USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=20 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 Set 1.1: A 269 ASN : amide:sc= -0.475 K(o=-0.76,f=1.1) USER MOD Set 1.2: A 320 LYS NZ :NH3+ 171:sc= -0.282 (180deg=0) USER MOD Set 2.1: A 298 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 336 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 TYR OH : rot 180:sc= 0.247 USER MOD Single : A 271 LYS NZ :NH3+ -125:sc= -0.245 (180deg=-0.877) USER MOD Single : A 273 THR OG1 : rot 180:sc= 0 USER MOD Single : A 274 SER OG : rot 29:sc= 0.0987 USER MOD Single : A 276 MET CE :methyl -151:sc= -7.22! (180deg=-12!) USER MOD Single : A 277 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.29) USER MOD Single : A 280 CYS SG : rot 31:sc= -0.53 USER MOD Single : A 283 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 289 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 HIS : no HD1:sc= -1.38 X(o=-1.4,f=-1.6) USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ 150:sc= -0.0314 (180deg=-0.955) USER MOD Single : A 317 GLN : amide:sc= -1.14 K(o=-1.1,f=-0.027) USER MOD Single : A 322 LYS NZ :NH3+ -159:sc= 0.262 (180deg=-0.173) USER MOD Single : A 325 SER OG : rot 180:sc= 0 USER MOD Single : A 327 THR OG1 : rot 180:sc= 0 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 180:sc= 0 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 SER OG : rot -160:sc= -0.945 USER MOD Single : A 335 MET CE :methyl 160:sc= -0.172 (180deg=-0.983) USER MOD Single : A 340 GLN : amide:sc= -1.37 K(o=-1.4,f=-9.9!) USER MOD Single : A 342 THR OG1 : rot 178:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.970 14.649 0.073 1.00 0.00 N ATOM 67 CA GLU A 260 8.780 14.549 1.516 1.00 0.00 C ATOM 68 C GLU A 260 7.518 13.757 1.844 1.00 0.00 C ATOM 69 O GLU A 260 7.533 12.873 2.700 1.00 0.00 O ATOM 70 CB GLU A 260 8.697 15.944 2.139 1.00 0.00 C ATOM 71 CG GLU A 260 8.423 15.928 3.634 1.00 0.00 C ATOM 72 CD GLU A 260 7.954 17.272 4.156 1.00 0.00 C ATOM 73 OE1 GLU A 260 7.334 18.026 3.377 1.00 0.00 O ATOM 74 OE2 GLU A 260 8.207 17.569 5.342 1.00 0.00 O ATOM 0 HA GLU A 260 9.638 14.023 1.935 1.00 0.00 H new ATOM 0 HB2 GLU A 260 9.633 16.471 1.955 1.00 0.00 H new ATOM 0 HB3 GLU A 260 7.910 16.509 1.640 1.00 0.00 H new ATOM 0 HG2 GLU A 260 7.667 15.174 3.853 1.00 0.00 H new ATOM 0 HG3 GLU A 260 9.330 15.634 4.163 1.00 0.00 H new ATOM 81 N GLU A 261 6.426 14.083 1.159 1.00 0.00 N ATOM 82 CA GLU A 261 5.155 13.403 1.379 1.00 0.00 C ATOM 83 C GLU A 261 4.668 12.732 0.098 1.00 0.00 C ATOM 84 O GLU A 261 4.847 13.244 -1.008 1.00 0.00 O ATOM 85 CB GLU A 261 4.102 14.392 1.882 1.00 0.00 C ATOM 86 CG GLU A 261 4.206 14.688 3.369 1.00 0.00 C ATOM 87 CD GLU A 261 3.511 15.978 3.757 1.00 0.00 C ATOM 88 OE1 GLU A 261 2.400 16.230 3.245 1.00 0.00 O ATOM 89 OE2 GLU A 261 4.077 16.736 4.572 1.00 0.00 O ATOM 0 H GLU A 261 6.396 14.813 0.448 1.00 0.00 H new ATOM 0 HA GLU A 261 5.310 12.634 2.135 1.00 0.00 H new ATOM 0 HB2 GLU A 261 4.198 15.325 1.327 1.00 0.00 H new ATOM 0 HB3 GLU A 261 3.110 13.994 1.668 1.00 0.00 H new ATOM 0 HG2 GLU A 261 3.771 13.862 3.931 1.00 0.00 H new ATOM 0 HG3 GLU A 261 5.257 14.747 3.651 1.00 0.00 H new ATOM 96 N PRO A 262 4.037 11.558 0.248 1.00 0.00 N ATOM 97 CA PRO A 262 3.510 10.792 -0.885 1.00 0.00 C ATOM 98 C PRO A 262 2.307 11.467 -1.533 1.00 0.00 C ATOM 99 O PRO A 262 1.692 12.359 -0.947 1.00 0.00 O ATOM 100 CB PRO A 262 3.099 9.460 -0.252 1.00 0.00 C ATOM 101 CG PRO A 262 2.830 9.787 1.177 1.00 0.00 C ATOM 102 CD PRO A 262 3.787 10.889 1.536 1.00 0.00 C ATOM 0 HA PRO A 262 4.244 10.692 -1.685 1.00 0.00 H new ATOM 0 HB2 PRO A 262 2.214 9.047 -0.737 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.890 8.716 -0.346 1.00 0.00 H new ATOM 0 HG2 PRO A 262 1.797 10.106 1.317 1.00 0.00 H new ATOM 0 HG3 PRO A 262 2.983 8.915 1.813 1.00 0.00 H new ATOM 0 HD2 PRO A 262 3.356 11.573 2.267 1.00 0.00 H new ATOM 0 HD3 PRO A 262 4.707 10.497 1.970 1.00 0.00 H new ATOM 110 N THR A 263 1.974 11.037 -2.746 1.00 0.00 N ATOM 111 CA THR A 263 0.844 11.601 -3.474 1.00 0.00 C ATOM 112 C THR A 263 -0.285 10.586 -3.608 1.00 0.00 C ATOM 113 O THR A 263 -0.071 9.461 -4.060 1.00 0.00 O ATOM 114 CB THR A 263 1.262 12.076 -4.879 1.00 0.00 C ATOM 115 OG1 THR A 263 2.356 12.994 -4.780 1.00 0.00 O ATOM 116 CG2 THR A 263 0.096 12.744 -5.593 1.00 0.00 C ATOM 0 H THR A 263 2.471 10.299 -3.245 1.00 0.00 H new ATOM 0 HA THR A 263 0.492 12.457 -2.899 1.00 0.00 H new ATOM 0 HB THR A 263 1.571 11.205 -5.457 1.00 0.00 H new ATOM 0 HG1 THR A 263 2.617 13.290 -5.677 1.00 0.00 H new ATOM 0 HG21 THR A 263 0.415 13.071 -6.583 1.00 0.00 H new ATOM 0 HG22 THR A 263 -0.725 12.034 -5.692 1.00 0.00 H new ATOM 0 HG23 THR A 263 -0.238 13.606 -5.016 1.00 0.00 H new ATOM 124 N ILE A 264 -1.488 10.991 -3.214 1.00 0.00 N ATOM 125 CA ILE A 264 -2.651 10.117 -3.292 1.00 0.00 C ATOM 126 C ILE A 264 -2.946 9.722 -4.735 1.00 0.00 C ATOM 127 O ILE A 264 -3.008 10.572 -5.623 1.00 0.00 O ATOM 128 CB ILE A 264 -3.901 10.787 -2.690 1.00 0.00 C ATOM 129 CG1 ILE A 264 -3.647 11.171 -1.231 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.103 9.860 -2.798 1.00 0.00 C ATOM 131 CD1 ILE A 264 -4.730 12.044 -0.639 1.00 0.00 C ATOM 0 H ILE A 264 -1.682 11.919 -2.838 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.413 9.224 -2.714 1.00 0.00 H new ATOM 0 HB ILE A 264 -4.116 11.695 -3.253 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -3.557 10.263 -0.635 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -2.693 11.693 -1.162 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -5.978 10.347 -2.368 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.293 9.631 -3.847 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -4.900 8.936 -2.256 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -4.484 12.277 0.397 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -4.805 12.969 -1.211 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -5.683 11.517 -0.676 1.00 0.00 H new ATOM 143 N GLY A 265 -3.129 8.424 -4.963 1.00 0.00 N ATOM 144 CA GLY A 265 -3.416 7.939 -6.300 1.00 0.00 C ATOM 145 C GLY A 265 -2.195 7.354 -6.980 1.00 0.00 C ATOM 146 O GLY A 265 -2.316 6.545 -7.900 1.00 0.00 O ATOM 0 H GLY A 265 -3.083 7.701 -4.245 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -4.197 7.181 -6.248 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -3.807 8.758 -6.904 1.00 0.00 H new ATOM 150 N ASP A 266 -1.015 7.764 -6.528 1.00 0.00 N ATOM 151 CA ASP A 266 0.235 7.275 -7.099 1.00 0.00 C ATOM 152 C ASP A 266 0.675 5.983 -6.418 1.00 0.00 C ATOM 153 O ASP A 266 0.367 5.750 -5.249 1.00 0.00 O ATOM 154 CB ASP A 266 1.330 8.335 -6.966 1.00 0.00 C ATOM 155 CG ASP A 266 2.350 8.256 -8.085 1.00 0.00 C ATOM 156 OD1 ASP A 266 2.002 7.746 -9.170 1.00 0.00 O ATOM 157 OD2 ASP A 266 3.497 8.703 -7.875 1.00 0.00 O ATOM 0 H ASP A 266 -0.898 8.434 -5.768 1.00 0.00 H new ATOM 0 HA ASP A 266 0.067 7.068 -8.156 1.00 0.00 H new ATOM 0 HB2 ASP A 266 0.875 9.325 -6.962 1.00 0.00 H new ATOM 0 HB3 ASP A 266 1.835 8.213 -6.008 1.00 0.00 H new ATOM 162 N ILE A 267 1.395 5.146 -7.157 1.00 0.00 N ATOM 163 CA ILE A 267 1.877 3.878 -6.624 1.00 0.00 C ATOM 164 C ILE A 267 3.348 3.970 -6.233 1.00 0.00 C ATOM 165 O ILE A 267 4.193 4.359 -7.039 1.00 0.00 O ATOM 166 CB ILE A 267 1.699 2.736 -7.642 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.222 2.573 -8.005 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.259 1.436 -7.083 1.00 0.00 C ATOM 169 CD1 ILE A 267 -0.206 3.412 -9.189 1.00 0.00 C ATOM 0 H ILE A 267 1.657 5.323 -8.127 1.00 0.00 H new ATOM 0 HA ILE A 267 1.281 3.661 -5.738 1.00 0.00 H new ATOM 0 HB ILE A 267 2.251 2.987 -8.548 1.00 0.00 H new ATOM 0 HG12 ILE A 267 0.024 1.524 -8.223 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -0.387 2.840 -7.142 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.126 0.638 -7.814 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.321 1.559 -6.870 1.00 0.00 H new ATOM 0 HG23 ILE A 267 1.732 1.178 -6.164 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -1.265 3.246 -9.389 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -0.040 4.466 -8.967 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.378 3.129 -10.065 1.00 0.00 H new ATOM 181 N TYR A 268 3.648 3.607 -4.990 1.00 0.00 N ATOM 182 CA TYR A 268 5.017 3.649 -4.491 1.00 0.00 C ATOM 183 C TYR A 268 5.506 2.251 -4.125 1.00 0.00 C ATOM 184 O TYR A 268 4.717 1.313 -4.019 1.00 0.00 O ATOM 185 CB TYR A 268 5.109 4.569 -3.272 1.00 0.00 C ATOM 186 CG TYR A 268 4.861 6.025 -3.593 1.00 0.00 C ATOM 187 CD1 TYR A 268 3.569 6.523 -3.704 1.00 0.00 C ATOM 188 CD2 TYR A 268 5.920 6.905 -3.784 1.00 0.00 C ATOM 189 CE1 TYR A 268 3.338 7.853 -3.997 1.00 0.00 C ATOM 190 CE2 TYR A 268 5.699 8.237 -4.076 1.00 0.00 C ATOM 191 CZ TYR A 268 4.406 8.706 -4.182 1.00 0.00 C ATOM 192 OH TYR A 268 4.180 10.032 -4.473 1.00 0.00 O ATOM 0 H TYR A 268 2.961 3.281 -4.310 1.00 0.00 H new ATOM 0 HA TYR A 268 5.654 4.041 -5.283 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.386 4.242 -2.525 1.00 0.00 H new ATOM 0 HB3 TYR A 268 6.098 4.467 -2.824 1.00 0.00 H new ATOM 0 HD1 TYR A 268 2.730 5.858 -3.559 1.00 0.00 H new ATOM 0 HD2 TYR A 268 6.934 6.541 -3.703 1.00 0.00 H new ATOM 0 HE1 TYR A 268 2.327 8.223 -4.081 1.00 0.00 H new ATOM 0 HE2 TYR A 268 6.534 8.907 -4.220 1.00 0.00 H new ATOM 0 HH TYR A 268 5.038 10.496 -4.572 1.00 0.00 H new ATOM 202 N ASN A 269 6.815 2.121 -3.933 1.00 0.00 N ATOM 203 CA ASN A 269 7.411 0.838 -3.579 1.00 0.00 C ATOM 204 C ASN A 269 7.529 0.692 -2.065 1.00 0.00 C ATOM 205 O ASN A 269 7.891 1.638 -1.366 1.00 0.00 O ATOM 206 CB ASN A 269 8.791 0.698 -4.226 1.00 0.00 C ATOM 207 CG ASN A 269 8.868 1.381 -5.577 1.00 0.00 C ATOM 208 OD1 ASN A 269 9.746 2.210 -5.817 1.00 0.00 O ATOM 209 ND2 ASN A 269 7.947 1.034 -6.469 1.00 0.00 N ATOM 0 H ASN A 269 7.482 2.888 -4.017 1.00 0.00 H new ATOM 0 HA ASN A 269 6.760 0.047 -3.952 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.545 1.123 -3.563 1.00 0.00 H new ATOM 0 HB3 ASN A 269 9.029 -0.359 -4.342 1.00 0.00 H new ATOM 0 HD21 ASN A 269 7.949 1.459 -7.396 1.00 0.00 H new ATOM 0 HD22 ASN A 269 7.238 0.342 -6.227 1.00 0.00 H new ATOM 216 N GLY A 270 7.222 -0.501 -1.565 1.00 0.00 N ATOM 217 CA GLY A 270 7.301 -0.749 -0.137 1.00 0.00 C ATOM 218 C GLY A 270 7.727 -2.168 0.182 1.00 0.00 C ATOM 219 O GLY A 270 7.891 -2.993 -0.718 1.00 0.00 O ATOM 0 H GLY A 270 6.920 -1.300 -2.123 1.00 0.00 H new ATOM 0 HA2 GLY A 270 8.008 -0.051 0.311 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.329 -0.554 0.317 1.00 0.00 H new ATOM 223 N LYS A 271 7.910 -2.455 1.466 1.00 0.00 N ATOM 224 CA LYS A 271 8.321 -3.784 1.903 1.00 0.00 C ATOM 225 C LYS A 271 7.623 -4.169 3.204 1.00 0.00 C ATOM 226 O LYS A 271 7.366 -3.320 4.057 1.00 0.00 O ATOM 227 CB LYS A 271 9.839 -3.834 2.093 1.00 0.00 C ATOM 228 CG LYS A 271 10.324 -5.098 2.782 1.00 0.00 C ATOM 229 CD LYS A 271 10.367 -4.928 4.291 1.00 0.00 C ATOM 230 CE LYS A 271 11.651 -4.245 4.739 1.00 0.00 C ATOM 231 NZ LYS A 271 12.858 -5.024 4.349 1.00 0.00 N ATOM 0 H LYS A 271 7.780 -1.784 2.223 1.00 0.00 H new ATOM 0 HA LYS A 271 8.033 -4.498 1.131 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.322 -3.753 1.119 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.152 -2.969 2.677 1.00 0.00 H new ATOM 0 HG2 LYS A 271 9.665 -5.928 2.527 1.00 0.00 H new ATOM 0 HG3 LYS A 271 11.318 -5.355 2.415 1.00 0.00 H new ATOM 0 HD2 LYS A 271 9.508 -4.341 4.617 1.00 0.00 H new ATOM 0 HD3 LYS A 271 10.286 -5.903 4.771 1.00 0.00 H new ATOM 0 HE2 LYS A 271 11.704 -3.249 4.300 1.00 0.00 H new ATOM 0 HE3 LYS A 271 11.636 -4.117 5.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 13.436 -5.214 5.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 12.566 -5.925 3.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 13.416 -4.478 3.662 1.00 0.00 H new ATOM 245 N VAL A 272 7.319 -5.455 3.349 1.00 0.00 N ATOM 246 CA VAL A 272 6.653 -5.953 4.546 1.00 0.00 C ATOM 247 C VAL A 272 7.616 -6.011 5.727 1.00 0.00 C ATOM 248 O VAL A 272 8.557 -6.806 5.737 1.00 0.00 O ATOM 249 CB VAL A 272 6.057 -7.354 4.315 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.755 -8.032 5.643 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.805 -7.265 3.456 1.00 0.00 C ATOM 0 H VAL A 272 7.524 -6.171 2.652 1.00 0.00 H new ATOM 0 HA VAL A 272 5.846 -5.256 4.772 1.00 0.00 H new ATOM 0 HB VAL A 272 6.792 -7.959 3.784 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.335 -9.021 5.459 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.675 -8.130 6.219 1.00 0.00 H new ATOM 0 HG13 VAL A 272 5.039 -7.431 6.203 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.397 -8.264 3.303 1.00 0.00 H new ATOM 0 HG22 VAL A 272 4.063 -6.643 3.957 1.00 0.00 H new ATOM 0 HG23 VAL A 272 5.056 -6.824 2.491 1.00 0.00 H new ATOM 261 N THR A 273 7.375 -5.163 6.722 1.00 0.00 N ATOM 262 CA THR A 273 8.221 -5.117 7.908 1.00 0.00 C ATOM 263 C THR A 273 7.681 -6.027 9.005 1.00 0.00 C ATOM 264 O THR A 273 8.446 -6.653 9.738 1.00 0.00 O ATOM 265 CB THR A 273 8.338 -3.683 8.459 1.00 0.00 C ATOM 266 OG1 THR A 273 7.060 -3.227 8.915 1.00 0.00 O ATOM 267 CG2 THR A 273 8.870 -2.736 7.393 1.00 0.00 C ATOM 0 H THR A 273 6.601 -4.499 6.730 1.00 0.00 H new ATOM 0 HA THR A 273 9.209 -5.464 7.605 1.00 0.00 H new ATOM 0 HB THR A 273 9.038 -3.694 9.295 1.00 0.00 H new ATOM 0 HG1 THR A 273 7.144 -2.315 9.265 1.00 0.00 H new ATOM 0 HG21 THR A 273 8.944 -1.729 7.805 1.00 0.00 H new ATOM 0 HG22 THR A 273 9.856 -3.069 7.070 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.191 -2.730 6.540 1.00 0.00 H new ATOM 275 N SER A 274 6.358 -6.098 9.110 1.00 0.00 N ATOM 276 CA SER A 274 5.715 -6.931 10.120 1.00 0.00 C ATOM 277 C SER A 274 4.367 -7.444 9.623 1.00 0.00 C ATOM 278 O SER A 274 3.499 -6.663 9.233 1.00 0.00 O ATOM 279 CB SER A 274 5.526 -6.142 11.417 1.00 0.00 C ATOM 280 OG SER A 274 6.653 -6.278 12.266 1.00 0.00 O ATOM 0 H SER A 274 5.710 -5.589 8.508 1.00 0.00 H new ATOM 0 HA SER A 274 6.361 -7.787 10.314 1.00 0.00 H new ATOM 0 HB2 SER A 274 5.366 -5.089 11.186 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.633 -6.494 11.934 1.00 0.00 H new ATOM 0 HG SER A 274 7.456 -6.424 11.723 1.00 0.00 H new ATOM 286 N ILE A 275 4.201 -8.763 9.640 1.00 0.00 N ATOM 287 CA ILE A 275 2.959 -9.381 9.193 1.00 0.00 C ATOM 288 C ILE A 275 1.987 -9.566 10.354 1.00 0.00 C ATOM 289 O ILE A 275 2.364 -10.051 11.420 1.00 0.00 O ATOM 290 CB ILE A 275 3.217 -10.748 8.531 1.00 0.00 C ATOM 291 CG1 ILE A 275 4.016 -10.570 7.239 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.901 -11.459 8.253 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.497 -10.358 7.468 1.00 0.00 C ATOM 0 H ILE A 275 4.910 -9.423 9.958 1.00 0.00 H new ATOM 0 HA ILE A 275 2.518 -8.708 8.458 1.00 0.00 H new ATOM 0 HB ILE A 275 3.801 -11.362 9.216 1.00 0.00 H new ATOM 0 HG12 ILE A 275 3.876 -11.450 6.611 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.616 -9.718 6.689 1.00 0.00 H new ATOM 0 HG21 ILE A 275 2.100 -12.423 7.785 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.366 -11.614 9.190 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.293 -10.850 7.584 1.00 0.00 H new ATOM 0 HD11 ILE A 275 6.000 -10.239 6.508 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.647 -9.462 8.070 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.911 -11.220 7.991 1.00 0.00 H new ATOM 305 N MET A 276 0.735 -9.177 10.137 1.00 0.00 N ATOM 306 CA MET A 276 -0.292 -9.303 11.165 1.00 0.00 C ATOM 307 C MET A 276 -1.443 -10.179 10.679 1.00 0.00 C ATOM 308 O MET A 276 -1.794 -10.159 9.500 1.00 0.00 O ATOM 309 CB MET A 276 -0.819 -7.923 11.562 1.00 0.00 C ATOM 310 CG MET A 276 0.269 -6.967 12.023 1.00 0.00 C ATOM 311 SD MET A 276 -0.124 -5.244 11.666 1.00 0.00 S ATOM 312 CE MET A 276 0.066 -5.215 9.885 1.00 0.00 C ATOM 0 H MET A 276 0.407 -8.772 9.260 1.00 0.00 H new ATOM 0 HA MET A 276 0.159 -9.776 12.037 1.00 0.00 H new ATOM 0 HB2 MET A 276 -1.341 -7.484 10.712 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.552 -8.039 12.361 1.00 0.00 H new ATOM 0 HG2 MET A 276 0.421 -7.086 13.096 1.00 0.00 H new ATOM 0 HG3 MET A 276 1.208 -7.230 11.536 1.00 0.00 H new ATOM 0 HE1 MET A 276 0.367 -4.217 9.567 1.00 0.00 H new ATOM 0 HE2 MET A 276 0.828 -5.936 9.589 1.00 0.00 H new ATOM 0 HE3 MET A 276 -0.882 -5.475 9.414 1.00 0.00 H new ATOM 322 N GLN A 277 -2.024 -10.947 11.595 1.00 0.00 N ATOM 323 CA GLN A 277 -3.134 -11.830 11.258 1.00 0.00 C ATOM 324 C GLN A 277 -4.182 -11.096 10.428 1.00 0.00 C ATOM 325 O GLN A 277 -4.852 -11.693 9.586 1.00 0.00 O ATOM 326 CB GLN A 277 -3.774 -12.388 12.531 1.00 0.00 C ATOM 327 CG GLN A 277 -4.487 -13.714 12.323 1.00 0.00 C ATOM 328 CD GLN A 277 -3.551 -14.814 11.863 1.00 0.00 C ATOM 329 OE1 GLN A 277 -3.594 -15.240 10.709 1.00 0.00 O ATOM 330 NE2 GLN A 277 -2.696 -15.280 12.766 1.00 0.00 N ATOM 0 H GLN A 277 -1.745 -10.976 12.576 1.00 0.00 H new ATOM 0 HA GLN A 277 -2.741 -12.656 10.665 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -3.002 -12.515 13.290 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -4.486 -11.659 12.919 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -4.965 -14.015 13.255 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -5.279 -13.584 11.586 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -2.695 -14.898 13.712 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -2.041 -16.020 12.514 1.00 0.00 H new ATOM 339 N PHE A 278 -4.318 -9.796 10.672 1.00 0.00 N ATOM 340 CA PHE A 278 -5.285 -8.980 9.947 1.00 0.00 C ATOM 341 C PHE A 278 -4.671 -8.414 8.670 1.00 0.00 C ATOM 342 O PHE A 278 -5.148 -8.681 7.568 1.00 0.00 O ATOM 343 CB PHE A 278 -5.787 -7.839 10.834 1.00 0.00 C ATOM 344 CG PHE A 278 -4.711 -7.218 11.678 1.00 0.00 C ATOM 345 CD1 PHE A 278 -4.318 -7.809 12.868 1.00 0.00 C ATOM 346 CD2 PHE A 278 -4.094 -6.042 11.282 1.00 0.00 C ATOM 347 CE1 PHE A 278 -3.328 -7.241 13.647 1.00 0.00 C ATOM 348 CE2 PHE A 278 -3.103 -5.469 12.057 1.00 0.00 C ATOM 349 CZ PHE A 278 -2.720 -6.068 13.241 1.00 0.00 C ATOM 0 H PHE A 278 -3.771 -9.286 11.366 1.00 0.00 H new ATOM 0 HA PHE A 278 -6.127 -9.616 9.673 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -6.233 -7.069 10.204 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.576 -8.216 11.485 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -4.791 -8.725 13.191 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -4.391 -5.568 10.358 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -3.030 -7.713 14.572 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -2.628 -4.553 11.737 1.00 0.00 H new ATOM 0 HZ PHE A 278 -1.947 -5.621 13.848 1.00 0.00 H new ATOM 359 N GLY A 279 -3.609 -7.629 8.828 1.00 0.00 N ATOM 360 CA GLY A 279 -2.947 -7.037 7.681 1.00 0.00 C ATOM 361 C GLY A 279 -1.438 -7.145 7.763 1.00 0.00 C ATOM 362 O GLY A 279 -0.906 -7.889 8.587 1.00 0.00 O ATOM 0 H GLY A 279 -3.196 -7.393 9.730 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.294 -7.528 6.772 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.229 -5.987 7.604 1.00 0.00 H new ATOM 366 N CYS A 280 -0.746 -6.403 6.905 1.00 0.00 N ATOM 367 CA CYS A 280 0.713 -6.421 6.882 1.00 0.00 C ATOM 368 C CYS A 280 1.272 -5.004 6.820 1.00 0.00 C ATOM 369 O CYS A 280 0.805 -4.174 6.040 1.00 0.00 O ATOM 370 CB CYS A 280 1.215 -7.234 5.688 1.00 0.00 C ATOM 371 SG CYS A 280 0.834 -6.497 4.081 1.00 0.00 S ATOM 0 H CYS A 280 -1.171 -5.782 6.217 1.00 0.00 H new ATOM 0 HA CYS A 280 1.061 -6.890 7.802 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.295 -7.356 5.773 1.00 0.00 H new ATOM 0 HB3 CYS A 280 0.777 -8.231 5.731 1.00 0.00 H new ATOM 0 HG CYS A 280 0.805 -5.202 4.193 1.00 0.00 H new ATOM 377 N PHE A 281 2.276 -4.732 7.648 1.00 0.00 N ATOM 378 CA PHE A 281 2.898 -3.414 7.690 1.00 0.00 C ATOM 379 C PHE A 281 3.878 -3.239 6.533 1.00 0.00 C ATOM 380 O PHE A 281 4.899 -3.923 6.461 1.00 0.00 O ATOM 381 CB PHE A 281 3.622 -3.210 9.022 1.00 0.00 C ATOM 382 CG PHE A 281 2.706 -2.831 10.150 1.00 0.00 C ATOM 383 CD1 PHE A 281 1.829 -1.766 10.021 1.00 0.00 C ATOM 384 CD2 PHE A 281 2.722 -3.540 11.341 1.00 0.00 C ATOM 385 CE1 PHE A 281 0.984 -1.415 11.057 1.00 0.00 C ATOM 386 CE2 PHE A 281 1.880 -3.193 12.380 1.00 0.00 C ATOM 387 CZ PHE A 281 1.011 -2.129 12.239 1.00 0.00 C ATOM 0 H PHE A 281 2.676 -5.408 8.299 1.00 0.00 H new ATOM 0 HA PHE A 281 2.112 -2.665 7.594 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.148 -4.128 9.285 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.377 -2.433 8.901 1.00 0.00 H new ATOM 0 HD1 PHE A 281 1.805 -1.203 9.100 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.400 -4.373 11.458 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.304 -0.584 10.942 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.901 -3.754 13.303 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.354 -1.856 13.051 1.00 0.00 H new ATOM 397 N VAL A 282 3.559 -2.318 5.629 1.00 0.00 N ATOM 398 CA VAL A 282 4.410 -2.052 4.476 1.00 0.00 C ATOM 399 C VAL A 282 5.087 -0.691 4.595 1.00 0.00 C ATOM 400 O VAL A 282 4.424 0.329 4.779 1.00 0.00 O ATOM 401 CB VAL A 282 3.607 -2.099 3.162 1.00 0.00 C ATOM 402 CG1 VAL A 282 4.453 -1.602 2.000 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.101 -3.510 2.899 1.00 0.00 C ATOM 0 H VAL A 282 2.717 -1.744 5.673 1.00 0.00 H new ATOM 0 HA VAL A 282 5.170 -2.833 4.457 1.00 0.00 H new ATOM 0 HB VAL A 282 2.745 -1.439 3.259 1.00 0.00 H new ATOM 0 HG11 VAL A 282 3.869 -1.643 1.081 1.00 0.00 H new ATOM 0 HG12 VAL A 282 4.762 -0.574 2.188 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.336 -2.233 1.897 1.00 0.00 H new ATOM 0 HG21 VAL A 282 2.536 -3.526 1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 282 3.948 -4.192 2.821 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.456 -3.824 3.720 1.00 0.00 H new ATOM 413 N GLN A 283 6.412 -0.684 4.489 1.00 0.00 N ATOM 414 CA GLN A 283 7.179 0.552 4.586 1.00 0.00 C ATOM 415 C GLN A 283 7.638 1.017 3.208 1.00 0.00 C ATOM 416 O GLN A 283 8.286 0.270 2.473 1.00 0.00 O ATOM 417 CB GLN A 283 8.390 0.355 5.500 1.00 0.00 C ATOM 418 CG GLN A 283 9.354 1.531 5.494 1.00 0.00 C ATOM 419 CD GLN A 283 10.770 1.126 5.855 1.00 0.00 C ATOM 420 OE1 GLN A 283 10.996 0.442 6.853 1.00 0.00 O ATOM 421 NE2 GLN A 283 11.732 1.548 5.043 1.00 0.00 N ATOM 0 H GLN A 283 6.976 -1.520 4.336 1.00 0.00 H new ATOM 0 HA GLN A 283 6.532 1.319 5.012 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.042 0.186 6.519 1.00 0.00 H new ATOM 0 HB3 GLN A 283 8.924 -0.544 5.193 1.00 0.00 H new ATOM 0 HG2 GLN A 283 9.353 1.992 4.506 1.00 0.00 H new ATOM 0 HG3 GLN A 283 9.005 2.286 6.199 1.00 0.00 H new ATOM 0 HE21 GLN A 283 11.499 2.113 4.227 1.00 0.00 H new ATOM 0 HE22 GLN A 283 12.704 1.307 5.236 1.00 0.00 H new ATOM 430 N LEU A 284 7.298 2.253 2.863 1.00 0.00 N ATOM 431 CA LEU A 284 7.675 2.818 1.571 1.00 0.00 C ATOM 432 C LEU A 284 9.181 3.051 1.498 1.00 0.00 C ATOM 433 O LEU A 284 9.807 3.439 2.483 1.00 0.00 O ATOM 434 CB LEU A 284 6.932 4.134 1.332 1.00 0.00 C ATOM 435 CG LEU A 284 5.406 4.063 1.393 1.00 0.00 C ATOM 436 CD1 LEU A 284 4.807 5.461 1.401 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.862 3.255 0.224 1.00 0.00 C ATOM 0 H LEU A 284 6.762 2.884 3.459 1.00 0.00 H new ATOM 0 HA LEU A 284 7.398 2.105 0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 284 7.272 4.860 2.071 1.00 0.00 H new ATOM 0 HB3 LEU A 284 7.219 4.518 0.353 1.00 0.00 H new ATOM 0 HG LEU A 284 5.122 3.562 2.318 1.00 0.00 H new ATOM 0 HD11 LEU A 284 3.720 5.391 1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 284 5.171 6.008 2.271 1.00 0.00 H new ATOM 0 HD13 LEU A 284 5.100 5.988 0.493 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.774 3.215 0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 284 5.157 3.727 -0.713 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.265 2.243 0.263 1.00 0.00 H new ATOM 449 N GLU A 285 9.755 2.812 0.322 1.00 0.00 N ATOM 450 CA GLU A 285 11.187 2.997 0.120 1.00 0.00 C ATOM 451 C GLU A 285 11.455 4.122 -0.876 1.00 0.00 C ATOM 452 O GLU A 285 10.870 4.160 -1.957 1.00 0.00 O ATOM 453 CB GLU A 285 11.827 1.699 -0.375 1.00 0.00 C ATOM 454 CG GLU A 285 11.800 0.577 0.650 1.00 0.00 C ATOM 455 CD GLU A 285 12.784 -0.531 0.328 1.00 0.00 C ATOM 456 OE1 GLU A 285 12.532 -1.287 -0.633 1.00 0.00 O ATOM 457 OE2 GLU A 285 13.806 -0.641 1.037 1.00 0.00 O ATOM 0 H GLU A 285 9.250 2.490 -0.504 1.00 0.00 H new ATOM 0 HA GLU A 285 11.631 3.270 1.078 1.00 0.00 H new ATOM 0 HB2 GLU A 285 11.309 1.369 -1.276 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.861 1.898 -0.656 1.00 0.00 H new ATOM 0 HG2 GLU A 285 12.027 0.984 1.635 1.00 0.00 H new ATOM 0 HG3 GLU A 285 10.794 0.161 0.701 1.00 0.00 H new ATOM 464 N GLY A 286 12.345 5.037 -0.501 1.00 0.00 N ATOM 465 CA GLY A 286 12.675 6.150 -1.372 1.00 0.00 C ATOM 466 C GLY A 286 12.309 7.489 -0.764 1.00 0.00 C ATOM 467 O GLY A 286 13.167 8.356 -0.590 1.00 0.00 O ATOM 0 H GLY A 286 12.843 5.027 0.389 1.00 0.00 H new ATOM 0 HA2 GLY A 286 13.743 6.133 -1.590 1.00 0.00 H new ATOM 0 HA3 GLY A 286 12.154 6.031 -2.322 1.00 0.00 H new ATOM 471 N LEU A 287 11.032 7.662 -0.441 1.00 0.00 N ATOM 472 CA LEU A 287 10.553 8.907 0.149 1.00 0.00 C ATOM 473 C LEU A 287 11.469 9.359 1.283 1.00 0.00 C ATOM 474 O LEU A 287 11.924 8.546 2.088 1.00 0.00 O ATOM 475 CB LEU A 287 9.126 8.732 0.670 1.00 0.00 C ATOM 476 CG LEU A 287 8.047 8.506 -0.390 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.739 8.086 0.261 1.00 0.00 C ATOM 478 CD2 LEU A 287 7.850 9.763 -1.225 1.00 0.00 C ATOM 0 H LEU A 287 10.309 6.955 -0.578 1.00 0.00 H new ATOM 0 HA LEU A 287 10.558 9.674 -0.626 1.00 0.00 H new ATOM 0 HB2 LEU A 287 9.113 7.887 1.359 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.860 9.618 1.247 1.00 0.00 H new ATOM 0 HG LEU A 287 8.375 7.703 -1.050 1.00 0.00 H new ATOM 0 HD11 LEU A 287 5.983 7.930 -0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 287 6.889 7.160 0.815 1.00 0.00 H new ATOM 0 HD13 LEU A 287 6.405 8.867 0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 287 7.079 9.585 -1.974 1.00 0.00 H new ATOM 0 HD22 LEU A 287 7.544 10.585 -0.578 1.00 0.00 H new ATOM 0 HD23 LEU A 287 8.786 10.020 -1.721 1.00 0.00 H new ATOM 490 N ARG A 288 11.732 10.660 1.340 1.00 0.00 N ATOM 491 CA ARG A 288 12.592 11.221 2.376 1.00 0.00 C ATOM 492 C ARG A 288 12.104 10.818 3.765 1.00 0.00 C ATOM 493 O ARG A 288 12.877 10.329 4.589 1.00 0.00 O ATOM 494 CB ARG A 288 12.637 12.745 2.262 1.00 0.00 C ATOM 495 CG ARG A 288 13.530 13.246 1.139 1.00 0.00 C ATOM 496 CD ARG A 288 14.986 13.311 1.573 1.00 0.00 C ATOM 497 NE ARG A 288 15.897 13.342 0.431 1.00 0.00 N ATOM 498 CZ ARG A 288 17.219 13.297 0.544 1.00 0.00 C ATOM 499 NH1 ARG A 288 17.783 13.218 1.742 1.00 0.00 N ATOM 500 NH2 ARG A 288 17.981 13.329 -0.542 1.00 0.00 N ATOM 0 H ARG A 288 11.362 11.346 0.681 1.00 0.00 H new ATOM 0 HA ARG A 288 13.597 10.823 2.233 1.00 0.00 H new ATOM 0 HB2 ARG A 288 11.625 13.119 2.105 1.00 0.00 H new ATOM 0 HB3 ARG A 288 12.987 13.161 3.206 1.00 0.00 H new ATOM 0 HG2 ARG A 288 13.435 12.587 0.276 1.00 0.00 H new ATOM 0 HG3 ARG A 288 13.199 14.235 0.823 1.00 0.00 H new ATOM 0 HD2 ARG A 288 15.142 14.199 2.186 1.00 0.00 H new ATOM 0 HD3 ARG A 288 15.217 12.448 2.198 1.00 0.00 H new ATOM 0 HE ARG A 288 15.495 13.401 -0.505 1.00 0.00 H new ATOM 0 HH11 ARG A 288 17.201 13.192 2.579 1.00 0.00 H new ATOM 0 HH12 ARG A 288 18.799 13.184 1.826 1.00 0.00 H new ATOM 0 HH21 ARG A 288 17.551 13.388 -1.465 1.00 0.00 H new ATOM 0 HH22 ARG A 288 18.997 13.294 -0.454 1.00 0.00 H new ATOM 514 N LYS A 289 10.817 11.027 4.017 1.00 0.00 N ATOM 515 CA LYS A 289 10.224 10.686 5.305 1.00 0.00 C ATOM 516 C LYS A 289 9.709 9.250 5.303 1.00 0.00 C ATOM 517 O LYS A 289 8.729 8.933 4.628 1.00 0.00 O ATOM 518 CB LYS A 289 9.081 11.649 5.634 1.00 0.00 C ATOM 519 CG LYS A 289 8.883 11.871 7.124 1.00 0.00 C ATOM 520 CD LYS A 289 7.511 12.450 7.424 1.00 0.00 C ATOM 521 CE LYS A 289 7.450 13.935 7.100 1.00 0.00 C ATOM 522 NZ LYS A 289 6.229 14.576 7.663 1.00 0.00 N ATOM 0 H LYS A 289 10.164 11.431 3.346 1.00 0.00 H new ATOM 0 HA LYS A 289 10.997 10.775 6.068 1.00 0.00 H new ATOM 0 HB2 LYS A 289 9.276 12.608 5.155 1.00 0.00 H new ATOM 0 HB3 LYS A 289 8.156 11.262 5.207 1.00 0.00 H new ATOM 0 HG2 LYS A 289 9.003 10.925 7.653 1.00 0.00 H new ATOM 0 HG3 LYS A 289 9.653 12.546 7.498 1.00 0.00 H new ATOM 0 HD2 LYS A 289 6.756 11.919 6.844 1.00 0.00 H new ATOM 0 HD3 LYS A 289 7.272 12.296 8.476 1.00 0.00 H new ATOM 0 HE2 LYS A 289 8.336 14.430 7.497 1.00 0.00 H new ATOM 0 HE3 LYS A 289 7.466 14.072 6.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 6.225 15.587 7.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 5.383 14.121 7.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 6.226 14.468 8.697 1.00 0.00 H new ATOM 536 N ARG A 290 10.374 8.387 6.064 1.00 0.00 N ATOM 537 CA ARG A 290 9.982 6.985 6.150 1.00 0.00 C ATOM 538 C ARG A 290 8.534 6.852 6.611 1.00 0.00 C ATOM 539 O ARG A 290 8.181 7.277 7.711 1.00 0.00 O ATOM 540 CB ARG A 290 10.906 6.234 7.112 1.00 0.00 C ATOM 541 CG ARG A 290 10.678 4.731 7.126 1.00 0.00 C ATOM 542 CD ARG A 290 9.640 4.335 8.165 1.00 0.00 C ATOM 543 NE ARG A 290 10.207 4.275 9.509 1.00 0.00 N ATOM 544 CZ ARG A 290 9.473 4.254 10.616 1.00 0.00 C ATOM 545 NH1 ARG A 290 8.150 4.287 10.539 1.00 0.00 N ATOM 546 NH2 ARG A 290 10.063 4.198 11.804 1.00 0.00 N ATOM 0 H ARG A 290 11.186 8.634 6.630 1.00 0.00 H new ATOM 0 HA ARG A 290 10.070 6.547 5.156 1.00 0.00 H new ATOM 0 HB2 ARG A 290 11.942 6.433 6.838 1.00 0.00 H new ATOM 0 HB3 ARG A 290 10.762 6.624 8.120 1.00 0.00 H new ATOM 0 HG2 ARG A 290 10.351 4.402 6.140 1.00 0.00 H new ATOM 0 HG3 ARG A 290 11.618 4.221 7.336 1.00 0.00 H new ATOM 0 HD2 ARG A 290 8.819 5.052 8.149 1.00 0.00 H new ATOM 0 HD3 ARG A 290 9.219 3.364 7.905 1.00 0.00 H new ATOM 0 HE ARG A 290 11.222 4.248 9.603 1.00 0.00 H new ATOM 0 HH11 ARG A 290 7.693 4.329 9.628 1.00 0.00 H new ATOM 0 HH12 ARG A 290 7.589 4.271 11.391 1.00 0.00 H new ATOM 0 HH21 ARG A 290 11.081 4.171 11.867 1.00 0.00 H new ATOM 0 HH22 ARG A 290 9.499 4.182 12.653 1.00 0.00 H new ATOM 560 N TRP A 291 7.701 6.262 5.762 1.00 0.00 N ATOM 561 CA TRP A 291 6.290 6.074 6.082 1.00 0.00 C ATOM 562 C TRP A 291 5.976 4.600 6.314 1.00 0.00 C ATOM 563 O TRP A 291 6.739 3.723 5.909 1.00 0.00 O ATOM 564 CB TRP A 291 5.413 6.624 4.957 1.00 0.00 C ATOM 565 CG TRP A 291 5.286 8.117 4.978 1.00 0.00 C ATOM 566 CD1 TRP A 291 5.657 8.985 3.991 1.00 0.00 C ATOM 567 CD2 TRP A 291 4.753 8.917 6.039 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.387 10.277 4.376 1.00 0.00 N ATOM 569 CE2 TRP A 291 4.831 10.261 5.628 1.00 0.00 C ATOM 570 CE3 TRP A 291 4.216 8.627 7.297 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.393 11.312 6.429 1.00 0.00 C ATOM 572 CZ3 TRP A 291 3.781 9.671 8.091 1.00 0.00 C ATOM 573 CH2 TRP A 291 3.871 11.000 7.655 1.00 0.00 C ATOM 0 H TRP A 291 7.977 5.906 4.847 1.00 0.00 H new ATOM 0 HA TRP A 291 6.076 6.621 7.000 1.00 0.00 H new ATOM 0 HB2 TRP A 291 5.829 6.316 3.998 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.420 6.181 5.031 1.00 0.00 H new ATOM 0 HD1 TRP A 291 6.097 8.699 3.047 1.00 0.00 H new ATOM 0 HE1 TRP A 291 5.571 11.112 3.820 1.00 0.00 H new ATOM 0 HE3 TRP A 291 4.143 7.606 7.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.463 12.337 6.095 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 3.364 9.459 9.065 1.00 0.00 H new ATOM 0 HH2 TRP A 291 3.522 11.793 8.299 1.00 0.00 H new ATOM 584 N GLU A 292 4.849 4.335 6.967 1.00 0.00 N ATOM 585 CA GLU A 292 4.436 2.965 7.252 1.00 0.00 C ATOM 586 C GLU A 292 2.915 2.855 7.302 1.00 0.00 C ATOM 587 O GLU A 292 2.265 3.472 8.144 1.00 0.00 O ATOM 588 CB GLU A 292 5.037 2.494 8.578 1.00 0.00 C ATOM 589 CG GLU A 292 4.640 1.076 8.956 1.00 0.00 C ATOM 590 CD GLU A 292 4.678 0.840 10.453 1.00 0.00 C ATOM 591 OE1 GLU A 292 5.746 0.440 10.963 1.00 0.00 O ATOM 592 OE2 GLU A 292 3.641 1.054 11.114 1.00 0.00 O ATOM 0 H GLU A 292 4.206 5.050 7.308 1.00 0.00 H new ATOM 0 HA GLU A 292 4.803 2.327 6.448 1.00 0.00 H new ATOM 0 HB2 GLU A 292 6.124 2.554 8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 292 4.724 3.174 9.371 1.00 0.00 H new ATOM 0 HG2 GLU A 292 3.635 0.873 8.585 1.00 0.00 H new ATOM 0 HG3 GLU A 292 5.310 0.371 8.464 1.00 0.00 H new ATOM 599 N GLY A 293 2.354 2.064 6.392 1.00 0.00 N ATOM 600 CA GLY A 293 0.915 1.887 6.349 1.00 0.00 C ATOM 601 C GLY A 293 0.496 0.461 6.650 1.00 0.00 C ATOM 602 O GLY A 293 1.318 -0.455 6.616 1.00 0.00 O ATOM 0 H GLY A 293 2.871 1.543 5.684 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.448 2.559 7.069 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.547 2.170 5.363 1.00 0.00 H new ATOM 606 N LEU A 294 -0.784 0.273 6.948 1.00 0.00 N ATOM 607 CA LEU A 294 -1.311 -1.052 7.259 1.00 0.00 C ATOM 608 C LEU A 294 -2.208 -1.559 6.134 1.00 0.00 C ATOM 609 O LEU A 294 -3.127 -0.865 5.699 1.00 0.00 O ATOM 610 CB LEU A 294 -2.092 -1.017 8.573 1.00 0.00 C ATOM 611 CG LEU A 294 -3.007 -2.212 8.843 1.00 0.00 C ATOM 612 CD1 LEU A 294 -2.185 -3.461 9.121 1.00 0.00 C ATOM 613 CD2 LEU A 294 -3.942 -1.916 10.006 1.00 0.00 C ATOM 0 H LEU A 294 -1.477 1.021 6.981 1.00 0.00 H new ATOM 0 HA LEU A 294 -0.468 -1.736 7.363 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -1.379 -0.938 9.394 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.697 -0.111 8.588 1.00 0.00 H new ATOM 0 HG LEU A 294 -3.612 -2.391 7.954 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -2.853 -4.301 9.311 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -1.558 -3.684 8.258 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -1.554 -3.294 9.994 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -4.586 -2.778 10.184 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -3.355 -1.711 10.901 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -4.556 -1.048 9.767 1.00 0.00 H new ATOM 625 N VAL A 295 -1.936 -2.774 5.669 1.00 0.00 N ATOM 626 CA VAL A 295 -2.720 -3.375 4.597 1.00 0.00 C ATOM 627 C VAL A 295 -3.668 -4.439 5.140 1.00 0.00 C ATOM 628 O VAL A 295 -3.252 -5.554 5.456 1.00 0.00 O ATOM 629 CB VAL A 295 -1.813 -4.010 3.526 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.640 -4.497 2.346 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.752 -3.020 3.072 1.00 0.00 C ATOM 0 H VAL A 295 -1.179 -3.361 6.018 1.00 0.00 H new ATOM 0 HA VAL A 295 -3.301 -2.573 4.141 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.309 -4.871 3.965 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -1.982 -4.942 1.600 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.358 -5.242 2.688 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -3.173 -3.656 1.904 1.00 0.00 H new ATOM 0 HG21 VAL A 295 -0.120 -3.485 2.315 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -1.234 -2.138 2.650 1.00 0.00 H new ATOM 0 HG23 VAL A 295 -0.140 -2.726 3.925 1.00 0.00 H new ATOM 641 N HIS A 296 -4.945 -4.087 5.245 1.00 0.00 N ATOM 642 CA HIS A 296 -5.954 -5.012 5.750 1.00 0.00 C ATOM 643 C HIS A 296 -5.934 -6.319 4.963 1.00 0.00 C ATOM 644 O HIS A 296 -5.375 -6.387 3.868 1.00 0.00 O ATOM 645 CB HIS A 296 -7.343 -4.377 5.672 1.00 0.00 C ATOM 646 CG HIS A 296 -8.360 -5.055 6.537 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.432 -5.757 6.028 1.00 0.00 N ATOM 648 CD2 HIS A 296 -8.464 -5.137 7.884 1.00 0.00 C ATOM 649 CE1 HIS A 296 -10.152 -6.240 7.025 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.586 -5.878 8.162 1.00 0.00 N ATOM 0 H HIS A 296 -5.306 -3.168 4.987 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.722 -5.232 6.792 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -7.271 -3.329 5.963 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.686 -4.398 4.637 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.790 -4.701 8.606 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -11.051 -6.831 6.927 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.927 -6.111 9.095 1.00 0.00 H new ATOM 658 N ILE A 297 -6.548 -7.353 5.528 1.00 0.00 N ATOM 659 CA ILE A 297 -6.600 -8.657 4.878 1.00 0.00 C ATOM 660 C ILE A 297 -7.274 -8.565 3.513 1.00 0.00 C ATOM 661 O ILE A 297 -6.970 -9.339 2.606 1.00 0.00 O ATOM 662 CB ILE A 297 -7.354 -9.686 5.741 1.00 0.00 C ATOM 663 CG1 ILE A 297 -7.232 -11.084 5.131 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.816 -9.289 5.882 1.00 0.00 C ATOM 665 CD1 ILE A 297 -8.197 -11.333 3.993 1.00 0.00 C ATOM 0 H ILE A 297 -7.016 -7.313 6.433 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.569 -8.987 4.750 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.905 -9.704 6.734 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -6.213 -11.227 4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -7.402 -11.827 5.910 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -9.336 -10.026 6.494 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.883 -8.310 6.357 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -9.278 -9.246 4.896 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -8.054 -12.343 3.609 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -9.220 -11.223 4.353 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -8.013 -10.613 3.196 1.00 0.00 H new ATOM 677 N SER A 298 -8.189 -7.611 3.374 1.00 0.00 N ATOM 678 CA SER A 298 -8.908 -7.417 2.120 1.00 0.00 C ATOM 679 C SER A 298 -7.988 -6.836 1.051 1.00 0.00 C ATOM 680 O SER A 298 -8.147 -7.114 -0.137 1.00 0.00 O ATOM 681 CB SER A 298 -10.109 -6.494 2.333 1.00 0.00 C ATOM 682 OG SER A 298 -10.810 -6.281 1.120 1.00 0.00 O ATOM 0 H SER A 298 -8.450 -6.960 4.115 1.00 0.00 H new ATOM 0 HA SER A 298 -9.263 -8.390 1.779 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.780 -6.930 3.073 1.00 0.00 H new ATOM 0 HB3 SER A 298 -9.771 -5.538 2.734 1.00 0.00 H new ATOM 0 HG SER A 298 -11.574 -5.689 1.283 1.00 0.00 H new ATOM 688 N GLU A 299 -7.026 -6.027 1.483 1.00 0.00 N ATOM 689 CA GLU A 299 -6.081 -5.405 0.563 1.00 0.00 C ATOM 690 C GLU A 299 -4.902 -6.333 0.285 1.00 0.00 C ATOM 691 O GLU A 299 -3.745 -5.913 0.318 1.00 0.00 O ATOM 692 CB GLU A 299 -5.576 -4.079 1.135 1.00 0.00 C ATOM 693 CG GLU A 299 -6.616 -2.971 1.115 1.00 0.00 C ATOM 694 CD GLU A 299 -6.214 -1.778 1.961 1.00 0.00 C ATOM 695 OE1 GLU A 299 -5.323 -1.018 1.528 1.00 0.00 O ATOM 696 OE2 GLU A 299 -6.790 -1.605 3.055 1.00 0.00 O ATOM 0 H GLU A 299 -6.880 -5.787 2.464 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.600 -5.213 -0.376 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.247 -4.238 2.162 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -4.703 -3.757 0.567 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -6.775 -2.646 0.087 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -7.567 -3.364 1.476 1.00 0.00 H new ATOM 703 N LEU A 300 -5.205 -7.597 0.010 1.00 0.00 N ATOM 704 CA LEU A 300 -4.171 -8.587 -0.275 1.00 0.00 C ATOM 705 C LEU A 300 -4.539 -9.422 -1.497 1.00 0.00 C ATOM 706 O LEU A 300 -3.899 -9.323 -2.544 1.00 0.00 O ATOM 707 CB LEU A 300 -3.962 -9.498 0.936 1.00 0.00 C ATOM 708 CG LEU A 300 -3.709 -8.794 2.270 1.00 0.00 C ATOM 709 CD1 LEU A 300 -3.747 -9.793 3.416 1.00 0.00 C ATOM 710 CD2 LEU A 300 -2.375 -8.062 2.242 1.00 0.00 C ATOM 0 H LEU A 300 -6.157 -7.961 -0.022 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.243 -8.056 -0.487 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -4.842 -10.133 1.044 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -3.118 -10.156 0.729 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.500 -8.061 2.428 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -3.565 -9.274 4.357 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -4.726 -10.272 3.449 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -2.978 -10.550 3.264 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -2.212 -7.567 3.199 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.572 -8.776 2.061 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.385 -7.318 1.446 1.00 0.00 H new ATOM 856 N VAL A 309 -2.714 -13.845 6.899 1.00 0.00 N ATOM 857 CA VAL A 309 -1.825 -13.028 6.082 1.00 0.00 C ATOM 858 C VAL A 309 -0.412 -13.601 6.065 1.00 0.00 C ATOM 859 O VAL A 309 0.327 -13.428 5.097 1.00 0.00 O ATOM 860 CB VAL A 309 -1.771 -11.575 6.591 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.864 -10.732 5.707 1.00 0.00 C ATOM 862 CG2 VAL A 309 -3.170 -10.981 6.653 1.00 0.00 C ATOM 0 HA VAL A 309 -2.230 -13.036 5.070 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.356 -11.577 7.599 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.839 -9.709 6.082 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.144 -11.148 5.718 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -1.246 -10.735 4.686 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -3.114 -9.954 7.015 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.614 -10.991 5.658 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.786 -11.571 7.331 1.00 0.00 H new ATOM 872 N ALA A 310 -0.044 -14.285 7.143 1.00 0.00 N ATOM 873 CA ALA A 310 1.279 -14.886 7.252 1.00 0.00 C ATOM 874 C ALA A 310 1.709 -15.510 5.928 1.00 0.00 C ATOM 875 O ALA A 310 2.702 -15.097 5.330 1.00 0.00 O ATOM 876 CB ALA A 310 1.295 -15.930 8.359 1.00 0.00 C ATOM 0 H ALA A 310 -0.644 -14.437 7.954 1.00 0.00 H new ATOM 0 HA ALA A 310 1.990 -14.098 7.501 1.00 0.00 H new ATOM 0 HB1 ALA A 310 2.289 -16.371 8.429 1.00 0.00 H new ATOM 0 HB2 ALA A 310 1.039 -15.458 9.308 1.00 0.00 H new ATOM 0 HB3 ALA A 310 0.568 -16.710 8.134 1.00 0.00 H new ATOM 882 N ASP A 311 0.954 -16.506 5.476 1.00 0.00 N ATOM 883 CA ASP A 311 1.257 -17.186 4.223 1.00 0.00 C ATOM 884 C ASP A 311 1.074 -16.246 3.036 1.00 0.00 C ATOM 885 O ASP A 311 1.688 -16.429 1.985 1.00 0.00 O ATOM 886 CB ASP A 311 0.363 -18.416 4.057 1.00 0.00 C ATOM 887 CG ASP A 311 0.888 -19.620 4.815 1.00 0.00 C ATOM 888 OD1 ASP A 311 2.119 -19.830 4.816 1.00 0.00 O ATOM 889 OD2 ASP A 311 0.068 -20.351 5.407 1.00 0.00 O ATOM 0 H ASP A 311 0.128 -16.860 5.959 1.00 0.00 H new ATOM 0 HA ASP A 311 2.299 -17.504 4.254 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -0.642 -18.181 4.406 1.00 0.00 H new ATOM 0 HB3 ASP A 311 0.283 -18.663 2.998 1.00 0.00 H new ATOM 894 N VAL A 312 0.225 -15.238 3.211 1.00 0.00 N ATOM 895 CA VAL A 312 -0.038 -14.268 2.155 1.00 0.00 C ATOM 896 C VAL A 312 1.190 -13.408 1.879 1.00 0.00 C ATOM 897 O VAL A 312 1.490 -13.085 0.730 1.00 0.00 O ATOM 898 CB VAL A 312 -1.222 -13.352 2.517 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.445 -12.311 1.430 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.482 -14.174 2.745 1.00 0.00 C ATOM 0 H VAL A 312 -0.292 -15.072 4.074 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.288 -14.836 1.259 1.00 0.00 H new ATOM 0 HB VAL A 312 -0.983 -12.830 3.443 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -2.286 -11.673 1.704 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.548 -11.702 1.320 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -1.661 -12.811 0.486 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.308 -13.510 3.000 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.726 -14.725 1.837 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.315 -14.876 3.562 1.00 0.00 H new ATOM 910 N VAL A 313 1.898 -13.040 2.942 1.00 0.00 N ATOM 911 CA VAL A 313 3.096 -12.218 2.815 1.00 0.00 C ATOM 912 C VAL A 313 4.157 -12.633 3.828 1.00 0.00 C ATOM 913 O VAL A 313 3.840 -13.005 4.958 1.00 0.00 O ATOM 914 CB VAL A 313 2.775 -10.724 3.007 1.00 0.00 C ATOM 915 CG1 VAL A 313 1.915 -10.211 1.862 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.088 -10.495 4.345 1.00 0.00 C ATOM 0 H VAL A 313 1.663 -13.298 3.900 1.00 0.00 H new ATOM 0 HA VAL A 313 3.480 -12.372 1.807 1.00 0.00 H new ATOM 0 HB VAL A 313 3.711 -10.166 3.005 1.00 0.00 H new ATOM 0 HG11 VAL A 313 1.698 -9.154 2.015 1.00 0.00 H new ATOM 0 HG12 VAL A 313 2.449 -10.340 0.920 1.00 0.00 H new ATOM 0 HG13 VAL A 313 0.981 -10.772 1.829 1.00 0.00 H new ATOM 0 HG21 VAL A 313 1.868 -9.434 4.464 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.159 -11.064 4.379 1.00 0.00 H new ATOM 0 HG23 VAL A 313 2.744 -10.823 5.152 1.00 0.00 H new ATOM 926 N SER A 314 5.419 -12.565 3.416 1.00 0.00 N ATOM 927 CA SER A 314 6.528 -12.937 4.287 1.00 0.00 C ATOM 928 C SER A 314 7.202 -11.698 4.867 1.00 0.00 C ATOM 929 O SER A 314 6.905 -10.571 4.470 1.00 0.00 O ATOM 930 CB SER A 314 7.551 -13.774 3.517 1.00 0.00 C ATOM 931 OG SER A 314 8.347 -14.546 4.399 1.00 0.00 O ATOM 0 H SER A 314 5.699 -12.256 2.485 1.00 0.00 H new ATOM 0 HA SER A 314 6.128 -13.531 5.109 1.00 0.00 H new ATOM 0 HB2 SER A 314 7.035 -14.432 2.818 1.00 0.00 H new ATOM 0 HB3 SER A 314 8.190 -13.119 2.925 1.00 0.00 H new ATOM 0 HG SER A 314 8.991 -15.073 3.882 1.00 0.00 H new ATOM 937 N LYS A 315 8.113 -11.914 5.810 1.00 0.00 N ATOM 938 CA LYS A 315 8.833 -10.816 6.446 1.00 0.00 C ATOM 939 C LYS A 315 10.056 -10.420 5.626 1.00 0.00 C ATOM 940 O LYS A 315 10.882 -11.263 5.278 1.00 0.00 O ATOM 941 CB LYS A 315 9.261 -11.212 7.861 1.00 0.00 C ATOM 942 CG LYS A 315 9.752 -10.043 8.697 1.00 0.00 C ATOM 943 CD LYS A 315 10.079 -10.472 10.117 1.00 0.00 C ATOM 944 CE LYS A 315 8.857 -10.390 11.020 1.00 0.00 C ATOM 945 NZ LYS A 315 8.077 -11.658 11.013 1.00 0.00 N ATOM 0 H LYS A 315 8.371 -12.840 6.151 1.00 0.00 H new ATOM 0 HA LYS A 315 8.162 -9.959 6.502 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.419 -11.682 8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 315 10.052 -11.959 7.797 1.00 0.00 H new ATOM 0 HG2 LYS A 315 10.638 -9.610 8.234 1.00 0.00 H new ATOM 0 HG3 LYS A 315 8.990 -9.264 8.718 1.00 0.00 H new ATOM 0 HD2 LYS A 315 10.460 -11.493 10.111 1.00 0.00 H new ATOM 0 HD3 LYS A 315 10.871 -9.838 10.516 1.00 0.00 H new ATOM 0 HE2 LYS A 315 9.172 -10.163 12.038 1.00 0.00 H new ATOM 0 HE3 LYS A 315 8.219 -9.569 10.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 7.606 -11.781 11.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 7.362 -11.621 10.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 8.718 -12.459 10.843 1.00 0.00 H new ATOM 959 N GLY A 316 10.166 -9.130 5.321 1.00 0.00 N ATOM 960 CA GLY A 316 11.292 -8.645 4.545 1.00 0.00 C ATOM 961 C GLY A 316 11.130 -8.908 3.061 1.00 0.00 C ATOM 962 O GLY A 316 12.116 -9.039 2.337 1.00 0.00 O ATOM 0 H GLY A 316 9.495 -8.413 5.598 1.00 0.00 H new ATOM 0 HA2 GLY A 316 11.409 -7.574 4.710 1.00 0.00 H new ATOM 0 HA3 GLY A 316 12.206 -9.123 4.898 1.00 0.00 H new ATOM 966 N GLN A 317 9.883 -8.986 2.608 1.00 0.00 N ATOM 967 CA GLN A 317 9.596 -9.237 1.201 1.00 0.00 C ATOM 968 C GLN A 317 9.196 -7.949 0.488 1.00 0.00 C ATOM 969 O GLN A 317 8.280 -7.249 0.919 1.00 0.00 O ATOM 970 CB GLN A 317 8.483 -10.277 1.063 1.00 0.00 C ATOM 971 CG GLN A 317 8.063 -10.532 -0.376 1.00 0.00 C ATOM 972 CD GLN A 317 6.652 -11.076 -0.484 1.00 0.00 C ATOM 973 OE1 GLN A 317 6.449 -12.247 -0.806 1.00 0.00 O ATOM 974 NE2 GLN A 317 5.668 -10.226 -0.216 1.00 0.00 N ATOM 0 H GLN A 317 9.056 -8.879 3.195 1.00 0.00 H new ATOM 0 HA GLN A 317 10.503 -9.622 0.735 1.00 0.00 H new ATOM 0 HB2 GLN A 317 8.817 -11.215 1.507 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.615 -9.946 1.633 1.00 0.00 H new ATOM 0 HG2 GLN A 317 8.134 -9.603 -0.941 1.00 0.00 H new ATOM 0 HG3 GLN A 317 8.756 -11.238 -0.833 1.00 0.00 H new ATOM 0 HE21 GLN A 317 5.882 -9.264 0.047 1.00 0.00 H new ATOM 0 HE22 GLN A 317 4.698 -10.535 -0.273 1.00 0.00 H new ATOM 983 N ARG A 318 9.889 -7.643 -0.604 1.00 0.00 N ATOM 984 CA ARG A 318 9.607 -6.439 -1.375 1.00 0.00 C ATOM 985 C ARG A 318 8.248 -6.538 -2.061 1.00 0.00 C ATOM 986 O ARG A 318 7.902 -7.574 -2.630 1.00 0.00 O ATOM 987 CB ARG A 318 10.701 -6.208 -2.419 1.00 0.00 C ATOM 988 CG ARG A 318 12.095 -6.087 -1.824 1.00 0.00 C ATOM 989 CD ARG A 318 12.675 -7.451 -1.483 1.00 0.00 C ATOM 990 NE ARG A 318 14.133 -7.463 -1.571 1.00 0.00 N ATOM 991 CZ ARG A 318 14.932 -7.079 -0.582 1.00 0.00 C ATOM 992 NH1 ARG A 318 14.417 -6.656 0.564 1.00 0.00 N ATOM 993 NH2 ARG A 318 16.249 -7.119 -0.738 1.00 0.00 N ATOM 0 H ARG A 318 10.650 -8.213 -0.974 1.00 0.00 H new ATOM 0 HA ARG A 318 9.587 -5.594 -0.687 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.690 -7.032 -3.133 1.00 0.00 H new ATOM 0 HB3 ARG A 318 10.473 -5.300 -2.977 1.00 0.00 H new ATOM 0 HG2 ARG A 318 12.751 -5.578 -2.531 1.00 0.00 H new ATOM 0 HG3 ARG A 318 12.056 -5.472 -0.925 1.00 0.00 H new ATOM 0 HD2 ARG A 318 12.370 -7.733 -0.475 1.00 0.00 H new ATOM 0 HD3 ARG A 318 12.265 -8.199 -2.161 1.00 0.00 H new ATOM 0 HE ARG A 318 14.561 -7.784 -2.440 1.00 0.00 H new ATOM 0 HH11 ARG A 318 13.405 -6.625 0.688 1.00 0.00 H new ATOM 0 HH12 ARG A 318 15.033 -6.362 1.322 1.00 0.00 H new ATOM 0 HH21 ARG A 318 16.649 -7.445 -1.618 1.00 0.00 H new ATOM 0 HH22 ARG A 318 16.862 -6.824 0.022 1.00 0.00 H new ATOM 1007 N VAL A 319 7.481 -5.454 -2.003 1.00 0.00 N ATOM 1008 CA VAL A 319 6.159 -5.419 -2.619 1.00 0.00 C ATOM 1009 C VAL A 319 5.787 -4.001 -3.038 1.00 0.00 C ATOM 1010 O VAL A 319 6.406 -3.030 -2.603 1.00 0.00 O ATOM 1011 CB VAL A 319 5.080 -5.960 -1.662 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.282 -7.447 -1.416 1.00 0.00 C ATOM 1013 CG2 VAL A 319 5.094 -5.188 -0.352 1.00 0.00 C ATOM 0 H VAL A 319 7.752 -4.589 -1.536 1.00 0.00 H new ATOM 0 HA VAL A 319 6.203 -6.056 -3.502 1.00 0.00 H new ATOM 0 HB VAL A 319 4.104 -5.822 -2.128 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.511 -7.812 -0.738 1.00 0.00 H new ATOM 0 HG12 VAL A 319 5.217 -7.984 -2.362 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.263 -7.612 -0.972 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.325 -5.584 0.312 1.00 0.00 H new ATOM 0 HG22 VAL A 319 6.071 -5.292 0.121 1.00 0.00 H new ATOM 0 HG23 VAL A 319 4.896 -4.134 -0.549 1.00 0.00 H new ATOM 1023 N LYS A 320 4.770 -3.889 -3.886 1.00 0.00 N ATOM 1024 CA LYS A 320 4.311 -2.590 -4.364 1.00 0.00 C ATOM 1025 C LYS A 320 2.942 -2.249 -3.785 1.00 0.00 C ATOM 1026 O LYS A 320 2.060 -3.105 -3.703 1.00 0.00 O ATOM 1027 CB LYS A 320 4.246 -2.581 -5.893 1.00 0.00 C ATOM 1028 CG LYS A 320 5.564 -2.934 -6.560 1.00 0.00 C ATOM 1029 CD LYS A 320 5.562 -2.558 -8.032 1.00 0.00 C ATOM 1030 CE LYS A 320 6.069 -1.140 -8.247 1.00 0.00 C ATOM 1031 NZ LYS A 320 7.544 -1.103 -8.448 1.00 0.00 N ATOM 0 H LYS A 320 4.248 -4.683 -4.257 1.00 0.00 H new ATOM 0 HA LYS A 320 5.024 -1.836 -4.031 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.482 -3.287 -6.220 1.00 0.00 H new ATOM 0 HB3 LYS A 320 3.932 -1.593 -6.229 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.379 -2.418 -6.053 1.00 0.00 H new ATOM 0 HG3 LYS A 320 5.750 -4.003 -6.457 1.00 0.00 H new ATOM 0 HD2 LYS A 320 6.187 -3.257 -8.588 1.00 0.00 H new ATOM 0 HD3 LYS A 320 4.551 -2.648 -8.430 1.00 0.00 H new ATOM 0 HE2 LYS A 320 5.573 -0.705 -9.115 1.00 0.00 H new ATOM 0 HE3 LYS A 320 5.804 -0.525 -7.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 7.831 -0.147 -8.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 8.022 -1.350 -7.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 7.811 -1.786 -9.186 1.00 0.00 H new ATOM 1045 N VAL A 321 2.770 -0.994 -3.384 1.00 0.00 N ATOM 1046 CA VAL A 321 1.507 -0.539 -2.814 1.00 0.00 C ATOM 1047 C VAL A 321 1.130 0.840 -3.344 1.00 0.00 C ATOM 1048 O VAL A 321 1.989 1.604 -3.784 1.00 0.00 O ATOM 1049 CB VAL A 321 1.572 -0.486 -1.276 1.00 0.00 C ATOM 1050 CG1 VAL A 321 1.775 -1.880 -0.702 1.00 0.00 C ATOM 1051 CG2 VAL A 321 2.679 0.453 -0.822 1.00 0.00 C ATOM 0 H VAL A 321 3.490 -0.273 -3.443 1.00 0.00 H new ATOM 0 HA VAL A 321 0.747 -1.260 -3.113 1.00 0.00 H new ATOM 0 HB VAL A 321 0.624 -0.100 -0.902 1.00 0.00 H new ATOM 0 HG11 VAL A 321 1.819 -1.823 0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 321 0.944 -2.520 -0.999 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.708 -2.297 -1.081 1.00 0.00 H new ATOM 0 HG21 VAL A 321 2.711 0.478 0.267 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.636 0.099 -1.205 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.485 1.456 -1.203 1.00 0.00 H new ATOM 1061 N LYS A 322 -0.160 1.153 -3.298 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.653 2.441 -3.771 1.00 0.00 C ATOM 1063 C LYS A 322 -1.183 3.279 -2.612 1.00 0.00 C ATOM 1064 O LYS A 322 -1.860 2.767 -1.721 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.756 2.237 -4.813 1.00 0.00 C ATOM 1066 CG LYS A 322 -2.471 3.519 -5.200 1.00 0.00 C ATOM 1067 CD LYS A 322 -3.821 3.234 -5.838 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.704 3.086 -7.347 1.00 0.00 C ATOM 1069 NZ LYS A 322 -3.846 4.393 -8.046 1.00 0.00 N ATOM 0 H LYS A 322 -0.884 0.532 -2.937 1.00 0.00 H new ATOM 0 HA LYS A 322 0.179 2.974 -4.231 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -1.322 1.789 -5.707 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.486 1.527 -4.423 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -2.610 4.141 -4.315 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -1.852 4.087 -5.895 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -4.240 2.322 -5.413 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -4.514 4.042 -5.603 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -2.738 2.645 -7.595 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -4.470 2.398 -7.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -4.115 4.229 -9.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -4.581 4.960 -7.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -2.941 4.904 -8.013 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.871 4.572 -2.632 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.318 5.482 -1.584 1.00 0.00 C ATOM 1085 C VAL A 323 -2.790 5.840 -1.759 1.00 0.00 C ATOM 1086 O VAL A 323 -3.140 6.693 -2.576 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.484 6.776 -1.572 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -1.008 7.740 -0.518 1.00 0.00 C ATOM 1089 CG2 VAL A 323 0.985 6.461 -1.334 1.00 0.00 C ATOM 0 H VAL A 323 -0.311 5.012 -3.362 1.00 0.00 H new ATOM 0 HA VAL A 323 -1.184 4.963 -0.635 1.00 0.00 H new ATOM 0 HB VAL A 323 -0.576 7.255 -2.547 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.406 8.649 -0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -2.046 7.991 -0.738 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -0.948 7.272 0.465 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.560 7.387 -1.329 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.098 5.958 -0.374 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.351 5.811 -2.129 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.648 5.184 -0.986 1.00 0.00 N ATOM 1100 CA LEU A 324 -5.084 5.434 -1.054 1.00 0.00 C ATOM 1101 C LEU A 324 -5.426 6.806 -0.482 1.00 0.00 C ATOM 1102 O LEU A 324 -6.126 7.597 -1.115 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.847 4.348 -0.294 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.801 2.945 -0.902 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -6.583 1.965 -0.041 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -6.343 2.961 -2.323 1.00 0.00 C ATOM 0 H LEU A 324 -3.375 4.475 -0.305 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.382 5.413 -2.102 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -5.451 4.296 0.720 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.890 4.653 -0.214 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.762 2.618 -0.936 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -6.539 0.972 -0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -6.149 1.932 0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -7.622 2.288 0.025 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -6.302 1.954 -2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -7.376 3.309 -2.315 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -5.740 3.631 -2.935 1.00 0.00 H new ATOM 1118 N SER A 325 -4.925 7.083 0.717 1.00 0.00 N ATOM 1119 CA SER A 325 -5.179 8.359 1.375 1.00 0.00 C ATOM 1120 C SER A 325 -4.134 8.632 2.454 1.00 0.00 C ATOM 1121 O SER A 325 -3.878 7.788 3.313 1.00 0.00 O ATOM 1122 CB SER A 325 -6.579 8.370 1.992 1.00 0.00 C ATOM 1123 OG SER A 325 -7.087 9.690 2.080 1.00 0.00 O ATOM 0 H SER A 325 -4.341 6.441 1.253 1.00 0.00 H new ATOM 0 HA SER A 325 -5.115 9.146 0.623 1.00 0.00 H new ATOM 0 HB2 SER A 325 -7.250 7.758 1.389 1.00 0.00 H new ATOM 0 HB3 SER A 325 -6.546 7.923 2.985 1.00 0.00 H new ATOM 0 HG SER A 325 -7.983 9.670 2.476 1.00 0.00 H new ATOM 1129 N PHE A 326 -3.534 9.816 2.401 1.00 0.00 N ATOM 1130 CA PHE A 326 -2.516 10.201 3.372 1.00 0.00 C ATOM 1131 C PHE A 326 -3.044 11.278 4.316 1.00 0.00 C ATOM 1132 O PHE A 326 -3.413 12.371 3.885 1.00 0.00 O ATOM 1133 CB PHE A 326 -1.262 10.705 2.655 1.00 0.00 C ATOM 1134 CG PHE A 326 -0.357 11.520 3.533 1.00 0.00 C ATOM 1135 CD1 PHE A 326 0.193 10.974 4.682 1.00 0.00 C ATOM 1136 CD2 PHE A 326 -0.055 12.834 3.211 1.00 0.00 C ATOM 1137 CE1 PHE A 326 1.027 11.721 5.492 1.00 0.00 C ATOM 1138 CE2 PHE A 326 0.778 13.586 4.016 1.00 0.00 C ATOM 1139 CZ PHE A 326 1.319 13.030 5.159 1.00 0.00 C ATOM 0 H PHE A 326 -3.735 10.526 1.696 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.260 9.320 3.961 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -0.707 9.851 2.268 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -1.561 11.307 1.797 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -0.033 9.952 4.948 1.00 0.00 H new ATOM 0 HD2 PHE A 326 -0.476 13.275 2.320 1.00 0.00 H new ATOM 0 HE1 PHE A 326 1.450 11.283 6.384 1.00 0.00 H new ATOM 0 HE2 PHE A 326 1.006 14.608 3.752 1.00 0.00 H new ATOM 0 HZ PHE A 326 1.969 13.617 5.791 1.00 0.00 H new ATOM 1149 N THR A 327 -3.078 10.961 5.606 1.00 0.00 N ATOM 1150 CA THR A 327 -3.561 11.900 6.611 1.00 0.00 C ATOM 1151 C THR A 327 -2.752 11.792 7.899 1.00 0.00 C ATOM 1152 O THR A 327 -2.854 10.806 8.627 1.00 0.00 O ATOM 1153 CB THR A 327 -5.049 11.662 6.932 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.476 12.555 7.967 1.00 0.00 O ATOM 1155 CG2 THR A 327 -5.286 10.223 7.367 1.00 0.00 C ATOM 0 H THR A 327 -2.777 10.061 5.980 1.00 0.00 H new ATOM 0 HA THR A 327 -3.442 12.900 6.193 1.00 0.00 H new ATOM 0 HB THR A 327 -5.627 11.851 6.028 1.00 0.00 H new ATOM 0 HG1 THR A 327 -6.423 12.398 8.164 1.00 0.00 H new ATOM 0 HG21 THR A 327 -6.344 10.079 7.588 1.00 0.00 H new ATOM 0 HG22 THR A 327 -4.988 9.547 6.566 1.00 0.00 H new ATOM 0 HG23 THR A 327 -4.697 10.011 8.259 1.00 0.00 H new ATOM 1163 N GLY A 328 -1.947 12.814 8.174 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.132 12.814 9.375 1.00 0.00 C ATOM 1165 C GLY A 328 -0.262 11.577 9.485 1.00 0.00 C ATOM 1166 O GLY A 328 0.355 11.153 8.508 1.00 0.00 O ATOM 0 H GLY A 328 -1.845 13.642 7.587 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -0.499 13.701 9.381 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -1.779 12.878 10.250 1.00 0.00 H new ATOM 1170 N THR A 329 -0.211 10.997 10.680 1.00 0.00 N ATOM 1171 CA THR A 329 0.592 9.804 10.916 1.00 0.00 C ATOM 1172 C THR A 329 -0.079 8.565 10.333 1.00 0.00 C ATOM 1173 O THR A 329 0.521 7.492 10.271 1.00 0.00 O ATOM 1174 CB THR A 329 0.838 9.580 12.420 1.00 0.00 C ATOM 1175 OG1 THR A 329 -0.411 9.428 13.104 1.00 0.00 O ATOM 1176 CG2 THR A 329 1.612 10.744 13.021 1.00 0.00 C ATOM 0 H THR A 329 -0.716 11.334 11.499 1.00 0.00 H new ATOM 0 HA THR A 329 1.549 9.964 10.419 1.00 0.00 H new ATOM 0 HB THR A 329 1.429 8.672 12.537 1.00 0.00 H new ATOM 0 HG1 THR A 329 -0.246 9.284 14.059 1.00 0.00 H new ATOM 0 HG21 THR A 329 1.774 10.563 14.084 1.00 0.00 H new ATOM 0 HG22 THR A 329 2.575 10.839 12.518 1.00 0.00 H new ATOM 0 HG23 THR A 329 1.043 11.665 12.892 1.00 0.00 H new ATOM 1184 N LYS A 330 -1.328 8.720 9.906 1.00 0.00 N ATOM 1185 CA LYS A 330 -2.081 7.615 9.326 1.00 0.00 C ATOM 1186 C LYS A 330 -1.945 7.603 7.806 1.00 0.00 C ATOM 1187 O LYS A 330 -2.253 8.589 7.136 1.00 0.00 O ATOM 1188 CB LYS A 330 -3.558 7.718 9.715 1.00 0.00 C ATOM 1189 CG LYS A 330 -4.402 6.563 9.205 1.00 0.00 C ATOM 1190 CD LYS A 330 -5.853 6.974 9.016 1.00 0.00 C ATOM 1191 CE LYS A 330 -6.663 5.872 8.351 1.00 0.00 C ATOM 1192 NZ LYS A 330 -7.978 6.368 7.861 1.00 0.00 N ATOM 0 H LYS A 330 -1.840 9.601 9.951 1.00 0.00 H new ATOM 0 HA LYS A 330 -1.672 6.684 9.718 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -3.637 7.763 10.801 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -3.963 8.653 9.327 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -3.998 6.206 8.258 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -4.347 5.732 9.909 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -6.292 7.216 9.984 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -5.900 7.878 8.409 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -6.097 5.459 7.516 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -6.823 5.060 9.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -8.499 5.587 7.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -8.529 6.739 8.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -7.826 7.125 7.165 1.00 0.00 H new ATOM 1206 N THR A 331 -1.482 6.479 7.268 1.00 0.00 N ATOM 1207 CA THR A 331 -1.305 6.338 5.828 1.00 0.00 C ATOM 1208 C THR A 331 -1.831 4.993 5.339 1.00 0.00 C ATOM 1209 O THR A 331 -1.431 3.941 5.837 1.00 0.00 O ATOM 1210 CB THR A 331 0.176 6.473 5.428 1.00 0.00 C ATOM 1211 OG1 THR A 331 0.756 7.612 6.074 1.00 0.00 O ATOM 1212 CG2 THR A 331 0.319 6.612 3.920 1.00 0.00 C ATOM 0 H THR A 331 -1.223 5.653 7.808 1.00 0.00 H new ATOM 0 HA THR A 331 -1.875 7.140 5.359 1.00 0.00 H new ATOM 0 HB THR A 331 0.699 5.570 5.745 1.00 0.00 H new ATOM 0 HG1 THR A 331 1.698 7.690 5.816 1.00 0.00 H new ATOM 0 HG21 THR A 331 1.374 6.706 3.662 1.00 0.00 H new ATOM 0 HG22 THR A 331 -0.097 5.730 3.432 1.00 0.00 H new ATOM 0 HG23 THR A 331 -0.217 7.499 3.584 1.00 0.00 H new ATOM 1220 N SER A 332 -2.729 5.035 4.360 1.00 0.00 N ATOM 1221 CA SER A 332 -3.312 3.819 3.805 1.00 0.00 C ATOM 1222 C SER A 332 -2.463 3.284 2.656 1.00 0.00 C ATOM 1223 O SER A 332 -1.776 4.044 1.970 1.00 0.00 O ATOM 1224 CB SER A 332 -4.738 4.087 3.319 1.00 0.00 C ATOM 1225 OG SER A 332 -5.664 4.010 4.388 1.00 0.00 O ATOM 0 H SER A 332 -3.069 5.898 3.935 1.00 0.00 H new ATOM 0 HA SER A 332 -3.340 3.067 4.594 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.789 5.074 2.860 1.00 0.00 H new ATOM 0 HB3 SER A 332 -5.005 3.363 2.549 1.00 0.00 H new ATOM 0 HG SER A 332 -6.567 4.187 4.052 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.515 1.973 2.450 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.751 1.335 1.384 1.00 0.00 C ATOM 1233 C LEU A 333 -2.480 0.105 0.853 1.00 0.00 C ATOM 1234 O LEU A 333 -2.941 -0.737 1.623 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.362 0.940 1.890 1.00 0.00 C ATOM 1236 CG LEU A 333 0.541 2.090 2.338 1.00 0.00 C ATOM 1237 CD1 LEU A 333 1.804 1.553 2.993 1.00 0.00 C ATOM 1238 CD2 LEU A 333 0.889 2.986 1.158 1.00 0.00 C ATOM 0 H LEU A 333 -3.078 1.331 3.007 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.644 2.051 0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.484 0.253 2.727 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.148 0.391 1.099 1.00 0.00 H new ATOM 0 HG LEU A 333 0.000 2.686 3.073 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.434 2.386 3.305 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.536 0.954 3.864 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.348 0.933 2.280 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.532 3.799 1.496 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.410 2.402 0.399 1.00 0.00 H new ATOM 0 HD23 LEU A 333 -0.026 3.400 0.733 1.00 0.00 H new ATOM 1250 N SER A 334 -2.577 0.006 -0.469 1.00 0.00 N ATOM 1251 CA SER A 334 -3.251 -1.121 -1.104 1.00 0.00 C ATOM 1252 C SER A 334 -2.255 -1.995 -1.859 1.00 0.00 C ATOM 1253 O SER A 334 -1.380 -1.491 -2.564 1.00 0.00 O ATOM 1254 CB SER A 334 -4.336 -0.621 -2.060 1.00 0.00 C ATOM 1255 OG SER A 334 -3.772 0.121 -3.128 1.00 0.00 O ATOM 0 H SER A 334 -2.198 0.692 -1.121 1.00 0.00 H new ATOM 0 HA SER A 334 -3.715 -1.722 -0.322 1.00 0.00 H new ATOM 0 HB2 SER A 334 -4.894 -1.469 -2.457 1.00 0.00 H new ATOM 0 HB3 SER A 334 -5.046 0.001 -1.516 1.00 0.00 H new ATOM 0 HG SER A 334 -4.462 0.685 -3.535 1.00 0.00 H new ATOM 1261 N MET A 335 -2.394 -3.307 -1.706 1.00 0.00 N ATOM 1262 CA MET A 335 -1.507 -4.252 -2.375 1.00 0.00 C ATOM 1263 C MET A 335 -2.209 -4.917 -3.555 1.00 0.00 C ATOM 1264 O MET A 335 -1.631 -5.065 -4.631 1.00 0.00 O ATOM 1265 CB MET A 335 -1.025 -5.318 -1.388 1.00 0.00 C ATOM 1266 CG MET A 335 0.116 -4.851 -0.499 1.00 0.00 C ATOM 1267 SD MET A 335 0.801 -6.180 0.509 1.00 0.00 S ATOM 1268 CE MET A 335 1.440 -7.271 -0.760 1.00 0.00 C ATOM 0 H MET A 335 -3.112 -3.740 -1.125 1.00 0.00 H new ATOM 0 HA MET A 335 -0.647 -3.699 -2.752 1.00 0.00 H new ATOM 0 HB2 MET A 335 -1.862 -5.625 -0.760 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.704 -6.198 -1.945 1.00 0.00 H new ATOM 0 HG2 MET A 335 0.905 -4.428 -1.120 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.240 -4.053 0.152 1.00 0.00 H new ATOM 0 HE1 MET A 335 2.186 -7.937 -0.326 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.624 -7.862 -1.176 1.00 0.00 H new ATOM 0 HE3 MET A 335 1.899 -6.679 -1.551 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.459 -5.315 -3.345 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.242 -5.963 -4.391 1.00 0.00 C ATOM 1280 C LYS A 336 -4.547 -4.989 -5.525 1.00 0.00 C ATOM 1281 O LYS A 336 -4.716 -5.394 -6.675 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.548 -6.513 -3.813 1.00 0.00 C ATOM 1283 CG LYS A 336 -6.455 -5.442 -3.233 1.00 0.00 C ATOM 1284 CD LYS A 336 -7.864 -5.966 -3.009 1.00 0.00 C ATOM 1285 CE LYS A 336 -8.789 -4.875 -2.490 1.00 0.00 C ATOM 1286 NZ LYS A 336 -10.174 -5.378 -2.275 1.00 0.00 N ATOM 0 H LYS A 336 -3.952 -5.200 -2.459 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.653 -6.788 -4.792 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -6.086 -7.047 -4.596 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.314 -7.239 -3.035 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.043 -5.088 -2.288 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -6.487 -4.586 -3.908 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -8.258 -6.364 -3.944 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -7.838 -6.791 -2.297 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -8.396 -4.481 -1.553 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -8.809 -4.048 -3.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -10.773 -4.605 -1.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -10.559 -5.731 -3.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -10.159 -6.150 -1.579 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.613 -3.704 -5.193 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.894 -2.672 -6.184 1.00 0.00 C ATOM 1302 C ASP A 337 -3.608 -2.196 -6.853 1.00 0.00 C ATOM 1303 O ASP A 337 -3.580 -1.142 -7.488 1.00 0.00 O ATOM 1304 CB ASP A 337 -5.612 -1.490 -5.531 1.00 0.00 C ATOM 1305 CG ASP A 337 -7.041 -1.820 -5.149 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -7.628 -2.728 -5.774 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -7.572 -1.171 -4.224 1.00 0.00 O ATOM 0 H ASP A 337 -4.476 -3.353 -4.245 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.541 -3.103 -6.948 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -5.063 -1.182 -4.641 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -5.609 -0.643 -6.217 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.545 -2.980 -6.705 1.00 0.00 N ATOM 1313 CA VAL A 338 -1.255 -2.639 -7.294 1.00 0.00 C ATOM 1314 C VAL A 338 -0.633 -3.844 -7.989 1.00 0.00 C ATOM 1315 O VAL A 338 -0.552 -4.931 -7.415 1.00 0.00 O ATOM 1316 CB VAL A 338 -0.275 -2.109 -6.231 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.122 -1.965 -6.817 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.765 -0.784 -5.668 1.00 0.00 C ATOM 0 H VAL A 338 -2.551 -3.856 -6.182 1.00 0.00 H new ATOM 0 HA VAL A 338 -1.439 -1.855 -8.029 1.00 0.00 H new ATOM 0 HB VAL A 338 -0.228 -2.829 -5.414 1.00 0.00 H new ATOM 0 HG11 VAL A 338 1.801 -1.589 -6.051 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.472 -2.936 -7.167 1.00 0.00 H new ATOM 0 HG13 VAL A 338 1.096 -1.266 -7.653 1.00 0.00 H new ATOM 0 HG21 VAL A 338 -0.060 -0.424 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.843 -0.053 -6.473 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.744 -0.923 -5.209 1.00 0.00 H new ATOM 1328 N ASP A 339 -0.193 -3.645 -9.226 1.00 0.00 N ATOM 1329 CA ASP A 339 0.425 -4.716 -10.000 1.00 0.00 C ATOM 1330 C ASP A 339 1.895 -4.877 -9.627 1.00 0.00 C ATOM 1331 O ASP A 339 2.663 -3.916 -9.665 1.00 0.00 O ATOM 1332 CB ASP A 339 0.294 -4.433 -11.497 1.00 0.00 C ATOM 1333 CG ASP A 339 0.272 -5.703 -12.326 1.00 0.00 C ATOM 1334 OD1 ASP A 339 -0.130 -6.756 -11.789 1.00 0.00 O ATOM 1335 OD2 ASP A 339 0.657 -5.642 -13.513 1.00 0.00 O ATOM 0 H ASP A 339 -0.253 -2.752 -9.715 1.00 0.00 H new ATOM 0 HA ASP A 339 -0.094 -5.646 -9.767 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -0.620 -3.868 -11.678 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.125 -3.806 -11.820 1.00 0.00 H new ATOM 1340 N GLN A 340 2.279 -6.097 -9.266 1.00 0.00 N ATOM 1341 CA GLN A 340 3.657 -6.383 -8.885 1.00 0.00 C ATOM 1342 C GLN A 340 4.530 -6.595 -10.117 1.00 0.00 C ATOM 1343 O GLN A 340 5.682 -7.013 -10.008 1.00 0.00 O ATOM 1344 CB GLN A 340 3.714 -7.619 -7.986 1.00 0.00 C ATOM 1345 CG GLN A 340 2.947 -7.459 -6.683 1.00 0.00 C ATOM 1346 CD GLN A 340 3.320 -6.193 -5.938 1.00 0.00 C ATOM 1347 OE1 GLN A 340 4.471 -5.756 -5.969 1.00 0.00 O ATOM 1348 NE2 GLN A 340 2.346 -5.595 -5.262 1.00 0.00 N ATOM 0 H GLN A 340 1.655 -6.903 -9.229 1.00 0.00 H new ATOM 0 HA GLN A 340 4.040 -5.524 -8.334 1.00 0.00 H new ATOM 0 HB2 GLN A 340 3.313 -8.474 -8.531 1.00 0.00 H new ATOM 0 HB3 GLN A 340 4.756 -7.846 -7.759 1.00 0.00 H new ATOM 0 HG2 GLN A 340 1.878 -7.450 -6.894 1.00 0.00 H new ATOM 0 HG3 GLN A 340 3.139 -8.322 -6.045 1.00 0.00 H new ATOM 0 HE21 GLN A 340 1.406 -5.992 -5.263 1.00 0.00 H new ATOM 0 HE22 GLN A 340 2.538 -4.739 -4.741 1.00 0.00 H new ATOM 1357 N GLU A 341 3.973 -6.304 -11.289 1.00 0.00 N ATOM 1358 CA GLU A 341 4.702 -6.465 -12.541 1.00 0.00 C ATOM 1359 C GLU A 341 5.253 -5.127 -13.026 1.00 0.00 C ATOM 1360 O GLU A 341 6.437 -5.007 -13.343 1.00 0.00 O ATOM 1361 CB GLU A 341 3.793 -7.072 -13.612 1.00 0.00 C ATOM 1362 CG GLU A 341 4.526 -7.460 -14.885 1.00 0.00 C ATOM 1363 CD GLU A 341 5.307 -8.751 -14.739 1.00 0.00 C ATOM 1364 OE1 GLU A 341 6.042 -8.891 -13.739 1.00 0.00 O ATOM 1365 OE2 GLU A 341 5.182 -9.623 -15.624 1.00 0.00 O ATOM 0 H GLU A 341 3.020 -5.956 -11.397 1.00 0.00 H new ATOM 0 HA GLU A 341 5.539 -7.139 -12.360 1.00 0.00 H new ATOM 0 HB2 GLU A 341 3.302 -7.955 -13.202 1.00 0.00 H new ATOM 0 HB3 GLU A 341 3.008 -6.357 -13.858 1.00 0.00 H new ATOM 0 HG2 GLU A 341 3.806 -7.565 -15.696 1.00 0.00 H new ATOM 0 HG3 GLU A 341 5.208 -6.657 -15.166 1.00 0.00 H new ATOM 1372 N THR A 342 4.385 -4.121 -13.082 1.00 0.00 N ATOM 1373 CA THR A 342 4.782 -2.793 -13.529 1.00 0.00 C ATOM 1374 C THR A 342 4.426 -1.734 -12.492 1.00 0.00 C ATOM 1375 O THR A 342 5.003 -0.647 -12.476 1.00 0.00 O ATOM 1376 CB THR A 342 4.114 -2.428 -14.868 1.00 0.00 C ATOM 1377 OG1 THR A 342 2.701 -2.285 -14.688 1.00 0.00 O ATOM 1378 CG2 THR A 342 4.392 -3.492 -15.919 1.00 0.00 C ATOM 0 H THR A 342 3.402 -4.202 -12.823 1.00 0.00 H new ATOM 0 HA THR A 342 5.863 -2.816 -13.665 1.00 0.00 H new ATOM 0 HB THR A 342 4.533 -1.482 -15.212 1.00 0.00 H new ATOM 0 HG1 THR A 342 2.287 -2.027 -15.538 1.00 0.00 H new ATOM 0 HG21 THR A 342 3.910 -3.213 -16.856 1.00 0.00 H new ATOM 0 HG22 THR A 342 5.467 -3.577 -16.075 1.00 0.00 H new ATOM 0 HG23 THR A 342 3.998 -4.450 -15.580 1.00 0.00 H new ATOM 1386 N GLY A 343 3.471 -2.059 -11.625 1.00 0.00 N ATOM 1387 CA GLY A 343 3.055 -1.124 -10.595 1.00 0.00 C ATOM 1388 C GLY A 343 1.990 -0.162 -11.081 1.00 0.00 C ATOM 1389 O GLY A 343 1.916 0.976 -10.619 1.00 0.00 O ATOM 0 H GLY A 343 2.978 -2.952 -11.618 1.00 0.00 H new ATOM 0 HA2 GLY A 343 2.675 -1.679 -9.737 1.00 0.00 H new ATOM 0 HA3 GLY A 343 3.921 -0.559 -10.251 1.00 0.00 H new ATOM 1393 N GLU A 344 1.165 -0.619 -12.018 1.00 0.00 N ATOM 1394 CA GLU A 344 0.101 0.212 -12.569 1.00 0.00 C ATOM 1395 C GLU A 344 -1.044 0.362 -11.571 1.00 0.00 C ATOM 1396 O GLU A 344 -1.026 -0.236 -10.495 1.00 0.00 O ATOM 1397 CB GLU A 344 -0.422 -0.389 -13.875 1.00 0.00 C ATOM 1398 CG GLU A 344 0.315 0.103 -15.110 1.00 0.00 C ATOM 1399 CD GLU A 344 0.166 -0.836 -16.291 1.00 0.00 C ATOM 1400 OE1 GLU A 344 -0.983 -1.079 -16.716 1.00 0.00 O ATOM 1401 OE2 GLU A 344 1.200 -1.327 -16.791 1.00 0.00 O ATOM 0 H GLU A 344 1.213 -1.559 -12.411 1.00 0.00 H new ATOM 0 HA GLU A 344 0.515 1.200 -12.772 1.00 0.00 H new ATOM 0 HB2 GLU A 344 -0.342 -1.475 -13.823 1.00 0.00 H new ATOM 0 HB3 GLU A 344 -1.481 -0.152 -13.976 1.00 0.00 H new ATOM 0 HG2 GLU A 344 -0.061 1.088 -15.384 1.00 0.00 H new ATOM 0 HG3 GLU A 344 1.373 0.220 -14.875 1.00 0.00 H new ATOM 1408 N ASP A 345 -2.038 1.164 -11.937 1.00 0.00 N ATOM 1409 CA ASP A 345 -3.192 1.393 -11.075 1.00 0.00 C ATOM 1410 C ASP A 345 -4.332 0.443 -11.429 1.00 0.00 C ATOM 1411 O ASP A 345 -5.112 0.707 -12.346 1.00 0.00 O ATOM 1412 CB ASP A 345 -3.664 2.843 -11.193 1.00 0.00 C ATOM 1413 CG ASP A 345 -5.145 2.995 -10.903 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -5.651 2.279 -10.014 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -5.797 3.829 -11.566 1.00 0.00 O ATOM 0 H ASP A 345 -2.068 1.666 -12.824 1.00 0.00 H new ATOM 0 HA ASP A 345 -2.889 1.201 -10.046 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -3.096 3.465 -10.501 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -3.454 3.210 -12.198 1.00 0.00 H new