USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 980 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 : A 327 TYR OH : rot 180:sc= 0 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 GLN :FLIP amide:sc= -0.663 F(o=-1.3,f=-0.66) USER MOD Single : A 340 MET CE :methyl 159:sc= -1.12 (180deg=-2.66!) USER MOD Single : A 345 ASN : amide:sc= -0.893 K(o=-0.89,f=-2.2!) USER MOD Single : A 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 354 GLN :FLIP amide:sc= 0 F(o=-0.61,f=0) USER MOD Single : B 327 TYR OH : rot 180:sc= 0 USER MOD Single : B 329 THR OG1 : rot 180:sc= 0 USER MOD Single : B 331 GLN : amide:sc= -0.423 X(o=-0.42,f=-0.29) USER MOD Single : B 340 MET CE :methyl 171:sc=-0.00705 (180deg=-0.151) USER MOD Single : B 345 ASN : amide:sc= -0.836 K(o=-0.84,f=-2.1!) USER MOD Single : B 351 LYS NZ :NH3+ -145:sc= 0.00172 (180deg=0) USER MOD Single : B 354 GLN :FLIP amide:sc= -0.341 F(o=-1.7,f=-0.34) USER MOD Single : C 327 TYR OH : rot 180:sc= 0 USER MOD Single : C 329 THR OG1 : rot 180:sc= 0 USER MOD Single : C 331 GLN : amide:sc= 0.0022 X(o=0.0022,f=0) USER MOD Single : C 340 MET CE :methyl 162:sc= -0.543 (180deg=-1.52) USER MOD Single : C 345 ASN : amide:sc= -1.87 X(o=-1.9,f=-2.3!) USER MOD Single : C 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 327 TYR OH : rot 180:sc= 0 USER MOD Single : D 329 THR OG1 : rot 180:sc= 0 USER MOD Single : D 331 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.34) USER MOD Single : D 340 MET CE :methyl 159:sc= -0.264 (180deg=-1.46) USER MOD Single : D 345 ASN : amide:sc= -1.56 K(o=-1.6,f=-2.7!) USER MOD Single : D 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 354 GLN :FLIP amide:sc= 0 F(o=-0.7,f=0) USER MOD ----------------------------------------------------------------- ATOM 121 N GLU A 326 15.884 8.192 11.057 1.00 0.48 N ATOM 122 CA GLU A 326 16.788 7.086 10.632 1.00 0.45 C ATOM 123 C GLU A 326 16.781 6.976 9.109 1.00 0.39 C ATOM 124 O GLU A 326 16.108 7.720 8.424 1.00 0.38 O ATOM 125 CB GLU A 326 16.292 5.768 11.228 1.00 0.46 C ATOM 126 CG GLU A 326 16.601 5.736 12.725 1.00 0.51 C ATOM 127 CD GLU A 326 18.115 5.789 12.929 1.00 1.39 C ATOM 128 OE1 GLU A 326 18.830 5.438 12.006 1.00 2.13 O ATOM 129 OE2 GLU A 326 18.535 6.181 14.006 1.00 2.13 O ATOM 0 HA GLU A 326 17.800 7.293 10.981 1.00 0.45 H new ATOM 0 HB2 GLU A 326 15.219 5.664 11.065 1.00 0.46 H new ATOM 0 HB3 GLU A 326 16.773 4.927 10.729 1.00 0.46 H new ATOM 0 HG2 GLU A 326 16.125 6.580 13.224 1.00 0.51 H new ATOM 0 HG3 GLU A 326 16.194 4.830 13.173 1.00 0.51 H new ATOM 136 N TYR A 327 17.521 6.044 8.577 1.00 0.36 N ATOM 137 CA TYR A 327 17.556 5.872 7.100 1.00 0.31 C ATOM 138 C TYR A 327 17.807 4.398 6.776 1.00 0.28 C ATOM 139 O TYR A 327 18.880 3.877 6.999 1.00 0.30 O ATOM 140 CB TYR A 327 18.674 6.733 6.507 1.00 0.34 C ATOM 141 CG TYR A 327 18.201 8.163 6.410 1.00 0.36 C ATOM 142 CD1 TYR A 327 18.320 9.015 7.516 1.00 0.41 C ATOM 143 CD2 TYR A 327 17.637 8.636 5.219 1.00 0.36 C ATOM 144 CE1 TYR A 327 17.875 10.339 7.432 1.00 0.45 C ATOM 145 CE2 TYR A 327 17.192 9.963 5.133 1.00 0.40 C ATOM 146 CZ TYR A 327 17.312 10.814 6.242 1.00 0.44 C ATOM 147 OH TYR A 327 16.875 12.121 6.165 1.00 0.48 O ATOM 0 H TYR A 327 18.104 5.393 9.103 1.00 0.36 H new ATOM 0 HA TYR A 327 16.604 6.184 6.670 1.00 0.31 H new ATOM 0 HB2 TYR A 327 19.565 6.674 7.132 1.00 0.34 H new ATOM 0 HB3 TYR A 327 18.951 6.361 5.520 1.00 0.34 H new ATOM 0 HD1 TYR A 327 18.756 8.649 8.434 1.00 0.41 H new ATOM 0 HD2 TYR A 327 17.545 7.979 4.367 1.00 0.36 H new ATOM 0 HE1 TYR A 327 17.966 10.994 8.286 1.00 0.45 H new ATOM 0 HE2 TYR A 327 16.758 10.329 4.215 1.00 0.40 H new ATOM 0 HH TYR A 327 16.512 12.292 5.271 1.00 0.48 H new ATOM 157 N PHE A 328 16.821 3.719 6.254 1.00 0.25 N ATOM 158 CA PHE A 328 17.003 2.277 5.923 1.00 0.23 C ATOM 159 C PHE A 328 16.970 2.091 4.407 1.00 0.22 C ATOM 160 O PHE A 328 17.034 3.040 3.650 1.00 0.22 O ATOM 161 CB PHE A 328 15.876 1.456 6.555 1.00 0.22 C ATOM 162 CG PHE A 328 15.912 1.622 8.052 1.00 0.24 C ATOM 163 CD1 PHE A 328 15.406 2.788 8.638 1.00 0.25 C ATOM 164 CD2 PHE A 328 16.452 0.610 8.856 1.00 0.28 C ATOM 165 CE1 PHE A 328 15.441 2.945 10.030 1.00 0.28 C ATOM 166 CE2 PHE A 328 16.488 0.766 10.247 1.00 0.31 C ATOM 167 CZ PHE A 328 15.983 1.933 10.836 1.00 0.30 C ATOM 0 H PHE A 328 15.899 4.100 6.043 1.00 0.25 H new ATOM 0 HA PHE A 328 17.963 1.939 6.313 1.00 0.23 H new ATOM 0 HB2 PHE A 328 14.912 1.782 6.165 1.00 0.22 H new ATOM 0 HB3 PHE A 328 15.987 0.404 6.292 1.00 0.22 H new ATOM 0 HD1 PHE A 328 14.988 3.567 8.017 1.00 0.25 H new ATOM 0 HD2 PHE A 328 16.840 -0.290 8.403 1.00 0.28 H new ATOM 0 HE1 PHE A 328 15.051 3.845 10.482 1.00 0.28 H new ATOM 0 HE2 PHE A 328 16.905 -0.014 10.867 1.00 0.31 H new ATOM 0 HZ PHE A 328 16.011 2.053 11.909 1.00 0.30 H new ATOM 177 N THR A 329 16.874 0.871 3.960 1.00 0.21 N ATOM 178 CA THR A 329 16.839 0.612 2.495 1.00 0.20 C ATOM 179 C THR A 329 16.061 -0.677 2.237 1.00 0.20 C ATOM 180 O THR A 329 15.813 -1.452 3.138 1.00 0.22 O ATOM 181 CB THR A 329 18.269 0.463 1.971 1.00 0.21 C ATOM 182 OG1 THR A 329 18.933 -0.564 2.697 1.00 0.21 O ATOM 183 CG2 THR A 329 19.016 1.784 2.152 1.00 0.21 C ATOM 0 H THR A 329 16.818 0.040 4.548 1.00 0.21 H new ATOM 0 HA THR A 329 16.353 1.443 1.983 1.00 0.20 H new ATOM 0 HB THR A 329 18.246 0.202 0.913 1.00 0.21 H new ATOM 0 HG1 THR A 329 19.849 -0.662 2.362 1.00 0.21 H new ATOM 0 HG21 THR A 329 20.035 1.680 1.779 1.00 0.21 H new ATOM 0 HG22 THR A 329 18.505 2.570 1.596 1.00 0.21 H new ATOM 0 HG23 THR A 329 19.042 2.046 3.210 1.00 0.21 H new ATOM 191 N LEU A 330 15.664 -0.911 1.020 1.00 0.19 N ATOM 192 CA LEU A 330 14.895 -2.149 0.720 1.00 0.20 C ATOM 193 C LEU A 330 15.149 -2.578 -0.725 1.00 0.19 C ATOM 194 O LEU A 330 15.055 -1.786 -1.642 1.00 0.19 O ATOM 195 CB LEU A 330 13.400 -1.873 0.915 1.00 0.20 C ATOM 196 CG LEU A 330 12.595 -3.113 0.526 1.00 0.21 C ATOM 197 CD1 LEU A 330 12.695 -4.157 1.640 1.00 0.28 C ATOM 198 CD2 LEU A 330 11.128 -2.726 0.321 1.00 0.22 C ATOM 0 H LEU A 330 15.838 -0.301 0.221 1.00 0.19 H new ATOM 0 HA LEU A 330 15.214 -2.946 1.392 1.00 0.20 H new ATOM 0 HB2 LEU A 330 13.201 -1.609 1.954 1.00 0.20 H new ATOM 0 HB3 LEU A 330 13.094 -1.023 0.306 1.00 0.20 H new ATOM 0 HG LEU A 330 12.994 -3.529 -0.399 1.00 0.21 H new ATOM 0 HD11 LEU A 330 12.121 -5.041 1.363 1.00 0.28 H new ATOM 0 HD12 LEU A 330 13.739 -4.434 1.787 1.00 0.28 H new ATOM 0 HD13 LEU A 330 12.296 -3.741 2.565 1.00 0.28 H new ATOM 0 HD21 LEU A 330 10.554 -3.610 0.044 1.00 0.22 H new ATOM 0 HD22 LEU A 330 10.729 -2.310 1.246 1.00 0.22 H new ATOM 0 HD23 LEU A 330 11.055 -1.982 -0.473 1.00 0.22 H new ATOM 210 N GLN A 331 15.460 -3.826 -0.939 1.00 0.21 N ATOM 211 CA GLN A 331 15.708 -4.303 -2.328 1.00 0.22 C ATOM 212 C GLN A 331 14.374 -4.679 -2.970 1.00 0.22 C ATOM 213 O GLN A 331 13.697 -5.584 -2.526 1.00 0.24 O ATOM 214 CB GLN A 331 16.623 -5.527 -2.296 1.00 0.24 C ATOM 215 CG GLN A 331 17.044 -5.886 -3.721 1.00 0.30 C ATOM 216 CD GLN A 331 18.571 -5.897 -3.808 1.00 0.43 C ATOM 217 OE1 GLN A 331 19.158 -5.331 -4.826 1.00 0.91 O flip ATOM 218 NE2 GLN A 331 19.236 -6.427 -2.941 1.00 0.29 N flip ATOM 0 H GLN A 331 15.553 -4.536 -0.213 1.00 0.21 H new ATOM 0 HA GLN A 331 16.187 -3.514 -2.907 1.00 0.22 H new ATOM 0 HB2 GLN A 331 17.503 -5.321 -1.687 1.00 0.24 H new ATOM 0 HB3 GLN A 331 16.106 -6.369 -1.835 1.00 0.24 H new ATOM 0 HG2 GLN A 331 16.645 -6.863 -3.995 1.00 0.30 H new ATOM 0 HG3 GLN A 331 16.633 -5.164 -4.427 1.00 0.30 H new ATOM 0 HE21 GLN A 331 18.777 -6.870 -2.145 1.00 0.29 H new ATOM 0 HE22 GLN A 331 20.254 -6.430 -3.009 1.00 0.29 H new ATOM 227 N ILE A 332 13.989 -3.993 -4.006 1.00 0.22 N ATOM 228 CA ILE A 332 12.693 -4.312 -4.665 1.00 0.23 C ATOM 229 C ILE A 332 12.946 -5.128 -5.936 1.00 0.24 C ATOM 230 O ILE A 332 13.343 -4.600 -6.956 1.00 0.26 O ATOM 231 CB ILE A 332 11.978 -3.010 -5.029 1.00 0.22 C ATOM 232 CG1 ILE A 332 11.720 -2.192 -3.760 1.00 0.21 C ATOM 233 CG2 ILE A 332 10.643 -3.331 -5.701 1.00 0.25 C ATOM 234 CD1 ILE A 332 11.215 -0.802 -4.146 1.00 0.24 C ATOM 0 H ILE A 332 14.514 -3.226 -4.426 1.00 0.22 H new ATOM 0 HA ILE A 332 12.073 -4.893 -3.983 1.00 0.23 H new ATOM 0 HB ILE A 332 12.604 -2.435 -5.712 1.00 0.22 H new ATOM 0 HG12 ILE A 332 10.986 -2.696 -3.132 1.00 0.21 H new ATOM 0 HG13 ILE A 332 12.636 -2.109 -3.175 1.00 0.21 H new ATOM 0 HG21 ILE A 332 10.134 -2.403 -5.960 1.00 0.25 H new ATOM 0 HG22 ILE A 332 10.822 -3.912 -6.606 1.00 0.25 H new ATOM 0 HG23 ILE A 332 10.021 -3.907 -5.017 1.00 0.25 H new ATOM 0 HD11 ILE A 332 11.031 -0.218 -3.244 1.00 0.24 H new ATOM 0 HD12 ILE A 332 11.965 -0.299 -4.757 1.00 0.24 H new ATOM 0 HD13 ILE A 332 10.289 -0.896 -4.713 1.00 0.24 H new ATOM 246 N ARG A 333 12.711 -6.412 -5.885 1.00 0.26 N ATOM 247 CA ARG A 333 12.930 -7.260 -7.092 1.00 0.28 C ATOM 248 C ARG A 333 11.862 -6.933 -8.137 1.00 0.27 C ATOM 249 O ARG A 333 10.754 -6.562 -7.808 1.00 0.27 O ATOM 250 CB ARG A 333 12.825 -8.734 -6.701 1.00 0.32 C ATOM 251 CG ARG A 333 13.987 -9.100 -5.778 1.00 0.42 C ATOM 252 CD ARG A 333 13.551 -8.933 -4.323 1.00 0.69 C ATOM 253 NE ARG A 333 14.123 -10.030 -3.496 1.00 1.44 N ATOM 254 CZ ARG A 333 14.164 -9.915 -2.196 1.00 1.96 C ATOM 255 NH1 ARG A 333 13.720 -8.832 -1.618 1.00 2.17 N ATOM 256 NH2 ARG A 333 14.657 -10.883 -1.474 1.00 2.92 N ATOM 0 H ARG A 333 12.377 -6.910 -5.060 1.00 0.26 H new ATOM 0 HA ARG A 333 13.919 -7.063 -7.505 1.00 0.28 H new ATOM 0 HB2 ARG A 333 11.875 -8.922 -6.200 1.00 0.32 H new ATOM 0 HB3 ARG A 333 12.844 -9.360 -7.593 1.00 0.32 H new ATOM 0 HG2 ARG A 333 14.300 -10.128 -5.960 1.00 0.42 H new ATOM 0 HG3 ARG A 333 14.847 -8.463 -5.987 1.00 0.42 H new ATOM 0 HD2 ARG A 333 13.884 -7.967 -3.943 1.00 0.69 H new ATOM 0 HD3 ARG A 333 12.463 -8.944 -4.256 1.00 0.69 H new ATOM 0 HE ARG A 333 14.483 -10.872 -3.945 1.00 1.44 H new ATOM 0 HH11 ARG A 333 13.339 -8.072 -2.182 1.00 2.17 H new ATOM 0 HH12 ARG A 333 13.754 -8.746 -0.602 1.00 2.17 H new ATOM 0 HH21 ARG A 333 15.009 -11.727 -1.925 1.00 2.92 H new ATOM 0 HH22 ARG A 333 14.690 -10.796 -0.458 1.00 2.92 H new ATOM 270 N GLY A 334 12.187 -7.063 -9.393 1.00 0.29 N ATOM 271 CA GLY A 334 11.188 -6.754 -10.455 1.00 0.31 C ATOM 272 C GLY A 334 11.088 -5.240 -10.640 1.00 0.33 C ATOM 273 O GLY A 334 10.849 -4.503 -9.703 1.00 0.40 O ATOM 0 H GLY A 334 13.100 -7.369 -9.730 1.00 0.29 H new ATOM 0 HA2 GLY A 334 11.481 -7.227 -11.393 1.00 0.31 H new ATOM 0 HA3 GLY A 334 10.215 -7.162 -10.183 1.00 0.31 H new ATOM 277 N ARG A 335 11.270 -4.771 -11.843 1.00 0.30 N ATOM 278 CA ARG A 335 11.187 -3.307 -12.101 1.00 0.34 C ATOM 279 C ARG A 335 9.721 -2.864 -12.073 1.00 0.32 C ATOM 280 O ARG A 335 9.398 -1.780 -11.629 1.00 0.30 O ATOM 281 CB ARG A 335 11.794 -3.006 -13.477 1.00 0.38 C ATOM 282 CG ARG A 335 11.310 -1.641 -13.980 1.00 0.47 C ATOM 283 CD ARG A 335 10.142 -1.841 -14.951 1.00 0.94 C ATOM 284 NE ARG A 335 10.371 -1.018 -16.175 1.00 1.54 N ATOM 285 CZ ARG A 335 9.667 -1.233 -17.255 1.00 2.11 C ATOM 286 NH1 ARG A 335 8.746 -2.160 -17.264 1.00 2.43 N ATOM 287 NH2 ARG A 335 9.885 -0.517 -18.327 1.00 3.01 N ATOM 0 H ARG A 335 11.474 -5.343 -12.663 1.00 0.30 H new ATOM 0 HA ARG A 335 11.738 -2.765 -11.332 1.00 0.34 H new ATOM 0 HB2 ARG A 335 12.882 -3.013 -13.412 1.00 0.38 H new ATOM 0 HB3 ARG A 335 11.511 -3.784 -14.186 1.00 0.38 H new ATOM 0 HG2 ARG A 335 10.997 -1.022 -13.140 1.00 0.47 H new ATOM 0 HG3 ARG A 335 12.125 -1.115 -14.477 1.00 0.47 H new ATOM 0 HD2 ARG A 335 10.053 -2.894 -15.218 1.00 0.94 H new ATOM 0 HD3 ARG A 335 9.205 -1.552 -14.475 1.00 0.94 H new ATOM 0 HE ARG A 335 11.080 -0.285 -16.169 1.00 1.54 H new ATOM 0 HH11 ARG A 335 8.575 -2.717 -16.427 1.00 2.43 H new ATOM 0 HH12 ARG A 335 8.198 -2.326 -18.108 1.00 2.43 H new ATOM 0 HH21 ARG A 335 10.603 0.207 -18.319 1.00 3.01 H new ATOM 0 HH22 ARG A 335 9.337 -0.683 -19.171 1.00 3.01 H new ATOM 301 N GLU A 336 8.832 -3.689 -12.551 1.00 0.35 N ATOM 302 CA GLU A 336 7.392 -3.306 -12.558 1.00 0.38 C ATOM 303 C GLU A 336 6.933 -2.992 -11.130 1.00 0.38 C ATOM 304 O GLU A 336 6.471 -1.907 -10.840 1.00 0.39 O ATOM 305 CB GLU A 336 6.560 -4.462 -13.117 1.00 0.45 C ATOM 306 CG GLU A 336 6.963 -4.733 -14.567 1.00 1.34 C ATOM 307 CD GLU A 336 6.692 -6.200 -14.901 1.00 1.73 C ATOM 308 OE1 GLU A 336 6.819 -7.022 -14.009 1.00 2.21 O ATOM 309 OE2 GLU A 336 6.361 -6.478 -16.042 1.00 2.29 O ATOM 0 H GLU A 336 9.039 -4.610 -12.937 1.00 0.35 H new ATOM 0 HA GLU A 336 7.257 -2.423 -13.183 1.00 0.38 H new ATOM 0 HB2 GLU A 336 6.712 -5.357 -12.514 1.00 0.45 H new ATOM 0 HB3 GLU A 336 5.499 -4.218 -13.064 1.00 0.45 H new ATOM 0 HG2 GLU A 336 6.401 -4.085 -15.240 1.00 1.34 H new ATOM 0 HG3 GLU A 336 8.019 -4.504 -14.712 1.00 1.34 H new ATOM 316 N ARG A 337 7.048 -3.937 -10.240 1.00 0.43 N ATOM 317 CA ARG A 337 6.611 -3.700 -8.834 1.00 0.50 C ATOM 318 C ARG A 337 7.414 -2.552 -8.218 1.00 0.40 C ATOM 319 O ARG A 337 6.942 -1.854 -7.344 1.00 0.38 O ATOM 320 CB ARG A 337 6.832 -4.973 -8.016 1.00 0.64 C ATOM 321 CG ARG A 337 6.019 -6.115 -8.628 1.00 0.77 C ATOM 322 CD ARG A 337 4.536 -5.738 -8.641 1.00 1.10 C ATOM 323 NE ARG A 337 3.712 -6.969 -8.504 1.00 1.39 N ATOM 324 CZ ARG A 337 2.448 -6.881 -8.191 1.00 2.18 C ATOM 325 NH1 ARG A 337 1.896 -5.715 -7.996 1.00 2.72 N ATOM 326 NH2 ARG A 337 1.733 -7.963 -8.071 1.00 2.93 N ATOM 0 H ARG A 337 7.427 -4.866 -10.425 1.00 0.43 H new ATOM 0 HA ARG A 337 5.554 -3.435 -8.828 1.00 0.50 H new ATOM 0 HB2 ARG A 337 7.891 -5.231 -8.003 1.00 0.64 H new ATOM 0 HB3 ARG A 337 6.531 -4.811 -6.981 1.00 0.64 H new ATOM 0 HG2 ARG A 337 6.362 -6.317 -9.643 1.00 0.77 H new ATOM 0 HG3 ARG A 337 6.167 -7.029 -8.054 1.00 0.77 H new ATOM 0 HD2 ARG A 337 4.318 -5.048 -7.826 1.00 1.10 H new ATOM 0 HD3 ARG A 337 4.289 -5.223 -9.569 1.00 1.10 H new ATOM 0 HE ARG A 337 4.136 -7.884 -8.655 1.00 1.39 H new ATOM 0 HH11 ARG A 337 2.453 -4.865 -8.088 1.00 2.72 H new ATOM 0 HH12 ARG A 337 0.908 -5.653 -7.752 1.00 2.72 H new ATOM 0 HH21 ARG A 337 2.161 -8.876 -8.222 1.00 2.93 H new ATOM 0 HH22 ARG A 337 0.745 -7.897 -7.826 1.00 2.93 H new ATOM 340 N PHE A 338 8.625 -2.353 -8.658 1.00 0.38 N ATOM 341 CA PHE A 338 9.454 -1.253 -8.087 1.00 0.34 C ATOM 342 C PHE A 338 8.733 0.090 -8.250 1.00 0.28 C ATOM 343 O PHE A 338 8.465 0.779 -7.287 1.00 0.27 O ATOM 344 CB PHE A 338 10.800 -1.201 -8.815 1.00 0.35 C ATOM 345 CG PHE A 338 11.536 0.060 -8.432 1.00 0.33 C ATOM 346 CD1 PHE A 338 12.395 0.059 -7.327 1.00 0.33 C ATOM 347 CD2 PHE A 338 11.362 1.231 -9.183 1.00 0.36 C ATOM 348 CE1 PHE A 338 13.081 1.228 -6.971 1.00 0.34 C ATOM 349 CE2 PHE A 338 12.048 2.401 -8.826 1.00 0.37 C ATOM 350 CZ PHE A 338 12.907 2.399 -7.721 1.00 0.35 C ATOM 0 H PHE A 338 9.077 -2.904 -9.388 1.00 0.38 H new ATOM 0 HA PHE A 338 9.616 -1.443 -7.026 1.00 0.34 H new ATOM 0 HB2 PHE A 338 11.398 -2.075 -8.557 1.00 0.35 H new ATOM 0 HB3 PHE A 338 10.643 -1.229 -9.893 1.00 0.35 H new ATOM 0 HD1 PHE A 338 12.529 -0.843 -6.748 1.00 0.33 H new ATOM 0 HD2 PHE A 338 10.700 1.232 -10.036 1.00 0.36 H new ATOM 0 HE1 PHE A 338 13.744 1.226 -6.118 1.00 0.34 H new ATOM 0 HE2 PHE A 338 11.913 3.304 -9.404 1.00 0.37 H new ATOM 0 HZ PHE A 338 13.436 3.300 -7.446 1.00 0.35 H new ATOM 360 N GLU A 339 8.427 0.472 -9.458 1.00 0.28 N ATOM 361 CA GLU A 339 7.737 1.776 -9.677 1.00 0.28 C ATOM 362 C GLU A 339 6.489 1.869 -8.791 1.00 0.25 C ATOM 363 O GLU A 339 6.122 2.933 -8.332 1.00 0.24 O ATOM 364 CB GLU A 339 7.326 1.889 -11.145 1.00 0.34 C ATOM 365 CG GLU A 339 8.466 1.387 -12.031 1.00 0.38 C ATOM 366 CD GLU A 339 8.464 2.155 -13.351 1.00 1.18 C ATOM 367 OE1 GLU A 339 8.364 3.371 -13.307 1.00 1.89 O ATOM 368 OE2 GLU A 339 8.567 1.516 -14.386 1.00 1.97 O ATOM 0 H GLU A 339 8.624 -0.062 -10.304 1.00 0.28 H new ATOM 0 HA GLU A 339 8.417 2.587 -9.418 1.00 0.28 H new ATOM 0 HB2 GLU A 339 6.424 1.305 -11.328 1.00 0.34 H new ATOM 0 HB3 GLU A 339 7.090 2.925 -11.389 1.00 0.34 H new ATOM 0 HG2 GLU A 339 9.421 1.520 -11.523 1.00 0.38 H new ATOM 0 HG3 GLU A 339 8.351 0.320 -12.219 1.00 0.38 H new ATOM 375 N MET A 340 5.829 0.768 -8.557 1.00 0.24 N ATOM 376 CA MET A 340 4.602 0.804 -7.709 1.00 0.22 C ATOM 377 C MET A 340 4.963 1.237 -6.285 1.00 0.19 C ATOM 378 O MET A 340 4.345 2.121 -5.723 1.00 0.19 O ATOM 379 CB MET A 340 3.963 -0.588 -7.672 1.00 0.24 C ATOM 380 CG MET A 340 2.552 -0.484 -7.089 1.00 0.27 C ATOM 381 SD MET A 340 1.795 -2.129 -7.035 1.00 0.29 S ATOM 382 CE MET A 340 2.294 -2.568 -5.351 1.00 0.31 C ATOM 0 H MET A 340 6.084 -0.152 -8.915 1.00 0.24 H new ATOM 0 HA MET A 340 3.897 1.519 -8.133 1.00 0.22 H new ATOM 0 HB2 MET A 340 3.923 -1.009 -8.677 1.00 0.24 H new ATOM 0 HB3 MET A 340 4.569 -1.263 -7.068 1.00 0.24 H new ATOM 0 HG2 MET A 340 2.592 -0.058 -6.087 1.00 0.27 H new ATOM 0 HG3 MET A 340 1.945 0.187 -7.697 1.00 0.27 H new ATOM 0 HE1 MET A 340 1.643 -3.356 -4.973 1.00 0.31 H new ATOM 0 HE2 MET A 340 3.325 -2.920 -5.357 1.00 0.31 H new ATOM 0 HE3 MET A 340 2.214 -1.692 -4.708 1.00 0.31 H new ATOM 392 N PHE A 341 5.949 0.623 -5.693 1.00 0.16 N ATOM 393 CA PHE A 341 6.336 1.002 -4.301 1.00 0.14 C ATOM 394 C PHE A 341 6.799 2.461 -4.264 1.00 0.15 C ATOM 395 O PHE A 341 6.444 3.213 -3.380 1.00 0.15 O ATOM 396 CB PHE A 341 7.477 0.099 -3.828 1.00 0.14 C ATOM 397 CG PHE A 341 6.914 -1.223 -3.371 1.00 0.14 C ATOM 398 CD1 PHE A 341 6.177 -1.295 -2.182 1.00 0.17 C ATOM 399 CD2 PHE A 341 7.126 -2.377 -4.134 1.00 0.15 C ATOM 400 CE1 PHE A 341 5.654 -2.521 -1.755 1.00 0.18 C ATOM 401 CE2 PHE A 341 6.602 -3.604 -3.708 1.00 0.17 C ATOM 402 CZ PHE A 341 5.866 -3.677 -2.518 1.00 0.17 C ATOM 0 H PHE A 341 6.504 -0.124 -6.110 1.00 0.16 H new ATOM 0 HA PHE A 341 5.473 0.883 -3.646 1.00 0.14 H new ATOM 0 HB2 PHE A 341 8.191 -0.057 -4.637 1.00 0.14 H new ATOM 0 HB3 PHE A 341 8.019 0.577 -3.012 1.00 0.14 H new ATOM 0 HD1 PHE A 341 6.012 -0.404 -1.594 1.00 0.17 H new ATOM 0 HD2 PHE A 341 7.694 -2.321 -5.051 1.00 0.15 H new ATOM 0 HE1 PHE A 341 5.087 -2.576 -0.837 1.00 0.18 H new ATOM 0 HE2 PHE A 341 6.765 -4.494 -4.297 1.00 0.17 H new ATOM 0 HZ PHE A 341 5.462 -4.623 -2.189 1.00 0.17 H new ATOM 412 N ARG A 342 7.599 2.862 -5.212 1.00 0.17 N ATOM 413 CA ARG A 342 8.095 4.267 -5.229 1.00 0.19 C ATOM 414 C ARG A 342 6.926 5.241 -5.045 1.00 0.18 C ATOM 415 O ARG A 342 7.007 6.183 -4.281 1.00 0.19 O ATOM 416 CB ARG A 342 8.784 4.543 -6.567 1.00 0.24 C ATOM 417 CG ARG A 342 9.598 5.835 -6.468 1.00 0.32 C ATOM 418 CD ARG A 342 10.800 5.761 -7.411 1.00 0.61 C ATOM 419 NE ARG A 342 10.888 7.027 -8.208 1.00 1.14 N ATOM 420 CZ ARG A 342 9.841 7.521 -8.823 1.00 1.74 C ATOM 421 NH1 ARG A 342 8.742 6.822 -8.941 1.00 2.34 N ATOM 422 NH2 ARG A 342 9.918 8.701 -9.378 1.00 2.42 N ATOM 0 H ARG A 342 7.932 2.276 -5.978 1.00 0.17 H new ATOM 0 HA ARG A 342 8.804 4.407 -4.413 1.00 0.19 H new ATOM 0 HB2 ARG A 342 9.436 3.710 -6.831 1.00 0.24 H new ATOM 0 HB3 ARG A 342 8.041 4.629 -7.359 1.00 0.24 H new ATOM 0 HG2 ARG A 342 8.973 6.690 -6.726 1.00 0.32 H new ATOM 0 HG3 ARG A 342 9.937 5.985 -5.443 1.00 0.32 H new ATOM 0 HD2 ARG A 342 11.716 5.614 -6.839 1.00 0.61 H new ATOM 0 HD3 ARG A 342 10.700 4.905 -8.078 1.00 0.61 H new ATOM 0 HE ARG A 342 11.781 7.515 -8.273 1.00 1.14 H new ATOM 0 HH11 ARG A 342 8.692 5.880 -8.552 1.00 2.34 H new ATOM 0 HH12 ARG A 342 7.935 7.218 -9.422 1.00 2.34 H new ATOM 0 HH21 ARG A 342 10.788 9.231 -9.331 1.00 2.42 H new ATOM 0 HH22 ARG A 342 9.108 9.092 -9.858 1.00 2.42 H new ATOM 436 N GLU A 343 5.846 5.027 -5.744 1.00 0.20 N ATOM 437 CA GLU A 343 4.677 5.946 -5.615 1.00 0.21 C ATOM 438 C GLU A 343 4.208 5.995 -4.157 1.00 0.16 C ATOM 439 O GLU A 343 3.986 7.054 -3.604 1.00 0.15 O ATOM 440 CB GLU A 343 3.533 5.441 -6.503 1.00 0.25 C ATOM 441 CG GLU A 343 2.247 6.206 -6.172 1.00 0.54 C ATOM 442 CD GLU A 343 1.447 6.447 -7.453 1.00 1.48 C ATOM 443 OE1 GLU A 343 1.162 5.480 -8.141 1.00 2.12 O ATOM 444 OE2 GLU A 343 1.133 7.594 -7.727 1.00 2.35 O ATOM 0 H GLU A 343 5.721 4.256 -6.400 1.00 0.20 H new ATOM 0 HA GLU A 343 4.972 6.947 -5.929 1.00 0.21 H new ATOM 0 HB2 GLU A 343 3.788 5.577 -7.554 1.00 0.25 H new ATOM 0 HB3 GLU A 343 3.383 4.373 -6.347 1.00 0.25 H new ATOM 0 HG2 GLU A 343 1.648 5.639 -5.459 1.00 0.54 H new ATOM 0 HG3 GLU A 343 2.490 7.157 -5.699 1.00 0.54 H new ATOM 451 N LEU A 344 4.049 4.862 -3.530 1.00 0.15 N ATOM 452 CA LEU A 344 3.588 4.850 -2.111 1.00 0.13 C ATOM 453 C LEU A 344 4.604 5.584 -1.231 1.00 0.13 C ATOM 454 O LEU A 344 4.253 6.197 -0.241 1.00 0.14 O ATOM 455 CB LEU A 344 3.457 3.401 -1.634 1.00 0.15 C ATOM 456 CG LEU A 344 2.194 2.777 -2.232 1.00 0.15 C ATOM 457 CD1 LEU A 344 2.237 1.259 -2.049 1.00 0.17 C ATOM 458 CD2 LEU A 344 0.964 3.341 -1.519 1.00 0.18 C ATOM 0 H LEU A 344 4.218 3.943 -3.938 1.00 0.15 H new ATOM 0 HA LEU A 344 2.622 5.350 -2.040 1.00 0.13 H new ATOM 0 HB2 LEU A 344 4.335 2.828 -1.933 1.00 0.15 H new ATOM 0 HB3 LEU A 344 3.411 3.368 -0.545 1.00 0.15 H new ATOM 0 HG LEU A 344 2.140 3.012 -3.295 1.00 0.15 H new ATOM 0 HD11 LEU A 344 1.337 0.816 -2.475 1.00 0.17 H new ATOM 0 HD12 LEU A 344 3.115 0.856 -2.555 1.00 0.17 H new ATOM 0 HD13 LEU A 344 2.290 1.022 -0.986 1.00 0.17 H new ATOM 0 HD21 LEU A 344 0.063 2.898 -1.943 1.00 0.18 H new ATOM 0 HD22 LEU A 344 1.019 3.105 -0.456 1.00 0.18 H new ATOM 0 HD23 LEU A 344 0.932 4.423 -1.649 1.00 0.18 H new ATOM 470 N ASN A 345 5.860 5.522 -1.581 1.00 0.16 N ATOM 471 CA ASN A 345 6.903 6.210 -0.766 1.00 0.19 C ATOM 472 C ASN A 345 6.572 7.698 -0.653 1.00 0.17 C ATOM 473 O ASN A 345 6.377 8.223 0.425 1.00 0.16 O ATOM 474 CB ASN A 345 8.266 6.045 -1.442 1.00 0.26 C ATOM 475 CG ASN A 345 9.324 6.810 -0.646 1.00 0.30 C ATOM 476 OD1 ASN A 345 9.373 8.024 -0.686 1.00 1.09 O ATOM 477 ND2 ASN A 345 10.179 6.146 0.083 1.00 0.69 N ATOM 0 H ASN A 345 6.210 5.023 -2.399 1.00 0.16 H new ATOM 0 HA ASN A 345 6.930 5.769 0.230 1.00 0.19 H new ATOM 0 HB2 ASN A 345 8.531 4.989 -1.499 1.00 0.26 H new ATOM 0 HB3 ASN A 345 8.224 6.418 -2.465 1.00 0.26 H new ATOM 0 HD21 ASN A 345 10.888 6.646 0.619 1.00 0.69 H new ATOM 0 HD22 ASN A 345 10.138 5.127 0.117 1.00 0.69 H new ATOM 484 N GLU A 346 6.512 8.384 -1.761 1.00 0.17 N ATOM 485 CA GLU A 346 6.199 9.838 -1.724 1.00 0.17 C ATOM 486 C GLU A 346 4.811 10.054 -1.115 1.00 0.14 C ATOM 487 O GLU A 346 4.512 11.108 -0.592 1.00 0.15 O ATOM 488 CB GLU A 346 6.222 10.402 -3.145 1.00 0.20 C ATOM 489 CG GLU A 346 6.219 11.931 -3.086 1.00 0.24 C ATOM 490 CD GLU A 346 7.188 12.485 -4.132 1.00 0.88 C ATOM 491 OE1 GLU A 346 7.094 12.070 -5.275 1.00 1.65 O ATOM 492 OE2 GLU A 346 8.005 13.317 -3.771 1.00 1.54 O ATOM 0 H GLU A 346 6.667 7.998 -2.692 1.00 0.17 H new ATOM 0 HA GLU A 346 6.944 10.349 -1.115 1.00 0.17 H new ATOM 0 HB2 GLU A 346 7.108 10.049 -3.674 1.00 0.20 H new ATOM 0 HB3 GLU A 346 5.355 10.047 -3.703 1.00 0.20 H new ATOM 0 HG2 GLU A 346 5.214 12.310 -3.269 1.00 0.24 H new ATOM 0 HG3 GLU A 346 6.510 12.268 -2.091 1.00 0.24 H new ATOM 499 N ALA A 347 3.959 9.069 -1.186 1.00 0.13 N ATOM 500 CA ALA A 347 2.590 9.220 -0.617 1.00 0.14 C ATOM 501 C ALA A 347 2.673 9.504 0.885 1.00 0.15 C ATOM 502 O ALA A 347 2.238 10.536 1.356 1.00 0.18 O ATOM 503 CB ALA A 347 1.798 7.931 -0.849 1.00 0.15 C ATOM 0 H ALA A 347 4.152 8.164 -1.615 1.00 0.13 H new ATOM 0 HA ALA A 347 2.089 10.054 -1.109 1.00 0.14 H new ATOM 0 HB1 ALA A 347 0.796 8.040 -0.433 1.00 0.15 H new ATOM 0 HB2 ALA A 347 1.728 7.735 -1.919 1.00 0.15 H new ATOM 0 HB3 ALA A 347 2.305 7.099 -0.360 1.00 0.15 H new ATOM 509 N LEU A 348 3.221 8.594 1.643 1.00 0.16 N ATOM 510 CA LEU A 348 3.320 8.807 3.115 1.00 0.20 C ATOM 511 C LEU A 348 4.176 10.041 3.405 1.00 0.20 C ATOM 512 O LEU A 348 3.816 10.887 4.202 1.00 0.23 O ATOM 513 CB LEU A 348 3.976 7.587 3.767 1.00 0.23 C ATOM 514 CG LEU A 348 2.970 6.437 3.858 1.00 0.25 C ATOM 515 CD1 LEU A 348 1.671 6.933 4.497 1.00 0.30 C ATOM 516 CD2 LEU A 348 2.676 5.906 2.454 1.00 0.21 C ATOM 0 H LEU A 348 3.605 7.711 1.306 1.00 0.16 H new ATOM 0 HA LEU A 348 2.318 8.952 3.519 1.00 0.20 H new ATOM 0 HB2 LEU A 348 4.844 7.276 3.185 1.00 0.23 H new ATOM 0 HB3 LEU A 348 4.336 7.846 4.763 1.00 0.23 H new ATOM 0 HG LEU A 348 3.390 5.640 4.471 1.00 0.25 H new ATOM 0 HD11 LEU A 348 0.959 6.110 4.559 1.00 0.30 H new ATOM 0 HD12 LEU A 348 1.879 7.309 5.499 1.00 0.30 H new ATOM 0 HD13 LEU A 348 1.249 7.733 3.889 1.00 0.30 H new ATOM 0 HD21 LEU A 348 1.960 5.087 2.517 1.00 0.21 H new ATOM 0 HD22 LEU A 348 2.259 6.706 1.842 1.00 0.21 H new ATOM 0 HD23 LEU A 348 3.599 5.546 2.000 1.00 0.21 H new ATOM 528 N GLU A 349 5.310 10.147 2.777 1.00 0.19 N ATOM 529 CA GLU A 349 6.192 11.319 3.031 1.00 0.21 C ATOM 530 C GLU A 349 5.425 12.614 2.764 1.00 0.20 C ATOM 531 O GLU A 349 5.679 13.632 3.375 1.00 0.23 O ATOM 532 CB GLU A 349 7.413 11.248 2.113 1.00 0.21 C ATOM 533 CG GLU A 349 8.355 10.159 2.622 1.00 0.27 C ATOM 534 CD GLU A 349 9.505 10.804 3.396 1.00 1.19 C ATOM 535 OE1 GLU A 349 9.237 11.386 4.436 1.00 1.94 O ATOM 536 OE2 GLU A 349 10.630 10.710 2.937 1.00 1.89 O ATOM 0 H GLU A 349 5.666 9.474 2.098 1.00 0.19 H new ATOM 0 HA GLU A 349 6.517 11.304 4.071 1.00 0.21 H new ATOM 0 HB2 GLU A 349 7.103 11.030 1.091 1.00 0.21 H new ATOM 0 HB3 GLU A 349 7.925 12.210 2.093 1.00 0.21 H new ATOM 0 HG2 GLU A 349 7.813 9.465 3.265 1.00 0.27 H new ATOM 0 HG3 GLU A 349 8.745 9.580 1.785 1.00 0.27 H new ATOM 543 N LEU A 350 4.492 12.587 1.855 1.00 0.21 N ATOM 544 CA LEU A 350 3.722 13.825 1.556 1.00 0.24 C ATOM 545 C LEU A 350 2.899 14.227 2.782 1.00 0.26 C ATOM 546 O LEU A 350 2.856 15.380 3.163 1.00 0.31 O ATOM 547 CB LEU A 350 2.791 13.576 0.369 1.00 0.27 C ATOM 548 CG LEU A 350 2.400 14.916 -0.258 1.00 0.33 C ATOM 549 CD1 LEU A 350 1.582 14.667 -1.525 1.00 0.46 C ATOM 550 CD2 LEU A 350 1.564 15.724 0.735 1.00 0.41 C ATOM 0 H LEU A 350 4.230 11.766 1.309 1.00 0.21 H new ATOM 0 HA LEU A 350 4.414 14.630 1.308 1.00 0.24 H new ATOM 0 HB2 LEU A 350 3.286 12.946 -0.370 1.00 0.27 H new ATOM 0 HB3 LEU A 350 1.900 13.041 0.697 1.00 0.27 H new ATOM 0 HG LEU A 350 3.302 15.473 -0.509 1.00 0.33 H new ATOM 0 HD11 LEU A 350 1.303 15.621 -1.972 1.00 0.46 H new ATOM 0 HD12 LEU A 350 2.177 14.094 -2.236 1.00 0.46 H new ATOM 0 HD13 LEU A 350 0.681 14.108 -1.272 1.00 0.46 H new ATOM 0 HD21 LEU A 350 1.287 16.678 0.286 1.00 0.41 H new ATOM 0 HD22 LEU A 350 0.662 15.167 0.989 1.00 0.41 H new ATOM 0 HD23 LEU A 350 2.146 15.904 1.639 1.00 0.41 H new ATOM 562 N LYS A 351 2.242 13.285 3.400 1.00 0.24 N ATOM 563 CA LYS A 351 1.419 13.611 4.598 1.00 0.27 C ATOM 564 C LYS A 351 2.312 14.211 5.686 1.00 0.30 C ATOM 565 O LYS A 351 2.021 15.252 6.239 1.00 0.37 O ATOM 566 CB LYS A 351 0.763 12.333 5.123 1.00 0.27 C ATOM 567 CG LYS A 351 -0.203 12.677 6.258 1.00 0.30 C ATOM 568 CD LYS A 351 -0.892 11.401 6.743 1.00 0.31 C ATOM 569 CE LYS A 351 -2.330 11.725 7.151 1.00 0.36 C ATOM 570 NZ LYS A 351 -2.868 10.627 8.004 1.00 1.40 N ATOM 0 H LYS A 351 2.240 12.302 3.127 1.00 0.24 H new ATOM 0 HA LYS A 351 0.649 14.332 4.326 1.00 0.27 H new ATOM 0 HB2 LYS A 351 0.228 11.830 4.317 1.00 0.27 H new ATOM 0 HB3 LYS A 351 1.526 11.641 5.479 1.00 0.27 H new ATOM 0 HG2 LYS A 351 0.337 13.147 7.080 1.00 0.30 H new ATOM 0 HG3 LYS A 351 -0.946 13.396 5.913 1.00 0.30 H new ATOM 0 HD2 LYS A 351 -0.887 10.649 5.954 1.00 0.31 H new ATOM 0 HD3 LYS A 351 -0.348 10.980 7.589 1.00 0.31 H new ATOM 0 HE2 LYS A 351 -2.360 12.669 7.694 1.00 0.36 H new ATOM 0 HE3 LYS A 351 -2.951 11.848 6.264 1.00 0.36 H new ATOM 0 HZ1 LYS A 351 -3.846 10.849 8.280 1.00 1.40 H new ATOM 0 HZ2 LYS A 351 -2.853 9.734 7.471 1.00 1.40 H new ATOM 0 HZ3 LYS A 351 -2.281 10.530 8.857 1.00 1.40 H new ATOM 584 N ASP A 352 3.398 13.559 6.002 1.00 0.31 N ATOM 585 CA ASP A 352 4.308 14.090 7.057 1.00 0.38 C ATOM 586 C ASP A 352 4.735 15.513 6.700 1.00 0.42 C ATOM 587 O ASP A 352 4.866 16.364 7.555 1.00 0.50 O ATOM 588 CB ASP A 352 5.548 13.201 7.151 1.00 0.42 C ATOM 589 CG ASP A 352 5.141 11.807 7.633 1.00 0.44 C ATOM 590 OD1 ASP A 352 4.511 11.721 8.675 1.00 1.16 O ATOM 591 OD2 ASP A 352 5.467 10.849 6.951 1.00 1.09 O ATOM 0 H ASP A 352 3.694 12.681 5.575 1.00 0.31 H new ATOM 0 HA ASP A 352 3.786 14.097 8.014 1.00 0.38 H new ATOM 0 HB2 ASP A 352 6.035 13.133 6.178 1.00 0.42 H new ATOM 0 HB3 ASP A 352 6.271 13.639 7.839 1.00 0.42 H new ATOM 596 N ALA A 353 4.956 15.777 5.444 1.00 0.40 N ATOM 597 CA ALA A 353 5.378 17.145 5.037 1.00 0.48 C ATOM 598 C ALA A 353 4.246 18.135 5.323 1.00 0.53 C ATOM 599 O ALA A 353 4.479 19.265 5.697 1.00 0.63 O ATOM 600 CB ALA A 353 5.698 17.152 3.542 1.00 0.48 C ATOM 0 H ALA A 353 4.863 15.106 4.682 1.00 0.40 H new ATOM 0 HA ALA A 353 6.264 17.437 5.601 1.00 0.48 H new ATOM 0 HB1 ALA A 353 6.007 18.153 3.241 1.00 0.48 H new ATOM 0 HB2 ALA A 353 6.504 16.447 3.339 1.00 0.48 H new ATOM 0 HB3 ALA A 353 4.811 16.862 2.979 1.00 0.48 H new ATOM 606 N GLN A 354 3.021 17.716 5.153 1.00 0.49 N ATOM 607 CA GLN A 354 1.878 18.633 5.419 1.00 0.57 C ATOM 608 C GLN A 354 1.565 18.632 6.917 1.00 0.62 C ATOM 609 O GLN A 354 0.810 19.449 7.406 1.00 0.77 O ATOM 610 CB GLN A 354 0.651 18.153 4.644 1.00 0.54 C ATOM 611 CG GLN A 354 -0.178 19.361 4.208 1.00 1.15 C ATOM 612 CD GLN A 354 -1.274 18.906 3.246 1.00 1.10 C ATOM 613 OE1 GLN A 354 -1.783 17.711 3.377 1.00 1.47 O flip ATOM 614 NE2 GLN A 354 -1.677 19.646 2.369 1.00 0.73 N flip ATOM 0 H GLN A 354 2.764 16.779 4.842 1.00 0.49 H new ATOM 0 HA GLN A 354 2.138 19.643 5.101 1.00 0.57 H new ATOM 0 HB2 GLN A 354 0.960 17.576 3.772 1.00 0.54 H new ATOM 0 HB3 GLN A 354 0.050 17.491 5.267 1.00 0.54 H new ATOM 0 HG2 GLN A 354 -0.621 19.845 5.078 1.00 1.15 H new ATOM 0 HG3 GLN A 354 0.462 20.099 3.724 1.00 1.15 H new ATOM 0 HE21 GLN A 354 -1.279 20.580 2.267 1.00 0.73 H new ATOM 0 HE22 GLN A 354 -2.413 19.333 1.736 1.00 0.73 H new ATOM 820 N GLU B 326 -16.024 8.556 -11.144 1.00 0.47 N ATOM 821 CA GLU B 326 -16.949 7.453 -10.757 1.00 0.45 C ATOM 822 C GLU B 326 -16.947 7.294 -9.237 1.00 0.39 C ATOM 823 O GLU B 326 -16.267 8.008 -8.529 1.00 0.38 O ATOM 824 CB GLU B 326 -16.486 6.143 -11.400 1.00 0.46 C ATOM 825 CG GLU B 326 -16.811 6.165 -12.894 1.00 0.51 C ATOM 826 CD GLU B 326 -18.326 6.267 -13.080 1.00 1.39 C ATOM 827 OE1 GLU B 326 -19.041 5.829 -12.196 1.00 2.13 O ATOM 828 OE2 GLU B 326 -18.744 6.783 -14.104 1.00 2.13 O ATOM 0 HA GLU B 326 -17.956 7.692 -11.100 1.00 0.45 H new ATOM 0 HB2 GLU B 326 -15.414 6.012 -11.252 1.00 0.46 H new ATOM 0 HB3 GLU B 326 -16.979 5.297 -10.922 1.00 0.46 H new ATOM 0 HG2 GLU B 326 -16.316 7.010 -13.373 1.00 0.51 H new ATOM 0 HG3 GLU B 326 -16.434 5.261 -13.373 1.00 0.51 H new ATOM 835 N TYR B 327 -17.700 6.357 -8.730 1.00 0.37 N ATOM 836 CA TYR B 327 -17.739 6.147 -7.258 1.00 0.32 C ATOM 837 C TYR B 327 -18.024 4.672 -6.977 1.00 0.29 C ATOM 838 O TYR B 327 -19.114 4.186 -7.205 1.00 0.30 O ATOM 839 CB TYR B 327 -18.839 7.014 -6.641 1.00 0.34 C ATOM 840 CG TYR B 327 -18.337 8.431 -6.499 1.00 0.37 C ATOM 841 CD1 TYR B 327 -18.446 9.318 -7.577 1.00 0.42 C ATOM 842 CD2 TYR B 327 -17.761 8.858 -5.295 1.00 0.36 C ATOM 843 CE1 TYR B 327 -17.978 10.632 -7.454 1.00 0.45 C ATOM 844 CE2 TYR B 327 -17.291 10.174 -5.171 1.00 0.40 C ATOM 845 CZ TYR B 327 -17.400 11.061 -6.252 1.00 0.44 C ATOM 846 OH TYR B 327 -16.937 12.355 -6.135 1.00 0.48 O ATOM 0 H TYR B 327 -18.290 5.727 -9.274 1.00 0.37 H new ATOM 0 HA TYR B 327 -16.781 6.427 -6.819 1.00 0.32 H new ATOM 0 HB2 TYR B 327 -19.730 6.993 -7.269 1.00 0.34 H new ATOM 0 HB3 TYR B 327 -19.126 6.618 -5.667 1.00 0.34 H new ATOM 0 HD1 TYR B 327 -18.891 8.988 -8.504 1.00 0.42 H new ATOM 0 HD2 TYR B 327 -17.679 8.174 -4.463 1.00 0.36 H new ATOM 0 HE1 TYR B 327 -18.063 11.315 -8.286 1.00 0.45 H new ATOM 0 HE2 TYR B 327 -16.846 10.504 -4.244 1.00 0.40 H new ATOM 0 HH TYR B 327 -16.567 12.490 -5.238 1.00 0.48 H new ATOM 856 N PHE B 328 -17.051 3.955 -6.489 1.00 0.26 N ATOM 857 CA PHE B 328 -17.262 2.510 -6.201 1.00 0.24 C ATOM 858 C PHE B 328 -17.226 2.276 -4.692 1.00 0.23 C ATOM 859 O PHE B 328 -17.274 3.202 -3.907 1.00 0.23 O ATOM 860 CB PHE B 328 -16.154 1.687 -6.859 1.00 0.23 C ATOM 861 CG PHE B 328 -16.189 1.899 -8.350 1.00 0.25 C ATOM 862 CD1 PHE B 328 -15.667 3.075 -8.907 1.00 0.25 C ATOM 863 CD2 PHE B 328 -16.743 0.916 -9.180 1.00 0.28 C ATOM 864 CE1 PHE B 328 -15.701 3.266 -10.294 1.00 0.28 C ATOM 865 CE2 PHE B 328 -16.777 1.109 -10.567 1.00 0.32 C ATOM 866 CZ PHE B 328 -16.257 2.283 -11.125 1.00 0.31 C ATOM 0 H PHE B 328 -16.118 4.308 -6.277 1.00 0.26 H new ATOM 0 HA PHE B 328 -18.231 2.206 -6.597 1.00 0.24 H new ATOM 0 HB2 PHE B 328 -15.183 1.982 -6.462 1.00 0.23 H new ATOM 0 HB3 PHE B 328 -16.285 0.630 -6.628 1.00 0.23 H new ATOM 0 HD1 PHE B 328 -15.239 3.833 -8.267 1.00 0.25 H new ATOM 0 HD2 PHE B 328 -17.144 0.010 -8.751 1.00 0.28 H new ATOM 0 HE1 PHE B 328 -15.299 4.171 -10.724 1.00 0.28 H new ATOM 0 HE2 PHE B 328 -17.205 0.351 -11.207 1.00 0.32 H new ATOM 0 HZ PHE B 328 -16.284 2.431 -12.194 1.00 0.31 H new ATOM 876 N THR B 329 -17.143 1.043 -4.282 1.00 0.22 N ATOM 877 CA THR B 329 -17.106 0.741 -2.826 1.00 0.21 C ATOM 878 C THR B 329 -16.349 -0.565 -2.605 1.00 0.21 C ATOM 879 O THR B 329 -16.141 -1.334 -3.522 1.00 0.23 O ATOM 880 CB THR B 329 -18.533 0.591 -2.303 1.00 0.22 C ATOM 881 OG1 THR B 329 -19.201 -0.414 -3.050 1.00 0.22 O ATOM 882 CG2 THR B 329 -19.274 1.919 -2.451 1.00 0.22 C ATOM 0 H THR B 329 -17.099 0.229 -4.895 1.00 0.22 H new ATOM 0 HA THR B 329 -16.606 1.552 -2.296 1.00 0.21 H new ATOM 0 HB THR B 329 -18.510 0.308 -1.251 1.00 0.22 H new ATOM 0 HG1 THR B 329 -20.117 -0.515 -2.717 1.00 0.22 H new ATOM 0 HG21 THR B 329 -20.292 1.811 -2.078 1.00 0.22 H new ATOM 0 HG22 THR B 329 -18.757 2.690 -1.879 1.00 0.22 H new ATOM 0 HG23 THR B 329 -19.302 2.205 -3.502 1.00 0.22 H new ATOM 890 N LEU B 330 -15.932 -0.826 -1.398 1.00 0.19 N ATOM 891 CA LEU B 330 -15.186 -2.087 -1.137 1.00 0.20 C ATOM 892 C LEU B 330 -15.440 -2.550 0.299 1.00 0.19 C ATOM 893 O LEU B 330 -15.334 -1.785 1.236 1.00 0.18 O ATOM 894 CB LEU B 330 -13.692 -1.832 -1.335 1.00 0.20 C ATOM 895 CG LEU B 330 -12.903 -3.090 -0.978 1.00 0.21 C ATOM 896 CD1 LEU B 330 -13.012 -4.101 -2.119 1.00 0.28 C ATOM 897 CD2 LEU B 330 -11.434 -2.722 -0.761 1.00 0.22 C ATOM 0 H LEU B 330 -16.074 -0.225 -0.586 1.00 0.19 H new ATOM 0 HA LEU B 330 -15.523 -2.861 -1.826 1.00 0.20 H new ATOM 0 HB2 LEU B 330 -13.496 -1.549 -2.369 1.00 0.20 H new ATOM 0 HB3 LEU B 330 -13.369 -0.999 -0.710 1.00 0.20 H new ATOM 0 HG LEU B 330 -13.308 -3.528 -0.066 1.00 0.21 H new ATOM 0 HD11 LEU B 330 -12.449 -4.999 -1.865 1.00 0.28 H new ATOM 0 HD12 LEU B 330 -14.059 -4.361 -2.276 1.00 0.28 H new ATOM 0 HD13 LEU B 330 -12.606 -3.665 -3.032 1.00 0.28 H new ATOM 0 HD21 LEU B 330 -10.868 -3.618 -0.506 1.00 0.22 H new ATOM 0 HD22 LEU B 330 -11.030 -2.285 -1.674 1.00 0.22 H new ATOM 0 HD23 LEU B 330 -11.356 -2.000 0.052 1.00 0.22 H new ATOM 909 N GLN B 331 -15.766 -3.802 0.477 1.00 0.20 N ATOM 910 CA GLN B 331 -16.017 -4.316 1.852 1.00 0.21 C ATOM 911 C GLN B 331 -14.687 -4.735 2.474 1.00 0.21 C ATOM 912 O GLN B 331 -14.022 -5.634 1.996 1.00 0.23 O ATOM 913 CB GLN B 331 -16.958 -5.522 1.787 1.00 0.23 C ATOM 914 CG GLN B 331 -17.378 -5.921 3.203 1.00 0.29 C ATOM 915 CD GLN B 331 -18.903 -5.917 3.297 1.00 0.43 C ATOM 916 OE1 GLN B 331 -19.579 -6.414 2.418 1.00 0.91 O ATOM 917 NE2 GLN B 331 -19.480 -5.373 4.332 1.00 0.28 N ATOM 0 H GLN B 331 -15.869 -4.489 -0.270 1.00 0.20 H new ATOM 0 HA GLN B 331 -16.479 -3.537 2.459 1.00 0.21 H new ATOM 0 HB2 GLN B 331 -17.837 -5.278 1.191 1.00 0.23 H new ATOM 0 HB3 GLN B 331 -16.461 -6.358 1.295 1.00 0.23 H new ATOM 0 HG2 GLN B 331 -16.990 -6.910 3.445 1.00 0.29 H new ATOM 0 HG3 GLN B 331 -16.956 -5.227 3.929 1.00 0.29 H new ATOM 0 HE21 GLN B 331 -18.914 -4.955 5.071 1.00 0.28 H new ATOM 0 HE22 GLN B 331 -20.497 -5.365 4.403 1.00 0.28 H new ATOM 926 N ILE B 332 -14.288 -4.090 3.532 1.00 0.21 N ATOM 927 CA ILE B 332 -12.996 -4.449 4.174 1.00 0.22 C ATOM 928 C ILE B 332 -13.262 -5.292 5.419 1.00 0.23 C ATOM 929 O ILE B 332 -13.661 -4.787 6.450 1.00 0.24 O ATOM 930 CB ILE B 332 -12.255 -3.172 4.569 1.00 0.21 C ATOM 931 CG1 ILE B 332 -11.993 -2.327 3.321 1.00 0.20 C ATOM 932 CG2 ILE B 332 -10.924 -3.534 5.222 1.00 0.24 C ATOM 933 CD1 ILE B 332 -11.472 -0.953 3.743 1.00 0.23 C ATOM 0 H ILE B 332 -14.800 -3.330 3.980 1.00 0.21 H new ATOM 0 HA ILE B 332 -12.387 -5.021 3.474 1.00 0.22 H new ATOM 0 HB ILE B 332 -12.864 -2.605 5.273 1.00 0.21 H new ATOM 0 HG12 ILE B 332 -11.266 -2.823 2.678 1.00 0.20 H new ATOM 0 HG13 ILE B 332 -12.910 -2.219 2.742 1.00 0.20 H new ATOM 0 HG21 ILE B 332 -10.397 -2.622 5.503 1.00 0.24 H new ATOM 0 HG22 ILE B 332 -11.107 -4.136 6.112 1.00 0.24 H new ATOM 0 HG23 ILE B 332 -10.316 -4.102 4.518 1.00 0.24 H new ATOM 0 HD11 ILE B 332 -11.284 -0.347 2.857 1.00 0.23 H new ATOM 0 HD12 ILE B 332 -12.215 -0.459 4.369 1.00 0.23 H new ATOM 0 HD13 ILE B 332 -10.545 -1.072 4.305 1.00 0.23 H new ATOM 945 N ARG B 333 -13.041 -6.575 5.335 1.00 0.25 N ATOM 946 CA ARG B 333 -13.276 -7.447 6.515 1.00 0.27 C ATOM 947 C ARG B 333 -12.196 -7.172 7.560 1.00 0.26 C ATOM 948 O ARG B 333 -11.085 -6.803 7.237 1.00 0.26 O ATOM 949 CB ARG B 333 -13.208 -8.918 6.097 1.00 0.32 C ATOM 950 CG ARG B 333 -14.372 -9.247 5.158 1.00 0.42 C ATOM 951 CD ARG B 333 -13.934 -9.054 3.703 1.00 0.70 C ATOM 952 NE ARG B 333 -14.544 -10.113 2.850 1.00 1.46 N ATOM 953 CZ ARG B 333 -14.582 -9.969 1.550 1.00 1.97 C ATOM 954 NH1 ARG B 333 -14.095 -8.891 0.995 1.00 2.17 N ATOM 955 NH2 ARG B 333 -15.106 -10.903 0.806 1.00 2.93 N ATOM 0 H ARG B 333 -12.708 -7.055 4.499 1.00 0.25 H new ATOM 0 HA ARG B 333 -14.262 -7.237 6.930 1.00 0.27 H new ATOM 0 HB2 ARG B 333 -12.260 -9.120 5.599 1.00 0.32 H new ATOM 0 HB3 ARG B 333 -13.248 -9.558 6.978 1.00 0.32 H new ATOM 0 HG2 ARG B 333 -14.699 -10.275 5.316 1.00 0.42 H new ATOM 0 HG3 ARG B 333 -15.223 -8.604 5.380 1.00 0.42 H new ATOM 0 HD2 ARG B 333 -14.238 -8.069 3.349 1.00 0.70 H new ATOM 0 HD3 ARG B 333 -12.847 -9.097 3.632 1.00 0.70 H new ATOM 0 HE ARG B 333 -14.933 -10.952 3.281 1.00 1.46 H new ATOM 0 HH11 ARG B 333 -13.684 -8.160 1.575 1.00 2.17 H new ATOM 0 HH12 ARG B 333 -14.126 -8.781 -0.019 1.00 2.17 H new ATOM 0 HH21 ARG B 333 -15.486 -11.745 1.237 1.00 2.93 H new ATOM 0 HH22 ARG B 333 -15.136 -10.791 -0.207 1.00 2.93 H new ATOM 969 N GLY B 334 -12.512 -7.347 8.811 1.00 0.29 N ATOM 970 CA GLY B 334 -11.500 -7.094 9.873 1.00 0.30 C ATOM 971 C GLY B 334 -11.368 -5.587 10.100 1.00 0.33 C ATOM 972 O GLY B 334 -11.137 -4.829 9.178 1.00 0.40 O ATOM 0 H GLY B 334 -13.426 -7.654 9.144 1.00 0.29 H new ATOM 0 HA2 GLY B 334 -11.797 -7.588 10.798 1.00 0.30 H new ATOM 0 HA3 GLY B 334 -10.538 -7.515 9.581 1.00 0.30 H new ATOM 976 N ARG B 335 -11.516 -5.149 11.319 1.00 0.30 N ATOM 977 CA ARG B 335 -11.407 -3.692 11.615 1.00 0.34 C ATOM 978 C ARG B 335 -9.935 -3.269 11.580 1.00 0.32 C ATOM 979 O ARG B 335 -9.601 -2.184 11.145 1.00 0.30 O ATOM 980 CB ARG B 335 -11.997 -3.422 13.007 1.00 0.39 C ATOM 981 CG ARG B 335 -11.495 -2.079 13.546 1.00 0.48 C ATOM 982 CD ARG B 335 -10.336 -2.320 14.517 1.00 0.93 C ATOM 983 NE ARG B 335 -10.571 -1.552 15.777 1.00 1.53 N ATOM 984 CZ ARG B 335 -9.866 -1.809 16.849 1.00 2.11 C ATOM 985 NH1 ARG B 335 -8.951 -2.739 16.822 1.00 2.43 N ATOM 986 NH2 ARG B 335 -10.073 -1.136 17.950 1.00 3.01 N ATOM 0 H ARG B 335 -11.709 -5.740 12.128 1.00 0.30 H new ATOM 0 HA ARG B 335 -11.956 -3.119 10.868 1.00 0.34 H new ATOM 0 HB2 ARG B 335 -13.086 -3.416 12.953 1.00 0.39 H new ATOM 0 HB3 ARG B 335 -11.716 -4.224 13.690 1.00 0.39 H new ATOM 0 HG2 ARG B 335 -11.168 -1.444 12.723 1.00 0.48 H new ATOM 0 HG3 ARG B 335 -12.304 -1.553 14.052 1.00 0.48 H new ATOM 0 HD2 ARG B 335 -10.249 -3.384 14.738 1.00 0.93 H new ATOM 0 HD3 ARG B 335 -9.396 -2.011 14.061 1.00 0.93 H new ATOM 0 HE ARG B 335 -11.285 -0.824 15.802 1.00 1.53 H new ATOM 0 HH11 ARG B 335 -8.785 -3.266 15.965 1.00 2.43 H new ATOM 0 HH12 ARG B 335 -8.402 -2.939 17.658 1.00 2.43 H new ATOM 0 HH21 ARG B 335 -10.786 -0.407 17.976 1.00 3.01 H new ATOM 0 HH22 ARG B 335 -9.521 -1.339 18.783 1.00 3.01 H new ATOM 1000 N GLU B 336 -9.057 -4.115 12.042 1.00 0.35 N ATOM 1001 CA GLU B 336 -7.606 -3.765 12.047 1.00 0.37 C ATOM 1002 C GLU B 336 -7.144 -3.424 10.631 1.00 0.38 C ATOM 1003 O GLU B 336 -6.634 -2.354 10.374 1.00 0.39 O ATOM 1004 CB GLU B 336 -6.796 -4.954 12.564 1.00 0.44 C ATOM 1005 CG GLU B 336 -7.203 -5.271 14.002 1.00 1.33 C ATOM 1006 CD GLU B 336 -6.913 -6.743 14.299 1.00 1.73 C ATOM 1007 OE1 GLU B 336 -6.966 -7.535 13.374 1.00 2.22 O ATOM 1008 OE2 GLU B 336 -6.644 -7.053 15.449 1.00 2.28 O ATOM 0 H GLU B 336 -9.281 -5.037 12.418 1.00 0.35 H new ATOM 0 HA GLU B 336 -7.453 -2.902 12.695 1.00 0.37 H new ATOM 0 HB2 GLU B 336 -6.964 -5.824 11.929 1.00 0.44 H new ATOM 0 HB3 GLU B 336 -5.731 -4.727 12.519 1.00 0.44 H new ATOM 0 HG2 GLU B 336 -6.655 -4.634 14.696 1.00 1.33 H new ATOM 0 HG3 GLU B 336 -8.263 -5.061 14.146 1.00 1.33 H new ATOM 1015 N ARG B 337 -7.311 -4.332 9.710 1.00 0.43 N ATOM 1016 CA ARG B 337 -6.875 -4.067 8.310 1.00 0.49 C ATOM 1017 C ARG B 337 -7.662 -2.884 7.734 1.00 0.40 C ATOM 1018 O ARG B 337 -7.180 -2.165 6.881 1.00 0.38 O ATOM 1019 CB ARG B 337 -7.130 -5.314 7.463 1.00 0.64 C ATOM 1020 CG ARG B 337 -6.324 -6.487 8.026 1.00 0.78 C ATOM 1021 CD ARG B 337 -4.835 -6.136 8.023 1.00 1.08 C ATOM 1022 NE ARG B 337 -4.028 -7.378 7.865 1.00 1.38 N ATOM 1023 CZ ARG B 337 -2.762 -7.300 7.549 1.00 2.18 C ATOM 1024 NH1 ARG B 337 -2.203 -6.134 7.365 1.00 2.72 N ATOM 1025 NH2 ARG B 337 -2.054 -8.385 7.414 1.00 2.93 N ATOM 0 H ARG B 337 -7.731 -5.248 9.867 1.00 0.43 H new ATOM 0 HA ARG B 337 -5.812 -3.825 8.299 1.00 0.49 H new ATOM 0 HB2 ARG B 337 -8.193 -5.556 7.463 1.00 0.64 H new ATOM 0 HB3 ARG B 337 -6.846 -5.128 6.427 1.00 0.64 H new ATOM 0 HG2 ARG B 337 -6.652 -6.713 9.040 1.00 0.78 H new ATOM 0 HG3 ARG B 337 -6.498 -7.381 7.428 1.00 0.78 H new ATOM 0 HD2 ARG B 337 -4.616 -5.443 7.211 1.00 1.08 H new ATOM 0 HD3 ARG B 337 -4.568 -5.633 8.952 1.00 1.08 H new ATOM 0 HE ARG B 337 -4.464 -8.290 8.003 1.00 1.38 H new ATOM 0 HH11 ARG B 337 -2.754 -5.282 7.468 1.00 2.72 H new ATOM 0 HH12 ARG B 337 -1.215 -6.075 7.118 1.00 2.72 H new ATOM 0 HH21 ARG B 337 -2.487 -9.298 7.555 1.00 2.93 H new ATOM 0 HH22 ARG B 337 -1.066 -8.322 7.167 1.00 2.93 H new ATOM 1039 N PHE B 338 -8.869 -2.682 8.187 1.00 0.37 N ATOM 1040 CA PHE B 338 -9.686 -1.550 7.659 1.00 0.33 C ATOM 1041 C PHE B 338 -8.937 -0.226 7.848 1.00 0.27 C ATOM 1042 O PHE B 338 -8.656 0.476 6.899 1.00 0.26 O ATOM 1043 CB PHE B 338 -11.019 -1.493 8.410 1.00 0.34 C ATOM 1044 CG PHE B 338 -11.738 -0.210 8.064 1.00 0.32 C ATOM 1045 CD1 PHE B 338 -12.609 -0.169 6.966 1.00 0.32 C ATOM 1046 CD2 PHE B 338 -11.533 0.939 8.839 1.00 0.34 C ATOM 1047 CE1 PHE B 338 -13.274 1.022 6.643 1.00 0.33 C ATOM 1048 CE2 PHE B 338 -12.198 2.130 8.515 1.00 0.36 C ATOM 1049 CZ PHE B 338 -13.068 2.172 7.417 1.00 0.34 C ATOM 0 H PHE B 338 -9.326 -3.251 8.900 1.00 0.37 H new ATOM 0 HA PHE B 338 -9.868 -1.707 6.596 1.00 0.33 H new ATOM 0 HB2 PHE B 338 -11.636 -2.351 8.143 1.00 0.34 H new ATOM 0 HB3 PHE B 338 -10.846 -1.547 9.485 1.00 0.34 H new ATOM 0 HD1 PHE B 338 -12.768 -1.055 6.369 1.00 0.32 H new ATOM 0 HD2 PHE B 338 -10.863 0.907 9.686 1.00 0.34 H new ATOM 0 HE1 PHE B 338 -13.945 1.053 5.798 1.00 0.33 H new ATOM 0 HE2 PHE B 338 -12.040 3.016 9.112 1.00 0.36 H new ATOM 0 HZ PHE B 338 -13.579 3.090 7.168 1.00 0.34 H new ATOM 1059 N GLU B 339 -8.625 0.125 9.065 1.00 0.26 N ATOM 1060 CA GLU B 339 -7.908 1.411 9.314 1.00 0.26 C ATOM 1061 C GLU B 339 -6.659 1.497 8.431 1.00 0.23 C ATOM 1062 O GLU B 339 -6.268 2.565 8.001 1.00 0.23 O ATOM 1063 CB GLU B 339 -7.493 1.486 10.784 1.00 0.32 C ATOM 1064 CG GLU B 339 -8.645 1.002 11.667 1.00 0.35 C ATOM 1065 CD GLU B 339 -8.581 1.705 13.024 1.00 1.18 C ATOM 1066 OE1 GLU B 339 -8.422 2.913 13.035 1.00 1.88 O ATOM 1067 OE2 GLU B 339 -8.690 1.021 14.028 1.00 1.98 O ATOM 0 H GLU B 339 -8.835 -0.422 9.900 1.00 0.26 H new ATOM 0 HA GLU B 339 -8.573 2.240 9.075 1.00 0.26 H new ATOM 0 HB2 GLU B 339 -6.608 0.873 10.954 1.00 0.32 H new ATOM 0 HB3 GLU B 339 -7.226 2.510 11.045 1.00 0.32 H new ATOM 0 HG2 GLU B 339 -9.599 1.209 11.183 1.00 0.35 H new ATOM 0 HG3 GLU B 339 -8.584 -0.078 11.802 1.00 0.35 H new ATOM 1074 N MET B 340 -6.024 0.390 8.162 1.00 0.22 N ATOM 1075 CA MET B 340 -4.797 0.425 7.314 1.00 0.21 C ATOM 1076 C MET B 340 -5.153 0.906 5.906 1.00 0.18 C ATOM 1077 O MET B 340 -4.519 1.788 5.362 1.00 0.18 O ATOM 1078 CB MET B 340 -4.187 -0.975 7.232 1.00 0.23 C ATOM 1079 CG MET B 340 -2.775 -0.880 6.645 1.00 0.27 C ATOM 1080 SD MET B 340 -2.041 -2.531 6.563 1.00 0.29 S ATOM 1081 CE MET B 340 -2.535 -2.917 4.865 1.00 0.32 C ATOM 0 H MET B 340 -6.300 -0.535 8.491 1.00 0.22 H new ATOM 0 HA MET B 340 -4.076 1.111 7.759 1.00 0.21 H new ATOM 0 HB2 MET B 340 -4.151 -1.427 8.223 1.00 0.23 H new ATOM 0 HB3 MET B 340 -4.809 -1.619 6.610 1.00 0.23 H new ATOM 0 HG2 MET B 340 -2.813 -0.438 5.649 1.00 0.27 H new ATOM 0 HG3 MET B 340 -2.157 -0.226 7.261 1.00 0.27 H new ATOM 0 HE1 MET B 340 -2.047 -3.837 4.544 1.00 0.32 H new ATOM 0 HE2 MET B 340 -3.616 -3.046 4.821 1.00 0.32 H new ATOM 0 HE3 MET B 340 -2.240 -2.101 4.206 1.00 0.32 H new ATOM 1091 N PHE B 341 -6.157 0.329 5.307 1.00 0.16 N ATOM 1092 CA PHE B 341 -6.543 0.750 3.929 1.00 0.14 C ATOM 1093 C PHE B 341 -6.976 2.219 3.931 1.00 0.15 C ATOM 1094 O PHE B 341 -6.602 2.986 3.066 1.00 0.15 O ATOM 1095 CB PHE B 341 -7.700 -0.118 3.433 1.00 0.14 C ATOM 1096 CG PHE B 341 -7.165 -1.439 2.935 1.00 0.15 C ATOM 1097 CD1 PHE B 341 -6.429 -1.487 1.746 1.00 0.18 C ATOM 1098 CD2 PHE B 341 -7.406 -2.614 3.659 1.00 0.16 C ATOM 1099 CE1 PHE B 341 -5.929 -2.709 1.280 1.00 0.18 C ATOM 1100 CE2 PHE B 341 -6.907 -3.838 3.192 1.00 0.18 C ATOM 1101 CZ PHE B 341 -6.168 -3.884 2.002 1.00 0.17 C ATOM 0 H PHE B 341 -6.727 -0.415 5.710 1.00 0.16 H new ATOM 0 HA PHE B 341 -5.684 0.630 3.268 1.00 0.14 H new ATOM 0 HB2 PHE B 341 -8.415 -0.284 4.239 1.00 0.14 H new ATOM 0 HB3 PHE B 341 -8.235 0.394 2.633 1.00 0.14 H new ATOM 0 HD1 PHE B 341 -6.246 -0.581 1.187 1.00 0.18 H new ATOM 0 HD2 PHE B 341 -7.976 -2.577 4.576 1.00 0.16 H new ATOM 0 HE1 PHE B 341 -5.359 -2.745 0.363 1.00 0.18 H new ATOM 0 HE2 PHE B 341 -7.092 -4.745 3.749 1.00 0.18 H new ATOM 0 HZ PHE B 341 -5.783 -4.827 1.642 1.00 0.17 H new ATOM 1111 N ARG B 342 -7.764 2.613 4.889 1.00 0.17 N ATOM 1112 CA ARG B 342 -8.230 4.027 4.944 1.00 0.19 C ATOM 1113 C ARG B 342 -7.041 4.979 4.791 1.00 0.18 C ATOM 1114 O ARG B 342 -7.104 5.955 4.067 1.00 0.19 O ATOM 1115 CB ARG B 342 -8.904 4.282 6.292 1.00 0.23 C ATOM 1116 CG ARG B 342 -9.681 5.597 6.239 1.00 0.32 C ATOM 1117 CD ARG B 342 -10.890 5.512 7.167 1.00 0.61 C ATOM 1118 NE ARG B 342 -10.962 6.751 8.004 1.00 1.13 N ATOM 1119 CZ ARG B 342 -9.914 7.193 8.655 1.00 1.74 C ATOM 1120 NH1 ARG B 342 -8.834 6.462 8.756 1.00 2.34 N ATOM 1121 NH2 ARG B 342 -9.971 8.353 9.253 1.00 2.42 N ATOM 0 H ARG B 342 -8.108 2.015 5.640 1.00 0.17 H new ATOM 0 HA ARG B 342 -8.936 4.202 4.132 1.00 0.19 H new ATOM 0 HB2 ARG B 342 -9.578 3.460 6.534 1.00 0.23 H new ATOM 0 HB3 ARG B 342 -8.154 4.323 7.082 1.00 0.23 H new ATOM 0 HG2 ARG B 342 -9.037 6.424 6.538 1.00 0.32 H new ATOM 0 HG3 ARG B 342 -10.006 5.799 5.218 1.00 0.32 H new ATOM 0 HD2 ARG B 342 -11.804 5.401 6.583 1.00 0.61 H new ATOM 0 HD3 ARG B 342 -10.811 4.632 7.806 1.00 0.61 H new ATOM 0 HE ARG B 342 -11.843 7.261 8.069 1.00 1.13 H new ATOM 0 HH11 ARG B 342 -8.802 5.538 8.326 1.00 2.34 H new ATOM 0 HH12 ARG B 342 -8.024 6.816 9.265 1.00 2.34 H new ATOM 0 HH21 ARG B 342 -10.826 8.907 9.211 1.00 2.42 H new ATOM 0 HH22 ARG B 342 -9.160 8.705 9.762 1.00 2.42 H new ATOM 1135 N GLU B 343 -5.963 4.713 5.473 1.00 0.19 N ATOM 1136 CA GLU B 343 -4.778 5.613 5.374 1.00 0.21 C ATOM 1137 C GLU B 343 -4.314 5.706 3.918 1.00 0.16 C ATOM 1138 O GLU B 343 -4.064 6.779 3.406 1.00 0.15 O ATOM 1139 CB GLU B 343 -3.642 5.059 6.238 1.00 0.25 C ATOM 1140 CG GLU B 343 -2.350 5.812 5.916 1.00 0.53 C ATOM 1141 CD GLU B 343 -1.547 6.035 7.199 1.00 1.47 C ATOM 1142 OE1 GLU B 343 -1.209 5.054 7.841 1.00 2.11 O ATOM 1143 OE2 GLU B 343 -1.282 7.182 7.518 1.00 2.35 O ATOM 0 H GLU B 343 -5.850 3.912 6.095 1.00 0.19 H new ATOM 0 HA GLU B 343 -5.053 6.607 5.726 1.00 0.21 H new ATOM 0 HB2 GLU B 343 -3.887 5.168 7.295 1.00 0.25 H new ATOM 0 HB3 GLU B 343 -3.512 3.993 6.049 1.00 0.25 H new ATOM 0 HG2 GLU B 343 -1.757 5.245 5.199 1.00 0.53 H new ATOM 0 HG3 GLU B 343 -2.583 6.770 5.451 1.00 0.53 H new ATOM 1150 N LEU B 344 -4.193 4.591 3.250 1.00 0.15 N ATOM 1151 CA LEU B 344 -3.741 4.615 1.828 1.00 0.13 C ATOM 1152 C LEU B 344 -4.745 5.392 0.974 1.00 0.13 C ATOM 1153 O LEU B 344 -4.388 6.018 -0.003 1.00 0.14 O ATOM 1154 CB LEU B 344 -3.638 3.182 1.302 1.00 0.15 C ATOM 1155 CG LEU B 344 -2.388 2.516 1.874 1.00 0.14 C ATOM 1156 CD1 LEU B 344 -2.467 1.008 1.644 1.00 0.17 C ATOM 1157 CD2 LEU B 344 -1.147 3.073 1.173 1.00 0.18 C ATOM 0 H LEU B 344 -4.388 3.663 3.627 1.00 0.15 H new ATOM 0 HA LEU B 344 -2.767 5.101 1.772 1.00 0.13 H new ATOM 0 HB2 LEU B 344 -4.526 2.616 1.584 1.00 0.15 H new ATOM 0 HB3 LEU B 344 -3.595 3.186 0.213 1.00 0.15 H new ATOM 0 HG LEU B 344 -2.324 2.720 2.943 1.00 0.14 H new ATOM 0 HD11 LEU B 344 -1.576 0.531 2.051 1.00 0.17 H new ATOM 0 HD12 LEU B 344 -3.351 0.610 2.141 1.00 0.17 H new ATOM 0 HD13 LEU B 344 -2.530 0.806 0.575 1.00 0.17 H new ATOM 0 HD21 LEU B 344 -0.255 2.598 1.581 1.00 0.18 H new ATOM 0 HD22 LEU B 344 -1.210 2.869 0.104 1.00 0.18 H new ATOM 0 HD23 LEU B 344 -1.091 4.150 1.334 1.00 0.18 H new ATOM 1169 N ASN B 345 -5.999 5.350 1.329 1.00 0.16 N ATOM 1170 CA ASN B 345 -7.026 6.080 0.534 1.00 0.19 C ATOM 1171 C ASN B 345 -6.670 7.565 0.465 1.00 0.17 C ATOM 1172 O ASN B 345 -6.468 8.118 -0.599 1.00 0.17 O ATOM 1173 CB ASN B 345 -8.390 5.917 1.202 1.00 0.26 C ATOM 1174 CG ASN B 345 -9.436 6.722 0.433 1.00 0.30 C ATOM 1175 OD1 ASN B 345 -9.466 7.935 0.510 1.00 1.09 O ATOM 1176 ND2 ASN B 345 -10.301 6.094 -0.314 1.00 0.68 N ATOM 0 H ASN B 345 -6.358 4.841 2.137 1.00 0.16 H new ATOM 0 HA ASN B 345 -7.058 5.671 -0.476 1.00 0.19 H new ATOM 0 HB2 ASN B 345 -8.671 4.864 1.225 1.00 0.26 H new ATOM 0 HB3 ASN B 345 -8.343 6.257 2.236 1.00 0.26 H new ATOM 0 HD21 ASN B 345 -11.003 6.620 -0.834 1.00 0.68 H new ATOM 0 HD22 ASN B 345 -10.275 5.076 -0.378 1.00 0.68 H new ATOM 1183 N GLU B 346 -6.596 8.216 1.591 1.00 0.17 N ATOM 1184 CA GLU B 346 -6.261 9.667 1.592 1.00 0.16 C ATOM 1185 C GLU B 346 -4.874 9.879 0.981 1.00 0.14 C ATOM 1186 O GLU B 346 -4.563 10.940 0.482 1.00 0.15 O ATOM 1187 CB GLU B 346 -6.267 10.191 3.030 1.00 0.20 C ATOM 1188 CG GLU B 346 -6.216 11.721 3.018 1.00 0.23 C ATOM 1189 CD GLU B 346 -7.201 12.274 4.052 1.00 0.89 C ATOM 1190 OE1 GLU B 346 -7.137 11.843 5.191 1.00 1.66 O ATOM 1191 OE2 GLU B 346 -8.000 13.121 3.685 1.00 1.55 O ATOM 0 H GLU B 346 -6.753 7.806 2.512 1.00 0.17 H new ATOM 0 HA GLU B 346 -7.002 10.207 1.002 1.00 0.16 H new ATOM 0 HB2 GLU B 346 -7.164 9.851 3.548 1.00 0.20 H new ATOM 0 HB3 GLU B 346 -5.412 9.793 3.577 1.00 0.20 H new ATOM 0 HG2 GLU B 346 -5.206 12.063 3.243 1.00 0.23 H new ATOM 0 HG3 GLU B 346 -6.466 12.096 2.025 1.00 0.23 H new ATOM 1198 N ALA B 347 -4.036 8.883 1.023 1.00 0.13 N ATOM 1199 CA ALA B 347 -2.668 9.032 0.450 1.00 0.14 C ATOM 1200 C ALA B 347 -2.758 9.359 -1.044 1.00 0.15 C ATOM 1201 O ALA B 347 -2.312 10.397 -1.489 1.00 0.17 O ATOM 1202 CB ALA B 347 -1.890 7.727 0.640 1.00 0.15 C ATOM 0 H ALA B 347 -4.238 7.970 1.430 1.00 0.13 H new ATOM 0 HA ALA B 347 -2.153 9.844 0.963 1.00 0.14 H new ATOM 0 HB1 ALA B 347 -0.890 7.836 0.221 1.00 0.15 H new ATOM 0 HB2 ALA B 347 -1.815 7.499 1.703 1.00 0.15 H new ATOM 0 HB3 ALA B 347 -2.410 6.916 0.131 1.00 0.15 H new ATOM 1208 N LEU B 348 -3.322 8.475 -1.823 1.00 0.16 N ATOM 1209 CA LEU B 348 -3.428 8.730 -3.290 1.00 0.20 C ATOM 1210 C LEU B 348 -4.268 9.986 -3.542 1.00 0.20 C ATOM 1211 O LEU B 348 -3.895 10.847 -4.313 1.00 0.22 O ATOM 1212 CB LEU B 348 -4.103 7.534 -3.972 1.00 0.23 C ATOM 1213 CG LEU B 348 -3.112 6.373 -4.094 1.00 0.25 C ATOM 1214 CD1 LEU B 348 -1.811 6.863 -4.730 1.00 0.29 C ATOM 1215 CD2 LEU B 348 -2.817 5.811 -2.703 1.00 0.21 C ATOM 0 H LEU B 348 -3.714 7.588 -1.508 1.00 0.16 H new ATOM 0 HA LEU B 348 -2.427 8.873 -3.697 1.00 0.20 H new ATOM 0 HB2 LEU B 348 -4.974 7.221 -3.396 1.00 0.23 H new ATOM 0 HB3 LEU B 348 -4.461 7.823 -4.960 1.00 0.23 H new ATOM 0 HG LEU B 348 -3.546 5.595 -4.722 1.00 0.25 H new ATOM 0 HD11 LEU B 348 -1.111 6.032 -4.813 1.00 0.29 H new ATOM 0 HD12 LEU B 348 -2.019 7.263 -5.722 1.00 0.29 H new ATOM 0 HD13 LEU B 348 -1.374 7.644 -4.108 1.00 0.29 H new ATOM 0 HD21 LEU B 348 -2.112 4.984 -2.787 1.00 0.21 H new ATOM 0 HD22 LEU B 348 -2.386 6.594 -2.078 1.00 0.21 H new ATOM 0 HD23 LEU B 348 -3.742 5.454 -2.251 1.00 0.21 H new ATOM 1227 N GLU B 349 -5.403 10.093 -2.908 1.00 0.19 N ATOM 1228 CA GLU B 349 -6.268 11.287 -3.125 1.00 0.20 C ATOM 1229 C GLU B 349 -5.479 12.562 -2.819 1.00 0.19 C ATOM 1230 O GLU B 349 -5.716 13.602 -3.398 1.00 0.21 O ATOM 1231 CB GLU B 349 -7.486 11.201 -2.202 1.00 0.22 C ATOM 1232 CG GLU B 349 -8.450 10.139 -2.735 1.00 0.27 C ATOM 1233 CD GLU B 349 -9.579 10.816 -3.516 1.00 1.21 C ATOM 1234 OE1 GLU B 349 -9.283 11.453 -4.514 1.00 1.95 O ATOM 1235 OE2 GLU B 349 -10.719 10.683 -3.104 1.00 1.90 O ATOM 0 H GLU B 349 -5.769 9.406 -2.249 1.00 0.19 H new ATOM 0 HA GLU B 349 -6.597 11.314 -4.164 1.00 0.20 H new ATOM 0 HB2 GLU B 349 -7.172 10.948 -1.189 1.00 0.22 H new ATOM 0 HB3 GLU B 349 -7.986 12.168 -2.149 1.00 0.22 H new ATOM 0 HG2 GLU B 349 -7.917 9.440 -3.379 1.00 0.27 H new ATOM 0 HG3 GLU B 349 -8.862 9.560 -1.909 1.00 0.27 H new ATOM 1242 N LEU B 350 -4.541 12.492 -1.917 1.00 0.20 N ATOM 1243 CA LEU B 350 -3.743 13.704 -1.584 1.00 0.23 C ATOM 1244 C LEU B 350 -2.920 14.119 -2.804 1.00 0.24 C ATOM 1245 O LEU B 350 -2.868 15.277 -3.166 1.00 0.29 O ATOM 1246 CB LEU B 350 -2.806 13.401 -0.413 1.00 0.26 C ATOM 1247 CG LEU B 350 -2.387 14.711 0.255 1.00 0.31 C ATOM 1248 CD1 LEU B 350 -1.592 14.404 1.523 1.00 0.45 C ATOM 1249 CD2 LEU B 350 -1.516 15.524 -0.705 1.00 0.40 C ATOM 0 H LEU B 350 -4.293 11.650 -1.397 1.00 0.20 H new ATOM 0 HA LEU B 350 -4.416 14.515 -1.304 1.00 0.23 H new ATOM 0 HB2 LEU B 350 -3.306 12.755 0.309 1.00 0.26 H new ATOM 0 HB3 LEU B 350 -1.927 12.863 -0.767 1.00 0.26 H new ATOM 0 HG LEU B 350 -3.277 15.286 0.511 1.00 0.31 H new ATOM 0 HD11 LEU B 350 -1.293 15.337 2.000 1.00 0.45 H new ATOM 0 HD12 LEU B 350 -2.211 13.828 2.210 1.00 0.45 H new ATOM 0 HD13 LEU B 350 -0.704 13.828 1.265 1.00 0.45 H new ATOM 0 HD21 LEU B 350 -1.219 16.457 -0.226 1.00 0.40 H new ATOM 0 HD22 LEU B 350 -0.626 14.950 -0.964 1.00 0.40 H new ATOM 0 HD23 LEU B 350 -2.081 15.745 -1.610 1.00 0.40 H new ATOM 1261 N LYS B 351 -2.275 13.181 -3.442 1.00 0.23 N ATOM 1262 CA LYS B 351 -1.454 13.523 -4.637 1.00 0.26 C ATOM 1263 C LYS B 351 -2.341 14.166 -5.703 1.00 0.28 C ATOM 1264 O LYS B 351 -2.038 15.222 -6.222 1.00 0.35 O ATOM 1265 CB LYS B 351 -0.819 12.250 -5.206 1.00 0.26 C ATOM 1266 CG LYS B 351 0.145 12.619 -6.336 1.00 0.29 C ATOM 1267 CD LYS B 351 0.811 11.348 -6.863 1.00 0.30 C ATOM 1268 CE LYS B 351 2.248 11.656 -7.287 1.00 0.34 C ATOM 1269 NZ LYS B 351 2.738 10.571 -8.182 1.00 1.38 N ATOM 0 H LYS B 351 -2.281 12.193 -3.187 1.00 0.23 H new ATOM 0 HA LYS B 351 -0.670 14.222 -4.346 1.00 0.26 H new ATOM 0 HB2 LYS B 351 -0.286 11.714 -4.420 1.00 0.26 H new ATOM 0 HB3 LYS B 351 -1.594 11.580 -5.579 1.00 0.26 H new ATOM 0 HG2 LYS B 351 -0.393 13.122 -7.139 1.00 0.29 H new ATOM 0 HG3 LYS B 351 0.900 13.316 -5.973 1.00 0.29 H new ATOM 0 HD2 LYS B 351 0.806 10.577 -6.092 1.00 0.30 H new ATOM 0 HD3 LYS B 351 0.248 10.955 -7.710 1.00 0.30 H new ATOM 0 HE2 LYS B 351 2.290 12.616 -7.802 1.00 0.34 H new ATOM 0 HE3 LYS B 351 2.889 11.737 -6.409 1.00 0.34 H new ATOM 0 HZ1 LYS B 351 3.751 10.411 -8.011 1.00 1.38 H new ATOM 0 HZ2 LYS B 351 2.212 9.696 -7.987 1.00 1.38 H new ATOM 0 HZ3 LYS B 351 2.594 10.848 -9.174 1.00 1.38 H new ATOM 1283 N ASP B 352 -3.432 13.535 -6.040 1.00 0.29 N ATOM 1284 CA ASP B 352 -4.335 14.108 -7.077 1.00 0.36 C ATOM 1285 C ASP B 352 -4.741 15.528 -6.681 1.00 0.40 C ATOM 1286 O ASP B 352 -4.862 16.406 -7.514 1.00 0.47 O ATOM 1287 CB ASP B 352 -5.587 13.240 -7.195 1.00 0.40 C ATOM 1288 CG ASP B 352 -5.205 11.857 -7.726 1.00 0.43 C ATOM 1289 OD1 ASP B 352 -4.563 11.799 -8.762 1.00 1.16 O ATOM 1290 OD2 ASP B 352 -5.563 10.881 -7.090 1.00 1.08 O ATOM 0 H ASP B 352 -3.737 12.647 -5.642 1.00 0.29 H new ATOM 0 HA ASP B 352 -3.813 14.134 -8.034 1.00 0.36 H new ATOM 0 HB2 ASP B 352 -6.070 13.146 -6.222 1.00 0.40 H new ATOM 0 HB3 ASP B 352 -6.307 13.711 -7.864 1.00 0.40 H new ATOM 1295 N ALA B 353 -4.957 15.758 -5.416 1.00 0.38 N ATOM 1296 CA ALA B 353 -5.365 17.119 -4.964 1.00 0.46 C ATOM 1297 C ALA B 353 -4.222 18.101 -5.215 1.00 0.51 C ATOM 1298 O ALA B 353 -4.437 19.253 -5.539 1.00 0.61 O ATOM 1299 CB ALA B 353 -5.688 17.083 -3.469 1.00 0.46 C ATOM 0 H ALA B 353 -4.869 15.063 -4.675 1.00 0.38 H new ATOM 0 HA ALA B 353 -6.247 17.438 -5.519 1.00 0.46 H new ATOM 0 HB1 ALA B 353 -5.986 18.077 -3.137 1.00 0.46 H new ATOM 0 HB2 ALA B 353 -6.502 16.381 -3.289 1.00 0.46 H new ATOM 0 HB3 ALA B 353 -4.806 16.765 -2.914 1.00 0.46 H new ATOM 1305 N GLN B 354 -3.005 17.656 -5.070 1.00 0.47 N ATOM 1306 CA GLN B 354 -1.849 18.562 -5.305 1.00 0.55 C ATOM 1307 C GLN B 354 -1.538 18.604 -6.803 1.00 0.60 C ATOM 1308 O GLN B 354 -0.779 19.432 -7.267 1.00 0.75 O ATOM 1309 CB GLN B 354 -0.630 18.033 -4.545 1.00 0.52 C ATOM 1310 CG GLN B 354 0.249 19.207 -4.094 1.00 1.14 C ATOM 1311 CD GLN B 354 1.351 18.699 -3.160 1.00 1.08 C ATOM 1312 OE1 GLN B 354 1.830 17.498 -3.326 1.00 1.45 O flip ATOM 1313 NE2 GLN B 354 1.783 19.406 -2.271 1.00 0.72 N flip ATOM 0 H GLN B 354 -2.762 16.703 -4.799 1.00 0.47 H new ATOM 0 HA GLN B 354 -2.090 19.566 -4.954 1.00 0.55 H new ATOM 0 HB2 GLN B 354 -0.952 17.454 -3.679 1.00 0.52 H new ATOM 0 HB3 GLN B 354 -0.056 17.360 -5.182 1.00 0.52 H new ATOM 0 HG2 GLN B 354 0.692 19.697 -4.962 1.00 1.14 H new ATOM 0 HG3 GLN B 354 -0.359 19.953 -3.583 1.00 1.14 H new ATOM 0 HE21 GLN B 354 1.409 20.346 -2.140 1.00 0.72 H new ATOM 0 HE22 GLN B 354 2.519 19.059 -1.656 1.00 0.72 H new ATOM 1519 N GLU C 326 15.209 -8.553 -11.932 1.00 0.49 N ATOM 1520 CA GLU C 326 15.821 -7.225 -11.663 1.00 0.44 C ATOM 1521 C GLU C 326 15.987 -7.051 -10.154 1.00 0.38 C ATOM 1522 O GLU C 326 15.373 -7.748 -9.370 1.00 0.37 O ATOM 1523 CB GLU C 326 14.919 -6.117 -12.206 1.00 0.47 C ATOM 1524 CG GLU C 326 14.638 -6.367 -13.689 1.00 0.53 C ATOM 1525 CD GLU C 326 15.607 -5.545 -14.540 1.00 1.38 C ATOM 1526 OE1 GLU C 326 16.674 -6.053 -14.842 1.00 2.13 O ATOM 1527 OE2 GLU C 326 15.266 -4.423 -14.876 1.00 2.17 O ATOM 0 HA GLU C 326 16.792 -7.166 -12.154 1.00 0.44 H new ATOM 0 HB2 GLU C 326 13.983 -6.089 -11.648 1.00 0.47 H new ATOM 0 HB3 GLU C 326 15.398 -5.147 -12.074 1.00 0.47 H new ATOM 0 HG2 GLU C 326 14.748 -7.427 -13.917 1.00 0.53 H new ATOM 0 HG3 GLU C 326 13.609 -6.095 -13.926 1.00 0.53 H new ATOM 1534 N TYR C 327 16.811 -6.133 -9.739 1.00 0.36 N ATOM 1535 CA TYR C 327 17.015 -5.920 -8.281 1.00 0.32 C ATOM 1536 C TYR C 327 17.282 -4.436 -8.028 1.00 0.29 C ATOM 1537 O TYR C 327 18.373 -3.944 -8.234 1.00 0.31 O ATOM 1538 CB TYR C 327 18.209 -6.753 -7.812 1.00 0.35 C ATOM 1539 CG TYR C 327 17.773 -8.189 -7.621 1.00 0.37 C ATOM 1540 CD1 TYR C 327 17.114 -8.565 -6.444 1.00 0.36 C ATOM 1541 CD2 TYR C 327 18.022 -9.143 -8.621 1.00 0.42 C ATOM 1542 CE1 TYR C 327 16.706 -9.893 -6.263 1.00 0.40 C ATOM 1543 CE2 TYR C 327 17.612 -10.470 -8.438 1.00 0.45 C ATOM 1544 CZ TYR C 327 16.954 -10.845 -7.260 1.00 0.44 C ATOM 1545 OH TYR C 327 16.552 -12.152 -7.079 1.00 0.48 O ATOM 0 H TYR C 327 17.353 -5.520 -10.347 1.00 0.36 H new ATOM 0 HA TYR C 327 16.127 -6.227 -7.729 1.00 0.32 H new ATOM 0 HB2 TYR C 327 19.014 -6.700 -8.545 1.00 0.35 H new ATOM 0 HB3 TYR C 327 18.602 -6.353 -6.877 1.00 0.35 H new ATOM 0 HD1 TYR C 327 16.920 -7.831 -5.676 1.00 0.36 H new ATOM 0 HD2 TYR C 327 18.529 -8.854 -9.530 1.00 0.42 H new ATOM 0 HE1 TYR C 327 16.200 -10.183 -5.354 1.00 0.40 H new ATOM 0 HE2 TYR C 327 17.804 -11.205 -9.206 1.00 0.45 H new ATOM 0 HH TYR C 327 16.799 -12.682 -7.865 1.00 0.48 H new ATOM 1555 N PHE C 328 16.286 -3.716 -7.591 1.00 0.26 N ATOM 1556 CA PHE C 328 16.466 -2.260 -7.333 1.00 0.24 C ATOM 1557 C PHE C 328 16.591 -2.014 -5.827 1.00 0.23 C ATOM 1558 O PHE C 328 16.785 -2.927 -5.051 1.00 0.24 O ATOM 1559 CB PHE C 328 15.252 -1.499 -7.876 1.00 0.23 C ATOM 1560 CG PHE C 328 15.137 -1.721 -9.366 1.00 0.25 C ATOM 1561 CD1 PHE C 328 14.458 -2.844 -9.858 1.00 0.26 C ATOM 1562 CD2 PHE C 328 15.705 -0.800 -10.257 1.00 0.29 C ATOM 1563 CE1 PHE C 328 14.349 -3.048 -11.242 1.00 0.29 C ATOM 1564 CE2 PHE C 328 15.596 -1.004 -11.639 1.00 0.33 C ATOM 1565 CZ PHE C 328 14.918 -2.129 -12.132 1.00 0.32 C ATOM 0 H PHE C 328 15.351 -4.076 -7.401 1.00 0.26 H new ATOM 0 HA PHE C 328 17.372 -1.911 -7.830 1.00 0.24 H new ATOM 0 HB2 PHE C 328 14.345 -1.839 -7.377 1.00 0.23 H new ATOM 0 HB3 PHE C 328 15.353 -0.435 -7.664 1.00 0.23 H new ATOM 0 HD1 PHE C 328 14.018 -3.553 -9.172 1.00 0.26 H new ATOM 0 HD2 PHE C 328 16.227 0.067 -9.878 1.00 0.29 H new ATOM 0 HE1 PHE C 328 13.826 -3.914 -11.621 1.00 0.29 H new ATOM 0 HE2 PHE C 328 16.034 -0.295 -12.325 1.00 0.33 H new ATOM 0 HZ PHE C 328 14.835 -2.286 -13.197 1.00 0.32 H new ATOM 1575 N THR C 329 16.481 -0.781 -5.413 1.00 0.22 N ATOM 1576 CA THR C 329 16.594 -0.460 -3.963 1.00 0.21 C ATOM 1577 C THR C 329 15.799 0.816 -3.671 1.00 0.20 C ATOM 1578 O THR C 329 15.480 1.576 -4.564 1.00 0.22 O ATOM 1579 CB THR C 329 18.067 -0.249 -3.600 1.00 0.21 C ATOM 1580 OG1 THR C 329 18.656 0.665 -4.518 1.00 0.23 O ATOM 1581 CG2 THR C 329 18.801 -1.590 -3.666 1.00 0.22 C ATOM 0 H THR C 329 16.317 0.022 -6.021 1.00 0.22 H new ATOM 0 HA THR C 329 16.195 -1.282 -3.369 1.00 0.21 H new ATOM 0 HB THR C 329 18.141 0.157 -2.591 1.00 0.21 H new ATOM 0 HG1 THR C 329 19.598 0.801 -4.285 1.00 0.23 H new ATOM 0 HG21 THR C 329 19.850 -1.444 -3.408 1.00 0.22 H new ATOM 0 HG22 THR C 329 18.348 -2.288 -2.962 1.00 0.22 H new ATOM 0 HG23 THR C 329 18.729 -1.995 -4.675 1.00 0.22 H new ATOM 1589 N LEU C 330 15.469 1.054 -2.433 1.00 0.19 N ATOM 1590 CA LEU C 330 14.686 2.277 -2.098 1.00 0.19 C ATOM 1591 C LEU C 330 15.043 2.741 -0.684 1.00 0.19 C ATOM 1592 O LEU C 330 15.092 1.958 0.245 1.00 0.18 O ATOM 1593 CB LEU C 330 13.190 1.958 -2.170 1.00 0.19 C ATOM 1594 CG LEU C 330 12.383 3.161 -1.678 1.00 0.20 C ATOM 1595 CD1 LEU C 330 12.342 4.234 -2.769 1.00 0.28 C ATOM 1596 CD2 LEU C 330 10.957 2.719 -1.350 1.00 0.22 C ATOM 0 H LEU C 330 15.706 0.457 -1.640 1.00 0.19 H new ATOM 0 HA LEU C 330 14.924 3.068 -2.809 1.00 0.19 H new ATOM 0 HB2 LEU C 330 12.909 1.714 -3.194 1.00 0.19 H new ATOM 0 HB3 LEU C 330 12.965 1.083 -1.560 1.00 0.19 H new ATOM 0 HG LEU C 330 12.854 3.569 -0.784 1.00 0.20 H new ATOM 0 HD11 LEU C 330 11.767 5.090 -2.416 1.00 0.28 H new ATOM 0 HD12 LEU C 330 13.358 4.552 -3.005 1.00 0.28 H new ATOM 0 HD13 LEU C 330 11.873 3.825 -3.664 1.00 0.28 H new ATOM 0 HD21 LEU C 330 10.382 3.576 -0.999 1.00 0.22 H new ATOM 0 HD22 LEU C 330 10.488 2.309 -2.245 1.00 0.22 H new ATOM 0 HD23 LEU C 330 10.982 1.956 -0.572 1.00 0.22 H new ATOM 1608 N GLN C 331 15.289 4.011 -0.515 1.00 0.20 N ATOM 1609 CA GLN C 331 15.638 4.529 0.836 1.00 0.20 C ATOM 1610 C GLN C 331 14.355 4.887 1.589 1.00 0.21 C ATOM 1611 O GLN C 331 13.618 5.769 1.195 1.00 0.23 O ATOM 1612 CB GLN C 331 16.507 5.776 0.687 1.00 0.23 C ATOM 1613 CG GLN C 331 16.933 6.266 2.071 1.00 0.27 C ATOM 1614 CD GLN C 331 18.458 6.378 2.130 1.00 0.75 C ATOM 1615 OE1 GLN C 331 19.036 7.277 1.551 1.00 1.48 O ATOM 1616 NE2 GLN C 331 19.141 5.494 2.808 1.00 0.72 N ATOM 0 H GLN C 331 15.263 4.712 -1.255 1.00 0.20 H new ATOM 0 HA GLN C 331 16.184 3.767 1.392 1.00 0.20 H new ATOM 0 HB2 GLN C 331 17.386 5.550 0.083 1.00 0.23 H new ATOM 0 HB3 GLN C 331 15.954 6.558 0.166 1.00 0.23 H new ATOM 0 HG2 GLN C 331 16.479 7.235 2.280 1.00 0.27 H new ATOM 0 HG3 GLN C 331 16.579 5.576 2.837 1.00 0.27 H new ATOM 0 HE21 GLN C 331 18.657 4.739 3.294 1.00 0.72 H new ATOM 0 HE22 GLN C 331 20.158 5.559 2.851 1.00 0.72 H new ATOM 1625 N ILE C 332 14.082 4.209 2.672 1.00 0.20 N ATOM 1626 CA ILE C 332 12.845 4.513 3.450 1.00 0.21 C ATOM 1627 C ILE C 332 13.212 5.296 4.713 1.00 0.22 C ATOM 1628 O ILE C 332 13.718 4.744 5.672 1.00 0.24 O ATOM 1629 CB ILE C 332 12.155 3.212 3.855 1.00 0.20 C ATOM 1630 CG1 ILE C 332 11.793 2.418 2.600 1.00 0.22 C ATOM 1631 CG2 ILE C 332 10.881 3.532 4.643 1.00 0.22 C ATOM 1632 CD1 ILE C 332 10.867 1.262 2.979 1.00 0.19 C ATOM 0 H ILE C 332 14.661 3.459 3.051 1.00 0.20 H new ATOM 0 HA ILE C 332 12.173 5.106 2.830 1.00 0.21 H new ATOM 0 HB ILE C 332 12.827 2.622 4.478 1.00 0.20 H new ATOM 0 HG12 ILE C 332 11.304 3.067 1.874 1.00 0.22 H new ATOM 0 HG13 ILE C 332 12.696 2.034 2.126 1.00 0.22 H new ATOM 0 HG21 ILE C 332 10.389 2.603 4.932 1.00 0.22 H new ATOM 0 HG22 ILE C 332 11.139 4.099 5.537 1.00 0.22 H new ATOM 0 HG23 ILE C 332 10.207 4.122 4.021 1.00 0.22 H new ATOM 0 HD11 ILE C 332 10.608 0.695 2.085 1.00 0.19 H new ATOM 0 HD12 ILE C 332 11.373 0.608 3.689 1.00 0.19 H new ATOM 0 HD13 ILE C 332 9.959 1.657 3.433 1.00 0.19 H new ATOM 1644 N ARG C 333 12.954 6.575 4.723 1.00 0.24 N ATOM 1645 CA ARG C 333 13.279 7.392 5.927 1.00 0.25 C ATOM 1646 C ARG C 333 12.283 7.070 7.045 1.00 0.25 C ATOM 1647 O ARG C 333 11.114 6.842 6.802 1.00 0.26 O ATOM 1648 CB ARG C 333 13.184 8.877 5.574 1.00 0.28 C ATOM 1649 CG ARG C 333 14.411 9.292 4.767 1.00 0.40 C ATOM 1650 CD ARG C 333 13.986 9.646 3.342 1.00 0.89 C ATOM 1651 NE ARG C 333 14.741 10.841 2.877 1.00 1.35 N ATOM 1652 CZ ARG C 333 14.768 11.148 1.608 1.00 2.02 C ATOM 1653 NH1 ARG C 333 14.133 10.407 0.740 1.00 2.54 N ATOM 1654 NH2 ARG C 333 15.434 12.197 1.211 1.00 2.74 N ATOM 0 H ARG C 333 12.532 7.090 3.950 1.00 0.24 H new ATOM 0 HA ARG C 333 14.290 7.161 6.262 1.00 0.25 H new ATOM 0 HB2 ARG C 333 12.277 9.067 5.000 1.00 0.28 H new ATOM 0 HB3 ARG C 333 13.116 9.474 6.484 1.00 0.28 H new ATOM 0 HG2 ARG C 333 14.896 10.148 5.237 1.00 0.40 H new ATOM 0 HG3 ARG C 333 15.140 8.482 4.750 1.00 0.40 H new ATOM 0 HD2 ARG C 333 14.173 8.804 2.676 1.00 0.89 H new ATOM 0 HD3 ARG C 333 12.915 9.845 3.310 1.00 0.89 H new ATOM 0 HE ARG C 333 15.239 11.422 3.551 1.00 1.35 H new ATOM 0 HH11 ARG C 333 13.614 9.586 1.053 1.00 2.54 H new ATOM 0 HH12 ARG C 333 14.156 10.649 -0.251 1.00 2.54 H new ATOM 0 HH21 ARG C 333 15.931 12.773 1.891 1.00 2.74 H new ATOM 0 HH22 ARG C 333 15.458 12.441 0.221 1.00 2.74 H new ATOM 1668 N GLY C 334 12.733 7.050 8.273 1.00 0.28 N ATOM 1669 CA GLY C 334 11.806 6.745 9.406 1.00 0.29 C ATOM 1670 C GLY C 334 11.604 5.232 9.515 1.00 0.30 C ATOM 1671 O GLY C 334 11.337 4.561 8.539 1.00 0.35 O ATOM 0 H GLY C 334 13.700 7.231 8.541 1.00 0.28 H new ATOM 0 HA2 GLY C 334 12.215 7.135 10.338 1.00 0.29 H new ATOM 0 HA3 GLY C 334 10.847 7.239 9.247 1.00 0.29 H new ATOM 1675 N ARG C 335 11.730 4.689 10.697 1.00 0.27 N ATOM 1676 CA ARG C 335 11.545 3.219 10.871 1.00 0.30 C ATOM 1677 C ARG C 335 10.052 2.888 10.914 1.00 0.29 C ATOM 1678 O ARG C 335 9.628 1.836 10.477 1.00 0.28 O ATOM 1679 CB ARG C 335 12.202 2.772 12.183 1.00 0.34 C ATOM 1680 CG ARG C 335 11.874 1.300 12.451 1.00 0.41 C ATOM 1681 CD ARG C 335 12.850 0.415 11.678 1.00 0.93 C ATOM 1682 NE ARG C 335 13.282 -0.732 12.540 1.00 1.26 N ATOM 1683 CZ ARG C 335 13.720 -0.541 13.760 1.00 1.89 C ATOM 1684 NH1 ARG C 335 13.969 0.665 14.201 1.00 2.51 N ATOM 1685 NH2 ARG C 335 13.965 -1.572 14.524 1.00 2.53 N ATOM 0 H ARG C 335 11.953 5.201 11.550 1.00 0.27 H new ATOM 0 HA ARG C 335 12.008 2.697 10.033 1.00 0.30 H new ATOM 0 HB2 ARG C 335 13.282 2.909 12.125 1.00 0.34 H new ATOM 0 HB3 ARG C 335 11.846 3.390 13.008 1.00 0.34 H new ATOM 0 HG2 ARG C 335 11.942 1.089 13.518 1.00 0.41 H new ATOM 0 HG3 ARG C 335 10.850 1.083 12.147 1.00 0.41 H new ATOM 0 HD2 ARG C 335 12.377 0.042 10.770 1.00 0.93 H new ATOM 0 HD3 ARG C 335 13.718 0.998 11.369 1.00 0.93 H new ATOM 0 HE ARG C 335 13.234 -1.681 12.169 1.00 1.26 H new ATOM 0 HH11 ARG C 335 13.823 1.471 13.593 1.00 2.51 H new ATOM 0 HH12 ARG C 335 14.310 0.800 15.153 1.00 2.51 H new ATOM 0 HH21 ARG C 335 13.815 -2.517 14.169 1.00 2.53 H new ATOM 0 HH22 ARG C 335 14.306 -1.432 15.475 1.00 2.53 H new ATOM 1699 N GLU C 336 9.251 3.774 11.442 1.00 0.31 N ATOM 1700 CA GLU C 336 7.789 3.501 11.515 1.00 0.34 C ATOM 1701 C GLU C 336 7.264 3.187 10.110 1.00 0.34 C ATOM 1702 O GLU C 336 6.777 2.106 9.846 1.00 0.34 O ATOM 1703 CB GLU C 336 7.070 4.733 12.075 1.00 0.39 C ATOM 1704 CG GLU C 336 7.577 5.023 13.490 1.00 1.29 C ATOM 1705 CD GLU C 336 6.806 6.209 14.073 1.00 1.90 C ATOM 1706 OE1 GLU C 336 7.095 7.327 13.680 1.00 2.62 O ATOM 1707 OE2 GLU C 336 5.941 5.981 14.903 1.00 2.40 O ATOM 0 H GLU C 336 9.546 4.672 11.825 1.00 0.31 H new ATOM 0 HA GLU C 336 7.604 2.649 12.169 1.00 0.34 H new ATOM 0 HB2 GLU C 336 7.247 5.594 11.431 1.00 0.39 H new ATOM 0 HB3 GLU C 336 5.994 4.563 12.091 1.00 0.39 H new ATOM 0 HG2 GLU C 336 7.447 4.144 14.122 1.00 1.29 H new ATOM 0 HG3 GLU C 336 8.644 5.244 13.468 1.00 1.29 H new ATOM 1714 N ARG C 337 7.365 4.121 9.206 1.00 0.40 N ATOM 1715 CA ARG C 337 6.876 3.869 7.820 1.00 0.45 C ATOM 1716 C ARG C 337 7.670 2.718 7.200 1.00 0.38 C ATOM 1717 O ARG C 337 7.183 2.005 6.345 1.00 0.37 O ATOM 1718 CB ARG C 337 7.065 5.130 6.975 1.00 0.57 C ATOM 1719 CG ARG C 337 6.377 6.310 7.664 1.00 0.66 C ATOM 1720 CD ARG C 337 4.861 6.103 7.636 1.00 1.24 C ATOM 1721 NE ARG C 337 4.182 7.364 8.039 1.00 1.26 N ATOM 1722 CZ ARG C 337 2.907 7.520 7.814 1.00 2.05 C ATOM 1723 NH1 ARG C 337 2.220 6.575 7.228 1.00 2.81 N ATOM 1724 NH2 ARG C 337 2.316 8.626 8.172 1.00 2.60 N ATOM 0 H ARG C 337 7.764 5.046 9.365 1.00 0.40 H new ATOM 0 HA ARG C 337 5.819 3.607 7.851 1.00 0.45 H new ATOM 0 HB2 ARG C 337 8.127 5.339 6.846 1.00 0.57 H new ATOM 0 HB3 ARG C 337 6.646 4.981 5.980 1.00 0.57 H new ATOM 0 HG2 ARG C 337 6.724 6.397 8.694 1.00 0.66 H new ATOM 0 HG3 ARG C 337 6.637 7.241 7.161 1.00 0.66 H new ATOM 0 HD2 ARG C 337 4.542 5.809 6.636 1.00 1.24 H new ATOM 0 HD3 ARG C 337 4.581 5.294 8.311 1.00 1.24 H new ATOM 0 HE ARG C 337 4.714 8.107 8.492 1.00 1.26 H new ATOM 0 HH11 ARG C 337 2.681 5.710 6.944 1.00 2.81 H new ATOM 0 HH12 ARG C 337 1.223 6.702 7.054 1.00 2.81 H new ATOM 0 HH21 ARG C 337 2.851 9.366 8.627 1.00 2.60 H new ATOM 0 HH22 ARG C 337 1.319 8.751 7.997 1.00 2.60 H new ATOM 1738 N PHE C 338 8.895 2.539 7.618 1.00 0.36 N ATOM 1739 CA PHE C 338 9.731 1.442 7.050 1.00 0.34 C ATOM 1740 C PHE C 338 9.007 0.097 7.195 1.00 0.28 C ATOM 1741 O PHE C 338 8.710 -0.564 6.218 1.00 0.26 O ATOM 1742 CB PHE C 338 11.070 1.391 7.795 1.00 0.35 C ATOM 1743 CG PHE C 338 11.864 0.201 7.316 1.00 0.35 C ATOM 1744 CD1 PHE C 338 12.518 0.247 6.079 1.00 0.36 C ATOM 1745 CD2 PHE C 338 11.942 -0.952 8.106 1.00 0.37 C ATOM 1746 CE1 PHE C 338 13.250 -0.859 5.631 1.00 0.38 C ATOM 1747 CE2 PHE C 338 12.675 -2.060 7.660 1.00 0.39 C ATOM 1748 CZ PHE C 338 13.329 -2.012 6.422 1.00 0.40 C ATOM 0 H PHE C 338 9.354 3.107 8.330 1.00 0.36 H new ATOM 0 HA PHE C 338 9.906 1.634 5.991 1.00 0.34 H new ATOM 0 HB2 PHE C 338 11.630 2.310 7.622 1.00 0.35 H new ATOM 0 HB3 PHE C 338 10.899 1.320 8.869 1.00 0.35 H new ATOM 0 HD1 PHE C 338 12.458 1.137 5.470 1.00 0.36 H new ATOM 0 HD2 PHE C 338 11.437 -0.988 9.060 1.00 0.37 H new ATOM 0 HE1 PHE C 338 13.753 -0.823 4.676 1.00 0.38 H new ATOM 0 HE2 PHE C 338 12.736 -2.949 8.270 1.00 0.39 H new ATOM 0 HZ PHE C 338 13.895 -2.865 6.077 1.00 0.40 H new ATOM 1758 N GLU C 339 8.727 -0.315 8.403 1.00 0.28 N ATOM 1759 CA GLU C 339 8.026 -1.619 8.609 1.00 0.25 C ATOM 1760 C GLU C 339 6.770 -1.675 7.737 1.00 0.22 C ATOM 1761 O GLU C 339 6.384 -2.723 7.253 1.00 0.21 O ATOM 1762 CB GLU C 339 7.623 -1.752 10.080 1.00 0.29 C ATOM 1763 CG GLU C 339 8.847 -2.120 10.921 1.00 0.33 C ATOM 1764 CD GLU C 339 8.505 -1.974 12.405 1.00 1.24 C ATOM 1765 OE1 GLU C 339 7.363 -2.217 12.756 1.00 1.99 O ATOM 1766 OE2 GLU C 339 9.393 -1.625 13.165 1.00 2.05 O ATOM 0 H GLU C 339 8.953 0.194 9.257 1.00 0.28 H new ATOM 0 HA GLU C 339 8.695 -2.434 8.334 1.00 0.25 H new ATOM 0 HB2 GLU C 339 7.194 -0.815 10.435 1.00 0.29 H new ATOM 0 HB3 GLU C 339 6.853 -2.516 10.188 1.00 0.29 H new ATOM 0 HG2 GLU C 339 9.155 -3.143 10.706 1.00 0.33 H new ATOM 0 HG3 GLU C 339 9.686 -1.474 10.664 1.00 0.33 H new ATOM 1773 N MET C 340 6.123 -0.558 7.541 1.00 0.23 N ATOM 1774 CA MET C 340 4.885 -0.548 6.710 1.00 0.22 C ATOM 1775 C MET C 340 5.219 -0.972 5.277 1.00 0.19 C ATOM 1776 O MET C 340 4.585 -1.842 4.716 1.00 0.19 O ATOM 1777 CB MET C 340 4.291 0.864 6.697 1.00 0.25 C ATOM 1778 CG MET C 340 2.820 0.792 6.288 1.00 0.28 C ATOM 1779 SD MET C 340 2.053 2.411 6.533 1.00 0.31 S ATOM 1780 CE MET C 340 2.563 3.134 4.956 1.00 0.32 C ATOM 0 H MET C 340 6.398 0.348 7.920 1.00 0.23 H new ATOM 0 HA MET C 340 4.163 -1.246 7.133 1.00 0.22 H new ATOM 0 HB2 MET C 340 4.384 1.319 7.683 1.00 0.25 H new ATOM 0 HB3 MET C 340 4.843 1.496 6.001 1.00 0.25 H new ATOM 0 HG2 MET C 340 2.735 0.491 5.244 1.00 0.28 H new ATOM 0 HG3 MET C 340 2.302 0.038 6.881 1.00 0.28 H new ATOM 0 HE1 MET C 340 1.948 4.007 4.740 1.00 0.32 H new ATOM 0 HE2 MET C 340 3.610 3.433 5.014 1.00 0.32 H new ATOM 0 HE3 MET C 340 2.440 2.398 4.161 1.00 0.32 H new ATOM 1790 N PHE C 341 6.206 -0.365 4.676 1.00 0.17 N ATOM 1791 CA PHE C 341 6.566 -0.739 3.279 1.00 0.16 C ATOM 1792 C PHE C 341 6.983 -2.210 3.225 1.00 0.16 C ATOM 1793 O PHE C 341 6.613 -2.934 2.327 1.00 0.17 O ATOM 1794 CB PHE C 341 7.725 0.135 2.799 1.00 0.16 C ATOM 1795 CG PHE C 341 7.204 1.511 2.463 1.00 0.16 C ATOM 1796 CD1 PHE C 341 6.440 1.706 1.304 1.00 0.18 C ATOM 1797 CD2 PHE C 341 7.479 2.593 3.310 1.00 0.16 C ATOM 1798 CE1 PHE C 341 5.953 2.982 0.992 1.00 0.18 C ATOM 1799 CE2 PHE C 341 6.991 3.869 2.998 1.00 0.17 C ATOM 1800 CZ PHE C 341 6.228 4.064 1.840 1.00 0.17 C ATOM 0 H PHE C 341 6.777 0.372 5.091 1.00 0.17 H new ATOM 0 HA PHE C 341 5.701 -0.587 2.634 1.00 0.16 H new ATOM 0 HB2 PHE C 341 8.490 0.202 3.572 1.00 0.16 H new ATOM 0 HB3 PHE C 341 8.195 -0.313 1.923 1.00 0.16 H new ATOM 0 HD1 PHE C 341 6.227 0.872 0.651 1.00 0.18 H new ATOM 0 HD2 PHE C 341 8.067 2.443 4.203 1.00 0.16 H new ATOM 0 HE1 PHE C 341 5.366 3.132 0.098 1.00 0.18 H new ATOM 0 HE2 PHE C 341 7.203 4.703 3.651 1.00 0.17 H new ATOM 0 HZ PHE C 341 5.852 5.047 1.600 1.00 0.17 H new ATOM 1810 N ARG C 342 7.754 -2.659 4.176 1.00 0.18 N ATOM 1811 CA ARG C 342 8.189 -4.084 4.171 1.00 0.20 C ATOM 1812 C ARG C 342 6.968 -4.998 4.039 1.00 0.20 C ATOM 1813 O ARG C 342 6.963 -5.935 3.265 1.00 0.20 O ATOM 1814 CB ARG C 342 8.917 -4.401 5.479 1.00 0.24 C ATOM 1815 CG ARG C 342 9.402 -5.850 5.452 1.00 0.34 C ATOM 1816 CD ARG C 342 10.930 -5.870 5.439 1.00 0.96 C ATOM 1817 NE ARG C 342 11.440 -5.965 6.836 1.00 1.54 N ATOM 1818 CZ ARG C 342 12.686 -6.291 7.057 1.00 2.04 C ATOM 1819 NH1 ARG C 342 13.490 -6.528 6.055 1.00 2.35 N ATOM 1820 NH2 ARG C 342 13.128 -6.377 8.281 1.00 2.91 N ATOM 0 H ARG C 342 8.102 -2.101 4.956 1.00 0.18 H new ATOM 0 HA ARG C 342 8.859 -4.250 3.328 1.00 0.20 H new ATOM 0 HB2 ARG C 342 9.762 -3.725 5.610 1.00 0.24 H new ATOM 0 HB3 ARG C 342 8.250 -4.245 6.327 1.00 0.24 H new ATOM 0 HG2 ARG C 342 9.027 -6.388 6.323 1.00 0.34 H new ATOM 0 HG3 ARG C 342 9.012 -6.360 4.571 1.00 0.34 H new ATOM 0 HD2 ARG C 342 11.288 -6.716 4.852 1.00 0.96 H new ATOM 0 HD3 ARG C 342 11.312 -4.967 4.962 1.00 0.96 H new ATOM 0 HE ARG C 342 10.816 -5.775 7.620 1.00 1.54 H new ATOM 0 HH11 ARG C 342 13.146 -6.459 5.097 1.00 2.35 H new ATOM 0 HH12 ARG C 342 14.462 -6.782 6.230 1.00 2.35 H new ATOM 0 HH21 ARG C 342 12.501 -6.190 9.064 1.00 2.91 H new ATOM 0 HH22 ARG C 342 14.100 -6.631 8.455 1.00 2.91 H new ATOM 1834 N GLU C 343 5.937 -4.740 4.795 1.00 0.21 N ATOM 1835 CA GLU C 343 4.721 -5.601 4.720 1.00 0.23 C ATOM 1836 C GLU C 343 4.189 -5.625 3.284 1.00 0.18 C ATOM 1837 O GLU C 343 3.919 -6.673 2.734 1.00 0.18 O ATOM 1838 CB GLU C 343 3.650 -5.040 5.656 1.00 0.27 C ATOM 1839 CG GLU C 343 2.353 -5.831 5.485 1.00 0.31 C ATOM 1840 CD GLU C 343 1.553 -5.775 6.787 1.00 1.31 C ATOM 1841 OE1 GLU C 343 1.915 -6.485 7.711 1.00 2.14 O ATOM 1842 OE2 GLU C 343 0.593 -5.024 6.838 1.00 2.07 O ATOM 0 H GLU C 343 5.883 -3.970 5.462 1.00 0.21 H new ATOM 0 HA GLU C 343 4.976 -6.617 5.021 1.00 0.23 H new ATOM 0 HB2 GLU C 343 3.990 -5.099 6.690 1.00 0.27 H new ATOM 0 HB3 GLU C 343 3.477 -3.986 5.437 1.00 0.27 H new ATOM 0 HG2 GLU C 343 1.766 -5.416 4.666 1.00 0.31 H new ATOM 0 HG3 GLU C 343 2.576 -6.866 5.226 1.00 0.31 H new ATOM 1849 N LEU C 344 4.037 -4.483 2.676 1.00 0.17 N ATOM 1850 CA LEU C 344 3.524 -4.444 1.277 1.00 0.15 C ATOM 1851 C LEU C 344 4.501 -5.177 0.352 1.00 0.14 C ATOM 1852 O LEU C 344 4.121 -5.708 -0.674 1.00 0.15 O ATOM 1853 CB LEU C 344 3.401 -2.987 0.825 1.00 0.17 C ATOM 1854 CG LEU C 344 2.334 -2.283 1.660 1.00 0.16 C ATOM 1855 CD1 LEU C 344 2.391 -0.778 1.399 1.00 0.22 C ATOM 1856 CD2 LEU C 344 0.952 -2.815 1.271 1.00 0.20 C ATOM 0 H LEU C 344 4.246 -3.573 3.087 1.00 0.17 H new ATOM 0 HA LEU C 344 2.548 -4.928 1.234 1.00 0.15 H new ATOM 0 HB2 LEU C 344 4.359 -2.479 0.936 1.00 0.17 H new ATOM 0 HB3 LEU C 344 3.138 -2.944 -0.232 1.00 0.17 H new ATOM 0 HG LEU C 344 2.515 -2.475 2.718 1.00 0.16 H new ATOM 0 HD11 LEU C 344 1.629 -0.276 1.995 1.00 0.22 H new ATOM 0 HD12 LEU C 344 3.375 -0.398 1.673 1.00 0.22 H new ATOM 0 HD13 LEU C 344 2.210 -0.585 0.342 1.00 0.22 H new ATOM 0 HD21 LEU C 344 0.188 -2.314 1.866 1.00 0.20 H new ATOM 0 HD22 LEU C 344 0.772 -2.622 0.213 1.00 0.20 H new ATOM 0 HD23 LEU C 344 0.910 -3.888 1.456 1.00 0.20 H new ATOM 1868 N ASN C 345 5.755 -5.199 0.704 1.00 0.17 N ATOM 1869 CA ASN C 345 6.767 -5.882 -0.152 1.00 0.20 C ATOM 1870 C ASN C 345 6.403 -7.357 -0.330 1.00 0.17 C ATOM 1871 O ASN C 345 6.147 -7.813 -1.427 1.00 0.18 O ATOM 1872 CB ASN C 345 8.141 -5.773 0.508 1.00 0.26 C ATOM 1873 CG ASN C 345 9.207 -6.359 -0.420 1.00 0.29 C ATOM 1874 OD1 ASN C 345 9.464 -7.546 -0.395 1.00 1.08 O ATOM 1875 ND2 ASN C 345 9.843 -5.570 -1.243 1.00 0.71 N ATOM 0 H ASN C 345 6.126 -4.771 1.552 1.00 0.17 H new ATOM 0 HA ASN C 345 6.786 -5.403 -1.131 1.00 0.20 H new ATOM 0 HB2 ASN C 345 8.369 -4.730 0.726 1.00 0.26 H new ATOM 0 HB3 ASN C 345 8.141 -6.305 1.459 1.00 0.26 H new ATOM 0 HD21 ASN C 345 10.556 -5.950 -1.865 1.00 0.71 H new ATOM 0 HD22 ASN C 345 9.627 -4.573 -1.264 1.00 0.71 H new ATOM 1882 N GLU C 346 6.387 -8.106 0.734 1.00 0.18 N ATOM 1883 CA GLU C 346 6.052 -9.550 0.617 1.00 0.17 C ATOM 1884 C GLU C 346 4.630 -9.714 0.073 1.00 0.15 C ATOM 1885 O GLU C 346 4.277 -10.747 -0.457 1.00 0.16 O ATOM 1886 CB GLU C 346 6.150 -10.209 1.992 1.00 0.21 C ATOM 1887 CG GLU C 346 5.938 -11.714 1.842 1.00 0.25 C ATOM 1888 CD GLU C 346 5.477 -12.294 3.178 1.00 1.42 C ATOM 1889 OE1 GLU C 346 6.231 -12.203 4.132 1.00 2.21 O ATOM 1890 OE2 GLU C 346 4.376 -12.815 3.225 1.00 2.20 O ATOM 0 H GLU C 346 6.591 -7.781 1.679 1.00 0.18 H new ATOM 0 HA GLU C 346 6.754 -10.025 -0.068 1.00 0.17 H new ATOM 0 HB2 GLU C 346 7.125 -10.009 2.436 1.00 0.21 H new ATOM 0 HB3 GLU C 346 5.402 -9.789 2.664 1.00 0.21 H new ATOM 0 HG2 GLU C 346 5.195 -11.913 1.070 1.00 0.25 H new ATOM 0 HG3 GLU C 346 6.864 -12.194 1.524 1.00 0.25 H new ATOM 1897 N ALA C 347 3.806 -8.712 0.207 1.00 0.13 N ATOM 1898 CA ALA C 347 2.409 -8.830 -0.300 1.00 0.14 C ATOM 1899 C ALA C 347 2.413 -9.053 -1.816 1.00 0.16 C ATOM 1900 O ALA C 347 1.886 -10.030 -2.311 1.00 0.18 O ATOM 1901 CB ALA C 347 1.635 -7.551 0.030 1.00 0.15 C ATOM 0 H ALA C 347 4.038 -7.820 0.644 1.00 0.13 H new ATOM 0 HA ALA C 347 1.928 -9.682 0.181 1.00 0.14 H new ATOM 0 HB1 ALA C 347 0.614 -7.638 -0.341 1.00 0.15 H new ATOM 0 HB2 ALA C 347 1.618 -7.405 1.110 1.00 0.15 H new ATOM 0 HB3 ALA C 347 2.122 -6.699 -0.444 1.00 0.15 H new ATOM 1907 N LEU C 348 2.989 -8.149 -2.560 1.00 0.18 N ATOM 1908 CA LEU C 348 3.009 -8.303 -4.045 1.00 0.22 C ATOM 1909 C LEU C 348 3.806 -9.553 -4.441 1.00 0.22 C ATOM 1910 O LEU C 348 3.321 -10.401 -5.163 1.00 0.25 O ATOM 1911 CB LEU C 348 3.650 -7.062 -4.677 1.00 0.25 C ATOM 1912 CG LEU C 348 2.667 -5.888 -4.622 1.00 0.27 C ATOM 1913 CD1 LEU C 348 1.308 -6.327 -5.173 1.00 0.32 C ATOM 1914 CD2 LEU C 348 2.502 -5.428 -3.170 1.00 0.23 C ATOM 0 H LEU C 348 3.447 -7.310 -2.205 1.00 0.18 H new ATOM 0 HA LEU C 348 1.986 -8.412 -4.404 1.00 0.22 H new ATOM 0 HB2 LEU C 348 4.568 -6.805 -4.148 1.00 0.25 H new ATOM 0 HB3 LEU C 348 3.926 -7.270 -5.711 1.00 0.25 H new ATOM 0 HG LEU C 348 3.053 -5.066 -5.225 1.00 0.27 H new ATOM 0 HD11 LEU C 348 0.611 -5.490 -5.132 1.00 0.32 H new ATOM 0 HD12 LEU C 348 1.423 -6.654 -6.206 1.00 0.32 H new ATOM 0 HD13 LEU C 348 0.921 -7.151 -4.573 1.00 0.32 H new ATOM 0 HD21 LEU C 348 1.803 -4.593 -3.130 1.00 0.23 H new ATOM 0 HD22 LEU C 348 2.118 -6.252 -2.569 1.00 0.23 H new ATOM 0 HD23 LEU C 348 3.468 -5.112 -2.777 1.00 0.23 H new ATOM 1926 N GLU C 349 5.024 -9.673 -3.987 1.00 0.22 N ATOM 1927 CA GLU C 349 5.842 -10.866 -4.355 1.00 0.24 C ATOM 1928 C GLU C 349 5.111 -12.144 -3.934 1.00 0.22 C ATOM 1929 O GLU C 349 5.294 -13.194 -4.517 1.00 0.23 O ATOM 1930 CB GLU C 349 7.200 -10.792 -3.653 1.00 0.26 C ATOM 1931 CG GLU C 349 8.113 -9.833 -4.420 1.00 0.33 C ATOM 1932 CD GLU C 349 8.427 -8.614 -3.550 1.00 1.35 C ATOM 1933 OE1 GLU C 349 8.490 -8.772 -2.342 1.00 2.04 O ATOM 1934 OE2 GLU C 349 8.599 -7.542 -4.108 1.00 2.19 O ATOM 0 H GLU C 349 5.488 -8.999 -3.378 1.00 0.22 H new ATOM 0 HA GLU C 349 5.994 -10.880 -5.434 1.00 0.24 H new ATOM 0 HB2 GLU C 349 7.073 -10.449 -2.626 1.00 0.26 H new ATOM 0 HB3 GLU C 349 7.652 -11.783 -3.605 1.00 0.26 H new ATOM 0 HG2 GLU C 349 9.037 -10.340 -4.700 1.00 0.33 H new ATOM 0 HG3 GLU C 349 7.630 -9.517 -5.345 1.00 0.33 H new ATOM 1941 N LEU C 350 4.281 -12.068 -2.932 1.00 0.22 N ATOM 1942 CA LEU C 350 3.541 -13.281 -2.490 1.00 0.23 C ATOM 1943 C LEU C 350 2.592 -13.723 -3.603 1.00 0.23 C ATOM 1944 O LEU C 350 2.521 -14.886 -3.953 1.00 0.26 O ATOM 1945 CB LEU C 350 2.736 -12.960 -1.230 1.00 0.26 C ATOM 1946 CG LEU C 350 1.902 -14.180 -0.836 1.00 0.30 C ATOM 1947 CD1 LEU C 350 1.621 -14.149 0.667 1.00 0.46 C ATOM 1948 CD2 LEU C 350 0.579 -14.155 -1.605 1.00 0.38 C ATOM 0 H LEU C 350 4.084 -11.220 -2.401 1.00 0.22 H new ATOM 0 HA LEU C 350 4.248 -14.081 -2.271 1.00 0.23 H new ATOM 0 HB2 LEU C 350 3.407 -12.686 -0.416 1.00 0.26 H new ATOM 0 HB3 LEU C 350 2.086 -12.104 -1.409 1.00 0.26 H new ATOM 0 HG LEU C 350 2.451 -15.090 -1.079 1.00 0.30 H new ATOM 0 HD11 LEU C 350 1.027 -15.020 0.944 1.00 0.46 H new ATOM 0 HD12 LEU C 350 2.564 -14.164 1.214 1.00 0.46 H new ATOM 0 HD13 LEU C 350 1.072 -13.241 0.916 1.00 0.46 H new ATOM 0 HD21 LEU C 350 -0.019 -15.023 -1.328 1.00 0.38 H new ATOM 0 HD22 LEU C 350 0.033 -13.244 -1.360 1.00 0.38 H new ATOM 0 HD23 LEU C 350 0.780 -14.180 -2.676 1.00 0.38 H new ATOM 1960 N LYS C 351 1.862 -12.799 -4.164 1.00 0.23 N ATOM 1961 CA LYS C 351 0.916 -13.154 -5.256 1.00 0.25 C ATOM 1962 C LYS C 351 1.695 -13.741 -6.435 1.00 0.27 C ATOM 1963 O LYS C 351 1.299 -14.728 -7.023 1.00 0.32 O ATOM 1964 CB LYS C 351 0.172 -11.897 -5.710 1.00 0.26 C ATOM 1965 CG LYS C 351 -0.795 -12.257 -6.839 1.00 0.28 C ATOM 1966 CD LYS C 351 -1.147 -10.998 -7.630 1.00 0.35 C ATOM 1967 CE LYS C 351 -1.815 -11.395 -8.947 1.00 0.41 C ATOM 1968 NZ LYS C 351 -2.634 -10.257 -9.450 1.00 1.35 N ATOM 0 H LYS C 351 1.881 -11.811 -3.912 1.00 0.23 H new ATOM 0 HA LYS C 351 0.199 -13.891 -4.893 1.00 0.25 H new ATOM 0 HB2 LYS C 351 -0.375 -11.463 -4.873 1.00 0.26 H new ATOM 0 HB3 LYS C 351 0.883 -11.144 -6.051 1.00 0.26 H new ATOM 0 HG2 LYS C 351 -0.342 -12.998 -7.497 1.00 0.28 H new ATOM 0 HG3 LYS C 351 -1.699 -12.706 -6.428 1.00 0.28 H new ATOM 0 HD2 LYS C 351 -1.815 -10.364 -7.047 1.00 0.35 H new ATOM 0 HD3 LYS C 351 -0.247 -10.416 -7.827 1.00 0.35 H new ATOM 0 HE2 LYS C 351 -1.059 -11.666 -9.684 1.00 0.41 H new ATOM 0 HE3 LYS C 351 -2.444 -12.272 -8.798 1.00 0.41 H new ATOM 0 HZ1 LYS C 351 -3.089 -10.526 -10.346 1.00 1.35 H new ATOM 0 HZ2 LYS C 351 -3.364 -10.018 -8.749 1.00 1.35 H new ATOM 0 HZ3 LYS C 351 -2.022 -9.431 -9.607 1.00 1.35 H new ATOM 1982 N ASP C 352 2.801 -13.142 -6.785 1.00 0.28 N ATOM 1983 CA ASP C 352 3.605 -13.666 -7.928 1.00 0.34 C ATOM 1984 C ASP C 352 3.965 -15.130 -7.675 1.00 0.36 C ATOM 1985 O ASP C 352 3.809 -15.973 -8.535 1.00 0.43 O ATOM 1986 CB ASP C 352 4.890 -12.850 -8.071 1.00 0.39 C ATOM 1987 CG ASP C 352 4.565 -11.494 -8.698 1.00 0.46 C ATOM 1988 OD1 ASP C 352 3.506 -10.965 -8.402 1.00 1.10 O ATOM 1989 OD2 ASP C 352 5.380 -11.008 -9.465 1.00 1.19 O ATOM 0 H ASP C 352 3.183 -12.313 -6.330 1.00 0.28 H new ATOM 0 HA ASP C 352 3.018 -13.586 -8.843 1.00 0.34 H new ATOM 0 HB2 ASP C 352 5.355 -12.709 -7.095 1.00 0.39 H new ATOM 0 HB3 ASP C 352 5.607 -13.387 -8.691 1.00 0.39 H new ATOM 1994 N ALA C 353 4.448 -15.441 -6.504 1.00 0.35 N ATOM 1995 CA ALA C 353 4.817 -16.852 -6.204 1.00 0.43 C ATOM 1996 C ALA C 353 3.550 -17.711 -6.158 1.00 0.47 C ATOM 1997 O ALA C 353 3.605 -18.918 -6.274 1.00 0.57 O ATOM 1998 CB ALA C 353 5.526 -16.919 -4.851 1.00 0.45 C ATOM 0 H ALA C 353 4.603 -14.780 -5.743 1.00 0.35 H new ATOM 0 HA ALA C 353 5.483 -17.226 -6.981 1.00 0.43 H new ATOM 0 HB1 ALA C 353 5.796 -17.952 -4.632 1.00 0.45 H new ATOM 0 HB2 ALA C 353 6.428 -16.307 -4.882 1.00 0.45 H new ATOM 0 HB3 ALA C 353 4.861 -16.545 -4.073 1.00 0.45 H new ATOM 2218 N GLU D 326 -15.337 -8.539 11.700 1.00 0.46 N ATOM 2219 CA GLU D 326 -16.263 -7.411 11.411 1.00 0.43 C ATOM 2220 C GLU D 326 -16.378 -7.216 9.900 1.00 0.38 C ATOM 2221 O GLU D 326 -15.776 -7.926 9.121 1.00 0.37 O ATOM 2222 CB GLU D 326 -15.719 -6.128 12.046 1.00 0.44 C ATOM 2223 CG GLU D 326 -15.920 -6.182 13.563 1.00 0.49 C ATOM 2224 CD GLU D 326 -17.415 -6.243 13.878 1.00 1.38 C ATOM 2225 OE1 GLU D 326 -18.188 -5.721 13.093 1.00 2.12 O ATOM 2226 OE2 GLU D 326 -17.760 -6.811 14.901 1.00 2.13 O ATOM 0 HA GLU D 326 -17.246 -7.637 11.825 1.00 0.43 H new ATOM 0 HB2 GLU D 326 -14.660 -6.015 11.813 1.00 0.44 H new ATOM 0 HB3 GLU D 326 -16.231 -5.259 11.632 1.00 0.44 H new ATOM 0 HG2 GLU D 326 -15.415 -7.055 13.977 1.00 0.49 H new ATOM 0 HG3 GLU D 326 -15.475 -5.304 14.031 1.00 0.49 H new ATOM 2233 N TYR D 327 -17.148 -6.254 9.481 1.00 0.35 N ATOM 2234 CA TYR D 327 -17.304 -6.004 8.025 1.00 0.31 C ATOM 2235 C TYR D 327 -17.579 -4.518 7.800 1.00 0.28 C ATOM 2236 O TYR D 327 -18.635 -4.016 8.131 1.00 0.29 O ATOM 2237 CB TYR D 327 -18.471 -6.834 7.488 1.00 0.33 C ATOM 2238 CG TYR D 327 -18.019 -8.260 7.279 1.00 0.35 C ATOM 2239 CD1 TYR D 327 -18.063 -9.168 8.343 1.00 0.40 C ATOM 2240 CD2 TYR D 327 -17.552 -8.673 6.024 1.00 0.35 C ATOM 2241 CE1 TYR D 327 -17.639 -10.492 8.153 1.00 0.43 C ATOM 2242 CE2 TYR D 327 -17.128 -9.995 5.833 1.00 0.39 C ATOM 2243 CZ TYR D 327 -17.172 -10.906 6.897 1.00 0.43 C ATOM 2244 OH TYR D 327 -16.756 -12.209 6.707 1.00 0.47 O ATOM 0 H TYR D 327 -17.678 -5.628 10.087 1.00 0.35 H new ATOM 0 HA TYR D 327 -16.392 -6.289 7.501 1.00 0.31 H new ATOM 0 HB2 TYR D 327 -19.305 -6.804 8.189 1.00 0.33 H new ATOM 0 HB3 TYR D 327 -18.829 -6.413 6.548 1.00 0.33 H new ATOM 0 HD1 TYR D 327 -18.423 -8.850 9.310 1.00 0.40 H new ATOM 0 HD2 TYR D 327 -17.519 -7.972 5.203 1.00 0.35 H new ATOM 0 HE1 TYR D 327 -17.672 -11.193 8.974 1.00 0.43 H new ATOM 0 HE2 TYR D 327 -16.767 -10.312 4.866 1.00 0.39 H new ATOM 0 HH TYR D 327 -16.464 -12.327 5.779 1.00 0.47 H new ATOM 2254 N PHE D 328 -16.634 -3.810 7.248 1.00 0.25 N ATOM 2255 CA PHE D 328 -16.836 -2.355 7.008 1.00 0.23 C ATOM 2256 C PHE D 328 -16.931 -2.091 5.506 1.00 0.22 C ATOM 2257 O PHE D 328 -17.083 -3.000 4.715 1.00 0.22 O ATOM 2258 CB PHE D 328 -15.655 -1.573 7.587 1.00 0.22 C ATOM 2259 CG PHE D 328 -15.564 -1.820 9.074 1.00 0.24 C ATOM 2260 CD1 PHE D 328 -15.026 -3.021 9.558 1.00 0.24 C ATOM 2261 CD2 PHE D 328 -16.023 -0.845 9.970 1.00 0.27 C ATOM 2262 CE1 PHE D 328 -14.945 -3.245 10.939 1.00 0.27 C ATOM 2263 CE2 PHE D 328 -15.941 -1.069 11.350 1.00 0.30 C ATOM 2264 CZ PHE D 328 -15.403 -2.270 11.835 1.00 0.30 C ATOM 0 H PHE D 328 -15.729 -4.177 6.952 1.00 0.25 H new ATOM 0 HA PHE D 328 -17.759 -2.034 7.492 1.00 0.23 H new ATOM 0 HB2 PHE D 328 -14.729 -1.879 7.100 1.00 0.22 H new ATOM 0 HB3 PHE D 328 -15.780 -0.508 7.392 1.00 0.22 H new ATOM 0 HD1 PHE D 328 -14.674 -3.773 8.867 1.00 0.24 H new ATOM 0 HD2 PHE D 328 -16.440 0.079 9.596 1.00 0.27 H new ATOM 0 HE1 PHE D 328 -14.530 -4.169 11.313 1.00 0.27 H new ATOM 0 HE2 PHE D 328 -16.292 -0.317 12.041 1.00 0.30 H new ATOM 0 HZ PHE D 328 -15.342 -2.443 12.899 1.00 0.30 H new ATOM 2274 N THR D 329 -16.842 -0.852 5.107 1.00 0.21 N ATOM 2275 CA THR D 329 -16.926 -0.522 3.659 1.00 0.21 C ATOM 2276 C THR D 329 -16.149 0.768 3.401 1.00 0.21 C ATOM 2277 O THR D 329 -15.839 1.509 4.314 1.00 0.22 O ATOM 2278 CB THR D 329 -18.389 -0.323 3.263 1.00 0.21 C ATOM 2279 OG1 THR D 329 -18.956 0.699 4.072 1.00 0.22 O ATOM 2280 CG2 THR D 329 -19.156 -1.634 3.467 1.00 0.21 C ATOM 0 H THR D 329 -16.714 -0.051 5.726 1.00 0.21 H new ATOM 0 HA THR D 329 -16.502 -1.335 3.070 1.00 0.21 H new ATOM 0 HB THR D 329 -18.452 -0.032 2.214 1.00 0.21 H new ATOM 0 HG1 THR D 329 -19.894 0.832 3.821 1.00 0.22 H new ATOM 0 HG21 THR D 329 -20.199 -1.493 3.185 1.00 0.21 H new ATOM 0 HG22 THR D 329 -18.715 -2.414 2.847 1.00 0.21 H new ATOM 0 HG23 THR D 329 -19.100 -1.929 4.515 1.00 0.21 H new ATOM 2288 N LEU D 330 -15.825 1.043 2.171 1.00 0.19 N ATOM 2289 CA LEU D 330 -15.062 2.285 1.870 1.00 0.20 C ATOM 2290 C LEU D 330 -15.426 2.786 0.473 1.00 0.20 C ATOM 2291 O LEU D 330 -15.425 2.039 -0.485 1.00 0.19 O ATOM 2292 CB LEU D 330 -13.562 1.982 1.928 1.00 0.20 C ATOM 2293 CG LEU D 330 -12.771 3.223 1.512 1.00 0.21 C ATOM 2294 CD1 LEU D 330 -12.749 4.225 2.666 1.00 0.28 C ATOM 2295 CD2 LEU D 330 -11.337 2.820 1.166 1.00 0.22 C ATOM 0 H LEU D 330 -16.054 0.464 1.363 1.00 0.19 H new ATOM 0 HA LEU D 330 -15.311 3.052 2.604 1.00 0.20 H new ATOM 0 HB2 LEU D 330 -13.281 1.680 2.937 1.00 0.20 H new ATOM 0 HB3 LEU D 330 -13.323 1.148 1.268 1.00 0.20 H new ATOM 0 HG LEU D 330 -13.244 3.679 0.642 1.00 0.21 H new ATOM 0 HD11 LEU D 330 -12.185 5.109 2.369 1.00 0.28 H new ATOM 0 HD12 LEU D 330 -13.770 4.513 2.917 1.00 0.28 H new ATOM 0 HD13 LEU D 330 -12.276 3.768 3.535 1.00 0.28 H new ATOM 0 HD21 LEU D 330 -10.772 3.704 0.869 1.00 0.22 H new ATOM 0 HD22 LEU D 330 -10.867 2.364 2.037 1.00 0.22 H new ATOM 0 HD23 LEU D 330 -11.348 2.104 0.344 1.00 0.22 H new ATOM 2307 N GLN D 331 -15.730 4.047 0.349 1.00 0.21 N ATOM 2308 CA GLN D 331 -16.084 4.596 -0.986 1.00 0.22 C ATOM 2309 C GLN D 331 -14.799 4.998 -1.710 1.00 0.22 C ATOM 2310 O GLN D 331 -14.075 5.870 -1.269 1.00 0.23 O ATOM 2311 CB GLN D 331 -16.983 5.821 -0.816 1.00 0.23 C ATOM 2312 CG GLN D 331 -17.505 6.263 -2.181 1.00 0.30 C ATOM 2313 CD GLN D 331 -19.034 6.300 -2.149 1.00 0.44 C ATOM 2314 OE1 GLN D 331 -19.622 6.767 -1.193 1.00 0.93 O ATOM 2315 NE2 GLN D 331 -19.707 5.819 -3.158 1.00 0.28 N ATOM 0 H GLN D 331 -15.748 4.720 1.115 1.00 0.21 H new ATOM 0 HA GLN D 331 -16.616 3.843 -1.567 1.00 0.22 H new ATOM 0 HB2 GLN D 331 -17.817 5.584 -0.155 1.00 0.23 H new ATOM 0 HB3 GLN D 331 -16.426 6.632 -0.348 1.00 0.23 H new ATOM 0 HG2 GLN D 331 -17.111 7.248 -2.433 1.00 0.30 H new ATOM 0 HG3 GLN D 331 -17.162 5.576 -2.954 1.00 0.30 H new ATOM 0 HE21 GLN D 331 -19.213 5.427 -3.960 1.00 0.28 H new ATOM 0 HE22 GLN D 331 -20.727 5.835 -3.145 1.00 0.28 H new ATOM 2324 N ILE D 332 -14.505 4.365 -2.811 1.00 0.21 N ATOM 2325 CA ILE D 332 -13.261 4.708 -3.552 1.00 0.22 C ATOM 2326 C ILE D 332 -13.608 5.574 -4.761 1.00 0.24 C ATOM 2327 O ILE D 332 -14.091 5.091 -5.764 1.00 0.25 O ATOM 2328 CB ILE D 332 -12.577 3.425 -4.029 1.00 0.22 C ATOM 2329 CG1 ILE D 332 -12.239 2.547 -2.821 1.00 0.20 C ATOM 2330 CG2 ILE D 332 -11.290 3.781 -4.776 1.00 0.25 C ATOM 2331 CD1 ILE D 332 -11.830 1.155 -3.305 1.00 0.24 C ATOM 0 H ILE D 332 -15.071 3.627 -3.229 1.00 0.21 H new ATOM 0 HA ILE D 332 -12.589 5.256 -2.891 1.00 0.22 H new ATOM 0 HB ILE D 332 -13.247 2.883 -4.696 1.00 0.22 H new ATOM 0 HG12 ILE D 332 -11.430 2.997 -2.246 1.00 0.20 H new ATOM 0 HG13 ILE D 332 -13.100 2.475 -2.157 1.00 0.20 H new ATOM 0 HG21 ILE D 332 -10.802 2.868 -5.116 1.00 0.25 H new ATOM 0 HG22 ILE D 332 -11.530 4.406 -5.636 1.00 0.25 H new ATOM 0 HG23 ILE D 332 -10.620 4.323 -4.109 1.00 0.25 H new ATOM 0 HD11 ILE D 332 -11.589 0.528 -2.447 1.00 0.24 H new ATOM 0 HD12 ILE D 332 -12.653 0.707 -3.862 1.00 0.24 H new ATOM 0 HD13 ILE D 332 -10.956 1.237 -3.952 1.00 0.24 H new ATOM 2343 N ARG D 333 -13.360 6.854 -4.676 1.00 0.25 N ATOM 2344 CA ARG D 333 -13.671 7.750 -5.825 1.00 0.27 C ATOM 2345 C ARG D 333 -12.690 7.470 -6.964 1.00 0.27 C ATOM 2346 O ARG D 333 -11.568 7.062 -6.741 1.00 0.27 O ATOM 2347 CB ARG D 333 -13.536 9.212 -5.390 1.00 0.32 C ATOM 2348 CG ARG D 333 -14.605 9.540 -4.347 1.00 0.42 C ATOM 2349 CD ARG D 333 -14.032 9.336 -2.943 1.00 0.69 C ATOM 2350 NE ARG D 333 -14.596 10.358 -2.014 1.00 1.45 N ATOM 2351 CZ ARG D 333 -14.511 10.189 -0.719 1.00 1.96 C ATOM 2352 NH1 ARG D 333 -13.959 9.108 -0.235 1.00 2.18 N ATOM 2353 NH2 ARG D 333 -14.986 11.097 0.091 1.00 2.93 N ATOM 0 H ARG D 333 -12.956 7.316 -3.861 1.00 0.25 H new ATOM 0 HA ARG D 333 -14.691 7.565 -6.162 1.00 0.27 H new ATOM 0 HB2 ARG D 333 -12.543 9.388 -4.975 1.00 0.32 H new ATOM 0 HB3 ARG D 333 -13.642 9.870 -6.253 1.00 0.32 H new ATOM 0 HG2 ARG D 333 -14.941 10.570 -4.467 1.00 0.42 H new ATOM 0 HG3 ARG D 333 -15.476 8.901 -4.491 1.00 0.42 H new ATOM 0 HD2 ARG D 333 -14.271 8.335 -2.585 1.00 0.69 H new ATOM 0 HD3 ARG D 333 -12.945 9.415 -2.969 1.00 0.69 H new ATOM 0 HE ARG D 333 -15.049 11.191 -2.389 1.00 1.45 H new ATOM 0 HH11 ARG D 333 -13.594 8.395 -0.867 1.00 2.18 H new ATOM 0 HH12 ARG D 333 -13.893 8.977 0.774 1.00 2.18 H new ATOM 0 HH21 ARG D 333 -15.423 11.938 -0.286 1.00 2.93 H new ATOM 0 HH22 ARG D 333 -14.920 10.965 1.100 1.00 2.93 H new ATOM 2367 N GLY D 334 -13.100 7.686 -8.183 1.00 0.30 N ATOM 2368 CA GLY D 334 -12.186 7.429 -9.330 1.00 0.32 C ATOM 2369 C GLY D 334 -12.112 5.924 -9.593 1.00 0.34 C ATOM 2370 O GLY D 334 -11.833 5.142 -8.705 1.00 0.41 O ATOM 0 H GLY D 334 -14.027 8.029 -8.434 1.00 0.30 H new ATOM 0 HA2 GLY D 334 -12.545 7.947 -10.219 1.00 0.32 H new ATOM 0 HA3 GLY D 334 -11.192 7.821 -9.112 1.00 0.32 H new ATOM 2374 N ARG D 335 -12.360 5.515 -10.806 1.00 0.31 N ATOM 2375 CA ARG D 335 -12.310 4.062 -11.133 1.00 0.35 C ATOM 2376 C ARG D 335 -10.851 3.607 -11.224 1.00 0.33 C ATOM 2377 O ARG D 335 -10.509 2.508 -10.836 1.00 0.31 O ATOM 2378 CB ARG D 335 -13.013 3.830 -12.479 1.00 0.39 C ATOM 2379 CG ARG D 335 -12.583 2.484 -13.073 1.00 0.49 C ATOM 2380 CD ARG D 335 -11.512 2.716 -14.141 1.00 0.94 C ATOM 2381 NE ARG D 335 -11.895 1.995 -15.390 1.00 1.55 N ATOM 2382 CZ ARG D 335 -11.292 2.262 -16.518 1.00 2.13 C ATOM 2383 NH1 ARG D 335 -10.339 3.151 -16.560 1.00 2.45 N ATOM 2384 NH2 ARG D 335 -11.644 1.635 -17.607 1.00 3.03 N ATOM 0 H ARG D 335 -12.596 6.126 -11.588 1.00 0.31 H new ATOM 0 HA ARG D 335 -12.812 3.489 -10.354 1.00 0.35 H new ATOM 0 HB2 ARG D 335 -14.094 3.847 -12.341 1.00 0.39 H new ATOM 0 HB3 ARG D 335 -12.767 4.636 -13.170 1.00 0.39 H new ATOM 0 HG2 ARG D 335 -12.194 1.836 -12.288 1.00 0.49 H new ATOM 0 HG3 ARG D 335 -13.443 1.976 -13.509 1.00 0.49 H new ATOM 0 HD2 ARG D 335 -11.407 3.782 -14.341 1.00 0.94 H new ATOM 0 HD3 ARG D 335 -10.545 2.361 -13.785 1.00 0.94 H new ATOM 0 HE ARG D 335 -12.632 1.290 -15.363 1.00 1.55 H new ATOM 0 HH11 ARG D 335 -10.061 3.641 -15.710 1.00 2.45 H new ATOM 0 HH12 ARG D 335 -9.871 3.356 -17.443 1.00 2.45 H new ATOM 0 HH21 ARG D 335 -12.388 0.938 -17.576 1.00 3.03 H new ATOM 0 HH22 ARG D 335 -11.175 1.842 -18.489 1.00 3.03 H new ATOM 2398 N GLU D 336 -9.993 4.439 -11.739 1.00 0.36 N ATOM 2399 CA GLU D 336 -8.561 4.051 -11.862 1.00 0.38 C ATOM 2400 C GLU D 336 -8.008 3.669 -10.487 1.00 0.38 C ATOM 2401 O GLU D 336 -7.533 2.570 -10.280 1.00 0.39 O ATOM 2402 CB GLU D 336 -7.759 5.227 -12.421 1.00 0.45 C ATOM 2403 CG GLU D 336 -8.273 5.583 -13.818 1.00 1.31 C ATOM 2404 CD GLU D 336 -7.971 7.053 -14.108 1.00 1.71 C ATOM 2405 OE1 GLU D 336 -7.849 7.812 -13.160 1.00 2.21 O ATOM 2406 OE2 GLU D 336 -7.866 7.397 -15.275 1.00 2.26 O ATOM 0 H GLU D 336 -10.221 5.373 -12.081 1.00 0.36 H new ATOM 0 HA GLU D 336 -8.478 3.198 -12.535 1.00 0.38 H new ATOM 0 HB2 GLU D 336 -7.849 6.088 -11.759 1.00 0.45 H new ATOM 0 HB3 GLU D 336 -6.701 4.969 -12.467 1.00 0.45 H new ATOM 0 HG2 GLU D 336 -7.798 4.948 -14.566 1.00 1.31 H new ATOM 0 HG3 GLU D 336 -9.346 5.401 -13.881 1.00 1.31 H new ATOM 2413 N ARG D 337 -8.058 4.570 -9.548 1.00 0.43 N ATOM 2414 CA ARG D 337 -7.528 4.266 -8.189 1.00 0.49 C ATOM 2415 C ARG D 337 -8.296 3.092 -7.572 1.00 0.40 C ATOM 2416 O ARG D 337 -7.770 2.356 -6.761 1.00 0.38 O ATOM 2417 CB ARG D 337 -7.686 5.498 -7.300 1.00 0.63 C ATOM 2418 CG ARG D 337 -6.904 6.664 -7.903 1.00 0.77 C ATOM 2419 CD ARG D 337 -5.437 6.267 -8.045 1.00 1.09 C ATOM 2420 NE ARG D 337 -4.586 7.482 -7.937 1.00 1.38 N ATOM 2421 CZ ARG D 337 -3.302 7.369 -7.737 1.00 2.18 C ATOM 2422 NH1 ARG D 337 -2.756 6.187 -7.632 1.00 2.72 N ATOM 2423 NH2 ARG D 337 -2.565 8.440 -7.642 1.00 2.92 N ATOM 0 H ARG D 337 -8.444 5.507 -9.662 1.00 0.43 H new ATOM 0 HA ARG D 337 -6.475 3.998 -8.269 1.00 0.49 H new ATOM 0 HB2 ARG D 337 -8.740 5.761 -7.209 1.00 0.63 H new ATOM 0 HB3 ARG D 337 -7.323 5.284 -6.295 1.00 0.63 H new ATOM 0 HG2 ARG D 337 -7.317 6.929 -8.876 1.00 0.77 H new ATOM 0 HG3 ARG D 337 -6.994 7.545 -7.268 1.00 0.77 H new ATOM 0 HD2 ARG D 337 -5.166 5.549 -7.271 1.00 1.09 H new ATOM 0 HD3 ARG D 337 -5.272 5.778 -9.005 1.00 1.09 H new ATOM 0 HE ARG D 337 -5.008 8.407 -8.020 1.00 1.38 H new ATOM 0 HH11 ARG D 337 -3.334 5.350 -7.706 1.00 2.72 H new ATOM 0 HH12 ARG D 337 -1.752 6.101 -7.476 1.00 2.72 H new ATOM 0 HH21 ARG D 337 -2.993 9.362 -7.724 1.00 2.92 H new ATOM 0 HH22 ARG D 337 -1.561 8.356 -7.486 1.00 2.92 H new ATOM 2437 N PHE D 338 -9.538 2.920 -7.938 1.00 0.37 N ATOM 2438 CA PHE D 338 -10.338 1.800 -7.360 1.00 0.33 C ATOM 2439 C PHE D 338 -9.641 0.463 -7.628 1.00 0.27 C ATOM 2440 O PHE D 338 -9.294 -0.260 -6.716 1.00 0.26 O ATOM 2441 CB PHE D 338 -11.731 1.777 -7.995 1.00 0.34 C ATOM 2442 CG PHE D 338 -12.445 0.501 -7.616 1.00 0.33 C ATOM 2443 CD1 PHE D 338 -13.233 0.455 -6.458 1.00 0.33 C ATOM 2444 CD2 PHE D 338 -12.323 -0.639 -8.424 1.00 0.35 C ATOM 2445 CE1 PHE D 338 -13.900 -0.728 -6.110 1.00 0.34 C ATOM 2446 CE2 PHE D 338 -12.990 -1.821 -8.074 1.00 0.37 C ATOM 2447 CZ PHE D 338 -13.778 -1.866 -6.917 1.00 0.35 C ATOM 0 H PHE D 338 -10.033 3.505 -8.611 1.00 0.37 H new ATOM 0 HA PHE D 338 -10.427 1.952 -6.284 1.00 0.33 H new ATOM 0 HB2 PHE D 338 -12.307 2.640 -7.661 1.00 0.34 H new ATOM 0 HB3 PHE D 338 -11.648 1.850 -9.079 1.00 0.34 H new ATOM 0 HD1 PHE D 338 -13.326 1.331 -5.833 1.00 0.33 H new ATOM 0 HD2 PHE D 338 -11.715 -0.606 -9.316 1.00 0.35 H new ATOM 0 HE1 PHE D 338 -14.509 -0.762 -5.218 1.00 0.34 H new ATOM 0 HE2 PHE D 338 -12.896 -2.698 -8.697 1.00 0.37 H new ATOM 0 HZ PHE D 338 -14.291 -2.777 -6.647 1.00 0.35 H new ATOM 2457 N GLU D 339 -9.447 0.125 -8.873 1.00 0.28 N ATOM 2458 CA GLU D 339 -8.790 -1.172 -9.203 1.00 0.28 C ATOM 2459 C GLU D 339 -7.471 -1.308 -8.435 1.00 0.24 C ATOM 2460 O GLU D 339 -7.070 -2.393 -8.064 1.00 0.24 O ATOM 2461 CB GLU D 339 -8.510 -1.232 -10.706 1.00 0.34 C ATOM 2462 CG GLU D 339 -9.731 -0.729 -11.478 1.00 0.38 C ATOM 2463 CD GLU D 339 -9.747 -1.363 -12.872 1.00 1.18 C ATOM 2464 OE1 GLU D 339 -9.579 -2.568 -12.954 1.00 1.87 O ATOM 2465 OE2 GLU D 339 -9.922 -0.632 -13.832 1.00 1.99 O ATOM 0 H GLU D 339 -9.715 0.692 -9.678 1.00 0.28 H new ATOM 0 HA GLU D 339 -9.453 -1.988 -8.917 1.00 0.28 H new ATOM 0 HB2 GLU D 339 -7.639 -0.624 -10.948 1.00 0.34 H new ATOM 0 HB3 GLU D 339 -8.277 -2.255 -11.002 1.00 0.34 H new ATOM 0 HG2 GLU D 339 -10.645 -0.982 -10.941 1.00 0.38 H new ATOM 0 HG3 GLU D 339 -9.701 0.357 -11.561 1.00 0.38 H new ATOM 2472 N MET D 340 -6.789 -0.221 -8.198 1.00 0.23 N ATOM 2473 CA MET D 340 -5.495 -0.300 -7.461 1.00 0.22 C ATOM 2474 C MET D 340 -5.741 -0.805 -6.035 1.00 0.18 C ATOM 2475 O MET D 340 -5.087 -1.720 -5.572 1.00 0.19 O ATOM 2476 CB MET D 340 -4.852 1.089 -7.412 1.00 0.24 C ATOM 2477 CG MET D 340 -3.398 0.967 -6.957 1.00 0.27 C ATOM 2478 SD MET D 340 -2.645 2.611 -6.905 1.00 0.29 S ATOM 2479 CE MET D 340 -2.953 2.940 -5.153 1.00 0.31 C ATOM 0 H MET D 340 -7.071 0.717 -8.482 1.00 0.23 H new ATOM 0 HA MET D 340 -4.827 -0.992 -7.975 1.00 0.22 H new ATOM 0 HB2 MET D 340 -4.897 1.556 -8.396 1.00 0.24 H new ATOM 0 HB3 MET D 340 -5.405 1.732 -6.727 1.00 0.24 H new ATOM 0 HG2 MET D 340 -3.351 0.502 -5.972 1.00 0.27 H new ATOM 0 HG3 MET D 340 -2.844 0.323 -7.640 1.00 0.27 H new ATOM 0 HE1 MET D 340 -2.268 3.712 -4.802 1.00 0.31 H new ATOM 0 HE2 MET D 340 -3.980 3.280 -5.022 1.00 0.31 H new ATOM 0 HE3 MET D 340 -2.797 2.027 -4.578 1.00 0.31 H new ATOM 2489 N PHE D 341 -6.674 -0.217 -5.337 1.00 0.16 N ATOM 2490 CA PHE D 341 -6.953 -0.662 -3.942 1.00 0.14 C ATOM 2491 C PHE D 341 -7.418 -2.119 -3.938 1.00 0.15 C ATOM 2492 O PHE D 341 -6.998 -2.912 -3.120 1.00 0.16 O ATOM 2493 CB PHE D 341 -8.045 0.220 -3.330 1.00 0.14 C ATOM 2494 CG PHE D 341 -7.438 1.514 -2.859 1.00 0.14 C ATOM 2495 CD1 PHE D 341 -6.595 1.520 -1.741 1.00 0.17 C ATOM 2496 CD2 PHE D 341 -7.715 2.711 -3.534 1.00 0.15 C ATOM 2497 CE1 PHE D 341 -6.027 2.721 -1.298 1.00 0.18 C ATOM 2498 CE2 PHE D 341 -7.147 3.913 -3.090 1.00 0.16 C ATOM 2499 CZ PHE D 341 -6.303 3.917 -1.972 1.00 0.17 C ATOM 0 H PHE D 341 -7.255 0.552 -5.672 1.00 0.16 H new ATOM 0 HA PHE D 341 -6.039 -0.576 -3.354 1.00 0.14 H new ATOM 0 HB2 PHE D 341 -8.823 0.418 -4.067 1.00 0.14 H new ATOM 0 HB3 PHE D 341 -8.520 -0.296 -2.496 1.00 0.14 H new ATOM 0 HD1 PHE D 341 -6.383 0.598 -1.220 1.00 0.17 H new ATOM 0 HD2 PHE D 341 -8.366 2.707 -4.396 1.00 0.15 H new ATOM 0 HE1 PHE D 341 -5.376 2.725 -0.436 1.00 0.18 H new ATOM 0 HE2 PHE D 341 -7.360 4.836 -3.610 1.00 0.16 H new ATOM 0 HZ PHE D 341 -5.865 4.843 -1.630 1.00 0.17 H new ATOM 2509 N ARG D 342 -8.289 -2.472 -4.841 1.00 0.17 N ATOM 2510 CA ARG D 342 -8.793 -3.874 -4.888 1.00 0.20 C ATOM 2511 C ARG D 342 -7.619 -4.855 -4.848 1.00 0.19 C ATOM 2512 O ARG D 342 -7.649 -5.845 -4.142 1.00 0.19 O ATOM 2513 CB ARG D 342 -9.584 -4.087 -6.180 1.00 0.24 C ATOM 2514 CG ARG D 342 -10.378 -5.391 -6.085 1.00 0.32 C ATOM 2515 CD ARG D 342 -11.674 -5.259 -6.883 1.00 0.62 C ATOM 2516 NE ARG D 342 -11.853 -6.468 -7.747 1.00 1.13 N ATOM 2517 CZ ARG D 342 -10.885 -6.906 -8.512 1.00 1.73 C ATOM 2518 NH1 ARG D 342 -9.804 -6.190 -8.695 1.00 2.34 N ATOM 2519 NH2 ARG D 342 -11.025 -8.041 -9.143 1.00 2.41 N ATOM 0 H ARG D 342 -8.675 -1.849 -5.551 1.00 0.17 H new ATOM 0 HA ARG D 342 -9.437 -4.050 -4.026 1.00 0.20 H new ATOM 0 HB2 ARG D 342 -10.260 -3.249 -6.347 1.00 0.24 H new ATOM 0 HB3 ARG D 342 -8.905 -4.124 -7.032 1.00 0.24 H new ATOM 0 HG2 ARG D 342 -9.784 -6.220 -6.471 1.00 0.32 H new ATOM 0 HG3 ARG D 342 -10.602 -5.617 -5.043 1.00 0.32 H new ATOM 0 HD2 ARG D 342 -12.522 -5.154 -6.206 1.00 0.62 H new ATOM 0 HD3 ARG D 342 -11.645 -4.360 -7.499 1.00 0.62 H new ATOM 0 HE ARG D 342 -12.746 -6.960 -7.740 1.00 1.13 H new ATOM 0 HH11 ARG D 342 -9.710 -5.282 -8.240 1.00 2.34 H new ATOM 0 HH12 ARG D 342 -9.055 -6.540 -9.293 1.00 2.34 H new ATOM 0 HH21 ARG D 342 -11.884 -8.580 -9.038 1.00 2.41 H new ATOM 0 HH22 ARG D 342 -10.275 -8.388 -9.741 1.00 2.41 H new ATOM 2533 N GLU D 343 -6.590 -4.596 -5.607 1.00 0.20 N ATOM 2534 CA GLU D 343 -5.421 -5.522 -5.620 1.00 0.21 C ATOM 2535 C GLU D 343 -4.842 -5.652 -4.209 1.00 0.16 C ATOM 2536 O GLU D 343 -4.584 -6.740 -3.733 1.00 0.16 O ATOM 2537 CB GLU D 343 -4.346 -4.977 -6.569 1.00 0.26 C ATOM 2538 CG GLU D 343 -3.041 -5.753 -6.372 1.00 0.54 C ATOM 2539 CD GLU D 343 -2.360 -5.972 -7.727 1.00 1.48 C ATOM 2540 OE1 GLU D 343 -2.036 -4.988 -8.371 1.00 2.11 O ATOM 2541 OE2 GLU D 343 -2.171 -7.121 -8.095 1.00 2.35 O ATOM 0 H GLU D 343 -6.507 -3.784 -6.219 1.00 0.20 H new ATOM 0 HA GLU D 343 -5.746 -6.504 -5.964 1.00 0.21 H new ATOM 0 HB2 GLU D 343 -4.681 -5.066 -7.602 1.00 0.26 H new ATOM 0 HB3 GLU D 343 -4.182 -3.917 -6.377 1.00 0.26 H new ATOM 0 HG2 GLU D 343 -2.377 -5.203 -5.705 1.00 0.54 H new ATOM 0 HG3 GLU D 343 -3.246 -6.713 -5.898 1.00 0.54 H new ATOM 2548 N LEU D 344 -4.630 -4.556 -3.536 1.00 0.15 N ATOM 2549 CA LEU D 344 -4.061 -4.627 -2.162 1.00 0.14 C ATOM 2550 C LEU D 344 -5.008 -5.404 -1.243 1.00 0.14 C ATOM 2551 O LEU D 344 -4.584 -6.069 -0.319 1.00 0.15 O ATOM 2552 CB LEU D 344 -3.879 -3.207 -1.621 1.00 0.15 C ATOM 2553 CG LEU D 344 -2.667 -2.558 -2.288 1.00 0.15 C ATOM 2554 CD1 LEU D 344 -2.705 -1.049 -2.044 1.00 0.17 C ATOM 2555 CD2 LEU D 344 -1.386 -3.141 -1.690 1.00 0.19 C ATOM 0 H LEU D 344 -4.826 -3.615 -3.878 1.00 0.15 H new ATOM 0 HA LEU D 344 -3.099 -5.138 -2.196 1.00 0.14 H new ATOM 0 HB2 LEU D 344 -4.774 -2.615 -1.814 1.00 0.15 H new ATOM 0 HB3 LEU D 344 -3.742 -3.233 -0.540 1.00 0.15 H new ATOM 0 HG LEU D 344 -2.688 -2.754 -3.360 1.00 0.15 H new ATOM 0 HD11 LEU D 344 -1.842 -0.582 -2.518 1.00 0.17 H new ATOM 0 HD12 LEU D 344 -3.620 -0.635 -2.467 1.00 0.17 H new ATOM 0 HD13 LEU D 344 -2.680 -0.853 -0.972 1.00 0.17 H new ATOM 0 HD21 LEU D 344 -0.520 -2.679 -2.164 1.00 0.19 H new ATOM 0 HD22 LEU D 344 -1.362 -2.942 -0.619 1.00 0.19 H new ATOM 0 HD23 LEU D 344 -1.362 -4.217 -1.860 1.00 0.19 H new ATOM 2567 N ASN D 345 -6.287 -5.319 -1.484 1.00 0.17 N ATOM 2568 CA ASN D 345 -7.259 -6.045 -0.617 1.00 0.20 C ATOM 2569 C ASN D 345 -6.934 -7.540 -0.611 1.00 0.17 C ATOM 2570 O ASN D 345 -6.661 -8.120 0.421 1.00 0.17 O ATOM 2571 CB ASN D 345 -8.674 -5.841 -1.159 1.00 0.26 C ATOM 2572 CG ASN D 345 -9.666 -6.642 -0.314 1.00 0.30 C ATOM 2573 OD1 ASN D 345 -9.706 -7.854 -0.387 1.00 1.09 O ATOM 2574 ND2 ASN D 345 -10.474 -6.010 0.493 1.00 0.68 N ATOM 0 H ASN D 345 -6.702 -4.779 -2.243 1.00 0.17 H new ATOM 0 HA ASN D 345 -7.192 -5.656 0.399 1.00 0.20 H new ATOM 0 HB2 ASN D 345 -8.934 -4.783 -1.138 1.00 0.26 H new ATOM 0 HB3 ASN D 345 -8.726 -6.161 -2.200 1.00 0.26 H new ATOM 0 HD21 ASN D 345 -11.139 -6.534 1.062 1.00 0.68 H new ATOM 0 HD22 ASN D 345 -10.441 -4.992 0.554 1.00 0.68 H new ATOM 2581 N GLU D 346 -6.972 -8.167 -1.752 1.00 0.17 N ATOM 2582 CA GLU D 346 -6.675 -9.627 -1.811 1.00 0.17 C ATOM 2583 C GLU D 346 -5.247 -9.883 -1.324 1.00 0.14 C ATOM 2584 O GLU D 346 -4.922 -10.961 -0.872 1.00 0.15 O ATOM 2585 CB GLU D 346 -6.819 -10.120 -3.254 1.00 0.20 C ATOM 2586 CG GLU D 346 -6.829 -11.651 -3.274 1.00 0.24 C ATOM 2587 CD GLU D 346 -7.914 -12.144 -4.235 1.00 0.90 C ATOM 2588 OE1 GLU D 346 -7.918 -11.699 -5.372 1.00 1.69 O ATOM 2589 OE2 GLU D 346 -8.722 -12.956 -3.818 1.00 1.54 O ATOM 0 H GLU D 346 -7.196 -7.733 -2.647 1.00 0.17 H new ATOM 0 HA GLU D 346 -7.376 -10.164 -1.171 1.00 0.17 H new ATOM 0 HB2 GLU D 346 -7.740 -9.734 -3.691 1.00 0.20 H new ATOM 0 HB3 GLU D 346 -5.996 -9.743 -3.862 1.00 0.20 H new ATOM 0 HG2 GLU D 346 -5.855 -12.027 -3.586 1.00 0.24 H new ATOM 0 HG3 GLU D 346 -7.014 -12.037 -2.272 1.00 0.24 H new ATOM 2596 N ALA D 347 -4.389 -8.904 -1.419 1.00 0.13 N ATOM 2597 CA ALA D 347 -2.982 -9.098 -0.966 1.00 0.14 C ATOM 2598 C ALA D 347 -2.954 -9.454 0.524 1.00 0.16 C ATOM 2599 O ALA D 347 -2.500 -10.512 0.911 1.00 0.18 O ATOM 2600 CB ALA D 347 -2.193 -7.809 -1.195 1.00 0.16 C ATOM 0 H ALA D 347 -4.601 -7.978 -1.791 1.00 0.13 H new ATOM 0 HA ALA D 347 -2.533 -9.912 -1.536 1.00 0.14 H new ATOM 0 HB1 ALA D 347 -1.164 -7.949 -0.864 1.00 0.16 H new ATOM 0 HB2 ALA D 347 -2.203 -7.560 -2.256 1.00 0.16 H new ATOM 0 HB3 ALA D 347 -2.649 -6.998 -0.628 1.00 0.16 H new ATOM 2606 N LEU D 348 -3.430 -8.575 1.365 1.00 0.17 N ATOM 2607 CA LEU D 348 -3.423 -8.859 2.830 1.00 0.21 C ATOM 2608 C LEU D 348 -4.271 -10.097 3.133 1.00 0.21 C ATOM 2609 O LEU D 348 -3.860 -10.979 3.858 1.00 0.23 O ATOM 2610 CB LEU D 348 -4.014 -7.665 3.585 1.00 0.24 C ATOM 2611 CG LEU D 348 -2.997 -6.527 3.640 1.00 0.26 C ATOM 2612 CD1 LEU D 348 -1.660 -7.056 4.158 1.00 0.31 C ATOM 2613 CD2 LEU D 348 -2.810 -5.949 2.238 1.00 0.22 C ATOM 0 H LEU D 348 -3.824 -7.672 1.101 1.00 0.17 H new ATOM 0 HA LEU D 348 -2.395 -9.035 3.146 1.00 0.21 H new ATOM 0 HB2 LEU D 348 -4.925 -7.326 3.091 1.00 0.24 H new ATOM 0 HB3 LEU D 348 -4.292 -7.965 4.595 1.00 0.24 H new ATOM 0 HG LEU D 348 -3.359 -5.748 4.311 1.00 0.26 H new ATOM 0 HD11 LEU D 348 -0.937 -6.242 4.196 1.00 0.31 H new ATOM 0 HD12 LEU D 348 -1.795 -7.469 5.158 1.00 0.31 H new ATOM 0 HD13 LEU D 348 -1.294 -7.836 3.490 1.00 0.31 H new ATOM 0 HD21 LEU D 348 -2.085 -5.136 2.273 1.00 0.22 H new ATOM 0 HD22 LEU D 348 -2.449 -6.729 1.568 1.00 0.22 H new ATOM 0 HD23 LEU D 348 -3.763 -5.569 1.871 1.00 0.22 H new ATOM 2625 N GLU D 349 -5.459 -10.164 2.595 1.00 0.20 N ATOM 2626 CA GLU D 349 -6.333 -11.339 2.868 1.00 0.21 C ATOM 2627 C GLU D 349 -5.609 -12.625 2.467 1.00 0.19 C ATOM 2628 O GLU D 349 -5.827 -13.674 3.040 1.00 0.21 O ATOM 2629 CB GLU D 349 -7.632 -11.208 2.067 1.00 0.22 C ATOM 2630 CG GLU D 349 -8.519 -10.133 2.703 1.00 0.28 C ATOM 2631 CD GLU D 349 -9.593 -10.799 3.566 1.00 1.21 C ATOM 2632 OE1 GLU D 349 -9.231 -11.477 4.512 1.00 1.95 O ATOM 2633 OE2 GLU D 349 -10.763 -10.615 3.266 1.00 1.91 O ATOM 0 H GLU D 349 -5.861 -9.457 1.979 1.00 0.20 H new ATOM 0 HA GLU D 349 -6.566 -11.376 3.932 1.00 0.21 H new ATOM 0 HB2 GLU D 349 -7.409 -10.945 1.033 1.00 0.22 H new ATOM 0 HB3 GLU D 349 -8.157 -12.163 2.047 1.00 0.22 H new ATOM 0 HG2 GLU D 349 -7.914 -9.461 3.312 1.00 0.28 H new ATOM 0 HG3 GLU D 349 -8.986 -9.526 1.927 1.00 0.28 H new ATOM 2640 N LEU D 350 -4.749 -12.554 1.491 1.00 0.19 N ATOM 2641 CA LEU D 350 -4.014 -13.774 1.059 1.00 0.21 C ATOM 2642 C LEU D 350 -3.104 -14.248 2.196 1.00 0.22 C ATOM 2643 O LEU D 350 -3.054 -15.418 2.518 1.00 0.28 O ATOM 2644 CB LEU D 350 -3.170 -13.455 -0.179 1.00 0.24 C ATOM 2645 CG LEU D 350 -2.833 -14.754 -0.911 1.00 0.29 C ATOM 2646 CD1 LEU D 350 -2.142 -14.433 -2.237 1.00 0.43 C ATOM 2647 CD2 LEU D 350 -1.899 -15.600 -0.045 1.00 0.38 C ATOM 0 H LEU D 350 -4.523 -11.704 0.974 1.00 0.19 H new ATOM 0 HA LEU D 350 -4.727 -14.561 0.813 1.00 0.21 H new ATOM 0 HB2 LEU D 350 -3.715 -12.782 -0.841 1.00 0.24 H new ATOM 0 HB3 LEU D 350 -2.254 -12.941 0.114 1.00 0.24 H new ATOM 0 HG LEU D 350 -3.752 -15.307 -1.105 1.00 0.29 H new ATOM 0 HD11 LEU D 350 -1.903 -15.361 -2.757 1.00 0.43 H new ATOM 0 HD12 LEU D 350 -2.806 -13.831 -2.857 1.00 0.43 H new ATOM 0 HD13 LEU D 350 -1.224 -13.878 -2.044 1.00 0.43 H new ATOM 0 HD21 LEU D 350 -1.659 -16.526 -0.567 1.00 0.38 H new ATOM 0 HD22 LEU D 350 -0.982 -15.045 0.150 1.00 0.38 H new ATOM 0 HD23 LEU D 350 -2.390 -15.833 0.900 1.00 0.38 H new ATOM 2659 N LYS D 351 -2.386 -13.342 2.803 1.00 0.22 N ATOM 2660 CA LYS D 351 -1.476 -13.726 3.921 1.00 0.24 C ATOM 2661 C LYS D 351 -2.290 -14.359 5.050 1.00 0.28 C ATOM 2662 O LYS D 351 -1.981 -15.434 5.524 1.00 0.33 O ATOM 2663 CB LYS D 351 -0.765 -12.477 4.445 1.00 0.25 C ATOM 2664 CG LYS D 351 0.298 -12.881 5.468 1.00 0.28 C ATOM 2665 CD LYS D 351 1.016 -11.631 5.981 1.00 0.30 C ATOM 2666 CE LYS D 351 2.481 -11.966 6.263 1.00 0.35 C ATOM 2667 NZ LYS D 351 3.070 -10.929 7.158 1.00 1.40 N ATOM 0 H LYS D 351 -2.390 -12.349 2.572 1.00 0.22 H new ATOM 0 HA LYS D 351 -0.739 -14.444 3.560 1.00 0.24 H new ATOM 0 HB2 LYS D 351 -0.302 -11.937 3.619 1.00 0.25 H new ATOM 0 HB3 LYS D 351 -1.487 -11.801 4.904 1.00 0.25 H new ATOM 0 HG2 LYS D 351 -0.166 -13.413 6.299 1.00 0.28 H new ATOM 0 HG3 LYS D 351 1.015 -13.564 5.012 1.00 0.28 H new ATOM 0 HD2 LYS D 351 0.950 -10.832 5.243 1.00 0.30 H new ATOM 0 HD3 LYS D 351 0.533 -11.268 6.888 1.00 0.30 H new ATOM 0 HE2 LYS D 351 2.556 -12.948 6.730 1.00 0.35 H new ATOM 0 HE3 LYS D 351 3.040 -12.013 5.328 1.00 0.35 H new ATOM 0 HZ1 LYS D 351 4.066 -11.160 7.348 1.00 1.40 H new ATOM 0 HZ2 LYS D 351 3.012 -9.999 6.697 1.00 1.40 H new ATOM 0 HZ3 LYS D 351 2.543 -10.904 8.054 1.00 1.40 H new ATOM 2681 N ASP D 352 -3.326 -13.699 5.485 1.00 0.29 N ATOM 2682 CA ASP D 352 -4.156 -14.264 6.584 1.00 0.36 C ATOM 2683 C ASP D 352 -4.633 -15.662 6.192 1.00 0.39 C ATOM 2684 O ASP D 352 -4.698 -16.560 7.009 1.00 0.47 O ATOM 2685 CB ASP D 352 -5.368 -13.363 6.829 1.00 0.40 C ATOM 2686 CG ASP D 352 -4.897 -12.005 7.353 1.00 0.44 C ATOM 2687 OD1 ASP D 352 -4.134 -11.992 8.305 1.00 1.17 O ATOM 2688 OD2 ASP D 352 -5.309 -11.001 6.796 1.00 1.08 O ATOM 0 H ASP D 352 -3.634 -12.794 5.128 1.00 0.29 H new ATOM 0 HA ASP D 352 -3.560 -14.323 7.494 1.00 0.36 H new ATOM 0 HB2 ASP D 352 -5.930 -13.233 5.904 1.00 0.40 H new ATOM 0 HB3 ASP D 352 -6.041 -13.829 7.549 1.00 0.40 H new ATOM 2693 N ALA D 353 -4.967 -15.858 4.945 1.00 0.37 N ATOM 2694 CA ALA D 353 -5.439 -17.200 4.506 1.00 0.44 C ATOM 2695 C ALA D 353 -4.301 -18.213 4.643 1.00 0.49 C ATOM 2696 O ALA D 353 -4.517 -19.363 4.968 1.00 0.59 O ATOM 2697 CB ALA D 353 -5.892 -17.133 3.046 1.00 0.44 C ATOM 0 H ALA D 353 -4.933 -15.148 4.214 1.00 0.37 H new ATOM 0 HA ALA D 353 -6.277 -17.510 5.130 1.00 0.44 H new ATOM 0 HB1 ALA D 353 -6.237 -18.116 2.727 1.00 0.44 H new ATOM 0 HB2 ALA D 353 -6.706 -16.414 2.950 1.00 0.44 H new ATOM 0 HB3 ALA D 353 -5.056 -16.821 2.420 1.00 0.44 H new ATOM 2703 N GLN D 354 -3.090 -17.797 4.401 1.00 0.45 N ATOM 2704 CA GLN D 354 -1.943 -18.738 4.517 1.00 0.53 C ATOM 2705 C GLN D 354 -1.497 -18.825 5.980 1.00 0.58 C ATOM 2706 O GLN D 354 -0.718 -19.678 6.352 1.00 0.73 O ATOM 2707 CB GLN D 354 -0.787 -18.230 3.658 1.00 0.50 C ATOM 2708 CG GLN D 354 0.011 -19.421 3.119 1.00 1.12 C ATOM 2709 CD GLN D 354 1.049 -18.923 2.113 1.00 1.06 C ATOM 2710 OE1 GLN D 354 1.565 -17.735 2.268 1.00 1.44 O flip ATOM 2711 NE2 GLN D 354 1.394 -19.619 1.180 1.00 0.70 N flip ATOM 0 H GLN D 354 -2.845 -16.845 4.128 1.00 0.45 H new ATOM 0 HA GLN D 354 -2.245 -19.728 4.174 1.00 0.53 H new ATOM 0 HB2 GLN D 354 -1.170 -17.631 2.832 1.00 0.50 H new ATOM 0 HB3 GLN D 354 -0.139 -17.582 4.248 1.00 0.50 H new ATOM 0 HG2 GLN D 354 0.504 -19.943 3.939 1.00 1.12 H new ATOM 0 HG3 GLN D 354 -0.659 -20.136 2.643 1.00 1.12 H new ATOM 0 HE21 GLN D 354 0.990 -20.548 1.060 1.00 0.70 H new ATOM 0 HE22 GLN D 354 2.088 -19.275 0.516 1.00 0.70 H new