USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 479 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 244 GLN : amide:sc= 0.232 K(o=-1.4,f=-0.88) USER MOD Set 1.2: A 290 HIS : no HE2:sc= -1.61 K(o=-1.4,f=-5.1!) USER MOD Set 2.1: A 279 CYS SG : rot 76:sc= 1.3 USER MOD Set 2.2: A 280 ASN : amide:sc= -0.0246 X(o=1.3,f=1.2) USER MOD Single : A 239 TYR OH : rot 180:sc= 0 USER MOD Single : A 245 LYS NZ :NH3+ -162:sc= -0.216 (180deg=-0.601) USER MOD Single : A 249 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 254 THR OG1 : rot -5:sc= 1.24 USER MOD Single : A 265 LYS NZ :NH3+ -166:sc= -0.0194 (180deg=-0.246) USER MOD Single : A 267 THR OG1 : rot -23:sc= 0.442 USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 270 ASN : amide:sc= -3.04! C(o=-3!,f=-10!) USER MOD Single : A 272 SER OG : rot 180:sc= 0 USER MOD Single : A 274 GLN : amide:sc= -0.972 K(o=-0.97,f=-0.36) USER MOD Single : A 282 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 285 HIS : no HD1:sc= 0.369 K(o=0.37,f=-1.8!) USER MOD Single : A 289 THR OG1 : rot 180:sc= -0.0195 USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 10.315 -5.189 0.223 1.00 0.00 N ATOM 9 CA PRO A 237 8.987 -4.678 0.509 1.00 0.00 C ATOM 10 C PRO A 237 9.031 -3.541 1.522 1.00 0.00 C ATOM 11 O PRO A 237 9.525 -3.725 2.637 1.00 0.00 O ATOM 12 CB PRO A 237 8.261 -5.898 1.108 1.00 0.00 C ATOM 13 CG PRO A 237 9.300 -6.970 1.276 1.00 0.00 C ATOM 14 CD PRO A 237 10.638 -6.312 1.098 1.00 0.00 C ATOM 0 HA PRO A 237 8.499 -4.268 -0.375 1.00 0.00 H new ATOM 0 HB2 PRO A 237 7.804 -5.647 2.065 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.459 -6.234 0.451 1.00 0.00 H new ATOM 0 HG2 PRO A 237 9.224 -7.430 2.261 1.00 0.00 H new ATOM 0 HG3 PRO A 237 9.159 -7.763 0.542 1.00 0.00 H new ATOM 0 HD2 PRO A 237 11.058 -5.981 2.048 1.00 0.00 H new ATOM 0 HD3 PRO A 237 11.366 -6.985 0.645 1.00 0.00 H new ATOM 22 N ILE A 238 8.527 -2.365 1.152 1.00 0.00 N ATOM 23 CA ILE A 238 8.540 -1.250 2.103 1.00 0.00 C ATOM 24 C ILE A 238 7.324 -1.325 2.999 1.00 0.00 C ATOM 25 O ILE A 238 6.333 -1.988 2.674 1.00 0.00 O ATOM 26 CB ILE A 238 8.577 0.181 1.477 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.223 0.610 0.913 1.00 0.00 C ATOM 28 CG2 ILE A 238 9.631 0.298 0.400 1.00 0.00 C ATOM 29 CD1 ILE A 238 6.872 -0.072 -0.380 1.00 0.00 C ATOM 0 H ILE A 238 8.120 -2.161 0.239 1.00 0.00 H new ATOM 0 HA ILE A 238 9.477 -1.375 2.646 1.00 0.00 H new ATOM 0 HB ILE A 238 8.833 0.852 2.297 1.00 0.00 H new ATOM 0 HG12 ILE A 238 6.447 0.398 1.649 1.00 0.00 H new ATOM 0 HG13 ILE A 238 7.228 1.689 0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 238 9.623 1.308 -0.009 1.00 0.00 H new ATOM 0 HG22 ILE A 238 10.612 0.087 0.826 1.00 0.00 H new ATOM 0 HG23 ILE A 238 9.419 -0.417 -0.395 1.00 0.00 H new ATOM 0 HD11 ILE A 238 5.899 0.279 -0.724 1.00 0.00 H new ATOM 0 HD12 ILE A 238 7.627 0.160 -1.131 1.00 0.00 H new ATOM 0 HD13 ILE A 238 6.835 -1.150 -0.224 1.00 0.00 H new ATOM 41 N TYR A 239 7.391 -0.635 4.117 1.00 0.00 N ATOM 42 CA TYR A 239 6.233 -0.496 4.963 1.00 0.00 C ATOM 43 C TYR A 239 5.680 0.882 4.755 1.00 0.00 C ATOM 44 O TYR A 239 6.343 1.861 5.047 1.00 0.00 O ATOM 45 CB TYR A 239 6.582 -0.702 6.436 1.00 0.00 C ATOM 46 CG TYR A 239 6.814 -2.141 6.805 1.00 0.00 C ATOM 47 CD1 TYR A 239 5.789 -3.071 6.717 1.00 0.00 C ATOM 48 CD2 TYR A 239 8.053 -2.570 7.250 1.00 0.00 C ATOM 49 CE1 TYR A 239 5.993 -4.387 7.060 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.265 -3.888 7.593 1.00 0.00 C ATOM 51 CZ TYR A 239 7.233 -4.792 7.498 1.00 0.00 C ATOM 52 OH TYR A 239 7.440 -6.107 7.842 1.00 0.00 O ATOM 0 H TYR A 239 8.230 -0.166 4.457 1.00 0.00 H new ATOM 0 HA TYR A 239 5.499 -1.257 4.699 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.477 -0.126 6.672 1.00 0.00 H new ATOM 0 HB3 TYR A 239 5.775 -0.304 7.051 1.00 0.00 H new ATOM 0 HD1 TYR A 239 4.815 -2.757 6.373 1.00 0.00 H new ATOM 0 HD2 TYR A 239 8.865 -1.862 7.329 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.184 -5.099 6.986 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.238 -4.210 7.935 1.00 0.00 H new ATOM 0 HH TYR A 239 8.369 -6.228 8.129 1.00 0.00 H new ATOM 62 N ALA A 240 4.465 0.978 4.288 1.00 0.00 N ATOM 63 CA ALA A 240 3.935 2.271 3.955 1.00 0.00 C ATOM 64 C ALA A 240 2.833 2.638 4.910 1.00 0.00 C ATOM 65 O ALA A 240 1.787 1.988 4.963 1.00 0.00 O ATOM 66 CB ALA A 240 3.430 2.289 2.521 1.00 0.00 C ATOM 0 H ALA A 240 3.834 0.192 4.132 1.00 0.00 H new ATOM 0 HA ALA A 240 4.732 3.009 4.042 1.00 0.00 H new ATOM 0 HB1 ALA A 240 3.032 3.277 2.288 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.252 2.059 1.843 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.643 1.544 2.403 1.00 0.00 H new ATOM 72 N ARG A 241 3.081 3.685 5.664 1.00 0.00 N ATOM 73 CA ARG A 241 2.094 4.223 6.556 1.00 0.00 C ATOM 74 C ARG A 241 1.086 4.980 5.717 1.00 0.00 C ATOM 75 O ARG A 241 1.346 6.096 5.263 1.00 0.00 O ATOM 76 CB ARG A 241 2.763 5.149 7.577 1.00 0.00 C ATOM 77 CG ARG A 241 1.789 5.771 8.572 1.00 0.00 C ATOM 78 CD ARG A 241 1.216 4.747 9.540 1.00 0.00 C ATOM 79 NE ARG A 241 2.189 4.351 10.556 1.00 0.00 N ATOM 80 CZ ARG A 241 1.920 3.524 11.565 1.00 0.00 C ATOM 81 NH1 ARG A 241 0.710 2.993 11.693 1.00 0.00 N ATOM 82 NH2 ARG A 241 2.855 3.237 12.463 1.00 0.00 N ATOM 0 H ARG A 241 3.972 4.182 5.672 1.00 0.00 H new ATOM 0 HA ARG A 241 1.594 3.429 7.111 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.518 4.585 8.125 1.00 0.00 H new ATOM 0 HB3 ARG A 241 3.283 5.946 7.045 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.299 6.553 9.135 1.00 0.00 H new ATOM 0 HG3 ARG A 241 0.974 6.249 8.028 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.333 5.162 10.026 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.891 3.866 8.986 1.00 0.00 H new ATOM 0 HE ARG A 241 3.133 4.732 10.488 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -0.020 3.218 11.017 1.00 0.00 H new ATOM 0 HH12 ARG A 241 0.510 2.360 12.468 1.00 0.00 H new ATOM 0 HH21 ARG A 241 3.784 3.650 12.382 1.00 0.00 H new ATOM 0 HH22 ARG A 241 2.644 2.603 13.234 1.00 0.00 H new ATOM 96 N VAL A 242 -0.048 4.363 5.479 1.00 0.00 N ATOM 97 CA VAL A 242 -1.032 4.958 4.607 1.00 0.00 C ATOM 98 C VAL A 242 -1.840 5.990 5.366 1.00 0.00 C ATOM 99 O VAL A 242 -2.488 5.684 6.365 1.00 0.00 O ATOM 100 CB VAL A 242 -1.948 3.910 3.943 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.605 3.008 4.970 1.00 0.00 C ATOM 102 CG2 VAL A 242 -2.996 4.599 3.096 1.00 0.00 C ATOM 0 H VAL A 242 -0.310 3.459 5.872 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.496 5.451 3.796 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.328 3.281 3.304 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.242 2.283 4.463 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.837 2.482 5.537 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.209 3.610 5.649 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.638 3.851 2.631 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.599 5.254 3.725 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.507 5.189 2.321 1.00 0.00 H new ATOM 112 N ILE A 243 -1.776 7.221 4.888 1.00 0.00 N ATOM 113 CA ILE A 243 -2.371 8.346 5.585 1.00 0.00 C ATOM 114 C ILE A 243 -3.691 8.761 4.955 1.00 0.00 C ATOM 115 O ILE A 243 -4.257 9.795 5.311 1.00 0.00 O ATOM 116 CB ILE A 243 -1.395 9.551 5.642 1.00 0.00 C ATOM 117 CG1 ILE A 243 -0.880 9.955 4.245 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.224 9.222 6.551 1.00 0.00 C ATOM 119 CD1 ILE A 243 -1.862 10.763 3.426 1.00 0.00 C ATOM 0 H ILE A 243 -1.314 7.467 4.013 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.574 8.020 6.605 1.00 0.00 H new ATOM 0 HB ILE A 243 -1.948 10.401 6.041 1.00 0.00 H new ATOM 0 HG12 ILE A 243 0.037 10.532 4.362 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -0.621 9.052 3.692 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.458 10.071 6.587 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.591 9.008 7.555 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.303 8.350 6.164 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -1.419 11.004 2.460 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -2.772 10.183 3.273 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.104 11.685 3.954 1.00 0.00 H new ATOM 131 N GLN A 244 -4.178 7.947 4.025 1.00 0.00 N ATOM 132 CA GLN A 244 -5.403 8.257 3.306 1.00 0.00 C ATOM 133 C GLN A 244 -5.759 7.123 2.366 1.00 0.00 C ATOM 134 O GLN A 244 -5.224 7.034 1.262 1.00 0.00 O ATOM 135 CB GLN A 244 -5.237 9.541 2.494 1.00 0.00 C ATOM 136 CG GLN A 244 -6.493 9.957 1.747 1.00 0.00 C ATOM 137 CD GLN A 244 -6.222 11.011 0.695 1.00 0.00 C ATOM 138 OE1 GLN A 244 -5.949 10.692 -0.461 1.00 0.00 O ATOM 139 NE2 GLN A 244 -6.282 12.269 1.090 1.00 0.00 N ATOM 0 H GLN A 244 -3.741 7.067 3.753 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.200 8.392 4.037 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -4.939 10.348 3.163 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -4.427 9.405 1.778 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -6.936 9.081 1.273 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -7.225 10.339 2.459 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -6.512 12.489 2.059 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -6.098 13.021 0.426 1.00 0.00 H new ATOM 148 N LYS A 245 -6.613 6.227 2.807 1.00 0.00 N ATOM 149 CA LYS A 245 -7.099 5.185 1.930 1.00 0.00 C ATOM 150 C LYS A 245 -8.535 4.815 2.260 1.00 0.00 C ATOM 151 O LYS A 245 -9.067 5.153 3.321 1.00 0.00 O ATOM 152 CB LYS A 245 -6.200 3.950 1.965 1.00 0.00 C ATOM 153 CG LYS A 245 -5.795 3.455 0.576 1.00 0.00 C ATOM 154 CD LYS A 245 -4.358 3.846 0.239 1.00 0.00 C ATOM 155 CE LYS A 245 -3.533 2.660 -0.262 1.00 0.00 C ATOM 156 NZ LYS A 245 -2.122 3.041 -0.553 1.00 0.00 N ATOM 0 H LYS A 245 -6.982 6.198 3.757 1.00 0.00 H new ATOM 0 HA LYS A 245 -7.074 5.582 0.915 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.301 4.180 2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.717 3.148 2.492 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -5.898 2.371 0.531 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -6.471 3.871 -0.171 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -4.366 4.627 -0.522 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -3.882 4.268 1.124 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.547 1.868 0.486 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -3.992 2.255 -1.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.686 2.319 -1.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -2.104 3.961 -1.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -1.590 3.109 0.338 1.00 0.00 H new ATOM 170 N ARG A 246 -9.131 4.130 1.316 1.00 0.00 N ATOM 171 CA ARG A 246 -10.517 3.698 1.367 1.00 0.00 C ATOM 172 C ARG A 246 -10.554 2.204 1.657 1.00 0.00 C ATOM 173 O ARG A 246 -9.509 1.593 1.859 1.00 0.00 O ATOM 174 CB ARG A 246 -11.194 3.994 0.026 1.00 0.00 C ATOM 175 CG ARG A 246 -10.548 3.272 -1.146 1.00 0.00 C ATOM 176 CD ARG A 246 -11.303 3.504 -2.444 1.00 0.00 C ATOM 177 NE ARG A 246 -12.645 2.924 -2.407 1.00 0.00 N ATOM 178 CZ ARG A 246 -13.093 2.021 -3.283 1.00 0.00 C ATOM 179 NH1 ARG A 246 -12.304 1.575 -4.253 1.00 0.00 N ATOM 180 NH2 ARG A 246 -14.340 1.568 -3.193 1.00 0.00 N ATOM 0 H ARG A 246 -8.654 3.845 0.460 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.049 4.233 2.153 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -12.244 3.708 0.086 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -11.166 5.068 -0.158 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.519 3.613 -1.259 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.508 2.203 -0.936 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -11.376 4.575 -2.635 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -10.743 3.070 -3.272 1.00 0.00 H new ATOM 0 HE ARG A 246 -13.278 3.228 -1.667 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -11.348 1.922 -4.333 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -12.654 0.885 -4.918 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -14.955 1.910 -2.455 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -14.682 0.878 -3.862 1.00 0.00 H new ATOM 194 N VAL A 247 -11.736 1.603 1.660 1.00 0.00 N ATOM 195 CA VAL A 247 -11.860 0.180 1.970 1.00 0.00 C ATOM 196 C VAL A 247 -12.257 -0.635 0.730 1.00 0.00 C ATOM 197 O VAL A 247 -13.382 -1.131 0.619 1.00 0.00 O ATOM 198 CB VAL A 247 -12.861 -0.072 3.123 1.00 0.00 C ATOM 199 CG1 VAL A 247 -12.226 0.281 4.460 1.00 0.00 C ATOM 200 CG2 VAL A 247 -14.142 0.726 2.920 1.00 0.00 C ATOM 0 H VAL A 247 -12.618 2.072 1.453 1.00 0.00 H new ATOM 0 HA VAL A 247 -10.877 -0.156 2.299 1.00 0.00 H new ATOM 0 HB VAL A 247 -13.118 -1.131 3.123 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -12.941 0.099 5.262 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -11.341 -0.335 4.616 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -11.940 1.333 4.461 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -14.827 0.530 3.745 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -13.907 1.790 2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -14.610 0.430 1.981 1.00 0.00 H new ATOM 210 N PRO A 248 -11.318 -0.773 -0.221 1.00 0.00 N ATOM 211 CA PRO A 248 -11.489 -1.507 -1.460 1.00 0.00 C ATOM 212 C PRO A 248 -10.967 -2.940 -1.351 1.00 0.00 C ATOM 213 O PRO A 248 -9.804 -3.166 -1.026 1.00 0.00 O ATOM 214 CB PRO A 248 -10.632 -0.690 -2.435 1.00 0.00 C ATOM 215 CG PRO A 248 -9.668 0.093 -1.590 1.00 0.00 C ATOM 216 CD PRO A 248 -9.973 -0.234 -0.164 1.00 0.00 C ATOM 0 HA PRO A 248 -12.533 -1.611 -1.757 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -10.101 -1.343 -3.128 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -11.252 -0.025 -3.036 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.639 -0.170 -1.835 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -9.776 1.162 -1.772 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.267 -0.959 0.242 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -9.922 0.651 0.471 1.00 0.00 H new ATOM 224 N ASN A 249 -11.826 -3.902 -1.618 1.00 0.00 N ATOM 225 CA ASN A 249 -11.446 -5.306 -1.544 1.00 0.00 C ATOM 226 C ASN A 249 -10.660 -5.727 -2.783 1.00 0.00 C ATOM 227 O ASN A 249 -10.486 -4.944 -3.717 1.00 0.00 O ATOM 228 CB ASN A 249 -12.688 -6.188 -1.386 1.00 0.00 C ATOM 229 CG ASN A 249 -13.329 -6.055 -0.019 1.00 0.00 C ATOM 230 OD1 ASN A 249 -12.996 -6.793 0.908 1.00 0.00 O ATOM 231 ND2 ASN A 249 -14.243 -5.109 0.121 1.00 0.00 N ATOM 0 H ASN A 249 -12.796 -3.741 -1.889 1.00 0.00 H new ATOM 0 HA ASN A 249 -10.806 -5.435 -0.671 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.417 -5.923 -2.152 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.413 -7.229 -1.554 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -14.700 -4.971 1.022 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -14.491 -4.518 -0.672 1.00 0.00 H new ATOM 238 N ALA A 250 -10.190 -6.973 -2.792 1.00 0.00 N ATOM 239 CA ALA A 250 -9.508 -7.543 -3.958 1.00 0.00 C ATOM 240 C ALA A 250 -10.442 -7.617 -5.169 1.00 0.00 C ATOM 241 O ALA A 250 -10.055 -8.025 -6.258 1.00 0.00 O ATOM 242 CB ALA A 250 -8.992 -8.928 -3.625 1.00 0.00 C ATOM 0 H ALA A 250 -10.269 -7.612 -2.001 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.673 -6.891 -4.213 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -8.486 -9.347 -4.495 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.291 -8.865 -2.793 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -9.828 -9.570 -3.347 1.00 0.00 H new ATOM 248 N TYR A 251 -11.671 -7.211 -4.955 1.00 0.00 N ATOM 249 CA TYR A 251 -12.686 -7.191 -5.995 1.00 0.00 C ATOM 250 C TYR A 251 -12.717 -5.823 -6.667 1.00 0.00 C ATOM 251 O TYR A 251 -13.467 -5.597 -7.614 1.00 0.00 O ATOM 252 CB TYR A 251 -14.062 -7.514 -5.407 1.00 0.00 C ATOM 253 CG TYR A 251 -14.140 -8.869 -4.737 1.00 0.00 C ATOM 254 CD1 TYR A 251 -13.460 -9.117 -3.554 1.00 0.00 C ATOM 255 CD2 TYR A 251 -14.896 -9.897 -5.286 1.00 0.00 C ATOM 256 CE1 TYR A 251 -13.526 -10.346 -2.936 1.00 0.00 C ATOM 257 CE2 TYR A 251 -14.968 -11.134 -4.672 1.00 0.00 C ATOM 258 CZ TYR A 251 -14.278 -11.352 -3.497 1.00 0.00 C ATOM 259 OH TYR A 251 -14.344 -12.576 -2.877 1.00 0.00 O ATOM 0 H TYR A 251 -12.003 -6.881 -4.048 1.00 0.00 H new ATOM 0 HA TYR A 251 -12.437 -7.949 -6.738 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -14.326 -6.745 -4.681 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -14.806 -7.470 -6.203 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -12.867 -8.331 -3.109 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -15.436 -9.728 -6.206 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -12.990 -10.519 -2.015 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -15.560 -11.924 -5.109 1.00 0.00 H new ATOM 0 HH TYR A 251 -14.916 -13.177 -3.399 1.00 0.00 H new ATOM 269 N ASP A 252 -11.877 -4.917 -6.178 1.00 0.00 N ATOM 270 CA ASP A 252 -11.807 -3.562 -6.714 1.00 0.00 C ATOM 271 C ASP A 252 -10.695 -3.489 -7.737 1.00 0.00 C ATOM 272 O ASP A 252 -9.867 -2.577 -7.709 1.00 0.00 O ATOM 273 CB ASP A 252 -11.549 -2.546 -5.597 1.00 0.00 C ATOM 274 CG ASP A 252 -12.815 -1.869 -5.111 1.00 0.00 C ATOM 275 OD1 ASP A 252 -13.573 -2.489 -4.335 1.00 0.00 O ATOM 276 OD2 ASP A 252 -13.049 -0.702 -5.495 1.00 0.00 O ATOM 0 H ASP A 252 -11.233 -5.097 -5.408 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.761 -3.320 -7.183 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -11.068 -3.050 -4.759 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -10.853 -1.788 -5.956 1.00 0.00 H new ATOM 281 N LYS A 253 -10.690 -4.470 -8.640 1.00 0.00 N ATOM 282 CA LYS A 253 -9.557 -4.713 -9.525 1.00 0.00 C ATOM 283 C LYS A 253 -8.337 -5.016 -8.668 1.00 0.00 C ATOM 284 O LYS A 253 -7.201 -4.717 -9.035 1.00 0.00 O ATOM 285 CB LYS A 253 -9.305 -3.523 -10.461 1.00 0.00 C ATOM 286 CG LYS A 253 -10.535 -3.115 -11.259 1.00 0.00 C ATOM 287 CD LYS A 253 -11.139 -4.299 -11.995 1.00 0.00 C ATOM 288 CE LYS A 253 -12.494 -3.954 -12.589 1.00 0.00 C ATOM 289 NZ LYS A 253 -13.138 -5.134 -13.221 1.00 0.00 N ATOM 0 H LYS A 253 -11.469 -5.114 -8.776 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.774 -5.566 -10.168 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -8.964 -2.672 -9.872 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -8.500 -3.776 -11.151 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -11.279 -2.684 -10.589 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -10.264 -2.339 -11.975 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -10.463 -4.618 -12.789 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -11.245 -5.139 -11.309 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -13.144 -3.561 -11.807 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -12.375 -3.165 -13.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -14.060 -4.857 -13.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -12.530 -5.494 -13.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -13.275 -5.878 -12.508 1.00 0.00 H new ATOM 303 N THR A 254 -8.627 -5.606 -7.507 1.00 0.00 N ATOM 304 CA THR A 254 -7.654 -5.975 -6.497 1.00 0.00 C ATOM 305 C THR A 254 -6.963 -4.747 -5.931 1.00 0.00 C ATOM 306 O THR A 254 -5.916 -4.307 -6.405 1.00 0.00 O ATOM 307 CB THR A 254 -6.626 -7.027 -6.968 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.702 -6.489 -7.924 1.00 0.00 O ATOM 309 CG2 THR A 254 -7.321 -8.229 -7.580 1.00 0.00 C ATOM 0 H THR A 254 -9.582 -5.845 -7.242 1.00 0.00 H new ATOM 0 HA THR A 254 -8.223 -6.458 -5.702 1.00 0.00 H new ATOM 0 HB THR A 254 -6.070 -7.333 -6.082 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.963 -5.572 -8.151 1.00 0.00 H new ATOM 0 HG21 THR A 254 -6.575 -8.955 -7.904 1.00 0.00 H new ATOM 0 HG22 THR A 254 -7.976 -8.687 -6.839 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.912 -7.909 -8.438 1.00 0.00 H new ATOM 317 N ALA A 255 -7.593 -4.171 -4.935 1.00 0.00 N ATOM 318 CA ALA A 255 -7.046 -3.012 -4.255 1.00 0.00 C ATOM 319 C ALA A 255 -6.841 -3.297 -2.770 1.00 0.00 C ATOM 320 O ALA A 255 -7.366 -4.275 -2.237 1.00 0.00 O ATOM 321 CB ALA A 255 -7.960 -1.820 -4.458 1.00 0.00 C ATOM 0 H ALA A 255 -8.493 -4.486 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 255 -6.070 -2.782 -4.683 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.545 -0.952 -3.946 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -8.047 -1.605 -5.523 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -8.946 -2.044 -4.051 1.00 0.00 H new ATOM 327 N LEU A 256 -6.051 -2.451 -2.124 1.00 0.00 N ATOM 328 CA LEU A 256 -5.774 -2.583 -0.696 1.00 0.00 C ATOM 329 C LEU A 256 -6.875 -1.957 0.136 1.00 0.00 C ATOM 330 O LEU A 256 -7.121 -0.759 0.032 1.00 0.00 O ATOM 331 CB LEU A 256 -4.450 -1.910 -0.317 1.00 0.00 C ATOM 332 CG LEU A 256 -3.193 -2.745 -0.501 1.00 0.00 C ATOM 333 CD1 LEU A 256 -3.251 -3.983 0.376 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.025 -3.115 -1.953 1.00 0.00 C ATOM 0 H LEU A 256 -5.586 -1.659 -2.568 1.00 0.00 H new ATOM 0 HA LEU A 256 -5.715 -3.652 -0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -4.347 -1.001 -0.909 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.508 -1.605 0.728 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.327 -2.157 -0.197 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -2.345 -4.572 0.234 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -3.330 -3.685 1.421 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -4.120 -4.582 0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.122 -3.713 -2.074 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -3.889 -3.692 -2.284 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -2.943 -2.208 -2.552 1.00 0.00 H new ATOM 346 N ALA A 257 -7.508 -2.755 0.977 1.00 0.00 N ATOM 347 CA ALA A 257 -8.523 -2.252 1.880 1.00 0.00 C ATOM 348 C ALA A 257 -7.891 -1.797 3.181 1.00 0.00 C ATOM 349 O ALA A 257 -7.720 -2.573 4.123 1.00 0.00 O ATOM 350 CB ALA A 257 -9.584 -3.300 2.119 1.00 0.00 C ATOM 0 H ALA A 257 -7.335 -3.757 1.052 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.006 -1.389 1.422 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.338 -2.905 2.800 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.053 -3.565 1.172 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.127 -4.187 2.559 1.00 0.00 H new ATOM 356 N LEU A 258 -7.542 -0.529 3.212 1.00 0.00 N ATOM 357 CA LEU A 258 -6.817 0.055 4.338 1.00 0.00 C ATOM 358 C LEU A 258 -7.203 1.522 4.522 1.00 0.00 C ATOM 359 O LEU A 258 -7.951 2.070 3.735 1.00 0.00 O ATOM 360 CB LEU A 258 -5.300 -0.120 4.159 1.00 0.00 C ATOM 361 CG LEU A 258 -4.845 -0.453 2.749 1.00 0.00 C ATOM 362 CD1 LEU A 258 -5.129 0.691 1.817 1.00 0.00 C ATOM 363 CD2 LEU A 258 -3.377 -0.772 2.724 1.00 0.00 C ATOM 0 H LEU A 258 -7.749 0.132 2.463 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.099 -0.475 5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -4.806 0.799 4.475 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -4.961 -0.911 4.828 1.00 0.00 H new ATOM 0 HG LEU A 258 -5.402 -1.329 2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.796 0.433 0.812 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -6.200 0.892 1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -4.597 1.579 2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.073 -1.007 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -2.812 0.089 3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -3.180 -1.629 3.368 1.00 0.00 H new ATOM 375 N GLU A 259 -6.685 2.159 5.546 1.00 0.00 N ATOM 376 CA GLU A 259 -7.261 3.400 6.020 1.00 0.00 C ATOM 377 C GLU A 259 -6.169 4.377 6.458 1.00 0.00 C ATOM 378 O GLU A 259 -5.010 3.994 6.595 1.00 0.00 O ATOM 379 CB GLU A 259 -8.194 3.043 7.190 1.00 0.00 C ATOM 380 CG GLU A 259 -8.592 4.197 8.089 1.00 0.00 C ATOM 381 CD GLU A 259 -9.258 3.718 9.360 1.00 0.00 C ATOM 382 OE1 GLU A 259 -10.484 3.489 9.344 1.00 0.00 O ATOM 383 OE2 GLU A 259 -8.558 3.558 10.383 1.00 0.00 O ATOM 0 H GLU A 259 -5.868 1.841 6.067 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.819 3.897 5.226 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.100 2.594 6.784 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -7.707 2.282 7.800 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -7.708 4.783 8.341 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -9.270 4.859 7.551 1.00 0.00 H new ATOM 390 N VAL A 260 -6.548 5.637 6.661 1.00 0.00 N ATOM 391 CA VAL A 260 -5.634 6.644 7.182 1.00 0.00 C ATOM 392 C VAL A 260 -5.064 6.226 8.540 1.00 0.00 C ATOM 393 O VAL A 260 -5.795 6.038 9.512 1.00 0.00 O ATOM 394 CB VAL A 260 -6.331 8.023 7.307 1.00 0.00 C ATOM 395 CG1 VAL A 260 -7.719 7.877 7.913 1.00 0.00 C ATOM 396 CG2 VAL A 260 -5.488 8.988 8.135 1.00 0.00 C ATOM 0 H VAL A 260 -7.488 5.984 6.470 1.00 0.00 H new ATOM 0 HA VAL A 260 -4.812 6.731 6.471 1.00 0.00 H new ATOM 0 HB VAL A 260 -6.436 8.435 6.303 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -8.187 8.858 7.990 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -8.328 7.233 7.278 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -7.638 7.435 8.906 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -5.999 9.948 8.207 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -5.342 8.578 9.134 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -4.519 9.128 7.656 1.00 0.00 H new ATOM 406 N GLY A 261 -3.753 6.062 8.579 1.00 0.00 N ATOM 407 CA GLY A 261 -3.066 5.737 9.809 1.00 0.00 C ATOM 408 C GLY A 261 -2.585 4.304 9.825 1.00 0.00 C ATOM 409 O GLY A 261 -1.917 3.870 10.768 1.00 0.00 O ATOM 0 H GLY A 261 -3.143 6.150 7.766 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.216 6.407 9.938 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.735 5.905 10.653 1.00 0.00 H new ATOM 413 N GLU A 262 -2.903 3.570 8.770 1.00 0.00 N ATOM 414 CA GLU A 262 -2.623 2.141 8.733 1.00 0.00 C ATOM 415 C GLU A 262 -1.303 1.852 8.031 1.00 0.00 C ATOM 416 O GLU A 262 -0.553 2.767 7.692 1.00 0.00 O ATOM 417 CB GLU A 262 -3.758 1.389 8.051 1.00 0.00 C ATOM 418 CG GLU A 262 -5.093 1.572 8.740 1.00 0.00 C ATOM 419 CD GLU A 262 -6.031 0.408 8.501 1.00 0.00 C ATOM 420 OE1 GLU A 262 -6.246 0.033 7.332 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.535 -0.163 9.489 1.00 0.00 O ATOM 0 H GLU A 262 -3.353 3.937 7.931 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.541 1.794 9.763 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.840 1.727 7.018 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.515 0.327 8.020 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -4.932 1.691 9.811 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.560 2.490 8.383 1.00 0.00 H new ATOM 428 N LEU A 263 -1.020 0.576 7.822 1.00 0.00 N ATOM 429 CA LEU A 263 0.260 0.160 7.272 1.00 0.00 C ATOM 430 C LEU A 263 0.062 -0.866 6.162 1.00 0.00 C ATOM 431 O LEU A 263 -0.537 -1.920 6.372 1.00 0.00 O ATOM 432 CB LEU A 263 1.124 -0.404 8.413 1.00 0.00 C ATOM 433 CG LEU A 263 2.569 -0.823 8.077 1.00 0.00 C ATOM 434 CD1 LEU A 263 2.619 -2.108 7.272 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.290 0.296 7.353 1.00 0.00 C ATOM 0 H LEU A 263 -1.661 -0.191 8.025 1.00 0.00 H new ATOM 0 HA LEU A 263 0.769 1.015 6.827 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.167 0.346 9.203 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.610 -1.272 8.825 1.00 0.00 H new ATOM 0 HG LEU A 263 3.080 -1.018 9.020 1.00 0.00 H new ATOM 0 HD11 LEU A 263 3.657 -2.364 7.059 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.157 -2.913 7.843 1.00 0.00 H new ATOM 0 HD13 LEU A 263 2.079 -1.972 6.335 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.309 -0.016 7.123 1.00 0.00 H new ATOM 0 HD22 LEU A 263 2.764 0.528 6.427 1.00 0.00 H new ATOM 0 HD23 LEU A 263 3.317 1.182 7.987 1.00 0.00 H new ATOM 447 N VAL A 264 0.569 -0.542 4.978 1.00 0.00 N ATOM 448 CA VAL A 264 0.563 -1.466 3.853 1.00 0.00 C ATOM 449 C VAL A 264 1.991 -1.863 3.494 1.00 0.00 C ATOM 450 O VAL A 264 2.846 -1.009 3.271 1.00 0.00 O ATOM 451 CB VAL A 264 -0.149 -0.864 2.616 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.354 0.541 2.310 1.00 0.00 C ATOM 453 CG2 VAL A 264 0.024 -1.769 1.401 1.00 0.00 C ATOM 0 H VAL A 264 0.993 0.363 4.773 1.00 0.00 H new ATOM 0 HA VAL A 264 0.005 -2.352 4.156 1.00 0.00 H new ATOM 0 HB VAL A 264 -1.211 -0.794 2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -0.167 0.932 1.436 1.00 0.00 H new ATOM 0 HG12 VAL A 264 0.165 1.189 3.166 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.425 0.508 2.109 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.484 -1.328 0.543 1.00 0.00 H new ATOM 0 HG22 VAL A 264 1.085 -1.879 1.177 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -0.406 -2.748 1.613 1.00 0.00 H new ATOM 463 N LYS A 265 2.250 -3.155 3.455 1.00 0.00 N ATOM 464 CA LYS A 265 3.576 -3.650 3.145 1.00 0.00 C ATOM 465 C LYS A 265 3.654 -4.001 1.663 1.00 0.00 C ATOM 466 O LYS A 265 3.240 -5.080 1.241 1.00 0.00 O ATOM 467 CB LYS A 265 3.888 -4.863 4.030 1.00 0.00 C ATOM 468 CG LYS A 265 5.353 -5.277 4.041 1.00 0.00 C ATOM 469 CD LYS A 265 5.630 -6.420 3.093 1.00 0.00 C ATOM 470 CE LYS A 265 4.892 -7.671 3.516 1.00 0.00 C ATOM 471 NZ LYS A 265 5.354 -8.178 4.840 1.00 0.00 N ATOM 0 H LYS A 265 1.558 -3.882 3.635 1.00 0.00 H new ATOM 0 HA LYS A 265 4.322 -2.882 3.349 1.00 0.00 H new ATOM 0 HB2 LYS A 265 3.579 -4.641 5.051 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.288 -5.707 3.692 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.972 -4.423 3.768 1.00 0.00 H new ATOM 0 HG3 LYS A 265 5.639 -5.568 5.052 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.328 -6.140 2.084 1.00 0.00 H new ATOM 0 HD3 LYS A 265 6.701 -6.619 3.062 1.00 0.00 H new ATOM 0 HE2 LYS A 265 3.823 -7.462 3.562 1.00 0.00 H new ATOM 0 HE3 LYS A 265 5.033 -8.446 2.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 5.004 -9.147 4.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 6.394 -8.178 4.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 4.987 -7.563 5.594 1.00 0.00 H new ATOM 485 N VAL A 266 4.159 -3.069 0.869 1.00 0.00 N ATOM 486 CA VAL A 266 4.246 -3.257 -0.568 1.00 0.00 C ATOM 487 C VAL A 266 5.321 -4.266 -0.922 1.00 0.00 C ATOM 488 O VAL A 266 6.512 -4.017 -0.712 1.00 0.00 O ATOM 489 CB VAL A 266 4.556 -1.944 -1.290 1.00 0.00 C ATOM 490 CG1 VAL A 266 4.735 -2.188 -2.773 1.00 0.00 C ATOM 491 CG2 VAL A 266 3.468 -0.912 -1.038 1.00 0.00 C ATOM 0 H VAL A 266 4.516 -2.172 1.199 1.00 0.00 H new ATOM 0 HA VAL A 266 3.273 -3.625 -0.893 1.00 0.00 H new ATOM 0 HB VAL A 266 5.489 -1.547 -0.891 1.00 0.00 H new ATOM 0 HG11 VAL A 266 4.955 -1.245 -3.273 1.00 0.00 H new ATOM 0 HG12 VAL A 266 5.560 -2.883 -2.930 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.819 -2.612 -3.185 1.00 0.00 H new ATOM 0 HG21 VAL A 266 3.714 0.011 -1.563 1.00 0.00 H new ATOM 0 HG22 VAL A 266 2.514 -1.293 -1.402 1.00 0.00 H new ATOM 0 HG23 VAL A 266 3.396 -0.713 0.031 1.00 0.00 H new ATOM 501 N THR A 267 4.878 -5.384 -1.485 1.00 0.00 N ATOM 502 CA THR A 267 5.758 -6.479 -1.861 1.00 0.00 C ATOM 503 C THR A 267 6.198 -6.360 -3.314 1.00 0.00 C ATOM 504 O THR A 267 7.078 -7.094 -3.766 1.00 0.00 O ATOM 505 CB THR A 267 5.068 -7.844 -1.625 1.00 0.00 C ATOM 506 OG1 THR A 267 5.891 -8.920 -2.097 1.00 0.00 O ATOM 507 CG2 THR A 267 3.711 -7.891 -2.313 1.00 0.00 C ATOM 0 H THR A 267 3.894 -5.555 -1.693 1.00 0.00 H new ATOM 0 HA THR A 267 6.644 -6.420 -1.229 1.00 0.00 H new ATOM 0 HB THR A 267 4.921 -7.960 -0.551 1.00 0.00 H new ATOM 0 HG1 THR A 267 6.516 -8.582 -2.772 1.00 0.00 H new ATOM 0 HG21 THR A 267 3.245 -8.860 -2.133 1.00 0.00 H new ATOM 0 HG22 THR A 267 3.073 -7.102 -1.914 1.00 0.00 H new ATOM 0 HG23 THR A 267 3.841 -7.745 -3.385 1.00 0.00 H new ATOM 515 N LYS A 268 5.596 -5.440 -4.050 1.00 0.00 N ATOM 516 CA LYS A 268 6.024 -5.196 -5.409 1.00 0.00 C ATOM 517 C LYS A 268 6.300 -3.716 -5.579 1.00 0.00 C ATOM 518 O LYS A 268 5.382 -2.917 -5.725 1.00 0.00 O ATOM 519 CB LYS A 268 4.943 -5.667 -6.376 1.00 0.00 C ATOM 520 CG LYS A 268 5.384 -5.761 -7.824 1.00 0.00 C ATOM 521 CD LYS A 268 6.376 -6.895 -8.026 1.00 0.00 C ATOM 522 CE LYS A 268 7.807 -6.419 -7.888 1.00 0.00 C ATOM 523 NZ LYS A 268 8.781 -7.429 -8.373 1.00 0.00 N ATOM 0 H LYS A 268 4.820 -4.859 -3.731 1.00 0.00 H new ATOM 0 HA LYS A 268 6.938 -5.750 -5.624 1.00 0.00 H new ATOM 0 HB2 LYS A 268 4.589 -6.646 -6.054 1.00 0.00 H new ATOM 0 HB3 LYS A 268 4.095 -4.985 -6.312 1.00 0.00 H new ATOM 0 HG2 LYS A 268 4.514 -5.918 -8.462 1.00 0.00 H new ATOM 0 HG3 LYS A 268 5.838 -4.819 -8.130 1.00 0.00 H new ATOM 0 HD2 LYS A 268 6.182 -7.682 -7.297 1.00 0.00 H new ATOM 0 HD3 LYS A 268 6.232 -7.333 -9.014 1.00 0.00 H new ATOM 0 HE2 LYS A 268 7.936 -5.493 -8.449 1.00 0.00 H new ATOM 0 HE3 LYS A 268 8.013 -6.190 -6.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 9.747 -7.062 -8.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 8.677 -8.305 -7.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 8.602 -7.629 -9.378 1.00 0.00 H new ATOM 537 N ILE A 269 7.572 -3.369 -5.588 1.00 0.00 N ATOM 538 CA ILE A 269 7.988 -1.977 -5.537 1.00 0.00 C ATOM 539 C ILE A 269 8.345 -1.402 -6.905 1.00 0.00 C ATOM 540 O ILE A 269 8.567 -2.133 -7.872 1.00 0.00 O ATOM 541 CB ILE A 269 9.147 -1.757 -4.534 1.00 0.00 C ATOM 542 CG1 ILE A 269 10.132 -2.925 -4.549 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.588 -1.587 -3.135 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.592 -3.297 -5.929 1.00 0.00 C ATOM 0 H ILE A 269 8.342 -4.036 -5.630 1.00 0.00 H new ATOM 0 HA ILE A 269 7.116 -1.428 -5.182 1.00 0.00 H new ATOM 0 HB ILE A 269 9.683 -0.857 -4.835 1.00 0.00 H new ATOM 0 HG12 ILE A 269 11.000 -2.667 -3.942 1.00 0.00 H new ATOM 0 HG13 ILE A 269 9.663 -3.792 -4.084 1.00 0.00 H new ATOM 0 HG21 ILE A 269 9.407 -1.432 -2.432 1.00 0.00 H new ATOM 0 HG22 ILE A 269 7.922 -0.724 -3.112 1.00 0.00 H new ATOM 0 HG23 ILE A 269 8.033 -2.482 -2.854 1.00 0.00 H new ATOM 0 HD11 ILE A 269 11.289 -4.133 -5.867 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.732 -3.586 -6.534 1.00 0.00 H new ATOM 0 HD13 ILE A 269 11.089 -2.443 -6.389 1.00 0.00 H new ATOM 556 N ASN A 270 8.327 -0.081 -6.981 1.00 0.00 N ATOM 557 CA ASN A 270 8.667 0.631 -8.204 1.00 0.00 C ATOM 558 C ASN A 270 9.349 1.956 -7.863 1.00 0.00 C ATOM 559 O ASN A 270 9.702 2.188 -6.705 1.00 0.00 O ATOM 560 CB ASN A 270 7.416 0.842 -9.066 1.00 0.00 C ATOM 561 CG ASN A 270 6.485 1.916 -8.544 1.00 0.00 C ATOM 562 OD1 ASN A 270 6.462 3.033 -9.042 1.00 0.00 O ATOM 563 ND2 ASN A 270 5.724 1.591 -7.522 1.00 0.00 N ATOM 0 H ASN A 270 8.077 0.527 -6.201 1.00 0.00 H new ATOM 0 HA ASN A 270 9.368 0.033 -8.786 1.00 0.00 H new ATOM 0 HB2 ASN A 270 7.724 1.103 -10.078 1.00 0.00 H new ATOM 0 HB3 ASN A 270 6.869 -0.099 -9.132 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.089 2.280 -7.120 1.00 0.00 H new ATOM 0 HD22 ASN A 270 5.769 0.650 -7.132 1.00 0.00 H new ATOM 570 N VAL A 271 9.535 2.823 -8.848 1.00 0.00 N ATOM 571 CA VAL A 271 10.170 4.114 -8.606 1.00 0.00 C ATOM 572 C VAL A 271 9.139 5.234 -8.405 1.00 0.00 C ATOM 573 O VAL A 271 9.325 6.114 -7.567 1.00 0.00 O ATOM 574 CB VAL A 271 11.139 4.493 -9.753 1.00 0.00 C ATOM 575 CG1 VAL A 271 10.412 4.583 -11.088 1.00 0.00 C ATOM 576 CG2 VAL A 271 11.864 5.794 -9.443 1.00 0.00 C ATOM 0 H VAL A 271 9.258 2.660 -9.816 1.00 0.00 H new ATOM 0 HA VAL A 271 10.742 4.008 -7.684 1.00 0.00 H new ATOM 0 HB VAL A 271 11.882 3.699 -9.833 1.00 0.00 H new ATOM 0 HG11 VAL A 271 11.121 4.851 -11.871 1.00 0.00 H new ATOM 0 HG12 VAL A 271 9.960 3.619 -11.322 1.00 0.00 H new ATOM 0 HG13 VAL A 271 9.634 5.344 -11.028 1.00 0.00 H new ATOM 0 HG21 VAL A 271 12.539 6.039 -10.263 1.00 0.00 H new ATOM 0 HG22 VAL A 271 11.136 6.596 -9.320 1.00 0.00 H new ATOM 0 HG23 VAL A 271 12.438 5.681 -8.523 1.00 0.00 H new ATOM 586 N SER A 272 8.040 5.176 -9.147 1.00 0.00 N ATOM 587 CA SER A 272 7.060 6.259 -9.162 1.00 0.00 C ATOM 588 C SER A 272 6.243 6.302 -7.871 1.00 0.00 C ATOM 589 O SER A 272 6.002 7.371 -7.312 1.00 0.00 O ATOM 590 CB SER A 272 6.117 6.088 -10.353 1.00 0.00 C ATOM 591 OG SER A 272 6.836 5.777 -11.534 1.00 0.00 O ATOM 0 H SER A 272 7.803 4.388 -9.749 1.00 0.00 H new ATOM 0 HA SER A 272 7.607 7.198 -9.248 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.399 5.295 -10.141 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.545 7.004 -10.502 1.00 0.00 H new ATOM 0 HG SER A 272 6.209 5.671 -12.280 1.00 0.00 H new ATOM 597 N GLY A 273 5.823 5.134 -7.400 1.00 0.00 N ATOM 598 CA GLY A 273 4.970 5.068 -6.234 1.00 0.00 C ATOM 599 C GLY A 273 3.686 4.314 -6.517 1.00 0.00 C ATOM 600 O GLY A 273 2.875 4.095 -5.624 1.00 0.00 O ATOM 0 H GLY A 273 6.060 4.230 -7.808 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.505 4.581 -5.419 1.00 0.00 H new ATOM 0 HA3 GLY A 273 4.732 6.078 -5.900 1.00 0.00 H new ATOM 604 N GLN A 274 3.496 3.929 -7.772 1.00 0.00 N ATOM 605 CA GLN A 274 2.344 3.125 -8.167 1.00 0.00 C ATOM 606 C GLN A 274 2.698 1.651 -8.064 1.00 0.00 C ATOM 607 O GLN A 274 3.078 1.022 -9.049 1.00 0.00 O ATOM 608 CB GLN A 274 1.901 3.460 -9.599 1.00 0.00 C ATOM 609 CG GLN A 274 1.120 4.764 -9.735 1.00 0.00 C ATOM 610 CD GLN A 274 1.926 5.998 -9.373 1.00 0.00 C ATOM 611 OE1 GLN A 274 2.607 6.576 -10.217 1.00 0.00 O ATOM 612 NE2 GLN A 274 1.842 6.415 -8.120 1.00 0.00 N ATOM 0 H GLN A 274 4.128 4.161 -8.538 1.00 0.00 H new ATOM 0 HA GLN A 274 1.515 3.352 -7.496 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.784 3.513 -10.235 1.00 0.00 H new ATOM 0 HB3 GLN A 274 1.286 2.643 -9.975 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.766 4.860 -10.762 1.00 0.00 H new ATOM 0 HG3 GLN A 274 0.238 4.717 -9.097 1.00 0.00 H new ATOM 0 HE21 GLN A 274 1.265 5.906 -7.451 1.00 0.00 H new ATOM 0 HE22 GLN A 274 2.354 7.246 -7.824 1.00 0.00 H new ATOM 621 N TRP A 275 2.609 1.111 -6.862 1.00 0.00 N ATOM 622 CA TRP A 275 3.041 -0.258 -6.618 1.00 0.00 C ATOM 623 C TRP A 275 1.896 -1.146 -6.183 1.00 0.00 C ATOM 624 O TRP A 275 0.769 -0.685 -5.982 1.00 0.00 O ATOM 625 CB TRP A 275 4.147 -0.323 -5.565 1.00 0.00 C ATOM 626 CG TRP A 275 4.218 0.838 -4.634 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.207 1.426 -3.936 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.410 1.526 -4.278 1.00 0.00 C ATOM 629 NE1 TRP A 275 3.706 2.476 -3.204 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.058 2.548 -3.395 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.742 1.379 -4.644 1.00 0.00 C ATOM 632 CZ2 TRP A 275 5.999 3.419 -2.866 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.677 2.235 -4.119 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.302 3.250 -3.240 1.00 0.00 C ATOM 0 H TRP A 275 2.244 1.595 -6.042 1.00 0.00 H new ATOM 0 HA TRP A 275 3.429 -0.623 -7.569 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.011 -1.230 -4.976 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.105 -0.415 -6.076 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.173 1.115 -3.955 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.157 3.101 -2.614 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.038 0.601 -5.333 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 5.711 4.204 -2.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.716 2.121 -4.390 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.056 3.916 -2.847 1.00 0.00 H new ATOM 645 N GLU A 276 2.202 -2.426 -6.034 1.00 0.00 N ATOM 646 CA GLU A 276 1.228 -3.384 -5.568 1.00 0.00 C ATOM 647 C GLU A 276 1.502 -3.690 -4.107 1.00 0.00 C ATOM 648 O GLU A 276 2.603 -4.116 -3.737 1.00 0.00 O ATOM 649 CB GLU A 276 1.280 -4.653 -6.420 1.00 0.00 C ATOM 650 CG GLU A 276 1.129 -4.376 -7.907 1.00 0.00 C ATOM 651 CD GLU A 276 1.050 -5.637 -8.741 1.00 0.00 C ATOM 652 OE1 GLU A 276 2.111 -6.228 -9.034 1.00 0.00 O ATOM 653 OE2 GLU A 276 -0.071 -6.023 -9.130 1.00 0.00 O ATOM 0 H GLU A 276 3.122 -2.820 -6.231 1.00 0.00 H new ATOM 0 HA GLU A 276 0.224 -2.969 -5.661 1.00 0.00 H new ATOM 0 HB2 GLU A 276 2.227 -5.163 -6.245 1.00 0.00 H new ATOM 0 HB3 GLU A 276 0.489 -5.332 -6.100 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.229 -3.783 -8.070 1.00 0.00 H new ATOM 0 HG3 GLU A 276 1.973 -3.775 -8.246 1.00 0.00 H new ATOM 660 N GLY A 277 0.485 -3.499 -3.292 1.00 0.00 N ATOM 661 CA GLY A 277 0.660 -3.533 -1.864 1.00 0.00 C ATOM 662 C GLY A 277 0.055 -4.767 -1.239 1.00 0.00 C ATOM 663 O GLY A 277 -0.875 -5.358 -1.788 1.00 0.00 O ATOM 0 H GLY A 277 -0.471 -3.319 -3.600 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.724 -3.495 -1.630 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.205 -2.646 -1.424 1.00 0.00 H new ATOM 667 N GLU A 278 0.596 -5.169 -0.106 1.00 0.00 N ATOM 668 CA GLU A 278 0.026 -6.253 0.666 1.00 0.00 C ATOM 669 C GLU A 278 -0.106 -5.818 2.116 1.00 0.00 C ATOM 670 O GLU A 278 0.882 -5.484 2.766 1.00 0.00 O ATOM 671 CB GLU A 278 0.905 -7.499 0.578 1.00 0.00 C ATOM 672 CG GLU A 278 0.293 -8.708 1.256 1.00 0.00 C ATOM 673 CD GLU A 278 1.311 -9.786 1.565 1.00 0.00 C ATOM 674 OE1 GLU A 278 2.054 -9.642 2.559 1.00 0.00 O ATOM 675 OE2 GLU A 278 1.360 -10.788 0.829 1.00 0.00 O ATOM 0 H GLU A 278 1.435 -4.757 0.302 1.00 0.00 H new ATOM 0 HA GLU A 278 -0.956 -6.497 0.261 1.00 0.00 H new ATOM 0 HB2 GLU A 278 1.090 -7.733 -0.471 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.873 -7.286 1.032 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -0.189 -8.394 2.182 1.00 0.00 H new ATOM 0 HG3 GLU A 278 -0.485 -9.123 0.616 1.00 0.00 H new ATOM 682 N CYS A 279 -1.316 -5.812 2.630 1.00 0.00 N ATOM 683 CA CYS A 279 -1.525 -5.414 4.002 1.00 0.00 C ATOM 684 C CYS A 279 -2.072 -6.578 4.800 1.00 0.00 C ATOM 685 O CYS A 279 -3.276 -6.826 4.787 1.00 0.00 O ATOM 686 CB CYS A 279 -2.488 -4.223 4.056 1.00 0.00 C ATOM 687 SG CYS A 279 -2.824 -3.604 5.719 1.00 0.00 S ATOM 0 H CYS A 279 -2.161 -6.075 2.124 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.573 -5.113 4.439 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -2.075 -3.411 3.457 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -3.431 -4.514 3.593 1.00 0.00 H new ATOM 0 HG CYS A 279 -1.801 -2.923 6.143 1.00 0.00 H new ATOM 693 N ASN A 280 -1.152 -7.279 5.476 1.00 0.00 N ATOM 694 CA ASN A 280 -1.449 -8.477 6.277 1.00 0.00 C ATOM 695 C ASN A 280 -2.723 -9.207 5.836 1.00 0.00 C ATOM 696 O ASN A 280 -3.673 -9.351 6.603 1.00 0.00 O ATOM 697 CB ASN A 280 -1.486 -8.145 7.780 1.00 0.00 C ATOM 698 CG ASN A 280 -1.959 -6.735 8.086 1.00 0.00 C ATOM 699 OD1 ASN A 280 -3.155 -6.483 8.234 1.00 0.00 O ATOM 700 ND2 ASN A 280 -1.016 -5.802 8.192 1.00 0.00 N ATOM 0 H ASN A 280 -0.164 -7.026 5.483 1.00 0.00 H new ATOM 0 HA ASN A 280 -0.629 -9.172 6.096 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -2.142 -8.855 8.283 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -0.488 -8.282 8.197 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -1.274 -4.838 8.403 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -0.035 -6.051 8.062 1.00 0.00 H new ATOM 707 N GLY A 281 -2.729 -9.679 4.594 1.00 0.00 N ATOM 708 CA GLY A 281 -3.857 -10.449 4.096 1.00 0.00 C ATOM 709 C GLY A 281 -4.588 -9.789 2.935 1.00 0.00 C ATOM 710 O GLY A 281 -5.308 -10.459 2.197 1.00 0.00 O ATOM 0 H GLY A 281 -1.974 -9.543 3.922 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -3.503 -11.430 3.780 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -4.562 -10.612 4.911 1.00 0.00 H new ATOM 714 N LYS A 282 -4.429 -8.484 2.771 1.00 0.00 N ATOM 715 CA LYS A 282 -5.003 -7.805 1.612 1.00 0.00 C ATOM 716 C LYS A 282 -3.937 -7.631 0.537 1.00 0.00 C ATOM 717 O LYS A 282 -2.832 -7.197 0.835 1.00 0.00 O ATOM 718 CB LYS A 282 -5.572 -6.427 1.981 1.00 0.00 C ATOM 719 CG LYS A 282 -6.649 -6.443 3.058 1.00 0.00 C ATOM 720 CD LYS A 282 -6.106 -5.954 4.387 1.00 0.00 C ATOM 721 CE LYS A 282 -7.189 -5.879 5.450 1.00 0.00 C ATOM 722 NZ LYS A 282 -6.631 -5.522 6.781 1.00 0.00 N ATOM 0 H LYS A 282 -3.916 -7.879 3.413 1.00 0.00 H new ATOM 0 HA LYS A 282 -5.820 -8.424 1.241 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.753 -5.790 2.316 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -5.985 -5.968 1.082 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.484 -5.814 2.750 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -7.038 -7.455 3.172 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -5.313 -6.623 4.723 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -5.658 -4.969 4.256 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -7.935 -5.139 5.158 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -7.701 -6.839 5.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -7.400 -5.480 7.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -5.938 -6.241 7.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -6.164 -4.594 6.724 1.00 0.00 H new ATOM 736 N ARG A 283 -4.257 -7.975 -0.701 1.00 0.00 N ATOM 737 CA ARG A 283 -3.331 -7.770 -1.809 1.00 0.00 C ATOM 738 C ARG A 283 -3.990 -6.921 -2.892 1.00 0.00 C ATOM 739 O ARG A 283 -5.182 -7.069 -3.162 1.00 0.00 O ATOM 740 CB ARG A 283 -2.863 -9.099 -2.396 1.00 0.00 C ATOM 741 CG ARG A 283 -1.938 -9.873 -1.473 1.00 0.00 C ATOM 742 CD ARG A 283 -1.018 -10.773 -2.271 1.00 0.00 C ATOM 743 NE ARG A 283 0.032 -11.368 -1.443 1.00 0.00 N ATOM 744 CZ ARG A 283 0.791 -12.396 -1.812 1.00 0.00 C ATOM 745 NH1 ARG A 283 0.634 -12.962 -3.004 1.00 0.00 N ATOM 746 NH2 ARG A 283 1.724 -12.843 -0.982 1.00 0.00 N ATOM 0 H ARG A 283 -5.148 -8.396 -0.965 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.456 -7.247 -1.424 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -3.734 -9.714 -2.625 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.349 -8.911 -3.339 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -1.347 -9.178 -0.876 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -2.527 -10.471 -0.777 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -1.603 -11.566 -2.737 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -0.561 -10.199 -3.077 1.00 0.00 H new ATOM 0 HE ARG A 283 0.193 -10.967 -0.519 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -0.075 -12.609 -3.647 1.00 0.00 H new ATOM 0 HH12 ARG A 283 1.222 -13.750 -3.276 1.00 0.00 H new ATOM 0 HH21 ARG A 283 1.853 -12.399 -0.073 1.00 0.00 H new ATOM 0 HH22 ARG A 283 2.313 -13.631 -1.253 1.00 0.00 H new ATOM 760 N GLY A 284 -3.218 -6.029 -3.497 1.00 0.00 N ATOM 761 CA GLY A 284 -3.752 -5.152 -4.525 1.00 0.00 C ATOM 762 C GLY A 284 -2.732 -4.136 -5.002 1.00 0.00 C ATOM 763 O GLY A 284 -1.540 -4.410 -4.978 1.00 0.00 O ATOM 0 H GLY A 284 -2.227 -5.895 -3.295 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -4.088 -5.751 -5.371 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -4.627 -4.630 -4.136 1.00 0.00 H new ATOM 767 N HIS A 285 -3.190 -2.951 -5.406 1.00 0.00 N ATOM 768 CA HIS A 285 -2.291 -1.918 -5.937 1.00 0.00 C ATOM 769 C HIS A 285 -2.808 -0.512 -5.630 1.00 0.00 C ATOM 770 O HIS A 285 -4.016 -0.288 -5.616 1.00 0.00 O ATOM 771 CB HIS A 285 -2.079 -2.092 -7.450 1.00 0.00 C ATOM 772 CG HIS A 285 -3.337 -2.198 -8.260 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.912 -1.125 -8.902 1.00 0.00 N ATOM 774 CD2 HIS A 285 -4.114 -3.270 -8.561 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.982 -1.527 -9.558 1.00 0.00 C ATOM 776 NE2 HIS A 285 -5.127 -2.823 -9.371 1.00 0.00 N ATOM 0 H HIS A 285 -4.173 -2.680 -5.377 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.330 -2.040 -5.438 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.497 -1.247 -7.819 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.481 -2.988 -7.617 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -3.963 -4.285 -8.225 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -5.631 -0.899 -10.150 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.871 -3.400 -9.764 1.00 0.00 H new ATOM 785 N PHE A 286 -1.885 0.430 -5.396 1.00 0.00 N ATOM 786 CA PHE A 286 -2.238 1.811 -5.037 1.00 0.00 C ATOM 787 C PHE A 286 -1.049 2.758 -5.247 1.00 0.00 C ATOM 788 O PHE A 286 0.092 2.306 -5.374 1.00 0.00 O ATOM 789 CB PHE A 286 -2.701 1.877 -3.579 1.00 0.00 C ATOM 790 CG PHE A 286 -4.191 1.804 -3.410 1.00 0.00 C ATOM 791 CD1 PHE A 286 -4.998 2.866 -3.782 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.778 0.681 -2.871 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.366 2.803 -3.619 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.146 0.610 -2.703 1.00 0.00 C ATOM 795 CZ PHE A 286 -6.941 1.672 -3.079 1.00 0.00 C ATOM 0 H PHE A 286 -0.881 0.259 -5.449 1.00 0.00 H new ATOM 0 HA PHE A 286 -3.051 2.130 -5.689 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.242 1.058 -3.025 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.340 2.805 -3.135 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.551 3.754 -4.205 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.160 -0.154 -2.576 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -6.985 3.637 -3.914 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.593 -0.276 -2.278 1.00 0.00 H new ATOM 0 HZ PHE A 286 -8.012 1.618 -2.951 1.00 0.00 H new ATOM 805 N PRO A 287 -1.298 4.090 -5.280 1.00 0.00 N ATOM 806 CA PRO A 287 -0.279 5.092 -5.575 1.00 0.00 C ATOM 807 C PRO A 287 0.373 5.708 -4.332 1.00 0.00 C ATOM 808 O PRO A 287 -0.110 5.554 -3.203 1.00 0.00 O ATOM 809 CB PRO A 287 -1.077 6.162 -6.330 1.00 0.00 C ATOM 810 CG PRO A 287 -2.515 5.966 -5.949 1.00 0.00 C ATOM 811 CD PRO A 287 -2.596 4.741 -5.071 1.00 0.00 C ATOM 0 HA PRO A 287 0.557 4.657 -6.123 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.737 7.162 -6.061 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.943 6.059 -7.407 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.893 6.841 -5.420 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -3.132 5.840 -6.839 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -2.750 5.005 -4.025 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.423 4.092 -5.361 1.00 0.00 H new ATOM 819 N PHE A 288 1.467 6.432 -4.584 1.00 0.00 N ATOM 820 CA PHE A 288 2.281 7.074 -3.549 1.00 0.00 C ATOM 821 C PHE A 288 1.595 8.333 -3.025 1.00 0.00 C ATOM 822 O PHE A 288 1.922 8.830 -1.944 1.00 0.00 O ATOM 823 CB PHE A 288 3.633 7.452 -4.169 1.00 0.00 C ATOM 824 CG PHE A 288 4.763 7.623 -3.195 1.00 0.00 C ATOM 825 CD1 PHE A 288 4.880 8.766 -2.422 1.00 0.00 C ATOM 826 CD2 PHE A 288 5.721 6.635 -3.070 1.00 0.00 C ATOM 827 CE1 PHE A 288 5.933 8.914 -1.540 1.00 0.00 C ATOM 828 CE2 PHE A 288 6.776 6.777 -2.194 1.00 0.00 C ATOM 829 CZ PHE A 288 6.884 7.919 -1.426 1.00 0.00 C ATOM 0 H PHE A 288 1.817 6.591 -5.529 1.00 0.00 H new ATOM 0 HA PHE A 288 2.416 6.386 -2.715 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.911 6.683 -4.890 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.511 8.382 -4.725 1.00 0.00 H new ATOM 0 HD1 PHE A 288 4.141 9.549 -2.509 1.00 0.00 H new ATOM 0 HD2 PHE A 288 5.642 5.739 -3.667 1.00 0.00 H new ATOM 0 HE1 PHE A 288 6.013 9.808 -0.939 1.00 0.00 H new ATOM 0 HE2 PHE A 288 7.517 5.996 -2.109 1.00 0.00 H new ATOM 0 HZ PHE A 288 7.709 8.034 -0.739 1.00 0.00 H new ATOM 839 N THR A 289 0.635 8.818 -3.804 1.00 0.00 N ATOM 840 CA THR A 289 -0.057 10.076 -3.550 1.00 0.00 C ATOM 841 C THR A 289 -0.492 10.251 -2.095 1.00 0.00 C ATOM 842 O THR A 289 -0.411 11.347 -1.544 1.00 0.00 O ATOM 843 CB THR A 289 -1.296 10.135 -4.453 1.00 0.00 C ATOM 844 OG1 THR A 289 -2.070 8.937 -4.274 1.00 0.00 O ATOM 845 CG2 THR A 289 -0.884 10.257 -5.907 1.00 0.00 C ATOM 0 H THR A 289 0.310 8.340 -4.644 1.00 0.00 H new ATOM 0 HA THR A 289 0.644 10.882 -3.765 1.00 0.00 H new ATOM 0 HB THR A 289 -1.892 11.007 -4.182 1.00 0.00 H new ATOM 0 HG1 THR A 289 -2.864 8.971 -4.848 1.00 0.00 H new ATOM 0 HG21 THR A 289 -1.774 10.298 -6.535 1.00 0.00 H new ATOM 0 HG22 THR A 289 -0.301 11.167 -6.045 1.00 0.00 H new ATOM 0 HG23 THR A 289 -0.281 9.394 -6.188 1.00 0.00 H new ATOM 853 N HIS A 290 -0.930 9.169 -1.472 1.00 0.00 N ATOM 854 CA HIS A 290 -1.481 9.242 -0.127 1.00 0.00 C ATOM 855 C HIS A 290 -0.903 8.172 0.795 1.00 0.00 C ATOM 856 O HIS A 290 -1.637 7.468 1.495 1.00 0.00 O ATOM 857 CB HIS A 290 -3.014 9.175 -0.178 1.00 0.00 C ATOM 858 CG HIS A 290 -3.593 8.085 -1.032 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.777 8.237 -1.717 1.00 0.00 N ATOM 860 CD2 HIS A 290 -3.163 6.834 -1.306 1.00 0.00 C ATOM 861 CE1 HIS A 290 -5.053 7.130 -2.375 1.00 0.00 C ATOM 862 NE2 HIS A 290 -4.087 6.257 -2.149 1.00 0.00 N ATOM 0 H HIS A 290 -0.915 8.232 -1.874 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.190 10.202 0.300 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.387 9.051 0.839 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.389 10.132 -0.541 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -5.353 9.079 -1.715 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -2.261 6.372 -0.933 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -5.922 6.964 -2.995 1.00 0.00 H new ATOM 871 N VAL A 291 0.423 8.052 0.788 1.00 0.00 N ATOM 872 CA VAL A 291 1.127 7.172 1.718 1.00 0.00 C ATOM 873 C VAL A 291 2.445 7.804 2.171 1.00 0.00 C ATOM 874 O VAL A 291 3.048 8.601 1.451 1.00 0.00 O ATOM 875 CB VAL A 291 1.431 5.778 1.115 1.00 0.00 C ATOM 876 CG1 VAL A 291 0.155 5.010 0.811 1.00 0.00 C ATOM 877 CG2 VAL A 291 2.287 5.906 -0.133 1.00 0.00 C ATOM 0 H VAL A 291 1.034 8.556 0.145 1.00 0.00 H new ATOM 0 HA VAL A 291 0.457 7.038 2.567 1.00 0.00 H new ATOM 0 HB VAL A 291 1.988 5.212 1.862 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.408 4.037 0.389 1.00 0.00 H new ATOM 0 HG12 VAL A 291 -0.413 4.870 1.730 1.00 0.00 H new ATOM 0 HG13 VAL A 291 -0.445 5.571 0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 291 2.488 4.915 -0.540 1.00 0.00 H new ATOM 0 HG22 VAL A 291 1.759 6.503 -0.877 1.00 0.00 H new ATOM 0 HG23 VAL A 291 3.229 6.392 0.120 1.00 0.00 H new ATOM 887 N ARG A 292 2.871 7.444 3.371 1.00 0.00 N ATOM 888 CA ARG A 292 4.146 7.885 3.927 1.00 0.00 C ATOM 889 C ARG A 292 4.888 6.653 4.408 1.00 0.00 C ATOM 890 O ARG A 292 4.508 6.051 5.399 1.00 0.00 O ATOM 891 CB ARG A 292 3.928 8.848 5.100 1.00 0.00 C ATOM 892 CG ARG A 292 3.035 10.031 4.768 1.00 0.00 C ATOM 893 CD ARG A 292 3.614 10.862 3.639 1.00 0.00 C ATOM 894 NE ARG A 292 2.677 11.877 3.167 1.00 0.00 N ATOM 895 CZ ARG A 292 2.525 12.198 1.885 1.00 0.00 C ATOM 896 NH1 ARG A 292 3.174 11.510 0.952 1.00 0.00 N ATOM 897 NH2 ARG A 292 1.704 13.179 1.535 1.00 0.00 N ATOM 0 H ARG A 292 2.341 6.834 3.993 1.00 0.00 H new ATOM 0 HA ARG A 292 4.718 8.414 3.165 1.00 0.00 H new ATOM 0 HB2 ARG A 292 3.490 8.297 5.933 1.00 0.00 H new ATOM 0 HB3 ARG A 292 4.896 9.219 5.437 1.00 0.00 H new ATOM 0 HG2 ARG A 292 2.044 9.673 4.487 1.00 0.00 H new ATOM 0 HG3 ARG A 292 2.910 10.654 5.653 1.00 0.00 H new ATOM 0 HD2 ARG A 292 4.530 11.345 3.978 1.00 0.00 H new ATOM 0 HD3 ARG A 292 3.886 10.208 2.811 1.00 0.00 H new ATOM 0 HE ARG A 292 2.108 12.367 3.858 1.00 0.00 H new ATOM 0 HH11 ARG A 292 3.786 10.739 1.220 1.00 0.00 H new ATOM 0 HH12 ARG A 292 3.060 11.753 -0.032 1.00 0.00 H new ATOM 0 HH21 ARG A 292 1.186 13.690 2.250 1.00 0.00 H new ATOM 0 HH22 ARG A 292 1.590 13.422 0.551 1.00 0.00 H new ATOM 911 N LEU A 293 5.947 6.277 3.728 1.00 0.00 N ATOM 912 CA LEU A 293 6.466 4.942 3.890 1.00 0.00 C ATOM 913 C LEU A 293 7.866 4.884 4.465 1.00 0.00 C ATOM 914 O LEU A 293 8.719 5.737 4.203 1.00 0.00 O ATOM 915 CB LEU A 293 6.408 4.204 2.559 1.00 0.00 C ATOM 916 CG LEU A 293 6.501 5.067 1.305 1.00 0.00 C ATOM 917 CD1 LEU A 293 7.943 5.197 0.839 1.00 0.00 C ATOM 918 CD2 LEU A 293 5.621 4.487 0.217 1.00 0.00 C ATOM 0 H LEU A 293 6.457 6.866 3.069 1.00 0.00 H new ATOM 0 HA LEU A 293 5.828 4.453 4.626 1.00 0.00 H new ATOM 0 HB2 LEU A 293 7.220 3.477 2.535 1.00 0.00 H new ATOM 0 HB3 LEU A 293 5.475 3.642 2.519 1.00 0.00 H new ATOM 0 HG LEU A 293 6.145 6.070 1.540 1.00 0.00 H new ATOM 0 HD11 LEU A 293 7.981 5.817 -0.057 1.00 0.00 H new ATOM 0 HD12 LEU A 293 8.539 5.659 1.626 1.00 0.00 H new ATOM 0 HD13 LEU A 293 8.343 4.208 0.613 1.00 0.00 H new ATOM 0 HD21 LEU A 293 5.691 5.107 -0.677 1.00 0.00 H new ATOM 0 HD22 LEU A 293 5.951 3.475 -0.017 1.00 0.00 H new ATOM 0 HD23 LEU A 293 4.587 4.461 0.561 1.00 0.00 H new ATOM 930 N LEU A 294 8.060 3.858 5.275 1.00 0.00 N ATOM 931 CA LEU A 294 9.351 3.466 5.773 1.00 0.00 C ATOM 932 C LEU A 294 10.000 2.525 4.767 1.00 0.00 C ATOM 933 O LEU A 294 9.340 2.027 3.851 1.00 0.00 O ATOM 934 CB LEU A 294 9.221 2.777 7.139 1.00 0.00 C ATOM 935 CG LEU A 294 8.500 3.585 8.217 1.00 0.00 C ATOM 936 CD1 LEU A 294 7.013 3.295 8.199 1.00 0.00 C ATOM 937 CD2 LEU A 294 9.088 3.299 9.590 1.00 0.00 C ATOM 0 H LEU A 294 7.300 3.265 5.608 1.00 0.00 H new ATOM 0 HA LEU A 294 9.972 4.352 5.904 1.00 0.00 H new ATOM 0 HB2 LEU A 294 8.692 1.834 7.002 1.00 0.00 H new ATOM 0 HB3 LEU A 294 10.220 2.533 7.500 1.00 0.00 H new ATOM 0 HG LEU A 294 8.643 4.644 8.001 1.00 0.00 H new ATOM 0 HD11 LEU A 294 6.519 3.880 8.974 1.00 0.00 H new ATOM 0 HD12 LEU A 294 6.602 3.562 7.225 1.00 0.00 H new ATOM 0 HD13 LEU A 294 6.847 2.234 8.385 1.00 0.00 H new ATOM 0 HD21 LEU A 294 8.559 3.885 10.342 1.00 0.00 H new ATOM 0 HD22 LEU A 294 8.983 2.238 9.817 1.00 0.00 H new ATOM 0 HD23 LEU A 294 10.144 3.568 9.597 1.00 0.00 H new