USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 614 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 TYR OH : rot 130:sc= 0 USER MOD Single : A 269 ASN : amide:sc= -0.0174 X(o=-0.017,f=0) USER MOD Single : A 271 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 273 THR OG1 : rot -119:sc=0.000248 USER MOD Single : A 274 SER OG : rot 27:sc= 0.274 USER MOD Single : A 276 MET CE :methyl -162:sc= -0.108 (180deg=-1.65) USER MOD Single : A 277 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 280 CYS SG : rot 36:sc= -0.27 USER MOD Single : A 283 GLN : amide:sc= -2.24 K(o=-2.2,f=-7.4!) USER MOD Single : A 289 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 HIS : no HD1:sc= -0.191 X(o=-0.19,f=-0.21) USER MOD Single : A 298 SER OG : rot 180:sc= 0 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 317 GLN : amide:sc= -0.307 X(o=-0.31,f=0) USER MOD Single : A 320 LYS NZ :NH3+ -123:sc= -0.0484 (180deg=-2.55) USER MOD Single : A 322 LYS NZ :NH3+ 160:sc= -0.0862 (180deg=-0.485) USER MOD Single : A 325 SER OG : rot 180:sc= 0 USER MOD Single : A 327 THR OG1 : rot 51:sc= -0.347 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 331 THR OG1 : rot 166:sc= 0.1 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 SER OG : rot -169:sc= 0.323 USER MOD Single : A 335 MET CE :methyl 168:sc= -1.48 (180deg=-2.31!) USER MOD Single : A 336 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 340 GLN : amide:sc= 2.17 K(o=2.2,f=-5!) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.206 15.191 0.207 1.00 0.00 N ATOM 67 CA GLU A 260 8.221 14.947 1.644 1.00 0.00 C ATOM 68 C GLU A 260 7.071 14.031 2.052 1.00 0.00 C ATOM 69 O GLU A 260 7.285 12.987 2.669 1.00 0.00 O ATOM 70 CB GLU A 260 8.131 16.269 2.410 1.00 0.00 C ATOM 71 CG GLU A 260 8.246 16.109 3.916 1.00 0.00 C ATOM 72 CD GLU A 260 8.753 17.364 4.599 1.00 0.00 C ATOM 73 OE1 GLU A 260 8.313 18.467 4.214 1.00 0.00 O ATOM 74 OE2 GLU A 260 9.591 17.243 5.518 1.00 0.00 O ATOM 0 HA GLU A 260 9.161 14.455 1.893 1.00 0.00 H new ATOM 0 HB2 GLU A 260 8.921 16.935 2.063 1.00 0.00 H new ATOM 0 HB3 GLU A 260 7.182 16.751 2.176 1.00 0.00 H new ATOM 0 HG2 GLU A 260 7.271 15.846 4.325 1.00 0.00 H new ATOM 0 HG3 GLU A 260 8.919 15.281 4.139 1.00 0.00 H new ATOM 81 N GLU A 261 5.852 14.430 1.705 1.00 0.00 N ATOM 82 CA GLU A 261 4.668 13.646 2.037 1.00 0.00 C ATOM 83 C GLU A 261 4.204 12.827 0.835 1.00 0.00 C ATOM 84 O GLU A 261 4.455 13.174 -0.319 1.00 0.00 O ATOM 85 CB GLU A 261 3.538 14.562 2.511 1.00 0.00 C ATOM 86 CG GLU A 261 3.679 15.002 3.959 1.00 0.00 C ATOM 87 CD GLU A 261 2.498 15.826 4.435 1.00 0.00 C ATOM 88 OE1 GLU A 261 1.380 15.610 3.923 1.00 0.00 O ATOM 89 OE2 GLU A 261 2.693 16.686 5.319 1.00 0.00 O ATOM 0 H GLU A 261 5.658 15.291 1.194 1.00 0.00 H new ATOM 0 HA GLU A 261 4.931 12.961 2.843 1.00 0.00 H new ATOM 0 HB2 GLU A 261 3.506 15.445 1.873 1.00 0.00 H new ATOM 0 HB3 GLU A 261 2.586 14.045 2.388 1.00 0.00 H new ATOM 0 HG2 GLU A 261 3.783 14.122 4.594 1.00 0.00 H new ATOM 0 HG3 GLU A 261 4.593 15.585 4.070 1.00 0.00 H new ATOM 96 N PRO A 262 3.509 11.713 1.112 1.00 0.00 N ATOM 97 CA PRO A 262 2.995 10.822 0.068 1.00 0.00 C ATOM 98 C PRO A 262 1.855 11.453 -0.724 1.00 0.00 C ATOM 99 O PRO A 262 1.001 12.141 -0.163 1.00 0.00 O ATOM 100 CB PRO A 262 2.492 9.609 0.854 1.00 0.00 C ATOM 101 CG PRO A 262 2.179 10.139 2.210 1.00 0.00 C ATOM 102 CD PRO A 262 3.173 11.239 2.464 1.00 0.00 C ATOM 0 HA PRO A 262 3.757 10.581 -0.674 1.00 0.00 H new ATOM 0 HB2 PRO A 262 1.609 9.173 0.386 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.249 8.826 0.900 1.00 0.00 H new ATOM 0 HG2 PRO A 262 1.158 10.518 2.255 1.00 0.00 H new ATOM 0 HG3 PRO A 262 2.262 9.356 2.964 1.00 0.00 H new ATOM 0 HD2 PRO A 262 2.745 12.035 3.074 1.00 0.00 H new ATOM 0 HD3 PRO A 262 4.053 10.871 2.991 1.00 0.00 H new ATOM 110 N THR A 263 1.846 11.216 -2.032 1.00 0.00 N ATOM 111 CA THR A 263 0.811 11.762 -2.901 1.00 0.00 C ATOM 112 C THR A 263 -0.258 10.719 -3.206 1.00 0.00 C ATOM 113 O THR A 263 0.055 9.579 -3.551 1.00 0.00 O ATOM 114 CB THR A 263 1.405 12.276 -4.227 1.00 0.00 C ATOM 115 OG1 THR A 263 2.367 13.304 -3.967 1.00 0.00 O ATOM 116 CG2 THR A 263 0.311 12.815 -5.136 1.00 0.00 C ATOM 0 H THR A 263 2.544 10.649 -2.513 1.00 0.00 H new ATOM 0 HA THR A 263 0.357 12.597 -2.367 1.00 0.00 H new ATOM 0 HB THR A 263 1.894 11.441 -4.729 1.00 0.00 H new ATOM 0 HG1 THR A 263 2.741 13.624 -4.814 1.00 0.00 H new ATOM 0 HG21 THR A 263 0.754 13.172 -6.066 1.00 0.00 H new ATOM 0 HG22 THR A 263 -0.403 12.022 -5.356 1.00 0.00 H new ATOM 0 HG23 THR A 263 -0.202 13.638 -4.639 1.00 0.00 H new ATOM 124 N ILE A 264 -1.519 11.116 -3.077 1.00 0.00 N ATOM 125 CA ILE A 264 -2.634 10.215 -3.341 1.00 0.00 C ATOM 126 C ILE A 264 -2.721 9.868 -4.823 1.00 0.00 C ATOM 127 O ILE A 264 -2.628 10.743 -5.683 1.00 0.00 O ATOM 128 CB ILE A 264 -3.972 10.828 -2.889 1.00 0.00 C ATOM 129 CG1 ILE A 264 -3.968 11.059 -1.376 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.130 9.926 -3.288 1.00 0.00 C ATOM 131 CD1 ILE A 264 -5.033 12.026 -0.909 1.00 0.00 C ATOM 0 H ILE A 264 -1.794 12.056 -2.791 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.448 9.307 -2.768 1.00 0.00 H new ATOM 0 HB ILE A 264 -4.098 11.791 -3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -4.109 10.104 -0.871 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -2.990 11.436 -1.077 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -6.069 10.373 -2.961 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.142 9.807 -4.371 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -5.010 8.950 -2.817 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -4.971 12.141 0.173 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -4.880 12.994 -1.386 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -6.017 11.641 -1.177 1.00 0.00 H new ATOM 143 N GLY A 265 -2.903 8.584 -5.115 1.00 0.00 N ATOM 144 CA GLY A 265 -3.002 8.143 -6.494 1.00 0.00 C ATOM 145 C GLY A 265 -1.665 7.709 -7.061 1.00 0.00 C ATOM 146 O GLY A 265 -1.608 7.054 -8.103 1.00 0.00 O ATOM 0 H GLY A 265 -2.984 7.841 -4.421 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -3.707 7.314 -6.557 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -3.406 8.952 -7.103 1.00 0.00 H new ATOM 150 N ASP A 266 -0.587 8.074 -6.377 1.00 0.00 N ATOM 151 CA ASP A 266 0.757 7.718 -6.819 1.00 0.00 C ATOM 152 C ASP A 266 1.151 6.339 -6.302 1.00 0.00 C ATOM 153 O ASP A 266 0.841 5.979 -5.166 1.00 0.00 O ATOM 154 CB ASP A 266 1.767 8.763 -6.342 1.00 0.00 C ATOM 155 CG ASP A 266 1.909 9.918 -7.315 1.00 0.00 C ATOM 156 OD1 ASP A 266 1.706 9.700 -8.528 1.00 0.00 O ATOM 157 OD2 ASP A 266 2.221 11.039 -6.863 1.00 0.00 O ATOM 0 H ASP A 266 -0.617 8.617 -5.514 1.00 0.00 H new ATOM 0 HA ASP A 266 0.760 7.692 -7.909 1.00 0.00 H new ATOM 0 HB2 ASP A 266 1.457 9.147 -5.370 1.00 0.00 H new ATOM 0 HB3 ASP A 266 2.738 8.288 -6.202 1.00 0.00 H new ATOM 162 N ILE A 267 1.835 5.571 -7.143 1.00 0.00 N ATOM 163 CA ILE A 267 2.272 4.230 -6.771 1.00 0.00 C ATOM 164 C ILE A 267 3.717 4.238 -6.286 1.00 0.00 C ATOM 165 O ILE A 267 4.607 4.757 -6.961 1.00 0.00 O ATOM 166 CB ILE A 267 2.143 3.249 -7.951 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.670 2.950 -8.235 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.903 1.964 -7.655 1.00 0.00 C ATOM 169 CD1 ILE A 267 0.447 2.171 -9.513 1.00 0.00 C ATOM 0 H ILE A 267 2.099 5.854 -8.087 1.00 0.00 H new ATOM 0 HA ILE A 267 1.622 3.899 -5.961 1.00 0.00 H new ATOM 0 HB ILE A 267 2.578 3.710 -8.838 1.00 0.00 H new ATOM 0 HG12 ILE A 267 0.254 2.388 -7.399 1.00 0.00 H new ATOM 0 HG13 ILE A 267 0.121 3.890 -8.292 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.803 1.280 -8.498 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.957 2.193 -7.496 1.00 0.00 H new ATOM 0 HG23 ILE A 267 2.494 1.498 -6.759 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -0.620 1.995 -9.650 1.00 0.00 H new ATOM 0 HD12 ILE A 267 0.833 2.741 -10.358 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.967 1.215 -9.452 1.00 0.00 H new ATOM 181 N TYR A 268 3.944 3.658 -5.112 1.00 0.00 N ATOM 182 CA TYR A 268 5.282 3.599 -4.536 1.00 0.00 C ATOM 183 C TYR A 268 5.655 2.165 -4.172 1.00 0.00 C ATOM 184 O TYR A 268 4.800 1.282 -4.125 1.00 0.00 O ATOM 185 CB TYR A 268 5.366 4.490 -3.295 1.00 0.00 C ATOM 186 CG TYR A 268 5.136 5.955 -3.586 1.00 0.00 C ATOM 187 CD1 TYR A 268 6.157 6.753 -4.088 1.00 0.00 C ATOM 188 CD2 TYR A 268 3.898 6.543 -3.357 1.00 0.00 C ATOM 189 CE1 TYR A 268 5.951 8.093 -4.354 1.00 0.00 C ATOM 190 CE2 TYR A 268 3.683 7.882 -3.622 1.00 0.00 C ATOM 191 CZ TYR A 268 4.712 8.652 -4.120 1.00 0.00 C ATOM 192 OH TYR A 268 4.503 9.987 -4.384 1.00 0.00 O ATOM 0 H TYR A 268 3.219 3.223 -4.541 1.00 0.00 H new ATOM 0 HA TYR A 268 5.988 3.961 -5.283 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.630 4.153 -2.565 1.00 0.00 H new ATOM 0 HB3 TYR A 268 6.347 4.369 -2.837 1.00 0.00 H new ATOM 0 HD1 TYR A 268 7.128 6.318 -4.273 1.00 0.00 H new ATOM 0 HD2 TYR A 268 3.090 5.943 -2.965 1.00 0.00 H new ATOM 0 HE1 TYR A 268 6.756 8.699 -4.743 1.00 0.00 H new ATOM 0 HE2 TYR A 268 2.714 8.323 -3.440 1.00 0.00 H new ATOM 0 HH TYR A 268 3.693 10.090 -4.926 1.00 0.00 H new ATOM 202 N ASN A 269 6.940 1.941 -3.915 1.00 0.00 N ATOM 203 CA ASN A 269 7.428 0.615 -3.555 1.00 0.00 C ATOM 204 C ASN A 269 7.456 0.439 -2.040 1.00 0.00 C ATOM 205 O ASN A 269 7.759 1.374 -1.301 1.00 0.00 O ATOM 206 CB ASN A 269 8.827 0.390 -4.132 1.00 0.00 C ATOM 207 CG ASN A 269 8.952 0.891 -5.558 1.00 0.00 C ATOM 208 OD1 ASN A 269 9.741 1.791 -5.845 1.00 0.00 O ATOM 209 ND2 ASN A 269 8.171 0.308 -6.460 1.00 0.00 N ATOM 0 H ASN A 269 7.662 2.661 -3.949 1.00 0.00 H new ATOM 0 HA ASN A 269 6.746 -0.123 -3.976 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.561 0.897 -3.506 1.00 0.00 H new ATOM 0 HB3 ASN A 269 9.063 -0.674 -4.102 1.00 0.00 H new ATOM 0 HD21 ASN A 269 8.211 0.603 -7.436 1.00 0.00 H new ATOM 0 HD22 ASN A 269 7.531 -0.435 -6.177 1.00 0.00 H new ATOM 216 N GLY A 270 7.138 -0.770 -1.584 1.00 0.00 N ATOM 217 CA GLY A 270 7.134 -1.047 -0.160 1.00 0.00 C ATOM 218 C GLY A 270 7.586 -2.459 0.157 1.00 0.00 C ATOM 219 O GLY A 270 7.738 -3.287 -0.742 1.00 0.00 O ATOM 0 H GLY A 270 6.883 -1.561 -2.175 1.00 0.00 H new ATOM 0 HA2 GLY A 270 7.788 -0.337 0.347 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.129 -0.893 0.234 1.00 0.00 H new ATOM 223 N LYS A 271 7.803 -2.736 1.438 1.00 0.00 N ATOM 224 CA LYS A 271 8.242 -4.057 1.872 1.00 0.00 C ATOM 225 C LYS A 271 7.626 -4.418 3.221 1.00 0.00 C ATOM 226 O LYS A 271 7.535 -3.580 4.117 1.00 0.00 O ATOM 227 CB LYS A 271 9.768 -4.104 1.968 1.00 0.00 C ATOM 228 CG LYS A 271 10.298 -5.372 2.616 1.00 0.00 C ATOM 229 CD LYS A 271 11.611 -5.122 3.338 1.00 0.00 C ATOM 230 CE LYS A 271 12.742 -4.844 2.360 1.00 0.00 C ATOM 231 NZ LYS A 271 14.068 -5.215 2.926 1.00 0.00 N ATOM 0 H LYS A 271 7.682 -2.063 2.195 1.00 0.00 H new ATOM 0 HA LYS A 271 7.908 -4.785 1.132 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.190 -4.014 0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.115 -3.242 2.538 1.00 0.00 H new ATOM 0 HG2 LYS A 271 9.561 -5.757 3.321 1.00 0.00 H new ATOM 0 HG3 LYS A 271 10.441 -6.139 1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 271 11.499 -4.276 4.016 1.00 0.00 H new ATOM 0 HD3 LYS A 271 11.862 -5.989 3.949 1.00 0.00 H new ATOM 0 HE2 LYS A 271 12.571 -5.402 1.439 1.00 0.00 H new ATOM 0 HE3 LYS A 271 12.743 -3.786 2.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 14.812 -5.010 2.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 14.243 -4.664 3.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 14.077 -6.230 3.154 1.00 0.00 H new ATOM 245 N VAL A 272 7.206 -5.672 3.357 1.00 0.00 N ATOM 246 CA VAL A 272 6.602 -6.145 4.597 1.00 0.00 C ATOM 247 C VAL A 272 7.640 -6.252 5.708 1.00 0.00 C ATOM 248 O VAL A 272 8.551 -7.078 5.645 1.00 0.00 O ATOM 249 CB VAL A 272 5.927 -7.516 4.405 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.508 -8.098 5.746 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.733 -7.396 3.470 1.00 0.00 C ATOM 0 H VAL A 272 7.273 -6.378 2.624 1.00 0.00 H new ATOM 0 HA VAL A 272 5.846 -5.413 4.880 1.00 0.00 H new ATOM 0 HB VAL A 272 6.648 -8.196 3.951 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.033 -9.067 5.590 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.387 -8.223 6.379 1.00 0.00 H new ATOM 0 HG13 VAL A 272 4.804 -7.423 6.232 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.268 -8.374 3.346 1.00 0.00 H new ATOM 0 HG22 VAL A 272 4.008 -6.701 3.893 1.00 0.00 H new ATOM 0 HG23 VAL A 272 5.066 -7.027 2.500 1.00 0.00 H new ATOM 261 N THR A 273 7.496 -5.412 6.729 1.00 0.00 N ATOM 262 CA THR A 273 8.421 -5.412 7.855 1.00 0.00 C ATOM 263 C THR A 273 7.850 -6.190 9.035 1.00 0.00 C ATOM 264 O THR A 273 8.595 -6.708 9.867 1.00 0.00 O ATOM 265 CB THR A 273 8.750 -3.978 8.311 1.00 0.00 C ATOM 266 OG1 THR A 273 7.544 -3.276 8.630 1.00 0.00 O ATOM 267 CG2 THR A 273 9.508 -3.226 7.227 1.00 0.00 C ATOM 0 H THR A 273 6.747 -4.723 6.799 1.00 0.00 H new ATOM 0 HA THR A 273 9.336 -5.896 7.513 1.00 0.00 H new ATOM 0 HB THR A 273 9.380 -4.039 9.198 1.00 0.00 H new ATOM 0 HG1 THR A 273 7.455 -2.495 8.044 1.00 0.00 H new ATOM 0 HG21 THR A 273 9.729 -2.216 7.572 1.00 0.00 H new ATOM 0 HG22 THR A 273 10.440 -3.747 7.007 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.898 -3.176 6.325 1.00 0.00 H new ATOM 275 N SER A 274 6.525 -6.269 9.101 1.00 0.00 N ATOM 276 CA SER A 274 5.855 -6.982 10.182 1.00 0.00 C ATOM 277 C SER A 274 4.502 -7.518 9.722 1.00 0.00 C ATOM 278 O SER A 274 3.677 -6.777 9.188 1.00 0.00 O ATOM 279 CB SER A 274 5.667 -6.061 11.389 1.00 0.00 C ATOM 280 OG SER A 274 6.815 -6.066 12.219 1.00 0.00 O ATOM 0 H SER A 274 5.894 -5.848 8.419 1.00 0.00 H new ATOM 0 HA SER A 274 6.482 -7.825 10.471 1.00 0.00 H new ATOM 0 HB2 SER A 274 5.466 -5.046 11.048 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.798 -6.382 11.963 1.00 0.00 H new ATOM 0 HG SER A 274 7.606 -6.281 11.682 1.00 0.00 H new ATOM 286 N ILE A 275 4.284 -8.812 9.934 1.00 0.00 N ATOM 287 CA ILE A 275 3.032 -9.448 9.543 1.00 0.00 C ATOM 288 C ILE A 275 2.081 -9.567 10.729 1.00 0.00 C ATOM 289 O ILE A 275 2.406 -10.195 11.737 1.00 0.00 O ATOM 290 CB ILE A 275 3.274 -10.849 8.951 1.00 0.00 C ATOM 291 CG1 ILE A 275 3.998 -10.741 7.607 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.955 -11.591 8.790 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.486 -10.504 7.740 1.00 0.00 C ATOM 0 H ILE A 275 4.957 -9.439 10.374 1.00 0.00 H new ATOM 0 HA ILE A 275 2.580 -8.813 8.781 1.00 0.00 H new ATOM 0 HB ILE A 275 3.905 -11.413 9.638 1.00 0.00 H new ATOM 0 HG12 ILE A 275 3.833 -11.657 7.040 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.559 -9.927 7.031 1.00 0.00 H new ATOM 0 HG21 ILE A 275 2.142 -12.579 8.371 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.475 -11.695 9.763 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.302 -11.031 8.121 1.00 0.00 H new ATOM 0 HD11 ILE A 275 5.934 -10.438 6.749 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.659 -9.573 8.279 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.938 -11.330 8.288 1.00 0.00 H new ATOM 305 N MET A 276 0.905 -8.962 10.601 1.00 0.00 N ATOM 306 CA MET A 276 -0.095 -9.003 11.662 1.00 0.00 C ATOM 307 C MET A 276 -1.246 -9.930 11.288 1.00 0.00 C ATOM 308 O MET A 276 -1.531 -10.136 10.108 1.00 0.00 O ATOM 309 CB MET A 276 -0.628 -7.597 11.944 1.00 0.00 C ATOM 310 CG MET A 276 0.464 -6.582 12.241 1.00 0.00 C ATOM 311 SD MET A 276 1.332 -6.925 13.783 1.00 0.00 S ATOM 312 CE MET A 276 2.494 -5.563 13.828 1.00 0.00 C ATOM 0 H MET A 276 0.621 -8.438 9.774 1.00 0.00 H new ATOM 0 HA MET A 276 0.382 -9.390 12.562 1.00 0.00 H new ATOM 0 HB2 MET A 276 -1.205 -7.257 11.084 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.313 -7.640 12.791 1.00 0.00 H new ATOM 0 HG2 MET A 276 1.180 -6.574 11.420 1.00 0.00 H new ATOM 0 HG3 MET A 276 0.025 -5.586 12.290 1.00 0.00 H new ATOM 0 HE1 MET A 276 3.299 -5.795 14.525 1.00 0.00 H new ATOM 0 HE2 MET A 276 2.910 -5.406 12.833 1.00 0.00 H new ATOM 0 HE3 MET A 276 1.981 -4.658 14.153 1.00 0.00 H new ATOM 322 N GLN A 277 -1.904 -10.488 12.300 1.00 0.00 N ATOM 323 CA GLN A 277 -3.024 -11.394 12.075 1.00 0.00 C ATOM 324 C GLN A 277 -4.080 -10.745 11.187 1.00 0.00 C ATOM 325 O GLN A 277 -4.799 -11.429 10.458 1.00 0.00 O ATOM 326 CB GLN A 277 -3.648 -11.808 13.409 1.00 0.00 C ATOM 327 CG GLN A 277 -4.863 -12.708 13.259 1.00 0.00 C ATOM 328 CD GLN A 277 -5.275 -13.356 14.567 1.00 0.00 C ATOM 329 OE1 GLN A 277 -6.041 -12.783 15.343 1.00 0.00 O ATOM 330 NE2 GLN A 277 -4.767 -14.556 14.819 1.00 0.00 N ATOM 0 H GLN A 277 -1.681 -10.329 13.282 1.00 0.00 H new ATOM 0 HA GLN A 277 -2.644 -12.281 11.568 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -2.897 -12.323 14.008 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -3.935 -10.912 13.960 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -5.697 -12.124 12.869 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -4.647 -13.485 12.525 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -4.136 -14.994 14.148 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -5.008 -15.040 15.684 1.00 0.00 H new ATOM 339 N PHE A 278 -4.169 -9.420 11.253 1.00 0.00 N ATOM 340 CA PHE A 278 -5.138 -8.679 10.455 1.00 0.00 C ATOM 341 C PHE A 278 -4.552 -8.304 9.097 1.00 0.00 C ATOM 342 O PHE A 278 -5.100 -8.658 8.053 1.00 0.00 O ATOM 343 CB PHE A 278 -5.582 -7.416 11.197 1.00 0.00 C ATOM 344 CG PHE A 278 -4.504 -6.812 12.050 1.00 0.00 C ATOM 345 CD1 PHE A 278 -4.237 -7.317 13.312 1.00 0.00 C ATOM 346 CD2 PHE A 278 -3.758 -5.739 11.590 1.00 0.00 C ATOM 347 CE1 PHE A 278 -3.245 -6.763 14.100 1.00 0.00 C ATOM 348 CE2 PHE A 278 -2.764 -5.182 12.372 1.00 0.00 C ATOM 349 CZ PHE A 278 -2.508 -5.694 13.629 1.00 0.00 C ATOM 0 H PHE A 278 -3.582 -8.838 11.851 1.00 0.00 H new ATOM 0 HA PHE A 278 -6.004 -9.321 10.293 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -5.916 -6.676 10.470 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.440 -7.656 11.825 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -4.810 -8.153 13.685 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -3.956 -5.333 10.609 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -3.047 -7.166 15.082 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -2.188 -4.347 12.001 1.00 0.00 H new ATOM 0 HZ PHE A 278 -1.733 -5.259 14.243 1.00 0.00 H new ATOM 359 N GLY A 279 -3.434 -7.585 9.119 1.00 0.00 N ATOM 360 CA GLY A 279 -2.792 -7.173 7.884 1.00 0.00 C ATOM 361 C GLY A 279 -1.280 -7.212 7.977 1.00 0.00 C ATOM 362 O GLY A 279 -0.723 -7.754 8.933 1.00 0.00 O ATOM 0 H GLY A 279 -2.961 -7.280 9.970 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.120 -7.823 7.073 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.112 -6.162 7.631 1.00 0.00 H new ATOM 366 N CYS A 280 -0.613 -6.639 6.981 1.00 0.00 N ATOM 367 CA CYS A 280 0.845 -6.612 6.953 1.00 0.00 C ATOM 368 C CYS A 280 1.360 -5.188 6.772 1.00 0.00 C ATOM 369 O CYS A 280 0.926 -4.470 5.870 1.00 0.00 O ATOM 370 CB CYS A 280 1.370 -7.504 5.827 1.00 0.00 C ATOM 371 SG CYS A 280 0.856 -6.984 4.173 1.00 0.00 S ATOM 0 H CYS A 280 -1.059 -6.187 6.183 1.00 0.00 H new ATOM 0 HA CYS A 280 1.209 -6.991 7.908 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.459 -7.521 5.869 1.00 0.00 H new ATOM 0 HB3 CYS A 280 1.029 -8.525 5.998 1.00 0.00 H new ATOM 0 HG CYS A 280 0.822 -5.686 4.117 1.00 0.00 H new ATOM 377 N PHE A 281 2.286 -4.784 7.635 1.00 0.00 N ATOM 378 CA PHE A 281 2.858 -3.444 7.572 1.00 0.00 C ATOM 379 C PHE A 281 3.901 -3.350 6.462 1.00 0.00 C ATOM 380 O PHE A 281 4.913 -4.050 6.484 1.00 0.00 O ATOM 381 CB PHE A 281 3.491 -3.074 8.915 1.00 0.00 C ATOM 382 CG PHE A 281 2.493 -2.622 9.944 1.00 0.00 C ATOM 383 CD1 PHE A 281 2.005 -1.326 9.932 1.00 0.00 C ATOM 384 CD2 PHE A 281 2.044 -3.495 10.922 1.00 0.00 C ATOM 385 CE1 PHE A 281 1.087 -0.907 10.877 1.00 0.00 C ATOM 386 CE2 PHE A 281 1.126 -3.082 11.869 1.00 0.00 C ATOM 387 CZ PHE A 281 0.648 -1.787 11.847 1.00 0.00 C ATOM 0 H PHE A 281 2.657 -5.366 8.387 1.00 0.00 H new ATOM 0 HA PHE A 281 2.054 -2.742 7.351 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.034 -3.936 9.301 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.222 -2.281 8.757 1.00 0.00 H new ATOM 0 HD1 PHE A 281 2.346 -0.635 9.176 1.00 0.00 H new ATOM 0 HD2 PHE A 281 2.415 -4.509 10.944 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.714 0.106 10.857 1.00 0.00 H new ATOM 0 HE2 PHE A 281 0.783 -3.772 12.626 1.00 0.00 H new ATOM 0 HZ PHE A 281 -0.068 -1.462 12.587 1.00 0.00 H new ATOM 397 N VAL A 282 3.646 -2.478 5.492 1.00 0.00 N ATOM 398 CA VAL A 282 4.561 -2.290 4.373 1.00 0.00 C ATOM 399 C VAL A 282 5.244 -0.929 4.444 1.00 0.00 C ATOM 400 O VAL A 282 4.583 0.109 4.421 1.00 0.00 O ATOM 401 CB VAL A 282 3.831 -2.416 3.023 1.00 0.00 C ATOM 402 CG1 VAL A 282 4.749 -2.010 1.879 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.316 -3.834 2.826 1.00 0.00 C ATOM 0 H VAL A 282 2.813 -1.890 5.459 1.00 0.00 H new ATOM 0 HA VAL A 282 5.314 -3.075 4.445 1.00 0.00 H new ATOM 0 HB VAL A 282 2.976 -1.740 3.028 1.00 0.00 H new ATOM 0 HG11 VAL A 282 4.216 -2.106 0.933 1.00 0.00 H new ATOM 0 HG12 VAL A 282 5.064 -0.975 2.015 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.626 -2.658 1.868 1.00 0.00 H new ATOM 0 HG21 VAL A 282 2.803 -3.905 1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 282 4.154 -4.531 2.841 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.622 -4.084 3.628 1.00 0.00 H new ATOM 413 N GLN A 283 6.570 -0.942 4.530 1.00 0.00 N ATOM 414 CA GLN A 283 7.343 0.292 4.605 1.00 0.00 C ATOM 415 C GLN A 283 7.738 0.773 3.212 1.00 0.00 C ATOM 416 O GLN A 283 8.344 0.032 2.438 1.00 0.00 O ATOM 417 CB GLN A 283 8.594 0.085 5.460 1.00 0.00 C ATOM 418 CG GLN A 283 9.345 1.372 5.762 1.00 0.00 C ATOM 419 CD GLN A 283 8.842 2.059 7.016 1.00 0.00 C ATOM 420 OE1 GLN A 283 8.346 1.410 7.938 1.00 0.00 O ATOM 421 NE2 GLN A 283 8.968 3.381 7.058 1.00 0.00 N ATOM 0 H GLN A 283 7.132 -1.793 4.549 1.00 0.00 H new ATOM 0 HA GLN A 283 6.717 1.055 5.069 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.308 -0.388 6.400 1.00 0.00 H new ATOM 0 HB3 GLN A 283 9.264 -0.605 4.947 1.00 0.00 H new ATOM 0 HG2 GLN A 283 10.407 1.151 5.874 1.00 0.00 H new ATOM 0 HG3 GLN A 283 9.248 2.052 4.916 1.00 0.00 H new ATOM 0 HE21 GLN A 283 9.385 3.879 6.271 1.00 0.00 H new ATOM 0 HE22 GLN A 283 8.648 3.898 7.877 1.00 0.00 H new ATOM 430 N LEU A 284 7.390 2.016 2.900 1.00 0.00 N ATOM 431 CA LEU A 284 7.708 2.596 1.600 1.00 0.00 C ATOM 432 C LEU A 284 9.201 2.884 1.483 1.00 0.00 C ATOM 433 O LEU A 284 9.853 3.240 2.464 1.00 0.00 O ATOM 434 CB LEU A 284 6.910 3.883 1.385 1.00 0.00 C ATOM 435 CG LEU A 284 5.388 3.741 1.409 1.00 0.00 C ATOM 436 CD1 LEU A 284 4.727 5.105 1.534 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.899 3.022 0.160 1.00 0.00 C ATOM 0 H LEU A 284 6.887 2.642 3.529 1.00 0.00 H new ATOM 0 HA LEU A 284 7.435 1.874 0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 284 7.200 4.599 2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 284 7.200 4.310 0.425 1.00 0.00 H new ATOM 0 HG LEU A 284 5.112 3.145 2.279 1.00 0.00 H new ATOM 0 HD11 LEU A 284 3.644 4.984 1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 284 5.052 5.584 2.458 1.00 0.00 H new ATOM 0 HD13 LEU A 284 5.011 5.726 0.684 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.813 2.930 0.195 1.00 0.00 H new ATOM 0 HD22 LEU A 284 5.187 3.591 -0.724 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.346 2.029 0.113 1.00 0.00 H new ATOM 449 N GLU A 285 9.736 2.729 0.275 1.00 0.00 N ATOM 450 CA GLU A 285 11.152 2.975 0.031 1.00 0.00 C ATOM 451 C GLU A 285 11.342 4.046 -1.040 1.00 0.00 C ATOM 452 O GLU A 285 11.298 3.759 -2.235 1.00 0.00 O ATOM 453 CB GLU A 285 11.850 1.682 -0.397 1.00 0.00 C ATOM 454 CG GLU A 285 11.727 0.559 0.619 1.00 0.00 C ATOM 455 CD GLU A 285 12.622 -0.622 0.295 1.00 0.00 C ATOM 456 OE1 GLU A 285 13.815 -0.579 0.662 1.00 0.00 O ATOM 457 OE2 GLU A 285 12.130 -1.587 -0.325 1.00 0.00 O ATOM 0 H GLU A 285 9.210 2.435 -0.548 1.00 0.00 H new ATOM 0 HA GLU A 285 11.598 3.331 0.960 1.00 0.00 H new ATOM 0 HB2 GLU A 285 11.430 1.349 -1.346 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.906 1.889 -0.571 1.00 0.00 H new ATOM 0 HG2 GLU A 285 11.979 0.940 1.609 1.00 0.00 H new ATOM 0 HG3 GLU A 285 10.691 0.224 0.661 1.00 0.00 H new ATOM 464 N GLY A 286 11.553 5.283 -0.600 1.00 0.00 N ATOM 465 CA GLY A 286 11.745 6.379 -1.531 1.00 0.00 C ATOM 466 C GLY A 286 11.444 7.728 -0.910 1.00 0.00 C ATOM 467 O GLY A 286 12.337 8.564 -0.760 1.00 0.00 O ATOM 0 H GLY A 286 11.594 5.545 0.385 1.00 0.00 H new ATOM 0 HA2 GLY A 286 12.774 6.370 -1.891 1.00 0.00 H new ATOM 0 HA3 GLY A 286 11.103 6.231 -2.399 1.00 0.00 H new ATOM 471 N LEU A 287 10.185 7.943 -0.547 1.00 0.00 N ATOM 472 CA LEU A 287 9.768 9.202 0.061 1.00 0.00 C ATOM 473 C LEU A 287 10.791 9.676 1.088 1.00 0.00 C ATOM 474 O LEU A 287 11.242 8.903 1.933 1.00 0.00 O ATOM 475 CB LEU A 287 8.399 9.041 0.725 1.00 0.00 C ATOM 476 CG LEU A 287 7.211 8.864 -0.220 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.004 8.327 0.534 1.00 0.00 C ATOM 478 CD2 LEU A 287 6.872 10.181 -0.904 1.00 0.00 C ATOM 0 H LEU A 287 9.435 7.262 -0.663 1.00 0.00 H new ATOM 0 HA LEU A 287 9.697 9.952 -0.727 1.00 0.00 H new ATOM 0 HB2 LEU A 287 8.440 8.179 1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.215 9.916 1.348 1.00 0.00 H new ATOM 0 HG LEU A 287 7.486 8.140 -0.987 1.00 0.00 H new ATOM 0 HD11 LEU A 287 5.168 8.208 -0.155 1.00 0.00 H new ATOM 0 HD12 LEU A 287 6.251 7.362 0.976 1.00 0.00 H new ATOM 0 HD13 LEU A 287 5.727 9.027 1.323 1.00 0.00 H new ATOM 0 HD21 LEU A 287 6.024 10.036 -1.573 1.00 0.00 H new ATOM 0 HD22 LEU A 287 6.617 10.927 -0.151 1.00 0.00 H new ATOM 0 HD23 LEU A 287 7.732 10.525 -1.478 1.00 0.00 H new ATOM 490 N ARG A 288 11.152 10.953 1.009 1.00 0.00 N ATOM 491 CA ARG A 288 12.122 11.531 1.932 1.00 0.00 C ATOM 492 C ARG A 288 11.847 11.078 3.363 1.00 0.00 C ATOM 493 O ARG A 288 12.772 10.801 4.127 1.00 0.00 O ATOM 494 CB ARG A 288 12.086 13.058 1.853 1.00 0.00 C ATOM 495 CG ARG A 288 13.090 13.641 0.873 1.00 0.00 C ATOM 496 CD ARG A 288 12.553 14.897 0.206 1.00 0.00 C ATOM 497 NE ARG A 288 13.620 15.830 -0.145 1.00 0.00 N ATOM 498 CZ ARG A 288 13.494 16.779 -1.067 1.00 0.00 C ATOM 499 NH1 ARG A 288 12.352 16.919 -1.726 1.00 0.00 N ATOM 500 NH2 ARG A 288 14.511 17.589 -1.330 1.00 0.00 N ATOM 0 H ARG A 288 10.788 11.607 0.316 1.00 0.00 H new ATOM 0 HA ARG A 288 13.114 11.183 1.643 1.00 0.00 H new ATOM 0 HB2 ARG A 288 11.084 13.375 1.565 1.00 0.00 H new ATOM 0 HB3 ARG A 288 12.278 13.469 2.844 1.00 0.00 H new ATOM 0 HG2 ARG A 288 14.018 13.874 1.396 1.00 0.00 H new ATOM 0 HG3 ARG A 288 13.331 12.898 0.112 1.00 0.00 H new ATOM 0 HD2 ARG A 288 12.002 14.622 -0.693 1.00 0.00 H new ATOM 0 HD3 ARG A 288 11.847 15.389 0.875 1.00 0.00 H new ATOM 0 HE ARG A 288 14.511 15.749 0.344 1.00 0.00 H new ATOM 0 HH11 ARG A 288 11.568 16.298 -1.526 1.00 0.00 H new ATOM 0 HH12 ARG A 288 12.257 17.648 -2.433 1.00 0.00 H new ATOM 0 HH21 ARG A 288 15.391 17.484 -0.825 1.00 0.00 H new ATOM 0 HH22 ARG A 288 14.413 18.317 -2.038 1.00 0.00 H new ATOM 514 N LYS A 289 10.570 11.005 3.720 1.00 0.00 N ATOM 515 CA LYS A 289 10.171 10.586 5.059 1.00 0.00 C ATOM 516 C LYS A 289 9.732 9.125 5.063 1.00 0.00 C ATOM 517 O LYS A 289 8.702 8.775 4.487 1.00 0.00 O ATOM 518 CB LYS A 289 9.036 11.472 5.577 1.00 0.00 C ATOM 519 CG LYS A 289 9.499 12.841 6.044 1.00 0.00 C ATOM 520 CD LYS A 289 8.360 13.632 6.666 1.00 0.00 C ATOM 521 CE LYS A 289 8.088 13.187 8.095 1.00 0.00 C ATOM 522 NZ LYS A 289 7.282 14.191 8.845 1.00 0.00 N ATOM 0 H LYS A 289 9.792 11.231 3.100 1.00 0.00 H new ATOM 0 HA LYS A 289 11.034 10.690 5.717 1.00 0.00 H new ATOM 0 HB2 LYS A 289 8.295 11.598 4.787 1.00 0.00 H new ATOM 0 HB3 LYS A 289 8.538 10.965 6.403 1.00 0.00 H new ATOM 0 HG2 LYS A 289 10.303 12.726 6.771 1.00 0.00 H new ATOM 0 HG3 LYS A 289 9.910 13.395 5.200 1.00 0.00 H new ATOM 0 HD2 LYS A 289 8.605 14.694 6.655 1.00 0.00 H new ATOM 0 HD3 LYS A 289 7.458 13.506 6.067 1.00 0.00 H new ATOM 0 HE2 LYS A 289 7.561 12.233 8.084 1.00 0.00 H new ATOM 0 HE3 LYS A 289 9.034 13.023 8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 7.118 13.851 9.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 7.796 15.095 8.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 6.368 14.329 8.368 1.00 0.00 H new ATOM 536 N ARG A 290 10.520 8.277 5.716 1.00 0.00 N ATOM 537 CA ARG A 290 10.212 6.854 5.795 1.00 0.00 C ATOM 538 C ARG A 290 8.812 6.632 6.360 1.00 0.00 C ATOM 539 O ARG A 290 8.615 6.632 7.575 1.00 0.00 O ATOM 540 CB ARG A 290 11.244 6.134 6.664 1.00 0.00 C ATOM 541 CG ARG A 290 12.526 5.785 5.925 1.00 0.00 C ATOM 542 CD ARG A 290 13.520 6.935 5.960 1.00 0.00 C ATOM 543 NE ARG A 290 13.350 7.840 4.827 1.00 0.00 N ATOM 544 CZ ARG A 290 13.842 7.602 3.616 1.00 0.00 C ATOM 545 NH1 ARG A 290 14.530 6.493 3.383 1.00 0.00 N ATOM 546 NH2 ARG A 290 13.646 8.474 2.635 1.00 0.00 N ATOM 0 H ARG A 290 11.376 8.551 6.198 1.00 0.00 H new ATOM 0 HA ARG A 290 10.248 6.444 4.786 1.00 0.00 H new ATOM 0 HB2 ARG A 290 11.488 6.763 7.520 1.00 0.00 H new ATOM 0 HB3 ARG A 290 10.801 5.219 7.057 1.00 0.00 H new ATOM 0 HG2 ARG A 290 12.976 4.900 6.374 1.00 0.00 H new ATOM 0 HG3 ARG A 290 12.294 5.535 4.890 1.00 0.00 H new ATOM 0 HD2 ARG A 290 13.398 7.491 6.890 1.00 0.00 H new ATOM 0 HD3 ARG A 290 14.535 6.537 5.957 1.00 0.00 H new ATOM 0 HE ARG A 290 12.825 8.702 4.973 1.00 0.00 H new ATOM 0 HH11 ARG A 290 14.683 5.820 4.134 1.00 0.00 H new ATOM 0 HH12 ARG A 290 14.907 6.313 2.452 1.00 0.00 H new ATOM 0 HH21 ARG A 290 13.117 9.328 2.810 1.00 0.00 H new ATOM 0 HH22 ARG A 290 14.024 8.290 1.706 1.00 0.00 H new ATOM 560 N TRP A 291 7.844 6.443 5.471 1.00 0.00 N ATOM 561 CA TRP A 291 6.462 6.220 5.881 1.00 0.00 C ATOM 562 C TRP A 291 6.161 4.729 5.991 1.00 0.00 C ATOM 563 O TRP A 291 6.713 3.919 5.247 1.00 0.00 O ATOM 564 CB TRP A 291 5.501 6.874 4.886 1.00 0.00 C ATOM 565 CG TRP A 291 5.357 8.353 5.086 1.00 0.00 C ATOM 566 CD1 TRP A 291 5.799 9.339 4.251 1.00 0.00 C ATOM 567 CD2 TRP A 291 4.729 9.011 6.191 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.484 10.571 4.771 1.00 0.00 N ATOM 569 CE2 TRP A 291 4.826 10.397 5.960 1.00 0.00 C ATOM 570 CE3 TRP A 291 4.091 8.565 7.352 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.311 11.338 6.848 1.00 0.00 C ATOM 572 CZ3 TRP A 291 3.581 9.499 8.233 1.00 0.00 C ATOM 573 CH2 TRP A 291 3.693 10.873 7.977 1.00 0.00 C ATOM 0 H TRP A 291 7.990 6.440 4.462 1.00 0.00 H new ATOM 0 HA TRP A 291 6.323 6.674 6.862 1.00 0.00 H new ATOM 0 HB2 TRP A 291 5.854 6.684 3.872 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.521 6.405 4.976 1.00 0.00 H new ATOM 0 HD1 TRP A 291 6.320 9.175 3.319 1.00 0.00 H new ATOM 0 HE1 TRP A 291 5.704 11.470 4.341 1.00 0.00 H new ATOM 0 HE3 TRP A 291 3.998 7.509 7.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.396 12.397 6.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 3.088 9.165 9.134 1.00 0.00 H new ATOM 0 HH2 TRP A 291 3.283 11.578 8.685 1.00 0.00 H new ATOM 584 N GLU A 292 5.282 4.375 6.924 1.00 0.00 N ATOM 585 CA GLU A 292 4.909 2.980 7.130 1.00 0.00 C ATOM 586 C GLU A 292 3.392 2.818 7.139 1.00 0.00 C ATOM 587 O GLU A 292 2.697 3.420 7.957 1.00 0.00 O ATOM 588 CB GLU A 292 5.496 2.462 8.445 1.00 0.00 C ATOM 589 CG GLU A 292 5.519 0.946 8.545 1.00 0.00 C ATOM 590 CD GLU A 292 6.439 0.448 9.643 1.00 0.00 C ATOM 591 OE1 GLU A 292 6.648 1.190 10.625 1.00 0.00 O ATOM 592 OE2 GLU A 292 6.951 -0.685 9.519 1.00 0.00 O ATOM 0 H GLU A 292 4.816 5.034 7.548 1.00 0.00 H new ATOM 0 HA GLU A 292 5.314 2.396 6.304 1.00 0.00 H new ATOM 0 HB2 GLU A 292 6.512 2.840 8.554 1.00 0.00 H new ATOM 0 HB3 GLU A 292 4.916 2.864 9.276 1.00 0.00 H new ATOM 0 HG2 GLU A 292 4.508 0.582 8.730 1.00 0.00 H new ATOM 0 HG3 GLU A 292 5.838 0.527 7.591 1.00 0.00 H new ATOM 599 N GLY A 293 2.884 2.001 6.221 1.00 0.00 N ATOM 600 CA GLY A 293 1.453 1.775 6.139 1.00 0.00 C ATOM 601 C GLY A 293 1.081 0.325 6.378 1.00 0.00 C ATOM 602 O GLY A 293 1.934 -0.562 6.313 1.00 0.00 O ATOM 0 H GLY A 293 3.438 1.492 5.533 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.946 2.403 6.872 1.00 0.00 H new ATOM 0 HA3 GLY A 293 1.096 2.081 5.156 1.00 0.00 H new ATOM 606 N LEU A 294 -0.195 0.082 6.656 1.00 0.00 N ATOM 607 CA LEU A 294 -0.679 -1.272 6.907 1.00 0.00 C ATOM 608 C LEU A 294 -1.603 -1.736 5.786 1.00 0.00 C ATOM 609 O LEU A 294 -2.301 -0.931 5.169 1.00 0.00 O ATOM 610 CB LEU A 294 -1.413 -1.331 8.247 1.00 0.00 C ATOM 611 CG LEU A 294 -2.064 -2.670 8.597 1.00 0.00 C ATOM 612 CD1 LEU A 294 -1.026 -3.643 9.136 1.00 0.00 C ATOM 613 CD2 LEU A 294 -3.185 -2.471 9.606 1.00 0.00 C ATOM 0 H LEU A 294 -0.913 0.804 6.713 1.00 0.00 H new ATOM 0 HA LEU A 294 0.182 -1.939 6.942 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -0.707 -1.076 9.037 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.186 -0.562 8.249 1.00 0.00 H new ATOM 0 HG LEU A 294 -2.492 -3.093 7.688 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -1.507 -4.590 9.380 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -0.257 -3.810 8.381 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -0.569 -3.227 10.034 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -3.636 -3.434 9.843 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -2.781 -2.026 10.515 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -3.942 -1.810 9.184 1.00 0.00 H new ATOM 625 N VAL A 295 -1.605 -3.040 5.530 1.00 0.00 N ATOM 626 CA VAL A 295 -2.447 -3.613 4.486 1.00 0.00 C ATOM 627 C VAL A 295 -3.364 -4.692 5.050 1.00 0.00 C ATOM 628 O VAL A 295 -2.929 -5.810 5.326 1.00 0.00 O ATOM 629 CB VAL A 295 -1.600 -4.217 3.350 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.456 -4.461 2.117 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.425 -3.308 3.022 1.00 0.00 C ATOM 0 H VAL A 295 -1.033 -3.720 6.031 1.00 0.00 H new ATOM 0 HA VAL A 295 -3.052 -2.799 4.085 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.206 -5.177 3.684 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -1.840 -4.888 1.325 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.261 -5.153 2.364 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -2.881 -3.517 1.777 1.00 0.00 H new ATOM 0 HG21 VAL A 295 0.163 -3.750 2.217 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -0.796 -2.333 2.707 1.00 0.00 H new ATOM 0 HG23 VAL A 295 0.201 -3.189 3.906 1.00 0.00 H new ATOM 641 N HIS A 296 -4.638 -4.350 5.218 1.00 0.00 N ATOM 642 CA HIS A 296 -5.618 -5.290 5.749 1.00 0.00 C ATOM 643 C HIS A 296 -5.623 -6.584 4.940 1.00 0.00 C ATOM 644 O HIS A 296 -5.143 -6.620 3.807 1.00 0.00 O ATOM 645 CB HIS A 296 -7.014 -4.664 5.739 1.00 0.00 C ATOM 646 CG HIS A 296 -7.996 -5.378 6.615 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.233 -5.798 6.172 1.00 0.00 N ATOM 648 CD2 HIS A 296 -7.918 -5.748 7.915 1.00 0.00 C ATOM 649 CE1 HIS A 296 -9.874 -6.393 7.162 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.097 -6.377 8.231 1.00 0.00 N ATOM 0 H HIS A 296 -5.015 -3.429 4.994 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.340 -5.525 6.776 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -6.940 -3.625 6.061 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.392 -4.654 4.717 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.084 -5.580 8.580 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -10.865 -6.820 7.107 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.335 -6.768 9.143 1.00 0.00 H new ATOM 658 N ILE A 297 -6.166 -7.643 5.531 1.00 0.00 N ATOM 659 CA ILE A 297 -6.233 -8.938 4.865 1.00 0.00 C ATOM 660 C ILE A 297 -7.124 -8.875 3.629 1.00 0.00 C ATOM 661 O ILE A 297 -7.214 -9.838 2.867 1.00 0.00 O ATOM 662 CB ILE A 297 -6.763 -10.031 5.812 1.00 0.00 C ATOM 663 CG1 ILE A 297 -6.781 -11.386 5.101 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.154 -9.670 6.312 1.00 0.00 C ATOM 665 CD1 ILE A 297 -6.967 -12.558 6.040 1.00 0.00 C ATOM 0 H ILE A 297 -6.566 -7.630 6.469 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.216 -9.191 4.564 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.097 -10.101 6.672 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -7.584 -11.390 4.364 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -5.846 -11.513 4.555 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -8.515 -10.452 6.980 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.113 -8.723 6.851 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -8.832 -9.576 5.464 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -6.970 -13.486 5.468 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -6.150 -12.579 6.762 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -7.915 -12.454 6.568 1.00 0.00 H new ATOM 677 N SER A 298 -7.781 -7.736 3.437 1.00 0.00 N ATOM 678 CA SER A 298 -8.667 -7.548 2.294 1.00 0.00 C ATOM 679 C SER A 298 -7.907 -6.963 1.108 1.00 0.00 C ATOM 680 O SER A 298 -8.319 -7.114 -0.042 1.00 0.00 O ATOM 681 CB SER A 298 -9.832 -6.630 2.671 1.00 0.00 C ATOM 682 OG SER A 298 -10.846 -6.662 1.682 1.00 0.00 O ATOM 0 H SER A 298 -7.717 -6.929 4.058 1.00 0.00 H new ATOM 0 HA SER A 298 -9.060 -8.523 2.006 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.246 -6.938 3.631 1.00 0.00 H new ATOM 0 HB3 SER A 298 -9.470 -5.609 2.793 1.00 0.00 H new ATOM 0 HG SER A 298 -11.580 -6.069 1.947 1.00 0.00 H new ATOM 688 N GLU A 299 -6.795 -6.294 1.396 1.00 0.00 N ATOM 689 CA GLU A 299 -5.978 -5.685 0.354 1.00 0.00 C ATOM 690 C GLU A 299 -4.787 -6.574 0.008 1.00 0.00 C ATOM 691 O GLU A 299 -3.677 -6.087 -0.211 1.00 0.00 O ATOM 692 CB GLU A 299 -5.487 -4.306 0.799 1.00 0.00 C ATOM 693 CG GLU A 299 -6.527 -3.210 0.642 1.00 0.00 C ATOM 694 CD GLU A 299 -7.892 -3.622 1.158 1.00 0.00 C ATOM 695 OE1 GLU A 299 -8.127 -3.496 2.378 1.00 0.00 O ATOM 696 OE2 GLU A 299 -8.724 -4.071 0.343 1.00 0.00 O ATOM 0 H GLU A 299 -6.440 -6.160 2.343 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.596 -5.572 -0.537 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.181 -4.358 1.844 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -4.602 -4.041 0.221 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -6.195 -2.320 1.176 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -6.607 -2.939 -0.411 1.00 0.00 H new ATOM 703 N LEU A 300 -5.025 -7.880 -0.040 1.00 0.00 N ATOM 704 CA LEU A 300 -3.972 -8.839 -0.359 1.00 0.00 C ATOM 705 C LEU A 300 -4.435 -9.819 -1.432 1.00 0.00 C ATOM 706 O LEU A 300 -3.715 -10.088 -2.393 1.00 0.00 O ATOM 707 CB LEU A 300 -3.552 -9.602 0.898 1.00 0.00 C ATOM 708 CG LEU A 300 -3.126 -8.747 2.092 1.00 0.00 C ATOM 709 CD1 LEU A 300 -2.829 -9.624 3.298 1.00 0.00 C ATOM 710 CD2 LEU A 300 -1.913 -7.900 1.734 1.00 0.00 C ATOM 0 H LEU A 300 -5.938 -8.300 0.138 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.115 -8.286 -0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -4.383 -10.236 1.209 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -2.726 -10.264 0.638 1.00 0.00 H new ATOM 0 HG LEU A 300 -3.948 -8.079 2.349 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -2.527 -8.998 4.138 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -3.723 -10.187 3.568 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -2.024 -10.317 3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -1.623 -7.298 2.595 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.086 -8.551 1.451 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.161 -7.244 0.899 1.00 0.00 H new ATOM 856 N VAL A 309 -2.926 -13.590 6.991 1.00 0.00 N ATOM 857 CA VAL A 309 -1.800 -12.873 6.405 1.00 0.00 C ATOM 858 C VAL A 309 -0.552 -13.747 6.366 1.00 0.00 C ATOM 859 O VAL A 309 0.172 -13.769 5.371 1.00 0.00 O ATOM 860 CB VAL A 309 -1.487 -11.584 7.189 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.355 -10.816 6.524 1.00 0.00 C ATOM 862 CG2 VAL A 309 -2.732 -10.718 7.308 1.00 0.00 C ATOM 0 HA VAL A 309 -2.087 -12.610 5.387 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.166 -11.859 8.194 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.148 -9.909 7.092 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.539 -11.438 6.496 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -0.644 -10.550 5.507 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -2.493 -9.812 7.865 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.085 -10.450 6.312 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.511 -11.271 7.833 1.00 0.00 H new ATOM 872 N ALA A 310 -0.305 -14.466 7.455 1.00 0.00 N ATOM 873 CA ALA A 310 0.855 -15.345 7.545 1.00 0.00 C ATOM 874 C ALA A 310 1.043 -16.139 6.256 1.00 0.00 C ATOM 875 O ALA A 310 2.104 -16.089 5.635 1.00 0.00 O ATOM 876 CB ALA A 310 0.713 -16.286 8.731 1.00 0.00 C ATOM 0 H ALA A 310 -0.893 -14.457 8.288 1.00 0.00 H new ATOM 0 HA ALA A 310 1.740 -14.725 7.691 1.00 0.00 H new ATOM 0 HB1 ALA A 310 1.586 -16.936 8.786 1.00 0.00 H new ATOM 0 HB2 ALA A 310 0.635 -15.704 9.650 1.00 0.00 H new ATOM 0 HB3 ALA A 310 -0.184 -16.893 8.609 1.00 0.00 H new ATOM 882 N ASP A 311 0.007 -16.870 5.862 1.00 0.00 N ATOM 883 CA ASP A 311 0.058 -17.675 4.646 1.00 0.00 C ATOM 884 C ASP A 311 -0.285 -16.832 3.422 1.00 0.00 C ATOM 885 O ASP A 311 -0.813 -17.341 2.433 1.00 0.00 O ATOM 886 CB ASP A 311 -0.905 -18.859 4.752 1.00 0.00 C ATOM 887 CG ASP A 311 -0.404 -20.081 4.008 1.00 0.00 C ATOM 888 OD1 ASP A 311 0.126 -19.919 2.889 1.00 0.00 O ATOM 889 OD2 ASP A 311 -0.541 -21.200 4.545 1.00 0.00 O ATOM 0 H ASP A 311 -0.878 -16.922 6.366 1.00 0.00 H new ATOM 0 HA ASP A 311 1.074 -18.053 4.532 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -1.052 -19.111 5.802 1.00 0.00 H new ATOM 0 HB3 ASP A 311 -1.878 -18.569 4.355 1.00 0.00 H new ATOM 894 N VAL A 312 0.020 -15.540 3.495 1.00 0.00 N ATOM 895 CA VAL A 312 -0.256 -14.627 2.393 1.00 0.00 C ATOM 896 C VAL A 312 0.976 -13.799 2.044 1.00 0.00 C ATOM 897 O VAL A 312 1.327 -13.651 0.873 1.00 0.00 O ATOM 898 CB VAL A 312 -1.421 -13.677 2.729 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.746 -12.788 1.538 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.645 -14.469 3.163 1.00 0.00 C ATOM 0 H VAL A 312 0.458 -15.103 4.306 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.533 -15.240 1.536 1.00 0.00 H new ATOM 0 HB VAL A 312 -1.118 -13.037 3.557 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -2.571 -12.124 1.794 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.870 -12.194 1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -2.030 -13.408 0.688 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.459 -13.782 3.397 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.952 -15.135 2.357 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.402 -15.058 4.047 1.00 0.00 H new ATOM 910 N VAL A 313 1.630 -13.260 3.069 1.00 0.00 N ATOM 911 CA VAL A 313 2.824 -12.448 2.871 1.00 0.00 C ATOM 912 C VAL A 313 3.982 -12.957 3.724 1.00 0.00 C ATOM 913 O VAL A 313 3.773 -13.610 4.746 1.00 0.00 O ATOM 914 CB VAL A 313 2.561 -10.970 3.213 1.00 0.00 C ATOM 915 CG1 VAL A 313 1.447 -10.410 2.341 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.221 -10.816 4.688 1.00 0.00 C ATOM 0 H VAL A 313 1.353 -13.371 4.044 1.00 0.00 H new ATOM 0 HA VAL A 313 3.090 -12.528 1.817 1.00 0.00 H new ATOM 0 HB VAL A 313 3.469 -10.402 3.011 1.00 0.00 H new ATOM 0 HG11 VAL A 313 1.275 -9.365 2.597 1.00 0.00 H new ATOM 0 HG12 VAL A 313 1.734 -10.484 1.292 1.00 0.00 H new ATOM 0 HG13 VAL A 313 0.533 -10.979 2.508 1.00 0.00 H new ATOM 0 HG21 VAL A 313 2.038 -9.765 4.911 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.328 -11.397 4.918 1.00 0.00 H new ATOM 0 HG23 VAL A 313 3.053 -11.176 5.293 1.00 0.00 H new ATOM 926 N SER A 314 5.203 -12.652 3.296 1.00 0.00 N ATOM 927 CA SER A 314 6.395 -13.081 4.019 1.00 0.00 C ATOM 928 C SER A 314 7.121 -11.885 4.627 1.00 0.00 C ATOM 929 O SER A 314 6.950 -10.749 4.185 1.00 0.00 O ATOM 930 CB SER A 314 7.336 -13.843 3.084 1.00 0.00 C ATOM 931 OG SER A 314 8.215 -14.679 3.817 1.00 0.00 O ATOM 0 H SER A 314 5.393 -12.110 2.453 1.00 0.00 H new ATOM 0 HA SER A 314 6.083 -13.743 4.827 1.00 0.00 H new ATOM 0 HB2 SER A 314 6.753 -14.445 2.387 1.00 0.00 H new ATOM 0 HB3 SER A 314 7.913 -13.136 2.488 1.00 0.00 H new ATOM 0 HG SER A 314 8.805 -15.157 3.197 1.00 0.00 H new ATOM 937 N LYS A 315 7.934 -12.149 5.644 1.00 0.00 N ATOM 938 CA LYS A 315 8.689 -11.097 6.315 1.00 0.00 C ATOM 939 C LYS A 315 9.854 -10.629 5.449 1.00 0.00 C ATOM 940 O LYS A 315 10.650 -11.436 4.973 1.00 0.00 O ATOM 941 CB LYS A 315 9.210 -11.596 7.664 1.00 0.00 C ATOM 942 CG LYS A 315 10.251 -10.684 8.289 1.00 0.00 C ATOM 943 CD LYS A 315 10.354 -10.900 9.790 1.00 0.00 C ATOM 944 CE LYS A 315 11.672 -10.376 10.339 1.00 0.00 C ATOM 945 NZ LYS A 315 12.792 -11.325 10.091 1.00 0.00 N ATOM 0 H LYS A 315 8.087 -13.084 6.022 1.00 0.00 H new ATOM 0 HA LYS A 315 8.020 -10.253 6.482 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.371 -11.701 8.352 1.00 0.00 H new ATOM 0 HB3 LYS A 315 9.641 -12.589 7.533 1.00 0.00 H new ATOM 0 HG2 LYS A 315 11.221 -10.867 7.827 1.00 0.00 H new ATOM 0 HG3 LYS A 315 9.993 -9.644 8.087 1.00 0.00 H new ATOM 0 HD2 LYS A 315 9.525 -10.397 10.289 1.00 0.00 H new ATOM 0 HD3 LYS A 315 10.263 -11.963 10.013 1.00 0.00 H new ATOM 0 HE2 LYS A 315 11.901 -9.415 9.878 1.00 0.00 H new ATOM 0 HE3 LYS A 315 11.575 -10.200 11.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 13.673 -10.932 10.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 12.585 -12.234 10.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 12.901 -11.473 9.067 1.00 0.00 H new ATOM 959 N GLY A 316 9.949 -9.317 5.252 1.00 0.00 N ATOM 960 CA GLY A 316 11.021 -8.764 4.446 1.00 0.00 C ATOM 961 C GLY A 316 10.831 -9.031 2.966 1.00 0.00 C ATOM 962 O GLY A 316 11.802 -9.207 2.231 1.00 0.00 O ATOM 0 H GLY A 316 9.303 -8.628 5.636 1.00 0.00 H new ATOM 0 HA2 GLY A 316 11.079 -7.689 4.613 1.00 0.00 H new ATOM 0 HA3 GLY A 316 11.971 -9.189 4.770 1.00 0.00 H new ATOM 966 N GLN A 317 9.576 -9.062 2.528 1.00 0.00 N ATOM 967 CA GLN A 317 9.262 -9.312 1.127 1.00 0.00 C ATOM 968 C GLN A 317 9.001 -8.005 0.386 1.00 0.00 C ATOM 969 O GLN A 317 8.194 -7.184 0.821 1.00 0.00 O ATOM 970 CB GLN A 317 8.044 -10.230 1.011 1.00 0.00 C ATOM 971 CG GLN A 317 7.770 -10.702 -0.408 1.00 0.00 C ATOM 972 CD GLN A 317 6.515 -11.545 -0.511 1.00 0.00 C ATOM 973 OE1 GLN A 317 6.571 -12.774 -0.448 1.00 0.00 O ATOM 974 NE2 GLN A 317 5.372 -10.888 -0.670 1.00 0.00 N ATOM 0 H GLN A 317 8.761 -8.917 3.124 1.00 0.00 H new ATOM 0 HA GLN A 317 10.122 -9.802 0.670 1.00 0.00 H new ATOM 0 HB2 GLN A 317 8.192 -11.099 1.652 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.166 -9.704 1.386 1.00 0.00 H new ATOM 0 HG2 GLN A 317 7.676 -9.836 -1.063 1.00 0.00 H new ATOM 0 HG3 GLN A 317 8.622 -11.281 -0.765 1.00 0.00 H new ATOM 0 HE21 GLN A 317 5.372 -9.869 -0.717 1.00 0.00 H new ATOM 0 HE22 GLN A 317 4.494 -11.402 -0.745 1.00 0.00 H new ATOM 983 N ARG A 318 9.690 -7.819 -0.736 1.00 0.00 N ATOM 984 CA ARG A 318 9.534 -6.610 -1.536 1.00 0.00 C ATOM 985 C ARG A 318 8.227 -6.645 -2.324 1.00 0.00 C ATOM 986 O ARG A 318 7.982 -7.569 -3.100 1.00 0.00 O ATOM 987 CB ARG A 318 10.715 -6.452 -2.495 1.00 0.00 C ATOM 988 CG ARG A 318 10.889 -7.624 -3.447 1.00 0.00 C ATOM 989 CD ARG A 318 12.130 -7.461 -4.310 1.00 0.00 C ATOM 990 NE ARG A 318 11.882 -6.610 -5.471 1.00 0.00 N ATOM 991 CZ ARG A 318 12.847 -6.089 -6.220 1.00 0.00 C ATOM 992 NH1 ARG A 318 14.118 -6.331 -5.931 1.00 0.00 N ATOM 993 NH2 ARG A 318 12.542 -5.324 -7.260 1.00 0.00 N ATOM 0 H ARG A 318 10.361 -8.490 -1.111 1.00 0.00 H new ATOM 0 HA ARG A 318 9.508 -5.757 -0.858 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.580 -5.540 -3.076 1.00 0.00 H new ATOM 0 HB3 ARG A 318 11.629 -6.328 -1.914 1.00 0.00 H new ATOM 0 HG2 ARG A 318 10.960 -8.550 -2.877 1.00 0.00 H new ATOM 0 HG3 ARG A 318 10.009 -7.710 -4.085 1.00 0.00 H new ATOM 0 HD2 ARG A 318 12.934 -7.032 -3.712 1.00 0.00 H new ATOM 0 HD3 ARG A 318 12.470 -8.441 -4.645 1.00 0.00 H new ATOM 0 HE ARG A 318 10.914 -6.405 -5.720 1.00 0.00 H new ATOM 0 HH11 ARG A 318 14.356 -6.918 -5.132 1.00 0.00 H new ATOM 0 HH12 ARG A 318 14.857 -5.930 -6.508 1.00 0.00 H new ATOM 0 HH21 ARG A 318 11.565 -5.135 -7.485 1.00 0.00 H new ATOM 0 HH22 ARG A 318 13.284 -4.925 -7.834 1.00 0.00 H new ATOM 1007 N VAL A 319 7.391 -5.632 -2.118 1.00 0.00 N ATOM 1008 CA VAL A 319 6.110 -5.546 -2.809 1.00 0.00 C ATOM 1009 C VAL A 319 5.806 -4.112 -3.228 1.00 0.00 C ATOM 1010 O VAL A 319 6.455 -3.170 -2.773 1.00 0.00 O ATOM 1011 CB VAL A 319 4.960 -6.066 -1.926 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.099 -7.563 -1.693 1.00 0.00 C ATOM 1013 CG2 VAL A 319 4.923 -5.314 -0.604 1.00 0.00 C ATOM 0 H VAL A 319 7.578 -4.860 -1.478 1.00 0.00 H new ATOM 0 HA VAL A 319 6.188 -6.172 -3.698 1.00 0.00 H new ATOM 0 HB VAL A 319 4.018 -5.890 -2.446 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.277 -7.912 -1.067 1.00 0.00 H new ATOM 0 HG12 VAL A 319 5.073 -8.084 -2.650 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.047 -7.767 -1.195 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.105 -5.694 0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 319 5.867 -5.457 -0.077 1.00 0.00 H new ATOM 0 HG23 VAL A 319 4.771 -4.251 -0.794 1.00 0.00 H new ATOM 1023 N LYS A 320 4.815 -3.953 -4.098 1.00 0.00 N ATOM 1024 CA LYS A 320 4.422 -2.634 -4.578 1.00 0.00 C ATOM 1025 C LYS A 320 3.037 -2.257 -4.062 1.00 0.00 C ATOM 1026 O LYS A 320 2.119 -3.077 -4.063 1.00 0.00 O ATOM 1027 CB LYS A 320 4.435 -2.600 -6.108 1.00 0.00 C ATOM 1028 CG LYS A 320 5.757 -3.036 -6.715 1.00 0.00 C ATOM 1029 CD LYS A 320 5.700 -3.038 -8.233 1.00 0.00 C ATOM 1030 CE LYS A 320 6.116 -1.692 -8.808 1.00 0.00 C ATOM 1031 NZ LYS A 320 4.992 -0.715 -8.800 1.00 0.00 N ATOM 0 H LYS A 320 4.269 -4.722 -4.486 1.00 0.00 H new ATOM 0 HA LYS A 320 5.141 -1.908 -4.199 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.642 -3.246 -6.484 1.00 0.00 H new ATOM 0 HB3 LYS A 320 4.208 -1.588 -6.442 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.550 -2.367 -6.381 1.00 0.00 H new ATOM 0 HG3 LYS A 320 6.011 -4.034 -6.358 1.00 0.00 H new ATOM 0 HD2 LYS A 320 6.354 -3.819 -8.622 1.00 0.00 H new ATOM 0 HD3 LYS A 320 4.688 -3.278 -8.560 1.00 0.00 H new ATOM 0 HE2 LYS A 320 6.949 -1.292 -8.230 1.00 0.00 H new ATOM 0 HE3 LYS A 320 6.472 -1.828 -9.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 4.825 -0.370 -9.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 4.132 -1.178 -8.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 5.233 0.087 -8.183 1.00 0.00 H new ATOM 1045 N VAL A 321 2.893 -1.010 -3.624 1.00 0.00 N ATOM 1046 CA VAL A 321 1.618 -0.524 -3.108 1.00 0.00 C ATOM 1047 C VAL A 321 1.336 0.895 -3.589 1.00 0.00 C ATOM 1048 O VAL A 321 2.228 1.583 -4.086 1.00 0.00 O ATOM 1049 CB VAL A 321 1.591 -0.548 -1.568 1.00 0.00 C ATOM 1050 CG1 VAL A 321 1.773 -1.967 -1.052 1.00 0.00 C ATOM 1051 CG2 VAL A 321 2.659 0.375 -1.002 1.00 0.00 C ATOM 0 H VAL A 321 3.643 -0.318 -3.616 1.00 0.00 H new ATOM 0 HA VAL A 321 0.846 -1.193 -3.488 1.00 0.00 H new ATOM 0 HB VAL A 321 0.618 -0.188 -1.234 1.00 0.00 H new ATOM 0 HG11 VAL A 321 1.751 -1.963 0.038 1.00 0.00 H new ATOM 0 HG12 VAL A 321 0.968 -2.597 -1.429 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.731 -2.359 -1.394 1.00 0.00 H new ATOM 0 HG21 VAL A 321 2.625 0.346 0.087 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.641 0.048 -1.344 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.477 1.394 -1.343 1.00 0.00 H new ATOM 1061 N LYS A 322 0.089 1.328 -3.436 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.312 2.667 -3.853 1.00 0.00 C ATOM 1063 C LYS A 322 -0.867 3.460 -2.674 1.00 0.00 C ATOM 1064 O LYS A 322 -1.382 2.886 -1.714 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.361 2.584 -4.964 1.00 0.00 C ATOM 1066 CG LYS A 322 -1.902 3.937 -5.391 1.00 0.00 C ATOM 1067 CD LYS A 322 -2.526 3.877 -6.776 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.887 3.198 -6.744 1.00 0.00 C ATOM 1069 NZ LYS A 322 -4.871 3.965 -5.932 1.00 0.00 N ATOM 0 H LYS A 322 -0.661 0.771 -3.026 1.00 0.00 H new ATOM 0 HA LYS A 322 0.570 3.182 -4.232 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -0.923 2.088 -5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.189 1.961 -4.625 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -2.646 4.276 -4.670 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -1.096 4.670 -5.386 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -2.631 4.887 -7.173 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -1.864 3.336 -7.452 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -4.262 3.089 -7.762 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -3.782 2.194 -6.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -5.836 3.681 -6.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -4.717 3.768 -4.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -4.749 4.983 -6.108 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.760 4.782 -2.753 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.253 5.654 -1.694 1.00 0.00 C ATOM 1085 C VAL A 323 -2.759 5.862 -1.810 1.00 0.00 C ATOM 1086 O VAL A 323 -3.233 6.550 -2.715 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.552 7.025 -1.723 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -1.094 7.926 -0.624 1.00 0.00 C ATOM 1089 CG2 VAL A 323 0.954 6.856 -1.592 1.00 0.00 C ATOM 0 H VAL A 323 -0.336 5.273 -3.540 1.00 0.00 H new ATOM 0 HA VAL A 323 -1.029 5.161 -0.748 1.00 0.00 H new ATOM 0 HB VAL A 323 -0.759 7.499 -2.682 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.587 8.890 -0.661 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -2.164 8.073 -0.769 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -0.920 7.461 0.346 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.433 7.835 -1.614 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.184 6.361 -0.649 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.326 6.251 -2.419 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.506 5.265 -0.889 1.00 0.00 N ATOM 1100 CA LEU A 324 -4.960 5.385 -0.887 1.00 0.00 C ATOM 1101 C LEU A 324 -5.397 6.696 -0.242 1.00 0.00 C ATOM 1102 O LEU A 324 -6.261 7.400 -0.765 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.588 4.204 -0.145 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.322 2.820 -0.739 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -5.807 1.732 0.206 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -5.992 2.686 -2.099 1.00 0.00 C ATOM 0 H LEU A 324 -3.129 4.693 -0.133 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.302 5.379 -1.922 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -5.225 4.212 0.883 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.666 4.359 -0.104 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.247 2.703 -0.873 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -5.610 0.754 -0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -5.281 1.815 1.157 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -6.878 1.845 0.372 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -5.792 1.695 -2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -7.068 2.823 -1.990 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -5.596 3.443 -2.776 1.00 0.00 H new ATOM 1118 N SER A 325 -4.793 7.020 0.897 1.00 0.00 N ATOM 1119 CA SER A 325 -5.121 8.246 1.615 1.00 0.00 C ATOM 1120 C SER A 325 -4.009 8.618 2.591 1.00 0.00 C ATOM 1121 O SER A 325 -3.211 7.772 2.993 1.00 0.00 O ATOM 1122 CB SER A 325 -6.442 8.083 2.369 1.00 0.00 C ATOM 1123 OG SER A 325 -7.121 9.322 2.483 1.00 0.00 O ATOM 0 H SER A 325 -4.074 6.450 1.342 1.00 0.00 H new ATOM 0 HA SER A 325 -5.224 9.049 0.885 1.00 0.00 H new ATOM 0 HB2 SER A 325 -7.075 7.364 1.848 1.00 0.00 H new ATOM 0 HB3 SER A 325 -6.250 7.677 3.362 1.00 0.00 H new ATOM 0 HG SER A 325 -7.963 9.190 2.967 1.00 0.00 H new ATOM 1129 N PHE A 326 -3.962 9.892 2.967 1.00 0.00 N ATOM 1130 CA PHE A 326 -2.948 10.379 3.894 1.00 0.00 C ATOM 1131 C PHE A 326 -3.512 11.479 4.789 1.00 0.00 C ATOM 1132 O PHE A 326 -3.939 12.529 4.307 1.00 0.00 O ATOM 1133 CB PHE A 326 -1.733 10.903 3.125 1.00 0.00 C ATOM 1134 CG PHE A 326 -0.665 11.477 4.012 1.00 0.00 C ATOM 1135 CD1 PHE A 326 -0.711 12.805 4.404 1.00 0.00 C ATOM 1136 CD2 PHE A 326 0.386 10.688 4.453 1.00 0.00 C ATOM 1137 CE1 PHE A 326 0.271 13.335 5.219 1.00 0.00 C ATOM 1138 CE2 PHE A 326 1.371 11.213 5.268 1.00 0.00 C ATOM 1139 CZ PHE A 326 1.313 12.538 5.652 1.00 0.00 C ATOM 0 H PHE A 326 -4.615 10.606 2.644 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.638 9.546 4.525 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -1.307 10.090 2.536 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -2.060 11.669 2.422 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -1.523 13.433 4.069 1.00 0.00 H new ATOM 0 HD2 PHE A 326 0.436 9.651 4.156 1.00 0.00 H new ATOM 0 HE1 PHE A 326 0.224 14.372 5.517 1.00 0.00 H new ATOM 0 HE2 PHE A 326 2.185 10.588 5.604 1.00 0.00 H new ATOM 0 HZ PHE A 326 2.081 12.951 6.290 1.00 0.00 H new ATOM 1149 N THR A 327 -3.509 11.231 6.095 1.00 0.00 N ATOM 1150 CA THR A 327 -4.021 12.198 7.057 1.00 0.00 C ATOM 1151 C THR A 327 -3.138 12.260 8.298 1.00 0.00 C ATOM 1152 O THR A 327 -3.086 11.314 9.083 1.00 0.00 O ATOM 1153 CB THR A 327 -5.462 11.858 7.483 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.466 10.683 8.301 1.00 0.00 O ATOM 1155 CG2 THR A 327 -6.349 11.638 6.267 1.00 0.00 C ATOM 0 H THR A 327 -3.157 10.368 6.510 1.00 0.00 H new ATOM 0 HA THR A 327 -4.016 13.169 6.562 1.00 0.00 H new ATOM 0 HB THR A 327 -5.857 12.699 8.053 1.00 0.00 H new ATOM 0 HG1 THR A 327 -4.811 10.784 9.023 1.00 0.00 H new ATOM 0 HG21 THR A 327 -7.361 11.399 6.593 1.00 0.00 H new ATOM 0 HG22 THR A 327 -6.367 12.544 5.661 1.00 0.00 H new ATOM 0 HG23 THR A 327 -5.955 10.813 5.674 1.00 0.00 H new ATOM 1163 N GLY A 328 -2.443 13.381 8.469 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.571 13.545 9.617 1.00 0.00 C ATOM 1165 C GLY A 328 -0.726 12.315 9.884 1.00 0.00 C ATOM 1166 O GLY A 328 0.349 12.154 9.306 1.00 0.00 O ATOM 0 H GLY A 328 -2.469 14.178 7.833 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -0.918 14.402 9.454 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -2.173 13.766 10.498 1.00 0.00 H new ATOM 1170 N THR A 329 -1.212 11.445 10.764 1.00 0.00 N ATOM 1171 CA THR A 329 -0.493 10.225 11.108 1.00 0.00 C ATOM 1172 C THR A 329 -1.188 8.996 10.534 1.00 0.00 C ATOM 1173 O THR A 329 -1.255 7.949 11.179 1.00 0.00 O ATOM 1174 CB THR A 329 -0.363 10.061 12.634 1.00 0.00 C ATOM 1175 OG1 THR A 329 -1.657 9.871 13.218 1.00 0.00 O ATOM 1176 CG2 THR A 329 0.305 11.279 13.255 1.00 0.00 C ATOM 0 H THR A 329 -2.100 11.563 11.251 1.00 0.00 H new ATOM 0 HA THR A 329 0.503 10.312 10.673 1.00 0.00 H new ATOM 0 HB THR A 329 0.257 9.186 12.832 1.00 0.00 H new ATOM 0 HG1 THR A 329 -1.566 9.766 14.188 1.00 0.00 H new ATOM 0 HG21 THR A 329 0.386 11.140 14.333 1.00 0.00 H new ATOM 0 HG22 THR A 329 1.301 11.404 12.830 1.00 0.00 H new ATOM 0 HG23 THR A 329 -0.292 12.167 13.048 1.00 0.00 H new ATOM 1184 N LYS A 330 -1.705 9.129 9.317 1.00 0.00 N ATOM 1185 CA LYS A 330 -2.394 8.028 8.654 1.00 0.00 C ATOM 1186 C LYS A 330 -1.890 7.854 7.224 1.00 0.00 C ATOM 1187 O LYS A 330 -1.866 8.805 6.443 1.00 0.00 O ATOM 1188 CB LYS A 330 -3.904 8.276 8.647 1.00 0.00 C ATOM 1189 CG LYS A 330 -4.730 7.001 8.669 1.00 0.00 C ATOM 1190 CD LYS A 330 -6.219 7.301 8.680 1.00 0.00 C ATOM 1191 CE LYS A 330 -7.043 6.030 8.822 1.00 0.00 C ATOM 1192 NZ LYS A 330 -8.391 6.303 9.391 1.00 0.00 N ATOM 0 H LYS A 330 -1.660 9.989 8.770 1.00 0.00 H new ATOM 0 HA LYS A 330 -2.184 7.113 9.209 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -4.168 8.885 9.512 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -4.165 8.853 7.760 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -4.487 6.394 7.797 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -4.470 6.413 9.549 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -6.449 7.978 9.502 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -6.495 7.814 7.758 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -7.150 5.556 7.846 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -6.514 5.324 9.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -8.921 5.412 9.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -8.290 6.732 10.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -8.906 6.956 8.766 1.00 0.00 H new ATOM 1206 N THR A 331 -1.490 6.631 6.888 1.00 0.00 N ATOM 1207 CA THR A 331 -0.988 6.332 5.553 1.00 0.00 C ATOM 1208 C THR A 331 -1.482 4.972 5.072 1.00 0.00 C ATOM 1209 O THR A 331 -0.998 3.932 5.518 1.00 0.00 O ATOM 1210 CB THR A 331 0.552 6.348 5.516 1.00 0.00 C ATOM 1211 OG1 THR A 331 1.045 7.525 6.166 1.00 0.00 O ATOM 1212 CG2 THR A 331 1.059 6.305 4.082 1.00 0.00 C ATOM 0 H THR A 331 -1.504 5.832 7.522 1.00 0.00 H new ATOM 0 HA THR A 331 -1.369 7.109 4.890 1.00 0.00 H new ATOM 0 HB THR A 331 0.916 5.464 6.040 1.00 0.00 H new ATOM 0 HG1 THR A 331 2.003 7.423 6.346 1.00 0.00 H new ATOM 0 HG21 THR A 331 2.149 6.317 4.081 1.00 0.00 H new ATOM 0 HG22 THR A 331 0.706 5.394 3.598 1.00 0.00 H new ATOM 0 HG23 THR A 331 0.686 7.173 3.538 1.00 0.00 H new ATOM 1220 N SER A 332 -2.447 4.988 4.159 1.00 0.00 N ATOM 1221 CA SER A 332 -3.009 3.755 3.619 1.00 0.00 C ATOM 1222 C SER A 332 -2.183 3.254 2.438 1.00 0.00 C ATOM 1223 O SER A 332 -1.530 4.035 1.746 1.00 0.00 O ATOM 1224 CB SER A 332 -4.459 3.978 3.184 1.00 0.00 C ATOM 1225 OG SER A 332 -5.319 4.071 4.307 1.00 0.00 O ATOM 0 H SER A 332 -2.856 5.841 3.777 1.00 0.00 H new ATOM 0 HA SER A 332 -2.985 2.999 4.404 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.528 4.891 2.592 1.00 0.00 H new ATOM 0 HB3 SER A 332 -4.780 3.157 2.543 1.00 0.00 H new ATOM 0 HG SER A 332 -6.239 4.215 4.003 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.219 1.945 2.213 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.474 1.337 1.115 1.00 0.00 C ATOM 1233 C LEU A 333 -2.218 0.128 0.557 1.00 0.00 C ATOM 1234 O LEU A 333 -2.644 -0.751 1.306 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.080 0.920 1.588 1.00 0.00 C ATOM 1236 CG LEU A 333 0.808 2.040 2.129 1.00 0.00 C ATOM 1237 CD1 LEU A 333 2.069 1.466 2.756 1.00 0.00 C ATOM 1238 CD2 LEU A 333 1.161 3.023 1.022 1.00 0.00 C ATOM 0 H LEU A 333 -2.755 1.285 2.775 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.375 2.077 0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.193 0.165 2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.437 0.444 0.755 1.00 0.00 H new ATOM 0 HG LEU A 333 0.254 2.575 2.900 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.689 2.278 3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.798 0.803 3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.626 0.905 2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.794 3.814 1.426 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.695 2.501 0.228 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.248 3.460 0.618 1.00 0.00 H new ATOM 1250 N SER A 334 -2.367 0.089 -0.763 1.00 0.00 N ATOM 1251 CA SER A 334 -3.061 -1.012 -1.421 1.00 0.00 C ATOM 1252 C SER A 334 -2.086 -1.860 -2.233 1.00 0.00 C ATOM 1253 O SER A 334 -1.309 -1.338 -3.032 1.00 0.00 O ATOM 1254 CB SER A 334 -4.167 -0.475 -2.331 1.00 0.00 C ATOM 1255 OG SER A 334 -5.216 -1.417 -2.471 1.00 0.00 O ATOM 0 H SER A 334 -2.017 0.807 -1.398 1.00 0.00 H new ATOM 0 HA SER A 334 -3.508 -1.640 -0.650 1.00 0.00 H new ATOM 0 HB2 SER A 334 -4.561 0.454 -1.920 1.00 0.00 H new ATOM 0 HB3 SER A 334 -3.753 -0.239 -3.311 1.00 0.00 H new ATOM 0 HG SER A 334 -5.820 -1.130 -3.187 1.00 0.00 H new ATOM 1261 N MET A 335 -2.133 -3.171 -2.021 1.00 0.00 N ATOM 1262 CA MET A 335 -1.255 -4.092 -2.733 1.00 0.00 C ATOM 1263 C MET A 335 -1.935 -4.629 -3.989 1.00 0.00 C ATOM 1264 O MET A 335 -1.281 -4.884 -5.000 1.00 0.00 O ATOM 1265 CB MET A 335 -0.851 -5.253 -1.822 1.00 0.00 C ATOM 1266 CG MET A 335 0.200 -4.878 -0.789 1.00 0.00 C ATOM 1267 SD MET A 335 0.864 -6.312 0.078 1.00 0.00 S ATOM 1268 CE MET A 335 1.546 -7.248 -1.288 1.00 0.00 C ATOM 0 H MET A 335 -2.770 -3.619 -1.362 1.00 0.00 H new ATOM 0 HA MET A 335 -0.360 -3.545 -3.030 1.00 0.00 H new ATOM 0 HB2 MET A 335 -1.737 -5.626 -1.308 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.471 -6.070 -2.435 1.00 0.00 H new ATOM 0 HG2 MET A 335 1.014 -4.347 -1.281 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.237 -4.191 -0.065 1.00 0.00 H new ATOM 0 HE1 MET A 335 2.175 -8.050 -0.901 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.735 -7.675 -1.878 1.00 0.00 H new ATOM 0 HE3 MET A 335 2.144 -6.589 -1.917 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.250 -4.800 -3.917 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.019 -5.306 -5.048 1.00 0.00 C ATOM 1280 C LYS A 336 -4.051 -4.288 -6.184 1.00 0.00 C ATOM 1281 O LYS A 336 -3.689 -4.598 -7.319 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.447 -5.642 -4.611 1.00 0.00 C ATOM 1283 CG LYS A 336 -5.515 -6.664 -3.489 1.00 0.00 C ATOM 1284 CD LYS A 336 -6.889 -7.305 -3.401 1.00 0.00 C ATOM 1285 CE LYS A 336 -7.960 -6.283 -3.053 1.00 0.00 C ATOM 1286 NZ LYS A 336 -9.314 -6.729 -3.484 1.00 0.00 N ATOM 0 H LYS A 336 -3.806 -4.596 -3.087 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.533 -6.212 -5.409 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -5.944 -4.727 -4.288 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -6.001 -6.020 -5.470 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -4.762 -7.435 -3.652 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -5.276 -6.181 -2.541 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -7.132 -7.779 -4.352 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.877 -8.092 -2.647 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -7.960 -6.110 -1.977 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -7.722 -5.332 -3.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -10.016 -6.005 -3.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -9.321 -6.870 -4.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -9.552 -7.624 -3.010 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.484 -3.072 -5.870 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.560 -2.007 -6.864 1.00 0.00 C ATOM 1302 C ASP A 337 -3.237 -1.864 -7.609 1.00 0.00 C ATOM 1303 O ASP A 337 -3.185 -1.299 -8.701 1.00 0.00 O ATOM 1304 CB ASP A 337 -4.929 -0.682 -6.196 1.00 0.00 C ATOM 1305 CG ASP A 337 -6.395 -0.612 -5.819 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -7.233 -1.109 -6.601 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -6.706 -0.060 -4.743 1.00 0.00 O ATOM 0 H ASP A 337 -4.788 -2.799 -4.935 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.335 -2.270 -7.584 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -4.320 -0.547 -5.302 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -4.691 0.140 -6.871 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.167 -2.380 -7.011 1.00 0.00 N ATOM 1313 CA VAL A 338 -0.844 -2.310 -7.618 1.00 0.00 C ATOM 1314 C VAL A 338 -0.295 -3.704 -7.902 1.00 0.00 C ATOM 1315 O VAL A 338 0.119 -4.417 -6.988 1.00 0.00 O ATOM 1316 CB VAL A 338 0.149 -1.554 -6.714 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.523 -1.494 -7.364 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.368 -0.156 -6.409 1.00 0.00 C ATOM 0 H VAL A 338 -2.192 -2.851 -6.107 1.00 0.00 H new ATOM 0 HA VAL A 338 -0.955 -1.768 -8.557 1.00 0.00 H new ATOM 0 HB VAL A 338 0.243 -2.095 -5.773 1.00 0.00 H new ATOM 0 HG11 VAL A 338 2.211 -0.957 -6.711 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.893 -2.506 -7.527 1.00 0.00 H new ATOM 0 HG13 VAL A 338 1.451 -0.976 -8.320 1.00 0.00 H new ATOM 0 HG21 VAL A 338 0.345 0.364 -5.770 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.492 0.397 -7.340 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.329 -0.227 -5.899 1.00 0.00 H new ATOM 1328 N ASP A 339 -0.295 -4.086 -9.174 1.00 0.00 N ATOM 1329 CA ASP A 339 0.204 -5.394 -9.580 1.00 0.00 C ATOM 1330 C ASP A 339 1.563 -5.678 -8.947 1.00 0.00 C ATOM 1331 O ASP A 339 2.238 -4.766 -8.472 1.00 0.00 O ATOM 1332 CB ASP A 339 0.312 -5.473 -11.104 1.00 0.00 C ATOM 1333 CG ASP A 339 -0.969 -5.961 -11.751 1.00 0.00 C ATOM 1334 OD1 ASP A 339 -1.892 -6.364 -11.011 1.00 0.00 O ATOM 1335 OD2 ASP A 339 -1.050 -5.940 -12.996 1.00 0.00 O ATOM 0 H ASP A 339 -0.635 -3.508 -9.942 1.00 0.00 H new ATOM 0 HA ASP A 339 -0.503 -6.148 -9.234 1.00 0.00 H new ATOM 0 HB2 ASP A 339 0.563 -4.489 -11.499 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.129 -6.142 -11.373 1.00 0.00 H new ATOM 1340 N GLN A 340 1.955 -6.948 -8.943 1.00 0.00 N ATOM 1341 CA GLN A 340 3.232 -7.351 -8.366 1.00 0.00 C ATOM 1342 C GLN A 340 4.148 -7.942 -9.432 1.00 0.00 C ATOM 1343 O GLN A 340 5.329 -8.184 -9.184 1.00 0.00 O ATOM 1344 CB GLN A 340 3.010 -8.368 -7.246 1.00 0.00 C ATOM 1345 CG GLN A 340 2.097 -7.866 -6.139 1.00 0.00 C ATOM 1346 CD GLN A 340 2.673 -6.672 -5.404 1.00 0.00 C ATOM 1347 OE1 GLN A 340 3.748 -6.754 -4.808 1.00 0.00 O ATOM 1348 NE2 GLN A 340 1.961 -5.552 -5.443 1.00 0.00 N ATOM 0 H GLN A 340 1.407 -7.715 -9.333 1.00 0.00 H new ATOM 0 HA GLN A 340 3.712 -6.464 -7.952 1.00 0.00 H new ATOM 0 HB2 GLN A 340 2.585 -9.277 -7.671 1.00 0.00 H new ATOM 0 HB3 GLN A 340 3.974 -8.638 -6.816 1.00 0.00 H new ATOM 0 HG2 GLN A 340 1.131 -7.594 -6.565 1.00 0.00 H new ATOM 0 HG3 GLN A 340 1.916 -8.673 -5.429 1.00 0.00 H new ATOM 0 HE21 GLN A 340 1.075 -5.528 -5.949 1.00 0.00 H new ATOM 0 HE22 GLN A 340 2.300 -4.716 -4.967 1.00 0.00 H new ATOM 1357 N GLU A 341 3.596 -8.173 -10.619 1.00 0.00 N ATOM 1358 CA GLU A 341 4.365 -8.738 -11.722 1.00 0.00 C ATOM 1359 C GLU A 341 4.927 -7.634 -12.614 1.00 0.00 C ATOM 1360 O GLU A 341 5.968 -7.803 -13.250 1.00 0.00 O ATOM 1361 CB GLU A 341 3.492 -9.683 -12.550 1.00 0.00 C ATOM 1362 CG GLU A 341 4.247 -10.390 -13.663 1.00 0.00 C ATOM 1363 CD GLU A 341 5.080 -11.551 -13.157 1.00 0.00 C ATOM 1364 OE1 GLU A 341 6.161 -11.301 -12.584 1.00 0.00 O ATOM 1365 OE2 GLU A 341 4.651 -12.710 -13.335 1.00 0.00 O ATOM 0 H GLU A 341 2.620 -7.978 -10.841 1.00 0.00 H new ATOM 0 HA GLU A 341 5.198 -9.301 -11.300 1.00 0.00 H new ATOM 0 HB2 GLU A 341 3.052 -10.430 -11.889 1.00 0.00 H new ATOM 0 HB3 GLU A 341 2.668 -9.116 -12.984 1.00 0.00 H new ATOM 0 HG2 GLU A 341 3.536 -10.754 -14.405 1.00 0.00 H new ATOM 0 HG3 GLU A 341 4.896 -9.675 -14.168 1.00 0.00 H new ATOM 1372 N THR A 342 4.229 -6.503 -12.657 1.00 0.00 N ATOM 1373 CA THR A 342 4.656 -5.373 -13.471 1.00 0.00 C ATOM 1374 C THR A 342 4.701 -4.089 -12.650 1.00 0.00 C ATOM 1375 O THR A 342 5.562 -3.236 -12.860 1.00 0.00 O ATOM 1376 CB THR A 342 3.721 -5.164 -14.678 1.00 0.00 C ATOM 1377 OG1 THR A 342 2.397 -4.862 -14.224 1.00 0.00 O ATOM 1378 CG2 THR A 342 3.691 -6.404 -15.559 1.00 0.00 C ATOM 0 H THR A 342 3.366 -6.346 -12.137 1.00 0.00 H new ATOM 0 HA THR A 342 5.658 -5.605 -13.832 1.00 0.00 H new ATOM 0 HB THR A 342 4.102 -4.329 -15.266 1.00 0.00 H new ATOM 0 HG1 THR A 342 1.809 -4.729 -14.996 1.00 0.00 H new ATOM 0 HG21 THR A 342 3.025 -6.234 -16.405 1.00 0.00 H new ATOM 0 HG22 THR A 342 4.696 -6.614 -15.925 1.00 0.00 H new ATOM 0 HG23 THR A 342 3.331 -7.254 -14.979 1.00 0.00 H new ATOM 1386 N GLY A 343 3.767 -3.959 -11.712 1.00 0.00 N ATOM 1387 CA GLY A 343 3.719 -2.776 -10.873 1.00 0.00 C ATOM 1388 C GLY A 343 3.081 -1.593 -11.574 1.00 0.00 C ATOM 1389 O GLY A 343 3.439 -0.444 -11.316 1.00 0.00 O ATOM 0 H GLY A 343 3.043 -4.651 -11.519 1.00 0.00 H new ATOM 0 HA2 GLY A 343 3.160 -3.001 -9.965 1.00 0.00 H new ATOM 0 HA3 GLY A 343 4.731 -2.510 -10.567 1.00 0.00 H new ATOM 1393 N GLU A 344 2.135 -1.875 -12.465 1.00 0.00 N ATOM 1394 CA GLU A 344 1.448 -0.824 -13.207 1.00 0.00 C ATOM 1395 C GLU A 344 0.291 -0.251 -12.393 1.00 0.00 C ATOM 1396 O GLU A 344 0.040 -0.676 -11.266 1.00 0.00 O ATOM 1397 CB GLU A 344 0.929 -1.366 -14.540 1.00 0.00 C ATOM 1398 CG GLU A 344 1.991 -1.431 -15.625 1.00 0.00 C ATOM 1399 CD GLU A 344 1.604 -2.353 -16.765 1.00 0.00 C ATOM 1400 OE1 GLU A 344 0.397 -2.442 -17.074 1.00 0.00 O ATOM 1401 OE2 GLU A 344 2.509 -2.986 -17.349 1.00 0.00 O ATOM 0 H GLU A 344 1.827 -2.821 -12.690 1.00 0.00 H new ATOM 0 HA GLU A 344 2.163 -0.025 -13.402 1.00 0.00 H new ATOM 0 HB2 GLU A 344 0.521 -2.364 -14.383 1.00 0.00 H new ATOM 0 HB3 GLU A 344 0.108 -0.737 -14.884 1.00 0.00 H new ATOM 0 HG2 GLU A 344 2.167 -0.429 -16.017 1.00 0.00 H new ATOM 0 HG3 GLU A 344 2.930 -1.772 -15.189 1.00 0.00 H new ATOM 1408 N ASP A 345 -0.410 0.717 -12.974 1.00 0.00 N ATOM 1409 CA ASP A 345 -1.540 1.349 -12.304 1.00 0.00 C ATOM 1410 C ASP A 345 -2.854 0.698 -12.724 1.00 0.00 C ATOM 1411 O ASP A 345 -3.458 1.083 -13.726 1.00 0.00 O ATOM 1412 CB ASP A 345 -1.575 2.846 -12.619 1.00 0.00 C ATOM 1413 CG ASP A 345 -2.907 3.480 -12.269 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -3.849 3.369 -13.082 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -3.008 4.086 -11.182 1.00 0.00 O ATOM 0 H ASP A 345 -0.215 1.081 -13.907 1.00 0.00 H new ATOM 0 HA ASP A 345 -1.415 1.214 -11.230 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -0.780 3.349 -12.068 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -1.372 2.996 -13.679 1.00 0.00 H new