USER MOD reduce.3.24.130724 H: found=0, std=0, add=784, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 787 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 51:sc= 1.24 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -136:sc= -0.0703 (180deg=-1.13) USER MOD Single : A 30 TYR OH : rot 180:sc= -0.437 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 35 SER OG : rot -53:sc= 0.542 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 166:sc= -0.0652 (180deg=-0.4) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot -135:sc= 0.956 USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.484 USER MOD Single : A 90 MET CE :methyl 141:sc= -0.164 (180deg=-1.14) USER MOD Single : A 94 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.69) USER MOD Single : A 96 GLN : amide:sc= -0.248 K(o=-0.25,f=-2!) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= -0.0735 USER MOD Single : A 112 LYS NZ :NH3+ -113:sc= 0.404 (180deg=-0.053) USER MOD Single : A 117 ASN : amide:sc= -0.154 K(o=-0.15,f=-2.8!) USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.554 USER MOD Single : A 128 SER OG : rot 113:sc= 2.12 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 LYS NZ :NH3+ -151:sc= -0.0539 (180deg=-0.461) USER MOD Single : A 147 THR OG1 : rot -164:sc= -0.811 USER MOD Single : A 148 ASN : amide:sc= -1.16 K(o=-1.2,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 223 N GLY A 17 6.538 -8.963 -15.596 1.00 0.00 N ATOM 224 CA GLY A 17 7.291 -8.619 -14.404 1.00 0.00 C ATOM 225 C GLY A 17 6.826 -7.318 -13.781 1.00 0.00 C ATOM 226 O GLY A 17 7.368 -6.252 -14.073 1.00 0.00 O ATOM 0 HA2 GLY A 17 7.196 -9.422 -13.674 1.00 0.00 H new ATOM 0 HA3 GLY A 17 8.349 -8.540 -14.656 1.00 0.00 H new ATOM 230 N THR A 18 5.817 -7.404 -12.919 1.00 0.00 N ATOM 231 CA THR A 18 5.277 -6.224 -12.255 1.00 0.00 C ATOM 232 C THR A 18 5.823 -6.093 -10.838 1.00 0.00 C ATOM 233 O THR A 18 5.501 -6.896 -9.961 1.00 0.00 O ATOM 234 CB THR A 18 3.738 -6.266 -12.199 1.00 0.00 C ATOM 235 OG1 THR A 18 3.224 -6.942 -13.352 1.00 0.00 O ATOM 236 CG2 THR A 18 3.161 -4.860 -12.130 1.00 0.00 C ATOM 0 H THR A 18 5.358 -8.278 -12.665 1.00 0.00 H new ATOM 0 HA THR A 18 5.588 -5.360 -12.842 1.00 0.00 H new ATOM 0 HB THR A 18 3.444 -6.807 -11.300 1.00 0.00 H new ATOM 0 HG1 THR A 18 2.245 -6.966 -13.308 1.00 0.00 H new ATOM 0 HG21 THR A 18 2.073 -4.915 -12.091 1.00 0.00 H new ATOM 0 HG22 THR A 18 3.531 -4.358 -11.236 1.00 0.00 H new ATOM 0 HG23 THR A 18 3.465 -4.298 -13.013 1.00 0.00 H new ATOM 244 N THR A 19 6.649 -5.076 -10.618 1.00 0.00 N ATOM 245 CA THR A 19 7.240 -4.840 -9.307 1.00 0.00 C ATOM 246 C THR A 19 7.552 -3.362 -9.103 1.00 0.00 C ATOM 247 O THR A 19 7.935 -2.662 -10.040 1.00 0.00 O ATOM 248 CB THR A 19 8.532 -5.657 -9.117 1.00 0.00 C ATOM 249 OG1 THR A 19 9.313 -5.099 -8.054 1.00 0.00 O ATOM 250 CG2 THR A 19 9.352 -5.678 -10.399 1.00 0.00 C ATOM 0 H THR A 19 6.924 -4.401 -11.332 1.00 0.00 H new ATOM 0 HA THR A 19 6.506 -5.159 -8.567 1.00 0.00 H new ATOM 0 HB THR A 19 8.255 -6.681 -8.865 1.00 0.00 H new ATOM 0 HG1 THR A 19 8.751 -4.989 -7.258 1.00 0.00 H new ATOM 0 HG21 THR A 19 10.260 -6.261 -10.241 1.00 0.00 H new ATOM 0 HG22 THR A 19 8.765 -6.130 -11.199 1.00 0.00 H new ATOM 0 HG23 THR A 19 9.619 -4.658 -10.677 1.00 0.00 H new ATOM 258 N LEU A 20 7.386 -2.892 -7.871 1.00 0.00 N ATOM 259 CA LEU A 20 7.652 -1.496 -7.542 1.00 0.00 C ATOM 260 C LEU A 20 9.084 -1.315 -7.049 1.00 0.00 C ATOM 261 O LEU A 20 9.624 -2.175 -6.351 1.00 0.00 O ATOM 262 CB LEU A 20 6.668 -1.006 -6.478 1.00 0.00 C ATOM 263 CG LEU A 20 7.055 -1.289 -5.026 1.00 0.00 C ATOM 264 CD1 LEU A 20 6.113 -0.568 -4.073 1.00 0.00 C ATOM 265 CD2 LEU A 20 7.048 -2.786 -4.754 1.00 0.00 C ATOM 0 H LEU A 20 7.068 -3.457 -7.084 1.00 0.00 H new ATOM 0 HA LEU A 20 7.523 -0.904 -8.448 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.542 0.070 -6.596 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.698 -1.464 -6.670 1.00 0.00 H new ATOM 0 HG LEU A 20 8.065 -0.915 -4.860 1.00 0.00 H new ATOM 0 HD11 LEU A 20 6.403 -0.781 -3.044 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.168 0.506 -4.251 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.092 -0.912 -4.241 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.326 -2.968 -3.716 1.00 0.00 H new ATOM 0 HD22 LEU A 20 6.050 -3.185 -4.938 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.763 -3.279 -5.413 1.00 0.00 H new ATOM 277 N TRP A 21 9.692 -0.192 -7.413 1.00 0.00 N ATOM 278 CA TRP A 21 11.061 0.102 -7.005 1.00 0.00 C ATOM 279 C TRP A 21 11.139 1.446 -6.289 1.00 0.00 C ATOM 280 O TRP A 21 10.350 2.351 -6.560 1.00 0.00 O ATOM 281 CB TRP A 21 11.989 0.104 -8.221 1.00 0.00 C ATOM 282 CG TRP A 21 11.487 -0.743 -9.352 1.00 0.00 C ATOM 283 CD1 TRP A 21 11.084 -2.046 -9.283 1.00 0.00 C ATOM 284 CD2 TRP A 21 11.337 -0.347 -10.719 1.00 0.00 C ATOM 285 NE1 TRP A 21 10.693 -2.483 -10.526 1.00 0.00 N ATOM 286 CE2 TRP A 21 10.838 -1.459 -11.423 1.00 0.00 C ATOM 287 CE3 TRP A 21 11.573 0.841 -11.417 1.00 0.00 C ATOM 288 CZ2 TRP A 21 10.573 -1.418 -12.790 1.00 0.00 C ATOM 289 CZ3 TRP A 21 11.311 0.881 -12.772 1.00 0.00 C ATOM 290 CH2 TRP A 21 10.814 -0.241 -13.447 1.00 0.00 C ATOM 0 H TRP A 21 9.259 0.530 -7.989 1.00 0.00 H new ATOM 0 HA TRP A 21 11.382 -0.677 -6.313 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.115 1.128 -8.572 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.974 -0.253 -7.918 1.00 0.00 H new ATOM 0 HD1 TRP A 21 11.074 -2.645 -8.384 1.00 0.00 H new ATOM 0 HE1 TRP A 21 10.350 -3.419 -10.745 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.954 1.712 -10.905 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 10.191 -2.283 -13.312 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.492 1.793 -13.321 1.00 0.00 H new ATOM 0 HH2 TRP A 21 10.617 -0.177 -14.507 1.00 0.00 H new ATOM 301 N VAL A 22 12.095 1.570 -5.374 1.00 0.00 N ATOM 302 CA VAL A 22 12.277 2.805 -4.620 1.00 0.00 C ATOM 303 C VAL A 22 13.643 3.422 -4.898 1.00 0.00 C ATOM 304 O VAL A 22 14.628 2.712 -5.093 1.00 0.00 O ATOM 305 CB VAL A 22 12.131 2.564 -3.105 1.00 0.00 C ATOM 306 CG1 VAL A 22 13.346 1.825 -2.564 1.00 0.00 C ATOM 307 CG2 VAL A 22 11.929 3.883 -2.375 1.00 0.00 C ATOM 0 H VAL A 22 12.756 0.830 -5.137 1.00 0.00 H new ATOM 0 HA VAL A 22 11.498 3.494 -4.947 1.00 0.00 H new ATOM 0 HB VAL A 22 11.252 1.942 -2.934 1.00 0.00 H new ATOM 0 HG11 VAL A 22 13.226 1.663 -1.493 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.441 0.863 -3.068 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.242 2.419 -2.743 1.00 0.00 H new ATOM 0 HG21 VAL A 22 11.828 3.695 -1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 22 12.788 4.531 -2.550 1.00 0.00 H new ATOM 0 HG23 VAL A 22 11.026 4.369 -2.745 1.00 0.00 H new ATOM 317 N TYR A 23 13.693 4.750 -4.911 1.00 0.00 N ATOM 318 CA TYR A 23 14.939 5.463 -5.167 1.00 0.00 C ATOM 319 C TYR A 23 15.377 6.250 -3.935 1.00 0.00 C ATOM 320 O TYR A 23 14.569 6.916 -3.288 1.00 0.00 O ATOM 321 CB TYR A 23 14.774 6.410 -6.357 1.00 0.00 C ATOM 322 CG TYR A 23 14.002 7.668 -6.030 1.00 0.00 C ATOM 323 CD1 TYR A 23 14.650 8.794 -5.538 1.00 0.00 C ATOM 324 CD2 TYR A 23 12.627 7.730 -6.210 1.00 0.00 C ATOM 325 CE1 TYR A 23 13.950 9.947 -5.236 1.00 0.00 C ATOM 326 CE2 TYR A 23 11.918 8.878 -5.911 1.00 0.00 C ATOM 327 CZ TYR A 23 12.584 9.983 -5.425 1.00 0.00 C ATOM 328 OH TYR A 23 11.881 11.128 -5.126 1.00 0.00 O ATOM 0 H TYR A 23 12.887 5.353 -4.748 1.00 0.00 H new ATOM 0 HA TYR A 23 15.708 4.727 -5.401 1.00 0.00 H new ATOM 0 HB2 TYR A 23 15.760 6.686 -6.730 1.00 0.00 H new ATOM 0 HB3 TYR A 23 14.265 5.881 -7.163 1.00 0.00 H new ATOM 0 HD1 TYR A 23 15.719 8.768 -5.389 1.00 0.00 H new ATOM 0 HD2 TYR A 23 12.102 6.866 -6.590 1.00 0.00 H new ATOM 0 HE1 TYR A 23 14.469 10.814 -4.855 1.00 0.00 H new ATOM 0 HE2 TYR A 23 10.848 8.909 -6.057 1.00 0.00 H new ATOM 0 HH TYR A 23 10.930 10.987 -5.317 1.00 0.00 H new ATOM 338 N LYS A 24 16.665 6.170 -3.617 1.00 0.00 N ATOM 339 CA LYS A 24 17.215 6.874 -2.466 1.00 0.00 C ATOM 340 C LYS A 24 18.299 7.858 -2.897 1.00 0.00 C ATOM 341 O LYS A 24 19.474 7.681 -2.577 1.00 0.00 O ATOM 342 CB LYS A 24 17.789 5.876 -1.458 1.00 0.00 C ATOM 343 CG LYS A 24 16.786 4.834 -0.994 1.00 0.00 C ATOM 344 CD LYS A 24 17.345 3.985 0.135 1.00 0.00 C ATOM 345 CE LYS A 24 17.069 4.611 1.493 1.00 0.00 C ATOM 346 NZ LYS A 24 18.146 5.557 1.898 1.00 0.00 N ATOM 0 H LYS A 24 17.348 5.623 -4.142 1.00 0.00 H new ATOM 0 HA LYS A 24 16.407 7.434 -1.994 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.644 5.370 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS A 24 18.161 6.422 -0.591 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.874 5.329 -0.661 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.513 4.192 -1.832 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.903 2.989 0.096 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.420 3.862 0.001 1.00 0.00 H new ATOM 0 HE2 LYS A 24 16.115 5.138 1.463 1.00 0.00 H new ATOM 0 HE3 LYS A 24 16.975 3.825 2.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 18.388 5.400 2.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.988 5.398 1.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 17.815 6.535 1.772 1.00 0.00 H new ATOM 411 N TYR A 30 11.903 13.962 -9.553 1.00 0.00 N ATOM 412 CA TYR A 30 10.879 13.888 -10.587 1.00 0.00 C ATOM 413 C TYR A 30 11.488 14.082 -11.973 1.00 0.00 C ATOM 414 O TYR A 30 10.922 13.655 -12.978 1.00 0.00 O ATOM 415 CB TYR A 30 9.799 14.942 -10.341 1.00 0.00 C ATOM 416 CG TYR A 30 9.238 14.918 -8.936 1.00 0.00 C ATOM 417 CD1 TYR A 30 8.437 13.868 -8.505 1.00 0.00 C ATOM 418 CD2 TYR A 30 9.510 15.945 -8.041 1.00 0.00 C ATOM 419 CE1 TYR A 30 7.922 13.842 -7.224 1.00 0.00 C ATOM 420 CE2 TYR A 30 9.001 15.927 -6.757 1.00 0.00 C ATOM 421 CZ TYR A 30 8.207 14.873 -6.354 1.00 0.00 C ATOM 422 OH TYR A 30 7.697 14.851 -5.076 1.00 0.00 O ATOM 0 HA TYR A 30 10.427 12.897 -10.544 1.00 0.00 H new ATOM 0 HB2 TYR A 30 10.215 15.930 -10.540 1.00 0.00 H new ATOM 0 HB3 TYR A 30 8.986 14.789 -11.051 1.00 0.00 H new ATOM 0 HD1 TYR A 30 8.213 13.058 -9.183 1.00 0.00 H new ATOM 0 HD2 TYR A 30 10.130 16.772 -8.354 1.00 0.00 H new ATOM 0 HE1 TYR A 30 7.300 13.019 -6.905 1.00 0.00 H new ATOM 0 HE2 TYR A 30 9.223 16.733 -6.073 1.00 0.00 H new ATOM 0 HH TYR A 30 7.993 15.650 -4.592 1.00 0.00 H new ATOM 432 N ALA A 31 12.648 14.729 -12.016 1.00 0.00 N ATOM 433 CA ALA A 31 13.337 14.979 -13.277 1.00 0.00 C ATOM 434 C ALA A 31 13.493 13.692 -14.081 1.00 0.00 C ATOM 435 O ALA A 31 12.957 13.569 -15.181 1.00 0.00 O ATOM 436 CB ALA A 31 14.697 15.610 -13.019 1.00 0.00 C ATOM 0 H ALA A 31 13.130 15.090 -11.193 1.00 0.00 H new ATOM 0 HA ALA A 31 12.732 15.672 -13.862 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.200 15.791 -13.969 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.566 16.555 -12.492 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.301 14.937 -12.411 1.00 0.00 H new ATOM 442 N ASN A 32 14.231 12.737 -13.524 1.00 0.00 N ATOM 443 CA ASN A 32 14.458 11.461 -14.190 1.00 0.00 C ATOM 444 C ASN A 32 14.922 10.402 -13.195 1.00 0.00 C ATOM 445 O ASN A 32 16.069 9.954 -13.217 1.00 0.00 O ATOM 446 CB ASN A 32 15.497 11.620 -15.303 1.00 0.00 C ATOM 447 CG ASN A 32 15.344 10.574 -16.390 1.00 0.00 C ATOM 448 OD1 ASN A 32 14.277 10.434 -16.988 1.00 0.00 O ATOM 449 ND2 ASN A 32 16.415 9.832 -16.651 1.00 0.00 N ATOM 0 H ASN A 32 14.682 12.823 -12.613 1.00 0.00 H new ATOM 0 HA ASN A 32 13.514 11.135 -14.626 1.00 0.00 H new ATOM 0 HB2 ASN A 32 15.405 12.613 -15.743 1.00 0.00 H new ATOM 0 HB3 ASN A 32 16.497 11.552 -14.875 1.00 0.00 H new ATOM 0 HD21 ASN A 32 16.373 9.112 -17.372 1.00 0.00 H new ATOM 0 HD22 ASN A 32 17.279 9.983 -16.130 1.00 0.00 H new ATOM 456 N PRO A 33 14.011 9.991 -12.301 1.00 0.00 N ATOM 457 CA PRO A 33 14.304 8.980 -11.281 1.00 0.00 C ATOM 458 C PRO A 33 14.487 7.589 -11.880 1.00 0.00 C ATOM 459 O PRO A 33 14.907 6.657 -11.192 1.00 0.00 O ATOM 460 CB PRO A 33 13.066 9.015 -10.382 1.00 0.00 C ATOM 461 CG PRO A 33 11.973 9.523 -11.259 1.00 0.00 C ATOM 462 CD PRO A 33 12.625 10.482 -12.217 1.00 0.00 C ATOM 0 HA PRO A 33 15.236 9.189 -10.756 1.00 0.00 H new ATOM 0 HB2 PRO A 33 12.832 8.024 -9.992 1.00 0.00 H new ATOM 0 HB3 PRO A 33 13.219 9.668 -9.523 1.00 0.00 H new ATOM 0 HG2 PRO A 33 11.489 8.705 -11.793 1.00 0.00 H new ATOM 0 HG3 PRO A 33 11.201 10.021 -10.672 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.136 10.472 -13.191 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.584 11.507 -11.850 1.00 0.00 H new ATOM 470 N LEU A 34 14.171 7.456 -13.163 1.00 0.00 N ATOM 471 CA LEU A 34 14.302 6.178 -13.854 1.00 0.00 C ATOM 472 C LEU A 34 15.759 5.727 -13.894 1.00 0.00 C ATOM 473 O LEU A 34 16.054 4.540 -13.759 1.00 0.00 O ATOM 474 CB LEU A 34 13.751 6.288 -15.278 1.00 0.00 C ATOM 475 CG LEU A 34 12.498 5.465 -15.577 1.00 0.00 C ATOM 476 CD1 LEU A 34 11.278 6.093 -14.924 1.00 0.00 C ATOM 477 CD2 LEU A 34 12.293 5.335 -17.080 1.00 0.00 C ATOM 0 H LEU A 34 13.822 8.217 -13.746 1.00 0.00 H new ATOM 0 HA LEU A 34 13.726 5.434 -13.304 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.530 7.336 -15.481 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.534 5.987 -15.974 1.00 0.00 H new ATOM 0 HG LEU A 34 12.634 4.467 -15.160 1.00 0.00 H new ATOM 0 HD11 LEU A 34 10.396 5.493 -15.148 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.424 6.135 -13.845 1.00 0.00 H new ATOM 0 HD13 LEU A 34 11.138 7.103 -15.310 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.397 4.746 -17.275 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.179 6.326 -17.519 1.00 0.00 H new ATOM 0 HD23 LEU A 34 13.157 4.839 -17.523 1.00 0.00 H new ATOM 489 N SER A 35 16.663 6.682 -14.077 1.00 0.00 N ATOM 490 CA SER A 35 18.090 6.384 -14.135 1.00 0.00 C ATOM 491 C SER A 35 18.743 6.581 -12.770 1.00 0.00 C ATOM 492 O SER A 35 19.843 7.125 -12.669 1.00 0.00 O ATOM 493 CB SER A 35 18.777 7.270 -15.174 1.00 0.00 C ATOM 494 OG SER A 35 20.131 6.892 -15.353 1.00 0.00 O ATOM 0 H SER A 35 16.434 7.670 -14.188 1.00 0.00 H new ATOM 0 HA SER A 35 18.205 5.340 -14.426 1.00 0.00 H new ATOM 0 HB2 SER A 35 18.248 7.198 -16.124 1.00 0.00 H new ATOM 0 HB3 SER A 35 18.726 8.312 -14.858 1.00 0.00 H new ATOM 0 HG SER A 35 20.583 6.871 -14.483 1.00 0.00 H new ATOM 500 N ASP A 36 18.056 6.138 -11.723 1.00 0.00 N ATOM 501 CA ASP A 36 18.568 6.264 -10.363 1.00 0.00 C ATOM 502 C ASP A 36 19.535 5.129 -10.039 1.00 0.00 C ATOM 503 O ASP A 36 19.249 3.962 -10.303 1.00 0.00 O ATOM 504 CB ASP A 36 17.415 6.272 -9.360 1.00 0.00 C ATOM 505 CG ASP A 36 16.749 7.630 -9.252 1.00 0.00 C ATOM 506 OD1 ASP A 36 17.404 8.639 -9.586 1.00 0.00 O ATOM 507 OD2 ASP A 36 15.573 7.683 -8.834 1.00 0.00 O ATOM 0 H ASP A 36 17.143 5.688 -11.790 1.00 0.00 H new ATOM 0 HA ASP A 36 19.108 7.208 -10.290 1.00 0.00 H new ATOM 0 HB2 ASP A 36 16.674 5.530 -9.657 1.00 0.00 H new ATOM 0 HB3 ASP A 36 17.788 5.975 -8.380 1.00 0.00 H new ATOM 512 N VAL A 37 20.681 5.481 -9.464 1.00 0.00 N ATOM 513 CA VAL A 37 21.690 4.493 -9.103 1.00 0.00 C ATOM 514 C VAL A 37 21.370 3.845 -7.761 1.00 0.00 C ATOM 515 O VAL A 37 21.969 2.836 -7.386 1.00 0.00 O ATOM 516 CB VAL A 37 23.094 5.122 -9.035 1.00 0.00 C ATOM 517 CG1 VAL A 37 24.154 4.046 -8.858 1.00 0.00 C ATOM 518 CG2 VAL A 37 23.367 5.952 -10.280 1.00 0.00 C ATOM 0 H VAL A 37 20.933 6.443 -9.238 1.00 0.00 H new ATOM 0 HA VAL A 37 21.679 3.731 -9.883 1.00 0.00 H new ATOM 0 HB VAL A 37 23.135 5.783 -8.170 1.00 0.00 H new ATOM 0 HG11 VAL A 37 25.139 4.510 -8.812 1.00 0.00 H new ATOM 0 HG12 VAL A 37 23.967 3.499 -7.934 1.00 0.00 H new ATOM 0 HG13 VAL A 37 24.117 3.356 -9.701 1.00 0.00 H new ATOM 0 HG21 VAL A 37 24.363 6.389 -10.215 1.00 0.00 H new ATOM 0 HG22 VAL A 37 23.307 5.315 -11.162 1.00 0.00 H new ATOM 0 HG23 VAL A 37 22.626 6.748 -10.356 1.00 0.00 H new ATOM 528 N ASP A 38 20.420 4.431 -7.039 1.00 0.00 N ATOM 529 CA ASP A 38 20.018 3.911 -5.738 1.00 0.00 C ATOM 530 C ASP A 38 18.826 2.968 -5.874 1.00 0.00 C ATOM 531 O ASP A 38 18.044 2.800 -4.938 1.00 0.00 O ATOM 532 CB ASP A 38 19.669 5.060 -4.791 1.00 0.00 C ATOM 533 CG ASP A 38 20.900 5.777 -4.273 1.00 0.00 C ATOM 534 OD1 ASP A 38 21.492 5.300 -3.283 1.00 0.00 O ATOM 535 OD2 ASP A 38 21.271 6.817 -4.858 1.00 0.00 O ATOM 0 H ASP A 38 19.914 5.266 -7.334 1.00 0.00 H new ATOM 0 HA ASP A 38 20.856 3.351 -5.324 1.00 0.00 H new ATOM 0 HB2 ASP A 38 19.028 5.773 -5.310 1.00 0.00 H new ATOM 0 HB3 ASP A 38 19.097 4.672 -3.948 1.00 0.00 H new ATOM 540 N TRP A 39 18.692 2.358 -7.047 1.00 0.00 N ATOM 541 CA TRP A 39 17.594 1.433 -7.306 1.00 0.00 C ATOM 542 C TRP A 39 17.506 0.373 -6.214 1.00 0.00 C ATOM 543 O TRP A 39 18.484 -0.316 -5.924 1.00 0.00 O ATOM 544 CB TRP A 39 17.774 0.765 -8.669 1.00 0.00 C ATOM 545 CG TRP A 39 16.760 -0.303 -8.945 1.00 0.00 C ATOM 546 CD1 TRP A 39 15.482 -0.364 -8.467 1.00 0.00 C ATOM 547 CD2 TRP A 39 16.939 -1.464 -9.764 1.00 0.00 C ATOM 548 NE1 TRP A 39 14.857 -1.494 -8.939 1.00 0.00 N ATOM 549 CE2 TRP A 39 15.729 -2.184 -9.737 1.00 0.00 C ATOM 550 CE3 TRP A 39 18.004 -1.965 -10.520 1.00 0.00 C ATOM 551 CZ2 TRP A 39 15.557 -3.377 -10.435 1.00 0.00 C ATOM 552 CZ3 TRP A 39 17.832 -3.149 -11.211 1.00 0.00 C ATOM 553 CH2 TRP A 39 16.616 -3.844 -11.166 1.00 0.00 C ATOM 0 H TRP A 39 19.329 2.487 -7.833 1.00 0.00 H new ATOM 0 HA TRP A 39 16.665 2.003 -7.308 1.00 0.00 H new ATOM 0 HB2 TRP A 39 17.713 1.524 -9.449 1.00 0.00 H new ATOM 0 HB3 TRP A 39 18.772 0.331 -8.724 1.00 0.00 H new ATOM 0 HD1 TRP A 39 15.029 0.368 -7.814 1.00 0.00 H new ATOM 0 HE1 TRP A 39 13.899 -1.773 -8.729 1.00 0.00 H new ATOM 0 HE3 TRP A 39 18.944 -1.436 -10.563 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 14.621 -3.915 -10.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 18.649 -3.546 -11.796 1.00 0.00 H new ATOM 0 HH2 TRP A 39 16.512 -4.766 -11.719 1.00 0.00 H new ATOM 564 N SER A 40 16.328 0.246 -5.611 1.00 0.00 N ATOM 565 CA SER A 40 16.115 -0.729 -4.548 1.00 0.00 C ATOM 566 C SER A 40 14.724 -1.348 -4.649 1.00 0.00 C ATOM 567 O SER A 40 13.742 -0.778 -4.173 1.00 0.00 O ATOM 568 CB SER A 40 16.293 -0.070 -3.179 1.00 0.00 C ATOM 569 OG SER A 40 17.426 -0.591 -2.505 1.00 0.00 O ATOM 0 H SER A 40 15.507 0.806 -5.841 1.00 0.00 H new ATOM 0 HA SER A 40 16.856 -1.521 -4.662 1.00 0.00 H new ATOM 0 HB2 SER A 40 16.403 1.007 -3.302 1.00 0.00 H new ATOM 0 HB3 SER A 40 15.400 -0.232 -2.575 1.00 0.00 H new ATOM 0 HG SER A 40 17.519 -0.152 -1.634 1.00 0.00 H new ATOM 575 N ARG A 41 14.648 -2.518 -5.274 1.00 0.00 N ATOM 576 CA ARG A 41 13.378 -3.215 -5.441 1.00 0.00 C ATOM 577 C ARG A 41 12.803 -3.627 -4.089 1.00 0.00 C ATOM 578 O ARG A 41 13.529 -4.083 -3.206 1.00 0.00 O ATOM 579 CB ARG A 41 13.561 -4.448 -6.327 1.00 0.00 C ATOM 580 CG ARG A 41 14.120 -5.652 -5.586 1.00 0.00 C ATOM 581 CD ARG A 41 15.532 -5.392 -5.085 1.00 0.00 C ATOM 582 NE ARG A 41 16.278 -6.631 -4.881 1.00 0.00 N ATOM 583 CZ ARG A 41 16.870 -7.302 -5.862 1.00 0.00 C ATOM 584 NH1 ARG A 41 16.804 -6.855 -7.109 1.00 0.00 N ATOM 585 NH2 ARG A 41 17.530 -8.421 -5.597 1.00 0.00 N ATOM 0 H ARG A 41 15.451 -3.004 -5.673 1.00 0.00 H new ATOM 0 HA ARG A 41 12.678 -2.532 -5.922 1.00 0.00 H new ATOM 0 HB2 ARG A 41 12.600 -4.716 -6.766 1.00 0.00 H new ATOM 0 HB3 ARG A 41 14.229 -4.197 -7.151 1.00 0.00 H new ATOM 0 HG2 ARG A 41 13.473 -5.894 -4.743 1.00 0.00 H new ATOM 0 HG3 ARG A 41 14.121 -6.519 -6.247 1.00 0.00 H new ATOM 0 HD2 ARG A 41 16.061 -4.764 -5.802 1.00 0.00 H new ATOM 0 HD3 ARG A 41 15.488 -4.837 -4.148 1.00 0.00 H new ATOM 0 HE ARG A 41 16.348 -7.001 -3.933 1.00 0.00 H new ATOM 0 HH11 ARG A 41 16.298 -5.994 -7.316 1.00 0.00 H new ATOM 0 HH12 ARG A 41 17.260 -7.372 -7.861 1.00 0.00 H new ATOM 0 HH21 ARG A 41 17.583 -8.767 -4.639 1.00 0.00 H new ATOM 0 HH22 ARG A 41 17.984 -8.936 -6.351 1.00 0.00 H new ATOM 599 N LEU A 42 11.494 -3.461 -3.934 1.00 0.00 N ATOM 600 CA LEU A 42 10.820 -3.815 -2.690 1.00 0.00 C ATOM 601 C LEU A 42 10.197 -5.204 -2.785 1.00 0.00 C ATOM 602 O LEU A 42 10.437 -6.063 -1.935 1.00 0.00 O ATOM 603 CB LEU A 42 9.742 -2.782 -2.358 1.00 0.00 C ATOM 604 CG LEU A 42 10.089 -1.326 -2.672 1.00 0.00 C ATOM 605 CD1 LEU A 42 8.901 -0.421 -2.387 1.00 0.00 C ATOM 606 CD2 LEU A 42 11.304 -0.883 -1.871 1.00 0.00 C ATOM 0 H LEU A 42 10.878 -3.083 -4.654 1.00 0.00 H new ATOM 0 HA LEU A 42 11.563 -3.824 -1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.835 -3.044 -2.903 1.00 0.00 H new ATOM 0 HB3 LEU A 42 9.509 -2.858 -1.296 1.00 0.00 H new ATOM 0 HG LEU A 42 10.331 -1.250 -3.732 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.167 0.611 -2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.056 -0.724 -3.005 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.628 -0.500 -1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.537 0.155 -2.107 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.091 -0.974 -0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.157 -1.513 -2.125 1.00 0.00 H new ATOM 618 N ALA A 43 9.397 -5.420 -3.824 1.00 0.00 N ATOM 619 CA ALA A 43 8.743 -6.705 -4.031 1.00 0.00 C ATOM 620 C ALA A 43 7.911 -6.698 -5.309 1.00 0.00 C ATOM 621 O ALA A 43 7.830 -5.685 -6.004 1.00 0.00 O ATOM 622 CB ALA A 43 7.870 -7.053 -2.834 1.00 0.00 C ATOM 0 H ALA A 43 9.186 -4.720 -4.536 1.00 0.00 H new ATOM 0 HA ALA A 43 9.517 -7.465 -4.136 1.00 0.00 H new ATOM 0 HB1 ALA A 43 7.388 -8.016 -3.003 1.00 0.00 H new ATOM 0 HB2 ALA A 43 8.487 -7.109 -1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 43 7.109 -6.284 -2.703 1.00 0.00 H new ATOM 628 N LYS A 44 7.296 -7.835 -5.615 1.00 0.00 N ATOM 629 CA LYS A 44 6.470 -7.961 -6.811 1.00 0.00 C ATOM 630 C LYS A 44 5.035 -7.526 -6.528 1.00 0.00 C ATOM 631 O LYS A 44 4.421 -7.971 -5.559 1.00 0.00 O ATOM 632 CB LYS A 44 6.486 -9.405 -7.317 1.00 0.00 C ATOM 633 CG LYS A 44 5.900 -10.401 -6.333 1.00 0.00 C ATOM 634 CD LYS A 44 5.978 -11.822 -6.865 1.00 0.00 C ATOM 635 CE LYS A 44 7.418 -12.302 -6.965 1.00 0.00 C ATOM 636 NZ LYS A 44 8.109 -12.263 -5.646 1.00 0.00 N ATOM 0 H LYS A 44 7.354 -8.683 -5.051 1.00 0.00 H new ATOM 0 HA LYS A 44 6.885 -7.309 -7.580 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.928 -9.460 -8.252 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.514 -9.691 -7.542 1.00 0.00 H new ATOM 0 HG2 LYS A 44 6.436 -10.336 -5.386 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.860 -10.144 -6.130 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.416 -12.488 -6.210 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.508 -11.870 -7.847 1.00 0.00 H new ATOM 0 HE2 LYS A 44 7.435 -13.320 -7.354 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.960 -11.680 -7.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 8.992 -12.809 -5.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 8.327 -11.277 -5.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 7.491 -12.675 -4.918 1.00 0.00 H new ATOM 650 N VAL A 45 4.506 -6.656 -7.383 1.00 0.00 N ATOM 651 CA VAL A 45 3.143 -6.163 -7.226 1.00 0.00 C ATOM 652 C VAL A 45 2.175 -6.934 -8.115 1.00 0.00 C ATOM 653 O VAL A 45 2.269 -6.886 -9.343 1.00 0.00 O ATOM 654 CB VAL A 45 3.046 -4.662 -7.561 1.00 0.00 C ATOM 655 CG1 VAL A 45 3.645 -4.381 -8.930 1.00 0.00 C ATOM 656 CG2 VAL A 45 1.600 -4.195 -7.495 1.00 0.00 C ATOM 0 H VAL A 45 5.001 -6.278 -8.191 1.00 0.00 H new ATOM 0 HA VAL A 45 2.871 -6.312 -6.181 1.00 0.00 H new ATOM 0 HB VAL A 45 3.618 -4.103 -6.820 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.568 -3.316 -9.149 1.00 0.00 H new ATOM 0 HG12 VAL A 45 4.694 -4.677 -8.936 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.104 -4.948 -9.687 1.00 0.00 H new ATOM 0 HG21 VAL A 45 1.549 -3.133 -7.734 1.00 0.00 H new ATOM 0 HG22 VAL A 45 1.003 -4.757 -8.213 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.210 -4.360 -6.491 1.00 0.00 H new ATOM 666 N LYS A 46 1.243 -7.646 -7.490 1.00 0.00 N ATOM 667 CA LYS A 46 0.254 -8.427 -8.224 1.00 0.00 C ATOM 668 C LYS A 46 -1.017 -7.616 -8.455 1.00 0.00 C ATOM 669 O LYS A 46 -1.734 -7.834 -9.432 1.00 0.00 O ATOM 670 CB LYS A 46 -0.079 -9.711 -7.462 1.00 0.00 C ATOM 671 CG LYS A 46 -0.461 -10.871 -8.364 1.00 0.00 C ATOM 672 CD LYS A 46 -1.961 -10.916 -8.608 1.00 0.00 C ATOM 673 CE LYS A 46 -2.286 -11.501 -9.973 1.00 0.00 C ATOM 674 NZ LYS A 46 -2.407 -12.985 -9.926 1.00 0.00 N ATOM 0 H LYS A 46 1.152 -7.698 -6.475 1.00 0.00 H new ATOM 0 HA LYS A 46 0.679 -8.687 -9.193 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.782 -9.999 -6.858 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.900 -9.512 -6.773 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.061 -10.780 -9.316 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -0.137 -11.808 -7.911 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -2.439 -11.513 -7.832 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.373 -9.910 -8.535 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -3.219 -11.072 -10.339 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.507 -11.222 -10.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.629 -13.345 -10.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.509 -13.396 -9.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.168 -13.251 -9.268 1.00 0.00 H new ATOM 688 N ASP A 47 -1.290 -6.681 -7.551 1.00 0.00 N ATOM 689 CA ASP A 47 -2.473 -5.836 -7.658 1.00 0.00 C ATOM 690 C ASP A 47 -2.126 -4.377 -7.383 1.00 0.00 C ATOM 691 O ASP A 47 -1.244 -4.079 -6.576 1.00 0.00 O ATOM 692 CB ASP A 47 -3.553 -6.310 -6.685 1.00 0.00 C ATOM 693 CG ASP A 47 -4.044 -7.708 -7.000 1.00 0.00 C ATOM 694 OD1 ASP A 47 -3.303 -8.674 -6.719 1.00 0.00 O ATOM 695 OD2 ASP A 47 -5.169 -7.838 -7.526 1.00 0.00 O ATOM 0 H ASP A 47 -0.708 -6.489 -6.736 1.00 0.00 H new ATOM 0 HA ASP A 47 -2.854 -5.913 -8.676 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -3.158 -6.287 -5.669 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.394 -5.617 -6.715 1.00 0.00 H new ATOM 700 N LEU A 48 -2.823 -3.470 -8.059 1.00 0.00 N ATOM 701 CA LEU A 48 -2.587 -2.040 -7.888 1.00 0.00 C ATOM 702 C LEU A 48 -3.882 -1.251 -8.058 1.00 0.00 C ATOM 703 O LEU A 48 -4.457 -1.207 -9.147 1.00 0.00 O ATOM 704 CB LEU A 48 -1.543 -1.552 -8.892 1.00 0.00 C ATOM 705 CG LEU A 48 -0.905 -0.195 -8.592 1.00 0.00 C ATOM 706 CD1 LEU A 48 -1.905 0.927 -8.819 1.00 0.00 C ATOM 707 CD2 LEU A 48 -0.377 -0.160 -7.164 1.00 0.00 C ATOM 0 H LEU A 48 -3.556 -3.699 -8.730 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.213 -1.876 -6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -0.751 -2.298 -8.953 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.010 -1.502 -9.876 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.067 -0.050 -9.273 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -1.433 1.885 -8.600 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -2.237 0.914 -9.857 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.764 0.787 -8.162 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.074 0.813 -6.967 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -1.199 -0.327 -6.468 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.373 -0.941 -7.034 1.00 0.00 H new ATOM 719 N THR A 49 -4.336 -0.628 -6.976 1.00 0.00 N ATOM 720 CA THR A 49 -5.561 0.161 -7.005 1.00 0.00 C ATOM 721 C THR A 49 -5.259 1.651 -6.909 1.00 0.00 C ATOM 722 O THR A 49 -5.154 2.220 -5.821 1.00 0.00 O ATOM 723 CB THR A 49 -6.511 -0.234 -5.859 1.00 0.00 C ATOM 724 OG1 THR A 49 -6.889 -1.609 -5.987 1.00 0.00 O ATOM 725 CG2 THR A 49 -7.755 0.642 -5.860 1.00 0.00 C ATOM 0 H THR A 49 -3.873 -0.654 -6.067 1.00 0.00 H new ATOM 0 HA THR A 49 -6.047 -0.047 -7.958 1.00 0.00 H new ATOM 0 HB THR A 49 -5.985 -0.089 -4.915 1.00 0.00 H new ATOM 0 HG1 THR A 49 -7.492 -1.852 -5.253 1.00 0.00 H new ATOM 0 HG21 THR A 49 -8.411 0.344 -5.042 1.00 0.00 H new ATOM 0 HG22 THR A 49 -7.466 1.685 -5.732 1.00 0.00 H new ATOM 0 HG23 THR A 49 -8.281 0.525 -6.807 1.00 0.00 H new ATOM 733 N PRO A 50 -5.115 2.303 -8.072 1.00 0.00 N ATOM 734 CA PRO A 50 -4.823 3.737 -8.146 1.00 0.00 C ATOM 735 C PRO A 50 -6.005 4.593 -7.699 1.00 0.00 C ATOM 736 O PRO A 50 -6.813 5.026 -8.519 1.00 0.00 O ATOM 737 CB PRO A 50 -4.528 3.965 -9.631 1.00 0.00 C ATOM 738 CG PRO A 50 -5.261 2.874 -10.333 1.00 0.00 C ATOM 739 CD PRO A 50 -5.226 1.690 -9.406 1.00 0.00 C ATOM 0 HA PRO A 50 -4.002 4.020 -7.487 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -4.872 4.947 -9.957 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -3.458 3.918 -9.834 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -6.287 3.170 -10.550 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -4.789 2.637 -11.287 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -6.127 1.083 -9.495 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -4.380 1.037 -9.620 1.00 0.00 H new ATOM 747 N GLY A 51 -6.097 4.833 -6.395 1.00 0.00 N ATOM 748 CA GLY A 51 -7.183 5.636 -5.864 1.00 0.00 C ATOM 749 C GLY A 51 -6.929 7.124 -6.008 1.00 0.00 C ATOM 750 O GLY A 51 -6.814 7.839 -5.015 1.00 0.00 O ATOM 0 H GLY A 51 -5.439 4.486 -5.697 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.108 5.377 -6.379 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.327 5.396 -4.811 1.00 0.00 H new ATOM 1139 N SER A 79 -2.121 16.512 2.353 1.00 0.00 N ATOM 1140 CA SER A 79 -1.699 15.159 2.009 1.00 0.00 C ATOM 1141 C SER A 79 -2.884 14.198 2.028 1.00 0.00 C ATOM 1142 O SER A 79 -3.566 14.058 3.042 1.00 0.00 O ATOM 1143 CB SER A 79 -0.620 14.675 2.980 1.00 0.00 C ATOM 1144 OG SER A 79 0.677 14.973 2.492 1.00 0.00 O ATOM 0 HA SER A 79 -1.287 15.180 1.000 1.00 0.00 H new ATOM 0 HB2 SER A 79 -0.763 15.147 3.952 1.00 0.00 H new ATOM 0 HB3 SER A 79 -0.717 13.600 3.130 1.00 0.00 H new ATOM 0 HG SER A 79 1.348 14.655 3.131 1.00 0.00 H new ATOM 1150 N ALA A 80 -3.120 13.538 0.899 1.00 0.00 N ATOM 1151 CA ALA A 80 -4.221 12.589 0.786 1.00 0.00 C ATOM 1152 C ALA A 80 -4.163 11.836 -0.539 1.00 0.00 C ATOM 1153 O ALA A 80 -4.128 12.444 -1.608 1.00 0.00 O ATOM 1154 CB ALA A 80 -5.554 13.308 0.929 1.00 0.00 C ATOM 0 H ALA A 80 -2.564 13.643 0.050 1.00 0.00 H new ATOM 0 HA ALA A 80 -4.125 11.861 1.592 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -6.367 12.587 0.843 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.602 13.795 1.903 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -5.649 14.058 0.144 1.00 0.00 H new ATOM 1160 N GLY A 81 -4.151 10.509 -0.461 1.00 0.00 N ATOM 1161 CA GLY A 81 -4.096 9.695 -1.661 1.00 0.00 C ATOM 1162 C GLY A 81 -3.540 8.310 -1.398 1.00 0.00 C ATOM 1163 O GLY A 81 -2.594 7.878 -2.057 1.00 0.00 O ATOM 0 H GLY A 81 -4.178 9.983 0.412 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.097 9.607 -2.083 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -3.479 10.195 -2.407 1.00 0.00 H new ATOM 1167 N ASP A 82 -4.125 7.614 -0.430 1.00 0.00 N ATOM 1168 CA ASP A 82 -3.681 6.269 -0.079 1.00 0.00 C ATOM 1169 C ASP A 82 -3.605 5.383 -1.318 1.00 0.00 C ATOM 1170 O ASP A 82 -4.086 5.751 -2.390 1.00 0.00 O ATOM 1171 CB ASP A 82 -4.627 5.649 0.950 1.00 0.00 C ATOM 1172 CG ASP A 82 -6.081 5.733 0.526 1.00 0.00 C ATOM 1173 OD1 ASP A 82 -6.554 4.801 -0.160 1.00 0.00 O ATOM 1174 OD2 ASP A 82 -6.744 6.730 0.878 1.00 0.00 O ATOM 0 H ASP A 82 -4.908 7.958 0.126 1.00 0.00 H new ATOM 0 HA ASP A 82 -2.684 6.343 0.355 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -4.357 4.604 1.105 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -4.501 6.156 1.907 1.00 0.00 H new ATOM 1179 N THR A 83 -2.997 4.211 -1.164 1.00 0.00 N ATOM 1180 CA THR A 83 -2.855 3.272 -2.270 1.00 0.00 C ATOM 1181 C THR A 83 -2.983 1.831 -1.789 1.00 0.00 C ATOM 1182 O THR A 83 -2.460 1.470 -0.733 1.00 0.00 O ATOM 1183 CB THR A 83 -1.501 3.444 -2.983 1.00 0.00 C ATOM 1184 OG1 THR A 83 -1.073 4.807 -2.898 1.00 0.00 O ATOM 1185 CG2 THR A 83 -1.602 3.030 -4.444 1.00 0.00 C ATOM 0 H THR A 83 -2.595 3.889 -0.284 1.00 0.00 H new ATOM 0 HA THR A 83 -3.658 3.490 -2.974 1.00 0.00 H new ATOM 0 HB THR A 83 -0.771 2.802 -2.489 1.00 0.00 H new ATOM 0 HG1 THR A 83 -0.749 5.103 -3.774 1.00 0.00 H new ATOM 0 HG21 THR A 83 -0.634 3.160 -4.927 1.00 0.00 H new ATOM 0 HG22 THR A 83 -1.900 1.983 -4.506 1.00 0.00 H new ATOM 0 HG23 THR A 83 -2.344 3.649 -4.947 1.00 0.00 H new ATOM 1193 N SER A 84 -3.681 1.011 -2.568 1.00 0.00 N ATOM 1194 CA SER A 84 -3.880 -0.391 -2.219 1.00 0.00 C ATOM 1195 C SER A 84 -3.254 -1.307 -3.266 1.00 0.00 C ATOM 1196 O SER A 84 -3.661 -1.309 -4.428 1.00 0.00 O ATOM 1197 CB SER A 84 -5.372 -0.698 -2.082 1.00 0.00 C ATOM 1198 OG SER A 84 -5.652 -2.038 -2.450 1.00 0.00 O ATOM 0 H SER A 84 -4.118 1.293 -3.445 1.00 0.00 H new ATOM 0 HA SER A 84 -3.390 -0.574 -1.263 1.00 0.00 H new ATOM 0 HB2 SER A 84 -5.689 -0.526 -1.053 1.00 0.00 H new ATOM 0 HB3 SER A 84 -5.946 -0.017 -2.711 1.00 0.00 H new ATOM 0 HG SER A 84 -6.612 -2.210 -2.352 1.00 0.00 H new ATOM 1204 N PHE A 85 -2.260 -2.083 -2.846 1.00 0.00 N ATOM 1205 CA PHE A 85 -1.576 -3.002 -3.748 1.00 0.00 C ATOM 1206 C PHE A 85 -1.255 -4.318 -3.043 1.00 0.00 C ATOM 1207 O PHE A 85 -0.859 -4.331 -1.877 1.00 0.00 O ATOM 1208 CB PHE A 85 -0.288 -2.368 -4.277 1.00 0.00 C ATOM 1209 CG PHE A 85 0.499 -1.642 -3.223 1.00 0.00 C ATOM 1210 CD1 PHE A 85 0.145 -0.359 -2.837 1.00 0.00 C ATOM 1211 CD2 PHE A 85 1.592 -2.242 -2.619 1.00 0.00 C ATOM 1212 CE1 PHE A 85 0.867 0.312 -1.869 1.00 0.00 C ATOM 1213 CE2 PHE A 85 2.319 -1.576 -1.651 1.00 0.00 C ATOM 1214 CZ PHE A 85 1.956 -0.297 -1.274 1.00 0.00 C ATOM 0 H PHE A 85 -1.911 -2.094 -1.888 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.241 -3.211 -4.586 1.00 0.00 H new ATOM 0 HB2 PHE A 85 0.337 -3.146 -4.715 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -0.537 -1.671 -5.077 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.705 0.122 -3.298 1.00 0.00 H new ATOM 0 HD2 PHE A 85 1.879 -3.242 -2.908 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.581 1.312 -1.577 1.00 0.00 H new ATOM 0 HE2 PHE A 85 3.170 -2.055 -1.189 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.522 0.225 -0.517 1.00 0.00 H new ATOM 1224 N THR A 86 -1.433 -5.424 -3.759 1.00 0.00 N ATOM 1225 CA THR A 86 -1.166 -6.744 -3.203 1.00 0.00 C ATOM 1226 C THR A 86 0.291 -7.144 -3.412 1.00 0.00 C ATOM 1227 O THR A 86 0.909 -6.777 -4.411 1.00 0.00 O ATOM 1228 CB THR A 86 -2.075 -7.814 -3.835 1.00 0.00 C ATOM 1229 OG1 THR A 86 -3.450 -7.445 -3.679 1.00 0.00 O ATOM 1230 CG2 THR A 86 -1.835 -9.175 -3.197 1.00 0.00 C ATOM 0 H THR A 86 -1.761 -5.431 -4.725 1.00 0.00 H new ATOM 0 HA THR A 86 -1.375 -6.685 -2.135 1.00 0.00 H new ATOM 0 HB THR A 86 -1.835 -7.880 -4.896 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.021 -8.130 -4.085 1.00 0.00 H new ATOM 0 HG21 THR A 86 -2.489 -9.914 -3.660 1.00 0.00 H new ATOM 0 HG22 THR A 86 -0.795 -9.467 -3.344 1.00 0.00 H new ATOM 0 HG23 THR A 86 -2.049 -9.119 -2.130 1.00 0.00 H new ATOM 1238 N LEU A 87 0.834 -7.898 -2.462 1.00 0.00 N ATOM 1239 CA LEU A 87 2.219 -8.349 -2.542 1.00 0.00 C ATOM 1240 C LEU A 87 2.303 -9.870 -2.455 1.00 0.00 C ATOM 1241 O LEU A 87 1.379 -10.525 -1.973 1.00 0.00 O ATOM 1242 CB LEU A 87 3.048 -7.716 -1.423 1.00 0.00 C ATOM 1243 CG LEU A 87 3.447 -6.254 -1.628 1.00 0.00 C ATOM 1244 CD1 LEU A 87 4.142 -6.074 -2.967 1.00 0.00 C ATOM 1245 CD2 LEU A 87 2.225 -5.350 -1.532 1.00 0.00 C ATOM 0 H LEU A 87 0.336 -8.210 -1.628 1.00 0.00 H new ATOM 0 HA LEU A 87 2.622 -8.036 -3.505 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.484 -7.791 -0.493 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.956 -8.305 -1.293 1.00 0.00 H new ATOM 0 HG LEU A 87 4.145 -5.973 -0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.419 -5.028 -3.096 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.039 -6.693 -2.998 1.00 0.00 H new ATOM 0 HD13 LEU A 87 3.468 -6.372 -3.770 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.527 -4.313 -1.680 1.00 0.00 H new ATOM 0 HD22 LEU A 87 1.503 -5.631 -2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.769 -5.458 -0.548 1.00 0.00 H new ATOM 1257 N ALA A 88 3.417 -10.423 -2.921 1.00 0.00 N ATOM 1258 CA ALA A 88 3.624 -11.866 -2.891 1.00 0.00 C ATOM 1259 C ALA A 88 5.085 -12.206 -2.619 1.00 0.00 C ATOM 1260 O ALA A 88 5.989 -11.639 -3.234 1.00 0.00 O ATOM 1261 CB ALA A 88 3.169 -12.492 -4.202 1.00 0.00 C ATOM 0 H ALA A 88 4.190 -9.894 -3.324 1.00 0.00 H new ATOM 0 HA ALA A 88 3.026 -12.277 -2.078 1.00 0.00 H new ATOM 0 HB1 ALA A 88 3.329 -13.570 -4.166 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.109 -12.288 -4.354 1.00 0.00 H new ATOM 0 HB3 ALA A 88 3.742 -12.068 -5.026 1.00 0.00 H new ATOM 1267 N TRP A 89 5.309 -13.134 -1.696 1.00 0.00 N ATOM 1268 CA TRP A 89 6.663 -13.547 -1.343 1.00 0.00 C ATOM 1269 C TRP A 89 6.978 -14.924 -1.919 1.00 0.00 C ATOM 1270 O TRP A 89 6.335 -15.914 -1.572 1.00 0.00 O ATOM 1271 CB TRP A 89 6.833 -13.565 0.177 1.00 0.00 C ATOM 1272 CG TRP A 89 8.092 -12.900 0.643 1.00 0.00 C ATOM 1273 CD1 TRP A 89 8.386 -11.568 0.580 1.00 0.00 C ATOM 1274 CD2 TRP A 89 9.227 -13.536 1.239 1.00 0.00 C ATOM 1275 NE1 TRP A 89 9.636 -11.337 1.102 1.00 0.00 N ATOM 1276 CE2 TRP A 89 10.172 -12.528 1.514 1.00 0.00 C ATOM 1277 CE3 TRP A 89 9.537 -14.858 1.570 1.00 0.00 C ATOM 1278 CZ2 TRP A 89 11.405 -12.804 2.103 1.00 0.00 C ATOM 1279 CZ3 TRP A 89 10.760 -15.129 2.154 1.00 0.00 C ATOM 1280 CH2 TRP A 89 11.681 -14.107 2.415 1.00 0.00 C ATOM 0 H TRP A 89 4.572 -13.614 -1.179 1.00 0.00 H new ATOM 0 HA TRP A 89 7.360 -12.826 -1.770 1.00 0.00 H new ATOM 0 HB2 TRP A 89 5.978 -13.070 0.637 1.00 0.00 H new ATOM 0 HB3 TRP A 89 6.827 -14.598 0.524 1.00 0.00 H new ATOM 0 HD1 TRP A 89 7.732 -10.808 0.179 1.00 0.00 H new ATOM 0 HE1 TRP A 89 10.091 -10.427 1.171 1.00 0.00 H new ATOM 0 HE3 TRP A 89 8.834 -15.653 1.373 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 12.117 -12.017 2.306 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 11.010 -16.147 2.414 1.00 0.00 H new ATOM 0 HH2 TRP A 89 12.628 -14.352 2.872 1.00 0.00 H new ATOM 1291 N MET A 90 7.973 -14.979 -2.798 1.00 0.00 N ATOM 1292 CA MET A 90 8.373 -16.236 -3.420 1.00 0.00 C ATOM 1293 C MET A 90 9.584 -16.833 -2.709 1.00 0.00 C ATOM 1294 O MET A 90 10.319 -16.144 -2.002 1.00 0.00 O ATOM 1295 CB MET A 90 8.693 -16.018 -4.900 1.00 0.00 C ATOM 1296 CG MET A 90 7.521 -16.307 -5.824 1.00 0.00 C ATOM 1297 SD MET A 90 8.041 -16.966 -7.420 1.00 0.00 S ATOM 1298 CE MET A 90 7.501 -18.668 -7.275 1.00 0.00 C ATOM 0 H MET A 90 8.517 -14.169 -3.095 1.00 0.00 H new ATOM 0 HA MET A 90 7.542 -16.936 -3.334 1.00 0.00 H new ATOM 0 HB2 MET A 90 9.014 -14.987 -5.046 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.532 -16.656 -5.180 1.00 0.00 H new ATOM 0 HG2 MET A 90 6.851 -17.019 -5.342 1.00 0.00 H new ATOM 0 HG3 MET A 90 6.953 -15.390 -5.981 1.00 0.00 H new ATOM 0 HE1 MET A 90 7.099 -19.005 -8.231 1.00 0.00 H new ATOM 0 HE2 MET A 90 8.347 -19.296 -6.996 1.00 0.00 H new ATOM 0 HE3 MET A 90 6.728 -18.740 -6.510 1.00 0.00 H new ATOM 1308 N PRO A 91 9.796 -18.143 -2.900 1.00 0.00 N ATOM 1309 CA PRO A 91 10.916 -18.860 -2.285 1.00 0.00 C ATOM 1310 C PRO A 91 12.261 -18.456 -2.881 1.00 0.00 C ATOM 1311 O PRO A 91 12.464 -18.538 -4.091 1.00 0.00 O ATOM 1312 CB PRO A 91 10.613 -20.328 -2.598 1.00 0.00 C ATOM 1313 CG PRO A 91 9.771 -20.287 -3.827 1.00 0.00 C ATOM 1314 CD PRO A 91 8.959 -19.025 -3.730 1.00 0.00 C ATOM 0 HA PRO A 91 11.001 -18.645 -1.220 1.00 0.00 H new ATOM 0 HB2 PRO A 91 11.529 -20.895 -2.764 1.00 0.00 H new ATOM 0 HB3 PRO A 91 10.087 -20.808 -1.773 1.00 0.00 H new ATOM 0 HG2 PRO A 91 10.390 -20.285 -4.724 1.00 0.00 H new ATOM 0 HG3 PRO A 91 9.125 -21.163 -3.887 1.00 0.00 H new ATOM 0 HD2 PRO A 91 8.771 -18.592 -4.712 1.00 0.00 H new ATOM 0 HD3 PRO A 91 7.988 -19.207 -3.270 1.00 0.00 H new ATOM 1322 N GLY A 92 13.177 -18.020 -2.021 1.00 0.00 N ATOM 1323 CA GLY A 92 14.490 -17.610 -2.481 1.00 0.00 C ATOM 1324 C GLY A 92 14.573 -16.120 -2.745 1.00 0.00 C ATOM 1325 O GLY A 92 15.551 -15.637 -3.314 1.00 0.00 O ATOM 0 H GLY A 92 13.032 -17.944 -1.014 1.00 0.00 H new ATOM 0 HA2 GLY A 92 15.235 -17.886 -1.735 1.00 0.00 H new ATOM 0 HA3 GLY A 92 14.737 -18.152 -3.394 1.00 0.00 H new ATOM 1329 N GLU A 93 13.543 -15.389 -2.330 1.00 0.00 N ATOM 1330 CA GLU A 93 13.503 -13.945 -2.528 1.00 0.00 C ATOM 1331 C GLU A 93 13.370 -13.217 -1.193 1.00 0.00 C ATOM 1332 O GLU A 93 12.847 -13.767 -0.224 1.00 0.00 O ATOM 1333 CB GLU A 93 12.339 -13.565 -3.446 1.00 0.00 C ATOM 1334 CG GLU A 93 12.384 -14.252 -4.801 1.00 0.00 C ATOM 1335 CD GLU A 93 13.434 -13.658 -5.721 1.00 0.00 C ATOM 1336 OE1 GLU A 93 13.299 -12.474 -6.090 1.00 0.00 O ATOM 1337 OE2 GLU A 93 14.391 -14.381 -6.071 1.00 0.00 O ATOM 0 H GLU A 93 12.726 -15.773 -1.855 1.00 0.00 H new ATOM 0 HA GLU A 93 14.439 -13.642 -2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.400 -13.816 -2.952 1.00 0.00 H new ATOM 0 HB3 GLU A 93 12.342 -12.485 -3.595 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.588 -15.313 -4.660 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.406 -14.176 -5.275 1.00 0.00 H new ATOM 1344 N GLN A 94 13.847 -11.976 -1.152 1.00 0.00 N ATOM 1345 CA GLN A 94 13.783 -11.174 0.063 1.00 0.00 C ATOM 1346 C GLN A 94 12.759 -10.052 -0.079 1.00 0.00 C ATOM 1347 O GLN A 94 12.285 -9.766 -1.177 1.00 0.00 O ATOM 1348 CB GLN A 94 15.159 -10.588 0.386 1.00 0.00 C ATOM 1349 CG GLN A 94 15.747 -9.758 -0.745 1.00 0.00 C ATOM 1350 CD GLN A 94 16.597 -10.582 -1.691 1.00 0.00 C ATOM 1351 OE1 GLN A 94 16.263 -10.740 -2.866 1.00 0.00 O ATOM 1352 NE2 GLN A 94 17.703 -11.112 -1.184 1.00 0.00 N ATOM 0 H GLN A 94 14.281 -11.506 -1.946 1.00 0.00 H new ATOM 0 HA GLN A 94 13.472 -11.823 0.881 1.00 0.00 H new ATOM 0 HB2 GLN A 94 15.080 -9.967 1.278 1.00 0.00 H new ATOM 0 HB3 GLN A 94 15.845 -11.401 0.623 1.00 0.00 H new ATOM 0 HG2 GLN A 94 14.938 -9.288 -1.305 1.00 0.00 H new ATOM 0 HG3 GLN A 94 16.352 -8.955 -0.325 1.00 0.00 H new ATOM 0 HE21 GLN A 94 17.941 -10.955 -0.205 1.00 0.00 H new ATOM 0 HE22 GLN A 94 18.315 -11.676 -1.774 1.00 0.00 H new ATOM 1361 N GLY A 95 12.422 -9.420 1.042 1.00 0.00 N ATOM 1362 CA GLY A 95 11.457 -8.337 1.021 1.00 0.00 C ATOM 1363 C GLY A 95 10.810 -8.109 2.373 1.00 0.00 C ATOM 1364 O GLY A 95 10.284 -7.031 2.642 1.00 0.00 O ATOM 0 H GLY A 95 12.800 -9.639 1.964 1.00 0.00 H new ATOM 0 HA2 GLY A 95 11.951 -7.420 0.699 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.684 -8.558 0.285 1.00 0.00 H new ATOM 1368 N GLN A 96 10.850 -9.130 3.224 1.00 0.00 N ATOM 1369 CA GLN A 96 10.260 -9.036 4.555 1.00 0.00 C ATOM 1370 C GLN A 96 10.755 -7.790 5.283 1.00 0.00 C ATOM 1371 O GLN A 96 9.970 -6.904 5.617 1.00 0.00 O ATOM 1372 CB GLN A 96 10.594 -10.285 5.372 1.00 0.00 C ATOM 1373 CG GLN A 96 9.727 -11.485 5.030 1.00 0.00 C ATOM 1374 CD GLN A 96 9.417 -12.345 6.240 1.00 0.00 C ATOM 1375 OE1 GLN A 96 9.438 -11.871 7.375 1.00 0.00 O ATOM 1376 NE2 GLN A 96 9.130 -13.620 6.002 1.00 0.00 N ATOM 0 H GLN A 96 11.284 -10.030 3.016 1.00 0.00 H new ATOM 0 HA GLN A 96 9.178 -8.962 4.442 1.00 0.00 H new ATOM 0 HB2 GLN A 96 11.640 -10.545 5.211 1.00 0.00 H new ATOM 0 HB3 GLN A 96 10.482 -10.056 6.432 1.00 0.00 H new ATOM 0 HG2 GLN A 96 8.794 -11.139 4.586 1.00 0.00 H new ATOM 0 HG3 GLN A 96 10.232 -12.091 4.278 1.00 0.00 H new ATOM 0 HE21 GLN A 96 9.124 -13.971 5.044 1.00 0.00 H new ATOM 0 HE22 GLN A 96 8.916 -14.248 6.777 1.00 0.00 H new ATOM 1385 N GLN A 97 12.060 -7.732 5.524 1.00 0.00 N ATOM 1386 CA GLN A 97 12.659 -6.595 6.214 1.00 0.00 C ATOM 1387 C GLN A 97 12.246 -5.281 5.559 1.00 0.00 C ATOM 1388 O GLN A 97 12.142 -4.251 6.222 1.00 0.00 O ATOM 1389 CB GLN A 97 14.184 -6.718 6.218 1.00 0.00 C ATOM 1390 CG GLN A 97 14.764 -7.126 4.874 1.00 0.00 C ATOM 1391 CD GLN A 97 16.279 -7.077 4.852 1.00 0.00 C ATOM 1392 OE1 GLN A 97 16.873 -6.053 4.509 1.00 0.00 O ATOM 1393 NE2 GLN A 97 16.914 -8.183 5.221 1.00 0.00 N ATOM 0 H GLN A 97 12.723 -8.458 5.252 1.00 0.00 H new ATOM 0 HA GLN A 97 12.299 -6.597 7.243 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.617 -5.763 6.516 1.00 0.00 H new ATOM 0 HB3 GLN A 97 14.479 -7.450 6.969 1.00 0.00 H new ATOM 0 HG2 GLN A 97 14.434 -8.136 4.632 1.00 0.00 H new ATOM 0 HG3 GLN A 97 14.372 -6.468 4.099 1.00 0.00 H new ATOM 0 HE21 GLN A 97 16.382 -9.008 5.498 1.00 0.00 H new ATOM 0 HE22 GLN A 97 17.934 -8.207 5.228 1.00 0.00 H new ATOM 1402 N ALA A 98 12.011 -5.326 4.250 1.00 0.00 N ATOM 1403 CA ALA A 98 11.607 -4.140 3.506 1.00 0.00 C ATOM 1404 C ALA A 98 10.256 -3.622 3.989 1.00 0.00 C ATOM 1405 O ALA A 98 10.125 -2.457 4.364 1.00 0.00 O ATOM 1406 CB ALA A 98 11.555 -4.445 2.016 1.00 0.00 C ATOM 0 H ALA A 98 12.094 -6.171 3.685 1.00 0.00 H new ATOM 0 HA ALA A 98 12.349 -3.361 3.681 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.252 -3.551 1.472 1.00 0.00 H new ATOM 0 HB2 ALA A 98 12.541 -4.761 1.675 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.835 -5.243 1.833 1.00 0.00 H new ATOM 1412 N LEU A 99 9.253 -4.495 3.975 1.00 0.00 N ATOM 1413 CA LEU A 99 7.912 -4.125 4.411 1.00 0.00 C ATOM 1414 C LEU A 99 7.904 -3.746 5.889 1.00 0.00 C ATOM 1415 O LEU A 99 7.443 -2.667 6.263 1.00 0.00 O ATOM 1416 CB LEU A 99 6.938 -5.278 4.163 1.00 0.00 C ATOM 1417 CG LEU A 99 6.314 -5.341 2.769 1.00 0.00 C ATOM 1418 CD1 LEU A 99 5.379 -4.163 2.548 1.00 0.00 C ATOM 1419 CD2 LEU A 99 7.398 -5.372 1.701 1.00 0.00 C ATOM 0 H LEU A 99 9.344 -5.463 3.666 1.00 0.00 H new ATOM 0 HA LEU A 99 7.595 -3.258 3.832 1.00 0.00 H new ATOM 0 HB2 LEU A 99 7.462 -6.216 4.347 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.134 -5.212 4.896 1.00 0.00 H new ATOM 0 HG LEU A 99 5.731 -6.259 2.694 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.945 -4.225 1.550 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.583 -4.186 3.292 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.938 -3.232 2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.936 -5.417 0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 99 8.008 -4.472 1.775 1.00 0.00 H new ATOM 0 HD23 LEU A 99 8.028 -6.250 1.847 1.00 0.00 H new ATOM 1431 N LEU A 100 8.420 -4.641 6.726 1.00 0.00 N ATOM 1432 CA LEU A 100 8.475 -4.400 8.163 1.00 0.00 C ATOM 1433 C LEU A 100 9.125 -3.053 8.466 1.00 0.00 C ATOM 1434 O LEU A 100 8.641 -2.295 9.305 1.00 0.00 O ATOM 1435 CB LEU A 100 9.250 -5.520 8.858 1.00 0.00 C ATOM 1436 CG LEU A 100 8.874 -5.794 10.315 1.00 0.00 C ATOM 1437 CD1 LEU A 100 9.256 -7.213 10.708 1.00 0.00 C ATOM 1438 CD2 LEU A 100 9.543 -4.784 11.237 1.00 0.00 C ATOM 0 H LEU A 100 8.806 -5.539 6.434 1.00 0.00 H new ATOM 0 HA LEU A 100 7.453 -4.383 8.542 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.110 -6.439 8.289 1.00 0.00 H new ATOM 0 HB3 LEU A 100 10.312 -5.279 8.817 1.00 0.00 H new ATOM 0 HG LEU A 100 7.794 -5.690 10.417 1.00 0.00 H new ATOM 0 HD11 LEU A 100 8.981 -7.389 11.748 1.00 0.00 H new ATOM 0 HD12 LEU A 100 8.730 -7.922 10.068 1.00 0.00 H new ATOM 0 HD13 LEU A 100 10.331 -7.346 10.590 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.264 -4.994 12.270 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.625 -4.856 11.131 1.00 0.00 H new ATOM 0 HD23 LEU A 100 9.219 -3.778 10.971 1.00 0.00 H new ATOM 1450 N ALA A 101 10.222 -2.764 7.774 1.00 0.00 N ATOM 1451 CA ALA A 101 10.935 -1.506 7.966 1.00 0.00 C ATOM 1452 C ALA A 101 10.131 -0.331 7.423 1.00 0.00 C ATOM 1453 O ALA A 101 10.178 0.771 7.969 1.00 0.00 O ATOM 1454 CB ALA A 101 12.301 -1.568 7.298 1.00 0.00 C ATOM 0 H ALA A 101 10.636 -3.382 7.076 1.00 0.00 H new ATOM 0 HA ALA A 101 11.072 -1.354 9.037 1.00 0.00 H new ATOM 0 HB1 ALA A 101 12.823 -0.623 7.449 1.00 0.00 H new ATOM 0 HB2 ALA A 101 12.884 -2.378 7.736 1.00 0.00 H new ATOM 0 HB3 ALA A 101 12.176 -1.747 6.230 1.00 0.00 H new ATOM 1460 N TRP A 102 9.395 -0.572 6.344 1.00 0.00 N ATOM 1461 CA TRP A 102 8.580 0.469 5.726 1.00 0.00 C ATOM 1462 C TRP A 102 7.519 0.976 6.695 1.00 0.00 C ATOM 1463 O TRP A 102 7.432 2.175 6.965 1.00 0.00 O ATOM 1464 CB TRP A 102 7.916 -0.062 4.455 1.00 0.00 C ATOM 1465 CG TRP A 102 7.574 1.014 3.469 1.00 0.00 C ATOM 1466 CD1 TRP A 102 7.648 2.363 3.670 1.00 0.00 C ATOM 1467 CD2 TRP A 102 7.100 0.831 2.130 1.00 0.00 C ATOM 1468 NE1 TRP A 102 7.250 3.030 2.537 1.00 0.00 N ATOM 1469 CE2 TRP A 102 6.909 2.113 1.578 1.00 0.00 C ATOM 1470 CE3 TRP A 102 6.821 -0.290 1.345 1.00 0.00 C ATOM 1471 CZ2 TRP A 102 6.452 2.301 0.276 1.00 0.00 C ATOM 1472 CZ3 TRP A 102 6.367 -0.102 0.053 1.00 0.00 C ATOM 1473 CH2 TRP A 102 6.186 1.185 -0.471 1.00 0.00 C ATOM 0 H TRP A 102 9.345 -1.478 5.879 1.00 0.00 H new ATOM 0 HA TRP A 102 9.234 1.301 5.465 1.00 0.00 H new ATOM 0 HB2 TRP A 102 8.582 -0.782 3.980 1.00 0.00 H new ATOM 0 HB3 TRP A 102 7.007 -0.599 4.726 1.00 0.00 H new ATOM 0 HD1 TRP A 102 7.972 2.836 4.585 1.00 0.00 H new ATOM 0 HE1 TRP A 102 7.214 4.043 2.427 1.00 0.00 H new ATOM 0 HE3 TRP A 102 6.958 -1.286 1.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 6.312 3.292 -0.130 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 6.148 -0.962 -0.563 1.00 0.00 H new ATOM 0 HH2 TRP A 102 5.830 1.299 -1.484 1.00 0.00 H new ATOM 1484 N PHE A 103 6.712 0.058 7.217 1.00 0.00 N ATOM 1485 CA PHE A 103 5.655 0.413 8.156 1.00 0.00 C ATOM 1486 C PHE A 103 6.242 0.890 9.482 1.00 0.00 C ATOM 1487 O PHE A 103 5.797 1.887 10.047 1.00 0.00 O ATOM 1488 CB PHE A 103 4.732 -0.783 8.395 1.00 0.00 C ATOM 1489 CG PHE A 103 3.786 -0.591 9.546 1.00 0.00 C ATOM 1490 CD1 PHE A 103 4.158 -0.944 10.832 1.00 0.00 C ATOM 1491 CD2 PHE A 103 2.525 -0.056 9.340 1.00 0.00 C ATOM 1492 CE1 PHE A 103 3.291 -0.768 11.893 1.00 0.00 C ATOM 1493 CE2 PHE A 103 1.652 0.123 10.397 1.00 0.00 C ATOM 1494 CZ PHE A 103 2.036 -0.234 11.675 1.00 0.00 C ATOM 0 H PHE A 103 6.770 -0.938 7.005 1.00 0.00 H new ATOM 0 HA PHE A 103 5.076 1.228 7.721 1.00 0.00 H new ATOM 0 HB2 PHE A 103 4.156 -0.973 7.490 1.00 0.00 H new ATOM 0 HB3 PHE A 103 5.339 -1.669 8.579 1.00 0.00 H new ATOM 0 HD1 PHE A 103 5.138 -1.362 11.008 1.00 0.00 H new ATOM 0 HD2 PHE A 103 2.220 0.224 8.343 1.00 0.00 H new ATOM 0 HE1 PHE A 103 3.594 -1.047 12.891 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.671 0.541 10.224 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.356 -0.096 12.503 1.00 0.00 H new ATOM 1504 N ASN A 104 7.246 0.168 9.970 1.00 0.00 N ATOM 1505 CA ASN A 104 7.894 0.516 11.230 1.00 0.00 C ATOM 1506 C ASN A 104 8.479 1.924 11.170 1.00 0.00 C ATOM 1507 O ASN A 104 8.299 2.719 12.092 1.00 0.00 O ATOM 1508 CB ASN A 104 8.998 -0.493 11.554 1.00 0.00 C ATOM 1509 CG ASN A 104 9.567 -0.300 12.946 1.00 0.00 C ATOM 1510 OD1 ASN A 104 8.892 0.215 13.838 1.00 0.00 O ATOM 1511 ND2 ASN A 104 10.814 -0.714 13.139 1.00 0.00 N ATOM 0 H ASN A 104 7.628 -0.660 9.513 1.00 0.00 H new ATOM 0 HA ASN A 104 7.141 0.488 12.018 1.00 0.00 H new ATOM 0 HB2 ASN A 104 8.600 -1.504 11.464 1.00 0.00 H new ATOM 0 HB3 ASN A 104 9.799 -0.399 10.821 1.00 0.00 H new ATOM 0 HD21 ASN A 104 11.250 -0.611 14.056 1.00 0.00 H new ATOM 0 HD22 ASN A 104 11.336 -1.135 12.371 1.00 0.00 H new ATOM 1518 N GLU A 105 9.177 2.223 10.079 1.00 0.00 N ATOM 1519 CA GLU A 105 9.788 3.536 9.901 1.00 0.00 C ATOM 1520 C GLU A 105 8.721 4.621 9.789 1.00 0.00 C ATOM 1521 O GLU A 105 8.793 5.649 10.461 1.00 0.00 O ATOM 1522 CB GLU A 105 10.673 3.545 8.653 1.00 0.00 C ATOM 1523 CG GLU A 105 11.379 4.870 8.418 1.00 0.00 C ATOM 1524 CD GLU A 105 12.757 4.917 9.052 1.00 0.00 C ATOM 1525 OE1 GLU A 105 13.595 4.054 8.715 1.00 0.00 O ATOM 1526 OE2 GLU A 105 12.996 5.817 9.883 1.00 0.00 O ATOM 0 H GLU A 105 9.334 1.576 9.306 1.00 0.00 H new ATOM 0 HA GLU A 105 10.404 3.745 10.776 1.00 0.00 H new ATOM 0 HB2 GLU A 105 11.419 2.756 8.741 1.00 0.00 H new ATOM 0 HB3 GLU A 105 10.061 3.309 7.782 1.00 0.00 H new ATOM 0 HG2 GLU A 105 11.470 5.044 7.346 1.00 0.00 H new ATOM 0 HG3 GLU A 105 10.770 5.679 8.821 1.00 0.00 H new ATOM 1533 N GLY A 106 7.731 4.384 8.934 1.00 0.00 N ATOM 1534 CA GLY A 106 6.663 5.349 8.748 1.00 0.00 C ATOM 1535 C GLY A 106 7.169 6.678 8.222 1.00 0.00 C ATOM 1536 O GLY A 106 6.747 7.738 8.686 1.00 0.00 O ATOM 0 H GLY A 106 7.649 3.540 8.366 1.00 0.00 H new ATOM 0 HA2 GLY A 106 5.927 4.943 8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 106 6.152 5.508 9.697 1.00 0.00 H new ATOM 1540 N ASP A 107 8.076 6.623 7.253 1.00 0.00 N ATOM 1541 CA ASP A 107 8.640 7.832 6.664 1.00 0.00 C ATOM 1542 C ASP A 107 8.272 7.940 5.188 1.00 0.00 C ATOM 1543 O ASP A 107 8.246 6.941 4.468 1.00 0.00 O ATOM 1544 CB ASP A 107 10.161 7.840 6.825 1.00 0.00 C ATOM 1545 CG ASP A 107 10.592 8.191 8.235 1.00 0.00 C ATOM 1546 OD1 ASP A 107 9.838 7.881 9.181 1.00 0.00 O ATOM 1547 OD2 ASP A 107 11.685 8.775 8.393 1.00 0.00 O ATOM 0 H ASP A 107 8.436 5.754 6.859 1.00 0.00 H new ATOM 0 HA ASP A 107 8.222 8.692 7.188 1.00 0.00 H new ATOM 0 HB2 ASP A 107 10.557 6.859 6.561 1.00 0.00 H new ATOM 0 HB3 ASP A 107 10.594 8.557 6.127 1.00 0.00 H new ATOM 1552 N THR A 108 7.985 9.159 4.742 1.00 0.00 N ATOM 1553 CA THR A 108 7.615 9.398 3.353 1.00 0.00 C ATOM 1554 C THR A 108 8.635 8.785 2.400 1.00 0.00 C ATOM 1555 O THR A 108 9.792 9.207 2.358 1.00 0.00 O ATOM 1556 CB THR A 108 7.491 10.904 3.056 1.00 0.00 C ATOM 1557 OG1 THR A 108 6.661 11.531 4.038 1.00 0.00 O ATOM 1558 CG2 THR A 108 6.910 11.137 1.669 1.00 0.00 C ATOM 0 H THR A 108 8.002 9.997 5.324 1.00 0.00 H new ATOM 0 HA THR A 108 6.646 8.924 3.197 1.00 0.00 H new ATOM 0 HB THR A 108 8.489 11.341 3.092 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.589 12.489 3.842 1.00 0.00 H new ATOM 0 HG21 THR A 108 6.832 12.208 1.482 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.561 10.685 0.921 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.920 10.685 1.609 1.00 0.00 H new ATOM 1566 N ARG A 109 8.200 7.790 1.635 1.00 0.00 N ATOM 1567 CA ARG A 109 9.075 7.119 0.681 1.00 0.00 C ATOM 1568 C ARG A 109 8.544 7.266 -0.742 1.00 0.00 C ATOM 1569 O ARG A 109 7.360 7.049 -0.998 1.00 0.00 O ATOM 1570 CB ARG A 109 9.211 5.637 1.036 1.00 0.00 C ATOM 1571 CG ARG A 109 10.094 5.380 2.246 1.00 0.00 C ATOM 1572 CD ARG A 109 10.710 3.990 2.200 1.00 0.00 C ATOM 1573 NE ARG A 109 11.984 3.978 1.486 1.00 0.00 N ATOM 1574 CZ ARG A 109 12.620 2.866 1.135 1.00 0.00 C ATOM 1575 NH1 ARG A 109 12.104 1.681 1.431 1.00 0.00 N ATOM 1576 NH2 ARG A 109 13.775 2.938 0.486 1.00 0.00 N ATOM 0 H ARG A 109 7.246 7.430 1.657 1.00 0.00 H new ATOM 0 HA ARG A 109 10.057 7.590 0.734 1.00 0.00 H new ATOM 0 HB2 ARG A 109 8.220 5.225 1.226 1.00 0.00 H new ATOM 0 HB3 ARG A 109 9.620 5.102 0.178 1.00 0.00 H new ATOM 0 HG2 ARG A 109 10.885 6.129 2.286 1.00 0.00 H new ATOM 0 HG3 ARG A 109 9.506 5.489 3.157 1.00 0.00 H new ATOM 0 HD2 ARG A 109 10.861 3.627 3.217 1.00 0.00 H new ATOM 0 HD3 ARG A 109 10.017 3.302 1.716 1.00 0.00 H new ATOM 0 HE ARG A 109 12.409 4.873 1.243 1.00 0.00 H new ATOM 0 HH11 ARG A 109 11.216 1.622 1.930 1.00 0.00 H new ATOM 0 HH12 ARG A 109 12.595 0.829 1.160 1.00 0.00 H new ATOM 0 HH21 ARG A 109 14.175 3.848 0.256 1.00 0.00 H new ATOM 0 HH22 ARG A 109 14.263 2.084 0.217 1.00 0.00 H new ATOM 1590 N ALA A 110 9.428 7.635 -1.662 1.00 0.00 N ATOM 1591 CA ALA A 110 9.048 7.809 -3.060 1.00 0.00 C ATOM 1592 C ALA A 110 9.438 6.591 -3.890 1.00 0.00 C ATOM 1593 O ALA A 110 10.613 6.237 -3.977 1.00 0.00 O ATOM 1594 CB ALA A 110 9.692 9.065 -3.629 1.00 0.00 C ATOM 0 H ALA A 110 10.412 7.819 -1.466 1.00 0.00 H new ATOM 0 HA ALA A 110 7.964 7.916 -3.106 1.00 0.00 H new ATOM 0 HB1 ALA A 110 9.400 9.183 -4.673 1.00 0.00 H new ATOM 0 HB2 ALA A 110 9.361 9.934 -3.059 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.777 8.980 -3.563 1.00 0.00 H new ATOM 1600 N TYR A 111 8.444 5.954 -4.497 1.00 0.00 N ATOM 1601 CA TYR A 111 8.682 4.772 -5.319 1.00 0.00 C ATOM 1602 C TYR A 111 7.842 4.815 -6.591 1.00 0.00 C ATOM 1603 O TYR A 111 6.872 5.569 -6.685 1.00 0.00 O ATOM 1604 CB TYR A 111 8.364 3.503 -4.527 1.00 0.00 C ATOM 1605 CG TYR A 111 6.927 3.421 -4.065 1.00 0.00 C ATOM 1606 CD1 TYR A 111 6.536 3.965 -2.848 1.00 0.00 C ATOM 1607 CD2 TYR A 111 5.961 2.798 -4.845 1.00 0.00 C ATOM 1608 CE1 TYR A 111 5.224 3.892 -2.421 1.00 0.00 C ATOM 1609 CE2 TYR A 111 4.645 2.721 -4.427 1.00 0.00 C ATOM 1610 CZ TYR A 111 4.283 3.269 -3.214 1.00 0.00 C ATOM 1611 OH TYR A 111 2.975 3.194 -2.794 1.00 0.00 O ATOM 0 H TYR A 111 7.465 6.235 -4.436 1.00 0.00 H new ATOM 0 HA TYR A 111 9.735 4.762 -5.601 1.00 0.00 H new ATOM 0 HB2 TYR A 111 8.588 2.634 -5.145 1.00 0.00 H new ATOM 0 HB3 TYR A 111 9.020 3.454 -3.658 1.00 0.00 H new ATOM 0 HD1 TYR A 111 7.270 4.454 -2.225 1.00 0.00 H new ATOM 0 HD2 TYR A 111 6.243 2.366 -5.794 1.00 0.00 H new ATOM 0 HE1 TYR A 111 4.937 4.320 -1.472 1.00 0.00 H new ATOM 0 HE2 TYR A 111 3.906 2.235 -5.046 1.00 0.00 H new ATOM 0 HH TYR A 111 2.441 2.725 -3.469 1.00 0.00 H new ATOM 1621 N LYS A 112 8.220 3.999 -7.570 1.00 0.00 N ATOM 1622 CA LYS A 112 7.502 3.940 -8.838 1.00 0.00 C ATOM 1623 C LYS A 112 7.209 2.496 -9.229 1.00 0.00 C ATOM 1624 O LYS A 112 8.082 1.631 -9.148 1.00 0.00 O ATOM 1625 CB LYS A 112 8.314 4.624 -9.939 1.00 0.00 C ATOM 1626 CG LYS A 112 8.506 6.114 -9.717 1.00 0.00 C ATOM 1627 CD LYS A 112 9.779 6.401 -8.937 1.00 0.00 C ATOM 1628 CE LYS A 112 9.566 7.502 -7.908 1.00 0.00 C ATOM 1629 NZ LYS A 112 9.916 8.843 -8.450 1.00 0.00 N ATOM 0 H LYS A 112 9.020 3.369 -7.509 1.00 0.00 H new ATOM 0 HA LYS A 112 6.554 4.464 -8.716 1.00 0.00 H new ATOM 0 HB2 LYS A 112 9.291 4.147 -10.008 1.00 0.00 H new ATOM 0 HB3 LYS A 112 7.816 4.469 -10.896 1.00 0.00 H new ATOM 0 HG2 LYS A 112 8.545 6.624 -10.679 1.00 0.00 H new ATOM 0 HG3 LYS A 112 7.649 6.516 -9.177 1.00 0.00 H new ATOM 0 HD2 LYS A 112 10.112 5.492 -8.436 1.00 0.00 H new ATOM 0 HD3 LYS A 112 10.571 6.694 -9.626 1.00 0.00 H new ATOM 0 HE2 LYS A 112 8.525 7.501 -7.586 1.00 0.00 H new ATOM 0 HE3 LYS A 112 10.173 7.297 -7.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 10.752 9.211 -7.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 10.124 8.763 -9.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 9.117 9.493 -8.310 1.00 0.00 H new ATOM 1643 N ILE A 113 5.976 2.242 -9.657 1.00 0.00 N ATOM 1644 CA ILE A 113 5.570 0.902 -10.064 1.00 0.00 C ATOM 1645 C ILE A 113 5.543 0.775 -11.584 1.00 0.00 C ATOM 1646 O ILE A 113 5.058 1.664 -12.283 1.00 0.00 O ATOM 1647 CB ILE A 113 4.183 0.540 -9.504 1.00 0.00 C ATOM 1648 CG1 ILE A 113 4.060 0.998 -8.050 1.00 0.00 C ATOM 1649 CG2 ILE A 113 3.941 -0.958 -9.615 1.00 0.00 C ATOM 1650 CD1 ILE A 113 2.722 0.673 -7.424 1.00 0.00 C ATOM 0 H ILE A 113 5.242 2.946 -9.731 1.00 0.00 H new ATOM 0 HA ILE A 113 6.308 0.210 -9.657 1.00 0.00 H new ATOM 0 HB ILE A 113 3.425 1.056 -10.093 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.850 0.530 -7.462 1.00 0.00 H new ATOM 0 HG13 ILE A 113 4.222 2.075 -8.002 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.956 -1.198 -9.215 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.990 -1.258 -10.662 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.703 -1.493 -9.048 1.00 0.00 H new ATOM 0 HD11 ILE A 113 2.707 1.027 -6.393 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.928 1.163 -7.988 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.565 -0.406 -7.439 1.00 0.00 H new ATOM 1662 N ARG A 114 6.064 -0.339 -12.088 1.00 0.00 N ATOM 1663 CA ARG A 114 6.098 -0.584 -13.525 1.00 0.00 C ATOM 1664 C ARG A 114 5.030 -1.595 -13.930 1.00 0.00 C ATOM 1665 O ARG A 114 5.143 -2.786 -13.635 1.00 0.00 O ATOM 1666 CB ARG A 114 7.480 -1.089 -13.944 1.00 0.00 C ATOM 1667 CG ARG A 114 7.728 -1.012 -15.442 1.00 0.00 C ATOM 1668 CD ARG A 114 8.654 -2.123 -15.911 1.00 0.00 C ATOM 1669 NE ARG A 114 7.945 -3.385 -16.100 1.00 0.00 N ATOM 1670 CZ ARG A 114 8.406 -4.383 -16.845 1.00 0.00 C ATOM 1671 NH1 ARG A 114 9.572 -4.267 -17.467 1.00 0.00 N ATOM 1672 NH2 ARG A 114 7.702 -5.501 -16.968 1.00 0.00 N ATOM 0 H ARG A 114 6.468 -1.086 -11.523 1.00 0.00 H new ATOM 0 HA ARG A 114 5.893 0.358 -14.034 1.00 0.00 H new ATOM 0 HB2 ARG A 114 8.243 -0.506 -13.428 1.00 0.00 H new ATOM 0 HB3 ARG A 114 7.594 -2.123 -13.618 1.00 0.00 H new ATOM 0 HG2 ARG A 114 6.779 -1.080 -15.973 1.00 0.00 H new ATOM 0 HG3 ARG A 114 8.164 -0.044 -15.691 1.00 0.00 H new ATOM 0 HD2 ARG A 114 9.127 -1.829 -16.848 1.00 0.00 H new ATOM 0 HD3 ARG A 114 9.452 -2.262 -15.181 1.00 0.00 H new ATOM 0 HE ARG A 114 7.046 -3.507 -15.634 1.00 0.00 H new ATOM 0 HH11 ARG A 114 10.117 -3.410 -17.374 1.00 0.00 H new ATOM 0 HH12 ARG A 114 9.924 -5.035 -18.039 1.00 0.00 H new ATOM 0 HH21 ARG A 114 6.806 -5.595 -16.490 1.00 0.00 H new ATOM 0 HH22 ARG A 114 8.057 -6.267 -17.541 1.00 0.00 H new ATOM 1686 N PHE A 115 3.992 -1.114 -14.605 1.00 0.00 N ATOM 1687 CA PHE A 115 2.903 -1.974 -15.049 1.00 0.00 C ATOM 1688 C PHE A 115 3.365 -2.902 -16.169 1.00 0.00 C ATOM 1689 O PHE A 115 4.372 -2.661 -16.834 1.00 0.00 O ATOM 1690 CB PHE A 115 1.719 -1.130 -15.527 1.00 0.00 C ATOM 1691 CG PHE A 115 0.763 -0.763 -14.429 1.00 0.00 C ATOM 1692 CD1 PHE A 115 1.071 0.249 -13.534 1.00 0.00 C ATOM 1693 CD2 PHE A 115 -0.444 -1.429 -14.291 1.00 0.00 C ATOM 1694 CE1 PHE A 115 0.193 0.588 -12.521 1.00 0.00 C ATOM 1695 CE2 PHE A 115 -1.327 -1.094 -13.281 1.00 0.00 C ATOM 1696 CZ PHE A 115 -1.007 -0.083 -12.396 1.00 0.00 C ATOM 0 H PHE A 115 3.882 -0.132 -14.857 1.00 0.00 H new ATOM 0 HA PHE A 115 2.587 -2.583 -14.202 1.00 0.00 H new ATOM 0 HB2 PHE A 115 2.096 -0.218 -15.989 1.00 0.00 H new ATOM 0 HB3 PHE A 115 1.180 -1.679 -16.299 1.00 0.00 H new ATOM 0 HD1 PHE A 115 2.007 0.779 -13.629 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -0.698 -2.220 -14.981 1.00 0.00 H new ATOM 0 HE1 PHE A 115 0.446 1.377 -11.828 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -2.264 -1.622 -13.184 1.00 0.00 H new ATOM 0 HZ PHE A 115 -1.695 0.182 -11.607 1.00 0.00 H new ATOM 1706 N PRO A 116 2.610 -3.991 -16.383 1.00 0.00 N ATOM 1707 CA PRO A 116 2.921 -4.978 -17.422 1.00 0.00 C ATOM 1708 C PRO A 116 2.703 -4.429 -18.828 1.00 0.00 C ATOM 1709 O PRO A 116 3.210 -4.978 -19.805 1.00 0.00 O ATOM 1710 CB PRO A 116 1.941 -6.117 -17.134 1.00 0.00 C ATOM 1711 CG PRO A 116 0.800 -5.467 -16.430 1.00 0.00 C ATOM 1712 CD PRO A 116 1.395 -4.342 -15.629 1.00 0.00 C ATOM 0 HA PRO A 116 3.968 -5.281 -17.396 1.00 0.00 H new ATOM 0 HB2 PRO A 116 1.614 -6.600 -18.055 1.00 0.00 H new ATOM 0 HB3 PRO A 116 2.401 -6.888 -16.515 1.00 0.00 H new ATOM 0 HG2 PRO A 116 0.064 -5.093 -17.142 1.00 0.00 H new ATOM 0 HG3 PRO A 116 0.285 -6.177 -15.783 1.00 0.00 H new ATOM 0 HD2 PRO A 116 0.711 -3.497 -15.554 1.00 0.00 H new ATOM 0 HD3 PRO A 116 1.630 -4.654 -14.611 1.00 0.00 H new ATOM 1720 N ASN A 117 1.943 -3.342 -18.922 1.00 0.00 N ATOM 1721 CA ASN A 117 1.657 -2.719 -20.209 1.00 0.00 C ATOM 1722 C ASN A 117 2.798 -1.798 -20.633 1.00 0.00 C ATOM 1723 O ASN A 117 2.779 -1.233 -21.725 1.00 0.00 O ATOM 1724 CB ASN A 117 0.350 -1.929 -20.137 1.00 0.00 C ATOM 1725 CG ASN A 117 -0.857 -2.825 -19.931 1.00 0.00 C ATOM 1726 OD1 ASN A 117 -0.742 -3.922 -19.384 1.00 0.00 O ATOM 1727 ND2 ASN A 117 -2.021 -2.360 -20.367 1.00 0.00 N ATOM 0 H ASN A 117 1.515 -2.875 -18.123 1.00 0.00 H new ATOM 0 HA ASN A 117 1.556 -3.509 -20.953 1.00 0.00 H new ATOM 0 HB2 ASN A 117 0.408 -1.209 -19.321 1.00 0.00 H new ATOM 0 HB3 ASN A 117 0.223 -1.358 -21.057 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -2.867 -2.918 -20.254 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -2.069 -1.445 -20.815 1.00 0.00 H new ATOM 1734 N GLY A 118 3.791 -1.653 -19.760 1.00 0.00 N ATOM 1735 CA GLY A 118 4.926 -0.801 -20.063 1.00 0.00 C ATOM 1736 C GLY A 118 4.835 0.549 -19.380 1.00 0.00 C ATOM 1737 O GLY A 118 5.825 1.275 -19.288 1.00 0.00 O ATOM 0 H GLY A 118 3.829 -2.110 -18.849 1.00 0.00 H new ATOM 0 HA2 GLY A 118 5.844 -1.300 -19.754 1.00 0.00 H new ATOM 0 HA3 GLY A 118 4.990 -0.656 -21.141 1.00 0.00 H new ATOM 1741 N THR A 119 3.642 0.889 -18.902 1.00 0.00 N ATOM 1742 CA THR A 119 3.425 2.162 -18.226 1.00 0.00 C ATOM 1743 C THR A 119 4.035 2.157 -16.830 1.00 0.00 C ATOM 1744 O THR A 119 4.397 1.103 -16.304 1.00 0.00 O ATOM 1745 CB THR A 119 1.924 2.492 -18.116 1.00 0.00 C ATOM 1746 OG1 THR A 119 1.299 1.616 -17.170 1.00 0.00 O ATOM 1747 CG2 THR A 119 1.239 2.356 -19.469 1.00 0.00 C ATOM 0 H THR A 119 2.812 0.301 -18.971 1.00 0.00 H new ATOM 0 HA THR A 119 3.915 2.926 -18.830 1.00 0.00 H new ATOM 0 HB THR A 119 1.825 3.524 -17.778 1.00 0.00 H new ATOM 0 HG1 THR A 119 0.346 1.833 -17.104 1.00 0.00 H new ATOM 0 HG21 THR A 119 0.180 2.594 -19.366 1.00 0.00 H new ATOM 0 HG22 THR A 119 1.698 3.043 -20.180 1.00 0.00 H new ATOM 0 HG23 THR A 119 1.348 1.334 -19.831 1.00 0.00 H new ATOM 1755 N VAL A 120 4.147 3.338 -16.232 1.00 0.00 N ATOM 1756 CA VAL A 120 4.713 3.469 -14.895 1.00 0.00 C ATOM 1757 C VAL A 120 3.963 4.518 -14.081 1.00 0.00 C ATOM 1758 O VAL A 120 3.566 5.558 -14.607 1.00 0.00 O ATOM 1759 CB VAL A 120 6.205 3.846 -14.951 1.00 0.00 C ATOM 1760 CG1 VAL A 120 6.383 5.229 -15.558 1.00 0.00 C ATOM 1761 CG2 VAL A 120 6.823 3.782 -13.562 1.00 0.00 C ATOM 0 H VAL A 120 3.853 4.219 -16.653 1.00 0.00 H new ATOM 0 HA VAL A 120 4.611 2.498 -14.411 1.00 0.00 H new ATOM 0 HB VAL A 120 6.720 3.126 -15.587 1.00 0.00 H new ATOM 0 HG11 VAL A 120 7.444 5.479 -15.590 1.00 0.00 H new ATOM 0 HG12 VAL A 120 5.978 5.237 -16.570 1.00 0.00 H new ATOM 0 HG13 VAL A 120 5.855 5.964 -14.950 1.00 0.00 H new ATOM 0 HG21 VAL A 120 7.878 4.051 -13.620 1.00 0.00 H new ATOM 0 HG22 VAL A 120 6.307 4.478 -12.902 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.728 2.770 -13.168 1.00 0.00 H new ATOM 1771 N ASP A 121 3.776 4.239 -12.795 1.00 0.00 N ATOM 1772 CA ASP A 121 3.076 5.159 -11.908 1.00 0.00 C ATOM 1773 C ASP A 121 3.963 5.562 -10.733 1.00 0.00 C ATOM 1774 O ASP A 121 4.581 4.713 -10.090 1.00 0.00 O ATOM 1775 CB ASP A 121 1.784 4.522 -11.394 1.00 0.00 C ATOM 1776 CG ASP A 121 0.668 5.534 -11.223 1.00 0.00 C ATOM 1777 OD1 ASP A 121 0.959 6.674 -10.807 1.00 0.00 O ATOM 1778 OD2 ASP A 121 -0.497 5.184 -11.506 1.00 0.00 O ATOM 0 H ASP A 121 4.100 3.383 -12.345 1.00 0.00 H new ATOM 0 HA ASP A 121 2.828 6.055 -12.476 1.00 0.00 H new ATOM 0 HB2 ASP A 121 1.463 3.746 -12.089 1.00 0.00 H new ATOM 0 HB3 ASP A 121 1.978 4.034 -10.439 1.00 0.00 H new ATOM 1783 N VAL A 122 4.020 6.861 -10.460 1.00 0.00 N ATOM 1784 CA VAL A 122 4.831 7.375 -9.363 1.00 0.00 C ATOM 1785 C VAL A 122 3.993 7.574 -8.105 1.00 0.00 C ATOM 1786 O VAL A 122 2.949 8.227 -8.139 1.00 0.00 O ATOM 1787 CB VAL A 122 5.500 8.712 -9.738 1.00 0.00 C ATOM 1788 CG1 VAL A 122 6.379 9.206 -8.600 1.00 0.00 C ATOM 1789 CG2 VAL A 122 6.304 8.564 -11.020 1.00 0.00 C ATOM 0 H VAL A 122 3.515 7.576 -10.983 1.00 0.00 H new ATOM 0 HA VAL A 122 5.604 6.632 -9.167 1.00 0.00 H new ATOM 0 HB VAL A 122 4.720 9.454 -9.910 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.843 10.151 -8.883 1.00 0.00 H new ATOM 0 HG12 VAL A 122 5.770 9.353 -7.708 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.154 8.469 -8.393 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.769 9.518 -11.270 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.077 7.809 -10.879 1.00 0.00 H new ATOM 0 HG23 VAL A 122 5.643 8.260 -11.831 1.00 0.00 H new ATOM 1799 N PHE A 123 4.456 7.008 -6.996 1.00 0.00 N ATOM 1800 CA PHE A 123 3.747 7.122 -5.727 1.00 0.00 C ATOM 1801 C PHE A 123 4.710 7.478 -4.597 1.00 0.00 C ATOM 1802 O PHE A 123 5.834 6.978 -4.545 1.00 0.00 O ATOM 1803 CB PHE A 123 3.024 5.814 -5.402 1.00 0.00 C ATOM 1804 CG PHE A 123 1.670 5.703 -6.041 1.00 0.00 C ATOM 1805 CD1 PHE A 123 1.528 5.152 -7.305 1.00 0.00 C ATOM 1806 CD2 PHE A 123 0.538 6.149 -5.379 1.00 0.00 C ATOM 1807 CE1 PHE A 123 0.284 5.050 -7.896 1.00 0.00 C ATOM 1808 CE2 PHE A 123 -0.710 6.049 -5.965 1.00 0.00 C ATOM 1809 CZ PHE A 123 -0.837 5.498 -7.225 1.00 0.00 C ATOM 0 H PHE A 123 5.319 6.466 -6.950 1.00 0.00 H new ATOM 0 HA PHE A 123 3.012 7.921 -5.821 1.00 0.00 H new ATOM 0 HB2 PHE A 123 3.641 4.977 -5.728 1.00 0.00 H new ATOM 0 HB3 PHE A 123 2.915 5.727 -4.321 1.00 0.00 H new ATOM 0 HD1 PHE A 123 2.401 4.798 -7.834 1.00 0.00 H new ATOM 0 HD2 PHE A 123 0.632 6.580 -4.393 1.00 0.00 H new ATOM 0 HE1 PHE A 123 0.188 4.620 -8.882 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -1.585 6.401 -5.438 1.00 0.00 H new ATOM 0 HZ PHE A 123 -1.811 5.418 -7.685 1.00 0.00 H new ATOM 1819 N ARG A 124 4.261 8.345 -3.695 1.00 0.00 N ATOM 1820 CA ARG A 124 5.082 8.769 -2.568 1.00 0.00 C ATOM 1821 C ARG A 124 4.284 8.731 -1.269 1.00 0.00 C ATOM 1822 O ARG A 124 3.090 9.029 -1.253 1.00 0.00 O ATOM 1823 CB ARG A 124 5.621 10.181 -2.805 1.00 0.00 C ATOM 1824 CG ARG A 124 6.309 10.353 -4.150 1.00 0.00 C ATOM 1825 CD ARG A 124 6.525 11.821 -4.482 1.00 0.00 C ATOM 1826 NE ARG A 124 7.940 12.184 -4.464 1.00 0.00 N ATOM 1827 CZ ARG A 124 8.606 12.487 -3.356 1.00 0.00 C ATOM 1828 NH1 ARG A 124 7.990 12.472 -2.183 1.00 0.00 N ATOM 1829 NH2 ARG A 124 9.892 12.807 -3.421 1.00 0.00 N ATOM 0 H ARG A 124 3.333 8.767 -3.723 1.00 0.00 H new ATOM 0 HA ARG A 124 5.919 8.077 -2.481 1.00 0.00 H new ATOM 0 HB2 ARG A 124 4.798 10.892 -2.734 1.00 0.00 H new ATOM 0 HB3 ARG A 124 6.326 10.430 -2.012 1.00 0.00 H new ATOM 0 HG2 ARG A 124 7.269 9.837 -4.137 1.00 0.00 H new ATOM 0 HG3 ARG A 124 5.707 9.887 -4.930 1.00 0.00 H new ATOM 0 HD2 ARG A 124 6.108 12.035 -5.466 1.00 0.00 H new ATOM 0 HD3 ARG A 124 5.983 12.438 -3.765 1.00 0.00 H new ATOM 0 HE ARG A 124 8.444 12.206 -5.351 1.00 0.00 H new ATOM 0 HH11 ARG A 124 7.001 12.227 -2.129 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.505 12.705 -1.334 1.00 0.00 H new ATOM 0 HH21 ARG A 124 10.369 12.820 -4.322 1.00 0.00 H new ATOM 0 HH22 ARG A 124 10.403 13.040 -2.570 1.00 0.00 H new ATOM 1843 N GLY A 125 4.951 8.359 -0.180 1.00 0.00 N ATOM 1844 CA GLY A 125 4.288 8.288 1.108 1.00 0.00 C ATOM 1845 C GLY A 125 4.788 7.133 1.955 1.00 0.00 C ATOM 1846 O GLY A 125 5.685 6.398 1.544 1.00 0.00 O ATOM 0 H GLY A 125 5.939 8.106 -0.168 1.00 0.00 H new ATOM 0 HA2 GLY A 125 4.444 9.223 1.646 1.00 0.00 H new ATOM 0 HA3 GLY A 125 3.214 8.184 0.955 1.00 0.00 H new ATOM 1850 N TRP A 126 4.209 6.976 3.139 1.00 0.00 N ATOM 1851 CA TRP A 126 4.603 5.904 4.046 1.00 0.00 C ATOM 1852 C TRP A 126 3.456 4.921 4.258 1.00 0.00 C ATOM 1853 O TRP A 126 2.287 5.306 4.253 1.00 0.00 O ATOM 1854 CB TRP A 126 5.049 6.483 5.389 1.00 0.00 C ATOM 1855 CG TRP A 126 3.955 7.201 6.120 1.00 0.00 C ATOM 1856 CD1 TRP A 126 3.452 8.438 5.833 1.00 0.00 C ATOM 1857 CD2 TRP A 126 3.232 6.726 7.261 1.00 0.00 C ATOM 1858 NE1 TRP A 126 2.458 8.759 6.726 1.00 0.00 N ATOM 1859 CE2 TRP A 126 2.304 7.726 7.611 1.00 0.00 C ATOM 1860 CE3 TRP A 126 3.277 5.553 8.019 1.00 0.00 C ATOM 1861 CZ2 TRP A 126 1.431 7.587 8.687 1.00 0.00 C ATOM 1862 CZ3 TRP A 126 2.409 5.417 9.086 1.00 0.00 C ATOM 1863 CH2 TRP A 126 1.496 6.428 9.412 1.00 0.00 C ATOM 0 H TRP A 126 3.465 7.577 3.494 1.00 0.00 H new ATOM 0 HA TRP A 126 5.438 5.368 3.594 1.00 0.00 H new ATOM 0 HB2 TRP A 126 5.427 5.676 6.017 1.00 0.00 H new ATOM 0 HB3 TRP A 126 5.877 7.172 5.222 1.00 0.00 H new ATOM 0 HD1 TRP A 126 3.786 9.070 5.024 1.00 0.00 H new ATOM 0 HE1 TRP A 126 1.922 9.627 6.729 1.00 0.00 H new ATOM 0 HE3 TRP A 126 3.977 4.767 7.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 0.727 8.366 8.940 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 2.435 4.515 9.679 1.00 0.00 H new ATOM 0 HH2 TRP A 126 0.831 6.290 10.251 1.00 0.00 H new ATOM 1874 N VAL A 127 3.799 3.651 4.446 1.00 0.00 N ATOM 1875 CA VAL A 127 2.798 2.613 4.662 1.00 0.00 C ATOM 1876 C VAL A 127 2.384 2.545 6.128 1.00 0.00 C ATOM 1877 O VAL A 127 3.207 2.726 7.025 1.00 0.00 O ATOM 1878 CB VAL A 127 3.319 1.232 4.222 1.00 0.00 C ATOM 1879 CG1 VAL A 127 3.640 1.230 2.735 1.00 0.00 C ATOM 1880 CG2 VAL A 127 4.538 0.836 5.040 1.00 0.00 C ATOM 0 H VAL A 127 4.762 3.316 4.453 1.00 0.00 H new ATOM 0 HA VAL A 127 1.932 2.877 4.055 1.00 0.00 H new ATOM 0 HB VAL A 127 2.536 0.495 4.401 1.00 0.00 H new ATOM 0 HG11 VAL A 127 4.007 0.246 2.443 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.739 1.464 2.168 1.00 0.00 H new ATOM 0 HG13 VAL A 127 4.405 1.978 2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.892 -0.142 4.715 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.328 1.574 4.897 1.00 0.00 H new ATOM 0 HG23 VAL A 127 4.269 0.792 6.095 1.00 0.00 H new ATOM 1890 N SER A 128 1.102 2.283 6.363 1.00 0.00 N ATOM 1891 CA SER A 128 0.577 2.194 7.720 1.00 0.00 C ATOM 1892 C SER A 128 -0.325 0.973 7.875 1.00 0.00 C ATOM 1893 O SER A 128 -1.129 0.895 8.805 1.00 0.00 O ATOM 1894 CB SER A 128 -0.198 3.464 8.074 1.00 0.00 C ATOM 1895 OG SER A 128 -0.037 3.796 9.443 1.00 0.00 O ATOM 0 H SER A 128 0.408 2.129 5.631 1.00 0.00 H new ATOM 0 HA SER A 128 1.420 2.090 8.403 1.00 0.00 H new ATOM 0 HB2 SER A 128 0.149 4.290 7.453 1.00 0.00 H new ATOM 0 HB3 SER A 128 -1.256 3.322 7.853 1.00 0.00 H new ATOM 0 HG SER A 128 0.468 4.632 9.520 1.00 0.00 H new ATOM 1901 N SER A 129 -0.187 0.023 6.956 1.00 0.00 N ATOM 1902 CA SER A 129 -0.992 -1.193 6.986 1.00 0.00 C ATOM 1903 C SER A 129 -0.148 -2.413 6.631 1.00 0.00 C ATOM 1904 O SER A 129 0.237 -2.600 5.476 1.00 0.00 O ATOM 1905 CB SER A 129 -2.170 -1.074 6.018 1.00 0.00 C ATOM 1906 OG SER A 129 -3.308 -0.527 6.662 1.00 0.00 O ATOM 0 H SER A 129 0.475 0.072 6.181 1.00 0.00 H new ATOM 0 HA SER A 129 -1.375 -1.321 7.999 1.00 0.00 H new ATOM 0 HB2 SER A 129 -1.889 -0.444 5.174 1.00 0.00 H new ATOM 0 HB3 SER A 129 -2.414 -2.057 5.615 1.00 0.00 H new ATOM 0 HG SER A 129 -4.046 -0.460 6.021 1.00 0.00 H new ATOM 1912 N ILE A 130 0.137 -3.239 7.631 1.00 0.00 N ATOM 1913 CA ILE A 130 0.935 -4.441 7.425 1.00 0.00 C ATOM 1914 C ILE A 130 0.460 -5.577 8.325 1.00 0.00 C ATOM 1915 O ILE A 130 0.543 -5.488 9.549 1.00 0.00 O ATOM 1916 CB ILE A 130 2.429 -4.178 7.692 1.00 0.00 C ATOM 1917 CG1 ILE A 130 2.968 -3.132 6.716 1.00 0.00 C ATOM 1918 CG2 ILE A 130 3.222 -5.471 7.582 1.00 0.00 C ATOM 1919 CD1 ILE A 130 3.001 -3.605 5.280 1.00 0.00 C ATOM 0 H ILE A 130 -0.173 -3.098 8.593 1.00 0.00 H new ATOM 0 HA ILE A 130 0.807 -4.730 6.382 1.00 0.00 H new ATOM 0 HB ILE A 130 2.539 -3.792 8.705 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.352 -2.235 6.780 1.00 0.00 H new ATOM 0 HG13 ILE A 130 3.976 -2.849 7.020 1.00 0.00 H new ATOM 0 HG21 ILE A 130 4.276 -5.269 7.773 1.00 0.00 H new ATOM 0 HG22 ILE A 130 2.851 -6.188 8.314 1.00 0.00 H new ATOM 0 HG23 ILE A 130 3.108 -5.884 6.580 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.394 -2.812 4.645 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.641 -4.484 5.201 1.00 0.00 H new ATOM 0 HD13 ILE A 130 1.992 -3.861 4.958 1.00 0.00 H new ATOM 1931 N GLY A 131 -0.035 -6.646 7.708 1.00 0.00 N ATOM 1932 CA GLY A 131 -0.513 -7.785 8.469 1.00 0.00 C ATOM 1933 C GLY A 131 0.338 -9.021 8.260 1.00 0.00 C ATOM 1934 O GLY A 131 1.406 -8.954 7.651 1.00 0.00 O ATOM 0 H GLY A 131 -0.113 -6.743 6.696 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -0.524 -7.531 9.529 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -1.542 -8.003 8.182 1.00 0.00 H new ATOM 1938 N LYS A 132 -0.133 -10.156 8.767 1.00 0.00 N ATOM 1939 CA LYS A 132 0.592 -11.414 8.633 1.00 0.00 C ATOM 1940 C LYS A 132 0.396 -12.010 7.244 1.00 0.00 C ATOM 1941 O LYS A 132 -0.731 -12.134 6.766 1.00 0.00 O ATOM 1942 CB LYS A 132 0.128 -12.409 9.698 1.00 0.00 C ATOM 1943 CG LYS A 132 0.810 -12.225 11.043 1.00 0.00 C ATOM 1944 CD LYS A 132 0.536 -13.395 11.972 1.00 0.00 C ATOM 1945 CE LYS A 132 1.318 -13.270 13.272 1.00 0.00 C ATOM 1946 NZ LYS A 132 1.273 -14.527 14.068 1.00 0.00 N ATOM 0 H LYS A 132 -1.014 -10.230 9.275 1.00 0.00 H new ATOM 0 HA LYS A 132 1.653 -11.210 8.774 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -0.949 -12.310 9.830 1.00 0.00 H new ATOM 0 HB3 LYS A 132 0.314 -13.422 9.342 1.00 0.00 H new ATOM 0 HG2 LYS A 132 1.885 -12.120 10.896 1.00 0.00 H new ATOM 0 HG3 LYS A 132 0.460 -11.302 11.506 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -0.531 -13.445 12.191 1.00 0.00 H new ATOM 0 HD3 LYS A 132 0.803 -14.327 11.474 1.00 0.00 H new ATOM 0 HE2 LYS A 132 2.355 -13.018 13.050 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.910 -12.450 13.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 1.817 -14.402 14.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 0.286 -14.754 14.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 1.685 -15.304 13.513 1.00 0.00 H new ATOM 1960 N ALA A 133 1.500 -12.379 6.601 1.00 0.00 N ATOM 1961 CA ALA A 133 1.447 -12.967 5.268 1.00 0.00 C ATOM 1962 C ALA A 133 1.035 -14.434 5.331 1.00 0.00 C ATOM 1963 O ALA A 133 1.505 -15.186 6.184 1.00 0.00 O ATOM 1964 CB ALA A 133 2.793 -12.823 4.575 1.00 0.00 C ATOM 0 H ALA A 133 2.441 -12.281 6.982 1.00 0.00 H new ATOM 0 HA ALA A 133 0.694 -12.431 4.690 1.00 0.00 H new ATOM 0 HB1 ALA A 133 2.740 -13.266 3.581 1.00 0.00 H new ATOM 0 HB2 ALA A 133 3.046 -11.766 4.488 1.00 0.00 H new ATOM 0 HB3 ALA A 133 3.559 -13.333 5.159 1.00 0.00 H new ATOM 1970 N VAL A 134 0.153 -14.835 4.421 1.00 0.00 N ATOM 1971 CA VAL A 134 -0.323 -16.213 4.372 1.00 0.00 C ATOM 1972 C VAL A 134 0.522 -17.052 3.419 1.00 0.00 C ATOM 1973 O VAL A 134 0.660 -16.723 2.241 1.00 0.00 O ATOM 1974 CB VAL A 134 -1.797 -16.283 3.932 1.00 0.00 C ATOM 1975 CG1 VAL A 134 -2.325 -17.704 4.056 1.00 0.00 C ATOM 1976 CG2 VAL A 134 -2.643 -15.318 4.748 1.00 0.00 C ATOM 0 H VAL A 134 -0.247 -14.225 3.708 1.00 0.00 H new ATOM 0 HA VAL A 134 -0.235 -16.615 5.381 1.00 0.00 H new ATOM 0 HB VAL A 134 -1.859 -15.988 2.884 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -3.368 -17.733 3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -1.736 -18.368 3.423 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -2.250 -18.031 5.093 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -3.682 -15.381 4.424 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -2.576 -15.579 5.804 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -2.278 -14.301 4.602 1.00 0.00 H new ATOM 1986 N THR A 135 1.085 -18.139 3.938 1.00 0.00 N ATOM 1987 CA THR A 135 1.917 -19.026 3.135 1.00 0.00 C ATOM 1988 C THR A 135 1.094 -20.167 2.546 1.00 0.00 C ATOM 1989 O THR A 135 0.330 -20.823 3.253 1.00 0.00 O ATOM 1990 CB THR A 135 3.073 -19.615 3.963 1.00 0.00 C ATOM 1991 OG1 THR A 135 3.733 -18.575 4.693 1.00 0.00 O ATOM 1992 CG2 THR A 135 4.075 -20.327 3.066 1.00 0.00 C ATOM 0 H THR A 135 0.980 -18.426 4.911 1.00 0.00 H new ATOM 0 HA THR A 135 2.331 -18.425 2.326 1.00 0.00 H new ATOM 0 HB THR A 135 2.656 -20.340 4.662 1.00 0.00 H new ATOM 0 HG1 THR A 135 4.466 -18.959 5.218 1.00 0.00 H new ATOM 0 HG21 THR A 135 4.882 -20.735 3.674 1.00 0.00 H new ATOM 0 HG22 THR A 135 3.576 -21.138 2.535 1.00 0.00 H new ATOM 0 HG23 THR A 135 4.485 -19.619 2.345 1.00 0.00 H new ATOM 2000 N ALA A 136 1.257 -20.400 1.248 1.00 0.00 N ATOM 2001 CA ALA A 136 0.533 -21.464 0.565 1.00 0.00 C ATOM 2002 C ALA A 136 1.289 -21.938 -0.671 1.00 0.00 C ATOM 2003 O ALA A 136 1.721 -21.132 -1.494 1.00 0.00 O ATOM 2004 CB ALA A 136 -0.863 -20.992 0.185 1.00 0.00 C ATOM 0 H ALA A 136 1.885 -19.865 0.648 1.00 0.00 H new ATOM 0 HA ALA A 136 0.446 -22.308 1.249 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -1.393 -21.797 -0.325 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -1.409 -20.711 1.085 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.788 -20.130 -0.478 1.00 0.00 H new ATOM 2010 N LYS A 137 1.445 -23.252 -0.796 1.00 0.00 N ATOM 2011 CA LYS A 137 2.149 -23.834 -1.932 1.00 0.00 C ATOM 2012 C LYS A 137 3.518 -23.187 -2.114 1.00 0.00 C ATOM 2013 O LYS A 137 3.874 -22.767 -3.215 1.00 0.00 O ATOM 2014 CB LYS A 137 1.321 -23.671 -3.209 1.00 0.00 C ATOM 2015 CG LYS A 137 0.133 -24.613 -3.289 1.00 0.00 C ATOM 2016 CD LYS A 137 -1.082 -24.041 -2.578 1.00 0.00 C ATOM 2017 CE LYS A 137 -2.361 -24.742 -3.009 1.00 0.00 C ATOM 2018 NZ LYS A 137 -2.929 -24.148 -4.251 1.00 0.00 N ATOM 0 H LYS A 137 1.093 -23.934 -0.124 1.00 0.00 H new ATOM 0 HA LYS A 137 2.293 -24.896 -1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 137 0.964 -22.643 -3.271 1.00 0.00 H new ATOM 0 HB3 LYS A 137 1.965 -23.838 -4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -0.112 -24.803 -4.334 1.00 0.00 H new ATOM 0 HG3 LYS A 137 0.398 -25.572 -2.844 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -0.956 -24.143 -1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -1.161 -22.975 -2.790 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -2.157 -25.800 -3.173 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -3.097 -24.680 -2.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -3.800 -24.654 -4.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -3.147 -23.144 -4.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -2.237 -24.230 -5.023 1.00 0.00 H new ATOM 2032 N GLU A 138 4.280 -23.111 -1.029 1.00 0.00 N ATOM 2033 CA GLU A 138 5.612 -22.515 -1.070 1.00 0.00 C ATOM 2034 C GLU A 138 5.550 -21.083 -1.593 1.00 0.00 C ATOM 2035 O GLU A 138 6.536 -20.554 -2.106 1.00 0.00 O ATOM 2036 CB GLU A 138 6.541 -23.351 -1.952 1.00 0.00 C ATOM 2037 CG GLU A 138 6.461 -24.844 -1.676 1.00 0.00 C ATOM 2038 CD GLU A 138 7.720 -25.581 -2.087 1.00 0.00 C ATOM 2039 OE1 GLU A 138 8.825 -25.053 -1.840 1.00 0.00 O ATOM 2040 OE2 GLU A 138 7.601 -26.687 -2.655 1.00 0.00 O ATOM 0 H GLU A 138 3.999 -23.454 -0.110 1.00 0.00 H new ATOM 0 HA GLU A 138 6.006 -22.496 -0.054 1.00 0.00 H new ATOM 0 HB2 GLU A 138 6.295 -23.170 -2.998 1.00 0.00 H new ATOM 0 HB3 GLU A 138 7.568 -23.017 -1.803 1.00 0.00 H new ATOM 0 HG2 GLU A 138 6.281 -25.004 -0.613 1.00 0.00 H new ATOM 0 HG3 GLU A 138 5.608 -25.263 -2.210 1.00 0.00 H new ATOM 2047 N VAL A 139 4.383 -20.460 -1.460 1.00 0.00 N ATOM 2048 CA VAL A 139 4.192 -19.089 -1.918 1.00 0.00 C ATOM 2049 C VAL A 139 3.409 -18.272 -0.895 1.00 0.00 C ATOM 2050 O VAL A 139 2.280 -18.617 -0.543 1.00 0.00 O ATOM 2051 CB VAL A 139 3.451 -19.046 -3.268 1.00 0.00 C ATOM 2052 CG1 VAL A 139 3.214 -17.608 -3.703 1.00 0.00 C ATOM 2053 CG2 VAL A 139 4.231 -19.810 -4.328 1.00 0.00 C ATOM 0 H VAL A 139 3.556 -20.883 -1.039 1.00 0.00 H new ATOM 0 HA VAL A 139 5.184 -18.656 -2.043 1.00 0.00 H new ATOM 0 HB VAL A 139 2.481 -19.527 -3.145 1.00 0.00 H new ATOM 0 HG11 VAL A 139 2.690 -17.599 -4.658 1.00 0.00 H new ATOM 0 HG12 VAL A 139 2.611 -17.096 -2.953 1.00 0.00 H new ATOM 0 HG13 VAL A 139 4.171 -17.098 -3.810 1.00 0.00 H new ATOM 0 HG21 VAL A 139 3.693 -19.769 -5.275 1.00 0.00 H new ATOM 0 HG22 VAL A 139 5.216 -19.359 -4.450 1.00 0.00 H new ATOM 0 HG23 VAL A 139 4.343 -20.849 -4.019 1.00 0.00 H new ATOM 2063 N ILE A 140 4.015 -17.188 -0.424 1.00 0.00 N ATOM 2064 CA ILE A 140 3.374 -16.321 0.557 1.00 0.00 C ATOM 2065 C ILE A 140 2.678 -15.146 -0.120 1.00 0.00 C ATOM 2066 O ILE A 140 3.103 -14.683 -1.180 1.00 0.00 O ATOM 2067 CB ILE A 140 4.390 -15.782 1.581 1.00 0.00 C ATOM 2068 CG1 ILE A 140 5.455 -16.838 1.880 1.00 0.00 C ATOM 2069 CG2 ILE A 140 3.680 -15.359 2.859 1.00 0.00 C ATOM 2070 CD1 ILE A 140 6.470 -16.398 2.912 1.00 0.00 C ATOM 0 H ILE A 140 4.949 -16.889 -0.706 1.00 0.00 H new ATOM 0 HA ILE A 140 2.633 -16.927 1.078 1.00 0.00 H new ATOM 0 HB ILE A 140 4.883 -14.907 1.156 1.00 0.00 H new ATOM 0 HG12 ILE A 140 4.965 -17.747 2.229 1.00 0.00 H new ATOM 0 HG13 ILE A 140 5.975 -17.090 0.956 1.00 0.00 H new ATOM 0 HG21 ILE A 140 4.411 -14.980 3.573 1.00 0.00 H new ATOM 0 HG22 ILE A 140 2.956 -14.576 2.631 1.00 0.00 H new ATOM 0 HG23 ILE A 140 3.163 -16.217 3.289 1.00 0.00 H new ATOM 0 HD11 ILE A 140 7.194 -17.197 3.074 1.00 0.00 H new ATOM 0 HD12 ILE A 140 6.987 -15.506 2.557 1.00 0.00 H new ATOM 0 HD13 ILE A 140 5.962 -16.174 3.850 1.00 0.00 H new ATOM 2082 N THR A 141 1.606 -14.662 0.499 1.00 0.00 N ATOM 2083 CA THR A 141 0.851 -13.540 -0.043 1.00 0.00 C ATOM 2084 C THR A 141 0.422 -12.580 1.062 1.00 0.00 C ATOM 2085 O THR A 141 0.119 -13.001 2.179 1.00 0.00 O ATOM 2086 CB THR A 141 -0.400 -14.019 -0.804 1.00 0.00 C ATOM 2087 OG1 THR A 141 -0.920 -15.206 -0.195 1.00 0.00 O ATOM 2088 CG2 THR A 141 -0.073 -14.293 -2.264 1.00 0.00 C ATOM 0 H THR A 141 1.241 -15.030 1.377 1.00 0.00 H new ATOM 0 HA THR A 141 1.513 -13.020 -0.736 1.00 0.00 H new ATOM 0 HB THR A 141 -1.150 -13.230 -0.758 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.716 -15.503 -0.684 1.00 0.00 H new ATOM 0 HG21 THR A 141 -0.971 -14.630 -2.781 1.00 0.00 H new ATOM 0 HG22 THR A 141 0.294 -13.380 -2.732 1.00 0.00 H new ATOM 0 HG23 THR A 141 0.693 -15.066 -2.326 1.00 0.00 H new ATOM 2096 N ARG A 142 0.399 -11.290 0.744 1.00 0.00 N ATOM 2097 CA ARG A 142 0.008 -10.272 1.711 1.00 0.00 C ATOM 2098 C ARG A 142 -0.344 -8.963 1.009 1.00 0.00 C ATOM 2099 O ARG A 142 0.399 -8.486 0.152 1.00 0.00 O ATOM 2100 CB ARG A 142 1.135 -10.036 2.718 1.00 0.00 C ATOM 2101 CG ARG A 142 0.798 -8.996 3.775 1.00 0.00 C ATOM 2102 CD ARG A 142 0.075 -9.620 4.959 1.00 0.00 C ATOM 2103 NE ARG A 142 -1.302 -9.980 4.632 1.00 0.00 N ATOM 2104 CZ ARG A 142 -2.308 -9.113 4.633 1.00 0.00 C ATOM 2105 NH1 ARG A 142 -2.092 -7.842 4.942 1.00 0.00 N ATOM 2106 NH2 ARG A 142 -3.533 -9.517 4.323 1.00 0.00 N ATOM 0 H ARG A 142 0.647 -10.925 -0.176 1.00 0.00 H new ATOM 0 HA ARG A 142 -0.875 -10.629 2.241 1.00 0.00 H new ATOM 0 HB2 ARG A 142 1.374 -10.978 3.211 1.00 0.00 H new ATOM 0 HB3 ARG A 142 2.030 -9.720 2.182 1.00 0.00 H new ATOM 0 HG2 ARG A 142 1.714 -8.515 4.119 1.00 0.00 H new ATOM 0 HG3 ARG A 142 0.174 -8.217 3.335 1.00 0.00 H new ATOM 0 HD2 ARG A 142 0.614 -10.509 5.285 1.00 0.00 H new ATOM 0 HD3 ARG A 142 0.078 -8.921 5.795 1.00 0.00 H new ATOM 0 HE ARG A 142 -1.502 -10.950 4.390 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -1.151 -7.528 5.180 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -2.867 -7.178 4.942 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -3.703 -10.494 4.084 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -4.305 -8.851 4.324 1.00 0.00 H new ATOM 2120 N THR A 143 -1.484 -8.387 1.379 1.00 0.00 N ATOM 2121 CA THR A 143 -1.936 -7.136 0.785 1.00 0.00 C ATOM 2122 C THR A 143 -1.436 -5.938 1.582 1.00 0.00 C ATOM 2123 O THR A 143 -1.728 -5.804 2.771 1.00 0.00 O ATOM 2124 CB THR A 143 -3.474 -7.078 0.701 1.00 0.00 C ATOM 2125 OG1 THR A 143 -3.888 -5.801 0.202 1.00 0.00 O ATOM 2126 CG2 THR A 143 -4.099 -7.322 2.065 1.00 0.00 C ATOM 0 H THR A 143 -2.111 -8.768 2.088 1.00 0.00 H new ATOM 0 HA THR A 143 -1.523 -7.096 -0.223 1.00 0.00 H new ATOM 0 HB THR A 143 -3.810 -7.860 0.020 1.00 0.00 H new ATOM 0 HG1 THR A 143 -4.866 -5.772 0.150 1.00 0.00 H new ATOM 0 HG21 THR A 143 -5.185 -7.276 1.981 1.00 0.00 H new ATOM 0 HG22 THR A 143 -3.804 -8.306 2.429 1.00 0.00 H new ATOM 0 HG23 THR A 143 -3.757 -6.559 2.764 1.00 0.00 H new ATOM 2134 N VAL A 144 -0.683 -5.064 0.920 1.00 0.00 N ATOM 2135 CA VAL A 144 -0.144 -3.875 1.567 1.00 0.00 C ATOM 2136 C VAL A 144 -0.919 -2.628 1.157 1.00 0.00 C ATOM 2137 O VAL A 144 -1.375 -2.512 0.020 1.00 0.00 O ATOM 2138 CB VAL A 144 1.345 -3.675 1.224 1.00 0.00 C ATOM 2139 CG1 VAL A 144 1.882 -2.417 1.888 1.00 0.00 C ATOM 2140 CG2 VAL A 144 2.155 -4.894 1.639 1.00 0.00 C ATOM 0 H VAL A 144 -0.433 -5.158 -0.064 1.00 0.00 H new ATOM 0 HA VAL A 144 -0.245 -4.026 2.642 1.00 0.00 H new ATOM 0 HB VAL A 144 1.438 -3.555 0.145 1.00 0.00 H new ATOM 0 HG11 VAL A 144 2.935 -2.293 1.634 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.319 -1.552 1.537 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.777 -2.503 2.970 1.00 0.00 H new ATOM 0 HG21 VAL A 144 3.204 -4.736 1.389 1.00 0.00 H new ATOM 0 HG22 VAL A 144 2.057 -5.048 2.714 1.00 0.00 H new ATOM 0 HG23 VAL A 144 1.785 -5.773 1.112 1.00 0.00 H new ATOM 2150 N LYS A 145 -1.065 -1.695 2.092 1.00 0.00 N ATOM 2151 CA LYS A 145 -1.784 -0.453 1.830 1.00 0.00 C ATOM 2152 C LYS A 145 -1.004 0.747 2.354 1.00 0.00 C ATOM 2153 O LYS A 145 -0.492 0.728 3.474 1.00 0.00 O ATOM 2154 CB LYS A 145 -3.171 -0.497 2.478 1.00 0.00 C ATOM 2155 CG LYS A 145 -3.972 0.778 2.285 1.00 0.00 C ATOM 2156 CD LYS A 145 -4.707 0.778 0.954 1.00 0.00 C ATOM 2157 CE LYS A 145 -6.214 0.735 1.150 1.00 0.00 C ATOM 2158 NZ LYS A 145 -6.629 -0.408 2.010 1.00 0.00 N ATOM 0 H LYS A 145 -0.695 -1.775 3.039 1.00 0.00 H new ATOM 0 HA LYS A 145 -1.897 -0.347 0.751 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.731 -1.335 2.062 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -3.058 -0.688 3.545 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -4.690 0.885 3.098 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -3.305 1.639 2.334 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -4.438 1.670 0.389 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -4.391 -0.082 0.363 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -6.548 1.669 1.601 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -6.704 0.656 0.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -7.588 -0.711 1.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -5.967 -1.199 1.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -6.622 -0.113 3.007 1.00 0.00 H new ATOM 2172 N VAL A 146 -0.920 1.794 1.539 1.00 0.00 N ATOM 2173 CA VAL A 146 -0.205 3.005 1.921 1.00 0.00 C ATOM 2174 C VAL A 146 -1.173 4.103 2.349 1.00 0.00 C ATOM 2175 O VAL A 146 -2.019 4.540 1.569 1.00 0.00 O ATOM 2176 CB VAL A 146 0.670 3.530 0.766 1.00 0.00 C ATOM 2177 CG1 VAL A 146 1.296 4.866 1.134 1.00 0.00 C ATOM 2178 CG2 VAL A 146 1.740 2.511 0.405 1.00 0.00 C ATOM 0 H VAL A 146 -1.339 1.827 0.610 1.00 0.00 H new ATOM 0 HA VAL A 146 0.436 2.741 2.762 1.00 0.00 H new ATOM 0 HB VAL A 146 0.036 3.683 -0.107 1.00 0.00 H new ATOM 0 HG11 VAL A 146 1.910 5.220 0.306 1.00 0.00 H new ATOM 0 HG12 VAL A 146 0.509 5.592 1.339 1.00 0.00 H new ATOM 0 HG13 VAL A 146 1.918 4.744 2.021 1.00 0.00 H new ATOM 0 HG21 VAL A 146 2.349 2.897 -0.412 1.00 0.00 H new ATOM 0 HG22 VAL A 146 2.373 2.325 1.273 1.00 0.00 H new ATOM 0 HG23 VAL A 146 1.266 1.580 0.095 1.00 0.00 H new ATOM 2188 N THR A 147 -1.043 4.546 3.596 1.00 0.00 N ATOM 2189 CA THR A 147 -1.906 5.591 4.130 1.00 0.00 C ATOM 2190 C THR A 147 -1.089 6.782 4.619 1.00 0.00 C ATOM 2191 O THR A 147 -0.361 6.683 5.605 1.00 0.00 O ATOM 2192 CB THR A 147 -2.774 5.067 5.290 1.00 0.00 C ATOM 2193 OG1 THR A 147 -2.174 3.899 5.861 1.00 0.00 O ATOM 2194 CG2 THR A 147 -4.179 4.738 4.808 1.00 0.00 C ATOM 0 H THR A 147 -0.347 4.196 4.255 1.00 0.00 H new ATOM 0 HA THR A 147 -2.557 5.909 3.316 1.00 0.00 H new ATOM 0 HB THR A 147 -2.841 5.848 6.047 1.00 0.00 H new ATOM 0 HG1 THR A 147 -2.834 3.429 6.412 1.00 0.00 H new ATOM 0 HG21 THR A 147 -4.774 4.370 5.644 1.00 0.00 H new ATOM 0 HG22 THR A 147 -4.643 5.636 4.400 1.00 0.00 H new ATOM 0 HG23 THR A 147 -4.128 3.972 4.034 1.00 0.00 H new ATOM 2202 N ASN A 148 -1.216 7.907 3.923 1.00 0.00 N ATOM 2203 CA ASN A 148 -0.489 9.118 4.288 1.00 0.00 C ATOM 2204 C ASN A 148 -1.189 9.850 5.430 1.00 0.00 C ATOM 2205 O ASN A 148 -2.266 9.448 5.872 1.00 0.00 O ATOM 2206 CB ASN A 148 -0.359 10.044 3.077 1.00 0.00 C ATOM 2207 CG ASN A 148 0.270 9.350 1.884 1.00 0.00 C ATOM 2208 OD1 ASN A 148 1.469 9.476 1.641 1.00 0.00 O ATOM 2209 ND2 ASN A 148 -0.541 8.614 1.133 1.00 0.00 N ATOM 0 H ASN A 148 -1.815 8.006 3.103 1.00 0.00 H new ATOM 0 HA ASN A 148 0.507 8.827 4.623 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -1.345 10.415 2.799 1.00 0.00 H new ATOM 0 HB3 ASN A 148 0.243 10.911 3.349 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -0.175 8.124 0.316 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -1.529 8.538 1.373 1.00 0.00 H new ATOM 2216 N VAL A 149 -0.571 10.927 5.902 1.00 0.00 N ATOM 2217 CA VAL A 149 -1.135 11.718 6.990 1.00 0.00 C ATOM 2218 C VAL A 149 -1.853 12.952 6.458 1.00 0.00 C ATOM 2219 O VAL A 149 -1.310 13.696 5.642 1.00 0.00 O ATOM 2220 CB VAL A 149 -0.045 12.159 7.985 1.00 0.00 C ATOM 2221 CG1 VAL A 149 -0.649 13.002 9.098 1.00 0.00 C ATOM 2222 CG2 VAL A 149 0.677 10.948 8.556 1.00 0.00 C ATOM 0 H VAL A 149 0.321 11.273 5.548 1.00 0.00 H new ATOM 0 HA VAL A 149 -1.852 11.080 7.507 1.00 0.00 H new ATOM 0 HB VAL A 149 0.684 12.770 7.452 1.00 0.00 H new ATOM 0 HG11 VAL A 149 0.135 13.305 9.792 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -1.117 13.889 8.670 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -1.399 12.418 9.631 1.00 0.00 H new ATOM 0 HG21 VAL A 149 1.444 11.278 9.257 1.00 0.00 H new ATOM 0 HG22 VAL A 149 -0.038 10.309 9.075 1.00 0.00 H new ATOM 0 HG23 VAL A 149 1.143 10.387 7.746 1.00 0.00 H new ATOM 2232 N GLY A 150 -3.078 13.166 6.928 1.00 0.00 N ATOM 2233 CA GLY A 150 -3.851 14.313 6.488 1.00 0.00 C ATOM 2234 C GLY A 150 -5.289 14.260 6.964 1.00 0.00 C ATOM 2235 O GLY A 150 -5.657 14.934 7.926 1.00 0.00 O ATOM 0 H GLY A 150 -3.549 12.566 7.605 1.00 0.00 H new ATOM 0 HA2 GLY A 150 -3.383 15.226 6.857 1.00 0.00 H new ATOM 0 HA3 GLY A 150 -3.833 14.363 5.399 1.00 0.00 H new