USER MOD reduce.3.24.130724 H: found=0, std=0, add=461, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 462 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 276 HIS : no HD1:sc= -17.8! C(o=-25!,f=-28!) USER MOD Set 1.2: A 279 GLN : amide:sc= -7.42! C(o=-25!,f=-26!) USER MOD Set 2.1: A 238 GLN : amide:sc= -0.194 K(o=-2.6,f=-4.8!) USER MOD Set 2.2: A 240 GLN : amide:sc= -2.38 K(o=-2.6,f=-6.6!) USER MOD Single : A 242 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 243 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 244 MET CE :methyl 156:sc= -5.73! (180deg=-6.22!) USER MOD Single : A 246 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 249 GLN : amide:sc= -1.59! C(o=-1.6!,f=-2.2!) USER MOD Single : A 250 GLN : amide:sc= 0 X(o=0,f=0.043) USER MOD Single : A 251 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 260 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.0065) USER MOD Single : A 261 GLN : amide:sc= 0 X(o=0,f=-0.091) USER MOD Single : A 264 GLN : amide:sc= -0.207 K(o=-0.21,f=-1.3!) USER MOD Single : A 266 ASN : amide:sc= -1.11 K(o=-1.1,f=0.21) USER MOD Single : A 268 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 271 GLN : amide:sc= -0.888! C(o=-0.89!,f=-2!) USER MOD Single : A 272 GLN : amide:sc= -0.92 K(o=-0.92,f=-1.9!) USER MOD Single : A 274 SER OG : rot 180:sc= 0 USER MOD Single : A 277 GLN : amide:sc= -0.569 X(o=-0.57,f=-0.67) USER MOD Single : A 282 GLN : amide:sc= -0.0839 X(o=-0.084,f=-0.39) USER MOD Single : A 283 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 285 ASN : amide:sc= -0.19 K(o=-0.19,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 29 N LEU A 232 -0.227 -3.760 -13.025 1.00 0.00 N ATOM 30 CA LEU A 232 0.309 -2.541 -12.431 1.00 0.00 C ATOM 31 C LEU A 232 1.348 -1.900 -13.342 1.00 0.00 C ATOM 32 O LEU A 232 2.195 -1.133 -12.887 1.00 0.00 O ATOM 33 CB LEU A 232 0.923 -2.835 -11.060 1.00 0.00 C ATOM 34 CG LEU A 232 0.037 -3.653 -10.118 1.00 0.00 C ATOM 35 CD1 LEU A 232 0.882 -4.592 -9.271 1.00 0.00 C ATOM 36 CD2 LEU A 232 -0.789 -2.732 -9.232 1.00 0.00 C ATOM 0 HA LEU A 232 -0.516 -1.841 -12.304 1.00 0.00 H new ATOM 0 HB2 LEU A 232 1.862 -3.368 -11.206 1.00 0.00 H new ATOM 0 HB3 LEU A 232 1.165 -1.889 -10.576 1.00 0.00 H new ATOM 0 HG LEU A 232 -0.644 -4.254 -10.720 1.00 0.00 H new ATOM 0 HD11 LEU A 232 0.235 -5.165 -8.607 1.00 0.00 H new ATOM 0 HD12 LEU A 232 1.431 -5.274 -9.921 1.00 0.00 H new ATOM 0 HD13 LEU A 232 1.587 -4.011 -8.677 1.00 0.00 H new ATOM 0 HD21 LEU A 232 -1.414 -3.330 -8.568 1.00 0.00 H new ATOM 0 HD22 LEU A 232 -0.124 -2.106 -8.638 1.00 0.00 H new ATOM 0 HD23 LEU A 232 -1.422 -2.100 -9.855 1.00 0.00 H new ATOM 48 N GLU A 233 1.277 -2.212 -14.632 1.00 0.00 N ATOM 49 CA GLU A 233 2.214 -1.652 -15.597 1.00 0.00 C ATOM 50 C GLU A 233 2.455 -0.176 -15.305 1.00 0.00 C ATOM 51 O GLU A 233 3.599 0.270 -15.197 1.00 0.00 O ATOM 52 CB GLU A 233 1.686 -1.828 -17.023 1.00 0.00 C ATOM 53 CG GLU A 233 0.613 -0.822 -17.408 1.00 0.00 C ATOM 54 CD GLU A 233 0.161 -0.976 -18.848 1.00 0.00 C ATOM 55 OE1 GLU A 233 0.973 -1.434 -19.679 1.00 0.00 O ATOM 56 OE2 GLU A 233 -1.005 -0.639 -19.144 1.00 0.00 O ATOM 0 H GLU A 233 0.584 -2.846 -15.031 1.00 0.00 H new ATOM 0 HA GLU A 233 3.160 -2.187 -15.509 1.00 0.00 H new ATOM 0 HB2 GLU A 233 2.518 -1.743 -17.722 1.00 0.00 H new ATOM 0 HB3 GLU A 233 1.282 -2.835 -17.129 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -0.245 -0.940 -16.747 1.00 0.00 H new ATOM 0 HG3 GLU A 233 0.995 0.188 -17.257 1.00 0.00 H new ATOM 63 N PHE A 234 1.369 0.576 -15.164 1.00 0.00 N ATOM 64 CA PHE A 234 1.463 2.001 -14.874 1.00 0.00 C ATOM 65 C PHE A 234 1.814 2.219 -13.409 1.00 0.00 C ATOM 66 O PHE A 234 2.574 3.126 -13.068 1.00 0.00 O ATOM 67 CB PHE A 234 0.152 2.707 -15.213 1.00 0.00 C ATOM 68 CG PHE A 234 -1.062 1.896 -14.874 1.00 0.00 C ATOM 69 CD1 PHE A 234 -1.643 1.992 -13.622 1.00 0.00 C ATOM 70 CD2 PHE A 234 -1.616 1.033 -15.806 1.00 0.00 C ATOM 71 CE1 PHE A 234 -2.757 1.243 -13.304 1.00 0.00 C ATOM 72 CE2 PHE A 234 -2.729 0.280 -15.492 1.00 0.00 C ATOM 73 CZ PHE A 234 -3.300 0.386 -14.240 1.00 0.00 C ATOM 0 H PHE A 234 0.416 0.223 -15.246 1.00 0.00 H new ATOM 0 HA PHE A 234 2.254 2.426 -15.492 1.00 0.00 H new ATOM 0 HB2 PHE A 234 0.109 3.655 -14.677 1.00 0.00 H new ATOM 0 HB3 PHE A 234 0.138 2.942 -16.277 1.00 0.00 H new ATOM 0 HD1 PHE A 234 -1.220 2.660 -12.886 1.00 0.00 H new ATOM 0 HD2 PHE A 234 -1.173 0.949 -16.787 1.00 0.00 H new ATOM 0 HE1 PHE A 234 -3.204 1.327 -12.324 1.00 0.00 H new ATOM 0 HE2 PHE A 234 -3.152 -0.391 -16.225 1.00 0.00 H new ATOM 0 HZ PHE A 234 -4.172 -0.202 -13.993 1.00 0.00 H new ATOM 83 N LEU A 235 1.262 1.371 -12.548 1.00 0.00 N ATOM 84 CA LEU A 235 1.521 1.456 -11.117 1.00 0.00 C ATOM 85 C LEU A 235 3.009 1.263 -10.838 1.00 0.00 C ATOM 86 O LEU A 235 3.623 2.039 -10.105 1.00 0.00 O ATOM 87 CB LEU A 235 0.707 0.394 -10.371 1.00 0.00 C ATOM 88 CG LEU A 235 -0.418 0.933 -9.491 1.00 0.00 C ATOM 89 CD1 LEU A 235 0.106 1.300 -8.113 1.00 0.00 C ATOM 90 CD2 LEU A 235 -1.080 2.131 -10.152 1.00 0.00 C ATOM 0 H LEU A 235 0.631 0.616 -12.818 1.00 0.00 H new ATOM 0 HA LEU A 235 1.222 2.443 -10.765 1.00 0.00 H new ATOM 0 HB2 LEU A 235 0.278 -0.291 -11.102 1.00 0.00 H new ATOM 0 HB3 LEU A 235 1.386 -0.189 -9.748 1.00 0.00 H new ATOM 0 HG LEU A 235 -1.166 0.150 -9.370 1.00 0.00 H new ATOM 0 HD11 LEU A 235 -0.712 1.682 -7.502 1.00 0.00 H new ATOM 0 HD12 LEU A 235 0.531 0.416 -7.638 1.00 0.00 H new ATOM 0 HD13 LEU A 235 0.876 2.066 -8.208 1.00 0.00 H new ATOM 0 HD21 LEU A 235 -1.880 2.504 -9.512 1.00 0.00 H new ATOM 0 HD22 LEU A 235 -0.341 2.917 -10.304 1.00 0.00 H new ATOM 0 HD23 LEU A 235 -1.495 1.832 -11.115 1.00 0.00 H new ATOM 102 N ARG A 236 3.580 0.222 -11.438 1.00 0.00 N ATOM 103 CA ARG A 236 4.995 -0.082 -11.270 1.00 0.00 C ATOM 104 C ARG A 236 5.859 0.966 -11.961 1.00 0.00 C ATOM 105 O ARG A 236 6.966 1.267 -11.513 1.00 0.00 O ATOM 106 CB ARG A 236 5.308 -1.473 -11.829 1.00 0.00 C ATOM 107 CG ARG A 236 4.631 -2.600 -11.066 1.00 0.00 C ATOM 108 CD ARG A 236 4.320 -3.782 -11.971 1.00 0.00 C ATOM 109 NE ARG A 236 5.532 -4.398 -12.505 1.00 0.00 N ATOM 110 CZ ARG A 236 5.525 -5.350 -13.431 1.00 0.00 C ATOM 111 NH1 ARG A 236 4.376 -5.793 -13.923 1.00 0.00 N ATOM 112 NH2 ARG A 236 6.669 -5.861 -13.868 1.00 0.00 N ATOM 0 H ARG A 236 3.081 -0.426 -12.047 1.00 0.00 H new ATOM 0 HA ARG A 236 5.223 -0.068 -10.204 1.00 0.00 H new ATOM 0 HB2 ARG A 236 4.998 -1.514 -12.873 1.00 0.00 H new ATOM 0 HB3 ARG A 236 6.387 -1.629 -11.810 1.00 0.00 H new ATOM 0 HG2 ARG A 236 5.276 -2.926 -10.250 1.00 0.00 H new ATOM 0 HG3 ARG A 236 3.708 -2.233 -10.616 1.00 0.00 H new ATOM 0 HD2 ARG A 236 3.751 -4.526 -11.413 1.00 0.00 H new ATOM 0 HD3 ARG A 236 3.689 -3.451 -12.795 1.00 0.00 H new ATOM 0 HE ARG A 236 6.433 -4.080 -12.147 1.00 0.00 H new ATOM 0 HH11 ARG A 236 3.494 -5.402 -13.590 1.00 0.00 H new ATOM 0 HH12 ARG A 236 4.374 -6.524 -14.634 1.00 0.00 H new ATOM 0 HH21 ARG A 236 7.555 -5.523 -13.493 1.00 0.00 H new ATOM 0 HH22 ARG A 236 6.662 -6.592 -14.579 1.00 0.00 H new ATOM 126 N ASP A 237 5.347 1.519 -13.057 1.00 0.00 N ATOM 127 CA ASP A 237 6.074 2.534 -13.810 1.00 0.00 C ATOM 128 C ASP A 237 5.999 3.886 -13.109 1.00 0.00 C ATOM 129 O ASP A 237 7.013 4.559 -12.926 1.00 0.00 O ATOM 130 CB ASP A 237 5.509 2.651 -15.227 1.00 0.00 C ATOM 131 CG ASP A 237 6.122 3.802 -16.000 1.00 0.00 C ATOM 132 OD1 ASP A 237 7.366 3.904 -16.027 1.00 0.00 O ATOM 133 OD2 ASP A 237 5.357 4.603 -16.577 1.00 0.00 O ATOM 0 H ASP A 237 4.433 1.281 -13.442 1.00 0.00 H new ATOM 0 HA ASP A 237 7.119 2.230 -13.867 1.00 0.00 H new ATOM 0 HB2 ASP A 237 5.688 1.720 -15.765 1.00 0.00 H new ATOM 0 HB3 ASP A 237 4.429 2.787 -15.175 1.00 0.00 H new ATOM 138 N GLN A 238 4.790 4.276 -12.717 1.00 0.00 N ATOM 139 CA GLN A 238 4.581 5.549 -12.035 1.00 0.00 C ATOM 140 C GLN A 238 4.976 5.452 -10.565 1.00 0.00 C ATOM 141 O GLN A 238 5.248 4.365 -10.055 1.00 0.00 O ATOM 142 CB GLN A 238 3.120 5.985 -12.157 1.00 0.00 C ATOM 143 CG GLN A 238 2.898 7.098 -13.169 1.00 0.00 C ATOM 144 CD GLN A 238 1.713 7.976 -12.819 1.00 0.00 C ATOM 145 OE1 GLN A 238 1.216 7.949 -11.693 1.00 0.00 O ATOM 146 NE2 GLN A 238 1.251 8.761 -13.787 1.00 0.00 N ATOM 0 H GLN A 238 3.941 3.729 -12.860 1.00 0.00 H new ATOM 0 HA GLN A 238 5.215 6.296 -12.513 1.00 0.00 H new ATOM 0 HB2 GLN A 238 2.515 5.123 -12.439 1.00 0.00 H new ATOM 0 HB3 GLN A 238 2.766 6.317 -11.181 1.00 0.00 H new ATOM 0 HG2 GLN A 238 3.796 7.713 -13.230 1.00 0.00 H new ATOM 0 HG3 GLN A 238 2.743 6.661 -14.156 1.00 0.00 H new ATOM 0 HE21 GLN A 238 1.693 8.752 -14.706 1.00 0.00 H new ATOM 0 HE22 GLN A 238 0.454 9.373 -13.611 1.00 0.00 H new ATOM 155 N PRO A 239 5.011 6.595 -9.862 1.00 0.00 N ATOM 156 CA PRO A 239 5.374 6.647 -8.443 1.00 0.00 C ATOM 157 C PRO A 239 4.219 6.254 -7.527 1.00 0.00 C ATOM 158 O PRO A 239 4.272 6.479 -6.318 1.00 0.00 O ATOM 159 CB PRO A 239 5.732 8.117 -8.242 1.00 0.00 C ATOM 160 CG PRO A 239 4.856 8.842 -9.203 1.00 0.00 C ATOM 161 CD PRO A 239 4.704 7.935 -10.399 1.00 0.00 C ATOM 0 HA PRO A 239 6.175 5.950 -8.197 1.00 0.00 H new ATOM 0 HB2 PRO A 239 5.546 8.435 -7.216 1.00 0.00 H new ATOM 0 HB3 PRO A 239 6.786 8.302 -8.447 1.00 0.00 H new ATOM 0 HG2 PRO A 239 3.887 9.063 -8.756 1.00 0.00 H new ATOM 0 HG3 PRO A 239 5.299 9.795 -9.491 1.00 0.00 H new ATOM 0 HD2 PRO A 239 3.696 7.980 -10.810 1.00 0.00 H new ATOM 0 HD3 PRO A 239 5.388 8.212 -11.201 1.00 0.00 H new ATOM 169 N GLN A 240 3.177 5.668 -8.108 1.00 0.00 N ATOM 170 CA GLN A 240 2.014 5.250 -7.336 1.00 0.00 C ATOM 171 C GLN A 240 2.438 4.598 -6.025 1.00 0.00 C ATOM 172 O GLN A 240 1.908 4.918 -4.962 1.00 0.00 O ATOM 173 CB GLN A 240 1.158 4.278 -8.150 1.00 0.00 C ATOM 174 CG GLN A 240 -0.203 4.840 -8.531 1.00 0.00 C ATOM 175 CD GLN A 240 -0.225 5.411 -9.935 1.00 0.00 C ATOM 176 OE1 GLN A 240 0.756 5.315 -10.673 1.00 0.00 O ATOM 177 NE2 GLN A 240 -1.349 6.011 -10.311 1.00 0.00 N ATOM 0 H GLN A 240 3.115 5.473 -9.107 1.00 0.00 H new ATOM 0 HA GLN A 240 1.424 6.137 -7.105 1.00 0.00 H new ATOM 0 HB2 GLN A 240 1.696 4.005 -9.058 1.00 0.00 H new ATOM 0 HB3 GLN A 240 1.016 3.363 -7.576 1.00 0.00 H new ATOM 0 HG2 GLN A 240 -0.953 4.053 -8.451 1.00 0.00 H new ATOM 0 HG3 GLN A 240 -0.482 5.619 -7.821 1.00 0.00 H new ATOM 0 HE21 GLN A 240 -2.137 6.067 -9.666 1.00 0.00 H new ATOM 0 HE22 GLN A 240 -1.424 6.415 -11.244 1.00 0.00 H new ATOM 186 N PHE A 241 3.401 3.682 -6.106 1.00 0.00 N ATOM 187 CA PHE A 241 3.895 2.992 -4.920 1.00 0.00 C ATOM 188 C PHE A 241 4.547 3.979 -3.959 1.00 0.00 C ATOM 189 O PHE A 241 4.216 4.019 -2.773 1.00 0.00 O ATOM 190 CB PHE A 241 4.895 1.901 -5.307 1.00 0.00 C ATOM 191 CG PHE A 241 5.740 2.260 -6.493 1.00 0.00 C ATOM 192 CD1 PHE A 241 6.933 2.942 -6.326 1.00 0.00 C ATOM 193 CD2 PHE A 241 5.338 1.919 -7.773 1.00 0.00 C ATOM 194 CE1 PHE A 241 7.711 3.279 -7.415 1.00 0.00 C ATOM 195 CE2 PHE A 241 6.112 2.252 -8.865 1.00 0.00 C ATOM 196 CZ PHE A 241 7.299 2.932 -8.686 1.00 0.00 C ATOM 0 H PHE A 241 3.852 3.402 -6.977 1.00 0.00 H new ATOM 0 HA PHE A 241 3.045 2.526 -4.422 1.00 0.00 H new ATOM 0 HB2 PHE A 241 5.545 1.696 -4.456 1.00 0.00 H new ATOM 0 HB3 PHE A 241 4.352 0.981 -5.522 1.00 0.00 H new ATOM 0 HD1 PHE A 241 7.259 3.213 -5.333 1.00 0.00 H new ATOM 0 HD2 PHE A 241 4.409 1.387 -7.918 1.00 0.00 H new ATOM 0 HE1 PHE A 241 8.639 3.813 -7.273 1.00 0.00 H new ATOM 0 HE2 PHE A 241 5.789 1.981 -9.859 1.00 0.00 H new ATOM 0 HZ PHE A 241 7.906 3.193 -9.540 1.00 0.00 H new ATOM 206 N GLN A 242 5.471 4.780 -4.480 1.00 0.00 N ATOM 207 CA GLN A 242 6.166 5.774 -3.673 1.00 0.00 C ATOM 208 C GLN A 242 5.171 6.755 -3.063 1.00 0.00 C ATOM 209 O GLN A 242 5.153 6.963 -1.850 1.00 0.00 O ATOM 210 CB GLN A 242 7.188 6.528 -4.525 1.00 0.00 C ATOM 211 CG GLN A 242 8.601 5.983 -4.409 1.00 0.00 C ATOM 212 CD GLN A 242 9.631 6.895 -5.044 1.00 0.00 C ATOM 213 OE1 GLN A 242 10.252 7.716 -4.368 1.00 0.00 O ATOM 214 NE2 GLN A 242 9.819 6.755 -6.351 1.00 0.00 N ATOM 0 H GLN A 242 5.755 4.759 -5.459 1.00 0.00 H new ATOM 0 HA GLN A 242 6.689 5.259 -2.867 1.00 0.00 H new ATOM 0 HB2 GLN A 242 6.877 6.488 -5.569 1.00 0.00 H new ATOM 0 HB3 GLN A 242 7.188 7.578 -4.232 1.00 0.00 H new ATOM 0 HG2 GLN A 242 8.846 5.841 -3.357 1.00 0.00 H new ATOM 0 HG3 GLN A 242 8.648 5.002 -4.882 1.00 0.00 H new ATOM 0 HE21 GLN A 242 9.282 6.062 -6.872 1.00 0.00 H new ATOM 0 HE22 GLN A 242 10.500 7.341 -6.834 1.00 0.00 H new ATOM 223 N ASN A 243 4.340 7.349 -3.913 1.00 0.00 N ATOM 224 CA ASN A 243 3.335 8.302 -3.457 1.00 0.00 C ATOM 225 C ASN A 243 2.584 7.747 -2.251 1.00 0.00 C ATOM 226 O ASN A 243 2.605 8.334 -1.168 1.00 0.00 O ATOM 227 CB ASN A 243 2.353 8.620 -4.584 1.00 0.00 C ATOM 228 CG ASN A 243 2.518 10.031 -5.113 1.00 0.00 C ATOM 229 OD1 ASN A 243 3.250 10.265 -6.074 1.00 0.00 O ATOM 230 ND2 ASN A 243 1.834 10.981 -4.485 1.00 0.00 N ATOM 0 H ASN A 243 4.343 7.187 -4.920 1.00 0.00 H new ATOM 0 HA ASN A 243 3.841 9.221 -3.162 1.00 0.00 H new ATOM 0 HB2 ASN A 243 2.497 7.910 -5.399 1.00 0.00 H new ATOM 0 HB3 ASN A 243 1.333 8.487 -4.222 1.00 0.00 H new ATOM 0 HD21 ASN A 243 1.904 11.950 -4.796 1.00 0.00 H new ATOM 0 HD22 ASN A 243 1.239 10.741 -3.692 1.00 0.00 H new ATOM 237 N MET A 244 1.930 6.606 -2.446 1.00 0.00 N ATOM 238 CA MET A 244 1.181 5.964 -1.373 1.00 0.00 C ATOM 239 C MET A 244 2.072 5.752 -0.158 1.00 0.00 C ATOM 240 O MET A 244 1.859 6.350 0.893 1.00 0.00 O ATOM 241 CB MET A 244 0.618 4.617 -1.842 1.00 0.00 C ATOM 242 CG MET A 244 -0.307 4.731 -3.040 1.00 0.00 C ATOM 243 SD MET A 244 -0.175 3.323 -4.158 1.00 0.00 S ATOM 244 CE MET A 244 -1.033 3.953 -5.598 1.00 0.00 C ATOM 0 H MET A 244 1.904 6.108 -3.336 1.00 0.00 H new ATOM 0 HA MET A 244 0.353 6.617 -1.098 1.00 0.00 H new ATOM 0 HB2 MET A 244 1.446 3.954 -2.094 1.00 0.00 H new ATOM 0 HB3 MET A 244 0.077 4.152 -1.018 1.00 0.00 H new ATOM 0 HG2 MET A 244 -1.336 4.818 -2.692 1.00 0.00 H new ATOM 0 HG3 MET A 244 -0.077 5.646 -3.586 1.00 0.00 H new ATOM 0 HE1 MET A 244 -0.691 3.422 -6.487 1.00 0.00 H new ATOM 0 HE2 MET A 244 -2.106 3.803 -5.477 1.00 0.00 H new ATOM 0 HE3 MET A 244 -0.825 5.017 -5.708 1.00 0.00 H new ATOM 254 N ARG A 245 3.074 4.898 -0.316 1.00 0.00 N ATOM 255 CA ARG A 245 3.999 4.593 0.767 1.00 0.00 C ATOM 256 C ARG A 245 4.251 5.813 1.643 1.00 0.00 C ATOM 257 O ARG A 245 4.333 5.694 2.860 1.00 0.00 O ATOM 258 CB ARG A 245 5.329 4.089 0.204 1.00 0.00 C ATOM 259 CG ARG A 245 5.240 2.730 -0.468 1.00 0.00 C ATOM 260 CD ARG A 245 6.161 2.648 -1.672 1.00 0.00 C ATOM 261 NE ARG A 245 7.523 2.279 -1.295 1.00 0.00 N ATOM 262 CZ ARG A 245 8.606 2.654 -1.971 1.00 0.00 C ATOM 263 NH1 ARG A 245 8.488 3.405 -3.059 1.00 0.00 N ATOM 264 NH2 ARG A 245 9.809 2.278 -1.559 1.00 0.00 N ATOM 0 H ARG A 245 3.267 4.403 -1.186 1.00 0.00 H new ATOM 0 HA ARG A 245 3.542 3.815 1.379 1.00 0.00 H new ATOM 0 HB2 ARG A 245 5.705 4.815 -0.517 1.00 0.00 H new ATOM 0 HB3 ARG A 245 6.057 4.036 1.013 1.00 0.00 H new ATOM 0 HG2 ARG A 245 5.503 1.951 0.247 1.00 0.00 H new ATOM 0 HG3 ARG A 245 4.213 2.543 -0.780 1.00 0.00 H new ATOM 0 HD2 ARG A 245 5.770 1.916 -2.379 1.00 0.00 H new ATOM 0 HD3 ARG A 245 6.175 3.610 -2.184 1.00 0.00 H new ATOM 0 HE ARG A 245 7.651 1.700 -0.465 1.00 0.00 H new ATOM 0 HH11 ARG A 245 7.565 3.697 -3.380 1.00 0.00 H new ATOM 0 HH12 ARG A 245 9.321 3.690 -3.574 1.00 0.00 H new ATOM 0 HH21 ARG A 245 9.905 1.701 -0.723 1.00 0.00 H new ATOM 0 HH22 ARG A 245 10.639 2.566 -2.078 1.00 0.00 H new ATOM 278 N GLN A 246 4.385 6.980 1.025 1.00 0.00 N ATOM 279 CA GLN A 246 4.646 8.208 1.769 1.00 0.00 C ATOM 280 C GLN A 246 3.437 8.648 2.594 1.00 0.00 C ATOM 281 O GLN A 246 3.478 8.629 3.825 1.00 0.00 O ATOM 282 CB GLN A 246 5.054 9.329 0.814 1.00 0.00 C ATOM 283 CG GLN A 246 6.402 9.100 0.148 1.00 0.00 C ATOM 284 CD GLN A 246 6.743 10.177 -0.863 1.00 0.00 C ATOM 285 OE1 GLN A 246 5.876 10.934 -1.297 1.00 0.00 O ATOM 286 NE2 GLN A 246 8.014 10.248 -1.244 1.00 0.00 N ATOM 0 H GLN A 246 4.318 7.103 0.015 1.00 0.00 H new ATOM 0 HA GLN A 246 5.463 7.999 2.460 1.00 0.00 H new ATOM 0 HB2 GLN A 246 4.290 9.434 0.043 1.00 0.00 H new ATOM 0 HB3 GLN A 246 5.085 10.270 1.363 1.00 0.00 H new ATOM 0 HG2 GLN A 246 7.179 9.064 0.912 1.00 0.00 H new ATOM 0 HG3 GLN A 246 6.398 8.129 -0.348 1.00 0.00 H new ATOM 0 HE21 GLN A 246 8.699 9.599 -0.857 1.00 0.00 H new ATOM 0 HE22 GLN A 246 8.304 10.952 -1.923 1.00 0.00 H new ATOM 295 N VAL A 247 2.371 9.054 1.913 1.00 0.00 N ATOM 296 CA VAL A 247 1.162 9.511 2.592 1.00 0.00 C ATOM 297 C VAL A 247 0.794 8.592 3.754 1.00 0.00 C ATOM 298 O VAL A 247 0.511 9.052 4.860 1.00 0.00 O ATOM 299 CB VAL A 247 -0.031 9.595 1.621 1.00 0.00 C ATOM 300 CG1 VAL A 247 0.387 10.259 0.318 1.00 0.00 C ATOM 301 CG2 VAL A 247 -0.614 8.214 1.359 1.00 0.00 C ATOM 0 H VAL A 247 2.318 9.076 0.895 1.00 0.00 H new ATOM 0 HA VAL A 247 1.379 10.507 2.979 1.00 0.00 H new ATOM 0 HB VAL A 247 -0.806 10.206 2.084 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -0.469 10.310 -0.355 1.00 0.00 H new ATOM 0 HG12 VAL A 247 0.748 11.267 0.523 1.00 0.00 H new ATOM 0 HG13 VAL A 247 1.182 9.677 -0.148 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -1.455 8.299 0.671 1.00 0.00 H new ATOM 0 HG22 VAL A 247 0.151 7.573 0.920 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -0.956 7.779 2.298 1.00 0.00 H new ATOM 311 N ILE A 248 0.798 7.293 3.489 1.00 0.00 N ATOM 312 CA ILE A 248 0.460 6.299 4.502 1.00 0.00 C ATOM 313 C ILE A 248 1.617 6.065 5.470 1.00 0.00 C ATOM 314 O ILE A 248 1.401 5.707 6.627 1.00 0.00 O ATOM 315 CB ILE A 248 0.035 4.951 3.872 1.00 0.00 C ATOM 316 CG1 ILE A 248 0.680 4.762 2.502 1.00 0.00 C ATOM 317 CG2 ILE A 248 -1.478 4.886 3.745 1.00 0.00 C ATOM 318 CD1 ILE A 248 0.469 3.387 1.916 1.00 0.00 C ATOM 0 H ILE A 248 1.032 6.900 2.577 1.00 0.00 H new ATOM 0 HA ILE A 248 -0.387 6.705 5.055 1.00 0.00 H new ATOM 0 HB ILE A 248 0.375 4.148 4.526 1.00 0.00 H new ATOM 0 HG12 ILE A 248 0.277 5.506 1.815 1.00 0.00 H new ATOM 0 HG13 ILE A 248 1.750 4.952 2.585 1.00 0.00 H new ATOM 0 HG21 ILE A 248 -1.765 3.933 3.300 1.00 0.00 H new ATOM 0 HG22 ILE A 248 -1.930 4.977 4.733 1.00 0.00 H new ATOM 0 HG23 ILE A 248 -1.825 5.702 3.111 1.00 0.00 H new ATOM 0 HD11 ILE A 248 0.956 3.328 0.942 1.00 0.00 H new ATOM 0 HD12 ILE A 248 0.897 2.638 2.582 1.00 0.00 H new ATOM 0 HD13 ILE A 248 -0.599 3.201 1.800 1.00 0.00 H new ATOM 330 N GLN A 249 2.847 6.277 5.001 1.00 0.00 N ATOM 331 CA GLN A 249 4.021 6.090 5.851 1.00 0.00 C ATOM 332 C GLN A 249 3.919 6.970 7.086 1.00 0.00 C ATOM 333 O GLN A 249 3.762 6.478 8.203 1.00 0.00 O ATOM 334 CB GLN A 249 5.309 6.412 5.086 1.00 0.00 C ATOM 335 CG GLN A 249 6.477 6.796 5.982 1.00 0.00 C ATOM 336 CD GLN A 249 6.589 5.909 7.206 1.00 0.00 C ATOM 337 OE1 GLN A 249 6.314 4.711 7.146 1.00 0.00 O ATOM 338 NE2 GLN A 249 6.994 6.496 8.326 1.00 0.00 N ATOM 0 H GLN A 249 3.054 6.575 4.048 1.00 0.00 H new ATOM 0 HA GLN A 249 4.055 5.044 6.157 1.00 0.00 H new ATOM 0 HB2 GLN A 249 5.592 5.545 4.488 1.00 0.00 H new ATOM 0 HB3 GLN A 249 5.113 7.228 4.391 1.00 0.00 H new ATOM 0 HG2 GLN A 249 7.403 6.738 5.410 1.00 0.00 H new ATOM 0 HG3 GLN A 249 6.362 7.833 6.298 1.00 0.00 H new ATOM 0 HE21 GLN A 249 7.211 7.493 8.330 1.00 0.00 H new ATOM 0 HE22 GLN A 249 7.088 5.950 9.183 1.00 0.00 H new ATOM 347 N GLN A 250 3.992 8.277 6.873 1.00 0.00 N ATOM 348 CA GLN A 250 3.889 9.227 7.966 1.00 0.00 C ATOM 349 C GLN A 250 2.443 9.320 8.425 1.00 0.00 C ATOM 350 O GLN A 250 2.145 9.206 9.615 1.00 0.00 O ATOM 351 CB GLN A 250 4.396 10.603 7.530 1.00 0.00 C ATOM 352 CG GLN A 250 5.649 10.545 6.670 1.00 0.00 C ATOM 353 CD GLN A 250 5.664 11.612 5.594 1.00 0.00 C ATOM 354 OE1 GLN A 250 5.108 11.426 4.511 1.00 0.00 O ATOM 355 NE2 GLN A 250 6.303 12.739 5.887 1.00 0.00 N ATOM 0 H GLN A 250 4.122 8.700 5.954 1.00 0.00 H new ATOM 0 HA GLN A 250 4.507 8.882 8.795 1.00 0.00 H new ATOM 0 HB2 GLN A 250 3.608 11.112 6.975 1.00 0.00 H new ATOM 0 HB3 GLN A 250 4.601 11.203 8.416 1.00 0.00 H new ATOM 0 HG2 GLN A 250 6.527 10.661 7.305 1.00 0.00 H new ATOM 0 HG3 GLN A 250 5.721 9.562 6.204 1.00 0.00 H new ATOM 0 HE21 GLN A 250 6.750 12.850 6.797 1.00 0.00 H new ATOM 0 HE22 GLN A 250 6.347 13.493 5.202 1.00 0.00 H new ATOM 364 N ASN A 251 1.546 9.515 7.463 1.00 0.00 N ATOM 365 CA ASN A 251 0.123 9.603 7.739 1.00 0.00 C ATOM 366 C ASN A 251 -0.586 8.281 7.440 1.00 0.00 C ATOM 367 O ASN A 251 -1.384 8.208 6.505 1.00 0.00 O ATOM 368 CB ASN A 251 -0.506 10.728 6.917 1.00 0.00 C ATOM 369 CG ASN A 251 -1.009 11.866 7.783 1.00 0.00 C ATOM 370 OD1 ASN A 251 -2.198 12.185 7.783 1.00 0.00 O ATOM 371 ND2 ASN A 251 -0.101 12.485 8.530 1.00 0.00 N ATOM 0 H ASN A 251 1.787 9.615 6.477 1.00 0.00 H new ATOM 0 HA ASN A 251 0.002 9.820 8.800 1.00 0.00 H new ATOM 0 HB2 ASN A 251 0.229 11.111 6.209 1.00 0.00 H new ATOM 0 HB3 ASN A 251 -1.334 10.327 6.332 1.00 0.00 H new ATOM 0 HD21 ASN A 251 -0.379 13.258 9.135 1.00 0.00 H new ATOM 0 HD22 ASN A 251 0.874 12.187 8.499 1.00 0.00 H new ATOM 378 N PRO A 252 -0.328 7.215 8.221 1.00 0.00 N ATOM 379 CA PRO A 252 -0.975 5.910 8.008 1.00 0.00 C ATOM 380 C PRO A 252 -2.419 5.889 8.508 1.00 0.00 C ATOM 381 O PRO A 252 -2.906 4.861 8.977 1.00 0.00 O ATOM 382 CB PRO A 252 -0.119 4.967 8.850 1.00 0.00 C ATOM 383 CG PRO A 252 0.367 5.822 9.967 1.00 0.00 C ATOM 384 CD PRO A 252 0.599 7.183 9.367 1.00 0.00 C ATOM 0 HA PRO A 252 -1.032 5.647 6.952 1.00 0.00 H new ATOM 0 HB2 PRO A 252 -0.701 4.122 9.218 1.00 0.00 H new ATOM 0 HB3 PRO A 252 0.709 4.557 8.272 1.00 0.00 H new ATOM 0 HG2 PRO A 252 -0.366 5.869 10.772 1.00 0.00 H new ATOM 0 HG3 PRO A 252 1.286 5.421 10.396 1.00 0.00 H new ATOM 0 HD2 PRO A 252 0.383 7.978 10.080 1.00 0.00 H new ATOM 0 HD3 PRO A 252 1.634 7.311 9.050 1.00 0.00 H new ATOM 392 N ALA A 253 -3.094 7.031 8.417 1.00 0.00 N ATOM 393 CA ALA A 253 -4.475 7.144 8.870 1.00 0.00 C ATOM 394 C ALA A 253 -5.457 6.683 7.800 1.00 0.00 C ATOM 395 O ALA A 253 -6.437 6.000 8.097 1.00 0.00 O ATOM 396 CB ALA A 253 -4.789 8.573 9.288 1.00 0.00 C ATOM 0 H ALA A 253 -2.705 7.892 8.033 1.00 0.00 H new ATOM 0 HA ALA A 253 -4.588 6.490 9.734 1.00 0.00 H new ATOM 0 HB1 ALA A 253 -5.825 8.635 9.623 1.00 0.00 H new ATOM 0 HB2 ALA A 253 -4.126 8.868 10.102 1.00 0.00 H new ATOM 0 HB3 ALA A 253 -4.641 9.241 8.440 1.00 0.00 H new ATOM 402 N LEU A 254 -5.194 7.069 6.558 1.00 0.00 N ATOM 403 CA LEU A 254 -6.061 6.703 5.446 1.00 0.00 C ATOM 404 C LEU A 254 -5.661 5.357 4.859 1.00 0.00 C ATOM 405 O LEU A 254 -6.244 4.902 3.876 1.00 0.00 O ATOM 406 CB LEU A 254 -6.016 7.780 4.361 1.00 0.00 C ATOM 407 CG LEU A 254 -4.801 7.717 3.434 1.00 0.00 C ATOM 408 CD1 LEU A 254 -5.180 7.098 2.098 1.00 0.00 C ATOM 409 CD2 LEU A 254 -4.212 9.104 3.234 1.00 0.00 C ATOM 0 H LEU A 254 -4.387 7.635 6.296 1.00 0.00 H new ATOM 0 HA LEU A 254 -7.079 6.622 5.827 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -6.919 7.702 3.756 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -6.037 8.758 4.841 1.00 0.00 H new ATOM 0 HG LEU A 254 -4.044 7.086 3.900 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -4.303 7.062 1.452 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -5.555 6.087 2.259 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -5.955 7.701 1.624 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -3.348 9.041 2.572 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -4.963 9.757 2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -3.902 9.510 4.197 1.00 0.00 H new ATOM 421 N LEU A 255 -4.655 4.731 5.457 1.00 0.00 N ATOM 422 CA LEU A 255 -4.173 3.447 4.976 1.00 0.00 C ATOM 423 C LEU A 255 -3.889 3.523 3.484 1.00 0.00 C ATOM 424 O LEU A 255 -4.200 4.520 2.831 1.00 0.00 O ATOM 425 CB LEU A 255 -5.190 2.341 5.271 1.00 0.00 C ATOM 426 CG LEU A 255 -6.213 2.075 4.162 1.00 0.00 C ATOM 427 CD1 LEU A 255 -5.989 0.703 3.544 1.00 0.00 C ATOM 428 CD2 LEU A 255 -7.625 2.185 4.711 1.00 0.00 C ATOM 0 H LEU A 255 -4.160 5.092 6.273 1.00 0.00 H new ATOM 0 HA LEU A 255 -3.248 3.206 5.499 1.00 0.00 H new ATOM 0 HB2 LEU A 255 -4.648 1.417 5.471 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -5.728 2.599 6.183 1.00 0.00 H new ATOM 0 HG LEU A 255 -6.082 2.827 3.384 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -6.725 0.533 2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 255 -4.987 0.655 3.118 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -6.094 -0.063 4.312 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -8.342 1.994 3.912 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -7.764 1.453 5.507 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -7.784 3.187 5.109 1.00 0.00 H new ATOM 440 N PRO A 256 -3.287 2.473 2.925 1.00 0.00 N ATOM 441 CA PRO A 256 -2.951 2.414 1.510 1.00 0.00 C ATOM 442 C PRO A 256 -4.152 2.039 0.650 1.00 0.00 C ATOM 443 O PRO A 256 -4.036 1.254 -0.290 1.00 0.00 O ATOM 444 CB PRO A 256 -1.867 1.327 1.433 1.00 0.00 C ATOM 445 CG PRO A 256 -1.698 0.794 2.829 1.00 0.00 C ATOM 446 CD PRO A 256 -2.880 1.265 3.631 1.00 0.00 C ATOM 0 HA PRO A 256 -2.619 3.381 1.131 1.00 0.00 H new ATOM 0 HB2 PRO A 256 -2.162 0.533 0.747 1.00 0.00 H new ATOM 0 HB3 PRO A 256 -0.930 1.739 1.059 1.00 0.00 H new ATOM 0 HG2 PRO A 256 -1.647 -0.295 2.822 1.00 0.00 H new ATOM 0 HG3 PRO A 256 -0.767 1.153 3.268 1.00 0.00 H new ATOM 0 HD2 PRO A 256 -3.677 0.521 3.653 1.00 0.00 H new ATOM 0 HD3 PRO A 256 -2.610 1.473 4.666 1.00 0.00 H new ATOM 454 N ALA A 257 -5.306 2.616 0.975 1.00 0.00 N ATOM 455 CA ALA A 257 -6.525 2.354 0.230 1.00 0.00 C ATOM 456 C ALA A 257 -6.277 2.544 -1.256 1.00 0.00 C ATOM 457 O ALA A 257 -6.949 1.944 -2.093 1.00 0.00 O ATOM 458 CB ALA A 257 -7.658 3.256 0.697 1.00 0.00 C ATOM 0 H ALA A 257 -5.418 3.268 1.751 1.00 0.00 H new ATOM 0 HA ALA A 257 -6.822 1.321 0.413 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -8.558 3.038 0.122 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -7.852 3.079 1.755 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -7.377 4.299 0.549 1.00 0.00 H new ATOM 464 N LEU A 258 -5.299 3.383 -1.576 1.00 0.00 N ATOM 465 CA LEU A 258 -4.953 3.649 -2.960 1.00 0.00 C ATOM 466 C LEU A 258 -4.987 2.354 -3.765 1.00 0.00 C ATOM 467 O LEU A 258 -5.455 2.323 -4.905 1.00 0.00 O ATOM 468 CB LEU A 258 -3.568 4.291 -3.051 1.00 0.00 C ATOM 469 CG LEU A 258 -3.556 5.817 -2.939 1.00 0.00 C ATOM 470 CD1 LEU A 258 -4.358 6.441 -4.071 1.00 0.00 C ATOM 471 CD2 LEU A 258 -4.107 6.254 -1.590 1.00 0.00 C ATOM 0 H LEU A 258 -4.734 3.889 -0.894 1.00 0.00 H new ATOM 0 HA LEU A 258 -5.684 4.343 -3.375 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -2.940 3.878 -2.261 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -3.114 4.007 -4.000 1.00 0.00 H new ATOM 0 HG LEU A 258 -2.525 6.162 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.339 7.527 -3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -3.922 6.153 -5.028 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -5.389 6.091 -4.022 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -4.092 7.342 -1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -5.132 5.898 -1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -3.493 5.835 -0.793 1.00 0.00 H new ATOM 483 N LEU A 259 -4.497 1.282 -3.150 1.00 0.00 N ATOM 484 CA LEU A 259 -4.476 -0.026 -3.791 1.00 0.00 C ATOM 485 C LEU A 259 -5.893 -0.561 -3.944 1.00 0.00 C ATOM 486 O LEU A 259 -6.235 -1.173 -4.955 1.00 0.00 O ATOM 487 CB LEU A 259 -3.628 -1.004 -2.975 1.00 0.00 C ATOM 488 CG LEU A 259 -3.974 -2.480 -3.171 1.00 0.00 C ATOM 489 CD1 LEU A 259 -5.252 -2.833 -2.425 1.00 0.00 C ATOM 490 CD2 LEU A 259 -4.112 -2.802 -4.651 1.00 0.00 C ATOM 0 H LEU A 259 -4.109 1.295 -2.207 1.00 0.00 H new ATOM 0 HA LEU A 259 -4.032 0.079 -4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 259 -2.580 -0.855 -3.233 1.00 0.00 H new ATOM 0 HB3 LEU A 259 -3.734 -0.759 -1.918 1.00 0.00 H new ATOM 0 HG LEU A 259 -3.162 -3.081 -2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -5.482 -3.888 -2.576 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -5.117 -2.640 -1.361 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -6.074 -2.224 -2.803 1.00 0.00 H new ATOM 0 HD21 LEU A 259 -4.358 -3.857 -4.772 1.00 0.00 H new ATOM 0 HD22 LEU A 259 -4.905 -2.192 -5.084 1.00 0.00 H new ATOM 0 HD23 LEU A 259 -3.172 -2.588 -5.159 1.00 0.00 H new ATOM 502 N GLN A 260 -6.715 -0.318 -2.929 1.00 0.00 N ATOM 503 CA GLN A 260 -8.102 -0.763 -2.942 1.00 0.00 C ATOM 504 C GLN A 260 -8.872 -0.079 -4.066 1.00 0.00 C ATOM 505 O GLN A 260 -9.735 -0.685 -4.699 1.00 0.00 O ATOM 506 CB GLN A 260 -8.769 -0.471 -1.597 1.00 0.00 C ATOM 507 CG GLN A 260 -8.107 -1.174 -0.423 1.00 0.00 C ATOM 508 CD GLN A 260 -9.046 -2.130 0.287 1.00 0.00 C ATOM 509 OE1 GLN A 260 -8.722 -3.300 0.490 1.00 0.00 O ATOM 510 NE2 GLN A 260 -10.217 -1.635 0.669 1.00 0.00 N ATOM 0 H GLN A 260 -6.443 0.186 -2.085 1.00 0.00 H new ATOM 0 HA GLN A 260 -8.114 -1.839 -3.114 1.00 0.00 H new ATOM 0 HB2 GLN A 260 -8.755 0.604 -1.420 1.00 0.00 H new ATOM 0 HB3 GLN A 260 -9.815 -0.772 -1.647 1.00 0.00 H new ATOM 0 HG2 GLN A 260 -7.235 -1.723 -0.778 1.00 0.00 H new ATOM 0 HG3 GLN A 260 -7.748 -0.429 0.287 1.00 0.00 H new ATOM 0 HE21 GLN A 260 -10.444 -0.659 0.480 1.00 0.00 H new ATOM 0 HE22 GLN A 260 -10.890 -2.231 1.152 1.00 0.00 H new ATOM 519 N GLN A 261 -8.545 1.186 -4.312 1.00 0.00 N ATOM 520 CA GLN A 261 -9.198 1.952 -5.364 1.00 0.00 C ATOM 521 C GLN A 261 -8.785 1.429 -6.732 1.00 0.00 C ATOM 522 O GLN A 261 -9.588 1.392 -7.664 1.00 0.00 O ATOM 523 CB GLN A 261 -8.846 3.436 -5.239 1.00 0.00 C ATOM 524 CG GLN A 261 -9.684 4.337 -6.132 1.00 0.00 C ATOM 525 CD GLN A 261 -9.524 5.806 -5.793 1.00 0.00 C ATOM 526 OE1 GLN A 261 -8.421 6.272 -5.508 1.00 0.00 O ATOM 527 NE2 GLN A 261 -10.628 6.543 -5.820 1.00 0.00 N ATOM 0 H GLN A 261 -7.831 1.701 -3.796 1.00 0.00 H new ATOM 0 HA GLN A 261 -10.277 1.839 -5.256 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -8.975 3.745 -4.202 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -7.793 3.573 -5.484 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -9.402 4.175 -7.172 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -10.734 4.059 -6.040 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -11.521 6.114 -6.062 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -10.583 7.538 -5.599 1.00 0.00 H new ATOM 536 N LEU A 262 -7.526 1.021 -6.843 1.00 0.00 N ATOM 537 CA LEU A 262 -7.004 0.492 -8.098 1.00 0.00 C ATOM 538 C LEU A 262 -7.549 -0.909 -8.365 1.00 0.00 C ATOM 539 O LEU A 262 -7.987 -1.213 -9.474 1.00 0.00 O ATOM 540 CB LEU A 262 -5.474 0.463 -8.067 1.00 0.00 C ATOM 541 CG LEU A 262 -4.792 1.602 -8.825 1.00 0.00 C ATOM 542 CD1 LEU A 262 -4.775 1.315 -10.318 1.00 0.00 C ATOM 543 CD2 LEU A 262 -5.492 2.923 -8.542 1.00 0.00 C ATOM 0 H LEU A 262 -6.849 1.046 -6.081 1.00 0.00 H new ATOM 0 HA LEU A 262 -7.330 1.148 -8.905 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -5.146 0.490 -7.028 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -5.135 -0.485 -8.484 1.00 0.00 H new ATOM 0 HG LEU A 262 -3.761 1.678 -8.479 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -4.286 2.137 -10.841 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -4.229 0.390 -10.505 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -5.798 1.212 -10.680 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -4.994 3.723 -9.089 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -6.533 2.859 -8.860 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -5.452 3.135 -7.473 1.00 0.00 H new ATOM 555 N GLY A 263 -7.521 -1.757 -7.341 1.00 0.00 N ATOM 556 CA GLY A 263 -8.019 -3.113 -7.488 1.00 0.00 C ATOM 557 C GLY A 263 -9.531 -3.167 -7.563 1.00 0.00 C ATOM 558 O GLY A 263 -10.097 -4.047 -8.211 1.00 0.00 O ATOM 0 H GLY A 263 -7.163 -1.530 -6.413 1.00 0.00 H new ATOM 0 HA2 GLY A 263 -7.597 -3.557 -8.390 1.00 0.00 H new ATOM 0 HA3 GLY A 263 -7.678 -3.716 -6.646 1.00 0.00 H new ATOM 562 N GLN A 264 -10.185 -2.216 -6.906 1.00 0.00 N ATOM 563 CA GLN A 264 -11.640 -2.149 -6.908 1.00 0.00 C ATOM 564 C GLN A 264 -12.125 -1.448 -8.167 1.00 0.00 C ATOM 565 O GLN A 264 -13.073 -1.890 -8.815 1.00 0.00 O ATOM 566 CB GLN A 264 -12.147 -1.410 -5.667 1.00 0.00 C ATOM 567 CG GLN A 264 -11.941 -2.182 -4.373 1.00 0.00 C ATOM 568 CD GLN A 264 -13.247 -2.534 -3.689 1.00 0.00 C ATOM 569 OE1 GLN A 264 -14.289 -2.647 -4.335 1.00 0.00 O ATOM 570 NE2 GLN A 264 -13.198 -2.710 -2.374 1.00 0.00 N ATOM 0 H GLN A 264 -9.730 -1.481 -6.365 1.00 0.00 H new ATOM 0 HA GLN A 264 -12.035 -3.165 -6.890 1.00 0.00 H new ATOM 0 HB2 GLN A 264 -11.637 -0.450 -5.593 1.00 0.00 H new ATOM 0 HB3 GLN A 264 -13.209 -1.198 -5.789 1.00 0.00 H new ATOM 0 HG2 GLN A 264 -11.388 -3.097 -4.585 1.00 0.00 H new ATOM 0 HG3 GLN A 264 -11.328 -1.589 -3.694 1.00 0.00 H new ATOM 0 HE21 GLN A 264 -12.313 -2.607 -1.878 1.00 0.00 H new ATOM 0 HE22 GLN A 264 -14.046 -2.949 -1.859 1.00 0.00 H new ATOM 579 N GLU A 265 -11.452 -0.356 -8.514 1.00 0.00 N ATOM 580 CA GLU A 265 -11.794 0.404 -9.705 1.00 0.00 C ATOM 581 C GLU A 265 -12.173 -0.542 -10.833 1.00 0.00 C ATOM 582 O GLU A 265 -13.330 -0.601 -11.250 1.00 0.00 O ATOM 583 CB GLU A 265 -10.609 1.287 -10.117 1.00 0.00 C ATOM 584 CG GLU A 265 -10.510 1.540 -11.615 1.00 0.00 C ATOM 585 CD GLU A 265 -11.850 1.869 -12.241 1.00 0.00 C ATOM 586 OE1 GLU A 265 -12.455 2.890 -11.848 1.00 0.00 O ATOM 587 OE2 GLU A 265 -12.295 1.108 -13.126 1.00 0.00 O ATOM 0 H GLU A 265 -10.666 0.021 -7.985 1.00 0.00 H new ATOM 0 HA GLU A 265 -12.648 1.046 -9.490 1.00 0.00 H new ATOM 0 HB2 GLU A 265 -10.688 2.245 -9.603 1.00 0.00 H new ATOM 0 HB3 GLU A 265 -9.686 0.818 -9.777 1.00 0.00 H new ATOM 0 HG2 GLU A 265 -9.817 2.362 -11.796 1.00 0.00 H new ATOM 0 HG3 GLU A 265 -10.093 0.659 -12.102 1.00 0.00 H new ATOM 594 N ASN A 266 -11.190 -1.290 -11.315 1.00 0.00 N ATOM 595 CA ASN A 266 -11.420 -2.247 -12.387 1.00 0.00 C ATOM 596 C ASN A 266 -11.470 -3.666 -11.833 1.00 0.00 C ATOM 597 O ASN A 266 -10.442 -4.233 -11.458 1.00 0.00 O ATOM 598 CB ASN A 266 -10.328 -2.133 -13.452 1.00 0.00 C ATOM 599 CG ASN A 266 -10.848 -1.548 -14.751 1.00 0.00 C ATOM 600 OD1 ASN A 266 -11.709 -0.669 -14.748 1.00 0.00 O ATOM 601 ND2 ASN A 266 -10.325 -2.035 -15.870 1.00 0.00 N ATOM 0 H ASN A 266 -10.227 -1.252 -10.981 1.00 0.00 H new ATOM 0 HA ASN A 266 -12.381 -2.019 -12.849 1.00 0.00 H new ATOM 0 HB2 ASN A 266 -9.519 -1.509 -13.074 1.00 0.00 H new ATOM 0 HB3 ASN A 266 -9.907 -3.120 -13.644 1.00 0.00 H new ATOM 0 HD21 ASN A 266 -10.635 -1.680 -16.775 1.00 0.00 H new ATOM 0 HD22 ASN A 266 -9.613 -2.764 -15.825 1.00 0.00 H new ATOM 608 N PRO A 267 -12.669 -4.260 -11.774 1.00 0.00 N ATOM 609 CA PRO A 267 -12.853 -5.618 -11.261 1.00 0.00 C ATOM 610 C PRO A 267 -11.829 -6.595 -11.827 1.00 0.00 C ATOM 611 O PRO A 267 -11.561 -7.641 -11.235 1.00 0.00 O ATOM 612 CB PRO A 267 -14.260 -5.979 -11.732 1.00 0.00 C ATOM 613 CG PRO A 267 -14.975 -4.674 -11.811 1.00 0.00 C ATOM 614 CD PRO A 267 -13.942 -3.650 -12.203 1.00 0.00 C ATOM 0 HA PRO A 267 -12.723 -5.671 -10.180 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -14.238 -6.479 -12.701 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -14.750 -6.658 -11.034 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -15.780 -4.715 -12.545 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -15.430 -4.421 -10.853 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -13.954 -3.459 -13.276 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -14.116 -2.695 -11.708 1.00 0.00 H new ATOM 622 N GLN A 268 -11.256 -6.247 -12.974 1.00 0.00 N ATOM 623 CA GLN A 268 -10.257 -7.092 -13.617 1.00 0.00 C ATOM 624 C GLN A 268 -8.849 -6.659 -13.221 1.00 0.00 C ATOM 625 O GLN A 268 -7.923 -7.469 -13.203 1.00 0.00 O ATOM 626 CB GLN A 268 -10.412 -7.038 -15.138 1.00 0.00 C ATOM 627 CG GLN A 268 -9.602 -8.096 -15.868 1.00 0.00 C ATOM 628 CD GLN A 268 -10.121 -8.366 -17.266 1.00 0.00 C ATOM 629 OE1 GLN A 268 -9.622 -7.812 -18.245 1.00 0.00 O ATOM 630 NE2 GLN A 268 -11.130 -9.224 -17.366 1.00 0.00 N ATOM 0 H GLN A 268 -11.466 -5.385 -13.478 1.00 0.00 H new ATOM 0 HA GLN A 268 -10.413 -8.117 -13.282 1.00 0.00 H new ATOM 0 HB2 GLN A 268 -11.465 -7.158 -15.392 1.00 0.00 H new ATOM 0 HB3 GLN A 268 -10.109 -6.052 -15.491 1.00 0.00 H new ATOM 0 HG2 GLN A 268 -8.562 -7.776 -15.926 1.00 0.00 H new ATOM 0 HG3 GLN A 268 -9.619 -9.022 -15.293 1.00 0.00 H new ATOM 0 HE21 GLN A 268 -11.513 -9.660 -16.528 1.00 0.00 H new ATOM 0 HE22 GLN A 268 -11.522 -9.446 -18.281 1.00 0.00 H new ATOM 639 N LEU A 269 -8.697 -5.377 -12.904 1.00 0.00 N ATOM 640 CA LEU A 269 -7.402 -4.839 -12.507 1.00 0.00 C ATOM 641 C LEU A 269 -6.752 -5.723 -11.451 1.00 0.00 C ATOM 642 O LEU A 269 -5.663 -6.256 -11.658 1.00 0.00 O ATOM 643 CB LEU A 269 -7.556 -3.416 -11.970 1.00 0.00 C ATOM 644 CG LEU A 269 -6.462 -2.439 -12.408 1.00 0.00 C ATOM 645 CD1 LEU A 269 -6.584 -2.133 -13.893 1.00 0.00 C ATOM 646 CD2 LEU A 269 -6.532 -1.159 -11.590 1.00 0.00 C ATOM 0 H LEU A 269 -9.454 -4.693 -12.914 1.00 0.00 H new ATOM 0 HA LEU A 269 -6.760 -4.818 -13.388 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -8.522 -3.025 -12.291 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -7.574 -3.454 -10.881 1.00 0.00 H new ATOM 0 HG LEU A 269 -5.493 -2.905 -12.233 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -5.798 -1.437 -14.187 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -6.483 -3.056 -14.464 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -7.558 -1.687 -14.094 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -5.747 -0.476 -11.915 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -7.505 -0.688 -11.733 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -6.395 -1.394 -10.534 1.00 0.00 H new ATOM 658 N LEU A 270 -7.431 -5.876 -10.320 1.00 0.00 N ATOM 659 CA LEU A 270 -6.923 -6.698 -9.227 1.00 0.00 C ATOM 660 C LEU A 270 -6.313 -7.992 -9.757 1.00 0.00 C ATOM 661 O LEU A 270 -5.161 -8.314 -9.464 1.00 0.00 O ATOM 662 CB LEU A 270 -8.047 -7.016 -8.239 1.00 0.00 C ATOM 663 CG LEU A 270 -7.720 -8.103 -7.213 1.00 0.00 C ATOM 664 CD1 LEU A 270 -7.500 -7.490 -5.839 1.00 0.00 C ATOM 665 CD2 LEU A 270 -8.834 -9.138 -7.164 1.00 0.00 C ATOM 0 H LEU A 270 -8.335 -5.442 -10.135 1.00 0.00 H new ATOM 0 HA LEU A 270 -6.144 -6.136 -8.713 1.00 0.00 H new ATOM 0 HB2 LEU A 270 -8.311 -6.102 -7.706 1.00 0.00 H new ATOM 0 HB3 LEU A 270 -8.929 -7.323 -8.802 1.00 0.00 H new ATOM 0 HG LEU A 270 -6.799 -8.601 -7.518 1.00 0.00 H new ATOM 0 HD11 LEU A 270 -7.269 -8.278 -5.122 1.00 0.00 H new ATOM 0 HD12 LEU A 270 -6.670 -6.785 -5.884 1.00 0.00 H new ATOM 0 HD13 LEU A 270 -8.404 -6.967 -5.525 1.00 0.00 H new ATOM 0 HD21 LEU A 270 -8.586 -9.904 -6.430 1.00 0.00 H new ATOM 0 HD22 LEU A 270 -9.769 -8.653 -6.882 1.00 0.00 H new ATOM 0 HD23 LEU A 270 -8.946 -9.599 -8.145 1.00 0.00 H new ATOM 677 N GLN A 271 -7.094 -8.731 -10.537 1.00 0.00 N ATOM 678 CA GLN A 271 -6.633 -9.990 -11.109 1.00 0.00 C ATOM 679 C GLN A 271 -5.164 -9.902 -11.511 1.00 0.00 C ATOM 680 O GLN A 271 -4.313 -10.586 -10.943 1.00 0.00 O ATOM 681 CB GLN A 271 -7.481 -10.362 -12.327 1.00 0.00 C ATOM 682 CG GLN A 271 -8.319 -11.614 -12.126 1.00 0.00 C ATOM 683 CD GLN A 271 -8.869 -11.727 -10.717 1.00 0.00 C ATOM 684 OE1 GLN A 271 -8.215 -12.264 -9.825 1.00 0.00 O ATOM 685 NE2 GLN A 271 -10.081 -11.222 -10.513 1.00 0.00 N ATOM 0 H GLN A 271 -8.050 -8.479 -10.788 1.00 0.00 H new ATOM 0 HA GLN A 271 -6.738 -10.763 -10.348 1.00 0.00 H new ATOM 0 HB2 GLN A 271 -8.141 -9.528 -12.568 1.00 0.00 H new ATOM 0 HB3 GLN A 271 -6.825 -10.508 -13.185 1.00 0.00 H new ATOM 0 HG2 GLN A 271 -9.146 -11.611 -12.836 1.00 0.00 H new ATOM 0 HG3 GLN A 271 -7.712 -12.492 -12.347 1.00 0.00 H new ATOM 0 HE21 GLN A 271 -10.588 -10.785 -11.283 1.00 0.00 H new ATOM 0 HE22 GLN A 271 -10.505 -11.271 -9.586 1.00 0.00 H new ATOM 694 N GLN A 272 -4.875 -9.059 -12.496 1.00 0.00 N ATOM 695 CA GLN A 272 -3.509 -8.884 -12.976 1.00 0.00 C ATOM 696 C GLN A 272 -2.639 -8.215 -11.917 1.00 0.00 C ATOM 697 O GLN A 272 -1.494 -8.614 -11.699 1.00 0.00 O ATOM 698 CB GLN A 272 -3.501 -8.058 -14.262 1.00 0.00 C ATOM 699 CG GLN A 272 -4.078 -8.794 -15.460 1.00 0.00 C ATOM 700 CD GLN A 272 -3.565 -10.216 -15.572 1.00 0.00 C ATOM 701 OE1 GLN A 272 -2.431 -10.511 -15.195 1.00 0.00 O ATOM 702 NE2 GLN A 272 -4.400 -11.106 -16.093 1.00 0.00 N ATOM 0 H GLN A 272 -5.568 -8.486 -12.978 1.00 0.00 H new ATOM 0 HA GLN A 272 -3.095 -9.870 -13.185 1.00 0.00 H new ATOM 0 HB2 GLN A 272 -4.070 -7.143 -14.100 1.00 0.00 H new ATOM 0 HB3 GLN A 272 -2.477 -7.761 -14.487 1.00 0.00 H new ATOM 0 HG2 GLN A 272 -5.165 -8.809 -15.384 1.00 0.00 H new ATOM 0 HG3 GLN A 272 -3.830 -8.249 -16.371 1.00 0.00 H new ATOM 0 HE21 GLN A 272 -5.331 -10.817 -16.392 1.00 0.00 H new ATOM 0 HE22 GLN A 272 -4.111 -12.079 -16.194 1.00 0.00 H new ATOM 711 N ILE A 273 -3.189 -7.201 -11.256 1.00 0.00 N ATOM 712 CA ILE A 273 -2.459 -6.486 -10.216 1.00 0.00 C ATOM 713 C ILE A 273 -1.678 -7.466 -9.347 1.00 0.00 C ATOM 714 O ILE A 273 -0.628 -7.130 -8.801 1.00 0.00 O ATOM 715 CB ILE A 273 -3.410 -5.650 -9.330 1.00 0.00 C ATOM 716 CG1 ILE A 273 -3.862 -4.392 -10.072 1.00 0.00 C ATOM 717 CG2 ILE A 273 -2.738 -5.275 -8.015 1.00 0.00 C ATOM 718 CD1 ILE A 273 -4.616 -3.413 -9.196 1.00 0.00 C ATOM 0 H ILE A 273 -4.135 -6.857 -11.422 1.00 0.00 H new ATOM 0 HA ILE A 273 -1.765 -5.806 -10.710 1.00 0.00 H new ATOM 0 HB ILE A 273 -4.286 -6.258 -9.105 1.00 0.00 H new ATOM 0 HG12 ILE A 273 -2.988 -3.894 -10.492 1.00 0.00 H new ATOM 0 HG13 ILE A 273 -4.497 -4.682 -10.909 1.00 0.00 H new ATOM 0 HG21 ILE A 273 -3.427 -4.687 -7.409 1.00 0.00 H new ATOM 0 HG22 ILE A 273 -2.463 -6.181 -7.476 1.00 0.00 H new ATOM 0 HG23 ILE A 273 -1.842 -4.688 -8.219 1.00 0.00 H new ATOM 0 HD11 ILE A 273 -4.906 -2.544 -9.787 1.00 0.00 H new ATOM 0 HD12 ILE A 273 -5.508 -3.895 -8.797 1.00 0.00 H new ATOM 0 HD13 ILE A 273 -3.977 -3.094 -8.373 1.00 0.00 H new ATOM 730 N SER A 274 -2.199 -8.683 -9.230 1.00 0.00 N ATOM 731 CA SER A 274 -1.552 -9.718 -8.434 1.00 0.00 C ATOM 732 C SER A 274 -0.119 -9.941 -8.904 1.00 0.00 C ATOM 733 O SER A 274 0.700 -10.515 -8.184 1.00 0.00 O ATOM 734 CB SER A 274 -2.340 -11.025 -8.522 1.00 0.00 C ATOM 735 OG SER A 274 -1.472 -12.145 -8.540 1.00 0.00 O ATOM 0 H SER A 274 -3.068 -8.976 -9.677 1.00 0.00 H new ATOM 0 HA SER A 274 -1.530 -9.387 -7.396 1.00 0.00 H new ATOM 0 HB2 SER A 274 -3.019 -11.101 -7.673 1.00 0.00 H new ATOM 0 HB3 SER A 274 -2.954 -11.023 -9.422 1.00 0.00 H new ATOM 0 HG SER A 274 -2.001 -12.968 -8.595 1.00 0.00 H new ATOM 741 N ARG A 275 0.178 -9.481 -10.115 1.00 0.00 N ATOM 742 CA ARG A 275 1.515 -9.628 -10.680 1.00 0.00 C ATOM 743 C ARG A 275 2.565 -9.065 -9.731 1.00 0.00 C ATOM 744 O ARG A 275 3.536 -9.740 -9.390 1.00 0.00 O ATOM 745 CB ARG A 275 1.598 -8.917 -12.034 1.00 0.00 C ATOM 746 CG ARG A 275 1.991 -9.833 -13.182 1.00 0.00 C ATOM 747 CD ARG A 275 1.316 -11.191 -13.070 1.00 0.00 C ATOM 748 NE ARG A 275 -0.057 -11.081 -12.585 1.00 0.00 N ATOM 749 CZ ARG A 275 -0.820 -12.130 -12.291 1.00 0.00 C ATOM 750 NH1 ARG A 275 -0.342 -13.359 -12.431 1.00 0.00 N ATOM 751 NH2 ARG A 275 -2.059 -11.950 -11.856 1.00 0.00 N ATOM 0 H ARG A 275 -0.488 -9.004 -10.723 1.00 0.00 H new ATOM 0 HA ARG A 275 1.712 -10.690 -10.824 1.00 0.00 H new ATOM 0 HB2 ARG A 275 0.632 -8.464 -12.257 1.00 0.00 H new ATOM 0 HB3 ARG A 275 2.322 -8.105 -11.964 1.00 0.00 H new ATOM 0 HG2 ARG A 275 1.719 -9.368 -14.129 1.00 0.00 H new ATOM 0 HG3 ARG A 275 3.073 -9.963 -13.190 1.00 0.00 H new ATOM 0 HD2 ARG A 275 1.318 -11.678 -14.045 1.00 0.00 H new ATOM 0 HD3 ARG A 275 1.889 -11.826 -12.395 1.00 0.00 H new ATOM 0 HE ARG A 275 -0.453 -10.149 -12.465 1.00 0.00 H new ATOM 0 HH11 ARG A 275 0.612 -13.500 -12.764 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -0.928 -14.163 -12.205 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -2.429 -11.006 -11.746 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -2.643 -12.756 -11.631 1.00 0.00 H new ATOM 765 N HIS A 276 2.360 -7.824 -9.301 1.00 0.00 N ATOM 766 CA HIS A 276 3.285 -7.170 -8.383 1.00 0.00 C ATOM 767 C HIS A 276 2.725 -7.170 -6.963 1.00 0.00 C ATOM 768 O HIS A 276 3.144 -6.378 -6.120 1.00 0.00 O ATOM 769 CB HIS A 276 3.558 -5.735 -8.841 1.00 0.00 C ATOM 770 CG HIS A 276 5.011 -5.437 -9.037 1.00 0.00 C ATOM 771 ND1 HIS A 276 5.611 -4.283 -8.580 1.00 0.00 N ATOM 772 CD2 HIS A 276 5.990 -6.150 -9.646 1.00 0.00 C ATOM 773 CE1 HIS A 276 6.894 -4.297 -8.898 1.00 0.00 C ATOM 774 NE2 HIS A 276 7.148 -5.420 -9.546 1.00 0.00 N ATOM 0 H HIS A 276 1.561 -7.251 -9.574 1.00 0.00 H new ATOM 0 HA HIS A 276 4.222 -7.727 -8.385 1.00 0.00 H new ATOM 0 HB2 HIS A 276 3.029 -5.554 -9.776 1.00 0.00 H new ATOM 0 HB3 HIS A 276 3.150 -5.043 -8.104 1.00 0.00 H new ATOM 0 HD2 HIS A 276 5.879 -7.113 -10.121 1.00 0.00 H new ATOM 0 HE1 HIS A 276 7.611 -3.523 -8.668 1.00 0.00 H new ATOM 0 HE2 HIS A 276 8.058 -5.699 -9.913 1.00 0.00 H new ATOM 783 N GLN A 277 1.774 -8.063 -6.710 1.00 0.00 N ATOM 784 CA GLN A 277 1.150 -8.170 -5.396 1.00 0.00 C ATOM 785 C GLN A 277 2.181 -7.999 -4.284 1.00 0.00 C ATOM 786 O GLN A 277 2.153 -7.013 -3.544 1.00 0.00 O ATOM 787 CB GLN A 277 0.450 -9.523 -5.252 1.00 0.00 C ATOM 788 CG GLN A 277 -0.575 -9.564 -4.131 1.00 0.00 C ATOM 789 CD GLN A 277 -1.395 -8.292 -4.043 1.00 0.00 C ATOM 790 OE1 GLN A 277 -1.049 -7.365 -3.310 1.00 0.00 O ATOM 791 NE2 GLN A 277 -2.490 -8.242 -4.793 1.00 0.00 N ATOM 0 H GLN A 277 1.418 -8.725 -7.400 1.00 0.00 H new ATOM 0 HA GLN A 277 0.413 -7.372 -5.307 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -0.043 -9.769 -6.192 1.00 0.00 H new ATOM 0 HB3 GLN A 277 1.200 -10.293 -5.075 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -1.242 -10.412 -4.285 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -0.064 -9.729 -3.182 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -2.739 -9.034 -5.386 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -3.082 -7.412 -4.776 1.00 0.00 H new ATOM 800 N GLU A 278 3.090 -8.961 -4.173 1.00 0.00 N ATOM 801 CA GLU A 278 4.130 -8.915 -3.152 1.00 0.00 C ATOM 802 C GLU A 278 4.932 -7.623 -3.259 1.00 0.00 C ATOM 803 O GLU A 278 5.371 -7.069 -2.254 1.00 0.00 O ATOM 804 CB GLU A 278 5.061 -10.121 -3.284 1.00 0.00 C ATOM 805 CG GLU A 278 5.498 -10.400 -4.712 1.00 0.00 C ATOM 806 CD GLU A 278 5.281 -11.845 -5.116 1.00 0.00 C ATOM 807 OE1 GLU A 278 4.347 -12.477 -4.581 1.00 0.00 O ATOM 808 OE2 GLU A 278 6.048 -12.344 -5.967 1.00 0.00 O ATOM 0 H GLU A 278 3.128 -9.782 -4.777 1.00 0.00 H new ATOM 0 HA GLU A 278 3.649 -8.946 -2.174 1.00 0.00 H new ATOM 0 HB2 GLU A 278 5.945 -9.956 -2.668 1.00 0.00 H new ATOM 0 HB3 GLU A 278 4.557 -11.003 -2.888 1.00 0.00 H new ATOM 0 HG2 GLU A 278 4.946 -9.750 -5.391 1.00 0.00 H new ATOM 0 HG3 GLU A 278 6.554 -10.151 -4.820 1.00 0.00 H new ATOM 815 N GLN A 279 5.115 -7.151 -4.487 1.00 0.00 N ATOM 816 CA GLN A 279 5.860 -5.923 -4.733 1.00 0.00 C ATOM 817 C GLN A 279 5.093 -4.715 -4.206 1.00 0.00 C ATOM 818 O GLN A 279 5.627 -3.915 -3.437 1.00 0.00 O ATOM 819 CB GLN A 279 6.133 -5.755 -6.228 1.00 0.00 C ATOM 820 CG GLN A 279 7.508 -6.242 -6.653 1.00 0.00 C ATOM 821 CD GLN A 279 7.442 -7.422 -7.604 1.00 0.00 C ATOM 822 OE1 GLN A 279 8.233 -7.523 -8.542 1.00 0.00 O ATOM 823 NE2 GLN A 279 6.495 -8.322 -7.365 1.00 0.00 N ATOM 0 H GLN A 279 4.757 -7.602 -5.329 1.00 0.00 H new ATOM 0 HA GLN A 279 6.811 -5.991 -4.205 1.00 0.00 H new ATOM 0 HB2 GLN A 279 5.374 -6.299 -6.791 1.00 0.00 H new ATOM 0 HB3 GLN A 279 6.032 -4.702 -6.491 1.00 0.00 H new ATOM 0 HG2 GLN A 279 8.047 -5.424 -7.132 1.00 0.00 H new ATOM 0 HG3 GLN A 279 8.078 -6.525 -5.768 1.00 0.00 H new ATOM 0 HE21 GLN A 279 5.861 -8.198 -6.576 1.00 0.00 H new ATOM 0 HE22 GLN A 279 6.402 -9.137 -7.971 1.00 0.00 H new ATOM 832 N PHE A 280 3.838 -4.589 -4.625 1.00 0.00 N ATOM 833 CA PHE A 280 2.997 -3.480 -4.193 1.00 0.00 C ATOM 834 C PHE A 280 3.103 -3.282 -2.686 1.00 0.00 C ATOM 835 O PHE A 280 3.479 -2.207 -2.215 1.00 0.00 O ATOM 836 CB PHE A 280 1.540 -3.728 -4.591 1.00 0.00 C ATOM 837 CG PHE A 280 0.715 -2.475 -4.659 1.00 0.00 C ATOM 838 CD1 PHE A 280 1.156 -1.306 -4.060 1.00 0.00 C ATOM 839 CD2 PHE A 280 -0.502 -2.466 -5.323 1.00 0.00 C ATOM 840 CE1 PHE A 280 0.399 -0.151 -4.122 1.00 0.00 C ATOM 841 CE2 PHE A 280 -1.264 -1.315 -5.387 1.00 0.00 C ATOM 842 CZ PHE A 280 -0.812 -0.155 -4.787 1.00 0.00 C ATOM 0 H PHE A 280 3.382 -5.241 -5.263 1.00 0.00 H new ATOM 0 HA PHE A 280 3.346 -2.573 -4.688 1.00 0.00 H new ATOM 0 HB2 PHE A 280 1.516 -4.222 -5.562 1.00 0.00 H new ATOM 0 HB3 PHE A 280 1.087 -4.413 -3.874 1.00 0.00 H new ATOM 0 HD1 PHE A 280 2.102 -1.297 -3.539 1.00 0.00 H new ATOM 0 HD2 PHE A 280 -0.859 -3.369 -5.796 1.00 0.00 H new ATOM 0 HE1 PHE A 280 0.754 0.754 -3.651 1.00 0.00 H new ATOM 0 HE2 PHE A 280 -2.212 -1.322 -5.905 1.00 0.00 H new ATOM 0 HZ PHE A 280 -1.404 0.747 -4.838 1.00 0.00 H new ATOM 852 N ILE A 281 2.782 -4.328 -1.931 1.00 0.00 N ATOM 853 CA ILE A 281 2.855 -4.268 -0.478 1.00 0.00 C ATOM 854 C ILE A 281 4.304 -4.181 -0.021 1.00 0.00 C ATOM 855 O ILE A 281 4.615 -3.521 0.971 1.00 0.00 O ATOM 856 CB ILE A 281 2.190 -5.493 0.177 1.00 0.00 C ATOM 857 CG1 ILE A 281 1.032 -5.994 -0.688 1.00 0.00 C ATOM 858 CG2 ILE A 281 1.703 -5.142 1.575 1.00 0.00 C ATOM 859 CD1 ILE A 281 0.087 -6.921 0.046 1.00 0.00 C ATOM 0 H ILE A 281 2.469 -5.225 -2.302 1.00 0.00 H new ATOM 0 HA ILE A 281 2.316 -3.374 -0.166 1.00 0.00 H new ATOM 0 HB ILE A 281 2.927 -6.291 0.259 1.00 0.00 H new ATOM 0 HG12 ILE A 281 0.471 -5.137 -1.061 1.00 0.00 H new ATOM 0 HG13 ILE A 281 1.436 -6.514 -1.557 1.00 0.00 H new ATOM 0 HG21 ILE A 281 1.235 -6.016 2.027 1.00 0.00 H new ATOM 0 HG22 ILE A 281 2.548 -4.826 2.186 1.00 0.00 H new ATOM 0 HG23 ILE A 281 0.976 -4.332 1.514 1.00 0.00 H new ATOM 0 HD11 ILE A 281 -0.709 -7.237 -0.628 1.00 0.00 H new ATOM 0 HD12 ILE A 281 0.635 -7.796 0.396 1.00 0.00 H new ATOM 0 HD13 ILE A 281 -0.346 -6.398 0.899 1.00 0.00 H new ATOM 871 N GLN A 282 5.188 -4.843 -0.759 1.00 0.00 N ATOM 872 CA GLN A 282 6.608 -4.828 -0.434 1.00 0.00 C ATOM 873 C GLN A 282 7.112 -3.393 -0.365 1.00 0.00 C ATOM 874 O GLN A 282 7.961 -3.057 0.460 1.00 0.00 O ATOM 875 CB GLN A 282 7.406 -5.611 -1.477 1.00 0.00 C ATOM 876 CG GLN A 282 7.661 -7.057 -1.088 1.00 0.00 C ATOM 877 CD GLN A 282 9.122 -7.330 -0.787 1.00 0.00 C ATOM 878 OE1 GLN A 282 9.831 -6.470 -0.265 1.00 0.00 O ATOM 879 NE2 GLN A 282 9.581 -8.531 -1.118 1.00 0.00 N ATOM 0 H GLN A 282 4.947 -5.394 -1.583 1.00 0.00 H new ATOM 0 HA GLN A 282 6.746 -5.303 0.538 1.00 0.00 H new ATOM 0 HB2 GLN A 282 6.869 -5.588 -2.425 1.00 0.00 H new ATOM 0 HB3 GLN A 282 8.362 -5.113 -1.640 1.00 0.00 H new ATOM 0 HG2 GLN A 282 7.061 -7.305 -0.213 1.00 0.00 H new ATOM 0 HG3 GLN A 282 7.332 -7.710 -1.896 1.00 0.00 H new ATOM 0 HE21 GLN A 282 8.958 -9.214 -1.549 1.00 0.00 H new ATOM 0 HE22 GLN A 282 10.557 -8.771 -0.941 1.00 0.00 H new ATOM 888 N MET A 283 6.571 -2.549 -1.239 1.00 0.00 N ATOM 889 CA MET A 283 6.948 -1.144 -1.287 1.00 0.00 C ATOM 890 C MET A 283 6.285 -0.370 -0.152 1.00 0.00 C ATOM 891 O MET A 283 6.930 0.429 0.526 1.00 0.00 O ATOM 892 CB MET A 283 6.557 -0.538 -2.636 1.00 0.00 C ATOM 893 CG MET A 283 7.637 0.343 -3.243 1.00 0.00 C ATOM 894 SD MET A 283 8.212 -0.264 -4.841 1.00 0.00 S ATOM 895 CE MET A 283 9.986 -0.118 -4.640 1.00 0.00 C ATOM 0 H MET A 283 5.867 -2.818 -1.926 1.00 0.00 H new ATOM 0 HA MET A 283 8.029 -1.074 -1.168 1.00 0.00 H new ATOM 0 HB2 MET A 283 6.323 -1.343 -3.332 1.00 0.00 H new ATOM 0 HB3 MET A 283 5.648 0.050 -2.511 1.00 0.00 H new ATOM 0 HG2 MET A 283 7.251 1.355 -3.361 1.00 0.00 H new ATOM 0 HG3 MET A 283 8.481 0.402 -2.556 1.00 0.00 H new ATOM 0 HE1 MET A 283 10.484 -0.457 -5.548 1.00 0.00 H new ATOM 0 HE2 MET A 283 10.246 0.923 -4.450 1.00 0.00 H new ATOM 0 HE3 MET A 283 10.309 -0.732 -3.799 1.00 0.00 H new ATOM 905 N LEU A 284 4.994 -0.620 0.055 1.00 0.00 N ATOM 906 CA LEU A 284 4.249 0.047 1.115 1.00 0.00 C ATOM 907 C LEU A 284 5.106 0.152 2.367 1.00 0.00 C ATOM 908 O LEU A 284 5.028 1.131 3.109 1.00 0.00 O ATOM 909 CB LEU A 284 2.957 -0.713 1.430 1.00 0.00 C ATOM 910 CG LEU A 284 1.795 -0.466 0.464 1.00 0.00 C ATOM 911 CD1 LEU A 284 0.466 -0.608 1.189 1.00 0.00 C ATOM 912 CD2 LEU A 284 1.905 0.911 -0.174 1.00 0.00 C ATOM 0 H LEU A 284 4.445 -1.279 -0.497 1.00 0.00 H new ATOM 0 HA LEU A 284 3.987 1.049 0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 284 3.177 -1.780 1.440 1.00 0.00 H new ATOM 0 HB3 LEU A 284 2.634 -0.444 2.436 1.00 0.00 H new ATOM 0 HG LEU A 284 1.844 -1.214 -0.328 1.00 0.00 H new ATOM 0 HD11 LEU A 284 -0.351 -0.430 0.490 1.00 0.00 H new ATOM 0 HD12 LEU A 284 0.380 -1.615 1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 284 0.414 0.119 2.000 1.00 0.00 H new ATOM 0 HD21 LEU A 284 1.069 1.064 -0.856 1.00 0.00 H new ATOM 0 HD22 LEU A 284 1.883 1.675 0.603 1.00 0.00 H new ATOM 0 HD23 LEU A 284 2.842 0.982 -0.727 1.00 0.00 H new ATOM 924 N ASN A 285 5.930 -0.865 2.589 1.00 0.00 N ATOM 925 CA ASN A 285 6.816 -0.892 3.745 1.00 0.00 C ATOM 926 C ASN A 285 8.146 -0.219 3.419 1.00 0.00 C ATOM 927 O ASN A 285 9.201 -0.663 3.872 1.00 0.00 O ATOM 928 CB ASN A 285 7.058 -2.334 4.197 1.00 0.00 C ATOM 929 CG ASN A 285 7.602 -2.410 5.610 1.00 0.00 C ATOM 930 OD1 ASN A 285 7.522 -1.447 6.373 1.00 0.00 O ATOM 931 ND2 ASN A 285 8.160 -3.561 5.968 1.00 0.00 N ATOM 0 H ASN A 285 6.003 -1.682 1.983 1.00 0.00 H new ATOM 0 HA ASN A 285 6.336 -0.343 4.555 1.00 0.00 H new ATOM 0 HB2 ASN A 285 6.124 -2.892 4.139 1.00 0.00 H new ATOM 0 HB3 ASN A 285 7.759 -2.814 3.514 1.00 0.00 H new ATOM 0 HD21 ASN A 285 8.543 -3.672 6.907 1.00 0.00 H new ATOM 0 HD22 ASN A 285 8.205 -4.334 5.304 1.00 0.00 H new ATOM 938 N GLU A 286 8.080 0.853 2.626 1.00 0.00 N ATOM 939 CA GLU A 286 9.270 1.602 2.225 1.00 0.00 C ATOM 940 C GLU A 286 10.372 1.502 3.275 1.00 0.00 C ATOM 941 O GLU A 286 10.132 1.704 4.466 1.00 0.00 O ATOM 942 CB GLU A 286 8.913 3.072 1.994 1.00 0.00 C ATOM 943 CG GLU A 286 8.417 3.780 3.244 1.00 0.00 C ATOM 944 CD GLU A 286 6.940 4.114 3.176 1.00 0.00 C ATOM 945 OE1 GLU A 286 6.603 5.208 2.675 1.00 0.00 O ATOM 946 OE2 GLU A 286 6.121 3.284 3.623 1.00 0.00 O ATOM 0 H GLU A 286 7.208 1.223 2.247 1.00 0.00 H new ATOM 0 HA GLU A 286 9.641 1.165 1.298 1.00 0.00 H new ATOM 0 HB2 GLU A 286 9.790 3.595 1.614 1.00 0.00 H new ATOM 0 HB3 GLU A 286 8.146 3.134 1.222 1.00 0.00 H new ATOM 0 HG2 GLU A 286 8.604 3.149 4.113 1.00 0.00 H new ATOM 0 HG3 GLU A 286 8.987 4.698 3.388 1.00 0.00 H new