USER MOD reduce.3.24.130724 H: found=0, std=0, add=567, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 568 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 Single : A2059 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2060 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2061 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A2062 THR OG1 : rot 180:sc= 0 USER MOD Single : A2065 THR OG1 : rot 68:sc= 1.29 USER MOD Single : A2071 THR OG1 : rot 160:sc= -1.86! USER MOD Single : A2073 THR OG1 : rot 71:sc= 1.17 USER MOD Single : A2079 THR OG1 : rot 36:sc= 0.234 USER MOD Single : A2082 SER OG : rot -42:sc= 0.339 USER MOD Single : A2084 SER OG : rot 180:sc= 0 USER MOD Single : A2087 THR OG1 : rot -156:sc= -2.64! USER MOD Single : A2090 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2096 SER OG : rot 180:sc= -0.0468 USER MOD Single : A2098 THR OG1 : rot -170:sc= 1.06 USER MOD Single : A2104 ASN : amide:sc= -1.98! C(o=-2!,f=-2!) USER MOD Single : A2105 THR OG1 : rot 180:sc= 0 USER MOD Single : A2107 THR OG1 : rot 97:sc= 0.0649 USER MOD Single : A2108 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A2109 ASN : amide:sc= -0.792 X(o=-0.79,f=-0.8) USER MOD Single : A2110 THR OG1 : rot -73:sc= 1.03 USER MOD Single : A2117 THR OG1 : rot 180:sc= 0.0244 USER MOD Single : A2122 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.55) USER MOD Single : A2124 THR OG1 : rot -170:sc= -2.27! USER MOD Single : A2126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A2129 THR OG1 : rot 64:sc= 0.331 USER MOD Single : A2130 GLN : amide:sc= -0.0649 K(o=-0.065,f=-0.63) USER MOD Single : A2131 HIS : no HD1:sc= -0.382 X(o=-0.38,f=-0.04) USER MOD Single : A2133 HIS : no HD1:sc= -0.252 X(o=-0.25,f=0) USER MOD Single : A2134 THR OG1 : rot 69:sc= 0.505 USER MOD ----------------------------------------------------------------- ATOM 198 N GLN A2059 11.623 6.511 1.273 1.00 0.87 N ATOM 199 CA GLN A2059 10.762 5.484 0.716 1.00 0.75 C ATOM 200 C GLN A2059 9.317 5.727 1.118 1.00 0.58 C ATOM 201 O GLN A2059 8.423 5.624 0.291 1.00 0.54 O ATOM 202 CB GLN A2059 11.196 4.087 1.152 1.00 0.80 C ATOM 203 CG GLN A2059 12.549 3.663 0.605 1.00 1.17 C ATOM 204 CD GLN A2059 12.573 2.202 0.206 1.00 1.86 C ATOM 205 OE1 GLN A2059 12.228 1.848 -0.917 1.00 2.83 O ATOM 206 NE2 GLN A2059 12.997 1.342 1.116 1.00 1.87 N ATOM 0 HA GLN A2059 10.847 5.539 -0.369 1.00 0.75 H new ATOM 0 HB2 GLN A2059 11.228 4.051 2.241 1.00 0.80 H new ATOM 0 HB3 GLN A2059 10.443 3.367 0.831 1.00 0.80 H new ATOM 0 HG2 GLN A2059 12.798 4.278 -0.260 1.00 1.17 H new ATOM 0 HG3 GLN A2059 13.316 3.845 1.357 1.00 1.17 H new ATOM 0 HE21 GLN A2059 13.276 1.673 2.040 1.00 1.87 H new ATOM 0 HE22 GLN A2059 13.045 0.348 0.894 1.00 1.87 H new ATOM 215 N GLN A2060 9.093 6.071 2.381 1.00 0.54 N ATOM 216 CA GLN A2060 7.739 6.242 2.893 1.00 0.45 C ATOM 217 C GLN A2060 6.932 7.247 2.084 1.00 0.44 C ATOM 218 O GLN A2060 5.745 7.053 1.896 1.00 0.42 O ATOM 219 CB GLN A2060 7.758 6.637 4.363 1.00 0.55 C ATOM 220 CG GLN A2060 8.325 5.549 5.250 1.00 0.57 C ATOM 221 CD GLN A2060 8.120 5.825 6.723 1.00 0.81 C ATOM 222 OE1 GLN A2060 7.117 5.420 7.306 1.00 1.38 O ATOM 223 NE2 GLN A2060 9.068 6.517 7.334 1.00 1.01 N ATOM 0 H GLN A2060 9.829 6.237 3.067 1.00 0.54 H new ATOM 0 HA GLN A2060 7.244 5.276 2.793 1.00 0.45 H new ATOM 0 HB2 GLN A2060 8.349 7.545 4.484 1.00 0.55 H new ATOM 0 HB3 GLN A2060 6.744 6.872 4.686 1.00 0.55 H new ATOM 0 HG2 GLN A2060 7.857 4.598 4.995 1.00 0.57 H new ATOM 0 HG3 GLN A2060 9.391 5.443 5.050 1.00 0.57 H new ATOM 0 HE21 GLN A2060 9.885 6.834 6.812 1.00 1.01 H new ATOM 0 HE22 GLN A2060 8.982 6.733 8.327 1.00 1.01 H new ATOM 232 N GLN A2061 7.566 8.305 1.588 1.00 0.58 N ATOM 233 CA GLN A2061 6.852 9.265 0.747 1.00 0.61 C ATOM 234 C GLN A2061 6.365 8.588 -0.536 1.00 0.51 C ATOM 235 O GLN A2061 5.231 8.792 -0.969 1.00 0.45 O ATOM 236 CB GLN A2061 7.730 10.479 0.420 1.00 0.83 C ATOM 237 CG GLN A2061 9.022 10.138 -0.293 1.00 0.89 C ATOM 238 CD GLN A2061 9.824 11.363 -0.685 1.00 1.29 C ATOM 239 OE1 GLN A2061 9.272 12.435 -0.932 1.00 1.75 O ATOM 240 NE2 GLN A2061 11.135 11.208 -0.761 1.00 1.97 N ATOM 0 H GLN A2061 8.551 8.519 1.748 1.00 0.58 H new ATOM 0 HA GLN A2061 5.986 9.623 1.303 1.00 0.61 H new ATOM 0 HB2 GLN A2061 7.158 11.170 -0.199 1.00 0.83 H new ATOM 0 HB3 GLN A2061 7.967 11.002 1.347 1.00 0.83 H new ATOM 0 HG2 GLN A2061 9.630 9.504 0.352 1.00 0.89 H new ATOM 0 HG3 GLN A2061 8.795 9.558 -1.187 1.00 0.89 H new ATOM 0 HE21 GLN A2061 11.555 10.303 -0.548 1.00 1.97 H new ATOM 0 HE22 GLN A2061 11.727 11.993 -1.032 1.00 1.97 H new ATOM 249 N THR A2062 7.229 7.772 -1.126 1.00 0.53 N ATOM 250 CA THR A2062 6.876 6.966 -2.286 1.00 0.50 C ATOM 251 C THR A2062 5.753 5.995 -1.946 1.00 0.39 C ATOM 252 O THR A2062 4.693 6.008 -2.566 1.00 0.42 O ATOM 253 CB THR A2062 8.095 6.167 -2.781 1.00 0.59 C ATOM 254 OG1 THR A2062 9.137 7.063 -3.185 1.00 0.74 O ATOM 255 CG2 THR A2062 7.723 5.246 -3.936 1.00 0.83 C ATOM 0 H THR A2062 8.193 7.651 -0.814 1.00 0.53 H new ATOM 0 HA THR A2062 6.542 7.644 -3.071 1.00 0.50 H new ATOM 0 HB THR A2062 8.449 5.548 -1.957 1.00 0.59 H new ATOM 0 HG1 THR A2062 9.910 6.547 -3.497 1.00 0.74 H new ATOM 0 HG21 THR A2062 8.606 4.696 -4.262 1.00 0.83 H new ATOM 0 HG22 THR A2062 6.958 4.542 -3.608 1.00 0.83 H new ATOM 0 HG23 THR A2062 7.339 5.840 -4.765 1.00 0.83 H new ATOM 263 N LEU A2063 6.003 5.168 -0.951 1.00 0.37 N ATOM 264 CA LEU A2063 5.086 4.134 -0.524 1.00 0.29 C ATOM 265 C LEU A2063 3.743 4.708 -0.082 1.00 0.22 C ATOM 266 O LEU A2063 2.696 4.131 -0.373 1.00 0.21 O ATOM 267 CB LEU A2063 5.744 3.341 0.603 1.00 0.30 C ATOM 268 CG LEU A2063 6.835 2.353 0.164 1.00 0.53 C ATOM 269 CD1 LEU A2063 7.861 2.998 -0.760 1.00 0.92 C ATOM 270 CD2 LEU A2063 7.525 1.767 1.387 1.00 0.79 C ATOM 0 H LEU A2063 6.866 5.197 -0.407 1.00 0.37 H new ATOM 0 HA LEU A2063 4.873 3.476 -1.367 1.00 0.29 H new ATOM 0 HB2 LEU A2063 6.179 4.044 1.313 1.00 0.30 H new ATOM 0 HB3 LEU A2063 4.970 2.788 1.135 1.00 0.30 H new ATOM 0 HG LEU A2063 6.349 1.557 -0.400 1.00 0.53 H new ATOM 0 HD11 LEU A2063 8.611 2.259 -1.043 1.00 0.92 H new ATOM 0 HD12 LEU A2063 7.362 3.369 -1.655 1.00 0.92 H new ATOM 0 HD13 LEU A2063 8.345 3.827 -0.244 1.00 0.92 H new ATOM 0 HD21 LEU A2063 8.298 1.067 1.068 1.00 0.79 H new ATOM 0 HD22 LEU A2063 7.980 2.570 1.968 1.00 0.79 H new ATOM 0 HD23 LEU A2063 6.793 1.244 2.002 1.00 0.79 H new ATOM 282 N ALA A2064 3.775 5.848 0.602 1.00 0.25 N ATOM 283 CA ALA A2064 2.554 6.525 1.026 1.00 0.27 C ATOM 284 C ALA A2064 1.776 7.025 -0.180 1.00 0.25 C ATOM 285 O ALA A2064 0.550 7.113 -0.145 1.00 0.30 O ATOM 286 CB ALA A2064 2.875 7.682 1.960 1.00 0.37 C ATOM 0 H ALA A2064 4.635 6.323 0.875 1.00 0.25 H new ATOM 0 HA ALA A2064 1.938 5.806 1.566 1.00 0.27 H new ATOM 0 HB1 ALA A2064 1.950 8.172 2.263 1.00 0.37 H new ATOM 0 HB2 ALA A2064 3.392 7.305 2.842 1.00 0.37 H new ATOM 0 HB3 ALA A2064 3.513 8.399 1.444 1.00 0.37 H new ATOM 292 N THR A2065 2.495 7.339 -1.249 1.00 0.24 N ATOM 293 CA THR A2065 1.865 7.780 -2.481 1.00 0.27 C ATOM 294 C THR A2065 1.377 6.569 -3.264 1.00 0.24 C ATOM 295 O THR A2065 0.341 6.615 -3.918 1.00 0.29 O ATOM 296 CB THR A2065 2.829 8.610 -3.351 1.00 0.35 C ATOM 297 OG1 THR A2065 3.351 9.712 -2.594 1.00 0.40 O ATOM 298 CG2 THR A2065 2.122 9.140 -4.589 1.00 0.42 C ATOM 0 H THR A2065 3.513 7.296 -1.286 1.00 0.24 H new ATOM 0 HA THR A2065 1.022 8.419 -2.218 1.00 0.27 H new ATOM 0 HB THR A2065 3.646 7.960 -3.664 1.00 0.35 H new ATOM 0 HG1 THR A2065 3.941 9.374 -1.888 1.00 0.40 H new ATOM 0 HG21 THR A2065 2.823 9.722 -5.187 1.00 0.42 H new ATOM 0 HG22 THR A2065 1.748 8.304 -5.180 1.00 0.42 H new ATOM 0 HG23 THR A2065 1.288 9.774 -4.288 1.00 0.42 H new ATOM 306 N LEU A2066 2.134 5.482 -3.177 1.00 0.21 N ATOM 307 CA LEU A2066 1.753 4.224 -3.799 1.00 0.21 C ATOM 308 C LEU A2066 0.431 3.732 -3.247 1.00 0.18 C ATOM 309 O LEU A2066 -0.544 3.632 -3.976 1.00 0.20 O ATOM 310 CB LEU A2066 2.836 3.165 -3.574 1.00 0.24 C ATOM 311 CG LEU A2066 2.427 1.724 -3.906 1.00 0.30 C ATOM 312 CD1 LEU A2066 1.785 1.640 -5.286 1.00 0.37 C ATOM 313 CD2 LEU A2066 3.633 0.800 -3.821 1.00 0.36 C ATOM 0 H LEU A2066 3.022 5.449 -2.677 1.00 0.21 H new ATOM 0 HA LEU A2066 1.643 4.396 -4.870 1.00 0.21 H new ATOM 0 HB2 LEU A2066 3.706 3.426 -4.177 1.00 0.24 H new ATOM 0 HB3 LEU A2066 3.148 3.205 -2.530 1.00 0.24 H new ATOM 0 HG LEU A2066 1.688 1.403 -3.172 1.00 0.30 H new ATOM 0 HD11 LEU A2066 1.505 0.607 -5.495 1.00 0.37 H new ATOM 0 HD12 LEU A2066 0.896 2.269 -5.312 1.00 0.37 H new ATOM 0 HD13 LEU A2066 2.495 1.983 -6.039 1.00 0.37 H new ATOM 0 HD21 LEU A2066 3.328 -0.219 -4.059 1.00 0.36 H new ATOM 0 HD22 LEU A2066 4.392 1.127 -4.531 1.00 0.36 H new ATOM 0 HD23 LEU A2066 4.044 0.830 -2.812 1.00 0.36 H new ATOM 325 N VAL A2067 0.414 3.428 -1.963 1.00 0.17 N ATOM 326 CA VAL A2067 -0.790 2.925 -1.309 1.00 0.18 C ATOM 327 C VAL A2067 -1.983 3.858 -1.542 1.00 0.19 C ATOM 328 O VAL A2067 -3.100 3.405 -1.806 1.00 0.22 O ATOM 329 CB VAL A2067 -0.560 2.714 0.201 1.00 0.21 C ATOM 330 CG1 VAL A2067 -0.094 3.994 0.878 1.00 0.51 C ATOM 331 CG2 VAL A2067 -1.824 2.199 0.857 1.00 0.64 C ATOM 0 H VAL A2067 1.221 3.519 -1.346 1.00 0.17 H new ATOM 0 HA VAL A2067 -1.021 1.959 -1.758 1.00 0.18 H new ATOM 0 HB VAL A2067 0.229 1.971 0.319 1.00 0.21 H new ATOM 0 HG11 VAL A2067 0.058 3.809 1.941 1.00 0.51 H new ATOM 0 HG12 VAL A2067 0.843 4.323 0.429 1.00 0.51 H new ATOM 0 HG13 VAL A2067 -0.849 4.769 0.749 1.00 0.51 H new ATOM 0 HG21 VAL A2067 -1.648 2.054 1.923 1.00 0.64 H new ATOM 0 HG22 VAL A2067 -2.627 2.922 0.717 1.00 0.64 H new ATOM 0 HG23 VAL A2067 -2.108 1.249 0.404 1.00 0.64 H new ATOM 341 N ALA A2068 -1.733 5.157 -1.463 1.00 0.19 N ATOM 342 CA ALA A2068 -2.747 6.153 -1.757 1.00 0.23 C ATOM 343 C ALA A2068 -3.221 6.041 -3.205 1.00 0.23 C ATOM 344 O ALA A2068 -4.401 5.824 -3.460 1.00 0.29 O ATOM 345 CB ALA A2068 -2.212 7.548 -1.470 1.00 0.27 C ATOM 0 H ALA A2068 -0.829 5.546 -1.195 1.00 0.19 H new ATOM 0 HA ALA A2068 -3.606 5.970 -1.111 1.00 0.23 H new ATOM 0 HB1 ALA A2068 -2.982 8.286 -1.694 1.00 0.27 H new ATOM 0 HB2 ALA A2068 -1.934 7.622 -0.419 1.00 0.27 H new ATOM 0 HB3 ALA A2068 -1.336 7.737 -2.091 1.00 0.27 H new ATOM 351 N ALA A2069 -2.298 6.153 -4.154 1.00 0.20 N ATOM 352 CA ALA A2069 -2.645 6.087 -5.568 1.00 0.22 C ATOM 353 C ALA A2069 -3.249 4.732 -5.918 1.00 0.23 C ATOM 354 O ALA A2069 -4.070 4.625 -6.831 1.00 0.29 O ATOM 355 CB ALA A2069 -1.425 6.371 -6.425 1.00 0.25 C ATOM 0 H ALA A2069 -1.304 6.290 -3.969 1.00 0.20 H new ATOM 0 HA ALA A2069 -3.396 6.850 -5.773 1.00 0.22 H new ATOM 0 HB1 ALA A2069 -1.700 6.318 -7.478 1.00 0.25 H new ATOM 0 HB2 ALA A2069 -1.045 7.367 -6.199 1.00 0.25 H new ATOM 0 HB3 ALA A2069 -0.652 5.632 -6.214 1.00 0.25 H new ATOM 361 N ALA A2070 -2.853 3.709 -5.174 1.00 0.21 N ATOM 362 CA ALA A2070 -3.391 2.376 -5.352 1.00 0.24 C ATOM 363 C ALA A2070 -4.882 2.369 -5.052 1.00 0.26 C ATOM 364 O ALA A2070 -5.693 2.044 -5.916 1.00 0.34 O ATOM 365 CB ALA A2070 -2.665 1.384 -4.462 1.00 0.25 C ATOM 0 H ALA A2070 -2.154 3.783 -4.435 1.00 0.21 H new ATOM 0 HA ALA A2070 -3.242 2.076 -6.389 1.00 0.24 H new ATOM 0 HB1 ALA A2070 -3.083 0.388 -4.610 1.00 0.25 H new ATOM 0 HB2 ALA A2070 -1.605 1.374 -4.717 1.00 0.25 H new ATOM 0 HB3 ALA A2070 -2.784 1.676 -3.419 1.00 0.25 H new ATOM 371 N THR A2071 -5.241 2.788 -3.842 1.00 0.24 N ATOM 372 CA THR A2071 -6.631 2.771 -3.411 1.00 0.28 C ATOM 373 C THR A2071 -7.430 3.832 -4.153 1.00 0.31 C ATOM 374 O THR A2071 -8.645 3.719 -4.317 1.00 0.37 O ATOM 375 CB THR A2071 -6.747 2.978 -1.887 1.00 0.30 C ATOM 376 OG1 THR A2071 -8.030 2.548 -1.425 1.00 0.38 O ATOM 377 CG2 THR A2071 -6.544 4.431 -1.500 1.00 0.29 C ATOM 0 H THR A2071 -4.587 3.143 -3.144 1.00 0.24 H new ATOM 0 HA THR A2071 -7.043 1.790 -3.649 1.00 0.28 H new ATOM 0 HB THR A2071 -5.963 2.382 -1.420 1.00 0.30 H new ATOM 0 HG1 THR A2071 -7.991 2.382 -0.460 1.00 0.38 H new ATOM 0 HG21 THR A2071 -6.633 4.535 -0.419 1.00 0.29 H new ATOM 0 HG22 THR A2071 -5.553 4.756 -1.815 1.00 0.29 H new ATOM 0 HG23 THR A2071 -7.300 5.046 -1.988 1.00 0.29 H new ATOM 385 N ALA A2072 -6.729 4.855 -4.604 1.00 0.31 N ATOM 386 CA ALA A2072 -7.313 5.891 -5.434 1.00 0.40 C ATOM 387 C ALA A2072 -7.725 5.321 -6.782 1.00 0.42 C ATOM 388 O ALA A2072 -8.620 5.843 -7.431 1.00 0.54 O ATOM 389 CB ALA A2072 -6.326 7.035 -5.601 1.00 0.47 C ATOM 0 H ALA A2072 -5.738 4.991 -4.405 1.00 0.31 H new ATOM 0 HA ALA A2072 -8.209 6.277 -4.948 1.00 0.40 H new ATOM 0 HB1 ALA A2072 -6.770 7.810 -6.225 1.00 0.47 H new ATOM 0 HB2 ALA A2072 -6.083 7.451 -4.623 1.00 0.47 H new ATOM 0 HB3 ALA A2072 -5.417 6.665 -6.074 1.00 0.47 H new ATOM 395 N THR A2073 -7.080 4.248 -7.195 1.00 0.36 N ATOM 396 CA THR A2073 -7.435 3.600 -8.444 1.00 0.40 C ATOM 397 C THR A2073 -8.558 2.586 -8.231 1.00 0.29 C ATOM 398 O THR A2073 -9.437 2.430 -9.083 1.00 0.34 O ATOM 399 CB THR A2073 -6.217 2.907 -9.077 1.00 0.49 C ATOM 400 OG1 THR A2073 -5.119 3.827 -9.144 1.00 0.60 O ATOM 401 CG2 THR A2073 -6.547 2.406 -10.475 1.00 0.58 C ATOM 0 H THR A2073 -6.312 3.808 -6.688 1.00 0.36 H new ATOM 0 HA THR A2073 -7.785 4.374 -9.126 1.00 0.40 H new ATOM 0 HB THR A2073 -5.945 2.053 -8.457 1.00 0.49 H new ATOM 0 HG1 THR A2073 -4.780 3.998 -8.241 1.00 0.60 H new ATOM 0 HG21 THR A2073 -5.671 1.919 -10.903 1.00 0.58 H new ATOM 0 HG22 THR A2073 -7.369 1.692 -10.421 1.00 0.58 H new ATOM 0 HG23 THR A2073 -6.838 3.247 -11.104 1.00 0.58 H new ATOM 409 N VAL A2074 -8.539 1.912 -7.084 1.00 0.20 N ATOM 410 CA VAL A2074 -9.553 0.903 -6.778 1.00 0.22 C ATOM 411 C VAL A2074 -10.890 1.581 -6.489 1.00 0.27 C ATOM 412 O VAL A2074 -11.947 1.110 -6.908 1.00 0.41 O ATOM 413 CB VAL A2074 -9.143 -0.016 -5.587 1.00 0.27 C ATOM 414 CG1 VAL A2074 -7.643 -0.150 -5.514 1.00 0.78 C ATOM 415 CG2 VAL A2074 -9.671 0.468 -4.252 1.00 0.72 C ATOM 0 H VAL A2074 -7.838 2.044 -6.355 1.00 0.20 H new ATOM 0 HA VAL A2074 -9.648 0.262 -7.654 1.00 0.22 H new ATOM 0 HB VAL A2074 -9.597 -0.987 -5.783 1.00 0.27 H new ATOM 0 HG11 VAL A2074 -7.376 -0.795 -4.677 1.00 0.78 H new ATOM 0 HG12 VAL A2074 -7.271 -0.586 -6.441 1.00 0.78 H new ATOM 0 HG13 VAL A2074 -7.196 0.834 -5.371 1.00 0.78 H new ATOM 0 HG21 VAL A2074 -9.351 -0.215 -3.465 1.00 0.72 H new ATOM 0 HG22 VAL A2074 -9.283 1.466 -4.047 1.00 0.72 H new ATOM 0 HG23 VAL A2074 -10.760 0.502 -4.282 1.00 0.72 H new ATOM 425 N LEU A2075 -10.825 2.687 -5.762 1.00 0.27 N ATOM 426 CA LEU A2075 -12.003 3.486 -5.454 1.00 0.37 C ATOM 427 C LEU A2075 -12.219 4.567 -6.507 1.00 0.42 C ATOM 428 O LEU A2075 -11.318 5.356 -6.793 1.00 1.24 O ATOM 429 CB LEU A2075 -11.866 4.114 -4.067 1.00 0.44 C ATOM 430 CG LEU A2075 -11.702 3.115 -2.923 1.00 0.51 C ATOM 431 CD1 LEU A2075 -11.661 3.831 -1.587 1.00 0.89 C ATOM 432 CD2 LEU A2075 -12.824 2.093 -2.953 1.00 1.04 C ATOM 0 H LEU A2075 -9.958 3.055 -5.370 1.00 0.27 H new ATOM 0 HA LEU A2075 -12.873 2.829 -5.460 1.00 0.37 H new ATOM 0 HB2 LEU A2075 -11.007 4.784 -4.071 1.00 0.44 H new ATOM 0 HB3 LEU A2075 -12.747 4.726 -3.872 1.00 0.44 H new ATOM 0 HG LEU A2075 -10.755 2.592 -3.053 1.00 0.51 H new ATOM 0 HD11 LEU A2075 -11.544 3.101 -0.786 1.00 0.89 H new ATOM 0 HD12 LEU A2075 -10.820 4.525 -1.572 1.00 0.89 H new ATOM 0 HD13 LEU A2075 -12.590 4.383 -1.441 1.00 0.89 H new ATOM 0 HD21 LEU A2075 -12.695 1.387 -2.133 1.00 1.04 H new ATOM 0 HD22 LEU A2075 -13.782 2.602 -2.847 1.00 1.04 H new ATOM 0 HD23 LEU A2075 -12.801 1.556 -3.901 1.00 1.04 H new ATOM 487 N THR A2079 -7.829 10.366 -5.984 1.00 1.12 N ATOM 488 CA THR A2079 -7.052 11.518 -5.560 1.00 0.78 C ATOM 489 C THR A2079 -6.268 11.150 -4.312 1.00 0.67 C ATOM 490 O THR A2079 -6.802 11.193 -3.206 1.00 0.86 O ATOM 491 CB THR A2079 -7.919 12.753 -5.257 1.00 1.25 C ATOM 492 OG1 THR A2079 -8.940 12.898 -6.253 1.00 1.52 O ATOM 493 CG2 THR A2079 -7.057 14.004 -5.229 1.00 1.42 C ATOM 0 HA THR A2079 -6.391 11.782 -6.385 1.00 0.78 H new ATOM 0 HB THR A2079 -8.386 12.617 -4.282 1.00 1.25 H new ATOM 0 HG1 THR A2079 -9.255 12.012 -6.530 1.00 1.52 H new ATOM 0 HG21 THR A2079 -7.681 14.871 -5.014 1.00 1.42 H new ATOM 0 HG22 THR A2079 -6.296 13.904 -4.455 1.00 1.42 H new ATOM 0 HG23 THR A2079 -6.575 14.135 -6.198 1.00 1.42 H new ATOM 501 N PRO A2080 -4.995 10.768 -4.472 1.00 0.48 N ATOM 502 CA PRO A2080 -4.161 10.304 -3.358 1.00 0.48 C ATOM 503 C PRO A2080 -3.917 11.410 -2.340 1.00 0.69 C ATOM 504 O PRO A2080 -3.582 11.156 -1.185 1.00 0.70 O ATOM 505 CB PRO A2080 -2.846 9.890 -4.034 1.00 0.56 C ATOM 506 CG PRO A2080 -3.172 9.767 -5.484 1.00 0.56 C ATOM 507 CD PRO A2080 -4.256 10.768 -5.742 1.00 0.50 C ATOM 0 HA PRO A2080 -4.631 9.493 -2.801 1.00 0.48 H new ATOM 0 HB2 PRO A2080 -2.067 10.634 -3.868 1.00 0.56 H new ATOM 0 HB3 PRO A2080 -2.477 8.946 -3.632 1.00 0.56 H new ATOM 0 HG2 PRO A2080 -2.297 9.970 -6.101 1.00 0.56 H new ATOM 0 HG3 PRO A2080 -3.505 8.758 -5.726 1.00 0.56 H new ATOM 0 HD2 PRO A2080 -3.852 11.753 -5.977 1.00 0.50 H new ATOM 0 HD3 PRO A2080 -4.888 10.475 -6.580 1.00 0.50 H new ATOM 515 N GLU A2081 -4.119 12.638 -2.790 1.00 0.93 N ATOM 516 CA GLU A2081 -3.949 13.810 -1.981 1.00 1.22 C ATOM 517 C GLU A2081 -4.962 13.850 -0.837 1.00 1.21 C ATOM 518 O GLU A2081 -4.636 14.247 0.282 1.00 1.32 O ATOM 519 CB GLU A2081 -4.120 15.015 -2.890 1.00 1.52 C ATOM 520 CG GLU A2081 -4.168 16.312 -2.152 1.00 2.12 C ATOM 521 CD GLU A2081 -4.227 17.503 -3.076 1.00 2.46 C ATOM 522 OE1 GLU A2081 -3.160 17.999 -3.483 1.00 2.53 O ATOM 523 OE2 GLU A2081 -5.344 17.957 -3.390 1.00 2.96 O ATOM 0 H GLU A2081 -4.411 12.840 -3.746 1.00 0.93 H new ATOM 0 HA GLU A2081 -2.960 13.808 -1.523 1.00 1.22 H new ATOM 0 HB2 GLU A2081 -3.297 15.042 -3.604 1.00 1.52 H new ATOM 0 HB3 GLU A2081 -5.038 14.899 -3.466 1.00 1.52 H new ATOM 0 HG2 GLU A2081 -5.039 16.321 -1.497 1.00 2.12 H new ATOM 0 HG3 GLU A2081 -3.289 16.395 -1.513 1.00 2.12 H new ATOM 530 N SER A2082 -6.181 13.414 -1.118 1.00 1.13 N ATOM 531 CA SER A2082 -7.261 13.503 -0.147 1.00 1.23 C ATOM 532 C SER A2082 -7.368 12.207 0.657 1.00 0.99 C ATOM 533 O SER A2082 -8.328 11.992 1.396 1.00 1.06 O ATOM 534 CB SER A2082 -8.583 13.814 -0.862 1.00 1.44 C ATOM 535 OG SER A2082 -9.606 14.163 0.056 1.00 1.70 O ATOM 0 H SER A2082 -6.447 12.996 -2.009 1.00 1.13 H new ATOM 0 HA SER A2082 -7.044 14.313 0.549 1.00 1.23 H new ATOM 0 HB2 SER A2082 -8.432 14.632 -1.567 1.00 1.44 H new ATOM 0 HB3 SER A2082 -8.896 12.946 -1.443 1.00 1.44 H new ATOM 0 HG SER A2082 -9.571 13.562 0.829 1.00 1.70 H new ATOM 541 N ILE A2083 -6.375 11.342 0.511 1.00 0.76 N ATOM 542 CA ILE A2083 -6.337 10.101 1.260 1.00 0.55 C ATOM 543 C ILE A2083 -5.573 10.301 2.563 1.00 0.43 C ATOM 544 O ILE A2083 -4.343 10.395 2.567 1.00 0.46 O ATOM 545 CB ILE A2083 -5.685 8.977 0.430 1.00 0.45 C ATOM 546 CG1 ILE A2083 -6.415 8.850 -0.910 1.00 0.58 C ATOM 547 CG2 ILE A2083 -5.695 7.655 1.194 1.00 0.42 C ATOM 548 CD1 ILE A2083 -5.972 7.676 -1.744 1.00 0.47 C ATOM 0 H ILE A2083 -5.586 11.480 -0.120 1.00 0.76 H new ATOM 0 HA ILE A2083 -7.361 9.807 1.488 1.00 0.55 H new ATOM 0 HB ILE A2083 -4.642 9.230 0.242 1.00 0.45 H new ATOM 0 HG12 ILE A2083 -7.485 8.765 -0.722 1.00 0.58 H new ATOM 0 HG13 ILE A2083 -6.264 9.766 -1.482 1.00 0.58 H new ATOM 0 HG21 ILE A2083 -5.229 6.880 0.586 1.00 0.42 H new ATOM 0 HG22 ILE A2083 -5.139 7.769 2.125 1.00 0.42 H new ATOM 0 HG23 ILE A2083 -6.724 7.372 1.418 1.00 0.42 H new ATOM 0 HD11 ILE A2083 -6.537 7.658 -2.676 1.00 0.47 H new ATOM 0 HD12 ILE A2083 -4.909 7.768 -1.966 1.00 0.47 H new ATOM 0 HD13 ILE A2083 -6.149 6.752 -1.194 1.00 0.47 H new ATOM 560 N SER A2084 -6.307 10.401 3.662 1.00 0.38 N ATOM 561 CA SER A2084 -5.700 10.602 4.965 1.00 0.32 C ATOM 562 C SER A2084 -5.075 9.306 5.471 1.00 0.29 C ATOM 563 O SER A2084 -5.707 8.252 5.463 1.00 0.31 O ATOM 564 CB SER A2084 -6.741 11.109 5.962 1.00 0.36 C ATOM 565 OG SER A2084 -7.296 12.345 5.539 1.00 0.42 O ATOM 0 H SER A2084 -7.325 10.346 3.675 1.00 0.38 H new ATOM 0 HA SER A2084 -4.914 11.350 4.866 1.00 0.32 H new ATOM 0 HB2 SER A2084 -7.534 10.369 6.072 1.00 0.36 H new ATOM 0 HB3 SER A2084 -6.281 11.230 6.943 1.00 0.36 H new ATOM 0 HG SER A2084 -7.960 12.646 6.193 1.00 0.42 H new ATOM 571 N PRO A2085 -3.816 9.385 5.921 1.00 0.29 N ATOM 572 CA PRO A2085 -3.039 8.216 6.354 1.00 0.28 C ATOM 573 C PRO A2085 -3.581 7.573 7.624 1.00 0.28 C ATOM 574 O PRO A2085 -3.401 6.375 7.847 1.00 0.33 O ATOM 575 CB PRO A2085 -1.653 8.804 6.617 1.00 0.32 C ATOM 576 CG PRO A2085 -1.929 10.223 6.964 1.00 0.36 C ATOM 577 CD PRO A2085 -3.039 10.630 6.047 1.00 0.36 C ATOM 0 HA PRO A2085 -3.062 7.421 5.609 1.00 0.28 H new ATOM 0 HB2 PRO A2085 -1.146 8.285 7.430 1.00 0.32 H new ATOM 0 HB3 PRO A2085 -1.012 8.724 5.739 1.00 0.32 H new ATOM 0 HG2 PRO A2085 -2.221 10.325 8.009 1.00 0.36 H new ATOM 0 HG3 PRO A2085 -1.046 10.845 6.818 1.00 0.36 H new ATOM 0 HD2 PRO A2085 -3.635 11.441 6.466 1.00 0.36 H new ATOM 0 HD3 PRO A2085 -2.664 10.975 5.083 1.00 0.36 H new ATOM 585 N ALA A2086 -4.232 8.374 8.453 1.00 0.30 N ATOM 586 CA ALA A2086 -4.756 7.893 9.726 1.00 0.36 C ATOM 587 C ALA A2086 -6.146 7.272 9.581 1.00 0.30 C ATOM 588 O ALA A2086 -6.668 6.680 10.528 1.00 0.28 O ATOM 589 CB ALA A2086 -4.786 9.026 10.740 1.00 0.47 C ATOM 0 H ALA A2086 -4.411 9.361 8.269 1.00 0.30 H new ATOM 0 HA ALA A2086 -4.088 7.108 10.079 1.00 0.36 H new ATOM 0 HB1 ALA A2086 -5.179 8.656 11.687 1.00 0.47 H new ATOM 0 HB2 ALA A2086 -3.776 9.407 10.890 1.00 0.47 H new ATOM 0 HB3 ALA A2086 -5.425 9.828 10.371 1.00 0.47 H new ATOM 595 N THR A2087 -6.747 7.401 8.407 1.00 0.32 N ATOM 596 CA THR A2087 -8.080 6.861 8.182 1.00 0.28 C ATOM 597 C THR A2087 -8.013 5.387 7.809 1.00 0.24 C ATOM 598 O THR A2087 -7.037 4.919 7.224 1.00 0.28 O ATOM 599 CB THR A2087 -8.809 7.613 7.060 1.00 0.32 C ATOM 600 OG1 THR A2087 -8.534 9.017 7.151 1.00 0.39 O ATOM 601 CG2 THR A2087 -10.313 7.387 7.137 1.00 0.34 C ATOM 0 H THR A2087 -6.336 7.872 7.601 1.00 0.32 H new ATOM 0 HA THR A2087 -8.630 6.983 9.115 1.00 0.28 H new ATOM 0 HB THR A2087 -8.447 7.228 6.107 1.00 0.32 H new ATOM 0 HG1 THR A2087 -9.255 9.520 6.718 1.00 0.39 H new ATOM 0 HG21 THR A2087 -10.804 7.931 6.331 1.00 0.34 H new ATOM 0 HG22 THR A2087 -10.526 6.323 7.039 1.00 0.34 H new ATOM 0 HG23 THR A2087 -10.686 7.745 8.096 1.00 0.34 H new ATOM 609 N ALA A2088 -9.068 4.674 8.143 1.00 0.23 N ATOM 610 CA ALA A2088 -9.186 3.261 7.833 1.00 0.25 C ATOM 611 C ALA A2088 -9.774 3.095 6.448 1.00 0.22 C ATOM 612 O ALA A2088 -10.715 3.796 6.081 1.00 0.25 O ATOM 613 CB ALA A2088 -10.069 2.579 8.862 1.00 0.32 C ATOM 0 H ALA A2088 -9.872 5.058 8.639 1.00 0.23 H new ATOM 0 HA ALA A2088 -8.198 2.800 7.859 1.00 0.25 H new ATOM 0 HB1 ALA A2088 -10.153 1.519 8.624 1.00 0.32 H new ATOM 0 HB2 ALA A2088 -9.629 2.694 9.853 1.00 0.32 H new ATOM 0 HB3 ALA A2088 -11.060 3.034 8.850 1.00 0.32 H new ATOM 619 N PHE A2089 -9.212 2.160 5.685 1.00 0.21 N ATOM 620 CA PHE A2089 -9.650 1.906 4.311 1.00 0.20 C ATOM 621 C PHE A2089 -11.147 1.654 4.228 1.00 0.24 C ATOM 622 O PHE A2089 -11.776 1.968 3.218 1.00 0.26 O ATOM 623 CB PHE A2089 -8.889 0.729 3.705 1.00 0.21 C ATOM 624 CG PHE A2089 -7.581 1.126 3.090 1.00 0.21 C ATOM 625 CD1 PHE A2089 -7.519 2.165 2.175 1.00 0.40 C ATOM 626 CD2 PHE A2089 -6.417 0.467 3.427 1.00 0.44 C ATOM 627 CE1 PHE A2089 -6.318 2.536 1.612 1.00 0.43 C ATOM 628 CE2 PHE A2089 -5.213 0.833 2.864 1.00 0.48 C ATOM 629 CZ PHE A2089 -5.164 1.871 1.956 1.00 0.34 C ATOM 0 H PHE A2089 -8.447 1.561 5.996 1.00 0.21 H new ATOM 0 HA PHE A2089 -9.429 2.806 3.737 1.00 0.20 H new ATOM 0 HB2 PHE A2089 -8.708 -0.016 4.480 1.00 0.21 H new ATOM 0 HB3 PHE A2089 -9.511 0.254 2.946 1.00 0.21 H new ATOM 0 HD1 PHE A2089 -8.422 2.690 1.900 1.00 0.40 H new ATOM 0 HD2 PHE A2089 -6.449 -0.344 4.139 1.00 0.44 H new ATOM 0 HE1 PHE A2089 -6.282 3.348 0.901 1.00 0.43 H new ATOM 0 HE2 PHE A2089 -4.309 0.308 3.133 1.00 0.48 H new ATOM 0 HZ PHE A2089 -4.221 2.161 1.516 1.00 0.34 H new ATOM 639 N LYS A2090 -11.702 1.090 5.289 1.00 0.30 N ATOM 640 CA LYS A2090 -13.131 0.886 5.403 1.00 0.40 C ATOM 641 C LYS A2090 -13.865 2.199 5.150 1.00 0.37 C ATOM 642 O LYS A2090 -14.792 2.265 4.343 1.00 0.47 O ATOM 643 CB LYS A2090 -13.433 0.375 6.811 1.00 0.55 C ATOM 644 CG LYS A2090 -14.755 -0.349 6.951 1.00 1.19 C ATOM 645 CD LYS A2090 -15.960 0.583 6.881 1.00 1.79 C ATOM 646 CE LYS A2090 -15.948 1.614 8.000 1.00 2.14 C ATOM 647 NZ LYS A2090 -17.139 2.501 7.946 1.00 2.91 N ATOM 0 H LYS A2090 -11.170 0.761 6.095 1.00 0.30 H new ATOM 0 HA LYS A2090 -13.467 0.158 4.665 1.00 0.40 H new ATOM 0 HB2 LYS A2090 -12.632 -0.297 7.119 1.00 0.55 H new ATOM 0 HB3 LYS A2090 -13.422 1.220 7.500 1.00 0.55 H new ATOM 0 HG2 LYS A2090 -14.837 -1.098 6.164 1.00 1.19 H new ATOM 0 HG3 LYS A2090 -14.771 -0.882 7.901 1.00 1.19 H new ATOM 0 HD2 LYS A2090 -15.968 1.093 5.918 1.00 1.79 H new ATOM 0 HD3 LYS A2090 -16.877 -0.004 6.939 1.00 1.79 H new ATOM 0 HE2 LYS A2090 -15.918 1.105 8.963 1.00 2.14 H new ATOM 0 HE3 LYS A2090 -15.042 2.217 7.929 1.00 2.14 H new ATOM 0 HZ1 LYS A2090 -17.095 3.190 8.724 1.00 2.91 H new ATOM 0 HZ2 LYS A2090 -17.155 3.006 7.037 1.00 2.91 H new ATOM 0 HZ3 LYS A2090 -18.002 1.929 8.039 1.00 2.91 H new ATOM 661 N ASP A2091 -13.417 3.240 5.837 1.00 0.33 N ATOM 662 CA ASP A2091 -14.031 4.559 5.745 1.00 0.35 C ATOM 663 C ASP A2091 -13.835 5.170 4.358 1.00 0.33 C ATOM 664 O ASP A2091 -14.715 5.872 3.856 1.00 0.39 O ATOM 665 CB ASP A2091 -13.454 5.489 6.817 1.00 0.38 C ATOM 666 CG ASP A2091 -14.082 6.871 6.792 1.00 1.03 C ATOM 667 OD1 ASP A2091 -13.532 7.768 6.125 1.00 1.88 O ATOM 668 OD2 ASP A2091 -15.132 7.069 7.446 1.00 1.04 O ATOM 0 H ASP A2091 -12.620 3.196 6.472 1.00 0.33 H new ATOM 0 HA ASP A2091 -15.102 4.441 5.912 1.00 0.35 H new ATOM 0 HB2 ASP A2091 -13.606 5.043 7.800 1.00 0.38 H new ATOM 0 HB3 ASP A2091 -12.378 5.581 6.672 1.00 0.38 H new ATOM 673 N LEU A2092 -12.689 4.895 3.731 1.00 0.30 N ATOM 674 CA LEU A2092 -12.410 5.444 2.408 1.00 0.32 C ATOM 675 C LEU A2092 -13.313 4.819 1.348 1.00 0.30 C ATOM 676 O LEU A2092 -13.562 5.425 0.307 1.00 0.36 O ATOM 677 CB LEU A2092 -10.943 5.228 2.007 1.00 0.34 C ATOM 678 CG LEU A2092 -9.902 6.163 2.646 1.00 0.35 C ATOM 679 CD1 LEU A2092 -10.430 7.582 2.778 1.00 0.73 C ATOM 680 CD2 LEU A2092 -9.438 5.636 3.990 1.00 0.61 C ATOM 0 H LEU A2092 -11.951 4.304 4.113 1.00 0.30 H new ATOM 0 HA LEU A2092 -12.609 6.514 2.465 1.00 0.32 H new ATOM 0 HB2 LEU A2092 -10.672 4.201 2.252 1.00 0.34 H new ATOM 0 HB3 LEU A2092 -10.869 5.328 0.924 1.00 0.34 H new ATOM 0 HG LEU A2092 -9.041 6.189 1.978 1.00 0.35 H new ATOM 0 HD11 LEU A2092 -9.667 8.213 3.233 1.00 0.73 H new ATOM 0 HD12 LEU A2092 -10.680 7.970 1.791 1.00 0.73 H new ATOM 0 HD13 LEU A2092 -11.322 7.582 3.405 1.00 0.73 H new ATOM 0 HD21 LEU A2092 -8.703 6.320 4.415 1.00 0.61 H new ATOM 0 HD22 LEU A2092 -10.291 5.556 4.664 1.00 0.61 H new ATOM 0 HD23 LEU A2092 -8.986 4.653 3.859 1.00 0.61 H new ATOM 692 N GLY A2093 -13.825 3.625 1.616 1.00 0.26 N ATOM 693 CA GLY A2093 -14.711 2.985 0.663 1.00 0.26 C ATOM 694 C GLY A2093 -14.261 1.593 0.284 1.00 0.22 C ATOM 695 O GLY A2093 -14.844 0.962 -0.597 1.00 0.27 O ATOM 0 H GLY A2093 -13.645 3.092 2.467 1.00 0.26 H new ATOM 0 HA2 GLY A2093 -15.715 2.935 1.085 1.00 0.26 H new ATOM 0 HA3 GLY A2093 -14.774 3.598 -0.236 1.00 0.26 H new ATOM 699 N ILE A2094 -13.220 1.116 0.942 1.00 0.22 N ATOM 700 CA ILE A2094 -12.673 -0.202 0.669 1.00 0.19 C ATOM 701 C ILE A2094 -13.563 -1.305 1.222 1.00 0.18 C ATOM 702 O ILE A2094 -13.966 -1.272 2.386 1.00 0.22 O ATOM 703 CB ILE A2094 -11.258 -0.335 1.271 1.00 0.19 C ATOM 704 CG1 ILE A2094 -10.285 0.595 0.550 1.00 0.24 C ATOM 705 CG2 ILE A2094 -10.755 -1.775 1.218 1.00 0.21 C ATOM 706 CD1 ILE A2094 -10.128 0.281 -0.916 1.00 0.28 C ATOM 0 H ILE A2094 -12.732 1.628 1.677 1.00 0.22 H new ATOM 0 HA ILE A2094 -12.622 -0.312 -0.414 1.00 0.19 H new ATOM 0 HB ILE A2094 -11.317 -0.045 2.320 1.00 0.19 H new ATOM 0 HG12 ILE A2094 -10.630 1.623 0.658 1.00 0.24 H new ATOM 0 HG13 ILE A2094 -9.310 0.533 1.033 1.00 0.24 H new ATOM 0 HG21 ILE A2094 -9.756 -1.828 1.651 1.00 0.21 H new ATOM 0 HG22 ILE A2094 -11.430 -2.417 1.784 1.00 0.21 H new ATOM 0 HG23 ILE A2094 -10.719 -2.110 0.181 1.00 0.21 H new ATOM 0 HD11 ILE A2094 -9.423 0.981 -1.364 1.00 0.28 H new ATOM 0 HD12 ILE A2094 -9.754 -0.736 -1.032 1.00 0.28 H new ATOM 0 HD13 ILE A2094 -11.094 0.371 -1.413 1.00 0.28 H new ATOM 718 N ASP A2095 -13.880 -2.263 0.366 1.00 0.19 N ATOM 719 CA ASP A2095 -14.553 -3.482 0.782 1.00 0.26 C ATOM 720 C ASP A2095 -13.584 -4.636 0.600 1.00 0.21 C ATOM 721 O ASP A2095 -12.391 -4.414 0.437 1.00 0.23 O ATOM 722 CB ASP A2095 -15.815 -3.742 -0.041 1.00 0.40 C ATOM 723 CG ASP A2095 -16.844 -2.633 0.074 1.00 0.77 C ATOM 724 OD1 ASP A2095 -17.633 -2.648 1.042 1.00 0.94 O ATOM 725 OD2 ASP A2095 -16.862 -1.730 -0.792 1.00 1.07 O ATOM 0 H ASP A2095 -13.679 -2.218 -0.633 1.00 0.19 H new ATOM 0 HA ASP A2095 -14.858 -3.381 1.824 1.00 0.26 H new ATOM 0 HB2 ASP A2095 -15.539 -3.865 -1.088 1.00 0.40 H new ATOM 0 HB3 ASP A2095 -16.265 -4.681 0.282 1.00 0.40 H new ATOM 730 N SER A2096 -14.075 -5.859 0.604 1.00 0.30 N ATOM 731 CA SER A2096 -13.193 -6.999 0.428 1.00 0.35 C ATOM 732 C SER A2096 -12.699 -7.082 -1.016 1.00 0.30 C ATOM 733 O SER A2096 -11.531 -7.374 -1.276 1.00 0.38 O ATOM 734 CB SER A2096 -13.897 -8.293 0.855 1.00 0.51 C ATOM 735 OG SER A2096 -14.633 -8.824 -0.252 1.00 0.85 O ATOM 0 H SER A2096 -15.061 -6.089 0.725 1.00 0.30 H new ATOM 0 HA SER A2096 -12.321 -6.866 1.068 1.00 0.35 H new ATOM 0 HB2 SER A2096 -13.164 -9.021 1.201 1.00 0.51 H new ATOM 0 HB3 SER A2096 -14.568 -8.096 1.691 1.00 0.51 H new ATOM 0 HG SER A2096 -15.081 -9.652 0.020 1.00 0.85 H new ATOM 740 N LEU A2097 -13.600 -6.800 -1.941 1.00 0.29 N ATOM 741 CA LEU A2097 -13.307 -6.803 -3.352 1.00 0.35 C ATOM 742 C LEU A2097 -12.249 -5.761 -3.709 1.00 0.26 C ATOM 743 O LEU A2097 -11.234 -6.076 -4.321 1.00 0.35 O ATOM 744 CB LEU A2097 -14.623 -6.554 -4.073 1.00 0.50 C ATOM 745 CG LEU A2097 -14.548 -6.146 -5.528 1.00 1.06 C ATOM 746 CD1 LEU A2097 -15.737 -6.720 -6.248 1.00 1.39 C ATOM 747 CD2 LEU A2097 -14.564 -4.639 -5.640 1.00 1.65 C ATOM 0 H LEU A2097 -14.567 -6.560 -1.723 1.00 0.29 H new ATOM 0 HA LEU A2097 -12.883 -7.759 -3.658 1.00 0.35 H new ATOM 0 HB2 LEU A2097 -15.221 -7.463 -4.007 1.00 0.50 H new ATOM 0 HB3 LEU A2097 -15.163 -5.777 -3.532 1.00 0.50 H new ATOM 0 HG LEU A2097 -13.626 -6.521 -5.971 1.00 1.06 H new ATOM 0 HD11 LEU A2097 -15.698 -6.435 -7.299 1.00 1.39 H new ATOM 0 HD12 LEU A2097 -15.722 -7.807 -6.166 1.00 1.39 H new ATOM 0 HD13 LEU A2097 -16.654 -6.335 -5.801 1.00 1.39 H new ATOM 0 HD21 LEU A2097 -14.510 -4.352 -6.690 1.00 1.65 H new ATOM 0 HD22 LEU A2097 -15.485 -4.252 -5.205 1.00 1.65 H new ATOM 0 HD23 LEU A2097 -13.709 -4.225 -5.106 1.00 1.65 H new ATOM 759 N THR A2098 -12.480 -4.521 -3.316 1.00 0.19 N ATOM 760 CA THR A2098 -11.528 -3.455 -3.585 1.00 0.16 C ATOM 761 C THR A2098 -10.235 -3.637 -2.793 1.00 0.15 C ATOM 762 O THR A2098 -9.207 -3.041 -3.118 1.00 0.19 O ATOM 763 CB THR A2098 -12.151 -2.085 -3.293 1.00 0.21 C ATOM 764 OG1 THR A2098 -13.182 -2.224 -2.306 1.00 0.26 O ATOM 765 CG2 THR A2098 -12.726 -1.485 -4.564 1.00 0.27 C ATOM 0 H THR A2098 -13.316 -4.227 -2.811 1.00 0.19 H new ATOM 0 HA THR A2098 -11.274 -3.504 -4.644 1.00 0.16 H new ATOM 0 HB THR A2098 -11.377 -1.418 -2.913 1.00 0.21 H new ATOM 0 HG1 THR A2098 -13.683 -1.385 -2.236 1.00 0.26 H new ATOM 0 HG21 THR A2098 -13.165 -0.512 -4.341 1.00 0.27 H new ATOM 0 HG22 THR A2098 -11.932 -1.364 -5.301 1.00 0.27 H new ATOM 0 HG23 THR A2098 -13.494 -2.147 -4.964 1.00 0.27 H new ATOM 773 N ALA A2099 -10.285 -4.481 -1.772 1.00 0.15 N ATOM 774 CA ALA A2099 -9.102 -4.805 -0.999 1.00 0.19 C ATOM 775 C ALA A2099 -8.120 -5.624 -1.833 1.00 0.22 C ATOM 776 O ALA A2099 -6.904 -5.501 -1.665 1.00 0.29 O ATOM 777 CB ALA A2099 -9.479 -5.554 0.268 1.00 0.21 C ATOM 0 H ALA A2099 -11.135 -4.952 -1.462 1.00 0.15 H new ATOM 0 HA ALA A2099 -8.615 -3.872 -0.715 1.00 0.19 H new ATOM 0 HB1 ALA A2099 -8.577 -5.788 0.834 1.00 0.21 H new ATOM 0 HB2 ALA A2099 -10.138 -4.933 0.875 1.00 0.21 H new ATOM 0 HB3 ALA A2099 -9.992 -6.479 0.005 1.00 0.21 H new ATOM 783 N LEU A2100 -8.638 -6.455 -2.737 1.00 0.22 N ATOM 784 CA LEU A2100 -7.767 -7.225 -3.613 1.00 0.27 C ATOM 785 C LEU A2100 -7.292 -6.350 -4.764 1.00 0.26 C ATOM 786 O LEU A2100 -6.168 -6.489 -5.223 1.00 0.29 O ATOM 787 CB LEU A2100 -8.443 -8.523 -4.111 1.00 0.31 C ATOM 788 CG LEU A2100 -9.684 -8.372 -5.002 1.00 0.33 C ATOM 789 CD1 LEU A2100 -9.297 -8.151 -6.457 1.00 0.36 C ATOM 790 CD2 LEU A2100 -10.579 -9.592 -4.876 1.00 0.40 C ATOM 0 H LEU A2100 -9.636 -6.608 -2.878 1.00 0.22 H new ATOM 0 HA LEU A2100 -6.896 -7.543 -3.039 1.00 0.27 H new ATOM 0 HB2 LEU A2100 -7.700 -9.100 -4.662 1.00 0.31 H new ATOM 0 HB3 LEU A2100 -8.723 -9.114 -3.239 1.00 0.31 H new ATOM 0 HG LEU A2100 -10.233 -7.494 -4.662 1.00 0.33 H new ATOM 0 HD11 LEU A2100 -10.198 -8.048 -7.062 1.00 0.36 H new ATOM 0 HD12 LEU A2100 -8.698 -7.244 -6.541 1.00 0.36 H new ATOM 0 HD13 LEU A2100 -8.717 -9.003 -6.813 1.00 0.36 H new ATOM 0 HD21 LEU A2100 -11.454 -9.469 -5.514 1.00 0.40 H new ATOM 0 HD22 LEU A2100 -10.028 -10.481 -5.184 1.00 0.40 H new ATOM 0 HD23 LEU A2100 -10.898 -9.704 -3.840 1.00 0.40 H new ATOM 802 N GLU A2101 -8.150 -5.429 -5.203 1.00 0.24 N ATOM 803 CA GLU A2101 -7.783 -4.453 -6.224 1.00 0.26 C ATOM 804 C GLU A2101 -6.590 -3.620 -5.768 1.00 0.24 C ATOM 805 O GLU A2101 -5.691 -3.315 -6.552 1.00 0.27 O ATOM 806 CB GLU A2101 -8.974 -3.541 -6.500 1.00 0.29 C ATOM 807 CG GLU A2101 -10.193 -4.276 -7.009 1.00 0.35 C ATOM 808 CD GLU A2101 -10.098 -4.595 -8.483 1.00 0.50 C ATOM 809 OE1 GLU A2101 -10.495 -3.752 -9.308 1.00 0.72 O ATOM 810 OE2 GLU A2101 -9.636 -5.703 -8.824 1.00 0.56 O ATOM 0 H GLU A2101 -9.108 -5.340 -4.864 1.00 0.24 H new ATOM 0 HA GLU A2101 -7.505 -4.983 -7.135 1.00 0.26 H new ATOM 0 HB2 GLU A2101 -9.235 -3.011 -5.584 1.00 0.29 H new ATOM 0 HB3 GLU A2101 -8.682 -2.788 -7.232 1.00 0.29 H new ATOM 0 HG2 GLU A2101 -10.317 -5.202 -6.447 1.00 0.35 H new ATOM 0 HG3 GLU A2101 -11.081 -3.671 -6.827 1.00 0.35 H new ATOM 817 N LEU A2102 -6.601 -3.247 -4.498 1.00 0.21 N ATOM 818 CA LEU A2102 -5.504 -2.505 -3.906 1.00 0.22 C ATOM 819 C LEU A2102 -4.228 -3.339 -3.917 1.00 0.24 C ATOM 820 O LEU A2102 -3.185 -2.894 -4.400 1.00 0.27 O ATOM 821 CB LEU A2102 -5.871 -2.119 -2.482 1.00 0.24 C ATOM 822 CG LEU A2102 -5.529 -0.688 -2.088 1.00 0.28 C ATOM 823 CD1 LEU A2102 -6.100 -0.390 -0.728 1.00 0.65 C ATOM 824 CD2 LEU A2102 -4.032 -0.464 -2.084 1.00 0.57 C ATOM 0 H LEU A2102 -7.366 -3.449 -3.854 1.00 0.21 H new ATOM 0 HA LEU A2102 -5.324 -1.603 -4.491 1.00 0.22 H new ATOM 0 HB2 LEU A2102 -6.942 -2.270 -2.347 1.00 0.24 H new ATOM 0 HB3 LEU A2102 -5.364 -2.798 -1.797 1.00 0.24 H new ATOM 0 HG LEU A2102 -5.967 -0.014 -2.824 1.00 0.28 H new ATOM 0 HD11 LEU A2102 -5.855 0.634 -0.447 1.00 0.65 H new ATOM 0 HD12 LEU A2102 -7.183 -0.510 -0.754 1.00 0.65 H new ATOM 0 HD13 LEU A2102 -5.676 -1.078 0.003 1.00 0.65 H new ATOM 0 HD21 LEU A2102 -3.819 0.566 -1.799 1.00 0.57 H new ATOM 0 HD22 LEU A2102 -3.565 -1.142 -1.370 1.00 0.57 H new ATOM 0 HD23 LEU A2102 -3.633 -0.655 -3.080 1.00 0.57 H new ATOM 836 N ARG A2103 -4.322 -4.557 -3.387 1.00 0.26 N ATOM 837 CA ARG A2103 -3.198 -5.486 -3.390 1.00 0.34 C ATOM 838 C ARG A2103 -2.720 -5.767 -4.810 1.00 0.35 C ATOM 839 O ARG A2103 -1.530 -5.961 -5.040 1.00 0.43 O ATOM 840 CB ARG A2103 -3.580 -6.789 -2.685 1.00 0.48 C ATOM 841 CG ARG A2103 -3.551 -6.665 -1.175 1.00 0.94 C ATOM 842 CD ARG A2103 -4.041 -7.925 -0.482 1.00 0.77 C ATOM 843 NE ARG A2103 -5.502 -8.026 -0.486 1.00 0.94 N ATOM 844 CZ ARG A2103 -6.189 -9.007 -1.074 1.00 1.48 C ATOM 845 NH1 ARG A2103 -5.568 -9.901 -1.835 1.00 2.43 N ATOM 846 NH2 ARG A2103 -7.505 -9.078 -0.917 1.00 1.60 N ATOM 0 H ARG A2103 -5.168 -4.922 -2.949 1.00 0.26 H new ATOM 0 HA ARG A2103 -2.376 -5.022 -2.845 1.00 0.34 H new ATOM 0 HB2 ARG A2103 -4.579 -7.090 -3.002 1.00 0.48 H new ATOM 0 HB3 ARG A2103 -2.896 -7.579 -2.994 1.00 0.48 H new ATOM 0 HG2 ARG A2103 -2.534 -6.447 -0.850 1.00 0.94 H new ATOM 0 HG3 ARG A2103 -4.170 -5.821 -0.870 1.00 0.94 H new ATOM 0 HD2 ARG A2103 -3.617 -8.798 -0.977 1.00 0.77 H new ATOM 0 HD3 ARG A2103 -3.681 -7.935 0.547 1.00 0.77 H new ATOM 0 HE ARG A2103 -6.030 -7.297 -0.007 1.00 0.94 H new ATOM 0 HH11 ARG A2103 -4.559 -9.840 -1.973 1.00 2.43 H new ATOM 0 HH12 ARG A2103 -6.100 -10.648 -2.281 1.00 2.43 H new ATOM 0 HH21 ARG A2103 -7.989 -8.384 -0.348 1.00 1.60 H new ATOM 0 HH22 ARG A2103 -8.032 -9.827 -1.366 1.00 1.60 H new ATOM 860 N ASN A2104 -3.656 -5.773 -5.753 1.00 0.33 N ATOM 861 CA ASN A2104 -3.338 -5.942 -7.168 1.00 0.38 C ATOM 862 C ASN A2104 -2.295 -4.925 -7.619 1.00 0.39 C ATOM 863 O ASN A2104 -1.360 -5.260 -8.349 1.00 0.48 O ATOM 864 CB ASN A2104 -4.606 -5.804 -8.022 1.00 0.39 C ATOM 865 CG ASN A2104 -5.437 -7.071 -8.062 1.00 0.43 C ATOM 866 OD1 ASN A2104 -4.925 -8.176 -7.887 1.00 0.47 O ATOM 867 ND2 ASN A2104 -6.728 -6.919 -8.319 1.00 0.44 N ATOM 0 H ASN A2104 -4.651 -5.662 -5.561 1.00 0.33 H new ATOM 0 HA ASN A2104 -2.926 -6.942 -7.302 1.00 0.38 H new ATOM 0 HB2 ASN A2104 -5.215 -4.990 -7.629 1.00 0.39 H new ATOM 0 HB3 ASN A2104 -4.324 -5.529 -9.038 1.00 0.39 H new ATOM 0 HD21 ASN A2104 -7.336 -7.736 -8.378 1.00 0.44 H new ATOM 0 HD22 ASN A2104 -7.114 -5.985 -8.458 1.00 0.44 H new ATOM 874 N THR A2105 -2.452 -3.686 -7.171 1.00 0.33 N ATOM 875 CA THR A2105 -1.515 -2.633 -7.515 1.00 0.39 C ATOM 876 C THR A2105 -0.267 -2.697 -6.637 1.00 0.42 C ATOM 877 O THR A2105 0.850 -2.649 -7.143 1.00 0.51 O ATOM 878 CB THR A2105 -2.170 -1.245 -7.389 1.00 0.41 C ATOM 879 OG1 THR A2105 -3.406 -1.237 -8.117 1.00 0.46 O ATOM 880 CG2 THR A2105 -1.253 -0.155 -7.930 1.00 0.51 C ATOM 0 H THR A2105 -3.220 -3.389 -6.569 1.00 0.33 H new ATOM 0 HA THR A2105 -1.220 -2.788 -8.553 1.00 0.39 H new ATOM 0 HB THR A2105 -2.355 -1.043 -6.334 1.00 0.41 H new ATOM 0 HG1 THR A2105 -3.827 -0.355 -8.038 1.00 0.46 H new ATOM 0 HG21 THR A2105 -1.741 0.814 -7.828 1.00 0.51 H new ATOM 0 HG22 THR A2105 -0.320 -0.152 -7.367 1.00 0.51 H new ATOM 0 HG23 THR A2105 -1.042 -0.346 -8.982 1.00 0.51 H new ATOM 888 N LEU A2106 -0.467 -2.834 -5.326 1.00 0.42 N ATOM 889 CA LEU A2106 0.644 -2.854 -4.371 1.00 0.55 C ATOM 890 C LEU A2106 1.666 -3.924 -4.734 1.00 0.54 C ATOM 891 O LEU A2106 2.869 -3.658 -4.787 1.00 0.56 O ATOM 892 CB LEU A2106 0.134 -3.111 -2.951 1.00 0.74 C ATOM 893 CG LEU A2106 -0.843 -2.071 -2.404 1.00 0.44 C ATOM 894 CD1 LEU A2106 -1.254 -2.432 -0.988 1.00 1.13 C ATOM 895 CD2 LEU A2106 -0.232 -0.678 -2.440 1.00 0.81 C ATOM 0 H LEU A2106 -1.388 -2.933 -4.900 1.00 0.42 H new ATOM 0 HA LEU A2106 1.124 -1.876 -4.414 1.00 0.55 H new ATOM 0 HB2 LEU A2106 -0.351 -4.087 -2.929 1.00 0.74 H new ATOM 0 HB3 LEU A2106 0.991 -3.166 -2.280 1.00 0.74 H new ATOM 0 HG LEU A2106 -1.729 -2.068 -3.038 1.00 0.44 H new ATOM 0 HD11 LEU A2106 -1.950 -1.684 -0.609 1.00 1.13 H new ATOM 0 HD12 LEU A2106 -1.736 -3.410 -0.987 1.00 1.13 H new ATOM 0 HD13 LEU A2106 -0.371 -2.462 -0.349 1.00 1.13 H new ATOM 0 HD21 LEU A2106 -0.948 0.043 -2.045 1.00 0.81 H new ATOM 0 HD22 LEU A2106 0.673 -0.662 -1.832 1.00 0.81 H new ATOM 0 HD23 LEU A2106 0.017 -0.416 -3.468 1.00 0.81 H new ATOM 907 N THR A2107 1.173 -5.127 -4.997 1.00 0.56 N ATOM 908 CA THR A2107 2.023 -6.259 -5.318 1.00 0.62 C ATOM 909 C THR A2107 2.820 -5.998 -6.598 1.00 0.60 C ATOM 910 O THR A2107 4.040 -6.155 -6.630 1.00 0.64 O ATOM 911 CB THR A2107 1.169 -7.532 -5.501 1.00 0.69 C ATOM 912 OG1 THR A2107 0.309 -7.707 -4.370 1.00 0.73 O ATOM 913 CG2 THR A2107 2.035 -8.764 -5.668 1.00 0.81 C ATOM 0 H THR A2107 0.176 -5.342 -4.993 1.00 0.56 H new ATOM 0 HA THR A2107 2.719 -6.401 -4.491 1.00 0.62 H new ATOM 0 HB THR A2107 0.575 -7.406 -6.406 1.00 0.69 H new ATOM 0 HG1 THR A2107 -0.578 -7.344 -4.574 1.00 0.73 H new ATOM 0 HG21 THR A2107 1.400 -9.641 -5.794 1.00 0.81 H new ATOM 0 HG22 THR A2107 2.670 -8.646 -6.546 1.00 0.81 H new ATOM 0 HG23 THR A2107 2.659 -8.893 -4.784 1.00 0.81 H new ATOM 921 N HIS A2108 2.116 -5.569 -7.639 1.00 0.58 N ATOM 922 CA HIS A2108 2.722 -5.345 -8.947 1.00 0.62 C ATOM 923 C HIS A2108 3.681 -4.160 -8.925 1.00 0.60 C ATOM 924 O HIS A2108 4.685 -4.149 -9.636 1.00 0.68 O ATOM 925 CB HIS A2108 1.624 -5.116 -9.992 1.00 0.68 C ATOM 926 CG HIS A2108 2.133 -4.821 -11.372 1.00 1.20 C ATOM 927 ND1 HIS A2108 2.880 -5.711 -12.107 1.00 1.74 N ATOM 928 CD2 HIS A2108 1.989 -3.723 -12.151 1.00 2.24 C ATOM 929 CE1 HIS A2108 3.174 -5.177 -13.275 1.00 2.48 C ATOM 930 NE2 HIS A2108 2.644 -3.969 -13.331 1.00 2.81 N ATOM 0 H HIS A2108 1.117 -5.368 -7.602 1.00 0.58 H new ATOM 0 HA HIS A2108 3.299 -6.232 -9.210 1.00 0.62 H new ATOM 0 HB2 HIS A2108 0.989 -6.001 -10.034 1.00 0.68 H new ATOM 0 HB3 HIS A2108 0.995 -4.288 -9.665 1.00 0.68 H new ATOM 0 HD2 HIS A2108 1.457 -2.820 -11.891 1.00 2.24 H new ATOM 0 HE1 HIS A2108 3.752 -5.649 -14.056 1.00 2.48 H new ATOM 0 HE2 HIS A2108 2.710 -3.326 -14.120 1.00 2.81 H new ATOM 939 N ASN A2109 3.371 -3.170 -8.103 1.00 0.57 N ATOM 940 CA ASN A2109 4.148 -1.939 -8.063 1.00 0.64 C ATOM 941 C ASN A2109 5.510 -2.169 -7.425 1.00 0.66 C ATOM 942 O ASN A2109 6.473 -1.465 -7.726 1.00 0.85 O ATOM 943 CB ASN A2109 3.390 -0.866 -7.290 1.00 0.82 C ATOM 944 CG ASN A2109 3.655 0.522 -7.826 1.00 1.61 C ATOM 945 OD1 ASN A2109 4.589 1.205 -7.405 1.00 1.85 O ATOM 946 ND2 ASN A2109 2.820 0.952 -8.756 1.00 2.60 N ATOM 0 H ASN A2109 2.585 -3.194 -7.453 1.00 0.57 H new ATOM 0 HA ASN A2109 4.303 -1.605 -9.089 1.00 0.64 H new ATOM 0 HB2 ASN A2109 2.321 -1.074 -7.338 1.00 0.82 H new ATOM 0 HB3 ASN A2109 3.676 -0.908 -6.239 1.00 0.82 H new ATOM 0 HD21 ASN A2109 2.936 1.884 -9.154 1.00 2.60 H new ATOM 0 HD22 ASN A2109 2.060 0.352 -9.075 1.00 2.60 H new ATOM 953 N THR A2110 5.585 -3.151 -6.541 1.00 0.65 N ATOM 954 CA THR A2110 6.829 -3.461 -5.863 1.00 0.78 C ATOM 955 C THR A2110 7.534 -4.663 -6.486 1.00 0.81 C ATOM 956 O THR A2110 8.762 -4.708 -6.554 1.00 1.02 O ATOM 957 CB THR A2110 6.593 -3.733 -4.369 1.00 0.83 C ATOM 958 OG1 THR A2110 5.418 -4.537 -4.193 1.00 0.72 O ATOM 959 CG2 THR A2110 6.459 -2.432 -3.598 1.00 1.03 C ATOM 0 H THR A2110 4.799 -3.745 -6.278 1.00 0.65 H new ATOM 0 HA THR A2110 7.469 -2.586 -5.975 1.00 0.78 H new ATOM 0 HB THR A2110 7.455 -4.274 -3.978 1.00 0.83 H new ATOM 0 HG1 THR A2110 4.621 -3.991 -4.357 1.00 0.72 H new ATOM 0 HG21 THR A2110 6.293 -2.650 -2.543 1.00 1.03 H new ATOM 0 HG22 THR A2110 7.373 -1.848 -3.708 1.00 1.03 H new ATOM 0 HG23 THR A2110 5.615 -1.863 -3.988 1.00 1.03 H new ATOM 967 N GLY A2111 6.750 -5.630 -6.948 1.00 0.72 N ATOM 968 CA GLY A2111 7.314 -6.856 -7.482 1.00 0.86 C ATOM 969 C GLY A2111 7.430 -7.916 -6.409 1.00 0.88 C ATOM 970 O GLY A2111 8.086 -8.944 -6.589 1.00 1.05 O ATOM 0 H GLY A2111 5.731 -5.587 -6.962 1.00 0.72 H new ATOM 0 HA2 GLY A2111 6.688 -7.224 -8.295 1.00 0.86 H new ATOM 0 HA3 GLY A2111 8.298 -6.653 -7.905 1.00 0.86 H new ATOM 974 N LEU A2112 6.795 -7.641 -5.281 1.00 0.84 N ATOM 975 CA LEU A2112 6.822 -8.518 -4.125 1.00 0.92 C ATOM 976 C LEU A2112 5.621 -9.439 -4.105 1.00 0.80 C ATOM 977 O LEU A2112 4.893 -9.560 -5.091 1.00 0.97 O ATOM 978 CB LEU A2112 6.823 -7.670 -2.860 1.00 1.21 C ATOM 979 CG LEU A2112 7.986 -6.700 -2.740 1.00 1.05 C ATOM 980 CD1 LEU A2112 7.740 -5.742 -1.597 1.00 1.45 C ATOM 981 CD2 LEU A2112 9.289 -7.454 -2.541 1.00 1.34 C ATOM 0 H LEU A2112 6.242 -6.795 -5.142 1.00 0.84 H new ATOM 0 HA LEU A2112 7.722 -9.131 -4.177 1.00 0.92 H new ATOM 0 HB2 LEU A2112 5.892 -7.105 -2.818 1.00 1.21 H new ATOM 0 HB3 LEU A2112 6.832 -8.334 -1.995 1.00 1.21 H new ATOM 0 HG LEU A2112 8.066 -6.127 -3.664 1.00 1.05 H new ATOM 0 HD11 LEU A2112 8.578 -5.049 -1.516 1.00 1.45 H new ATOM 0 HD12 LEU A2112 6.823 -5.183 -1.782 1.00 1.45 H new ATOM 0 HD13 LEU A2112 7.642 -6.302 -0.667 1.00 1.45 H new ATOM 0 HD21 LEU A2112 10.111 -6.744 -2.457 1.00 1.34 H new ATOM 0 HD22 LEU A2112 9.229 -8.049 -1.630 1.00 1.34 H new ATOM 0 HD23 LEU A2112 9.463 -8.111 -3.393 1.00 1.34 H new ATOM 993 N ASP A2113 5.446 -10.099 -2.974 1.00 0.77 N ATOM 994 CA ASP A2113 4.328 -10.995 -2.764 1.00 0.77 C ATOM 995 C ASP A2113 3.506 -10.520 -1.576 1.00 0.92 C ATOM 996 O ASP A2113 4.018 -10.412 -0.458 1.00 1.14 O ATOM 997 CB ASP A2113 4.840 -12.410 -2.527 1.00 0.83 C ATOM 998 CG ASP A2113 3.719 -13.410 -2.337 1.00 0.91 C ATOM 999 OD1 ASP A2113 3.561 -13.921 -1.210 1.00 0.90 O ATOM 1000 OD2 ASP A2113 2.988 -13.684 -3.312 1.00 1.18 O ATOM 0 H ASP A2113 6.077 -10.027 -2.176 1.00 0.77 H new ATOM 0 HA ASP A2113 3.693 -10.997 -3.650 1.00 0.77 H new ATOM 0 HB2 ASP A2113 5.456 -12.716 -3.373 1.00 0.83 H new ATOM 0 HB3 ASP A2113 5.482 -12.417 -1.646 1.00 0.83 H new ATOM 1005 N LEU A2114 2.243 -10.217 -1.821 1.00 1.05 N ATOM 1006 CA LEU A2114 1.377 -9.648 -0.795 1.00 1.34 C ATOM 1007 C LEU A2114 0.281 -10.631 -0.402 1.00 1.00 C ATOM 1008 O LEU A2114 -0.362 -11.235 -1.263 1.00 1.04 O ATOM 1009 CB LEU A2114 0.740 -8.336 -1.285 1.00 1.98 C ATOM 1010 CG LEU A2114 1.632 -7.081 -1.250 1.00 2.33 C ATOM 1011 CD1 LEU A2114 2.026 -6.739 0.173 1.00 2.71 C ATOM 1012 CD2 LEU A2114 2.878 -7.254 -2.104 1.00 2.95 C ATOM 0 H LEU A2114 1.790 -10.355 -2.724 1.00 1.05 H new ATOM 0 HA LEU A2114 1.994 -9.439 0.079 1.00 1.34 H new ATOM 0 HB2 LEU A2114 0.401 -8.484 -2.310 1.00 1.98 H new ATOM 0 HB3 LEU A2114 -0.146 -8.141 -0.681 1.00 1.98 H new ATOM 0 HG LEU A2114 1.047 -6.260 -1.664 1.00 2.33 H new ATOM 0 HD11 LEU A2114 2.656 -5.849 0.172 1.00 2.71 H new ATOM 0 HD12 LEU A2114 1.129 -6.549 0.763 1.00 2.71 H new ATOM 0 HD13 LEU A2114 2.577 -7.573 0.608 1.00 2.71 H new ATOM 0 HD21 LEU A2114 3.482 -6.348 -2.054 1.00 2.95 H new ATOM 0 HD22 LEU A2114 3.459 -8.098 -1.733 1.00 2.95 H new ATOM 0 HD23 LEU A2114 2.587 -7.440 -3.138 1.00 2.95 H new ATOM 1024 N PRO A2115 0.063 -10.807 0.911 1.00 0.85 N ATOM 1025 CA PRO A2115 -0.992 -11.680 1.430 1.00 0.64 C ATOM 1026 C PRO A2115 -2.375 -11.082 1.219 1.00 0.57 C ATOM 1027 O PRO A2115 -2.555 -9.867 1.308 1.00 0.58 O ATOM 1028 CB PRO A2115 -0.689 -11.764 2.927 1.00 0.76 C ATOM 1029 CG PRO A2115 0.084 -10.529 3.242 1.00 0.98 C ATOM 1030 CD PRO A2115 0.834 -10.162 1.991 1.00 1.10 C ATOM 0 HA PRO A2115 -1.002 -12.647 0.927 1.00 0.64 H new ATOM 0 HB2 PRO A2115 -1.607 -11.813 3.512 1.00 0.76 H new ATOM 0 HB3 PRO A2115 -0.113 -12.659 3.162 1.00 0.76 H new ATOM 0 HG2 PRO A2115 -0.582 -9.722 3.545 1.00 0.98 H new ATOM 0 HG3 PRO A2115 0.772 -10.703 4.070 1.00 0.98 H new ATOM 0 HD2 PRO A2115 0.882 -9.081 1.857 1.00 1.10 H new ATOM 0 HD3 PRO A2115 1.861 -10.525 2.020 1.00 1.10 H new ATOM 1038 N PRO A2116 -3.380 -11.933 0.955 1.00 0.57 N ATOM 1039 CA PRO A2116 -4.760 -11.489 0.733 1.00 0.62 C ATOM 1040 C PRO A2116 -5.374 -10.888 1.991 1.00 0.58 C ATOM 1041 O PRO A2116 -6.411 -10.228 1.945 1.00 0.68 O ATOM 1042 CB PRO A2116 -5.496 -12.773 0.336 1.00 0.73 C ATOM 1043 CG PRO A2116 -4.675 -13.876 0.908 1.00 0.75 C ATOM 1044 CD PRO A2116 -3.251 -13.399 0.850 1.00 0.63 C ATOM 0 HA PRO A2116 -4.821 -10.705 -0.022 1.00 0.62 H new ATOM 0 HB2 PRO A2116 -6.510 -12.787 0.735 1.00 0.73 H new ATOM 0 HB3 PRO A2116 -5.579 -12.862 -0.747 1.00 0.73 H new ATOM 0 HG2 PRO A2116 -4.973 -14.094 1.934 1.00 0.75 H new ATOM 0 HG3 PRO A2116 -4.803 -14.795 0.337 1.00 0.75 H new ATOM 0 HD2 PRO A2116 -2.656 -13.810 1.665 1.00 0.63 H new ATOM 0 HD3 PRO A2116 -2.765 -13.695 -0.080 1.00 0.63 H new ATOM 1052 N THR A2117 -4.707 -11.104 3.109 1.00 0.54 N ATOM 1053 CA THR A2117 -5.170 -10.611 4.393 1.00 0.59 C ATOM 1054 C THR A2117 -4.519 -9.277 4.741 1.00 0.50 C ATOM 1055 O THR A2117 -4.697 -8.764 5.840 1.00 0.54 O ATOM 1056 CB THR A2117 -4.903 -11.637 5.507 1.00 0.73 C ATOM 1057 OG1 THR A2117 -3.633 -12.267 5.289 1.00 0.74 O ATOM 1058 CG2 THR A2117 -6.004 -12.688 5.549 1.00 0.86 C ATOM 0 H THR A2117 -3.831 -11.625 3.153 1.00 0.54 H new ATOM 0 HA THR A2117 -6.246 -10.457 4.314 1.00 0.59 H new ATOM 0 HB THR A2117 -4.890 -11.116 6.464 1.00 0.73 H new ATOM 0 HG1 THR A2117 -3.465 -12.919 6.001 1.00 0.74 H new ATOM 0 HG21 THR A2117 -5.794 -13.403 6.344 1.00 0.86 H new ATOM 0 HG22 THR A2117 -6.962 -12.204 5.740 1.00 0.86 H new ATOM 0 HG23 THR A2117 -6.045 -13.210 4.593 1.00 0.86 H new ATOM 1066 N LEU A2118 -3.740 -8.739 3.805 1.00 0.45 N ATOM 1067 CA LEU A2118 -3.125 -7.424 3.950 1.00 0.45 C ATOM 1068 C LEU A2118 -4.106 -6.393 4.499 1.00 0.41 C ATOM 1069 O LEU A2118 -3.889 -5.803 5.559 1.00 0.43 O ATOM 1070 CB LEU A2118 -2.647 -6.943 2.592 1.00 0.49 C ATOM 1071 CG LEU A2118 -1.748 -5.726 2.637 1.00 0.40 C ATOM 1072 CD1 LEU A2118 -0.413 -6.112 3.232 1.00 0.70 C ATOM 1073 CD2 LEU A2118 -1.590 -5.134 1.250 1.00 0.65 C ATOM 0 H LEU A2118 -3.518 -9.204 2.925 1.00 0.45 H new ATOM 0 HA LEU A2118 -2.296 -7.525 4.651 1.00 0.45 H new ATOM 0 HB2 LEU A2118 -2.112 -7.756 2.100 1.00 0.49 H new ATOM 0 HB3 LEU A2118 -3.516 -6.714 1.975 1.00 0.49 H new ATOM 0 HG LEU A2118 -2.199 -4.960 3.268 1.00 0.40 H new ATOM 0 HD11 LEU A2118 0.237 -5.238 3.266 1.00 0.70 H new ATOM 0 HD12 LEU A2118 -0.561 -6.493 4.242 1.00 0.70 H new ATOM 0 HD13 LEU A2118 0.050 -6.884 2.617 1.00 0.70 H new ATOM 0 HD21 LEU A2118 -0.941 -4.260 1.299 1.00 0.65 H new ATOM 0 HD22 LEU A2118 -1.149 -5.877 0.586 1.00 0.65 H new ATOM 0 HD23 LEU A2118 -2.567 -4.839 0.867 1.00 0.65 H new ATOM 1085 N ILE A2119 -5.197 -6.203 3.766 1.00 0.38 N ATOM 1086 CA ILE A2119 -6.187 -5.183 4.090 1.00 0.40 C ATOM 1087 C ILE A2119 -7.095 -5.673 5.222 1.00 0.42 C ATOM 1088 O ILE A2119 -8.008 -4.981 5.662 1.00 0.50 O ATOM 1089 CB ILE A2119 -7.030 -4.830 2.840 1.00 0.42 C ATOM 1090 CG1 ILE A2119 -6.130 -4.676 1.604 1.00 0.40 C ATOM 1091 CG2 ILE A2119 -7.828 -3.552 3.061 1.00 0.42 C ATOM 1092 CD1 ILE A2119 -5.123 -3.545 1.702 1.00 0.33 C ATOM 0 H ILE A2119 -5.420 -6.749 2.934 1.00 0.38 H new ATOM 0 HA ILE A2119 -5.667 -4.284 4.420 1.00 0.40 H new ATOM 0 HB ILE A2119 -7.728 -5.650 2.669 1.00 0.42 H new ATOM 0 HG12 ILE A2119 -5.594 -5.611 1.441 1.00 0.40 H new ATOM 0 HG13 ILE A2119 -6.759 -4.512 0.729 1.00 0.40 H new ATOM 0 HG21 ILE A2119 -8.411 -3.328 2.168 1.00 0.42 H new ATOM 0 HG22 ILE A2119 -8.500 -3.685 3.909 1.00 0.42 H new ATOM 0 HG23 ILE A2119 -7.145 -2.727 3.265 1.00 0.42 H new ATOM 0 HD11 ILE A2119 -4.529 -3.507 0.789 1.00 0.33 H new ATOM 0 HD12 ILE A2119 -5.649 -2.599 1.833 1.00 0.33 H new ATOM 0 HD13 ILE A2119 -4.466 -3.715 2.555 1.00 0.33 H new ATOM 1104 N PHE A2120 -6.829 -6.882 5.682 1.00 0.46 N ATOM 1105 CA PHE A2120 -7.536 -7.452 6.814 1.00 0.53 C ATOM 1106 C PHE A2120 -6.771 -7.112 8.093 1.00 0.52 C ATOM 1107 O PHE A2120 -7.356 -6.725 9.105 1.00 0.60 O ATOM 1108 CB PHE A2120 -7.630 -8.974 6.637 1.00 0.61 C ATOM 1109 CG PHE A2120 -8.715 -9.660 7.425 1.00 1.47 C ATOM 1110 CD1 PHE A2120 -9.090 -9.155 8.658 1.00 1.67 C ATOM 1111 CD2 PHE A2120 -9.354 -10.793 6.947 1.00 2.50 C ATOM 1112 CE1 PHE A2120 -10.083 -9.760 9.398 1.00 2.55 C ATOM 1113 CE2 PHE A2120 -10.349 -11.405 7.685 1.00 3.49 C ATOM 1114 CZ PHE A2120 -10.718 -10.962 8.845 1.00 3.43 C ATOM 0 H PHE A2120 -6.118 -7.495 5.282 1.00 0.46 H new ATOM 0 HA PHE A2120 -8.544 -7.043 6.878 1.00 0.53 H new ATOM 0 HB2 PHE A2120 -7.784 -9.189 5.580 1.00 0.61 H new ATOM 0 HB3 PHE A2120 -6.672 -9.413 6.915 1.00 0.61 H new ATOM 0 HD1 PHE A2120 -8.598 -8.275 9.045 1.00 1.67 H new ATOM 0 HD2 PHE A2120 -9.071 -11.202 5.988 1.00 2.50 H new ATOM 0 HE1 PHE A2120 -10.385 -9.362 10.356 1.00 2.55 H new ATOM 0 HE2 PHE A2120 -10.835 -12.281 7.282 1.00 3.49 H new ATOM 0 HZ PHE A2120 -11.489 -11.474 9.402 1.00 3.43 H new ATOM 1124 N ASP A2121 -5.450 -7.233 8.017 1.00 0.48 N ATOM 1125 CA ASP A2121 -4.584 -7.050 9.175 1.00 0.49 C ATOM 1126 C ASP A2121 -4.224 -5.580 9.370 1.00 0.45 C ATOM 1127 O ASP A2121 -4.386 -5.034 10.462 1.00 0.51 O ATOM 1128 CB ASP A2121 -3.308 -7.878 9.011 1.00 0.50 C ATOM 1129 CG ASP A2121 -2.625 -8.172 10.333 1.00 1.20 C ATOM 1130 OD1 ASP A2121 -1.945 -7.269 10.865 1.00 1.42 O ATOM 1131 OD2 ASP A2121 -2.767 -9.298 10.849 1.00 2.00 O ATOM 0 H ASP A2121 -4.952 -7.459 7.156 1.00 0.48 H new ATOM 0 HA ASP A2121 -5.127 -7.388 10.058 1.00 0.49 H new ATOM 0 HB2 ASP A2121 -3.551 -8.818 8.516 1.00 0.50 H new ATOM 0 HB3 ASP A2121 -2.615 -7.345 8.360 1.00 0.50 H new ATOM 1136 N HIS A2122 -3.743 -4.929 8.313 1.00 0.38 N ATOM 1137 CA HIS A2122 -3.338 -3.527 8.417 1.00 0.37 C ATOM 1138 C HIS A2122 -4.039 -2.669 7.375 1.00 0.34 C ATOM 1139 O HIS A2122 -3.372 -2.114 6.503 1.00 0.32 O ATOM 1140 CB HIS A2122 -1.819 -3.341 8.213 1.00 0.35 C ATOM 1141 CG HIS A2122 -0.952 -4.330 8.924 1.00 0.45 C ATOM 1142 ND1 HIS A2122 -0.424 -4.106 10.172 1.00 0.63 N ATOM 1143 CD2 HIS A2122 -0.496 -5.543 8.535 1.00 0.51 C ATOM 1144 CE1 HIS A2122 0.319 -5.137 10.524 1.00 0.71 C ATOM 1145 NE2 HIS A2122 0.294 -6.027 9.549 1.00 0.63 N ATOM 0 H HIS A2122 -3.625 -5.341 7.387 1.00 0.38 H new ATOM 0 HA HIS A2122 -3.617 -3.217 9.424 1.00 0.37 H new ATOM 0 HB2 HIS A2122 -1.603 -3.395 7.146 1.00 0.35 H new ATOM 0 HB3 HIS A2122 -1.545 -2.339 8.543 1.00 0.35 H new ATOM 0 HD2 HIS A2122 -0.713 -6.039 7.600 1.00 0.51 H new ATOM 0 HE1 HIS A2122 0.858 -5.237 11.455 1.00 0.71 H new ATOM 0 HE2 HIS A2122 0.780 -6.924 9.549 1.00 0.63 H new ATOM 1154 N PRO A2123 -5.373 -2.507 7.408 1.00 0.36 N ATOM 1155 CA PRO A2123 -5.997 -1.636 6.435 1.00 0.34 C ATOM 1156 C PRO A2123 -5.853 -0.186 6.859 1.00 0.32 C ATOM 1157 O PRO A2123 -6.563 0.299 7.741 1.00 0.36 O ATOM 1158 CB PRO A2123 -7.459 -2.072 6.475 1.00 0.40 C ATOM 1159 CG PRO A2123 -7.672 -2.621 7.850 1.00 0.43 C ATOM 1160 CD PRO A2123 -6.334 -3.110 8.344 1.00 0.41 C ATOM 0 HA PRO A2123 -5.557 -1.705 5.440 1.00 0.34 H new ATOM 0 HB2 PRO A2123 -8.125 -1.232 6.280 1.00 0.40 H new ATOM 0 HB3 PRO A2123 -7.665 -2.825 5.715 1.00 0.40 H new ATOM 0 HG2 PRO A2123 -8.071 -1.854 8.514 1.00 0.43 H new ATOM 0 HG3 PRO A2123 -8.397 -3.435 7.832 1.00 0.43 H new ATOM 0 HD2 PRO A2123 -6.146 -2.793 9.370 1.00 0.41 H new ATOM 0 HD3 PRO A2123 -6.276 -4.198 8.331 1.00 0.41 H new ATOM 1168 N THR A2124 -4.943 0.497 6.184 1.00 0.27 N ATOM 1169 CA THR A2124 -4.650 1.899 6.425 1.00 0.23 C ATOM 1170 C THR A2124 -3.597 2.363 5.425 1.00 0.22 C ATOM 1171 O THR A2124 -2.710 1.579 5.084 1.00 0.26 O ATOM 1172 CB THR A2124 -4.142 2.147 7.858 1.00 0.31 C ATOM 1173 OG1 THR A2124 -3.766 0.905 8.470 1.00 0.50 O ATOM 1174 CG2 THR A2124 -5.195 2.842 8.705 1.00 0.29 C ATOM 0 H THR A2124 -4.378 0.085 5.441 1.00 0.27 H new ATOM 0 HA THR A2124 -5.574 2.463 6.303 1.00 0.23 H new ATOM 0 HB THR A2124 -3.271 2.799 7.796 1.00 0.31 H new ATOM 0 HG1 THR A2124 -3.596 1.049 9.424 1.00 0.50 H new ATOM 0 HG21 THR A2124 -4.805 3.003 9.710 1.00 0.29 H new ATOM 0 HG22 THR A2124 -5.447 3.803 8.256 1.00 0.29 H new ATOM 0 HG23 THR A2124 -6.089 2.220 8.757 1.00 0.29 H new ATOM 1182 N PRO A2125 -3.658 3.601 4.932 1.00 0.19 N ATOM 1183 CA PRO A2125 -2.674 4.097 3.966 1.00 0.18 C ATOM 1184 C PRO A2125 -1.241 4.013 4.505 1.00 0.17 C ATOM 1185 O PRO A2125 -0.396 3.310 3.946 1.00 0.20 O ATOM 1186 CB PRO A2125 -3.084 5.553 3.741 1.00 0.22 C ATOM 1187 CG PRO A2125 -4.517 5.616 4.150 1.00 0.25 C ATOM 1188 CD PRO A2125 -4.677 4.610 5.254 1.00 0.24 C ATOM 0 HA PRO A2125 -2.669 3.505 3.051 1.00 0.18 H new ATOM 0 HB2 PRO A2125 -2.473 6.232 4.336 1.00 0.22 H new ATOM 0 HB3 PRO A2125 -2.958 5.842 2.698 1.00 0.22 H new ATOM 0 HG2 PRO A2125 -4.781 6.616 4.492 1.00 0.25 H new ATOM 0 HG3 PRO A2125 -5.173 5.382 3.311 1.00 0.25 H new ATOM 0 HD2 PRO A2125 -4.508 5.056 6.234 1.00 0.24 H new ATOM 0 HD3 PRO A2125 -5.679 4.182 5.267 1.00 0.24 H new ATOM 1196 N HIS A2126 -0.988 4.691 5.623 1.00 0.23 N ATOM 1197 CA HIS A2126 0.364 4.790 6.168 1.00 0.31 C ATOM 1198 C HIS A2126 0.844 3.462 6.751 1.00 0.29 C ATOM 1199 O HIS A2126 2.026 3.137 6.673 1.00 0.32 O ATOM 1200 CB HIS A2126 0.433 5.878 7.244 1.00 0.45 C ATOM 1201 CG HIS A2126 1.800 6.046 7.835 1.00 0.58 C ATOM 1202 ND1 HIS A2126 2.852 6.629 7.158 1.00 0.65 N ATOM 1203 CD2 HIS A2126 2.294 5.671 9.038 1.00 0.71 C ATOM 1204 CE1 HIS A2126 3.932 6.596 7.920 1.00 0.77 C ATOM 1205 NE2 HIS A2126 3.616 6.023 9.064 1.00 0.80 N ATOM 0 H HIS A2126 -1.699 5.179 6.168 1.00 0.23 H new ATOM 0 HA HIS A2126 1.023 5.054 5.341 1.00 0.31 H new ATOM 0 HB2 HIS A2126 0.113 6.826 6.812 1.00 0.45 H new ATOM 0 HB3 HIS A2126 -0.271 5.636 8.040 1.00 0.45 H new ATOM 0 HD2 HIS A2126 1.746 5.184 9.831 1.00 0.71 H new ATOM 0 HE1 HIS A2126 4.907 6.974 7.651 1.00 0.77 H new ATOM 0 HE2 HIS A2126 4.255 5.867 9.844 1.00 0.80 H new ATOM 1214 N ALA A2127 -0.060 2.705 7.346 1.00 0.28 N ATOM 1215 CA ALA A2127 0.315 1.448 7.977 1.00 0.29 C ATOM 1216 C ALA A2127 0.753 0.412 6.940 1.00 0.26 C ATOM 1217 O ALA A2127 1.629 -0.412 7.212 1.00 0.30 O ATOM 1218 CB ALA A2127 -0.824 0.923 8.828 1.00 0.34 C ATOM 0 H ALA A2127 -1.052 2.934 7.407 1.00 0.28 H new ATOM 0 HA ALA A2127 1.169 1.637 8.627 1.00 0.29 H new ATOM 0 HB1 ALA A2127 -0.527 -0.017 9.293 1.00 0.34 H new ATOM 0 HB2 ALA A2127 -1.065 1.651 9.603 1.00 0.34 H new ATOM 0 HB3 ALA A2127 -1.700 0.757 8.201 1.00 0.34 H new ATOM 1224 N LEU A2128 0.152 0.452 5.751 1.00 0.22 N ATOM 1225 CA LEU A2128 0.617 -0.360 4.648 1.00 0.21 C ATOM 1226 C LEU A2128 1.993 0.114 4.198 1.00 0.21 C ATOM 1227 O LEU A2128 2.848 -0.689 3.818 1.00 0.23 O ATOM 1228 CB LEU A2128 -0.353 -0.272 3.481 1.00 0.21 C ATOM 1229 CG LEU A2128 -1.647 -1.069 3.628 1.00 0.37 C ATOM 1230 CD1 LEU A2128 -2.419 -1.043 2.323 1.00 0.60 C ATOM 1231 CD2 LEU A2128 -1.354 -2.502 4.050 1.00 0.64 C ATOM 0 H LEU A2128 -0.654 1.039 5.536 1.00 0.22 H new ATOM 0 HA LEU A2128 0.680 -1.396 4.983 1.00 0.21 H new ATOM 0 HB2 LEU A2128 -0.610 0.776 3.326 1.00 0.21 H new ATOM 0 HB3 LEU A2128 0.160 -0.611 2.581 1.00 0.21 H new ATOM 0 HG LEU A2128 -2.255 -0.608 4.406 1.00 0.37 H new ATOM 0 HD11 LEU A2128 -3.341 -1.613 2.434 1.00 0.60 H new ATOM 0 HD12 LEU A2128 -2.659 -0.012 2.063 1.00 0.60 H new ATOM 0 HD13 LEU A2128 -1.812 -1.485 1.533 1.00 0.60 H new ATOM 0 HD21 LEU A2128 -2.290 -3.051 4.149 1.00 0.64 H new ATOM 0 HD22 LEU A2128 -0.729 -2.982 3.297 1.00 0.64 H new ATOM 0 HD23 LEU A2128 -0.832 -2.500 5.007 1.00 0.64 H new ATOM 1243 N THR A2129 2.190 1.433 4.242 1.00 0.21 N ATOM 1244 CA THR A2129 3.477 2.040 3.930 1.00 0.24 C ATOM 1245 C THR A2129 4.575 1.413 4.773 1.00 0.25 C ATOM 1246 O THR A2129 5.650 1.093 4.272 1.00 0.33 O ATOM 1247 CB THR A2129 3.445 3.566 4.181 1.00 0.27 C ATOM 1248 OG1 THR A2129 2.428 4.175 3.377 1.00 0.27 O ATOM 1249 CG2 THR A2129 4.792 4.214 3.882 1.00 0.32 C ATOM 0 H THR A2129 1.464 2.104 4.494 1.00 0.21 H new ATOM 0 HA THR A2129 3.683 1.862 2.875 1.00 0.24 H new ATOM 0 HB THR A2129 3.222 3.722 5.236 1.00 0.27 H new ATOM 0 HG1 THR A2129 1.549 3.838 3.650 1.00 0.27 H new ATOM 0 HG21 THR A2129 4.730 5.286 4.070 1.00 0.32 H new ATOM 0 HG22 THR A2129 5.557 3.777 4.524 1.00 0.32 H new ATOM 0 HG23 THR A2129 5.054 4.043 2.838 1.00 0.32 H new ATOM 1257 N GLN A2130 4.274 1.216 6.045 1.00 0.25 N ATOM 1258 CA GLN A2130 5.217 0.620 6.983 1.00 0.28 C ATOM 1259 C GLN A2130 5.584 -0.791 6.545 1.00 0.23 C ATOM 1260 O GLN A2130 6.757 -1.166 6.540 1.00 0.22 O ATOM 1261 CB GLN A2130 4.612 0.572 8.387 1.00 0.38 C ATOM 1262 CG GLN A2130 3.986 1.882 8.836 1.00 0.52 C ATOM 1263 CD GLN A2130 3.439 1.805 10.246 1.00 1.39 C ATOM 1264 OE1 GLN A2130 2.993 0.750 10.691 1.00 2.22 O ATOM 1265 NE2 GLN A2130 3.488 2.913 10.965 1.00 1.90 N ATOM 0 H GLN A2130 3.374 1.462 6.458 1.00 0.25 H new ATOM 0 HA GLN A2130 6.116 1.236 6.998 1.00 0.28 H new ATOM 0 HB2 GLN A2130 3.854 -0.210 8.418 1.00 0.38 H new ATOM 0 HB3 GLN A2130 5.390 0.291 9.097 1.00 0.38 H new ATOM 0 HG2 GLN A2130 4.731 2.676 8.781 1.00 0.52 H new ATOM 0 HG3 GLN A2130 3.182 2.151 8.151 1.00 0.52 H new ATOM 0 HE21 GLN A2130 3.866 3.769 10.558 1.00 1.90 H new ATOM 0 HE22 GLN A2130 3.148 2.912 11.927 1.00 1.90 H new ATOM 1274 N HIS A2131 4.570 -1.556 6.155 1.00 0.25 N ATOM 1275 CA HIS A2131 4.766 -2.933 5.719 1.00 0.27 C ATOM 1276 C HIS A2131 5.729 -2.996 4.546 1.00 0.26 C ATOM 1277 O HIS A2131 6.749 -3.685 4.595 1.00 0.30 O ATOM 1278 CB HIS A2131 3.430 -3.569 5.323 1.00 0.32 C ATOM 1279 CG HIS A2131 3.576 -4.927 4.707 1.00 0.40 C ATOM 1280 ND1 HIS A2131 4.398 -5.906 5.220 1.00 0.52 N ATOM 1281 CD2 HIS A2131 3.040 -5.446 3.578 1.00 0.42 C ATOM 1282 CE1 HIS A2131 4.368 -6.962 4.433 1.00 0.59 C ATOM 1283 NE2 HIS A2131 3.550 -6.712 3.429 1.00 0.53 N ATOM 0 H HIS A2131 3.599 -1.243 6.132 1.00 0.25 H new ATOM 0 HA HIS A2131 5.191 -3.490 6.554 1.00 0.27 H new ATOM 0 HB2 HIS A2131 2.797 -3.645 6.207 1.00 0.32 H new ATOM 0 HB3 HIS A2131 2.918 -2.912 4.620 1.00 0.32 H new ATOM 0 HD2 HIS A2131 2.341 -4.955 2.917 1.00 0.42 H new ATOM 0 HE1 HIS A2131 4.920 -7.878 4.584 1.00 0.59 H new ATOM 0 HE2 HIS A2131 3.332 -7.354 2.667 1.00 0.53 H new ATOM 1292 N LEU A2132 5.398 -2.278 3.490 1.00 0.27 N ATOM 1293 CA LEU A2132 6.228 -2.280 2.299 1.00 0.33 C ATOM 1294 C LEU A2132 7.560 -1.586 2.561 1.00 0.35 C ATOM 1295 O LEU A2132 8.550 -1.874 1.904 1.00 0.47 O ATOM 1296 CB LEU A2132 5.506 -1.647 1.103 1.00 0.36 C ATOM 1297 CG LEU A2132 4.461 -2.540 0.410 1.00 0.42 C ATOM 1298 CD1 LEU A2132 5.037 -3.919 0.108 1.00 0.48 C ATOM 1299 CD2 LEU A2132 3.196 -2.659 1.249 1.00 0.42 C ATOM 0 H LEU A2132 4.567 -1.690 3.431 1.00 0.27 H new ATOM 0 HA LEU A2132 6.430 -3.320 2.045 1.00 0.33 H new ATOM 0 HB2 LEU A2132 5.013 -0.735 1.440 1.00 0.36 H new ATOM 0 HB3 LEU A2132 6.252 -1.352 0.365 1.00 0.36 H new ATOM 0 HG LEU A2132 4.195 -2.066 -0.535 1.00 0.42 H new ATOM 0 HD11 LEU A2132 4.279 -4.531 -0.381 1.00 0.48 H new ATOM 0 HD12 LEU A2132 5.901 -3.817 -0.549 1.00 0.48 H new ATOM 0 HD13 LEU A2132 5.344 -4.397 1.038 1.00 0.48 H new ATOM 0 HD21 LEU A2132 2.476 -3.296 0.734 1.00 0.42 H new ATOM 0 HD22 LEU A2132 3.441 -3.097 2.216 1.00 0.42 H new ATOM 0 HD23 LEU A2132 2.764 -1.670 1.398 1.00 0.42 H new ATOM 1311 N HIS A2133 7.597 -0.692 3.541 1.00 0.28 N ATOM 1312 CA HIS A2133 8.842 -0.031 3.907 1.00 0.34 C ATOM 1313 C HIS A2133 9.826 -1.049 4.478 1.00 0.38 C ATOM 1314 O HIS A2133 11.036 -0.943 4.270 1.00 0.55 O ATOM 1315 CB HIS A2133 8.572 1.095 4.907 1.00 0.36 C ATOM 1316 CG HIS A2133 9.798 1.833 5.342 1.00 0.47 C ATOM 1317 ND1 HIS A2133 10.184 1.943 6.657 1.00 0.59 N ATOM 1318 CD2 HIS A2133 10.717 2.514 4.623 1.00 0.53 C ATOM 1319 CE1 HIS A2133 11.287 2.660 6.730 1.00 0.67 C ATOM 1320 NE2 HIS A2133 11.636 3.020 5.508 1.00 0.63 N ATOM 0 H HIS A2133 6.786 -0.410 4.092 1.00 0.28 H new ATOM 0 HA HIS A2133 9.286 0.411 3.015 1.00 0.34 H new ATOM 0 HB2 HIS A2133 7.874 1.803 4.460 1.00 0.36 H new ATOM 0 HB3 HIS A2133 8.082 0.676 5.786 1.00 0.36 H new ATOM 0 HD2 HIS A2133 10.727 2.637 3.550 1.00 0.53 H new ATOM 0 HE1 HIS A2133 11.817 2.911 7.637 1.00 0.67 H new ATOM 0 HE2 HIS A2133 12.452 3.580 5.263 1.00 0.63 H new ATOM 1329 N THR A2134 9.296 -2.036 5.184 1.00 0.32 N ATOM 1330 CA THR A2134 10.091 -3.142 5.677 1.00 0.43 C ATOM 1331 C THR A2134 10.479 -4.057 4.517 1.00 0.51 C ATOM 1332 O THR A2134 11.619 -4.489 4.409 1.00 0.66 O ATOM 1333 CB THR A2134 9.297 -3.932 6.731 1.00 0.55 C ATOM 1334 OG1 THR A2134 8.619 -3.024 7.610 1.00 0.59 O ATOM 1335 CG2 THR A2134 10.211 -4.820 7.547 1.00 0.74 C ATOM 0 H THR A2134 8.307 -2.090 5.429 1.00 0.32 H new ATOM 0 HA THR A2134 10.997 -2.752 6.140 1.00 0.43 H new ATOM 0 HB THR A2134 8.573 -4.558 6.209 1.00 0.55 H new ATOM 0 HG1 THR A2134 7.906 -2.565 7.119 1.00 0.59 H new ATOM 0 HG21 THR A2134 9.624 -5.367 8.284 1.00 0.74 H new ATOM 0 HG22 THR A2134 10.715 -5.527 6.888 1.00 0.74 H new ATOM 0 HG23 THR A2134 10.954 -4.207 8.057 1.00 0.74 H new ATOM 1343 N ARG A2135 9.527 -4.304 3.628 1.00 0.52 N ATOM 1344 CA ARG A2135 9.748 -5.142 2.455 1.00 0.71 C ATOM 1345 C ARG A2135 10.777 -4.548 1.498 1.00 0.88 C ATOM 1346 O ARG A2135 11.351 -5.254 0.680 1.00 1.12 O ATOM 1347 CB ARG A2135 8.430 -5.336 1.714 1.00 0.76 C ATOM 1348 CG ARG A2135 7.424 -6.162 2.488 1.00 0.74 C ATOM 1349 CD ARG A2135 7.910 -7.591 2.611 1.00 0.86 C ATOM 1350 NE ARG A2135 7.059 -8.423 3.460 1.00 1.75 N ATOM 1351 CZ ARG A2135 7.495 -9.080 4.540 1.00 2.11 C ATOM 1352 NH1 ARG A2135 8.755 -8.955 4.941 1.00 1.86 N ATOM 1353 NH2 ARG A2135 6.668 -9.865 5.216 1.00 3.18 N ATOM 0 H ARG A2135 8.581 -3.930 3.698 1.00 0.52 H new ATOM 0 HA ARG A2135 10.138 -6.097 2.808 1.00 0.71 H new ATOM 0 HB2 ARG A2135 7.997 -4.360 1.495 1.00 0.76 H new ATOM 0 HB3 ARG A2135 8.627 -5.819 0.757 1.00 0.76 H new ATOM 0 HG2 ARG A2135 7.275 -5.733 3.479 1.00 0.74 H new ATOM 0 HG3 ARG A2135 6.458 -6.140 1.983 1.00 0.74 H new ATOM 0 HD2 ARG A2135 7.964 -8.035 1.617 1.00 0.86 H new ATOM 0 HD3 ARG A2135 8.922 -7.589 3.015 1.00 0.86 H new ATOM 0 HE ARG A2135 6.073 -8.507 3.214 1.00 1.75 H new ATOM 0 HH11 ARG A2135 9.398 -8.355 4.424 1.00 1.86 H new ATOM 0 HH12 ARG A2135 9.080 -9.459 5.766 1.00 1.86 H new ATOM 0 HH21 ARG A2135 5.700 -9.968 4.912 1.00 3.18 H new ATOM 0 HH22 ARG A2135 7.000 -10.366 6.040 1.00 3.18 H new