 3.434 7.475 1.00 0.00 H new ATOM 0 HD22 LEU A2019 5.653 1.868 8.320 1.00 0.00 H new ATOM 0 HD23 LEU A2019 4.968 2.002 6.683 1.00 0.00 H new ATOM 1331 N GLU A2020 0.543 -0.531 7.784 1.00 0.00 N ATOM 1332 CA GLU A2020 -0.137 -1.789 8.062 1.00 0.00 C ATOM 1333 C GLU A2020 -0.291 -2.601 6.780 1.00 0.00 C ATOM 1334 O GLU A2020 0.067 -3.779 6.734 1.00 0.00 O ATOM 1335 CB GLU A2020 -1.478 -1.533 8.739 1.00 0.00 C ATOM 1336 CG GLU A2020 -1.247 -0.911 10.110 1.00 0.00 C ATOM 1337 CD GLU A2020 -2.366 -1.220 11.085 1.00 0.00 C ATOM 1338 OE1 GLU A2020 -3.458 -0.632 10.933 1.00 0.00 O ATOM 1339 OE2 GLU A2020 -2.120 -1.924 12.089 1.00 0.00 O ATOM 0 H GLU A2020 -0.068 0.285 7.781 1.00 0.00 H new ATOM 0 HA GLU A2020 0.468 -2.376 8.753 1.00 0.00 H new ATOM 0 HB2 GLU A2020 -2.086 -0.869 8.125 1.00 0.00 H new ATOM 0 HB3 GLU A2020 -2.030 -2.467 8.841 1.00 0.00 H new ATOM 0 HG2 GLU A2020 -0.304 -1.277 10.517 1.00 0.00 H new ATOM 0 HG3 GLU A2020 -1.151 0.169 10.003 1.00 0.00 H new ATOM 1346 N LEU A2021 -0.784 -1.953 5.721 1.00 0.00 N ATOM 1347 CA LEU A2021 -1.011 -2.590 4.433 1.00 0.00 C ATOM 1348 C LEU A2021 0.309 -3.131 3.881 1.00 0.00 C ATOM 1349 O LEU A2021 0.333 -4.216 3.307 1.00 0.00 O ATOM 1350 CB LEU A2021 -1.708 -1.592 3.485 1.00 0.00 C ATOM 1351 CG LEU A2021 -2.537 -2.262 2.372 1.00 0.00 C ATOM 1352 CD1 LEU A2021 -3.862 -2.801 2.921 1.00 0.00 C ATOM 1353 CD2 LEU A2021 -2.901 -1.261 1.270 1.00 0.00 C ATOM 0 H LEU A2021 -1.037 -0.965 5.740 1.00 0.00 H new ATOM 0 HA LEU A2021 -1.676 -3.447 4.538 1.00 0.00 H new ATOM 0 HB2 LEU A2021 -2.361 -0.945 4.071 1.00 0.00 H new ATOM 0 HB3 LEU A2021 -0.953 -0.953 3.027 1.00 0.00 H new ATOM 0 HG LEU A2021 -1.919 -3.068 1.976 1.00 0.00 H new ATOM 0 HD11 LEU A2021 -4.427 -3.268 2.114 1.00 0.00 H new ATOM 0 HD12 LEU A2021 -3.661 -3.539 3.698 1.00 0.00 H new ATOM 0 HD13 LEU A2021 -4.442 -1.980 3.342 1.00 0.00 H new ATOM 0 HD21 LEU A2021 -3.485 -1.764 0.500 1.00 0.00 H new ATOM 0 HD22 LEU A2021 -3.487 -0.447 1.697 1.00 0.00 H new ATOM 0 HD23 LEU A2021 -1.989 -0.858 0.828 1.00 0.00 H new ATOM 1365 N SER A2022 1.410 -2.399 4.072 1.00 0.00 N ATOM 1366 CA SER A2022 2.719 -2.817 3.603 1.00 0.00 C ATOM 1367 C SER A2022 3.294 -3.942 4.448 1.00 0.00 C ATOM 1368 O SER A2022 3.897 -4.845 3.880 1.00 0.00 O ATOM 1369 CB SER A2022 3.741 -1.677 3.602 1.00 0.00 C ATOM 1370 OG SER A2022 3.809 -0.990 4.822 1.00 0.00 O ATOM 0 H SER A2022 1.411 -1.502 4.557 1.00 0.00 H new ATOM 0 HA SER A2022 2.551 -3.157 2.581 1.00 0.00 H new ATOM 0 HB2 SER A2022 4.725 -2.081 3.366 1.00 0.00 H new ATOM 0 HB3 SER A2022 3.487 -0.972 2.810 1.00 0.00 H new ATOM 0 HG SER A2022 3.254 -0.184 4.775 1.00 0.00 H new ATOM 1376 N GLY A2023 3.103 -3.908 5.770 1.00 0.00 N ATOM 1377 CA GLY A2023 3.630 -4.895 6.696 1.00 0.00 C ATOM 1378 C GLY A2023 3.228 -6.305 6.329 1.00 0.00 C ATOM 1379 O GLY A2023 4.082 -7.191 6.261 1.00 0.00 O ATOM 0 H GLY A2023 2.564 -3.174 6.229 1.00 0.00 H new ATOM 0 HA2 GLY A2023 4.718 -4.824 6.717 1.00 0.00 H new ATOM 0 HA3 GLY A2023 3.276 -4.670 7.702 1.00 0.00 H new ATOM 1383 N TYR A2024 1.945 -6.497 6.032 1.00 0.00 N ATOM 1384 CA TYR A2024 1.448 -7.812 5.678 1.00 0.00 C ATOM 1385 C TYR A2024 2.121 -8.313 4.400 1.00 0.00 C ATOM 1386 O TYR A2024 2.651 -9.424 4.366 1.00 0.00 O ATOM 1387 CB TYR A2024 -0.081 -7.769 5.555 1.00 0.00 C ATOM 1388 CG TYR A2024 -0.696 -9.101 5.161 1.00 0.00 C ATOM 1389 CD1 TYR A2024 -0.303 -10.286 5.819 1.00 0.00 C ATOM 1390 CD2 TYR A2024 -1.630 -9.168 4.109 1.00 0.00 C ATOM 1391 CE1 TYR A2024 -0.789 -11.533 5.391 1.00 0.00 C ATOM 1392 CE2 TYR A2024 -2.140 -10.412 3.704 1.00 0.00 C ATOM 1393 CZ TYR A2024 -1.688 -11.601 4.305 1.00 0.00 C ATOM 1394 OH TYR A2024 -2.088 -12.799 3.804 1.00 0.00 O ATOM 0 H TYR A2024 1.239 -5.760 6.031 1.00 0.00 H new ATOM 0 HA TYR A2024 1.698 -8.523 6.465 1.00 0.00 H new ATOM 0 HB2 TYR A2024 -0.505 -7.450 6.507 1.00 0.00 H new ATOM 0 HB3 TYR A2024 -0.357 -7.018 4.815 1.00 0.00 H new ATOM 0 HD1 TYR A2024 0.376 -10.234 6.657 1.00 0.00 H new ATOM 0 HD2 TYR A2024 -1.953 -8.264 3.615 1.00 0.00 H new ATOM 0 HE1 TYR A2024 -0.475 -12.437 5.892 1.00 0.00 H new ATOM 0 HE2 TYR A2024 -2.886 -10.456 2.924 1.00 0.00 H new ATOM 0 HH TYR A2024 -2.708 -12.652 3.060 1.00 0.00 H new ATOM 1404 N ILE A2025 2.118 -7.485 3.354 1.00 0.00 N ATOM 1405 CA ILE A2025 2.706 -7.817 2.064 1.00 0.00 C ATOM 1406 C ILE A2025 4.224 -8.040 2.188 1.00 0.00 C ATOM 1407 O ILE A2025 4.745 -8.933 1.522 1.00 0.00 O ATOM 1408 CB ILE A2025 2.360 -6.721 1.033 1.00 0.00 C ATOM 1409 CG1 ILE A2025 0.854 -6.386 0.909 1.00 0.00 C ATOM 1410 CG2 ILE A2025 2.870 -7.129 -0.355 1.00 0.00 C ATOM 1411 CD1 ILE A2025 0.602 -5.093 0.113 1.00 0.00 C ATOM 0 H ILE A2025 1.701 -6.555 3.384 1.00 0.00 H new ATOM 0 HA ILE A2025 2.282 -8.757 1.710 1.00 0.00 H new ATOM 0 HB ILE A2025 2.852 -5.824 1.408 1.00 0.00 H new ATOM 0 HG12 ILE A2025 0.340 -7.215 0.422 1.00 0.00 H new ATOM 0 HG13 ILE A2025 0.424 -6.285 1.906 1.00 0.00 H new ATOM 0 HG21 ILE A2025 2.622 -6.351 -1.077 1.00 0.00 H new ATOM 0 HG22 ILE A2025 3.951 -7.261 -0.321 1.00 0.00 H new ATOM 0 HG23 ILE A2025 2.399 -8.065 -0.655 1.00 0.00 H new ATOM 0 HD11 ILE A2025 -0.470 -4.904 0.056 1.00 0.00 H new ATOM 0 HD12 ILE A2025 1.092 -4.257 0.612 1.00 0.00 H new ATOM 0 HD13 ILE A2025 1.006 -5.201 -0.894 1.00 0.00 H new ATOM 1423 N ALA A2026 4.930 -7.269 3.025 1.00 0.00 N ATOM 1424 CA ALA A2026 6.372 -7.372 3.240 1.00 0.00 C ATOM 1425 C ALA A2026 6.739 -8.818 3.549 1.00 0.00 C ATOM 1426 O ALA A2026 7.684 -9.327 2.960 1.00 0.00 O ATOM 1427 CB ALA A2026 6.798 -6.483 4.423 1.00 0.00 C ATOM 0 H ALA A2026 4.497 -6.536 3.586 1.00 0.00 H new ATOM 0 HA ALA A2026 6.886 -7.042 2.337 1.00 0.00 H new ATOM 0 HB1 ALA A2026 7.874 -6.568 4.573 1.00 0.00 H new ATOM 0 HB2 ALA A2026 6.543 -5.445 4.209 1.00 0.00 H new ATOM 0 HB3 ALA A2026 6.279 -6.805 5.326 1.00 0.00 H new ATOM 1433 N GLN A2027 5.986 -9.467 4.445 1.00 0.00 N ATOM 1434 CA GLN A2027 6.237 -10.845 4.842 1.00 0.00 C ATOM 1435 C GLN A2027 6.038 -11.816 3.684 1.00 0.00 C ATOM 1436 O GLN A2027 6.830 -12.738 3.510 1.00 0.00 O ATOM 1437 CB GLN A2027 5.347 -11.239 6.032 1.00 0.00 C ATOM 1438 CG GLN A2027 5.529 -10.345 7.264 1.00 0.00 C ATOM 1439 CD GLN A2027 7.004 -10.169 7.616 1.00 0.00 C ATOM 1440 OE1 GLN A2027 7.740 -11.138 7.798 1.00 0.00 O ATOM 1441 NE2 GLN A2027 7.492 -8.941 7.675 1.00 0.00 N ATOM 0 H GLN A2027 5.184 -9.044 4.913 1.00 0.00 H new ATOM 0 HA GLN A2027 7.281 -10.908 5.148 1.00 0.00 H new ATOM 0 HB2 GLN A2027 4.303 -11.204 5.720 1.00 0.00 H new ATOM 0 HB3 GLN A2027 5.562 -12.271 6.309 1.00 0.00 H new ATOM 0 HG2 GLN A2027 5.080 -9.370 7.076 1.00 0.00 H new ATOM 0 HG3 GLN A2027 5.001 -10.781 8.112 1.00 0.00 H new ATOM 0 HE21 GLN A2027 6.878 -8.141 7.523 1.00 0.00 H new ATOM 0 HE22 GLN A2027 8.482 -8.795 7.872 1.00 0.00 H new ATOM 1450 N ILE A2028 4.984 -11.622 2.889 1.00 0.00 N ATOM 1451 CA ILE A2028 4.696 -12.491 1.758 1.00 0.00 C ATOM 1452 C ILE A2028 5.850 -12.372 0.755 1.00 0.00 C ATOM 1453 O ILE A2028 6.429 -13.381 0.359 1.00 0.00 O ATOM 1454 CB ILE A2028 3.321 -12.164 1.132 1.00 0.00 C ATOM 1455 CG1 ILE A2028 2.176 -12.096 2.172 1.00 0.00 C ATOM 1456 CG2 ILE A2028 2.975 -13.244 0.093 1.00 0.00 C ATOM 1457 CD1 ILE A2028 0.899 -11.448 1.628 1.00 0.00 C ATOM 0 H ILE A2028 4.314 -10.863 3.013 1.00 0.00 H new ATOM 0 HA ILE A2028 4.625 -13.528 2.087 1.00 0.00 H new ATOM 0 HB ILE A2028 3.406 -11.177 0.677 1.00 0.00 H new ATOM 0 HG12 ILE A2028 1.945 -13.105 2.514 1.00 0.00 H new ATOM 0 HG13 ILE A2028 2.518 -11.535 3.042 1.00 0.00 H new ATOM 0 HG21 ILE A2028 2.006 -13.022 -0.354 1.00 0.00 H new ATOM 0 HG22 ILE A2028 3.739 -13.259 -0.685 1.00 0.00 H new ATOM 0 HG23 ILE A2028 2.935 -14.218 0.580 1.00 0.00 H new ATOM 0 HD11 ILE A2028 0.138 -11.433 2.408 1.00 0.00 H new ATOM 0 HD12 ILE A2028 1.115 -10.428 1.312 1.00 0.00 H new ATOM 0 HD13 ILE A2028 0.534 -12.022 0.776 1.00 0.00 H new ATOM 1469 N LEU A2029 6.228 -11.150 0.371 1.00 0.00 N ATOM 1470 CA LEU A2029 7.309 -10.903 -0.581 1.00 0.00 C ATOM 1471 C LEU A2029 8.637 -11.424 -0.044 1.00 0.00 C ATOM 1472 O LEU A2029 9.388 -12.074 -0.773 1.00 0.00 O ATOM 1473 CB LEU A2029 7.402 -9.404 -0.896 1.00 0.00 C ATOM 1474 CG LEU A2029 6.258 -8.915 -1.806 1.00 0.00 C ATOM 1475 CD1 LEU A2029 6.099 -7.397 -1.745 1.00 0.00 C ATOM 1476 CD2 LEU A2029 6.494 -9.316 -3.268 1.00 0.00 C ATOM 0 H LEU A2029 5.787 -10.298 0.717 1.00 0.00 H new ATOM 0 HA LEU A2029 7.087 -11.441 -1.503 1.00 0.00 H new ATOM 0 HB2 LEU A2029 7.386 -8.839 0.036 1.00 0.00 H new ATOM 0 HB3 LEU A2029 8.358 -9.197 -1.378 1.00 0.00 H new ATOM 0 HG LEU A2029 5.350 -9.391 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A2029 5.283 -7.090 -2.399 1.00 0.00 H new ATOM 0 HD12 LEU A2029 5.876 -7.095 -0.722 1.00 0.00 H new ATOM 0 HD13 LEU A2029 7.024 -6.921 -2.071 1.00 0.00 H new ATOM 0 HD21 LEU A2029 5.669 -8.955 -3.882 1.00 0.00 H new ATOM 0 HD22 LEU A2029 7.427 -8.876 -3.620 1.00 0.00 H new ATOM 0 HD23 LEU A2029 6.554 -10.402 -3.342 1.00 0.00 H new ATOM 1488 N SER A2030 8.935 -11.167 1.230 1.00 0.00 N ATOM 1489 CA SER A2030 10.171 -11.633 1.843 1.00 0.00 C ATOM 1490 C SER A2030 10.207 -13.169 1.915 1.00 0.00 C ATOM 1491 O SER A2030 11.295 -13.751 1.975 1.00 0.00 O ATOM 1492 CB SER A2030 10.384 -10.938 3.199 1.00 0.00 C ATOM 1493 OG SER A2030 9.535 -11.384 4.244 1.00 0.00 O ATOM 0 H SER A2030 8.331 -10.635 1.857 1.00 0.00 H new ATOM 0 HA SER A2030 11.018 -11.353 1.217 1.00 0.00 H new ATOM 0 HB2 SER A2030 11.420 -11.084 3.506 1.00 0.00 H new ATOM 0 HB3 SER A2030 10.239 -9.866 3.067 1.00 0.00 H new ATOM 0 HG SER A2030 8.742 -11.813 3.860 1.00 0.00 H new