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= -0.0238 X(o=1.2,f=1) USER MOD Set 1.2: A2002 THR OG1 : rot 77:sc= 1.24 USER MOD Set 2.1: A1953 ASN : amide:sc= -1.3! C(o=-1.2!,f=-7.6!) USER MOD Set 2.2: A1955 SER OG : rot 180:sc= 0.147 USER MOD Single : A1958 LYS NZ :NH3+ -135:sc= 0.527 (180deg=-1.16!) USER MOD Single : A1959 GLN : amide:sc= -0.136 K(o=-0.14,f=-1.3!) 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 160:sc= 1.34 USER MOD Single : A1974 SER OG : rot 180:sc= 0 USER MOD Single : A1980 GLN : amide:sc= -0.545 X(o=-0.54,f=-0.082) USER MOD Single : A1981 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1989 SER OG : rot 180:sc= 0 USER MOD Single : A1996 THR OG1 : rot 120:sc= 0.0206 USER MOD Single : A1997 THR OG1 : rot 180:sc= 0 USER MOD Single : A1998 THR OG1 : rot 180:sc= 0.00338 USER MOD Single : A2000 ASN : amide:sc= 0.371 K(o=0.37,f=-6.8!) USER MOD Single : A2001 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2003 TYR OH : rot 180:sc= -0.308 USER MOD Single : A2004 ASN : amide:sc= -0.257 K(o=-0.26,f=-1.9!) USER MOD Single : A2006 ASN : amide:sc= -0.0441 X(o=-0.044,f=-0.49) 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+ -159:sc= 1.12 (180deg=0.622) USER MOD Single : A2013 TYR OH : rot 180:sc= 0 USER MOD Single : A2015 TYR OH : rot 180:sc= 0 USER MOD Single : A2017 THR OG1 : rot -179:sc= -0.483 USER MOD Single : A2022 SER OG : rot -76:sc= 1.13 USER MOD Single : A2024 TYR OH : rot 180:sc= 0 USER MOD Single : A2027 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A2030 SER OG : rot -70:sc= 1 USER MOD ----------------------------------------------------------------- ATOM 252 N ASN A1953 11.560 -4.427 1.116 1.00 0.00 N ATOM 253 CA ASN A1953 11.505 -3.727 2.386 1.00 0.00 C ATOM 254 C ASN A1953 10.163 -3.033 2.518 1.00 0.00 C ATOM 255 O ASN A1953 9.552 -2.640 1.538 1.00 0.00 O ATOM 256 CB ASN A1953 12.628 -2.676 2.413 1.00 0.00 C ATOM 257 CG ASN A1953 12.256 -1.262 2.789 1.00 0.00 C ATOM 258 OD1 ASN A1953 12.089 -0.418 1.924 1.00 0.00 O ATOM 259 ND2 ASN A1953 12.178 -0.925 4.054 1.00 0.00 N ATOM 0 HA ASN A1953 11.630 -4.430 3.209 1.00 0.00 H new ATOM 0 HB2 ASN A1953 13.392 -3.019 3.111 1.00 0.00 H new ATOM 0 HB3 ASN A1953 13.088 -2.651 1.425 1.00 0.00 H new ATOM 0 HD21 ASN A1953 11.978 0.041 4.313 1.00 0.00 H new ATOM 0 HD22 ASN A1953 12.317 -1.629 4.779 1.00 0.00 H new ATOM 266 N LEU A1954 9.767 -2.781 3.753 1.00 0.00 N ATOM 267 CA LEU A1954 8.542 -2.105 4.135 1.00 0.00 C ATOM 268 C LEU A1954 8.319 -0.806 3.374 1.00 0.00 C ATOM 269 O LEU A1954 7.253 -0.579 2.806 1.00 0.00 O ATOM 270 CB LEU A1954 8.681 -1.778 5.631 1.00 0.00 C ATOM 271 CG LEU A1954 7.650 -2.513 6.501 1.00 0.00 C ATOM 272 CD1 LEU A1954 6.231 -2.154 6.043 1.00 0.00 C ATOM 273 CD2 LEU A1954 7.900 -4.015 6.525 1.00 0.00 C ATOM 0 H LEU A1954 10.324 -3.059 4.561 1.00 0.00 H new ATOM 0 HA LEU A1954 7.693 -2.751 3.910 1.00 0.00 H new ATOM 0 HB2 LEU A1954 9.685 -2.042 5.964 1.00 0.00 H new ATOM 0 HB3 LEU A1954 8.570 -0.703 5.775 1.00 0.00 H new ATOM 0 HG LEU A1954 7.759 -2.180 7.533 1.00 0.00 H new ATOM 0 HD11 LEU A1954 5.505 -2.678 6.664 1.00 0.00 H new ATOM 0 HD12 LEU A1954 6.079 -1.079 6.137 1.00 0.00 H new ATOM 0 HD13 LEU A1954 6.099 -2.449 5.002 1.00 0.00 H new ATOM 0 HD21 LEU A1954 7.150 -4.499 7.151 1.00 0.00 H new ATOM 0 HD22 LEU A1954 7.837 -4.411 5.511 1.00 0.00 H new ATOM 0 HD23 LEU A1954 8.893 -4.212 6.930 1.00 0.00 H new ATOM 285 N SER A1955 9.329 0.062 3.400 1.00 0.00 N ATOM 286 CA SER A1955 9.302 1.355 2.749 1.00 0.00 C ATOM 287 C SER A1955 9.070 1.211 1.252 1.00 0.00 C ATOM 288 O SER A1955 8.366 2.060 0.711 1.00 0.00 O ATOM 289 CB SER A1955 10.573 2.154 3.051 1.00 0.00 C ATOM 290 OG SER A1955 10.949 1.981 4.407 1.00 0.00 O ATOM 0 H SER A1955 10.205 -0.126 3.887 1.00 0.00 H new ATOM 0 HA SER A1955 8.462 1.917 3.156 1.00 0.00 H new ATOM 0 HB2 SER A1955 11.381 1.826 2.397 1.00 0.00 H new ATOM 0 HB3 SER A1955 10.405 3.211 2.845 1.00 0.00 H new ATOM 0 HG SER A1955 11.764 2.495 4.589 1.00 0.00 H new ATOM 296 N GLU A1956 9.595 0.156 0.612 1.00 0.00 N ATOM 297 CA GLU A1956 9.401 -0.039 -0.817 1.00 0.00 C ATOM 298 C GLU A1956 7.910 -0.135 -1.141 1.00 0.00 C ATOM 299 O GLU A1956 7.387 0.629 -1.941 1.00 0.00 O ATOM 300 CB GLU A1956 10.053 -1.349 -1.283 1.00 0.00 C ATOM 301 CG GLU A1956 11.581 -1.356 -1.201 1.00 0.00 C ATOM 302 CD GLU A1956 12.178 -1.906 -2.492 1.00 0.00 C ATOM 303 OE1 GLU A1956 12.165 -1.183 -3.515 1.00 0.00 O ATOM 304 OE2 GLU A1956 12.600 -3.082 -2.500 1.00 0.00 O ATOM 0 H GLU A1956 10.153 -0.567 1.066 1.00 0.00 H new ATOM 0 HA GLU A1956 9.855 0.812 -1.325 1.00 0.00 H new ATOM 0 HB2 GLU A1956 9.665 -2.169 -0.679 1.00 0.00 H new ATOM 0 HB3 GLU A1956 9.755 -1.543 -2.313 1.00 0.00 H new ATOM 0 HG2 GLU A1956 11.947 -0.345 -1.025 1.00 0.00 H new ATOM 0 HG3 GLU A1956 11.904 -1.963 -0.355 1.00 0.00 H new ATOM 311 N ILE A1957 7.184 -1.024 -0.463 1.00 0.00 N ATOM 312 CA ILE A1957 5.766 -1.228 -0.693 1.00 0.00 C ATOM 313 C ILE A1957 5.014 -0.006 -0.201 1.00 0.00 C ATOM 314 O ILE A1957 4.140 0.458 -0.911 1.00 0.00 O ATOM 315 CB ILE A1957 5.269 -2.511 -0.009 1.00 0.00 C ATOM 316 CG1 ILE A1957 6.209 -3.714 -0.224 1.00 0.00 C ATOM 317 CG2 ILE A1957 3.857 -2.922 -0.420 1.00 0.00 C ATOM 318 CD1 ILE A1957 6.826 -4.057 1.124 1.00 0.00 C ATOM 0 H ILE A1957 7.572 -1.624 0.265 1.00 0.00 H new ATOM 0 HA ILE A1957 5.584 -1.356 -1.760 1.00 0.00 H new ATOM 0 HB ILE A1957 5.259 -2.245 1.048 1.00 0.00 H new ATOM 0 HG12 ILE A1957 5.657 -4.566 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE A1957 6.985 -3.470 -0.950 1.00 0.00 H new ATOM 0 HG21 ILE A1957 3.577 -3.836 0.104 1.00 0.00 H new ATOM 0 HG22 ILE A1957 3.157 -2.127 -0.163 1.00 0.00 H new ATOM 0 HG23 ILE A1957 3.828 -3.097 -1.495 1.00 0.00 H new ATOM 0 HD11 ILE A1957 7.499 -4.907 1.010 1.00 0.00 H new ATOM 0 HD12 ILE A1957 7.385 -3.199 1.497 1.00 0.00 H new ATOM 0 HD13 ILE A1957 6.037 -4.312 1.831 1.00 0.00 H new ATOM 330 N LYS A1958 5.320 0.548 0.978 1.00 0.00 N ATOM 331 CA LYS A1958 4.606 1.717 1.466 1.00 0.00 C ATOM 332 C LYS A1958 4.676 2.868 0.466 1.00 0.00 C ATOM 333 O LYS A1958 3.643 3.445 0.131 1.00 0.00 O ATOM 334 CB LYS A1958 5.173 2.105 2.836 1.00 0.00 C ATOM 335 CG LYS A1958 4.825 3.540 3.270 1.00 0.00 C ATOM 336 CD LYS A1958 6.066 4.439 3.238 1.00 0.00 C ATOM 337 CE LYS A1958 6.927 4.114 4.459 1.00 0.00 C ATOM 338 NZ LYS A1958 7.881 5.184 4.805 1.00 0.00 N ATOM 0 H LYS A1958 6.051 0.205 1.601 1.00 0.00 H new ATOM 0 HA LYS A1958 3.548 1.480 1.579 1.00 0.00 H new ATOM 0 HB2 LYS A1958 4.797 1.408 3.585 1.00 0.00 H new ATOM 0 HB3 LYS A1958 6.257 1.995 2.814 1.00 0.00 H new ATOM 0 HG2 LYS A1958 4.059 3.948 2.610 1.00 0.00 H new ATOM 0 HG3 LYS A1958 4.406 3.528 4.276 1.00 0.00 H new ATOM 0 HD2 LYS A1958 6.631 4.274 2.320 1.00 0.00 H new ATOM 0 HD3 LYS A1958 5.774 5.489 3.248 1.00 0.00 H new ATOM 0 HE2 LYS A1958 6.277 3.927 5.313 1.00 0.00 H new ATOM 0 HE3 LYS A1958 7.478 3.193 4.271 1.00 0.00 H new ATOM 0 HZ1 LYS A1958 8.812 4.767 5.007 1.00 0.00 H new ATOM 0 HZ2 LYS A1958 7.964 5.847 4.008 1.00 0.00 H new ATOM 0 HZ3 LYS A1958 7.541 5.694 5.645 1.00 0.00 H new ATOM 352 N GLN A1959 5.876 3.242 0.029 1.00 0.00 N ATOM 353 CA GLN A1959 6.004 4.358 -0.903 1.00 0.00 C ATOM 354 C GLN A1959 5.338 4.065 -2.254 1.00 0.00 C ATOM 355 O GLN A1959 4.811 4.983 -2.883 1.00 0.00 O ATOM 356 CB GLN A1959 7.442 4.872 -1.004 1.00 0.00 C ATOM 357 CG GLN A1959 8.432 3.996 -1.782 1.00 0.00 C ATOM 358 CD GLN A1959 8.807 4.518 -3.171 1.00 0.00 C ATOM 359 OE1 GLN A1959 8.797 3.772 -4.142 1.00 0.00 O ATOM 360 NE2 GLN A1959 9.191 5.776 -3.313 1.00 0.00 N ATOM 0 H GLN A1959 6.755 2.800 0.298 1.00 0.00 H new ATOM 0 HA GLN A1959 5.441 5.194 -0.488 1.00 0.00 H new ATOM 0 HB2 GLN A1959 7.420 5.857 -1.470 1.00 0.00 H new ATOM 0 HB3 GLN A1959 7.827 5.006 0.007 1.00 0.00 H new ATOM 0 HG2 GLN A1959 9.343 3.892 -1.192 1.00 0.00 H new ATOM 0 HG3 GLN A1959 8.005 2.999 -1.889 1.00 0.00 H new ATOM 0 HE21 GLN A1959 9.201 6.400 -2.507 1.00 0.00 H new ATOM 0 HE22 GLN A1959 9.477 6.122 -4.229 1.00 0.00 H new ATOM 369 N VAL A1960 5.331 2.803 -2.681 1.00 0.00 N ATOM 370 CA VAL A1960 4.711 2.379 -3.931 1.00 0.00 C ATOM 371 C VAL A1960 3.190 2.494 -3.744 1.00 0.00 C ATOM 372 O VAL A1960 2.507 3.129 -4.543 1.00 0.00 O ATOM 373 CB VAL A1960 5.224 0.964 -4.274 1.00 0.00 C ATOM 374 CG1 VAL A1960 4.302 0.157 -5.183 1.00 0.00 C ATOM 375 CG2 VAL A1960 6.617 1.054 -4.919 1.00 0.00 C ATOM 0 H VAL A1960 5.762 2.039 -2.161 1.00 0.00 H new ATOM 0 HA VAL A1960 4.974 3.002 -4.786 1.00 0.00 H new ATOM 0 HB VAL A1960 5.261 0.430 -3.325 1.00 0.00 H new ATOM 0 HG11 VAL A1960 4.742 -0.822 -5.371 1.00 0.00 H new ATOM 0 HG12 VAL A1960 3.333 0.033 -4.700 1.00 0.00 H new ATOM 0 HG13 VAL A1960 4.172 0.683 -6.129 1.00 0.00 H new ATOM 0 HG21 VAL A1960 6.973 0.052 -5.158 1.00 0.00 H new ATOM 0 HG22 VAL A1960 6.557 1.646 -5.833 1.00 0.00 H new ATOM 0 HG23 VAL A1960 7.310 1.528 -4.224 1.00 0.00 H new ATOM 385 N LEU A1961 2.647 1.939 -2.655 1.00 0.00 N ATOM 386 CA LEU A1961 1.232 1.987 -2.324 1.00 0.00 C ATOM 387 C LEU A1961 0.785 3.446 -2.267 1.00 0.00 C ATOM 388 O LEU A1961 -0.351 3.720 -2.616 1.00 0.00 O ATOM 389 CB LEU A1961 0.954 1.323 -0.972 1.00 0.00 C ATOM 390 CG LEU A1961 1.006 -0.207 -0.941 1.00 0.00 C ATOM 391 CD1 LEU A1961 0.887 -0.633 0.524 1.00 0.00 C ATOM 392 CD2 LEU A1961 -0.075 -0.860 -1.802 1.00 0.00 C ATOM 0 H LEU A1961 3.201 1.432 -1.965 1.00 0.00 H new ATOM 0 HA LEU A1961 0.679 1.445 -3.091 1.00 0.00 H new ATOM 0 HB2 LEU A1961 1.676 1.704 -0.250 1.00 0.00 H new ATOM 0 HB3 LEU A1961 -0.033 1.638 -0.633 1.00 0.00 H new ATOM 0 HG LEU A1961 1.949 -0.545 -1.371 1.00 0.00 H new ATOM 0 HD11 LEU A1961 0.920 -1.720 0.591 1.00 0.00 H new ATOM 0 HD12 LEU A1961 1.714 -0.209 1.094 1.00 0.00 H new ATOM 0 HD13 LEU A1961 -0.057 -0.273 0.932 1.00 0.00 H new ATOM 0 HD21 LEU A1961 0.015 -1.944 -1.738 1.00 0.00 H new ATOM 0 HD22 LEU A1961 -1.058 -0.556 -1.444 1.00 0.00 H new ATOM 0 HD23 LEU A1961 0.047 -0.546 -2.839 1.00 0.00 H new ATOM 404 N LYS A1962 1.632 4.393 -1.839 1.00 0.00 N ATOM 405 CA LYS A1962 1.245 5.798 -1.795 1.00 0.00 C ATOM 406 C LYS A1962 0.885 6.256 -3.204 1.00 0.00 C ATOM 407 O LYS A1962 -0.219 6.761 -3.394 1.00 0.00 O ATOM 408 CB LYS A1962 2.350 6.680 -1.191 1.00 0.00 C ATOM 409 CG LYS A1962 2.109 8.148 -1.551 1.00 0.00 C ATOM 410 CD LYS A1962 2.488 9.161 -0.479 1.00 0.00 C ATOM 411 CE LYS A1962 3.939 9.631 -0.456 1.00 0.00 C ATOM 412 NZ LYS A1962 4.768 8.850 0.476 1.00 0.00 N ATOM 0 H LYS A1962 2.583 4.207 -1.521 1.00 0.00 H new ATOM 0 HA LYS A1962 0.377 5.902 -1.144 1.00 0.00 H new ATOM 0 HB2 LYS A1962 2.368 6.562 -0.108 1.00 0.00 H new ATOM 0 HB3 LYS A1962 3.324 6.362 -1.563 1.00 0.00 H new ATOM 0 HG2 LYS A1962 2.670 8.378 -2.457 1.00 0.00 H new ATOM 0 HG3 LYS A1962 1.053 8.276 -1.789 1.00 0.00 H new ATOM 0 HD2 LYS A1962 1.850 10.036 -0.599 1.00 0.00 H new ATOM 0 HD3 LYS A1962 2.256 8.728 0.494 1.00 0.00 H new ATOM 0 HE2 LYS A1962 4.358 9.557 -1.460 1.00 0.00 H new ATOM 0 HE3 LYS A1962 3.973 10.683 -0.173 1.00 0.00 H new ATOM 0 HZ1 LYS A1962 5.744 9.208 0.455 1.00 0.00 H new ATOM 0 HZ2 LYS A1962 4.386 8.940 1.439 1.00 0.00 H new ATOM 0 HZ3 LYS A1962 4.760 7.849 0.193 1.00 0.00 H new ATOM 426 N GLN A1963 1.797 6.094 -4.163 1.00 0.00 N ATOM 427 CA GLN A1963 1.544 6.515 -5.536 1.00 0.00 C ATOM 428 C GLN A1963 0.249 5.923 -6.067 1.00 0.00 C ATOM 429 O GLN A1963 -0.526 6.636 -6.703 1.00 0.00 O ATOM 430 CB GLN A1963 2.739 6.244 -6.492 1.00 0.00 C ATOM 431 CG GLN A1963 2.750 4.950 -7.327 1.00 0.00 C ATOM 432 CD GLN A1963 3.864 4.952 -8.368 1.00 0.00 C ATOM 433 OE1 GLN A1963 4.964 4.462 -8.103 1.00 0.00 O ATOM 434 NE2 GLN A1963 3.624 5.484 -9.552 1.00 0.00 N ATOM 0 H GLN A1963 2.715 5.675 -4.012 1.00 0.00 H new ATOM 0 HA GLN A1963 1.429 7.599 -5.507 1.00 0.00 H new ATOM 0 HB2 GLN A1963 2.803 7.083 -7.185 1.00 0.00 H new ATOM 0 HB3 GLN A1963 3.649 6.256 -5.892 1.00 0.00 H new ATOM 0 HG2 GLN A1963 2.873 4.093 -6.665 1.00 0.00 H new ATOM 0 HG3 GLN A1963 1.788 4.832 -7.826 1.00 0.00 H new ATOM 0 HE21 GLN A1963 2.708 5.885 -9.755 1.00 0.00 H new ATOM 0 HE22 GLN A1963 4.354 5.494 -10.264 1.00 0.00 H new ATOM 443 N GLN A1964 0.043 4.641 -5.777 1.00 0.00 N ATOM 444 CA GLN A1964 -1.112 3.872 -6.208 1.00 0.00 C ATOM 445 C GLN A1964 -2.391 4.317 -5.494 1.00 0.00 C ATOM 446 O GLN A1964 -3.479 4.183 -6.047 1.00 0.00 O ATOM 447 CB GLN A1964 -0.849 2.381 -5.972 1.00 0.00 C ATOM 448 CG GLN A1964 0.384 1.836 -6.717 1.00 0.00 C ATOM 449 CD GLN A1964 0.019 0.890 -7.858 1.00 0.00 C ATOM 450 OE1 GLN A1964 -0.599 1.263 -8.840 1.00 0.00 O ATOM 451 NE2 GLN A1964 0.370 -0.379 -7.751 1.00 0.00 N ATOM 0 H GLN A1964 0.698 4.095 -5.218 1.00 0.00 H new ATOM 0 HA GLN A1964 -1.264 4.050 -7.273 1.00 0.00 H new ATOM 0 HB2 GLN A1964 -0.720 2.210 -4.903 1.00 0.00 H new ATOM 0 HB3 GLN A1964 -1.727 1.814 -6.281 1.00 0.00 H new ATOM 0 HG2 GLN A1964 0.960 2.671 -7.115 1.00 0.00 H new ATOM 0 HG3 GLN A1964 1.028 1.313 -6.010 1.00 0.00 H new ATOM 0 HE21 GLN A1964 0.887 -0.698 -6.932 1.00 0.00 H new ATOM 0 HE22 GLN A1964 0.124 -1.040 -8.488 1.00 0.00 H new ATOM 460 N LEU A1965 -2.297 4.803 -4.261 1.00 0.00 N ATOM 461 CA LEU A1965 -3.439 5.255 -3.486 1.00 0.00 C ATOM 462 C LEU A1965 -3.850 6.625 -3.988 1.00 0.00 C ATOM 463 O LEU A1965 -5.019 6.828 -4.286 1.00 0.00 O ATOM 464 CB LEU A1965 -3.096 5.270 -1.980 1.00 0.00 C ATOM 465 CG LEU A1965 -4.259 5.511 -0.994 1.00 0.00 C ATOM 466 CD1 LEU A1965 -4.632 6.971 -0.766 1.00 0.00 C ATOM 467 CD2 LEU A1965 -5.488 4.668 -1.323 1.00 0.00 C ATOM 0 H LEU A1965 -1.409 4.894 -3.767 1.00 0.00 H new ATOM 0 HA LEU A1965 -4.278 4.570 -3.611 1.00 0.00 H new ATOM 0 HB2 LEU A1965 -2.633 4.316 -1.729 1.00 0.00 H new ATOM 0 HB3 LEU A1965 -2.345 6.042 -1.812 1.00 0.00 H new ATOM 0 HG LEU A1965 -3.857 5.173 -0.039 1.00 0.00 H new ATOM 0 HD11 LEU A1965 -5.459 7.029 -0.058 1.00 0.00 H new ATOM 0 HD12 LEU A1965 -3.772 7.508 -0.365 1.00 0.00 H new ATOM 0 HD13 LEU A1965 -4.932 7.422 -1.712 1.00 0.00 H new ATOM 0 HD21 LEU A1965 -6.276 4.876 -0.599 1.00 0.00 H new ATOM 0 HD22 LEU A1965 -5.841 4.914 -2.324 1.00 0.00 H new ATOM 0 HD23 LEU A1965 -5.226 3.611 -1.281 1.00 0.00 H new ATOM 479 N ALA A1966 -2.892 7.551 -4.125 1.00 0.00 N ATOM 480 CA ALA A1966 -3.202 8.891 -4.578 1.00 0.00 C ATOM 481 C ALA A1966 -3.850 8.857 -5.961 1.00 0.00 C ATOM 482 O ALA A1966 -4.844 9.539 -6.175 1.00 0.00 O ATOM 483 CB ALA A1966 -1.955 9.792 -4.575 1.00 0.00 C ATOM 0 H ALA A1966 -1.905 7.387 -3.927 1.00 0.00 H new ATOM 0 HA ALA A1966 -3.916 9.321 -3.876 1.00 0.00 H new ATOM 0 HB1 ALA A1966 -2.226 10.790 -4.921 1.00 0.00 H new ATOM 0 HB2 ALA A1966 -1.554 9.855 -3.563 1.00 0.00 H new ATOM 0 HB3 ALA A1966 -1.200 9.371 -5.239 1.00 0.00 H new ATOM 489 N GLU A1967 -3.335 8.044 -6.891 1.00 0.00 N ATOM 490 CA GLU A1967 -3.918 7.977 -8.234 1.00 0.00 C ATOM 491 C GLU A1967 -5.349 7.431 -8.198 1.00 0.00 C ATOM 492 O GLU A1967 -6.206 7.896 -8.944 1.00 0.00 O ATOM 493 CB GLU A1967 -3.045 7.151 -9.208 1.00 0.00 C ATOM 494 CG GLU A1967 -2.973 5.661 -8.839 1.00 0.00 C ATOM 495 CD GLU A1967 -2.141 4.771 -9.762 1.00 0.00 C ATOM 496 OE1 GLU A1967 -1.013 5.159 -10.162 1.00 0.00 O ATOM 497 OE2 GLU A1967 -2.610 3.645 -10.056 1.00 0.00 O ATOM 0 H GLU A1967 -2.531 7.434 -6.742 1.00 0.00 H new ATOM 0 HA GLU A1967 -3.952 9.000 -8.610 1.00 0.00 H new ATOM 0 HB2 GLU A1967 -3.444 7.250 -10.217 1.00 0.00 H new ATOM 0 HB3 GLU A1967 -2.037 7.565 -9.222 1.00 0.00 H new ATOM 0 HG2 GLU A1967 -2.569 5.578 -7.830 1.00 0.00 H new ATOM 0 HG3 GLU A1967 -3.989 5.267 -8.809 1.00 0.00 H new ATOM 504 N ALA A1968 -5.618 6.455 -7.326 1.00 0.00 N ATOM 505 CA ALA A1968 -6.932 5.835 -7.201 1.00 0.00 C ATOM 506 C ALA A1968 -7.939 6.772 -6.538 1.00 0.00 C ATOM 507 O ALA A1968 -9.148 6.629 -6.744 1.00 0.00 O ATOM 508 CB ALA A1968 -6.797 4.534 -6.412 1.00 0.00 C ATOM 0 H ALA A1968 -4.923 6.073 -6.685 1.00 0.00 H new ATOM 0 HA ALA A1968 -7.313 5.619 -8.199 1.00 0.00 H new ATOM 0 HB1 ALA A1968 -7.776 4.064 -6.314 1.00 0.00 H new ATOM 0 HB2 ALA A1968 -6.121 3.859 -6.937 1.00 0.00 H new ATOM 0 HB3 ALA A1968 -6.397 4.749 -5.421 1.00 0.00 H new ATOM 514 N LEU A1969 -7.449 7.706 -5.723 1.00 0.00 N ATOM 515 CA LEU A1969 -8.261 8.691 -5.030 1.00 0.00 C ATOM 516 C LEU A1969 -8.257 10.024 -5.811 1.00 0.00 C ATOM 517 O LEU A1969 -8.880 10.985 -5.368 1.00 0.00 O ATOM 518 CB LEU A1969 -7.744 8.899 -3.594 1.00 0.00 C ATOM 519 CG LEU A1969 -7.842 7.672 -2.658 1.00 0.00 C ATOM 520 CD1 LEU A1969 -7.808 8.145 -1.214 1.00 0.00 C ATOM 521 CD2 LEU A1969 -9.116 6.852 -2.846 1.00 0.00 C ATOM 0 H LEU A1969 -6.452 7.796 -5.526 1.00 0.00 H new ATOM 0 HA LEU A1969 -9.286 8.326 -4.972 1.00 0.00 H new ATOM 0 HB2 LEU A1969 -6.701 9.210 -3.645 1.00 0.00 H new ATOM 0 HB3 LEU A1969 -8.300 9.721 -3.143 1.00 0.00 H new ATOM 0 HG LEU A1969 -6.997 7.031 -2.908 1.00 0.00 H new ATOM 0 HD11 LEU A1969 -7.877 7.285 -0.548 1.00 0.00 H new ATOM 0 HD12 LEU A1969 -6.874 8.675 -1.027 1.00 0.00 H new ATOM 0 HD13 LEU A1969 -8.649 8.814 -1.030 1.00 0.00 H new ATOM 0 HD21 LEU A1969 -9.112 6.009 -2.155 1.00 0.00 H new ATOM 0 HD22 LEU A1969 -9.985 7.479 -2.648 1.00 0.00 H new ATOM 0 HD23 LEU A1969 -9.162 6.481 -3.870 1.00 0.00 H new ATOM 533 N TYR A1970 -7.596 10.075 -6.977 1.00 0.00 N ATOM 534 CA TYR A1970 -7.433 11.219 -7.869 1.00 0.00 C ATOM 535 C TYR A1970 -6.807 12.410 -7.130 1.00 0.00 C ATOM 536 O TYR A1970 -7.421 13.473 -6.999 1.00 0.00 O ATOM 537 CB TYR A1970 -8.743 11.587 -8.590 1.00 0.00 C ATOM 538 CG TYR A1970 -9.443 10.487 -9.369 1.00 0.00 C ATOM 539 CD1 TYR A1970 -8.722 9.560 -10.148 1.00 0.00 C ATOM 540 CD2 TYR A1970 -10.847 10.416 -9.331 1.00 0.00 C ATOM 541 CE1 TYR A1970 -9.397 8.566 -10.881 1.00 0.00 C ATOM 542 CE2 TYR A1970 -11.526 9.424 -10.055 1.00 0.00 C ATOM 543 CZ TYR A1970 -10.807 8.499 -10.835 1.00 0.00 C ATOM 544 OH TYR A1970 -11.494 7.543 -11.515 1.00 0.00 O ATOM 0 H TYR A1970 -7.126 9.248 -7.345 1.00 0.00 H new ATOM 0 HA TYR A1970 -6.735 10.928 -8.654 1.00 0.00 H new ATOM 0 HB2 TYR A1970 -9.441 11.970 -7.846 1.00 0.00 H new ATOM 0 HB3 TYR A1970 -8.531 12.405 -9.278 1.00 0.00 H new ATOM 0 HD1 TYR A1970 -7.644 9.613 -10.183 1.00 0.00 H new ATOM 0 HD2 TYR A1970 -11.405 11.128 -8.742 1.00 0.00 H new ATOM 0 HE1 TYR A1970 -8.839 7.858 -11.476 1.00 0.00 H new ATOM 0 HE2 TYR A1970 -12.604 9.370 -10.014 1.00 0.00 H new ATOM 0 HH TYR A1970 -12.455 7.658 -11.360 1.00 0.00 H new ATOM 554 N THR A1971 -5.578 12.246 -6.643 1.00 0.00 N ATOM 555 CA THR A1971 -4.861 13.285 -5.934 1.00 0.00 C ATOM 556 C THR A1971 -3.342 13.104 -6.062 1.00 0.00 C ATOM 557 O THR A1971 -2.840 12.225 -6.769 1.00 0.00 O ATOM 558 CB THR A1971 -5.368 13.359 -4.483 1.00 0.00 C ATOM 559 OG1 THR A1971 -4.998 14.635 -3.996 1.00 0.00 O ATOM 560 CG2 THR A1971 -4.823 12.223 -3.606 1.00 0.00 C ATOM 0 H THR A1971 -5.053 11.376 -6.735 1.00 0.00 H new ATOM 0 HA THR A1971 -5.064 14.254 -6.389 1.00 0.00 H new ATOM 0 HB THR A1971 -6.450 13.229 -4.452 1.00 0.00 H new ATOM 0 HG1 THR A1971 -5.555 14.864 -3.223 1.00 0.00 H new ATOM 0 HG21 THR A1971 -5.213 12.326 -2.594 1.00 0.00 H new ATOM 0 HG22 THR A1971 -5.134 11.263 -4.019 1.00 0.00 H new ATOM 0 HG23 THR A1971 -3.734 12.272 -3.582 1.00 0.00 H new ATOM 568 N GLU A1972 -2.602 13.996 -5.413 1.00 0.00 N ATOM 569 CA GLU A1972 -1.158 14.052 -5.374 1.00 0.00 C ATOM 570 C GLU A1972 -0.662 13.288 -4.163 1.00 0.00 C ATOM 571 O GLU A1972 -1.246 13.301 -3.082 1.00 0.00 O ATOM 572 CB GLU A1972 -0.711 15.509 -5.198 1.00 0.00 C ATOM 573 CG GLU A1972 -1.188 16.473 -6.292 1.00 0.00 C ATOM 574 CD GLU A1972 -1.681 17.782 -5.665 1.00 0.00 C ATOM 575 OE1 GLU A1972 -0.898 18.436 -4.945 1.00 0.00 O ATOM 576 OE2 GLU A1972 -2.869 18.142 -5.837 1.00 0.00 O ATOM 0 H GLU A1972 -3.029 14.744 -4.867 1.00 0.00 H new ATOM 0 HA GLU A1972 -0.762 13.629 -6.297 1.00 0.00 H new ATOM 0 HB2 GLU A1972 -1.072 15.870 -4.235 1.00 0.00 H new ATOM 0 HB3 GLU A1972 0.378 15.537 -5.161 1.00 0.00 H new ATOM 0 HG2 GLU A1972 -0.374 16.678 -6.987 1.00 0.00 H new ATOM 0 HG3 GLU A1972 -1.990 16.012 -6.868 1.00 0.00 H new ATOM 583 N GLU A1973 0.503 12.681 -4.301 1.00 0.00 N ATOM 584 CA GLU A1973 1.104 11.922 -3.224 1.00 0.00 C ATOM 585 C GLU A1973 1.517 12.816 -2.064 1.00 0.00 C ATOM 586 O GLU A1973 1.784 12.328 -0.972 1.00 0.00 O ATOM 587 CB GLU A1973 2.323 11.169 -3.744 1.00 0.00 C ATOM 588 CG GLU A1973 1.989 10.336 -4.974 1.00 0.00 C ATOM 589 CD GLU A1973 3.162 9.461 -5.420 1.00 0.00 C ATOM 590 OE1 GLU A1973 3.929 8.925 -4.580 1.00 0.00 O ATOM 591 OE2 GLU A1973 3.254 9.270 -6.649 1.00 0.00 O ATOM 0 H GLU A1973 1.055 12.701 -5.159 1.00 0.00 H new ATOM 0 HA GLU A1973 0.357 11.219 -2.857 1.00 0.00 H new ATOM 0 HB2 GLU A1973 3.112 11.880 -3.989 1.00 0.00 H new ATOM 0 HB3 GLU A1973 2.711 10.520 -2.959 1.00 0.00 H new ATOM 0 HG2 GLU A1973 1.128 9.703 -4.758 1.00 0.00 H new ATOM 0 HG3 GLU A1973 1.701 10.998 -5.791 1.00 0.00 H new ATOM 598 N SER A1974 1.665 14.111 -2.296 1.00 0.00 N ATOM 599 CA SER A1974 2.037 15.053 -1.260 1.00 0.00 C ATOM 600 C SER A1974 0.928 15.201 -0.213 1.00 0.00 C ATOM 601 O SER A1974 1.228 15.681 0.879 1.00 0.00 O ATOM 602 CB SER A1974 2.407 16.389 -1.895 1.00 0.00 C ATOM 603 OG SER A1974 3.656 16.269 -2.559 1.00 0.00 O ATOM 0 H SER A1974 1.529 14.537 -3.213 1.00 0.00 H new ATOM 0 HA SER A1974 2.910 14.671 -0.730 1.00 0.00 H new ATOM 0 HB2 SER A1974 1.635 16.694 -2.602 1.00 0.00 H new ATOM 0 HB3 SER A1974 2.463 17.164 -1.130 1.00 0.00 H new ATOM 0 HG SER A1974 3.893 17.127 -2.968 1.00 0.00 H new ATOM 609 N GLU A1975 -0.302 14.749 -0.482 1.00 0.00 N ATOM 610 CA GLU A1975 -1.387 14.870 0.485 1.00 0.00 C ATOM 611 C GLU A1975 -1.546 13.620 1.360 1.00 0.00 C ATOM 612 O GLU A1975 -2.151 13.679 2.429 1.00 0.00 O ATOM 613 CB GLU A1975 -2.696 15.211 -0.250 1.00 0.00 C ATOM 614 CG GLU A1975 -3.504 14.047 -0.849 1.00 0.00 C ATOM 615 CD GLU A1975 -5.005 14.337 -0.735 1.00 0.00 C ATOM 616 OE1 GLU A1975 -5.518 15.130 -1.554 1.00 0.00 O ATOM 617 OE2 GLU A1975 -5.659 13.799 0.186 1.00 0.00 O ATOM 0 H GLU A1975 -0.565 14.299 -1.359 1.00 0.00 H new ATOM 0 HA GLU A1975 -1.135 15.681 1.169 1.00 0.00 H new ATOM 0 HB2 GLU A1975 -3.343 15.744 0.447 1.00 0.00 H new ATOM 0 HB3 GLU A1975 -2.457 15.904 -1.057 1.00 0.00 H new ATOM 0 HG2 GLU A1975 -3.231 13.904 -1.895 1.00 0.00 H new ATOM 0 HG3 GLU A1975 -3.264 13.120 -0.328 1.00 0.00 H new ATOM 624 N ILE A1976 -0.997 12.491 0.917 1.00 0.00 N ATOM 625 CA ILE A1976 -1.088 11.192 1.564 1.00 0.00 C ATOM 626 C ILE A1976 -0.080 11.042 2.705 1.00 0.00 C ATOM 627 O ILE A1976 1.032 11.584 2.693 1.00 0.00 O ATOM 628 CB ILE A1976 -0.886 10.080 0.505 1.00 0.00 C ATOM 629 CG1 ILE A1976 -1.413 10.358 -0.924 1.00 0.00 C ATOM 630 CG2 ILE A1976 -1.347 8.679 0.945 1.00 0.00 C ATOM 631 CD1 ILE A1976 -2.816 9.890 -1.295 1.00 0.00 C ATOM 0 H ILE A1976 -0.451 12.460 0.056 1.00 0.00 H new ATOM 0 HA ILE A1976 -2.079 11.102 2.009 1.00 0.00 H new ATOM 0 HB ILE A1976 0.202 10.098 0.439 1.00 0.00 H new ATOM 0 HG12 ILE A1976 -1.371 11.435 -1.087 1.00 0.00 H new ATOM 0 HG13 ILE A1976 -0.716 9.901 -1.627 1.00 0.00 H new ATOM 0 HG21 ILE A1976 -1.166 7.967 0.140 1.00 0.00 H new ATOM 0 HG22 ILE A1976 -0.790 8.374 1.831 1.00 0.00 H new ATOM 0 HG23 ILE A1976 -2.412 8.702 1.177 1.00 0.00 H new ATOM 0 HD11 ILE A1976 -3.029 10.163 -2.329 1.00 0.00 H new ATOM 0 HD12 ILE A1976 -2.879 8.807 -1.185 1.00 0.00 H new ATOM 0 HD13 ILE A1976 -3.544 10.365 -0.637 1.00 0.00 H new ATOM 643 N ALA A1977 -0.467 10.241 3.691 1.00 0.00 N ATOM 644 CA ALA A1977 0.317 9.910 4.868 1.00 0.00 C ATOM 645 C ALA A1977 0.528 8.402 4.881 1.00 0.00 C ATOM 646 O ALA A1977 -0.108 7.656 4.137 1.00 0.00 O ATOM 647 CB ALA A1977 -0.378 10.391 6.132 1.00 0.00 C ATOM 0 H ALA A1977 -1.379 9.785 3.688 1.00 0.00 H new ATOM 0 HA ALA A1977 1.284 10.412 4.835 1.00 0.00 H new ATOM 0 HB1 ALA A1977 0.227 10.132 7.001 1.00 0.00 H new ATOM 0 HB2 ALA A1977 -0.506 11.473 6.088 1.00 0.00 H new ATOM 0 HB3 ALA A1977 -1.354 9.913 6.215 1.00 0.00 H new ATOM 653 N GLU A1978 1.390 7.937 5.772 1.00 0.00 N ATOM 654 CA GLU A1978 1.722 6.522 5.872 1.00 0.00 C ATOM 655 C GLU A1978 0.973 5.813 6.989 1.00 0.00 C ATOM 656 O GLU A1978 0.748 4.607 6.912 1.00 0.00 O ATOM 657 CB GLU A1978 3.241 6.404 6.070 1.00 0.00 C ATOM 658 CG GLU A1978 4.058 7.248 5.078 1.00 0.00 C ATOM 659 CD GLU A1978 5.561 7.167 5.313 1.00 0.00 C ATOM 660 OE1 GLU A1978 6.021 6.569 6.313 1.00 0.00 O ATOM 661 OE2 GLU A1978 6.334 7.616 4.443 1.00 0.00 O ATOM 0 H GLU A1978 1.879 8.527 6.445 1.00 0.00 H new ATOM 0 HA GLU A1978 1.412 6.027 4.952 1.00 0.00 H new ATOM 0 HB2 GLU A1978 3.491 6.709 7.086 1.00 0.00 H new ATOM 0 HB3 GLU A1978 3.532 5.358 5.970 1.00 0.00 H new ATOM 0 HG2 GLU A1978 3.838 6.918 4.063 1.00 0.00 H new ATOM 0 HG3 GLU A1978 3.742 8.289 5.150 1.00 0.00 H new ATOM 668 N ASP A1979 0.534 6.580 7.977 1.00 0.00 N ATOM 669 CA ASP A1979 -0.173 6.182 9.189 1.00 0.00 C ATOM 670 C ASP A1979 -1.601 6.741 9.241 1.00 0.00 C ATOM 671 O ASP A1979 -2.285 6.611 10.257 1.00 0.00 O ATOM 672 CB ASP A1979 0.687 6.521 10.434 1.00 0.00 C ATOM 673 CG ASP A1979 1.681 7.685 10.283 1.00 0.00 C ATOM 674 OD1 ASP A1979 1.425 8.659 9.542 1.00 0.00 O ATOM 675 OD2 ASP A1979 2.805 7.587 10.838 1.00 0.00 O ATOM 0 H ASP A1979 0.676 7.590 7.949 1.00 0.00 H new ATOM 0 HA ASP A1979 -0.310 5.101 9.182 1.00 0.00 H new ATOM 0 HB2 ASP A1979 0.015 6.751 11.261 1.00 0.00 H new ATOM 0 HB3 ASP A1979 1.246 5.629 10.716 1.00 0.00 H new ATOM 680 N GLN A1980 -2.075 7.363 8.157 1.00 0.00 N ATOM 681 CA GLN A1980 -3.429 7.905 8.074 1.00 0.00 C ATOM 682 C GLN A1980 -4.294 6.917 7.319 1.00 0.00 C ATOM 683 O GLN A1980 -3.827 6.203 6.427 1.00 0.00 O ATOM 684 CB GLN A1980 -3.441 9.278 7.430 1.00 0.00 C ATOM 685 CG GLN A1980 -4.760 10.052 7.559 1.00 0.00 C ATOM 686 CD GLN A1980 -4.424 11.539 7.563 1.00 0.00 C ATOM 687 OE1 GLN A1980 -3.855 12.022 8.543 1.00 0.00 O ATOM 688 NE2 GLN A1980 -4.713 12.255 6.494 1.00 0.00 N ATOM 0 H GLN A1980 -1.525 7.504 7.310 1.00 0.00 H new ATOM 0 HA GLN A1980 -3.832 8.042 9.077 1.00 0.00 H new ATOM 0 HB2 GLN A1980 -2.644 9.875 7.872 1.00 0.00 H new ATOM 0 HB3 GLN A1980 -3.206 9.167 6.371 1.00 0.00 H new ATOM 0 HG2 GLN A1980 -5.427 9.812 6.731 1.00 0.00 H new ATOM 0 HG3 GLN A1980 -5.279 9.774 8.477 1.00 0.00 H new ATOM 0 HE21 GLN A1980 -5.185 11.820 5.701 1.00 0.00 H new ATOM 0 HE22 GLN A1980 -4.464 13.244 6.460 1.00 0.00 H new ATOM 697 N LYS A1981 -5.559 6.865 7.716 1.00 0.00 N ATOM 698 CA LYS A1981 -6.529 5.965 7.131 1.00 0.00 C ATOM 699 C LYS A1981 -6.908 6.416 5.739 1.00 0.00 C ATOM 700 O LYS A1981 -7.371 7.541 5.588 1.00 0.00 O ATOM 701 CB LYS A1981 -7.775 5.870 8.028 1.00 0.00 C ATOM 702 CG LYS A1981 -7.480 5.712 9.525 1.00 0.00 C ATOM 703 CD LYS A1981 -6.640 4.467 9.822 1.00 0.00 C ATOM 704 CE LYS A1981 -5.742 4.617 11.047 1.00 0.00 C ATOM 705 NZ LYS A1981 -6.515 4.579 12.298 1.00 0.00 N ATOM 0 H LYS A1981 -5.938 7.453 8.459 1.00 0.00 H new ATOM 0 HA LYS A1981 -6.079 4.975 7.054 1.00 0.00 H new ATOM 0 HB2 LYS A1981 -8.378 6.766 7.884 1.00 0.00 H new ATOM 0 HB3 LYS A1981 -8.378 5.023 7.700 1.00 0.00 H new ATOM 0 HG2 LYS A1981 -6.955 6.597 9.885 1.00 0.00 H new ATOM 0 HG3 LYS A1981 -8.420 5.653 10.074 1.00 0.00 H new ATOM 0 HD2 LYS A1981 -7.305 3.617 9.971 1.00 0.00 H new ATOM 0 HD3 LYS A1981 -6.022 4.240 8.954 1.00 0.00 H new ATOM 0 HE2 LYS A1981 -5.000 3.819 11.054 1.00 0.00 H new ATOM 0 HE3 LYS A1981 -5.197 5.559 10.985 1.00 0.00 H new ATOM 0 HZ1 LYS A1981 -5.871 4.684 13.108 1.00 0.00 H new ATOM 0 HZ2 LYS A1981 -7.206 5.356 12.303 1.00 0.00 H new ATOM 0 HZ3 LYS A1981 -7.015 3.670 12.369 1.00 0.00 H new ATOM 719 N PHE A1982 -6.822 5.525 4.753 1.00 0.00 N ATOM 720 CA PHE A1982 -7.177 5.814 3.375 1.00 0.00 C ATOM 721 C PHE A1982 -8.581 6.410 3.290 1.00 0.00 C ATOM 722 O PHE A1982 -8.816 7.265 2.446 1.00 0.00 O ATOM 723 CB PHE A1982 -7.117 4.534 2.539 1.00 0.00 C ATOM 724 CG PHE A1982 -5.844 3.731 2.609 1.00 0.00 C ATOM 725 CD1 PHE A1982 -4.614 4.369 2.399 1.00 0.00 C ATOM 726 CD2 PHE A1982 -5.890 2.346 2.851 1.00 0.00 C ATOM 727 CE1 PHE A1982 -3.428 3.627 2.475 1.00 0.00 C ATOM 728 CE2 PHE A1982 -4.701 1.601 2.915 1.00 0.00 C ATOM 729 CZ PHE A1982 -3.467 2.244 2.730 1.00 0.00 C ATOM 0 H PHE A1982 -6.498 4.569 4.897 1.00 0.00 H new ATOM 0 HA PHE A1982 -6.463 6.539 2.985 1.00 0.00 H new ATOM 0 HB2 PHE A1982 -7.941 3.890 2.846 1.00 0.00 H new ATOM 0 HB3 PHE A1982 -7.292 4.801 1.497 1.00 0.00 H new ATOM 0 HD1 PHE A1982 -4.581 5.426 2.180 1.00 0.00 H new ATOM 0 HD2 PHE A1982 -6.842 1.854 2.988 1.00 0.00 H new ATOM 0 HE1 PHE A1982 -2.477 4.120 2.337 1.00 0.00 H new ATOM 0 HE2 PHE A1982 -4.736 0.539 3.106 1.00 0.00 H new ATOM 0 HZ PHE A1982 -2.549 1.678 2.783 1.00 0.00 H new ATOM 739 N VAL A1983 -9.509 5.986 4.157 1.00 0.00 N ATOM 740 CA VAL A1983 -10.878 6.491 4.173 1.00 0.00 C ATOM 741 C VAL A1983 -10.893 8.019 4.285 1.00 0.00 C ATOM 742 O VAL A1983 -11.686 8.658 3.597 1.00 0.00 O ATOM 743 CB VAL A1983 -11.731 5.772 5.239 1.00 0.00 C ATOM 744 CG1 VAL A1983 -11.676 4.249 5.057 1.00 0.00 C ATOM 745 CG2 VAL A1983 -11.335 6.104 6.683 1.00 0.00 C ATOM 0 H VAL A1983 -9.325 5.279 4.869 1.00 0.00 H new ATOM 0 HA VAL A1983 -11.353 6.257 3.220 1.00 0.00 H new ATOM 0 HB VAL A1983 -12.744 6.143 5.081 1.00 0.00 H new ATOM 0 HG11 VAL A1983 -12.286 3.769 5.822 1.00 0.00 H new ATOM 0 HG12 VAL A1983 -12.058 3.986 4.070 1.00 0.00 H new ATOM 0 HG13 VAL A1983 -10.645 3.909 5.149 1.00 0.00 H new ATOM 0 HG21 VAL A1983 -11.981 5.560 7.372 1.00 0.00 H new ATOM 0 HG22 VAL A1983 -10.298 5.814 6.852 1.00 0.00 H new ATOM 0 HG23 VAL A1983 -11.444 7.175 6.853 1.00 0.00 H new ATOM 755 N ASP A1984 -10.010 8.606 5.102 1.00 0.00 N ATOM 756 CA ASP A1984 -9.915 10.058 5.272 1.00 0.00 C ATOM 757 C ASP A1984 -9.375 10.701 3.998 1.00 0.00 C ATOM 758 O ASP A1984 -9.812 11.786 3.619 1.00 0.00 O ATOM 759 CB ASP A1984 -9.014 10.384 6.468 1.00 0.00 C ATOM 760 CG ASP A1984 -8.564 11.840 6.516 1.00 0.00 C ATOM 761 OD1 ASP A1984 -7.501 12.164 5.940 1.00 0.00 O ATOM 762 OD2 ASP A1984 -9.147 12.619 7.302 1.00 0.00 O ATOM 0 H ASP A1984 -9.339 8.083 5.665 1.00 0.00 H new ATOM 0 HA ASP A1984 -10.909 10.462 5.465 1.00 0.00 H new ATOM 0 HB2 ASP A1984 -9.547 10.147 7.389 1.00 0.00 H new ATOM 0 HB3 ASP A1984 -8.134 9.742 6.435 1.00 0.00 H new ATOM 767 N LEU A1985 -8.445 10.019 3.323 1.00 0.00 N ATOM 768 CA LEU A1985 -7.861 10.496 2.077 1.00 0.00 C ATOM 769 C LEU A1985 -8.935 10.436 0.970 1.00 0.00 C ATOM 770 O LEU A1985 -8.770 11.115 -0.040 1.00 0.00 O ATOM 771 CB LEU A1985 -6.582 9.705 1.710 1.00 0.00 C ATOM 772 CG LEU A1985 -5.296 10.046 2.499 1.00 0.00 C ATOM 773 CD1 LEU A1985 -4.730 11.403 2.093 1.00 0.00 C ATOM 774 CD2 LEU A1985 -5.434 9.985 4.016 1.00 0.00 C ATOM 0 H LEU A1985 -8.078 9.118 3.631 1.00 0.00 H new ATOM 0 HA LEU A1985 -7.542 11.532 2.194 1.00 0.00 H new ATOM 0 HB2 LEU A1985 -6.790 8.643 1.843 1.00 0.00 H new ATOM 0 HB3 LEU A1985 -6.380 9.860 0.650 1.00 0.00 H new ATOM 0 HG LEU A1985 -4.601 9.253 2.223 1.00 0.00 H new ATOM 0 HD11 LEU A1985 -3.827 11.608 2.669 1.00 0.00 H new ATOM 0 HD12 LEU A1985 -4.488 11.393 1.030 1.00 0.00 H new ATOM 0 HD13 LEU A1985 -5.469 12.179 2.290 1.00 0.00 H new ATOM 0 HD21 LEU A1985 -4.480 10.240 4.479 1.00 0.00 H new ATOM 0 HD22 LEU A1985 -6.196 10.694 4.341 1.00 0.00 H new ATOM 0 HD23 LEU A1985 -5.725 8.978 4.315 1.00 0.00 H new ATOM 786 N GLY A1986 -10.021 9.657 1.143 1.00 0.00 N ATOM 787 CA GLY A1986 -11.137 9.500 0.204 1.00 0.00 C ATOM 788 C GLY A1986 -11.433 8.057 -0.226 1.00 0.00 C ATOM 789 O GLY A1986 -12.128 7.838 -1.220 1.00 0.00 O ATOM 0 H GLY A1986 -10.145 9.095 1.985 1.00 0.00 H new ATOM 0 HA2 GLY A1986 -12.035 9.918 0.659 1.00 0.00 H new ATOM 0 HA3 GLY A1986 -10.927 10.092 -0.687 1.00 0.00 H new ATOM 793 N LEU A1987 -10.908 7.058 0.487 1.00 0.00 N ATOM 794 CA LEU A1987 -11.106 5.644 0.162 1.00 0.00 C ATOM 795 C LEU A1987 -12.451 5.137 0.631 1.00 0.00 C ATOM 796 O LEU A1987 -12.647 4.786 1.793 1.00 0.00 O ATOM 797 CB LEU A1987 -9.955 4.835 0.785 1.00 0.00 C ATOM 798 CG LEU A1987 -9.648 3.407 0.311 1.00 0.00 C ATOM 799 CD1 LEU A1987 -10.731 2.401 0.689 1.00 0.00 C ATOM 800 CD2 LEU A1987 -9.344 3.400 -1.189 1.00 0.00 C ATOM 0 H LEU A1987 -10.329 7.209 1.313 1.00 0.00 H new ATOM 0 HA LEU A1987 -11.099 5.523 -0.921 1.00 0.00 H new ATOM 0 HB2 LEU A1987 -9.045 5.419 0.651 1.00 0.00 H new ATOM 0 HB3 LEU A1987 -10.145 4.782 1.857 1.00 0.00 H new ATOM 0 HG LEU A1987 -8.756 3.074 0.842 1.00 0.00 H new ATOM 0 HD11 LEU A1987 -10.452 1.412 0.325 1.00 0.00 H new ATOM 0 HD12 LEU A1987 -10.838 2.371 1.773 1.00 0.00 H new ATOM 0 HD13 LEU A1987 -11.678 2.700 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A1987 -9.128 2.382 -1.512 1.00 0.00 H new ATOM 0 HD22 LEU A1987 -10.207 3.779 -1.737 1.00 0.00 H new ATOM 0 HD23 LEU A1987 -8.480 4.034 -1.388 1.00 0.00 H new ATOM 812 N ASP A1988 -13.366 5.024 -0.320 1.00 0.00 N ATOM 813 CA ASP A1988 -14.687 4.502 -0.041 1.00 0.00 C ATOM 814 C ASP A1988 -14.659 3.015 -0.384 1.00 0.00 C ATOM 815 O ASP A1988 -13.727 2.518 -1.020 1.00 0.00 O ATOM 816 CB ASP A1988 -15.760 5.193 -0.864 1.00 0.00 C ATOM 817 CG ASP A1988 -16.172 6.561 -0.328 1.00 0.00 C ATOM 818 OD1 ASP A1988 -16.804 6.623 0.752 1.00 0.00 O ATOM 819 OD2 ASP A1988 -15.946 7.565 -1.038 1.00 0.00 O ATOM 0 H ASP A1988 -13.213 5.289 -1.293 1.00 0.00 H new ATOM 0 HA ASP A1988 -14.932 4.675 1.007 1.00 0.00 H new ATOM 0 HB2 ASP A1988 -15.400 5.309 -1.886 1.00 0.00 H new ATOM 0 HB3 ASP A1988 -16.640 4.551 -0.906 1.00 0.00 H new ATOM 824 N SER A1989 -15.716 2.310 -0.006 1.00 0.00 N ATOM 825 CA SER A1989 -15.897 0.885 -0.203 1.00 0.00 C ATOM 826 C SER A1989 -15.641 0.380 -1.617 1.00 0.00 C ATOM 827 O SER A1989 -15.280 -0.787 -1.770 1.00 0.00 O ATOM 828 CB SER A1989 -17.347 0.576 0.149 1.00 0.00 C ATOM 829 OG SER A1989 -17.538 -0.787 0.448 1.00 0.00 O ATOM 0 H SER A1989 -16.508 2.741 0.470 1.00 0.00 H new ATOM 0 HA SER A1989 -15.160 0.384 0.425 1.00 0.00 H new ATOM 0 HB2 SER A1989 -17.649 1.181 1.004 1.00 0.00 H new ATOM 0 HB3 SER A1989 -17.990 0.858 -0.684 1.00 0.00 H new ATOM 0 HG SER A1989 -18.479 -0.944 0.670 1.00 0.00 H new ATOM 834 N ILE A1990 -16.020 1.152 -2.637 1.00 0.00 N ATOM 835 CA ILE A1990 -15.867 0.785 -4.031 1.00 0.00 C ATOM 836 C ILE A1990 -14.391 0.876 -4.380 1.00 0.00 C ATOM 837 O ILE A1990 -13.789 -0.090 -4.839 1.00 0.00 O ATOM 838 CB ILE A1990 -16.740 1.746 -4.881 1.00 0.00 C ATOM 839 CG1 ILE A1990 -18.234 1.442 -4.634 1.00 0.00 C ATOM 840 CG2 ILE A1990 -16.409 1.691 -6.382 1.00 0.00 C ATOM 841 CD1 ILE A1990 -19.165 2.562 -5.109 1.00 0.00 C ATOM 0 H ILE A1990 -16.450 2.068 -2.506 1.00 0.00 H new ATOM 0 HA ILE A1990 -16.198 -0.234 -4.232 1.00 0.00 H new ATOM 0 HB ILE A1990 -16.514 2.763 -4.561 1.00 0.00 H new ATOM 0 HG12 ILE A1990 -18.499 0.517 -5.146 1.00 0.00 H new ATOM 0 HG13 ILE A1990 -18.393 1.274 -3.569 1.00 0.00 H new ATOM 0 HG21 ILE A1990 -17.053 2.385 -6.922 1.00 0.00 H new ATOM 0 HG22 ILE A1990 -15.366 1.969 -6.535 1.00 0.00 H new ATOM 0 HG23 ILE A1990 -16.573 0.680 -6.754 1.00 0.00 H new ATOM 0 HD11 ILE A1990 -20.200 2.286 -4.906 1.00 0.00 H new ATOM 0 HD12 ILE A1990 -18.925 3.484 -4.579 1.00 0.00 H new ATOM 0 HD13 ILE A1990 -19.033 2.715 -6.180 1.00 0.00 H new ATOM 853 N VAL A1991 -13.812 2.043 -4.117 1.00 0.00 N ATOM 854 CA VAL A1991 -12.425 2.324 -4.400 1.00 0.00 C ATOM 855 C VAL A1991 -11.521 1.312 -3.691 1.00 0.00 C ATOM 856 O VAL A1991 -10.578 0.798 -4.286 1.00 0.00 O ATOM 857 CB VAL A1991 -12.118 3.792 -4.079 1.00 0.00 C ATOM 858 CG1 VAL A1991 -10.777 4.150 -4.706 1.00 0.00 C ATOM 859 CG2 VAL A1991 -13.170 4.737 -4.674 1.00 0.00 C ATOM 0 H VAL A1991 -14.309 2.827 -3.694 1.00 0.00 H new ATOM 0 HA VAL A1991 -12.216 2.200 -5.463 1.00 0.00 H new ATOM 0 HB VAL A1991 -12.112 3.906 -2.995 1.00 0.00 H new ATOM 0 HG11 VAL A1991 -10.540 5.192 -4.489 1.00 0.00 H new ATOM 0 HG12 VAL A1991 -9.999 3.507 -4.293 1.00 0.00 H new ATOM 0 HG13 VAL A1991 -10.830 4.008 -5.785 1.00 0.00 H new ATOM 0 HG21 VAL A1991 -12.916 5.767 -4.424 1.00 0.00 H new ATOM 0 HG22 VAL A1991 -13.192 4.621 -5.758 1.00 0.00 H new ATOM 0 HG23 VAL A1991 -14.150 4.495 -4.263 1.00 0.00 H new ATOM 869 N GLY A1992 -11.839 0.948 -2.449 1.00 0.00 N ATOM 870 CA GLY A1992 -11.052 0.003 -1.684 1.00 0.00 C ATOM 871 C GLY A1992 -11.034 -1.386 -2.320 1.00 0.00 C ATOM 872 O GLY A1992 -9.977 -2.017 -2.415 1.00 0.00 O ATOM 0 H GLY A1992 -12.654 1.306 -1.951 1.00 0.00 H new ATOM 0 HA2 GLY A1992 -10.030 0.373 -1.595 1.00 0.00 H new ATOM 0 HA3 GLY A1992 -11.455 -0.068 -0.674 1.00 0.00 H new ATOM 876 N VAL A1993 -12.199 -1.886 -2.742 1.00 0.00 N ATOM 877 CA VAL A1993 -12.281 -3.205 -3.356 1.00 0.00 C ATOM 878 C VAL A1993 -11.658 -3.223 -4.747 1.00 0.00 C ATOM 879 O VAL A1993 -11.131 -4.256 -5.152 1.00 0.00 O ATOM 880 CB VAL A1993 -13.731 -3.725 -3.346 1.00 0.00 C ATOM 881 CG1 VAL A1993 -14.687 -3.024 -4.298 1.00 0.00 C ATOM 882 CG2 VAL A1993 -13.806 -5.215 -3.691 1.00 0.00 C ATOM 0 H VAL A1993 -13.091 -1.397 -2.668 1.00 0.00 H new ATOM 0 HA VAL A1993 -11.690 -3.895 -2.754 1.00 0.00 H new ATOM 0 HB VAL A1993 -14.045 -3.517 -2.323 1.00 0.00 H new ATOM 0 HG11 VAL A1993 -15.679 -3.468 -4.210 1.00 0.00 H new ATOM 0 HG12 VAL A1993 -14.740 -1.965 -4.046 1.00 0.00 H new ATOM 0 HG13 VAL A1993 -14.329 -3.136 -5.321 1.00 0.00 H new ATOM 0 HG21 VAL A1993 -14.846 -5.541 -3.673 1.00 0.00 H new ATOM 0 HG22 VAL A1993 -13.392 -5.379 -4.686 1.00 0.00 H new ATOM 0 HG23 VAL A1993 -13.234 -5.787 -2.961 1.00 0.00 H new ATOM 892 N GLU A1994 -11.720 -2.141 -5.515 1.00 0.00 N ATOM 893 CA GLU A1994 -11.111 -2.155 -6.834 1.00 0.00 C ATOM 894 C GLU A1994 -9.586 -2.028 -6.724 1.00 0.00 C ATOM 895 O GLU A1994 -8.858 -2.754 -7.404 1.00 0.00 O ATOM 896 CB GLU A1994 -11.775 -1.137 -7.759 1.00 0.00 C ATOM 897 CG GLU A1994 -11.499 0.324 -7.401 1.00 0.00 C ATOM 898 CD GLU A1994 -11.721 1.279 -8.564 1.00 0.00 C ATOM 899 OE1 GLU A1994 -12.890 1.601 -8.868 1.00 0.00 O ATOM 900 OE2 GLU A1994 -10.702 1.725 -9.139 1.00 0.00 O ATOM 0 H GLU A1994 -12.174 -1.266 -5.254 1.00 0.00 H new ATOM 0 HA GLU A1994 -11.289 -3.120 -7.309 1.00 0.00 H new ATOM 0 HB2 GLU A1994 -11.436 -1.318 -8.779 1.00 0.00 H new ATOM 0 HB3 GLU A1994 -12.852 -1.303 -7.747 1.00 0.00 H new ATOM 0 HG2 GLU A1994 -12.143 0.616 -6.572 1.00 0.00 H new ATOM 0 HG3 GLU A1994 -10.470 0.418 -7.054 1.00 0.00 H new ATOM 907 N TRP A1995 -9.099 -1.187 -5.807 1.00 0.00 N ATOM 908 CA TRP A1995 -7.682 -0.928 -5.584 1.00 0.00 C ATOM 909 C TRP A1995 -6.937 -2.147 -5.064 1.00 0.00 C ATOM 910 O TRP A1995 -5.785 -2.372 -5.441 1.00 0.00 O ATOM 911 CB TRP A1995 -7.521 0.247 -4.636 1.00 0.00 C ATOM 912 CG TRP A1995 -6.118 0.740 -4.497 1.00 0.00 C ATOM 913 CD1 TRP A1995 -5.359 1.230 -5.497 1.00 0.00 C ATOM 914 CD2 TRP A1995 -5.303 0.846 -3.295 1.00 0.00 C ATOM 915 NE1 TRP A1995 -4.143 1.626 -4.991 1.00 0.00 N ATOM 916 CE2 TRP A1995 -4.040 1.400 -3.635 1.00 0.00 C ATOM 917 CE3 TRP A1995 -5.541 0.579 -1.938 1.00 0.00 C ATOM 918 CZ2 TRP A1995 -3.050 1.647 -2.667 1.00 0.00 C ATOM 919 CZ3 TRP A1995 -4.571 0.845 -0.953 1.00 0.00 C ATOM 920 CH2 TRP A1995 -3.321 1.373 -1.317 1.00 0.00 C ATOM 0 H TRP A1995 -9.703 -0.653 -5.182 1.00 0.00 H new ATOM 0 HA TRP A1995 -7.236 -0.684 -6.548 1.00 0.00 H new ATOM 0 HB2 TRP A1995 -8.149 1.067 -4.984 1.00 0.00 H new ATOM 0 HB3 TRP A1995 -7.891 -0.042 -3.652 1.00 0.00 H new ATOM 0 HD1 TRP A1995 -5.658 1.301 -6.532 1.00 0.00 H new ATOM 0 HE1 TRP A1995 -3.401 2.040 -5.555 1.00 0.00 H new ATOM 0 HE3 TRP A1995 -6.491 0.159 -1.642 1.00 0.00 H new ATOM 0 HZ2 TRP A1995 -2.089 2.044 -2.960 1.00 0.00 H new ATOM 0 HZ3 TRP A1995 -4.788 0.643 0.085 1.00 0.00 H new ATOM 0 HH2 TRP A1995 -2.573 1.567 -0.563 1.00 0.00 H new ATOM 931 N THR A1996 -7.596 -2.986 -4.251 1.00 0.00 N ATOM 932 CA THR A1996 -6.955 -4.201 -3.740 1.00 0.00 C ATOM 933 C THR A1996 -6.420 -5.045 -4.924 1.00 0.00 C ATOM 934 O THR A1996 -5.414 -5.743 -4.788 1.00 0.00 O ATOM 935 CB THR A1996 -7.934 -4.954 -2.818 1.00 0.00 C ATOM 936 OG1 THR A1996 -7.292 -5.835 -1.922 1.00 0.00 O ATOM 937 CG2 THR A1996 -8.946 -5.800 -3.586 1.00 0.00 C ATOM 0 H THR A1996 -8.557 -2.847 -3.939 1.00 0.00 H new ATOM 0 HA THR A1996 -6.088 -3.957 -3.126 1.00 0.00 H new ATOM 0 HB THR A1996 -8.431 -4.150 -2.275 1.00 0.00 H new ATOM 0 HG1 THR A1996 -7.497 -5.571 -1.001 1.00 0.00 H new ATOM 0 HG21 THR A1996 -9.607 -6.305 -2.882 1.00 0.00 H new ATOM 0 HG22 THR A1996 -9.536 -5.157 -4.240 1.00 0.00 H new ATOM 0 HG23 THR A1996 -8.419 -6.542 -4.186 1.00 0.00 H new ATOM 945 N THR A1997 -7.054 -4.960 -6.101 1.00 0.00 N ATOM 946 CA THR A1997 -6.649 -5.686 -7.286 1.00 0.00 C ATOM 947 C THR A1997 -5.343 -5.126 -7.844 1.00 0.00 C ATOM 948 O THR A1997 -4.474 -5.928 -8.183 1.00 0.00 O ATOM 949 CB THR A1997 -7.772 -5.646 -8.329 1.00 0.00 C ATOM 950 OG1 THR A1997 -8.982 -6.088 -7.740 1.00 0.00 O ATOM 951 CG2 THR A1997 -7.451 -6.543 -9.518 1.00 0.00 C ATOM 0 H THR A1997 -7.875 -4.372 -6.247 1.00 0.00 H new ATOM 0 HA THR A1997 -6.466 -6.728 -7.021 1.00 0.00 H new ATOM 0 HB THR A1997 -7.871 -4.618 -8.679 1.00 0.00 H new ATOM 0 HG1 THR A1997 -9.700 -6.060 -8.407 1.00 0.00 H new ATOM 0 HG21 THR A1997 -8.265 -6.494 -10.241 1.00 0.00 H new ATOM 0 HG22 THR A1997 -6.527 -6.207 -9.989 1.00 0.00 H new ATOM 0 HG23 THR A1997 -7.330 -7.571 -9.176 1.00 0.00 H new ATOM 959 N THR A1998 -5.151 -3.804 -7.889 1.00 0.00 N ATOM 960 CA THR A1998 -3.926 -3.200 -8.408 1.00 0.00 C ATOM 961 C THR A1998 -2.733 -3.793 -7.652 1.00 0.00 C ATOM 962 O THR A1998 -1.742 -4.209 -8.244 1.00 0.00 O ATOM 963 CB THR A1998 -3.952 -1.665 -8.239 1.00 0.00 C ATOM 964 OG1 THR A1998 -5.207 -1.092 -8.554 1.00 0.00 O ATOM 965 CG2 THR A1998 -2.908 -1.034 -9.156 1.00 0.00 C ATOM 0 H THR A1998 -5.841 -3.126 -7.566 1.00 0.00 H new ATOM 0 HA THR A1998 -3.841 -3.415 -9.473 1.00 0.00 H new ATOM 0 HB THR A1998 -3.742 -1.467 -7.188 1.00 0.00 H new ATOM 0 HG1 THR A1998 -5.164 -0.121 -8.427 1.00 0.00 H new ATOM 0 HG21 THR A1998 -2.926 0.049 -9.037 1.00 0.00 H new ATOM 0 HG22 THR A1998 -1.919 -1.411 -8.895 1.00 0.00 H new ATOM 0 HG23 THR A1998 -3.132 -1.289 -10.192 1.00 0.00 H new ATOM 973 N ILE A1999 -2.855 -3.883 -6.327 1.00 0.00 N ATOM 974 CA ILE A1999 -1.852 -4.428 -5.427 1.00 0.00 C ATOM 975 C ILE A1999 -1.572 -5.887 -5.787 1.00 0.00 C ATOM 976 O ILE A1999 -0.407 -6.282 -5.877 1.00 0.00 O ATOM 977 CB ILE A1999 -2.355 -4.277 -3.971 1.00 0.00 C ATOM 978 CG1 ILE A1999 -2.555 -2.792 -3.607 1.00 0.00 C ATOM 979 CG2 ILE A1999 -1.359 -4.921 -2.997 1.00 0.00 C ATOM 980 CD1 ILE A1999 -3.326 -2.530 -2.317 1.00 0.00 C ATOM 0 H ILE A1999 -3.691 -3.564 -5.837 1.00 0.00 H new ATOM 0 HA ILE A1999 -0.913 -3.884 -5.524 1.00 0.00 H new ATOM 0 HB ILE A1999 -3.316 -4.785 -3.891 1.00 0.00 H new ATOM 0 HG12 ILE A1999 -1.575 -2.321 -3.526 1.00 0.00 H new ATOM 0 HG13 ILE A1999 -3.078 -2.302 -4.428 1.00 0.00 H new ATOM 0 HG21 ILE A1999 -1.724 -4.808 -1.976 1.00 0.00 H new ATOM 0 HG22 ILE A1999 -1.255 -5.981 -3.230 1.00 0.00 H new ATOM 0 HG23 ILE A1999 -0.389 -4.432 -3.092 1.00 0.00 H new ATOM 0 HD11 ILE A1999 -3.410 -1.455 -2.155 1.00 0.00 H new ATOM 0 HD12 ILE A1999 -4.323 -2.964 -2.394 1.00 0.00 H new ATOM 0 HD13 ILE A1999 -2.797 -2.983 -1.479 1.00 0.00 H new ATOM 992 N ASN A2000 -2.617 -6.690 -5.990 1.00 0.00 N ATOM 993 CA ASN A2000 -2.466 -8.095 -6.326 1.00 0.00 C ATOM 994 C ASN A2000 -1.707 -8.243 -7.616 1.00 0.00 C ATOM 995 O ASN A2000 -0.808 -9.063 -7.678 1.00 0.00 O ATOM 996 CB ASN A2000 -3.813 -8.791 -6.532 1.00 0.00 C ATOM 997 CG ASN A2000 -4.639 -8.784 -5.279 1.00 0.00 C ATOM 998 OD1 ASN A2000 -4.118 -8.700 -4.179 1.00 0.00 O ATOM 999 ND2 ASN A2000 -5.942 -8.859 -5.419 1.00 0.00 N ATOM 0 H ASN A2000 -3.587 -6.380 -5.925 1.00 0.00 H new ATOM 0 HA ASN A2000 -1.938 -8.551 -5.488 1.00 0.00 H new ATOM 0 HB2 ASN A2000 -4.361 -8.293 -7.332 1.00 0.00 H new ATOM 0 HB3 ASN A2000 -3.646 -9.819 -6.852 1.00 0.00 H new ATOM 0 HD21 ASN A2000 -6.545 -8.848 -4.596 1.00 0.00 H new ATOM 0 HD22 ASN A2000 -6.352 -8.928 -6.351 1.00 0.00 H new ATOM 1006 N GLN A2001 -2.073 -7.468 -8.631 1.00 0.00 N ATOM 1007 CA GLN A2001 -1.428 -7.521 -9.930 1.00 0.00 C ATOM 1008 C GLN A2001 0.023 -7.073 -9.802 1.00 0.00 C ATOM 1009 O GLN A2001 0.902 -7.672 -10.423 1.00 0.00 O ATOM 1010 CB GLN A2001 -2.180 -6.658 -10.953 1.00 0.00 C ATOM 1011 CG GLN A2001 -3.649 -7.078 -11.127 1.00 0.00 C ATOM 1012 CD GLN A2001 -4.072 -7.120 -12.591 1.00 0.00 C ATOM 1013 OE1 GLN A2001 -3.596 -7.940 -13.377 1.00 0.00 O ATOM 1014 NE2 GLN A2001 -4.974 -6.255 -13.006 1.00 0.00 N ATOM 0 H GLN A2001 -2.828 -6.785 -8.572 1.00 0.00 H new ATOM 0 HA GLN A2001 -1.449 -8.550 -10.290 1.00 0.00 H new ATOM 0 HB2 GLN A2001 -2.141 -5.615 -10.639 1.00 0.00 H new ATOM 0 HB3 GLN A2001 -1.673 -6.721 -11.916 1.00 0.00 H new ATOM 0 HG2 GLN A2001 -3.798 -8.061 -10.680 1.00 0.00 H new ATOM 0 HG3 GLN A2001 -4.290 -6.381 -10.586 1.00 0.00 H new ATOM 0 HE21 GLN A2001 -5.368 -5.576 -12.354 1.00 0.00 H new ATOM 0 HE22 GLN A2001 -5.279 -6.264 -13.979 1.00 0.00 H new ATOM 1023 N THR A2002 0.289 -6.077 -8.953 1.00 0.00 N ATOM 1024 CA THR A2002 1.628 -5.560 -8.767 1.00 0.00 C ATOM 1025 C THR A2002 2.579 -6.612 -8.193 1.00 0.00 C ATOM 1026 O THR A2002 3.716 -6.740 -8.650 1.00 0.00 O ATOM 1027 CB THR A2002 1.626 -4.353 -7.809 1.00 0.00 C ATOM 1028 OG1 THR A2002 0.739 -3.321 -8.185 1.00 0.00 O ATOM 1029 CG2 THR A2002 3.019 -3.720 -7.702 1.00 0.00 C ATOM 0 H THR A2002 -0.420 -5.615 -8.383 1.00 0.00 H new ATOM 0 HA THR A2002 1.975 -5.262 -9.756 1.00 0.00 H new ATOM 0 HB THR A2002 1.299 -4.772 -6.857 1.00 0.00 H new ATOM 0 HG1 THR A2002 -0.179 -3.581 -7.961 1.00 0.00 H new ATOM 0 HG21 THR A2002 2.982 -2.872 -7.019 1.00 0.00 H new ATOM 0 HG22 THR A2002 3.726 -4.459 -7.325 1.00 0.00 H new ATOM 0 HG23 THR A2002 3.340 -3.379 -8.686 1.00 0.00 H new ATOM 1037 N TYR A2003 2.115 -7.364 -7.196 1.00 0.00 N ATOM 1038 CA TYR A2003 2.924 -8.367 -6.509 1.00 0.00 C ATOM 1039 C TYR A2003 2.585 -9.823 -6.835 1.00 0.00 C ATOM 1040 O TYR A2003 3.217 -10.720 -6.286 1.00 0.00 O ATOM 1041 CB TYR A2003 2.819 -8.036 -5.015 1.00 0.00 C ATOM 1042 CG TYR A2003 3.242 -6.614 -4.688 1.00 0.00 C ATOM 1043 CD1 TYR A2003 4.536 -6.167 -5.014 1.00 0.00 C ATOM 1044 CD2 TYR A2003 2.320 -5.720 -4.110 1.00 0.00 C ATOM 1045 CE1 TYR A2003 4.921 -4.844 -4.739 1.00 0.00 C ATOM 1046 CE2 TYR A2003 2.694 -4.394 -3.834 1.00 0.00 C ATOM 1047 CZ TYR A2003 4.000 -3.957 -4.145 1.00 0.00 C ATOM 1048 OH TYR A2003 4.357 -2.675 -3.877 1.00 0.00 O ATOM 0 H TYR A2003 1.161 -7.293 -6.841 1.00 0.00 H new ATOM 0 HA TYR A2003 3.953 -8.307 -6.863 1.00 0.00 H new ATOM 0 HB2 TYR A2003 1.791 -8.187 -4.687 1.00 0.00 H new ATOM 0 HB3 TYR A2003 3.439 -8.732 -4.450 1.00 0.00 H new ATOM 0 HD1 TYR A2003 5.237 -6.845 -5.478 1.00 0.00 H new ATOM 0 HD2 TYR A2003 1.320 -6.055 -3.878 1.00 0.00 H new ATOM 0 HE1 TYR A2003 5.918 -4.508 -4.982 1.00 0.00 H new ATOM 0 HE2 TYR A2003 1.986 -3.712 -3.386 1.00 0.00 H new ATOM 0 HH TYR A2003 3.601 -2.203 -3.469 1.00 0.00 H new ATOM 1058 N ASN A2004 1.671 -10.063 -7.774 1.00 0.00 N ATOM 1059 CA ASN A2004 1.186 -11.372 -8.221 1.00 0.00 C ATOM 1060 C ASN A2004 0.643 -12.192 -7.038 1.00 0.00 C ATOM 1061 O ASN A2004 0.940 -13.383 -6.882 1.00 0.00 O ATOM 1062 CB ASN A2004 2.275 -12.079 -9.044 1.00 0.00 C ATOM 1063 CG ASN A2004 1.753 -12.860 -10.242 1.00 0.00 C ATOM 1064 OD1 ASN A2004 0.609 -12.731 -10.678 1.00 0.00 O ATOM 1065 ND2 ASN A2004 2.632 -13.607 -10.884 1.00 0.00 N ATOM 0 H ASN A2004 1.219 -9.299 -8.277 1.00 0.00 H new ATOM 0 HA ASN A2004 0.334 -11.248 -8.890 1.00 0.00 H new ATOM 0 HB2 ASN A2004 2.989 -11.334 -9.395 1.00 0.00 H new ATOM 0 HB3 ASN A2004 2.821 -12.761 -8.392 1.00 0.00 H new ATOM 0 HD21 ASN A2004 2.365 -14.081 -11.747 1.00 0.00 H new ATOM 0 HD22 ASN A2004 3.578 -13.710 -10.517 1.00 0.00 H new ATOM 1072 N LEU A2005 -0.113 -11.508 -6.167 1.00 0.00 N ATOM 1073 CA LEU A2005 -0.726 -12.042 -4.952 1.00 0.00 C ATOM 1074 C LEU A2005 -2.245 -12.133 -5.104 1.00 0.00 C ATOM 1075 O LEU A2005 -2.787 -11.986 -6.197 1.00 0.00 O ATOM 1076 CB LEU A2005 -0.332 -11.183 -3.730 1.00 0.00 C ATOM 1077 CG LEU A2005 1.180 -10.997 -3.509 1.00 0.00 C ATOM 1078 CD1 LEU A2005 1.400 -10.195 -2.223 1.00 0.00 C ATOM 1079 CD2 LEU A2005 1.948 -12.320 -3.462 1.00 0.00 C ATOM 0 H LEU A2005 -0.321 -10.519 -6.302 1.00 0.00 H new ATOM 0 HA LEU A2005 -0.352 -13.053 -4.788 1.00 0.00 H new ATOM 0 HB2 LEU A2005 -0.789 -10.199 -3.837 1.00 0.00 H new ATOM 0 HB3 LEU A2005 -0.759 -11.637 -2.836 1.00 0.00 H new ATOM 0 HG LEU A2005 1.577 -10.453 -4.366 1.00 0.00 H new ATOM 0 HD11 LEU A2005 2.469 -10.058 -2.058 1.00 0.00 H new ATOM 0 HD12 LEU A2005 0.919 -9.221 -2.315 1.00 0.00 H new ATOM 0 HD13 LEU A2005 0.969 -10.734 -1.380 1.00 0.00 H new ATOM 0 HD21 LEU A2005 3.008 -12.120 -3.304 1.00 0.00 H new ATOM 0 HD22 LEU A2005 1.568 -12.932 -2.644 1.00 0.00 H new ATOM 0 HD23 LEU A2005 1.816 -12.851 -4.405 1.00 0.00 H new ATOM 1091 N ASN A2006 -2.953 -12.397 -4.006 1.00 0.00 N ATOM 1092 CA ASN A2006 -4.404 -12.519 -3.945 1.00 0.00 C ATOM 1093 C ASN A2006 -4.844 -11.907 -2.631 1.00 0.00 C ATOM 1094 O ASN A2006 -4.528 -12.427 -1.562 1.00 0.00 O ATOM 1095 CB ASN A2006 -4.770 -13.997 -4.002 1.00 0.00 C ATOM 1096 CG ASN A2006 -6.212 -14.308 -3.620 1.00 0.00 C ATOM 1097 OD1 ASN A2006 -7.117 -13.489 -3.753 1.00 0.00 O ATOM 1098 ND2 ASN A2006 -6.452 -15.506 -3.114 1.00 0.00 N ATOM 0 H ASN A2006 -2.510 -12.537 -3.098 1.00 0.00 H new ATOM 0 HA ASN A2006 -4.894 -12.011 -4.776 1.00 0.00 H new ATOM 0 HB2 ASN A2006 -4.588 -14.364 -5.012 1.00 0.00 H new ATOM 0 HB3 ASN A2006 -4.105 -14.549 -3.338 1.00 0.00 H new ATOM 0 HD21 ASN A2006 -7.398 -15.759 -2.829 1.00 0.00 H new ATOM 0 HD22 ASN A2006 -5.691 -16.177 -3.009 1.00 0.00 H new ATOM 1105 N LEU A2007 -5.571 -10.801 -2.722 1.00 0.00 N ATOM 1106 CA LEU A2007 -6.099 -10.009 -1.626 1.00 0.00 C ATOM 1107 C LEU A2007 -7.415 -9.430 -2.087 1.00 0.00 C ATOM 1108 O LEU A2007 -7.769 -9.449 -3.271 1.00 0.00 O ATOM 1109 CB LEU A2007 -5.150 -8.836 -1.296 1.00 0.00 C ATOM 1110 CG LEU A2007 -3.648 -9.162 -1.135 1.00 0.00 C ATOM 1111 CD1 LEU A2007 -2.815 -7.879 -1.200 1.00 0.00 C ATOM 1112 CD2 LEU A2007 -3.365 -9.925 0.155 1.00 0.00 C ATOM 0 H LEU A2007 -5.823 -10.409 -3.629 1.00 0.00 H new ATOM 0 HA LEU A2007 -6.211 -10.634 -0.740 1.00 0.00 H new ATOM 0 HB2 LEU A2007 -5.250 -8.089 -2.084 1.00 0.00 H new ATOM 0 HB3 LEU A2007 -5.495 -8.373 -0.372 1.00 0.00 H new ATOM 0 HG LEU A2007 -3.361 -9.811 -1.962 1.00 0.00 H new ATOM 0 HD11 LEU A2007 -1.759 -8.124 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A2007 -2.972 -7.392 -2.162 1.00 0.00 H new ATOM 0 HD13 LEU A2007 -3.120 -7.206 -0.399 1.00 0.00 H new ATOM 0 HD21 LEU A2007 -2.298 -10.133 0.228 1.00 0.00 H new ATOM 0 HD22 LEU A2007 -3.676 -9.324 1.009 1.00 0.00 H new ATOM 0 HD23 LEU A2007 -3.919 -10.864 0.151 1.00 0.00 H new ATOM 1124 N LYS A2008 -8.171 -8.987 -1.100 1.00 0.00 N ATOM 1125 CA LYS A2008 -9.473 -8.394 -1.260 1.00 0.00 C ATOM 1126 C LYS A2008 -9.610 -7.191 -0.370 1.00 0.00 C ATOM 1127 O LYS A2008 -8.730 -6.913 0.441 1.00 0.00 O ATOM 1128 CB LYS A2008 -10.556 -9.448 -1.065 1.00 0.00 C ATOM 1129 CG LYS A2008 -10.307 -10.638 -0.130 1.00 0.00 C ATOM 1130 CD LYS A2008 -11.393 -10.719 0.917 1.00 0.00 C ATOM 1131 CE LYS A2008 -12.740 -11.191 0.352 1.00 0.00 C ATOM 1132 NZ LYS A2008 -12.881 -12.664 0.402 1.00 0.00 N ATOM 0 H LYS A2008 -7.876 -9.036 -0.125 1.00 0.00 H new ATOM 0 HA LYS A2008 -9.598 -8.023 -2.277 1.00 0.00 H new ATOM 0 HB2 LYS A2008 -11.448 -8.934 -0.706 1.00 0.00 H new ATOM 0 HB3 LYS A2008 -10.796 -9.853 -2.048 1.00 0.00 H new ATOM 0 HG2 LYS A2008 -10.279 -11.563 -0.707 1.00 0.00 H new ATOM 0 HG3 LYS A2008 -9.335 -10.533 0.352 1.00 0.00 H new ATOM 0 HD2 LYS A2008 -11.078 -11.401 1.707 1.00 0.00 H new ATOM 0 HD3 LYS A2008 -11.522 -9.738 1.375 1.00 0.00 H new ATOM 0 HE2 LYS A2008 -13.551 -10.731 0.917 1.00 0.00 H new ATOM 0 HE3 LYS A2008 -12.838 -10.853 -0.680 1.00 0.00 H new ATOM 0 HZ1 LYS A2008 -13.805 -12.938 0.011 1.00 0.00 H new ATOM 0 HZ2 LYS A2008 -12.123 -13.104 -0.158 1.00 0.00 H new ATOM 0 HZ3 LYS A2008 -12.814 -12.986 1.389 1.00 0.00 H new ATOM 1146 N ALA A2009 -10.778 -6.557 -0.455 1.00 0.00 N ATOM 1147 CA ALA A2009 -11.149 -5.377 0.316 1.00 0.00 C ATOM 1148 C ALA A2009 -10.900 -5.567 1.820 1.00 0.00 C ATOM 1149 O ALA A2009 -10.704 -4.584 2.525 1.00 0.00 O ATOM 1150 CB ALA A2009 -12.608 -5.046 0.051 1.00 0.00 C ATOM 0 H ALA A2009 -11.518 -6.864 -1.087 1.00 0.00 H new ATOM 0 HA ALA A2009 -10.518 -4.547 -0.004 1.00 0.00 H new ATOM 0 HB1 ALA A2009 -12.891 -4.164 0.625 1.00 0.00 H new ATOM 0 HB2 ALA A2009 -12.749 -4.848 -1.012 1.00 0.00 H new ATOM 0 HB3 ALA A2009 -13.232 -5.889 0.349 1.00 0.00 H new ATOM 1156 N THR A2010 -10.872 -6.817 2.306 1.00 0.00 N ATOM 1157 CA THR A2010 -10.598 -7.142 3.701 1.00 0.00 C ATOM 1158 C THR A2010 -9.262 -6.483 4.061 1.00 0.00 C ATOM 1159 O THR A2010 -9.133 -5.913 5.136 1.00 0.00 O ATOM 1160 CB THR A2010 -10.541 -8.682 3.846 1.00 0.00 C ATOM 1161 OG1 THR A2010 -10.450 -9.156 5.169 1.00 0.00 O ATOM 1162 CG2 THR A2010 -9.358 -9.330 3.103 1.00 0.00 C ATOM 0 H THR A2010 -11.043 -7.639 1.726 1.00 0.00 H new ATOM 0 HA THR A2010 -11.372 -6.775 4.375 1.00 0.00 H new ATOM 0 HB THR A2010 -11.498 -8.968 3.409 1.00 0.00 H new ATOM 0 HG1 THR A2010 -10.421 -10.136 5.164 1.00 0.00 H new ATOM 0 HG21 THR A2010 -9.383 -10.410 3.250 1.00 0.00 H new ATOM 0 HG22 THR A2010 -9.431 -9.107 2.039 1.00 0.00 H new ATOM 0 HG23 THR A2010 -8.421 -8.933 3.494 1.00 0.00 H new ATOM 1170 N LYS A2011 -8.274 -6.504 3.154 1.00 0.00 N ATOM 1171 CA LYS A2011 -6.977 -5.886 3.428 1.00 0.00 C ATOM 1172 C LYS A2011 -7.105 -4.387 3.644 1.00 0.00 C ATOM 1173 O LYS A2011 -6.480 -3.858 4.555 1.00 0.00 O ATOM 1174 CB LYS A2011 -6.011 -6.154 2.282 1.00 0.00 C ATOM 1175 CG LYS A2011 -5.515 -7.600 2.255 1.00 0.00 C ATOM 1176 CD LYS A2011 -4.749 -8.060 3.510 1.00 0.00 C ATOM 1177 CE LYS A2011 -5.430 -9.230 4.233 1.00 0.00 C ATOM 1178 NZ LYS A2011 -4.487 -10.093 4.981 1.00 0.00 N ATOM 0 H LYS A2011 -8.351 -6.939 2.234 1.00 0.00 H new ATOM 0 HA LYS A2011 -6.590 -6.331 4.345 1.00 0.00 H new ATOM 0 HB2 LYS A2011 -6.503 -5.925 1.337 1.00 0.00 H new ATOM 0 HB3 LYS A2011 -5.157 -5.483 2.368 1.00 0.00 H new ATOM 0 HG2 LYS A2011 -6.372 -8.258 2.112 1.00 0.00 H new ATOM 0 HG3 LYS A2011 -4.867 -7.728 1.388 1.00 0.00 H new ATOM 0 HD2 LYS A2011 -3.739 -8.355 3.225 1.00 0.00 H new ATOM 0 HD3 LYS A2011 -4.654 -7.221 4.199 1.00 0.00 H new ATOM 0 HE2 LYS A2011 -6.175 -8.835 4.924 1.00 0.00 H new ATOM 0 HE3 LYS A2011 -5.964 -9.837 3.502 1.00 0.00 H new ATOM 0 HZ1 LYS A2011 -4.921 -11.025 5.140 1.00 0.00 H new ATOM 0 HZ2 LYS A2011 -3.611 -10.208 4.432 1.00 0.00 H new ATOM 0 HZ3 LYS A2011 -4.266 -9.653 5.897 1.00 0.00 H new ATOM 1192 N LEU A2012 -7.894 -3.713 2.810 1.00 0.00 N ATOM 1193 CA LEU A2012 -8.114 -2.272 2.890 1.00 0.00 C ATOM 1194 C LEU A2012 -8.756 -1.868 4.215 1.00 0.00 C ATOM 1195 O LEU A2012 -8.561 -0.733 4.647 1.00 0.00 O ATOM 1196 CB LEU A2012 -8.976 -1.810 1.690 1.00 0.00 C ATOM 1197 CG LEU A2012 -8.153 -1.253 0.514 1.00 0.00 C ATOM 1198 CD1 LEU A2012 -7.565 0.101 0.945 1.00 0.00 C ATOM 1199 CD2 LEU A2012 -7.070 -2.245 0.050 1.00 0.00 C ATOM 0 H LEU A2012 -8.406 -4.160 2.049 1.00 0.00 H new ATOM 0 HA LEU A2012 -7.145 -1.775 2.846 1.00 0.00 H new ATOM 0 HB2 LEU A2012 -9.573 -2.651 1.338 1.00 0.00 H new ATOM 0 HB3 LEU A2012 -9.673 -1.044 2.029 1.00 0.00 H new ATOM 0 HG LEU A2012 -8.796 -1.107 -0.354 1.00 0.00 H new ATOM 0 HD11 LEU A2012 -6.976 0.518 0.128 1.00 0.00 H new ATOM 0 HD12 LEU A2012 -8.375 0.786 1.195 1.00 0.00 H new ATOM 0 HD13 LEU A2012 -6.927 -0.041 1.817 1.00 0.00 H new ATOM 0 HD21 LEU A2012 -6.513 -1.813 -0.781 1.00 0.00 H new ATOM 0 HD22 LEU A2012 -6.389 -2.452 0.875 1.00 0.00 H new ATOM 0 HD23 LEU A2012 -7.541 -3.173 -0.273 1.00 0.00 H new ATOM 1211 N TYR A2013 -9.501 -2.771 4.850 1.00 0.00 N ATOM 1212 CA TYR A2013 -10.178 -2.529 6.113 1.00 0.00 C ATOM 1213 C TYR A2013 -9.331 -2.968 7.305 1.00 0.00 C ATOM 1214 O TYR A2013 -9.362 -2.326 8.352 1.00 0.00 O ATOM 1215 CB TYR A2013 -11.521 -3.258 6.054 1.00 0.00 C ATOM 1216 CG TYR A2013 -12.435 -3.036 7.240 1.00 0.00 C ATOM 1217 CD1 TYR A2013 -13.243 -1.885 7.314 1.00 0.00 C ATOM 1218 CD2 TYR A2013 -12.530 -4.021 8.235 1.00 0.00 C ATOM 1219 CE1 TYR A2013 -14.185 -1.746 8.352 1.00 0.00 C ATOM 1220 CE2 TYR A2013 -13.452 -3.879 9.283 1.00 0.00 C ATOM 1221 CZ TYR A2013 -14.292 -2.749 9.342 1.00 0.00 C ATOM 1222 OH TYR A2013 -15.178 -2.652 10.372 1.00 0.00 O ATOM 0 H TYR A2013 -9.651 -3.713 4.488 1.00 0.00 H new ATOM 0 HA TYR A2013 -10.341 -1.461 6.259 1.00 0.00 H new ATOM 0 HB2 TYR A2013 -12.045 -2.946 5.150 1.00 0.00 H new ATOM 0 HB3 TYR A2013 -11.331 -4.327 5.959 1.00 0.00 H new ATOM 0 HD1 TYR A2013 -13.140 -1.106 6.573 1.00 0.00 H new ATOM 0 HD2 TYR A2013 -11.891 -4.891 8.194 1.00 0.00 H new ATOM 0 HE1 TYR A2013 -14.823 -0.876 8.391 1.00 0.00 H new ATOM 0 HE2 TYR A2013 -13.518 -4.639 10.048 1.00 0.00 H new ATOM 0 HH TYR A2013 -15.100 -3.442 10.946 1.00 0.00 H new ATOM 1232 N ASP A2014 -8.555 -4.044 7.167 1.00 0.00 N ATOM 1233 CA ASP A2014 -7.705 -4.567 8.227 1.00 0.00 C ATOM 1234 C ASP A2014 -6.486 -3.673 8.427 1.00 0.00 C ATOM 1235 O ASP A2014 -6.065 -3.400 9.555 1.00 0.00 O ATOM 1236 CB ASP A2014 -7.251 -5.964 7.784 1.00 0.00 C ATOM 1237 CG ASP A2014 -6.793 -6.867 8.923 1.00 0.00 C ATOM 1238 OD1 ASP A2014 -7.280 -6.715 10.068 1.00 0.00 O ATOM 1239 OD2 ASP A2014 -6.138 -7.889 8.634 1.00 0.00 O ATOM 0 H ASP A2014 -8.502 -4.581 6.302 1.00 0.00 H new ATOM 0 HA ASP A2014 -8.250 -4.604 9.170 1.00 0.00 H new ATOM 0 HB2 ASP A2014 -8.073 -6.450 7.259 1.00 0.00 H new ATOM 0 HB3 ASP A2014 -6.435 -5.858 7.070 1.00 0.00 H new ATOM 1244 N TYR A2015 -5.969 -3.173 7.305 1.00 0.00 N ATOM 1245 CA TYR A2015 -4.808 -2.323 7.187 1.00 0.00 C ATOM 1246 C TYR A2015 -5.183 -1.080 6.369 1.00 0.00 C ATOM 1247 O TYR A2015 -4.892 -0.985 5.177 1.00 0.00 O ATOM 1248 CB TYR A2015 -3.703 -3.150 6.546 1.00 0.00 C ATOM 1249 CG TYR A2015 -3.477 -4.519 7.152 1.00 0.00 C ATOM 1250 CD1 TYR A2015 -3.208 -4.668 8.524 1.00 0.00 C ATOM 1251 CD2 TYR A2015 -3.625 -5.654 6.338 1.00 0.00 C ATOM 1252 CE1 TYR A2015 -2.989 -5.948 9.052 1.00 0.00 C ATOM 1253 CE2 TYR A2015 -3.427 -6.941 6.863 1.00 0.00 C ATOM 1254 CZ TYR A2015 -3.034 -7.083 8.216 1.00 0.00 C ATOM 1255 OH TYR A2015 -2.679 -8.288 8.735 1.00 0.00 O ATOM 0 H TYR A2015 -6.388 -3.372 6.396 1.00 0.00 H new ATOM 0 HA TYR A2015 -4.451 -1.966 8.153 1.00 0.00 H new ATOM 0 HB2 TYR A2015 -3.933 -3.274 5.488 1.00 0.00 H new ATOM 0 HB3 TYR A2015 -2.771 -2.587 6.605 1.00 0.00 H new ATOM 0 HD1 TYR A2015 -3.170 -3.801 9.167 1.00 0.00 H new ATOM 0 HD2 TYR A2015 -3.894 -5.536 5.299 1.00 0.00 H new ATOM 0 HE1 TYR A2015 -2.784 -6.066 10.106 1.00 0.00 H new ATOM 0 HE2 TYR A2015 -3.573 -7.813 6.242 1.00 0.00 H new ATOM 0 HH TYR A2015 -2.760 -8.978 8.044 1.00 0.00 H new ATOM 1265 N PRO A2016 -5.849 -0.104 6.996 1.00 0.00 N ATOM 1266 CA PRO A2016 -6.278 1.134 6.356 1.00 0.00 C ATOM 1267 C PRO A2016 -5.146 2.144 6.148 1.00 0.00 C ATOM 1268 O PRO A2016 -5.442 3.242 5.687 1.00 0.00 O ATOM 1269 CB PRO A2016 -7.310 1.703 7.331 1.00 0.00 C ATOM 1270 CG PRO A2016 -6.845 1.215 8.701 1.00 0.00 C ATOM 1271 CD PRO A2016 -6.233 -0.137 8.399 1.00 0.00 C ATOM 0 HA PRO A2016 -6.660 0.939 5.354 1.00 0.00 H new ATOM 0 HB2 PRO A2016 -7.341 2.792 7.286 1.00 0.00 H new ATOM 0 HB3 PRO A2016 -8.314 1.345 7.101 1.00 0.00 H new ATOM 0 HG2 PRO A2016 -6.118 1.895 9.145 1.00 0.00 H new ATOM 0 HG3 PRO A2016 -7.675 1.133 9.402 1.00 0.00 H new ATOM 0 HD2 PRO A2016 -5.368 -0.324 9.035 1.00 0.00 H new ATOM 0 HD3 PRO A2016 -6.947 -0.939 8.589 1.00 0.00 H new ATOM 1279 N THR A2017 -3.900 1.836 6.503 1.00 0.00 N ATOM 1280 CA THR A2017 -2.762 2.743 6.348 1.00 0.00 C ATOM 1281 C THR A2017 -1.695 2.091 5.471 1.00 0.00 C ATOM 1282 O THR A2017 -1.642 0.864 5.346 1.00 0.00 O ATOM 1283 CB THR A2017 -2.185 3.146 7.718 1.00 0.00 C ATOM 1284 OG1 THR A2017 -1.547 2.053 8.323 1.00 0.00 O ATOM 1285 CG2 THR A2017 -3.218 3.660 8.714 1.00 0.00 C ATOM 0 H THR A2017 -3.648 0.936 6.912 1.00 0.00 H new ATOM 0 HA THR A2017 -3.105 3.655 5.859 1.00 0.00 H new ATOM 0 HB THR A2017 -1.495 3.959 7.492 1.00 0.00 H new ATOM 0 HG1 THR A2017 -1.198 2.321 9.199 1.00 0.00 H new ATOM 0 HG21 THR A2017 -2.723 3.920 9.650 1.00 0.00 H new ATOM 0 HG22 THR A2017 -3.709 4.543 8.306 1.00 0.00 H new ATOM 0 HG23 THR A2017 -3.961 2.885 8.900 1.00 0.00 H new ATOM 1293 N LEU A2018 -0.820 2.896 4.859 1.00 0.00 N ATOM 1294 CA LEU A2018 0.245 2.372 4.007 1.00 0.00 C ATOM 1295 C LEU A2018 1.195 1.525 4.830 1.00 0.00 C ATOM 1296 O LEU A2018 1.638 0.502 4.323 1.00 0.00 O ATOM 1297 CB LEU A2018 1.075 3.489 3.352 1.00 0.00 C ATOM 1298 CG LEU A2018 0.316 4.469 2.445 1.00 0.00 C ATOM 1299 CD1 LEU A2018 1.277 5.573 2.011 1.00 0.00 C ATOM 1300 CD2 LEU A2018 -0.202 3.791 1.172 1.00 0.00 C ATOM 0 H LEU A2018 -0.831 3.913 4.940 1.00 0.00 H new ATOM 0 HA LEU A2018 -0.242 1.786 3.227 1.00 0.00 H new ATOM 0 HB2 LEU A2018 1.559 4.062 4.143 1.00 0.00 H new ATOM 0 HB3 LEU A2018 1.867 3.025 2.764 1.00 0.00 H new ATOM 0 HG LEU A2018 -0.532 4.855 3.011 1.00 0.00 H new ATOM 0 HD11 LEU A2018 0.753 6.278 1.366 1.00 0.00 H new ATOM 0 HD12 LEU A2018 1.652 6.096 2.891 1.00 0.00 H new ATOM 0 HD13 LEU A2018 2.113 5.134 1.466 1.00 0.00 H new ATOM 0 HD21 LEU A2018 -0.732 4.521 0.561 1.00 0.00 H new ATOM 0 HD22 LEU A2018 0.638 3.387 0.607 1.00 0.00 H new ATOM 0 HD23 LEU A2018 -0.881 2.982 1.441 1.00 0.00 H new ATOM 1312 N LEU A2019 1.533 1.913 6.062 1.00 0.00 N ATOM 1313 CA LEU A2019 2.463 1.150 6.891 1.00 0.00 C ATOM 1314 C LEU A2019 1.939 -0.244 7.200 1.00 0.00 C ATOM 1315 O LEU A2019 2.718 -1.194 7.163 1.00 0.00 O ATOM 1316 CB LEU A2019 2.794 1.901 8.189 1.00 0.00 C ATOM 1317 CG LEU A2019 3.613 3.179 7.976 1.00 0.00 C ATOM 1318 CD1 LEU A2019 3.886 3.838 9.330 1.00 0.00 C ATOM 1319 CD2 LEU A2019 4.926 2.950 7.213 1.00 0.00 C ATOM 0 H LEU A2019 1.173 2.757 6.508 1.00 0.00 H new ATOM 0 HA LEU A2019 3.381 1.036 6.314 1.00 0.00 H new ATOM 0 HB2 LEU A2019 1.864 2.158 8.696 1.00 0.00 H new ATOM 0 HB3 LEU A2019 3.345 1.234 8.852 1.00 0.00 H new ATOM 0 HG LEU A2019 3.017 3.839 7.346 1.00 0.00 H new ATOM 0 HD11 LEU A2019 4.468 4.747 9.181 1.00 0.00 H new ATOM 0 HD12 LEU A2019 2.940 4.088 9.811 1.00 0.00 H new ATOM 0 HD13 LEU A2019 4.444 3.149 9.964 1.00 0.00 H new ATOM 0 HD21 LEU A2019 5.451 3.898 7.100 1.00 0.00 H new ATOM 0 HD22 LEU A2019 5.552 2.252 7.768 1.00 0.00 H new ATOM 0 HD23 LEU A2019 4.707 2.537 6.228 1.00 0.00 H new ATOM 1331 N GLU A2020 0.655 -0.381 7.517 1.00 0.00 N ATOM 1332 CA GLU A2020 0.101 -1.695 7.814 1.00 0.00 C ATOM 1333 C GLU A2020 -0.082 -2.508 6.534 1.00 0.00 C ATOM 1334 O GLU A2020 0.279 -3.686 6.493 1.00 0.00 O ATOM 1335 CB GLU A2020 -1.200 -1.567 8.603 1.00 0.00 C ATOM 1336 CG GLU A2020 -0.974 -0.818 9.914 1.00 0.00 C ATOM 1337 CD GLU A2020 -1.950 -1.218 11.006 1.00 0.00 C ATOM 1338 OE1 GLU A2020 -3.055 -0.630 11.058 1.00 0.00 O ATOM 1339 OE2 GLU A2020 -1.571 -2.082 11.827 1.00 0.00 O ATOM 0 H GLU A2020 -0.011 0.389 7.574 1.00 0.00 H new ATOM 0 HA GLU A2020 0.808 -2.237 8.442 1.00 0.00 H new ATOM 0 HB2 GLU A2020 -1.943 -1.041 8.003 1.00 0.00 H new ATOM 0 HB3 GLU A2020 -1.602 -2.558 8.811 1.00 0.00 H new ATOM 0 HG2 GLU A2020 0.043 -1.002 10.259 1.00 0.00 H new ATOM 0 HG3 GLU A2020 -1.060 0.253 9.733 1.00 0.00 H new ATOM 1346 N LEU A2021 -0.604 -1.879 5.471 1.00 0.00 N ATOM 1347 CA LEU A2021 -0.840 -2.553 4.198 1.00 0.00 C ATOM 1348 C LEU A2021 0.482 -3.069 3.635 1.00 0.00 C ATOM 1349 O LEU A2021 0.543 -4.180 3.110 1.00 0.00 O ATOM 1350 CB LEU A2021 -1.553 -1.602 3.216 1.00 0.00 C ATOM 1351 CG LEU A2021 -2.345 -2.320 2.108 1.00 0.00 C ATOM 1352 CD1 LEU A2021 -3.641 -2.939 2.640 1.00 0.00 C ATOM 1353 CD2 LEU A2021 -2.765 -1.320 1.029 1.00 0.00 C ATOM 0 H LEU A2021 -0.871 -0.895 5.475 1.00 0.00 H new ATOM 0 HA LEU A2021 -1.495 -3.411 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A2021 -2.233 -0.961 3.777 1.00 0.00 H new ATOM 0 HB3 LEU A2021 -0.811 -0.951 2.754 1.00 0.00 H new ATOM 0 HG LEU A2021 -1.688 -3.096 1.716 1.00 0.00 H new ATOM 0 HD11 LEU A2021 -4.168 -3.435 1.825 1.00 0.00 H new ATOM 0 HD12 LEU A2021 -3.405 -3.667 3.416 1.00 0.00 H new ATOM 0 HD13 LEU A2021 -4.274 -2.156 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A2021 -3.324 -1.838 0.250 1.00 0.00 H new ATOM 0 HD22 LEU A2021 -3.393 -0.547 1.473 1.00 0.00 H new ATOM 0 HD23 LEU A2021 -1.878 -0.861 0.593 1.00 0.00 H new ATOM 1365 N SER A2022 1.539 -2.263 3.756 1.00 0.00 N ATOM 1366 CA SER A2022 2.856 -2.627 3.278 1.00 0.00 C ATOM 1367 C SER A2022 3.470 -3.737 4.123 1.00 0.00 C ATOM 1368 O SER A2022 4.117 -4.612 3.558 1.00 0.00 O ATOM 1369 CB SER A2022 3.816 -1.437 3.239 1.00 0.00 C ATOM 1370 OG SER A2022 3.869 -0.738 4.455 1.00 0.00 O ATOM 0 H SER A2022 1.496 -1.341 4.190 1.00 0.00 H new ATOM 0 HA SER A2022 2.713 -2.985 2.258 1.00 0.00 H new ATOM 0 HB2 SER A2022 4.815 -1.791 2.985 1.00 0.00 H new ATOM 0 HB3 SER A2022 3.509 -0.755 2.447 1.00 0.00 H new ATOM 0 HG SER A2022 3.066 -0.184 4.549 1.00 0.00 H new ATOM 1376 N GLY A2023 3.256 -3.729 5.446 1.00 0.00 N ATOM 1377 CA GLY A2023 3.807 -4.709 6.370 1.00 0.00 C ATOM 1378 C GLY A2023 3.452 -6.133 5.982 1.00 0.00 C ATOM 1379 O GLY A2023 4.321 -7.009 5.975 1.00 0.00 O ATOM 0 H GLY A2023 2.682 -3.023 5.906 1.00 0.00 H new ATOM 0 HA2 GLY A2023 4.891 -4.604 6.403 1.00 0.00 H new ATOM 0 HA3 GLY A2023 3.436 -4.506 7.375 1.00 0.00 H new ATOM 1383 N TYR A2024 2.190 -6.361 5.622 1.00 0.00 N ATOM 1384 CA TYR A2024 1.755 -7.694 5.243 1.00 0.00 C ATOM 1385 C TYR A2024 2.461 -8.110 3.956 1.00 0.00 C ATOM 1386 O TYR A2024 3.103 -9.157 3.895 1.00 0.00 O ATOM 1387 CB TYR A2024 0.228 -7.735 5.105 1.00 0.00 C ATOM 1388 CG TYR A2024 -0.326 -9.102 4.725 1.00 0.00 C ATOM 1389 CD1 TYR A2024 0.113 -10.259 5.400 1.00 0.00 C ATOM 1390 CD2 TYR A2024 -1.246 -9.229 3.664 1.00 0.00 C ATOM 1391 CE1 TYR A2024 -0.329 -11.533 5.005 1.00 0.00 C ATOM 1392 CE2 TYR A2024 -1.743 -10.497 3.310 1.00 0.00 C ATOM 1393 CZ TYR A2024 -1.264 -11.655 3.956 1.00 0.00 C ATOM 1394 OH TYR A2024 -1.728 -12.870 3.553 1.00 0.00 O ATOM 0 H TYR A2024 1.463 -5.647 5.586 1.00 0.00 H new ATOM 0 HA TYR A2024 2.025 -8.409 6.020 1.00 0.00 H new ATOM 0 HB2 TYR A2024 -0.220 -7.423 6.049 1.00 0.00 H new ATOM 0 HB3 TYR A2024 -0.078 -7.009 4.352 1.00 0.00 H new ATOM 0 HD1 TYR A2024 0.797 -10.165 6.230 1.00 0.00 H new ATOM 0 HD2 TYR A2024 -1.569 -8.352 3.123 1.00 0.00 H new ATOM 0 HE1 TYR A2024 0.046 -12.415 5.503 1.00 0.00 H new ATOM 0 HE2 TYR A2024 -2.495 -10.584 2.540 1.00 0.00 H new ATOM 0 HH TYR A2024 -2.366 -12.750 2.819 1.00 0.00 H new ATOM 1404 N ILE A2025 2.367 -7.271 2.922 1.00 0.00 N ATOM 1405 CA ILE A2025 2.969 -7.530 1.623 1.00 0.00 C ATOM 1406 C ILE A2025 4.492 -7.723 1.740 1.00 0.00 C ATOM 1407 O ILE A2025 5.025 -8.584 1.046 1.00 0.00 O ATOM 1408 CB ILE A2025 2.572 -6.405 0.644 1.00 0.00 C ATOM 1409 CG1 ILE A2025 1.045 -6.193 0.498 1.00 0.00 C ATOM 1410 CG2 ILE A2025 3.172 -6.675 -0.743 1.00 0.00 C ATOM 1411 CD1 ILE A2025 0.672 -4.909 -0.267 1.00 0.00 C ATOM 0 H ILE A2025 1.864 -6.385 2.969 1.00 0.00 H new ATOM 0 HA ILE A2025 2.587 -8.469 1.221 1.00 0.00 H new ATOM 0 HB ILE A2025 2.975 -5.490 1.077 1.00 0.00 H new ATOM 0 HG12 ILE A2025 0.615 -7.051 -0.018 1.00 0.00 H new ATOM 0 HG13 ILE A2025 0.595 -6.159 1.490 1.00 0.00 H new ATOM 0 HG21 ILE A2025 2.885 -5.875 -1.425 1.00 0.00 H new ATOM 0 HG22 ILE A2025 4.259 -6.716 -0.668 1.00 0.00 H new ATOM 0 HG23 ILE A2025 2.799 -7.626 -1.122 1.00 0.00 H new ATOM 0 HD11 ILE A2025 -0.413 -4.826 -0.331 1.00 0.00 H new ATOM 0 HD12 ILE A2025 1.072 -4.043 0.260 1.00 0.00 H new ATOM 0 HD13 ILE A2025 1.093 -4.949 -1.272 1.00 0.00 H new ATOM 1423 N ALA A2026 5.194 -6.968 2.594 1.00 0.00 N ATOM 1424 CA ALA A2026 6.639 -7.061 2.808 1.00 0.00 C ATOM 1425 C ALA A2026 6.998 -8.491 3.174 1.00 0.00 C ATOM 1426 O ALA A2026 7.897 -9.047 2.555 1.00 0.00 O ATOM 1427 CB ALA A2026 7.062 -6.117 3.944 1.00 0.00 C ATOM 0 H ALA A2026 4.755 -6.252 3.173 1.00 0.00 H new ATOM 0 HA ALA A2026 7.160 -6.773 1.895 1.00 0.00 H new ATOM 0 HB1 ALA A2026 8.139 -6.192 4.097 1.00 0.00 H new ATOM 0 HB2 ALA A2026 6.803 -5.092 3.680 1.00 0.00 H new ATOM 0 HB3 ALA A2026 6.544 -6.397 4.862 1.00 0.00 H new ATOM 1433 N GLN A2027 6.301 -9.075 4.155 1.00 0.00 N ATOM 1434 CA GLN A2027 6.557 -10.437 4.604 1.00 0.00 C ATOM 1435 C GLN A2027 6.369 -11.418 3.450 1.00 0.00 C ATOM 1436 O GLN A2027 7.227 -12.279 3.240 1.00 0.00 O ATOM 1437 CB GLN A2027 5.631 -10.804 5.776 1.00 0.00 C ATOM 1438 CG GLN A2027 5.918 -9.970 7.033 1.00 0.00 C ATOM 1439 CD GLN A2027 4.991 -10.307 8.201 1.00 0.00 C ATOM 1440 OE1 GLN A2027 3.879 -10.817 8.040 1.00 0.00 O ATOM 1441 NE2 GLN A2027 5.406 -10.007 9.418 1.00 0.00 N ATOM 0 H GLN A2027 5.544 -8.611 4.657 1.00 0.00 H new ATOM 0 HA GLN A2027 7.589 -10.498 4.950 1.00 0.00 H new ATOM 0 HB2 GLN A2027 4.594 -10.658 5.475 1.00 0.00 H new ATOM 0 HB3 GLN A2027 5.749 -11.862 6.011 1.00 0.00 H new ATOM 0 HG2 GLN A2027 6.952 -10.130 7.340 1.00 0.00 H new ATOM 0 HG3 GLN A2027 5.817 -8.912 6.791 1.00 0.00 H new ATOM 0 HE21 GLN A2027 6.325 -9.585 9.554 1.00 0.00 H new ATOM 0 HE22 GLN A2027 4.808 -10.197 10.222 1.00 0.00 H new ATOM 1450 N ILE A2028 5.277 -11.267 2.689 1.00 0.00 N ATOM 1451 CA ILE A2028 4.974 -12.144 1.567 1.00 0.00 C ATOM 1452 C ILE A2028 6.076 -12.039 0.521 1.00 0.00 C ATOM 1453 O ILE A2028 6.703 -13.042 0.201 1.00 0.00 O ATOM 1454 CB ILE A2028 3.608 -11.799 0.924 1.00 0.00 C ATOM 1455 CG1 ILE A2028 2.438 -11.790 1.926 1.00 0.00 C ATOM 1456 CG2 ILE A2028 3.281 -12.797 -0.203 1.00 0.00 C ATOM 1457 CD1 ILE A2028 1.210 -11.059 1.378 1.00 0.00 C ATOM 0 H ILE A2028 4.585 -10.533 2.839 1.00 0.00 H new ATOM 0 HA ILE A2028 4.917 -13.165 1.945 1.00 0.00 H new ATOM 0 HB ILE A2028 3.713 -10.787 0.533 1.00 0.00 H new ATOM 0 HG12 ILE A2028 2.167 -12.816 2.174 1.00 0.00 H new ATOM 0 HG13 ILE A2028 2.759 -11.313 2.852 1.00 0.00 H new ATOM 0 HG21 ILE A2028 2.318 -12.543 -0.646 1.00 0.00 H new ATOM 0 HG22 ILE A2028 4.056 -12.749 -0.968 1.00 0.00 H new ATOM 0 HG23 ILE A2028 3.237 -13.806 0.206 1.00 0.00 H new ATOM 0 HD11 ILE A2028 0.413 -11.080 2.121 1.00 0.00 H new ATOM 0 HD12 ILE A2028 1.472 -10.025 1.155 1.00 0.00 H new ATOM 0 HD13 ILE A2028 0.870 -11.551 0.467 1.00 0.00 H new ATOM 1469 N LEU A2029 6.375 -10.841 0.034 1.00 0.00 N ATOM 1470 CA LEU A2029 7.376 -10.613 -0.994 1.00 0.00 C ATOM 1471 C LEU A2029 8.758 -11.068 -0.575 1.00 0.00 C ATOM 1472 O LEU A2029 9.454 -11.710 -1.362 1.00 0.00 O ATOM 1473 CB LEU A2029 7.408 -9.129 -1.349 1.00 0.00 C ATOM 1474 CG LEU A2029 6.204 -8.670 -2.184 1.00 0.00 C ATOM 1475 CD1 LEU A2029 6.269 -7.146 -2.320 1.00 0.00 C ATOM 1476 CD2 LEU A2029 6.239 -9.318 -3.570 1.00 0.00 C ATOM 0 H LEU A2029 5.918 -9.986 0.351 1.00 0.00 H new ATOM 0 HA LEU A2029 7.093 -11.208 -1.862 1.00 0.00 H new ATOM 0 HB2 LEU A2029 7.446 -8.545 -0.429 1.00 0.00 H new ATOM 0 HB3 LEU A2029 8.324 -8.916 -1.900 1.00 0.00 H new ATOM 0 HG LEU A2029 5.278 -8.967 -1.693 1.00 0.00 H new ATOM 0 HD11 LEU A2029 5.422 -6.797 -2.911 1.00 0.00 H new ATOM 0 HD12 LEU A2029 6.234 -6.691 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU A2029 7.198 -6.864 -2.816 1.00 0.00 H new ATOM 0 HD21 LEU A2029 5.379 -8.983 -4.150 1.00 0.00 H new ATOM 0 HD22 LEU A2029 7.157 -9.031 -4.083 1.00 0.00 H new ATOM 0 HD23 LEU A2029 6.206 -10.402 -3.466 1.00 0.00 H new ATOM 1488 N SER A2030 9.177 -10.743 0.646 1.00 0.00 N ATOM 1489 CA SER A2030 10.491 -11.159 1.093 1.00 0.00 C ATOM 1490 C SER A2030 10.575 -12.690 1.234 1.00 0.00 C ATOM 1491 O SER A2030 11.669 -13.241 1.131 1.00 0.00 O ATOM 1492 CB SER A2030 10.951 -10.298 2.272 1.00 0.00 C ATOM 1493 OG SER A2030 10.192 -10.368 3.463 1.00 0.00 O ATOM 0 H SER A2030 8.636 -10.206 1.324 1.00 0.00 H new ATOM 0 HA SER A2030 11.248 -10.961 0.334 1.00 0.00 H new ATOM 0 HB2 SER A2030 11.978 -10.574 2.510 1.00 0.00 H new ATOM 0 HB3 SER A2030 10.968 -9.259 1.944 1.00 0.00 H new ATOM 0 HG SER A2030 9.324 -9.936 3.323 1.00 0.00 H new