USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=22 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 298 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 336 LYS NZ :NH3+ 157:sc= 1.44 (180deg=0.357) USER MOD Set 2.1: A 274 SER OG : rot 160:sc= 0 USER MOD Set 2.2: A 276 MET CE :methyl -135:sc= -2.09 (180deg=-5.88!) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 TYR OH : rot 180:sc= 0 USER MOD Single : A 269 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 271 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 273 THR OG1 : rot 180:sc= 0 USER MOD Single : A 277 GLN : amide:sc= 0 X(o=0,f=-0.003) USER MOD Single : A 280 CYS SG : rot 140:sc= -1.19 USER MOD Single : A 283 GLN :FLIP amide:sc= 1.15 F(o=-0.22,f=1.2) USER MOD Single : A 289 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 HIS : no HD1:sc= -1.56 K(o=-1.6,f=-2.1) USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ 165:sc=-0.00439 (180deg=-0.157) USER MOD Single : A 317 GLN : amide:sc= -0.447 X(o=-0.45,f=-0.4) USER MOD Single : A 320 LYS NZ :NH3+ -118:sc= -0.0856 (180deg=-3.63!) USER MOD Single : A 322 LYS NZ :NH3+ 170:sc= -0.208 (180deg=-0.59!) USER MOD Single : A 325 SER OG : rot 180:sc= -0.0888 USER MOD Single : A 327 THR OG1 : rot -18:sc= 0.409 USER MOD Single : A 329 THR OG1 : rot -57:sc= 1.17 USER MOD Single : A 330 LYS NZ :NH3+ -157:sc= -0.0911 (180deg=-0.531) USER MOD Single : A 331 THR OG1 : rot 153:sc= 0.93 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 SER OG : rot 160:sc= 0 USER MOD Single : A 335 MET CE :methyl 155:sc= -0.249 (180deg=-1.01) USER MOD Single : A 340 GLN : amide:sc= 1.47 K(o=1.5,f=-5.5!) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.781 14.726 -0.904 1.00 0.00 N ATOM 67 CA GLU A 260 8.705 14.919 0.539 1.00 0.00 C ATOM 68 C GLU A 260 7.679 13.976 1.160 1.00 0.00 C ATOM 69 O GLU A 260 7.999 13.199 2.059 1.00 0.00 O ATOM 70 CB GLU A 260 8.343 16.369 0.864 1.00 0.00 C ATOM 71 CG GLU A 260 7.031 16.822 0.248 1.00 0.00 C ATOM 72 CD GLU A 260 6.964 18.325 0.056 1.00 0.00 C ATOM 73 OE1 GLU A 260 7.097 19.058 1.058 1.00 0.00 O ATOM 74 OE2 GLU A 260 6.779 18.768 -1.097 1.00 0.00 O ATOM 0 HA GLU A 260 9.684 14.693 0.962 1.00 0.00 H new ATOM 0 HB2 GLU A 260 8.286 16.486 1.946 1.00 0.00 H new ATOM 0 HB3 GLU A 260 9.143 17.021 0.514 1.00 0.00 H new ATOM 0 HG2 GLU A 260 6.898 16.330 -0.716 1.00 0.00 H new ATOM 0 HG3 GLU A 260 6.206 16.504 0.885 1.00 0.00 H new ATOM 81 N GLU A 261 6.444 14.051 0.674 1.00 0.00 N ATOM 82 CA GLU A 261 5.370 13.206 1.183 1.00 0.00 C ATOM 83 C GLU A 261 4.685 12.453 0.045 1.00 0.00 C ATOM 84 O GLU A 261 4.656 12.902 -1.101 1.00 0.00 O ATOM 85 CB GLU A 261 4.344 14.048 1.943 1.00 0.00 C ATOM 86 CG GLU A 261 4.956 14.930 3.018 1.00 0.00 C ATOM 87 CD GLU A 261 5.584 14.128 4.142 1.00 0.00 C ATOM 88 OE1 GLU A 261 6.407 13.237 3.846 1.00 0.00 O ATOM 89 OE2 GLU A 261 5.252 14.392 5.316 1.00 0.00 O ATOM 0 H GLU A 261 6.162 14.688 -0.071 1.00 0.00 H new ATOM 0 HA GLU A 261 5.808 12.478 1.866 1.00 0.00 H new ATOM 0 HB2 GLU A 261 3.805 14.676 1.234 1.00 0.00 H new ATOM 0 HB3 GLU A 261 3.611 13.385 2.403 1.00 0.00 H new ATOM 0 HG2 GLU A 261 5.713 15.573 2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 261 4.186 15.583 3.429 1.00 0.00 H new ATOM 96 N PRO A 262 4.120 11.280 0.368 1.00 0.00 N ATOM 97 CA PRO A 262 3.424 10.440 -0.611 1.00 0.00 C ATOM 98 C PRO A 262 2.109 11.058 -1.075 1.00 0.00 C ATOM 99 O PRO A 262 1.465 11.802 -0.334 1.00 0.00 O ATOM 100 CB PRO A 262 3.164 9.142 0.156 1.00 0.00 C ATOM 101 CG PRO A 262 3.140 9.547 1.589 1.00 0.00 C ATOM 102 CD PRO A 262 4.116 10.684 1.715 1.00 0.00 C ATOM 0 HA PRO A 262 4.010 10.304 -1.520 1.00 0.00 H new ATOM 0 HB2 PRO A 262 2.219 8.688 -0.143 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.945 8.406 -0.034 1.00 0.00 H new ATOM 0 HG2 PRO A 262 2.139 9.857 1.890 1.00 0.00 H new ATOM 0 HG3 PRO A 262 3.424 8.716 2.234 1.00 0.00 H new ATOM 0 HD2 PRO A 262 3.801 11.403 2.472 1.00 0.00 H new ATOM 0 HD3 PRO A 262 5.107 10.333 2.002 1.00 0.00 H new ATOM 110 N THR A 263 1.715 10.745 -2.305 1.00 0.00 N ATOM 111 CA THR A 263 0.477 11.270 -2.868 1.00 0.00 C ATOM 112 C THR A 263 -0.583 10.180 -2.977 1.00 0.00 C ATOM 113 O THR A 263 -0.261 9.002 -3.135 1.00 0.00 O ATOM 114 CB THR A 263 0.709 11.885 -4.261 1.00 0.00 C ATOM 115 OG1 THR A 263 1.498 13.075 -4.146 1.00 0.00 O ATOM 116 CG2 THR A 263 -0.614 12.211 -4.936 1.00 0.00 C ATOM 0 H THR A 263 2.235 10.130 -2.931 1.00 0.00 H new ATOM 0 HA THR A 263 0.127 12.048 -2.189 1.00 0.00 H new ATOM 0 HB THR A 263 1.240 11.155 -4.872 1.00 0.00 H new ATOM 0 HG1 THR A 263 1.642 13.459 -5.036 1.00 0.00 H new ATOM 0 HG21 THR A 263 -0.424 12.644 -5.918 1.00 0.00 H new ATOM 0 HG22 THR A 263 -1.200 11.299 -5.049 1.00 0.00 H new ATOM 0 HG23 THR A 263 -1.168 12.924 -4.326 1.00 0.00 H new ATOM 124 N ILE A 264 -1.847 10.580 -2.891 1.00 0.00 N ATOM 125 CA ILE A 264 -2.954 9.636 -2.981 1.00 0.00 C ATOM 126 C ILE A 264 -3.152 9.157 -4.416 1.00 0.00 C ATOM 127 O ILE A 264 -2.969 9.917 -5.366 1.00 0.00 O ATOM 128 CB ILE A 264 -4.268 10.259 -2.474 1.00 0.00 C ATOM 129 CG1 ILE A 264 -4.164 10.577 -0.981 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.436 9.322 -2.741 1.00 0.00 C ATOM 131 CD1 ILE A 264 -5.248 11.507 -0.484 1.00 0.00 C ATOM 0 H ILE A 264 -2.130 11.551 -2.759 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.697 8.786 -2.348 1.00 0.00 H new ATOM 0 HB ILE A 264 -4.444 11.190 -3.013 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -4.208 9.646 -0.416 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -3.191 11.026 -0.780 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -6.358 9.776 -2.377 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.519 9.141 -3.813 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -5.269 8.376 -2.225 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -5.111 11.688 0.582 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -5.191 12.453 -1.023 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -6.224 11.051 -0.652 1.00 0.00 H new ATOM 143 N GLY A 265 -3.530 7.891 -4.564 1.00 0.00 N ATOM 144 CA GLY A 265 -3.748 7.332 -5.886 1.00 0.00 C ATOM 145 C GLY A 265 -2.461 6.878 -6.544 1.00 0.00 C ATOM 146 O GLY A 265 -2.465 5.957 -7.361 1.00 0.00 O ATOM 0 H GLY A 265 -3.689 7.243 -3.793 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -4.432 6.486 -5.811 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -4.231 8.078 -6.517 1.00 0.00 H new ATOM 150 N ASP A 266 -1.356 7.525 -6.188 1.00 0.00 N ATOM 151 CA ASP A 266 -0.055 7.182 -6.750 1.00 0.00 C ATOM 152 C ASP A 266 0.455 5.864 -6.175 1.00 0.00 C ATOM 153 O ASP A 266 0.129 5.502 -5.044 1.00 0.00 O ATOM 154 CB ASP A 266 0.954 8.298 -6.474 1.00 0.00 C ATOM 155 CG ASP A 266 0.876 9.415 -7.497 1.00 0.00 C ATOM 156 OD1 ASP A 266 -0.240 9.917 -7.742 1.00 0.00 O ATOM 157 OD2 ASP A 266 1.932 9.785 -8.052 1.00 0.00 O ATOM 0 H ASP A 266 -1.336 8.289 -5.513 1.00 0.00 H new ATOM 0 HA ASP A 266 -0.171 7.067 -7.828 1.00 0.00 H new ATOM 0 HB2 ASP A 266 0.776 8.707 -5.479 1.00 0.00 H new ATOM 0 HB3 ASP A 266 1.961 7.881 -6.472 1.00 0.00 H new ATOM 162 N ILE A 267 1.256 5.153 -6.961 1.00 0.00 N ATOM 163 CA ILE A 267 1.811 3.876 -6.529 1.00 0.00 C ATOM 164 C ILE A 267 3.251 4.035 -6.053 1.00 0.00 C ATOM 165 O ILE A 267 4.073 4.659 -6.724 1.00 0.00 O ATOM 166 CB ILE A 267 1.769 2.832 -7.661 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.321 2.520 -8.043 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.497 1.564 -7.240 1.00 0.00 C ATOM 169 CD1 ILE A 267 -0.239 3.447 -9.099 1.00 0.00 C ATOM 0 H ILE A 267 1.535 5.439 -7.899 1.00 0.00 H new ATOM 0 HA ILE A 267 1.193 3.528 -5.701 1.00 0.00 H new ATOM 0 HB ILE A 267 2.274 3.244 -8.534 1.00 0.00 H new ATOM 0 HG12 ILE A 267 0.262 1.493 -8.404 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -0.302 2.580 -7.151 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.458 0.836 -8.050 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.537 1.800 -7.013 1.00 0.00 H new ATOM 0 HG23 ILE A 267 2.018 1.146 -6.354 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -1.269 3.167 -9.320 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -0.213 4.473 -8.733 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.361 3.370 -10.006 1.00 0.00 H new ATOM 181 N TYR A 268 3.550 3.465 -4.891 1.00 0.00 N ATOM 182 CA TYR A 268 4.891 3.544 -4.324 1.00 0.00 C ATOM 183 C TYR A 268 5.428 2.153 -3.999 1.00 0.00 C ATOM 184 O TYR A 268 4.677 1.179 -3.962 1.00 0.00 O ATOM 185 CB TYR A 268 4.884 4.407 -3.061 1.00 0.00 C ATOM 186 CG TYR A 268 4.826 5.891 -3.343 1.00 0.00 C ATOM 187 CD1 TYR A 268 3.621 6.515 -3.643 1.00 0.00 C ATOM 188 CD2 TYR A 268 5.976 6.670 -3.307 1.00 0.00 C ATOM 189 CE1 TYR A 268 3.564 7.871 -3.902 1.00 0.00 C ATOM 190 CE2 TYR A 268 5.928 8.027 -3.563 1.00 0.00 C ATOM 191 CZ TYR A 268 4.720 8.623 -3.861 1.00 0.00 C ATOM 192 OH TYR A 268 4.667 9.974 -4.116 1.00 0.00 O ATOM 0 H TYR A 268 2.882 2.943 -4.323 1.00 0.00 H new ATOM 0 HA TYR A 268 5.545 4.003 -5.066 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.028 4.129 -2.446 1.00 0.00 H new ATOM 0 HB3 TYR A 268 5.780 4.191 -2.478 1.00 0.00 H new ATOM 0 HD1 TYR A 268 2.714 5.930 -3.674 1.00 0.00 H new ATOM 0 HD2 TYR A 268 6.924 6.207 -3.075 1.00 0.00 H new ATOM 0 HE1 TYR A 268 2.619 8.340 -4.135 1.00 0.00 H new ATOM 0 HE2 TYR A 268 6.831 8.618 -3.530 1.00 0.00 H new ATOM 0 HH TYR A 268 5.567 10.356 -4.046 1.00 0.00 H new ATOM 202 N ASN A 269 6.734 2.070 -3.766 1.00 0.00 N ATOM 203 CA ASN A 269 7.373 0.799 -3.444 1.00 0.00 C ATOM 204 C ASN A 269 7.561 0.651 -1.937 1.00 0.00 C ATOM 205 O ASN A 269 7.993 1.582 -1.260 1.00 0.00 O ATOM 206 CB ASN A 269 8.726 0.692 -4.151 1.00 0.00 C ATOM 207 CG ASN A 269 8.677 1.210 -5.575 1.00 0.00 C ATOM 208 OD1 ASN A 269 9.000 2.369 -5.837 1.00 0.00 O ATOM 209 ND2 ASN A 269 8.271 0.352 -6.503 1.00 0.00 N ATOM 0 H ASN A 269 7.370 2.867 -3.794 1.00 0.00 H new ATOM 0 HA ASN A 269 6.724 -0.005 -3.792 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.472 1.253 -3.589 1.00 0.00 H new ATOM 0 HB3 ASN A 269 9.048 -0.349 -4.157 1.00 0.00 H new ATOM 0 HD21 ASN A 269 8.217 0.644 -7.479 1.00 0.00 H new ATOM 0 HD22 ASN A 269 8.013 -0.599 -6.240 1.00 0.00 H new ATOM 216 N GLY A 270 7.233 -0.529 -1.419 1.00 0.00 N ATOM 217 CA GLY A 270 7.373 -0.779 0.004 1.00 0.00 C ATOM 218 C GLY A 270 7.761 -2.213 0.306 1.00 0.00 C ATOM 219 O GLY A 270 7.849 -3.044 -0.599 1.00 0.00 O ATOM 0 H GLY A 270 6.873 -1.316 -1.959 1.00 0.00 H new ATOM 0 HA2 GLY A 270 8.127 -0.108 0.415 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.433 -0.547 0.505 1.00 0.00 H new ATOM 223 N LYS A 271 7.995 -2.506 1.580 1.00 0.00 N ATOM 224 CA LYS A 271 8.376 -3.849 2.000 1.00 0.00 C ATOM 225 C LYS A 271 7.660 -4.239 3.290 1.00 0.00 C ATOM 226 O LYS A 271 7.456 -3.408 4.174 1.00 0.00 O ATOM 227 CB LYS A 271 9.891 -3.933 2.200 1.00 0.00 C ATOM 228 CG LYS A 271 10.365 -5.290 2.689 1.00 0.00 C ATOM 229 CD LYS A 271 11.661 -5.177 3.475 1.00 0.00 C ATOM 230 CE LYS A 271 11.421 -4.616 4.868 1.00 0.00 C ATOM 231 NZ LYS A 271 12.575 -4.868 5.774 1.00 0.00 N ATOM 0 H LYS A 271 7.927 -1.830 2.341 1.00 0.00 H new ATOM 0 HA LYS A 271 8.080 -4.546 1.216 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.387 -3.702 1.257 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.197 -3.171 2.916 1.00 0.00 H new ATOM 0 HG2 LYS A 271 9.596 -5.741 3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 271 10.512 -5.954 1.837 1.00 0.00 H new ATOM 0 HD2 LYS A 271 12.127 -6.159 3.553 1.00 0.00 H new ATOM 0 HD3 LYS A 271 12.359 -4.534 2.938 1.00 0.00 H new ATOM 0 HE2 LYS A 271 11.239 -3.543 4.801 1.00 0.00 H new ATOM 0 HE3 LYS A 271 10.523 -5.066 5.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 12.372 -4.470 6.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 12.733 -5.892 5.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 13.427 -4.417 5.384 1.00 0.00 H new ATOM 245 N VAL A 272 7.282 -5.510 3.390 1.00 0.00 N ATOM 246 CA VAL A 272 6.591 -6.011 4.572 1.00 0.00 C ATOM 247 C VAL A 272 7.531 -6.076 5.771 1.00 0.00 C ATOM 248 O VAL A 272 8.452 -6.893 5.809 1.00 0.00 O ATOM 249 CB VAL A 272 5.996 -7.409 4.324 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.620 -8.071 5.641 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.791 -7.319 3.400 1.00 0.00 C ATOM 0 H VAL A 272 7.443 -6.211 2.667 1.00 0.00 H new ATOM 0 HA VAL A 272 5.782 -5.313 4.785 1.00 0.00 H new ATOM 0 HB VAL A 272 6.752 -8.025 3.838 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.201 -9.058 5.445 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.508 -8.171 6.265 1.00 0.00 H new ATOM 0 HG13 VAL A 272 4.881 -7.459 6.158 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.383 -8.316 3.236 1.00 0.00 H new ATOM 0 HG22 VAL A 272 4.029 -6.686 3.856 1.00 0.00 H new ATOM 0 HG23 VAL A 272 5.096 -6.890 2.445 1.00 0.00 H new ATOM 261 N THR A 273 7.293 -5.210 6.751 1.00 0.00 N ATOM 262 CA THR A 273 8.118 -5.168 7.951 1.00 0.00 C ATOM 263 C THR A 273 7.582 -6.114 9.020 1.00 0.00 C ATOM 264 O THR A 273 8.348 -6.698 9.786 1.00 0.00 O ATOM 265 CB THR A 273 8.192 -3.743 8.533 1.00 0.00 C ATOM 266 OG1 THR A 273 6.883 -3.300 8.911 1.00 0.00 O ATOM 267 CG2 THR A 273 8.787 -2.776 7.521 1.00 0.00 C ATOM 0 H THR A 273 6.535 -4.528 6.737 1.00 0.00 H new ATOM 0 HA THR A 273 9.119 -5.485 7.658 1.00 0.00 H new ATOM 0 HB THR A 273 8.836 -3.766 9.412 1.00 0.00 H new ATOM 0 HG1 THR A 273 6.938 -2.394 9.281 1.00 0.00 H new ATOM 0 HG21 THR A 273 8.829 -1.777 7.954 1.00 0.00 H new ATOM 0 HG22 THR A 273 9.794 -3.100 7.257 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.165 -2.758 6.626 1.00 0.00 H new ATOM 275 N SER A 274 6.262 -6.261 9.065 1.00 0.00 N ATOM 276 CA SER A 274 5.623 -7.134 10.043 1.00 0.00 C ATOM 277 C SER A 274 4.291 -7.659 9.514 1.00 0.00 C ATOM 278 O SER A 274 3.536 -6.930 8.871 1.00 0.00 O ATOM 279 CB SER A 274 5.403 -6.386 11.359 1.00 0.00 C ATOM 280 OG SER A 274 5.433 -7.276 12.462 1.00 0.00 O ATOM 0 H SER A 274 5.614 -5.787 8.436 1.00 0.00 H new ATOM 0 HA SER A 274 6.283 -7.983 10.222 1.00 0.00 H new ATOM 0 HB2 SER A 274 6.173 -5.624 11.481 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.444 -5.868 11.331 1.00 0.00 H new ATOM 0 HG SER A 274 5.612 -6.773 13.284 1.00 0.00 H new ATOM 286 N ILE A 275 4.011 -8.928 9.791 1.00 0.00 N ATOM 287 CA ILE A 275 2.771 -9.551 9.344 1.00 0.00 C ATOM 288 C ILE A 275 1.801 -9.737 10.506 1.00 0.00 C ATOM 289 O ILE A 275 2.102 -10.435 11.473 1.00 0.00 O ATOM 290 CB ILE A 275 3.034 -10.918 8.685 1.00 0.00 C ATOM 291 CG1 ILE A 275 3.833 -10.740 7.392 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.720 -11.633 8.407 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.312 -10.519 7.622 1.00 0.00 C ATOM 0 H ILE A 275 4.626 -9.545 10.322 1.00 0.00 H new ATOM 0 HA ILE A 275 2.328 -8.881 8.607 1.00 0.00 H new ATOM 0 HB ILE A 275 3.620 -11.529 9.371 1.00 0.00 H new ATOM 0 HG12 ILE A 275 3.699 -11.623 6.767 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.429 -9.893 6.838 1.00 0.00 H new ATOM 0 HG21 ILE A 275 1.922 -12.598 7.941 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.185 -11.787 9.344 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.111 -11.027 7.737 1.00 0.00 H new ATOM 0 HD11 ILE A 275 5.816 -10.401 6.663 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.457 -9.620 8.221 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.731 -11.377 8.148 1.00 0.00 H new ATOM 305 N MET A 276 0.634 -9.109 10.401 1.00 0.00 N ATOM 306 CA MET A 276 -0.383 -9.208 11.442 1.00 0.00 C ATOM 307 C MET A 276 -1.580 -10.019 10.956 1.00 0.00 C ATOM 308 O MET A 276 -1.847 -10.089 9.757 1.00 0.00 O ATOM 309 CB MET A 276 -0.838 -7.813 11.874 1.00 0.00 C ATOM 310 CG MET A 276 0.152 -7.105 12.784 1.00 0.00 C ATOM 311 SD MET A 276 1.802 -6.995 12.064 1.00 0.00 S ATOM 312 CE MET A 276 2.595 -5.866 13.206 1.00 0.00 C ATOM 0 H MET A 276 0.369 -8.527 9.606 1.00 0.00 H new ATOM 0 HA MET A 276 0.057 -9.720 12.298 1.00 0.00 H new ATOM 0 HB2 MET A 276 -1.003 -7.203 10.986 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.796 -7.895 12.387 1.00 0.00 H new ATOM 0 HG2 MET A 276 -0.213 -6.101 13.001 1.00 0.00 H new ATOM 0 HG3 MET A 276 0.209 -7.635 13.735 1.00 0.00 H new ATOM 0 HE1 MET A 276 3.156 -5.117 12.647 1.00 0.00 H new ATOM 0 HE2 MET A 276 1.837 -5.372 13.814 1.00 0.00 H new ATOM 0 HE3 MET A 276 3.275 -6.421 13.853 1.00 0.00 H new ATOM 322 N GLN A 277 -2.295 -10.629 11.895 1.00 0.00 N ATOM 323 CA GLN A 277 -3.463 -11.436 11.562 1.00 0.00 C ATOM 324 C GLN A 277 -4.465 -10.630 10.740 1.00 0.00 C ATOM 325 O GLN A 277 -5.229 -11.189 9.953 1.00 0.00 O ATOM 326 CB GLN A 277 -4.132 -11.955 12.836 1.00 0.00 C ATOM 327 CG GLN A 277 -3.559 -13.274 13.329 1.00 0.00 C ATOM 328 CD GLN A 277 -4.563 -14.086 14.123 1.00 0.00 C ATOM 329 OE1 GLN A 277 -5.274 -13.554 14.976 1.00 0.00 O ATOM 330 NE2 GLN A 277 -4.627 -15.383 13.846 1.00 0.00 N ATOM 0 H GLN A 277 -2.086 -10.580 12.892 1.00 0.00 H new ATOM 0 HA GLN A 277 -3.128 -12.284 10.965 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -4.028 -11.207 13.622 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -5.199 -12.078 12.652 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -3.218 -13.859 12.475 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -2.685 -13.077 13.950 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -4.019 -15.782 13.131 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -5.284 -15.980 14.348 1.00 0.00 H new ATOM 339 N PHE A 278 -4.455 -9.315 10.929 1.00 0.00 N ATOM 340 CA PHE A 278 -5.363 -8.432 10.206 1.00 0.00 C ATOM 341 C PHE A 278 -4.761 -8.009 8.870 1.00 0.00 C ATOM 342 O PHE A 278 -5.375 -8.181 7.817 1.00 0.00 O ATOM 343 CB PHE A 278 -5.685 -7.196 11.048 1.00 0.00 C ATOM 344 CG PHE A 278 -4.567 -6.788 11.965 1.00 0.00 C ATOM 345 CD1 PHE A 278 -3.567 -5.937 11.523 1.00 0.00 C ATOM 346 CD2 PHE A 278 -4.516 -7.255 13.269 1.00 0.00 C ATOM 347 CE1 PHE A 278 -2.537 -5.561 12.365 1.00 0.00 C ATOM 348 CE2 PHE A 278 -3.489 -6.882 14.115 1.00 0.00 C ATOM 349 CZ PHE A 278 -2.498 -6.033 13.662 1.00 0.00 C ATOM 0 H PHE A 278 -3.828 -8.837 11.577 1.00 0.00 H new ATOM 0 HA PHE A 278 -6.285 -8.980 10.012 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -5.921 -6.365 10.383 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.578 -7.393 11.642 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -3.592 -5.563 10.510 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -5.289 -7.919 13.628 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -1.763 -4.898 12.008 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -3.461 -7.254 15.129 1.00 0.00 H new ATOM 0 HZ PHE A 278 -1.694 -5.739 14.321 1.00 0.00 H new ATOM 359 N GLY A 279 -3.555 -7.453 8.920 1.00 0.00 N ATOM 360 CA GLY A 279 -2.889 -7.012 7.708 1.00 0.00 C ATOM 361 C GLY A 279 -1.379 -7.067 7.823 1.00 0.00 C ATOM 362 O GLY A 279 -0.843 -7.557 8.817 1.00 0.00 O ATOM 0 H GLY A 279 -3.026 -7.300 9.779 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.210 -7.636 6.874 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.196 -5.991 7.479 1.00 0.00 H new ATOM 366 N CYS A 280 -0.691 -6.565 6.804 1.00 0.00 N ATOM 367 CA CYS A 280 0.767 -6.561 6.793 1.00 0.00 C ATOM 368 C CYS A 280 1.307 -5.139 6.675 1.00 0.00 C ATOM 369 O CYS A 280 0.907 -4.384 5.788 1.00 0.00 O ATOM 370 CB CYS A 280 1.292 -7.416 5.639 1.00 0.00 C ATOM 371 SG CYS A 280 0.791 -6.834 4.002 1.00 0.00 S ATOM 0 H CYS A 280 -1.120 -6.155 5.974 1.00 0.00 H new ATOM 0 HA CYS A 280 1.113 -6.984 7.736 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.381 -7.442 5.686 1.00 0.00 H new ATOM 0 HB3 CYS A 280 0.943 -8.440 5.771 1.00 0.00 H new ATOM 0 HG CYS A 280 1.787 -6.954 3.175 1.00 0.00 H new ATOM 377 N PHE A 281 2.215 -4.780 7.575 1.00 0.00 N ATOM 378 CA PHE A 281 2.808 -3.447 7.574 1.00 0.00 C ATOM 379 C PHE A 281 3.851 -3.317 6.468 1.00 0.00 C ATOM 380 O PHE A 281 4.804 -4.094 6.404 1.00 0.00 O ATOM 381 CB PHE A 281 3.446 -3.148 8.932 1.00 0.00 C ATOM 382 CG PHE A 281 2.457 -2.724 9.979 1.00 0.00 C ATOM 383 CD1 PHE A 281 2.084 -1.396 10.101 1.00 0.00 C ATOM 384 CD2 PHE A 281 1.901 -3.655 10.843 1.00 0.00 C ATOM 385 CE1 PHE A 281 1.174 -1.002 11.064 1.00 0.00 C ATOM 386 CE2 PHE A 281 0.990 -3.267 11.807 1.00 0.00 C ATOM 387 CZ PHE A 281 0.627 -1.939 11.919 1.00 0.00 C ATOM 0 H PHE A 281 2.557 -5.393 8.315 1.00 0.00 H new ATOM 0 HA PHE A 281 2.015 -2.723 7.387 1.00 0.00 H new ATOM 0 HB2 PHE A 281 3.973 -4.036 9.280 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.192 -2.363 8.809 1.00 0.00 H new ATOM 0 HD1 PHE A 281 2.509 -0.659 9.436 1.00 0.00 H new ATOM 0 HD2 PHE A 281 2.183 -4.694 10.762 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.891 0.037 11.148 1.00 0.00 H new ATOM 0 HE2 PHE A 281 0.562 -4.002 12.473 1.00 0.00 H new ATOM 0 HZ PHE A 281 -0.083 -1.634 12.673 1.00 0.00 H new ATOM 397 N VAL A 282 3.664 -2.329 5.599 1.00 0.00 N ATOM 398 CA VAL A 282 4.588 -2.096 4.496 1.00 0.00 C ATOM 399 C VAL A 282 5.273 -0.741 4.630 1.00 0.00 C ATOM 400 O VAL A 282 4.611 0.292 4.732 1.00 0.00 O ATOM 401 CB VAL A 282 3.868 -2.163 3.136 1.00 0.00 C ATOM 402 CG1 VAL A 282 4.809 -1.757 2.012 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.309 -3.558 2.897 1.00 0.00 C ATOM 0 H VAL A 282 2.881 -1.677 5.638 1.00 0.00 H new ATOM 0 HA VAL A 282 5.338 -2.885 4.540 1.00 0.00 H new ATOM 0 HB VAL A 282 3.035 -1.460 3.151 1.00 0.00 H new ATOM 0 HG11 VAL A 282 4.282 -1.811 1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 282 5.155 -0.737 2.178 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.665 -2.432 1.992 1.00 0.00 H new ATOM 0 HG21 VAL A 282 2.804 -3.587 1.932 1.00 0.00 H new ATOM 0 HG22 VAL A 282 4.124 -4.282 2.902 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.599 -3.805 3.686 1.00 0.00 H new ATOM 413 N GLN A 283 6.602 -0.752 4.627 1.00 0.00 N ATOM 414 CA GLN A 283 7.376 0.477 4.749 1.00 0.00 C ATOM 415 C GLN A 283 7.799 0.992 3.377 1.00 0.00 C ATOM 416 O GLN A 283 8.386 0.258 2.581 1.00 0.00 O ATOM 417 CB GLN A 283 8.610 0.244 5.622 1.00 0.00 C ATOM 418 CG GLN A 283 9.560 1.430 5.663 1.00 0.00 C ATOM 419 CD GLN A 283 10.843 1.124 6.411 1.00 0.00 C ATOM 420 OE1 GLN A 283 10.757 1.066 7.735 1.00 0.00 O flip ATOM 421 NE2 GLN A 283 11.900 0.943 5.805 1.00 0.00 N flip ATOM 0 H GLN A 283 7.165 -1.598 4.541 1.00 0.00 H new ATOM 0 HA GLN A 283 6.744 1.229 5.221 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.288 0.012 6.637 1.00 0.00 H new ATOM 0 HB3 GLN A 283 9.148 -0.629 5.251 1.00 0.00 H new ATOM 0 HG2 GLN A 283 9.801 1.733 4.644 1.00 0.00 H new ATOM 0 HG3 GLN A 283 9.060 2.275 6.137 1.00 0.00 H new ATOM 0 HE21 GLN A 283 11.920 0.997 4.787 1.00 0.00 H new ATOM 0 HE22 GLN A 283 12.756 0.739 6.322 1.00 0.00 H new ATOM 430 N LEU A 284 7.498 2.257 3.107 1.00 0.00 N ATOM 431 CA LEU A 284 7.847 2.870 1.830 1.00 0.00 C ATOM 432 C LEU A 284 9.360 3.000 1.684 1.00 0.00 C ATOM 433 O LEU A 284 10.076 3.161 2.671 1.00 0.00 O ATOM 434 CB LEU A 284 7.192 4.247 1.707 1.00 0.00 C ATOM 435 CG LEU A 284 5.677 4.290 1.915 1.00 0.00 C ATOM 436 CD1 LEU A 284 5.191 5.728 2.001 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.963 3.549 0.794 1.00 0.00 C ATOM 0 H LEU A 284 7.013 2.878 3.755 1.00 0.00 H new ATOM 0 HA LEU A 284 7.477 2.225 1.033 1.00 0.00 H new ATOM 0 HB2 LEU A 284 7.657 4.915 2.432 1.00 0.00 H new ATOM 0 HB3 LEU A 284 7.414 4.646 0.717 1.00 0.00 H new ATOM 0 HG LEU A 284 5.445 3.793 2.857 1.00 0.00 H new ATOM 0 HD11 LEU A 284 4.111 5.739 2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 284 5.677 6.227 2.839 1.00 0.00 H new ATOM 0 HD13 LEU A 284 5.436 6.251 1.076 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.886 3.590 0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 284 5.202 4.017 -0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.288 2.509 0.780 1.00 0.00 H new ATOM 449 N GLU A 285 9.838 2.931 0.445 1.00 0.00 N ATOM 450 CA GLU A 285 11.266 3.043 0.171 1.00 0.00 C ATOM 451 C GLU A 285 11.531 4.071 -0.925 1.00 0.00 C ATOM 452 O GLU A 285 11.423 3.769 -2.113 1.00 0.00 O ATOM 453 CB GLU A 285 11.837 1.684 -0.240 1.00 0.00 C ATOM 454 CG GLU A 285 11.794 0.645 0.868 1.00 0.00 C ATOM 455 CD GLU A 285 12.415 1.144 2.158 1.00 0.00 C ATOM 456 OE1 GLU A 285 13.627 1.446 2.157 1.00 0.00 O ATOM 457 OE2 GLU A 285 11.689 1.232 3.171 1.00 0.00 O ATOM 0 H GLU A 285 9.258 2.798 -0.384 1.00 0.00 H new ATOM 0 HA GLU A 285 11.760 3.376 1.084 1.00 0.00 H new ATOM 0 HB2 GLU A 285 11.280 1.310 -1.099 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.870 1.816 -0.563 1.00 0.00 H new ATOM 0 HG2 GLU A 285 10.759 0.360 1.054 1.00 0.00 H new ATOM 0 HG3 GLU A 285 12.318 -0.253 0.540 1.00 0.00 H new ATOM 464 N GLY A 286 11.877 5.288 -0.516 1.00 0.00 N ATOM 465 CA GLY A 286 12.151 6.342 -1.475 1.00 0.00 C ATOM 466 C GLY A 286 12.024 7.725 -0.868 1.00 0.00 C ATOM 467 O GLY A 286 12.988 8.491 -0.841 1.00 0.00 O ATOM 0 H GLY A 286 11.972 5.562 0.462 1.00 0.00 H new ATOM 0 HA2 GLY A 286 13.158 6.214 -1.873 1.00 0.00 H new ATOM 0 HA3 GLY A 286 11.462 6.253 -2.315 1.00 0.00 H new ATOM 471 N LEU A 287 10.831 8.047 -0.380 1.00 0.00 N ATOM 472 CA LEU A 287 10.579 9.349 0.229 1.00 0.00 C ATOM 473 C LEU A 287 11.570 9.624 1.355 1.00 0.00 C ATOM 474 O LEU A 287 11.907 8.729 2.131 1.00 0.00 O ATOM 475 CB LEU A 287 9.148 9.415 0.765 1.00 0.00 C ATOM 476 CG LEU A 287 8.037 9.176 -0.257 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.725 8.862 0.445 1.00 0.00 C ATOM 478 CD2 LEU A 287 7.880 10.385 -1.168 1.00 0.00 C ATOM 0 H LEU A 287 10.023 7.425 -0.394 1.00 0.00 H new ATOM 0 HA LEU A 287 10.708 10.113 -0.538 1.00 0.00 H new ATOM 0 HB2 LEU A 287 9.046 8.679 1.562 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.995 10.396 1.216 1.00 0.00 H new ATOM 0 HG LEU A 287 8.313 8.318 -0.870 1.00 0.00 H new ATOM 0 HD11 LEU A 287 5.946 8.695 -0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 287 6.844 7.966 1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 287 6.444 9.700 1.083 1.00 0.00 H new ATOM 0 HD21 LEU A 287 7.085 10.196 -1.889 1.00 0.00 H new ATOM 0 HD22 LEU A 287 7.628 11.261 -0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 287 8.815 10.565 -1.698 1.00 0.00 H new ATOM 490 N ARG A 288 12.031 10.867 1.441 1.00 0.00 N ATOM 491 CA ARG A 288 12.982 11.260 2.473 1.00 0.00 C ATOM 492 C ARG A 288 12.509 10.805 3.851 1.00 0.00 C ATOM 493 O ARG A 288 13.221 10.096 4.561 1.00 0.00 O ATOM 494 CB ARG A 288 13.179 12.777 2.465 1.00 0.00 C ATOM 495 CG ARG A 288 14.571 13.214 2.890 1.00 0.00 C ATOM 496 CD ARG A 288 14.777 13.041 4.387 1.00 0.00 C ATOM 497 NE ARG A 288 14.090 14.074 5.157 1.00 0.00 N ATOM 498 CZ ARG A 288 14.427 14.413 6.396 1.00 0.00 C ATOM 499 NH1 ARG A 288 15.438 13.804 7.002 1.00 0.00 N ATOM 500 NH2 ARG A 288 13.754 15.363 7.032 1.00 0.00 N ATOM 0 H ARG A 288 11.761 11.620 0.808 1.00 0.00 H new ATOM 0 HA ARG A 288 13.934 10.776 2.257 1.00 0.00 H new ATOM 0 HB2 ARG A 288 12.979 13.155 1.462 1.00 0.00 H new ATOM 0 HB3 ARG A 288 12.446 13.233 3.130 1.00 0.00 H new ATOM 0 HG2 ARG A 288 15.317 12.632 2.349 1.00 0.00 H new ATOM 0 HG3 ARG A 288 14.724 14.259 2.619 1.00 0.00 H new ATOM 0 HD2 ARG A 288 14.413 12.060 4.692 1.00 0.00 H new ATOM 0 HD3 ARG A 288 15.843 13.070 4.612 1.00 0.00 H new ATOM 0 HE ARG A 288 13.308 14.562 4.719 1.00 0.00 H new ATOM 0 HH11 ARG A 288 15.958 13.074 6.516 1.00 0.00 H new ATOM 0 HH12 ARG A 288 15.695 14.066 7.954 1.00 0.00 H new ATOM 0 HH21 ARG A 288 12.977 15.834 6.569 1.00 0.00 H new ATOM 0 HH22 ARG A 288 14.014 15.622 7.984 1.00 0.00 H new ATOM 514 N LYS A 289 11.302 11.218 4.222 1.00 0.00 N ATOM 515 CA LYS A 289 10.731 10.853 5.513 1.00 0.00 C ATOM 516 C LYS A 289 10.280 9.396 5.516 1.00 0.00 C ATOM 517 O LYS A 289 9.696 8.915 4.545 1.00 0.00 O ATOM 518 CB LYS A 289 9.548 11.764 5.846 1.00 0.00 C ATOM 519 CG LYS A 289 9.155 11.739 7.313 1.00 0.00 C ATOM 520 CD LYS A 289 7.692 12.102 7.506 1.00 0.00 C ATOM 521 CE LYS A 289 7.429 12.631 8.907 1.00 0.00 C ATOM 522 NZ LYS A 289 7.625 14.104 8.990 1.00 0.00 N ATOM 0 H LYS A 289 10.700 11.806 3.646 1.00 0.00 H new ATOM 0 HA LYS A 289 11.503 10.978 6.272 1.00 0.00 H new ATOM 0 HB2 LYS A 289 9.797 12.787 5.563 1.00 0.00 H new ATOM 0 HB3 LYS A 289 8.690 11.466 5.244 1.00 0.00 H new ATOM 0 HG2 LYS A 289 9.342 10.747 7.723 1.00 0.00 H new ATOM 0 HG3 LYS A 289 9.780 12.437 7.870 1.00 0.00 H new ATOM 0 HD2 LYS A 289 7.403 12.854 6.772 1.00 0.00 H new ATOM 0 HD3 LYS A 289 7.071 11.224 7.325 1.00 0.00 H new ATOM 0 HE2 LYS A 289 6.410 12.383 9.203 1.00 0.00 H new ATOM 0 HE3 LYS A 289 8.095 12.136 9.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 7.436 14.425 9.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 8.605 14.339 8.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 6.971 14.579 8.335 1.00 0.00 H new ATOM 536 N ARG A 290 10.555 8.699 6.614 1.00 0.00 N ATOM 537 CA ARG A 290 10.177 7.297 6.743 1.00 0.00 C ATOM 538 C ARG A 290 8.688 7.160 7.046 1.00 0.00 C ATOM 539 O ARG A 290 8.207 7.643 8.071 1.00 0.00 O ATOM 540 CB ARG A 290 10.997 6.625 7.847 1.00 0.00 C ATOM 541 CG ARG A 290 11.034 5.109 7.741 1.00 0.00 C ATOM 542 CD ARG A 290 11.879 4.495 8.846 1.00 0.00 C ATOM 543 NE ARG A 290 11.232 4.598 10.151 1.00 0.00 N ATOM 544 CZ ARG A 290 11.332 5.663 10.939 1.00 0.00 C ATOM 545 NH1 ARG A 290 12.049 6.710 10.555 1.00 0.00 N ATOM 546 NH2 ARG A 290 10.715 5.682 12.113 1.00 0.00 N ATOM 0 H ARG A 290 11.038 9.082 7.427 1.00 0.00 H new ATOM 0 HA ARG A 290 10.384 6.803 5.794 1.00 0.00 H new ATOM 0 HB2 ARG A 290 12.017 7.008 7.815 1.00 0.00 H new ATOM 0 HB3 ARG A 290 10.583 6.903 8.816 1.00 0.00 H new ATOM 0 HG2 ARG A 290 10.019 4.714 7.795 1.00 0.00 H new ATOM 0 HG3 ARG A 290 11.437 4.821 6.770 1.00 0.00 H new ATOM 0 HD2 ARG A 290 12.069 3.446 8.617 1.00 0.00 H new ATOM 0 HD3 ARG A 290 12.848 4.994 8.881 1.00 0.00 H new ATOM 0 HE ARG A 290 10.673 3.809 10.475 1.00 0.00 H new ATOM 0 HH11 ARG A 290 12.525 6.699 9.653 1.00 0.00 H new ATOM 0 HH12 ARG A 290 12.124 7.527 11.162 1.00 0.00 H new ATOM 0 HH21 ARG A 290 10.163 4.878 12.412 1.00 0.00 H new ATOM 0 HH22 ARG A 290 10.793 6.500 12.717 1.00 0.00 H new ATOM 560 N TRP A 291 7.965 6.501 6.148 1.00 0.00 N ATOM 561 CA TRP A 291 6.530 6.302 6.320 1.00 0.00 C ATOM 562 C TRP A 291 6.223 4.859 6.707 1.00 0.00 C ATOM 563 O TRP A 291 7.077 3.981 6.589 1.00 0.00 O ATOM 564 CB TRP A 291 5.787 6.667 5.034 1.00 0.00 C ATOM 565 CG TRP A 291 5.627 8.144 4.839 1.00 0.00 C ATOM 566 CD1 TRP A 291 6.311 8.933 3.958 1.00 0.00 C ATOM 567 CD2 TRP A 291 4.729 9.009 5.541 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.891 10.237 4.071 1.00 0.00 N ATOM 569 CE2 TRP A 291 4.920 10.310 5.035 1.00 0.00 C ATOM 570 CE3 TRP A 291 3.779 8.812 6.547 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.198 11.404 5.502 1.00 0.00 C ATOM 572 CZ3 TRP A 291 3.063 9.899 7.011 1.00 0.00 C ATOM 573 CH2 TRP A 291 3.275 11.182 6.488 1.00 0.00 C ATOM 0 H TRP A 291 8.348 6.096 5.294 1.00 0.00 H new ATOM 0 HA TRP A 291 6.191 6.954 7.125 1.00 0.00 H new ATOM 0 HB2 TRP A 291 6.325 6.251 4.182 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.802 6.201 5.047 1.00 0.00 H new ATOM 0 HD1 TRP A 291 7.070 8.584 3.274 1.00 0.00 H new ATOM 0 HE1 TRP A 291 6.245 11.023 3.526 1.00 0.00 H new ATOM 0 HE3 TRP A 291 3.607 7.827 6.955 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.360 12.393 5.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 2.328 9.758 7.789 1.00 0.00 H new ATOM 0 HH2 TRP A 291 2.699 12.012 6.870 1.00 0.00 H new ATOM 584 N GLU A 292 5.000 4.623 7.169 1.00 0.00 N ATOM 585 CA GLU A 292 4.582 3.285 7.574 1.00 0.00 C ATOM 586 C GLU A 292 3.086 3.091 7.347 1.00 0.00 C ATOM 587 O GLU A 292 2.260 3.763 7.964 1.00 0.00 O ATOM 588 CB GLU A 292 4.921 3.045 9.046 1.00 0.00 C ATOM 589 CG GLU A 292 4.668 1.618 9.504 1.00 0.00 C ATOM 590 CD GLU A 292 4.742 1.467 11.011 1.00 0.00 C ATOM 591 OE1 GLU A 292 3.966 2.148 11.714 1.00 0.00 O ATOM 592 OE2 GLU A 292 5.576 0.668 11.486 1.00 0.00 O ATOM 0 H GLU A 292 4.281 5.339 7.272 1.00 0.00 H new ATOM 0 HA GLU A 292 5.122 2.562 6.962 1.00 0.00 H new ATOM 0 HB2 GLU A 292 5.970 3.291 9.213 1.00 0.00 H new ATOM 0 HB3 GLU A 292 4.332 3.725 9.661 1.00 0.00 H new ATOM 0 HG2 GLU A 292 3.685 1.298 9.158 1.00 0.00 H new ATOM 0 HG3 GLU A 292 5.399 0.956 9.040 1.00 0.00 H new ATOM 599 N GLY A 293 2.743 2.165 6.456 1.00 0.00 N ATOM 600 CA GLY A 293 1.347 1.898 6.162 1.00 0.00 C ATOM 601 C GLY A 293 0.961 0.460 6.442 1.00 0.00 C ATOM 602 O GLY A 293 1.809 -0.433 6.429 1.00 0.00 O ATOM 0 H GLY A 293 3.407 1.595 5.933 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.720 2.562 6.757 1.00 0.00 H new ATOM 0 HA3 GLY A 293 1.149 2.127 5.115 1.00 0.00 H new ATOM 606 N LEU A 294 -0.323 0.233 6.697 1.00 0.00 N ATOM 607 CA LEU A 294 -0.821 -1.108 6.984 1.00 0.00 C ATOM 608 C LEU A 294 -1.771 -1.581 5.888 1.00 0.00 C ATOM 609 O LEU A 294 -2.704 -0.872 5.511 1.00 0.00 O ATOM 610 CB LEU A 294 -1.533 -1.131 8.337 1.00 0.00 C ATOM 611 CG LEU A 294 -2.191 -2.455 8.728 1.00 0.00 C ATOM 612 CD1 LEU A 294 -1.145 -3.447 9.212 1.00 0.00 C ATOM 613 CD2 LEU A 294 -3.250 -2.230 9.796 1.00 0.00 C ATOM 0 H LEU A 294 -1.038 0.960 6.711 1.00 0.00 H new ATOM 0 HA LEU A 294 0.032 -1.786 7.019 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -0.811 -0.865 9.109 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.298 -0.355 8.335 1.00 0.00 H new ATOM 0 HG LEU A 294 -2.677 -2.872 7.846 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -1.631 -4.383 9.486 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -0.423 -3.632 8.416 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -0.630 -3.038 10.081 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -3.707 -3.183 10.062 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -2.788 -1.791 10.680 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -4.015 -1.555 9.413 1.00 0.00 H new ATOM 625 N VAL A 295 -1.529 -2.787 5.383 1.00 0.00 N ATOM 626 CA VAL A 295 -2.365 -3.357 4.333 1.00 0.00 C ATOM 627 C VAL A 295 -3.387 -4.329 4.911 1.00 0.00 C ATOM 628 O VAL A 295 -3.069 -5.485 5.196 1.00 0.00 O ATOM 629 CB VAL A 295 -1.517 -4.089 3.276 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.379 -4.502 2.092 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.359 -3.214 2.823 1.00 0.00 C ATOM 0 H VAL A 295 -0.761 -3.388 5.684 1.00 0.00 H new ATOM 0 HA VAL A 295 -2.887 -2.526 3.858 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.105 -4.992 3.727 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -1.763 -5.018 1.356 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.171 -5.169 2.433 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -2.822 -3.616 1.638 1.00 0.00 H new ATOM 0 HG21 VAL A 295 0.229 -3.747 2.076 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -0.747 -2.293 2.389 1.00 0.00 H new ATOM 0 HG23 VAL A 295 0.272 -2.974 3.679 1.00 0.00 H new ATOM 641 N HIS A 296 -4.617 -3.855 5.083 1.00 0.00 N ATOM 642 CA HIS A 296 -5.687 -4.683 5.627 1.00 0.00 C ATOM 643 C HIS A 296 -5.784 -6.007 4.877 1.00 0.00 C ATOM 644 O HIS A 296 -5.224 -6.158 3.790 1.00 0.00 O ATOM 645 CB HIS A 296 -7.022 -3.942 5.552 1.00 0.00 C ATOM 646 CG HIS A 296 -8.089 -4.541 6.415 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.231 -5.124 5.905 1.00 0.00 N ATOM 648 CD2 HIS A 296 -8.183 -4.649 7.761 1.00 0.00 C ATOM 649 CE1 HIS A 296 -9.981 -5.561 6.900 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.368 -5.286 8.037 1.00 0.00 N ATOM 0 H HIS A 296 -4.897 -2.902 4.853 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.455 -4.893 6.671 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -6.869 -2.904 5.846 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.365 -3.933 4.518 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.460 -4.299 8.484 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -10.934 -6.059 6.801 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.718 -5.510 8.969 1.00 0.00 H new ATOM 658 N ILE A 297 -6.497 -6.963 5.463 1.00 0.00 N ATOM 659 CA ILE A 297 -6.667 -8.274 4.849 1.00 0.00 C ATOM 660 C ILE A 297 -7.392 -8.165 3.512 1.00 0.00 C ATOM 661 O ILE A 297 -7.158 -8.958 2.600 1.00 0.00 O ATOM 662 CB ILE A 297 -7.449 -9.230 5.769 1.00 0.00 C ATOM 663 CG1 ILE A 297 -7.441 -10.647 5.194 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.876 -8.736 5.955 1.00 0.00 C ATOM 665 CD1 ILE A 297 -6.274 -11.485 5.668 1.00 0.00 C ATOM 0 H ILE A 297 -6.966 -6.854 6.362 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.668 -8.678 4.686 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.962 -9.252 6.744 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -8.371 -11.146 5.467 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -7.418 -10.589 4.106 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -9.416 -9.422 6.608 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.862 -7.743 6.404 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -9.374 -8.689 4.986 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -6.333 -12.477 5.220 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -5.340 -11.008 5.372 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -6.308 -11.574 6.754 1.00 0.00 H new ATOM 677 N SER A 298 -8.274 -7.177 3.403 1.00 0.00 N ATOM 678 CA SER A 298 -9.037 -6.965 2.178 1.00 0.00 C ATOM 679 C SER A 298 -8.163 -6.335 1.097 1.00 0.00 C ATOM 680 O SER A 298 -8.420 -6.499 -0.095 1.00 0.00 O ATOM 681 CB SER A 298 -10.248 -6.073 2.454 1.00 0.00 C ATOM 682 OG SER A 298 -11.222 -6.205 1.433 1.00 0.00 O ATOM 0 H SER A 298 -8.478 -6.511 4.148 1.00 0.00 H new ATOM 0 HA SER A 298 -9.383 -7.935 1.822 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.687 -6.338 3.416 1.00 0.00 H new ATOM 0 HB3 SER A 298 -9.929 -5.033 2.524 1.00 0.00 H new ATOM 0 HG SER A 298 -11.987 -5.626 1.634 1.00 0.00 H new ATOM 688 N GLU A 299 -7.131 -5.615 1.524 1.00 0.00 N ATOM 689 CA GLU A 299 -6.220 -4.960 0.593 1.00 0.00 C ATOM 690 C GLU A 299 -5.051 -5.875 0.240 1.00 0.00 C ATOM 691 O GLU A 299 -3.898 -5.443 0.205 1.00 0.00 O ATOM 692 CB GLU A 299 -5.696 -3.653 1.191 1.00 0.00 C ATOM 693 CG GLU A 299 -6.713 -2.523 1.171 1.00 0.00 C ATOM 694 CD GLU A 299 -8.112 -2.992 1.522 1.00 0.00 C ATOM 695 OE1 GLU A 299 -8.441 -3.027 2.726 1.00 0.00 O ATOM 696 OE2 GLU A 299 -8.877 -3.324 0.592 1.00 0.00 O ATOM 0 H GLU A 299 -6.905 -5.470 2.508 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.773 -4.738 -0.320 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.386 -3.833 2.220 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -4.808 -3.341 0.640 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -6.406 -1.750 1.875 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -6.724 -2.067 0.181 1.00 0.00 H new ATOM 703 N LEU A 300 -5.357 -7.141 -0.020 1.00 0.00 N ATOM 704 CA LEU A 300 -4.333 -8.119 -0.369 1.00 0.00 C ATOM 705 C LEU A 300 -4.551 -8.657 -1.780 1.00 0.00 C ATOM 706 O LEU A 300 -3.699 -8.499 -2.654 1.00 0.00 O ATOM 707 CB LEU A 300 -4.338 -9.273 0.635 1.00 0.00 C ATOM 708 CG LEU A 300 -4.019 -8.904 2.084 1.00 0.00 C ATOM 709 CD1 LEU A 300 -3.834 -10.156 2.926 1.00 0.00 C ATOM 710 CD2 LEU A 300 -2.778 -8.026 2.150 1.00 0.00 C ATOM 0 H LEU A 300 -6.306 -7.514 0.004 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.364 -7.621 -0.336 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -5.320 -9.746 0.609 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -3.616 -10.019 0.304 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.860 -8.341 2.488 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -3.608 -9.873 3.954 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -4.750 -10.747 2.906 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -3.012 -10.747 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -2.566 -7.773 3.189 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.929 -8.563 1.727 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.949 -7.112 1.582 1.00 0.00 H new ATOM 856 N VAL A 309 -2.788 -13.737 6.461 1.00 0.00 N ATOM 857 CA VAL A 309 -1.792 -12.966 5.727 1.00 0.00 C ATOM 858 C VAL A 309 -0.451 -13.692 5.693 1.00 0.00 C ATOM 859 O VAL A 309 0.352 -13.491 4.783 1.00 0.00 O ATOM 860 CB VAL A 309 -1.592 -11.571 6.348 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.673 -10.726 5.479 1.00 0.00 C ATOM 862 CG2 VAL A 309 -2.933 -10.881 6.549 1.00 0.00 C ATOM 0 HA VAL A 309 -2.167 -12.852 4.710 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.121 -11.691 7.323 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.544 -9.744 5.934 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.297 -11.216 5.391 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -1.113 -10.612 4.488 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -2.773 -9.896 6.989 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.434 -10.772 5.587 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.554 -11.480 7.216 1.00 0.00 H new ATOM 872 N ALA A 310 -0.217 -14.537 6.692 1.00 0.00 N ATOM 873 CA ALA A 310 1.026 -15.295 6.775 1.00 0.00 C ATOM 874 C ALA A 310 1.346 -15.972 5.447 1.00 0.00 C ATOM 875 O ALA A 310 2.431 -15.792 4.894 1.00 0.00 O ATOM 876 CB ALA A 310 0.940 -16.328 7.889 1.00 0.00 C ATOM 0 H ALA A 310 -0.871 -14.714 7.454 1.00 0.00 H new ATOM 0 HA ALA A 310 1.833 -14.598 7.001 1.00 0.00 H new ATOM 0 HB1 ALA A 310 1.874 -16.887 7.940 1.00 0.00 H new ATOM 0 HB2 ALA A 310 0.766 -15.824 8.840 1.00 0.00 H new ATOM 0 HB3 ALA A 310 0.118 -17.014 7.686 1.00 0.00 H new ATOM 882 N ASP A 311 0.396 -16.750 4.941 1.00 0.00 N ATOM 883 CA ASP A 311 0.577 -17.454 3.677 1.00 0.00 C ATOM 884 C ASP A 311 0.255 -16.543 2.496 1.00 0.00 C ATOM 885 O ASP A 311 -0.021 -17.013 1.393 1.00 0.00 O ATOM 886 CB ASP A 311 -0.308 -18.701 3.631 1.00 0.00 C ATOM 887 CG ASP A 311 0.384 -19.923 4.203 1.00 0.00 C ATOM 888 OD1 ASP A 311 1.313 -20.440 3.548 1.00 0.00 O ATOM 889 OD2 ASP A 311 -0.004 -20.362 5.306 1.00 0.00 O ATOM 0 H ASP A 311 -0.508 -16.909 5.387 1.00 0.00 H new ATOM 0 HA ASP A 311 1.622 -17.757 3.605 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -1.226 -18.513 4.188 1.00 0.00 H new ATOM 0 HB3 ASP A 311 -0.597 -18.900 2.599 1.00 0.00 H new ATOM 894 N VAL A 312 0.292 -15.236 2.737 1.00 0.00 N ATOM 895 CA VAL A 312 0.003 -14.259 1.694 1.00 0.00 C ATOM 896 C VAL A 312 1.232 -13.412 1.380 1.00 0.00 C ATOM 897 O VAL A 312 1.559 -13.180 0.216 1.00 0.00 O ATOM 898 CB VAL A 312 -1.157 -13.330 2.100 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.406 -12.285 1.023 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.416 -14.139 2.372 1.00 0.00 C ATOM 0 H VAL A 312 0.519 -14.830 3.645 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.286 -14.820 0.805 1.00 0.00 H new ATOM 0 HB VAL A 312 -0.881 -12.811 3.018 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -2.229 -11.638 1.327 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.506 -11.686 0.882 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -1.662 -12.781 0.087 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.226 -13.467 2.658 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.698 -14.686 1.472 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.227 -14.844 3.181 1.00 0.00 H new ATOM 910 N VAL A 313 1.910 -12.952 2.427 1.00 0.00 N ATOM 911 CA VAL A 313 3.104 -12.131 2.264 1.00 0.00 C ATOM 912 C VAL A 313 4.282 -12.716 3.034 1.00 0.00 C ATOM 913 O VAL A 313 4.118 -13.636 3.836 1.00 0.00 O ATOM 914 CB VAL A 313 2.861 -10.686 2.738 1.00 0.00 C ATOM 915 CG1 VAL A 313 1.748 -10.038 1.929 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.536 -10.661 4.224 1.00 0.00 C ATOM 0 H VAL A 313 1.653 -13.134 3.397 1.00 0.00 H new ATOM 0 HA VAL A 313 3.338 -12.121 1.200 1.00 0.00 H new ATOM 0 HB VAL A 313 3.774 -10.112 2.579 1.00 0.00 H new ATOM 0 HG11 VAL A 313 1.591 -9.018 2.278 1.00 0.00 H new ATOM 0 HG12 VAL A 313 2.026 -10.022 0.875 1.00 0.00 H new ATOM 0 HG13 VAL A 313 0.828 -10.610 2.053 1.00 0.00 H new ATOM 0 HG21 VAL A 313 2.367 -9.632 4.542 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.638 -11.250 4.410 1.00 0.00 H new ATOM 0 HG23 VAL A 313 3.370 -11.082 4.786 1.00 0.00 H new ATOM 926 N SER A 314 5.471 -12.176 2.786 1.00 0.00 N ATOM 927 CA SER A 314 6.679 -12.647 3.454 1.00 0.00 C ATOM 928 C SER A 314 7.333 -11.521 4.250 1.00 0.00 C ATOM 929 O SER A 314 7.200 -10.345 3.909 1.00 0.00 O ATOM 930 CB SER A 314 7.669 -13.205 2.430 1.00 0.00 C ATOM 931 OG SER A 314 7.154 -14.368 1.805 1.00 0.00 O ATOM 0 H SER A 314 5.624 -11.412 2.128 1.00 0.00 H new ATOM 0 HA SER A 314 6.397 -13.441 4.145 1.00 0.00 H new ATOM 0 HB2 SER A 314 7.883 -12.447 1.676 1.00 0.00 H new ATOM 0 HB3 SER A 314 8.613 -13.440 2.922 1.00 0.00 H new ATOM 0 HG SER A 314 7.804 -14.705 1.154 1.00 0.00 H new ATOM 937 N LYS A 315 8.040 -11.890 5.313 1.00 0.00 N ATOM 938 CA LYS A 315 8.717 -10.914 6.158 1.00 0.00 C ATOM 939 C LYS A 315 9.932 -10.328 5.447 1.00 0.00 C ATOM 940 O LYS A 315 10.764 -11.061 4.912 1.00 0.00 O ATOM 941 CB LYS A 315 9.148 -11.562 7.476 1.00 0.00 C ATOM 942 CG LYS A 315 9.695 -10.572 8.490 1.00 0.00 C ATOM 943 CD LYS A 315 9.737 -11.170 9.886 1.00 0.00 C ATOM 944 CE LYS A 315 10.905 -12.131 10.046 1.00 0.00 C ATOM 945 NZ LYS A 315 12.210 -11.415 10.091 1.00 0.00 N ATOM 0 H LYS A 315 8.159 -12.859 5.610 1.00 0.00 H new ATOM 0 HA LYS A 315 8.017 -10.106 6.369 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.295 -12.082 7.912 1.00 0.00 H new ATOM 0 HB3 LYS A 315 9.908 -12.315 7.269 1.00 0.00 H new ATOM 0 HG2 LYS A 315 10.698 -10.264 8.195 1.00 0.00 H new ATOM 0 HG3 LYS A 315 9.075 -9.675 8.496 1.00 0.00 H new ATOM 0 HD2 LYS A 315 9.818 -10.371 10.623 1.00 0.00 H new ATOM 0 HD3 LYS A 315 8.803 -11.695 10.086 1.00 0.00 H new ATOM 0 HE2 LYS A 315 10.777 -12.710 10.961 1.00 0.00 H new ATOM 0 HE3 LYS A 315 10.908 -12.840 9.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 12.946 -12.057 10.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 12.465 -11.097 9.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 12.132 -10.591 10.721 1.00 0.00 H new ATOM 959 N GLY A 316 10.030 -9.002 5.446 1.00 0.00 N ATOM 960 CA GLY A 316 11.148 -8.341 4.798 1.00 0.00 C ATOM 961 C GLY A 316 11.178 -8.583 3.302 1.00 0.00 C ATOM 962 O GLY A 316 12.249 -8.647 2.699 1.00 0.00 O ATOM 0 H GLY A 316 9.355 -8.374 5.882 1.00 0.00 H new ATOM 0 HA2 GLY A 316 11.092 -7.269 4.988 1.00 0.00 H new ATOM 0 HA3 GLY A 316 12.080 -8.695 5.239 1.00 0.00 H new ATOM 966 N GLN A 317 10.000 -8.721 2.703 1.00 0.00 N ATOM 967 CA GLN A 317 9.896 -8.961 1.269 1.00 0.00 C ATOM 968 C GLN A 317 9.490 -7.689 0.532 1.00 0.00 C ATOM 969 O GLN A 317 8.566 -6.988 0.946 1.00 0.00 O ATOM 970 CB GLN A 317 8.883 -10.072 0.988 1.00 0.00 C ATOM 971 CG GLN A 317 8.701 -10.370 -0.492 1.00 0.00 C ATOM 972 CD GLN A 317 7.595 -11.372 -0.754 1.00 0.00 C ATOM 973 OE1 GLN A 317 7.854 -12.552 -0.994 1.00 0.00 O ATOM 974 NE2 GLN A 317 6.352 -10.908 -0.708 1.00 0.00 N ATOM 0 H GLN A 317 9.104 -8.671 3.188 1.00 0.00 H new ATOM 0 HA GLN A 317 10.876 -9.272 0.907 1.00 0.00 H new ATOM 0 HB2 GLN A 317 9.203 -10.981 1.496 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.920 -9.791 1.414 1.00 0.00 H new ATOM 0 HG2 GLN A 317 8.479 -9.443 -1.021 1.00 0.00 H new ATOM 0 HG3 GLN A 317 9.637 -10.753 -0.899 1.00 0.00 H new ATOM 0 HE21 GLN A 317 6.183 -9.923 -0.506 1.00 0.00 H new ATOM 0 HE22 GLN A 317 5.566 -11.537 -0.875 1.00 0.00 H new ATOM 983 N ARG A 318 10.186 -7.396 -0.561 1.00 0.00 N ATOM 984 CA ARG A 318 9.899 -6.207 -1.355 1.00 0.00 C ATOM 985 C ARG A 318 8.600 -6.376 -2.136 1.00 0.00 C ATOM 986 O ARG A 318 8.453 -7.313 -2.921 1.00 0.00 O ATOM 987 CB ARG A 318 11.053 -5.919 -2.317 1.00 0.00 C ATOM 988 CG ARG A 318 11.314 -7.043 -3.307 1.00 0.00 C ATOM 989 CD ARG A 318 12.636 -6.848 -4.034 1.00 0.00 C ATOM 990 NE ARG A 318 12.485 -6.030 -5.234 1.00 0.00 N ATOM 991 CZ ARG A 318 12.075 -6.509 -6.404 1.00 0.00 C ATOM 992 NH1 ARG A 318 11.776 -7.795 -6.529 1.00 0.00 N ATOM 993 NH2 ARG A 318 11.963 -5.702 -7.450 1.00 0.00 N ATOM 0 H ARG A 318 10.953 -7.966 -0.917 1.00 0.00 H new ATOM 0 HA ARG A 318 9.785 -5.364 -0.674 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.836 -5.004 -2.868 1.00 0.00 H new ATOM 0 HB3 ARG A 318 11.959 -5.736 -1.740 1.00 0.00 H new ATOM 0 HG2 ARG A 318 11.324 -7.998 -2.781 1.00 0.00 H new ATOM 0 HG3 ARG A 318 10.501 -7.087 -4.032 1.00 0.00 H new ATOM 0 HD2 ARG A 318 13.353 -6.377 -3.362 1.00 0.00 H new ATOM 0 HD3 ARG A 318 13.046 -7.820 -4.307 1.00 0.00 H new ATOM 0 HE ARG A 318 12.706 -5.036 -5.171 1.00 0.00 H new ATOM 0 HH11 ARG A 318 11.860 -8.419 -5.726 1.00 0.00 H new ATOM 0 HH12 ARG A 318 11.462 -8.160 -7.428 1.00 0.00 H new ATOM 0 HH21 ARG A 318 12.192 -4.712 -7.357 1.00 0.00 H new ATOM 0 HH22 ARG A 318 11.648 -6.071 -8.347 1.00 0.00 H new ATOM 1007 N VAL A 319 7.659 -5.463 -1.916 1.00 0.00 N ATOM 1008 CA VAL A 319 6.372 -5.510 -2.600 1.00 0.00 C ATOM 1009 C VAL A 319 5.954 -4.125 -3.080 1.00 0.00 C ATOM 1010 O VAL A 319 6.538 -3.115 -2.684 1.00 0.00 O ATOM 1011 CB VAL A 319 5.271 -6.079 -1.685 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.525 -7.550 -1.396 1.00 0.00 C ATOM 1013 CG2 VAL A 319 5.187 -5.280 -0.393 1.00 0.00 C ATOM 0 H VAL A 319 7.764 -4.681 -1.269 1.00 0.00 H new ATOM 0 HA VAL A 319 6.494 -6.168 -3.461 1.00 0.00 H new ATOM 0 HB VAL A 319 4.314 -5.995 -2.200 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.737 -7.935 -0.748 1.00 0.00 H new ATOM 0 HG12 VAL A 319 5.531 -8.109 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.489 -7.662 -0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.404 -5.696 0.242 1.00 0.00 H new ATOM 0 HG22 VAL A 319 6.142 -5.331 0.129 1.00 0.00 H new ATOM 0 HG23 VAL A 319 4.954 -4.240 -0.623 1.00 0.00 H new ATOM 1023 N LYS A 320 4.938 -4.083 -3.935 1.00 0.00 N ATOM 1024 CA LYS A 320 4.438 -2.822 -4.469 1.00 0.00 C ATOM 1025 C LYS A 320 3.052 -2.507 -3.915 1.00 0.00 C ATOM 1026 O LYS A 320 2.148 -3.341 -3.966 1.00 0.00 O ATOM 1027 CB LYS A 320 4.387 -2.876 -5.997 1.00 0.00 C ATOM 1028 CG LYS A 320 5.732 -3.169 -6.641 1.00 0.00 C ATOM 1029 CD LYS A 320 5.617 -3.265 -8.153 1.00 0.00 C ATOM 1030 CE LYS A 320 6.688 -4.174 -8.737 1.00 0.00 C ATOM 1031 NZ LYS A 320 7.002 -3.825 -10.150 1.00 0.00 N ATOM 0 H LYS A 320 4.444 -4.909 -4.273 1.00 0.00 H new ATOM 0 HA LYS A 320 5.121 -2.030 -4.162 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.673 -3.642 -6.301 1.00 0.00 H new ATOM 0 HB3 LYS A 320 4.013 -1.924 -6.374 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.441 -2.384 -6.378 1.00 0.00 H new ATOM 0 HG3 LYS A 320 6.130 -4.103 -6.245 1.00 0.00 H new ATOM 0 HD2 LYS A 320 4.631 -3.644 -8.421 1.00 0.00 H new ATOM 0 HD3 LYS A 320 5.705 -2.270 -8.590 1.00 0.00 H new ATOM 0 HE2 LYS A 320 7.594 -4.101 -8.135 1.00 0.00 H new ATOM 0 HE3 LYS A 320 6.353 -5.210 -8.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 6.772 -4.631 -10.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 6.439 -2.999 -10.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 8.014 -3.601 -10.236 1.00 0.00 H new ATOM 1045 N VAL A 321 2.892 -1.298 -3.386 1.00 0.00 N ATOM 1046 CA VAL A 321 1.616 -0.872 -2.824 1.00 0.00 C ATOM 1047 C VAL A 321 1.177 0.466 -3.408 1.00 0.00 C ATOM 1048 O VAL A 321 1.972 1.179 -4.020 1.00 0.00 O ATOM 1049 CB VAL A 321 1.689 -0.752 -1.290 1.00 0.00 C ATOM 1050 CG1 VAL A 321 2.027 -2.097 -0.665 1.00 0.00 C ATOM 1051 CG2 VAL A 321 2.708 0.303 -0.888 1.00 0.00 C ATOM 0 H VAL A 321 3.630 -0.596 -3.335 1.00 0.00 H new ATOM 0 HA VAL A 321 0.885 -1.637 -3.086 1.00 0.00 H new ATOM 0 HB VAL A 321 0.712 -0.442 -0.919 1.00 0.00 H new ATOM 0 HG11 VAL A 321 2.074 -1.993 0.419 1.00 0.00 H new ATOM 0 HG12 VAL A 321 1.258 -2.823 -0.927 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.992 -2.440 -1.039 1.00 0.00 H new ATOM 0 HG21 VAL A 321 2.747 0.375 0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.690 0.024 -1.269 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.418 1.267 -1.306 1.00 0.00 H new ATOM 1061 N LYS A 322 -0.093 0.802 -3.214 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.639 2.056 -3.719 1.00 0.00 C ATOM 1063 C LYS A 322 -1.216 2.895 -2.583 1.00 0.00 C ATOM 1064 O LYS A 322 -1.879 2.372 -1.686 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.722 1.781 -4.764 1.00 0.00 C ATOM 1066 CG LYS A 322 -2.541 3.007 -5.129 1.00 0.00 C ATOM 1067 CD LYS A 322 -3.863 2.623 -5.772 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.723 2.453 -7.277 1.00 0.00 C ATOM 1069 NZ LYS A 322 -3.470 3.751 -7.961 1.00 0.00 N ATOM 0 H LYS A 322 -0.765 0.223 -2.710 1.00 0.00 H new ATOM 0 HA LYS A 322 0.173 2.615 -4.184 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -1.253 1.386 -5.665 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.390 1.007 -4.387 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -2.729 3.600 -4.234 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -1.971 3.636 -5.813 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -4.226 1.694 -5.332 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -4.608 3.389 -5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -2.905 1.765 -7.490 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -4.631 2.002 -7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -3.213 3.576 -8.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -4.329 4.336 -7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -2.691 4.248 -7.485 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.961 4.199 -2.627 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.458 5.110 -1.603 1.00 0.00 C ATOM 1085 C VAL A 323 -2.967 5.294 -1.716 1.00 0.00 C ATOM 1086 O VAL A 323 -3.458 5.942 -2.641 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.776 6.488 -1.699 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -1.279 7.411 -0.600 1.00 0.00 C ATOM 1089 CG2 VAL A 323 0.737 6.339 -1.631 1.00 0.00 C ATOM 0 H VAL A 323 -0.413 4.648 -3.361 1.00 0.00 H new ATOM 0 HA VAL A 323 -1.221 4.661 -0.638 1.00 0.00 H new ATOM 0 HB VAL A 323 -1.032 6.934 -2.660 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.786 8.379 -0.684 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -2.356 7.542 -0.700 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -1.056 6.974 0.373 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.203 7.322 -1.700 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.014 5.872 -0.686 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.079 5.716 -2.458 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.700 4.720 -0.768 1.00 0.00 N ATOM 1100 CA LEU A 324 -5.155 4.820 -0.759 1.00 0.00 C ATOM 1101 C LEU A 324 -5.606 6.149 -0.162 1.00 0.00 C ATOM 1102 O LEU A 324 -6.506 6.804 -0.688 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.761 3.660 0.033 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.723 2.291 -0.647 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -6.092 1.195 0.341 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -6.656 2.265 -1.848 1.00 0.00 C ATOM 0 H LEU A 324 -3.310 4.180 0.005 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.504 4.769 -1.790 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -5.238 3.585 0.986 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.799 3.903 0.258 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.707 2.109 -0.998 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -6.060 0.228 -0.160 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -5.384 1.198 1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -7.097 1.373 0.723 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -6.615 1.283 -2.319 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -7.676 2.469 -1.521 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -6.346 3.025 -2.566 1.00 0.00 H new ATOM 1118 N SER A 325 -4.972 6.543 0.938 1.00 0.00 N ATOM 1119 CA SER A 325 -5.309 7.794 1.607 1.00 0.00 C ATOM 1120 C SER A 325 -4.133 8.299 2.438 1.00 0.00 C ATOM 1121 O SER A 325 -3.180 7.564 2.698 1.00 0.00 O ATOM 1122 CB SER A 325 -6.535 7.604 2.502 1.00 0.00 C ATOM 1123 OG SER A 325 -6.967 8.840 3.045 1.00 0.00 O ATOM 0 H SER A 325 -4.223 6.014 1.384 1.00 0.00 H new ATOM 0 HA SER A 325 -5.537 8.536 0.842 1.00 0.00 H new ATOM 0 HB2 SER A 325 -7.343 7.154 1.926 1.00 0.00 H new ATOM 0 HB3 SER A 325 -6.296 6.912 3.310 1.00 0.00 H new ATOM 0 HG SER A 325 -7.753 8.692 3.612 1.00 0.00 H new ATOM 1129 N PHE A 326 -4.207 9.560 2.851 1.00 0.00 N ATOM 1130 CA PHE A 326 -3.149 10.166 3.651 1.00 0.00 C ATOM 1131 C PHE A 326 -3.701 11.294 4.518 1.00 0.00 C ATOM 1132 O PHE A 326 -4.263 12.265 4.010 1.00 0.00 O ATOM 1133 CB PHE A 326 -2.038 10.700 2.745 1.00 0.00 C ATOM 1134 CG PHE A 326 -1.148 11.707 3.417 1.00 0.00 C ATOM 1135 CD1 PHE A 326 -0.493 11.393 4.597 1.00 0.00 C ATOM 1136 CD2 PHE A 326 -0.968 12.967 2.870 1.00 0.00 C ATOM 1137 CE1 PHE A 326 0.327 12.316 5.218 1.00 0.00 C ATOM 1138 CE2 PHE A 326 -0.149 13.894 3.487 1.00 0.00 C ATOM 1139 CZ PHE A 326 0.498 13.569 4.662 1.00 0.00 C ATOM 0 H PHE A 326 -4.989 10.182 2.645 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.737 9.398 4.305 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -1.430 9.864 2.398 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -2.487 11.156 1.863 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -0.625 10.415 5.037 1.00 0.00 H new ATOM 0 HD2 PHE A 326 -1.473 13.228 1.952 1.00 0.00 H new ATOM 0 HE1 PHE A 326 0.833 12.058 6.136 1.00 0.00 H new ATOM 0 HE2 PHE A 326 -0.015 14.872 3.050 1.00 0.00 H new ATOM 0 HZ PHE A 326 1.137 14.293 5.146 1.00 0.00 H new ATOM 1149 N THR A 327 -3.537 11.159 5.830 1.00 0.00 N ATOM 1150 CA THR A 327 -4.019 12.164 6.768 1.00 0.00 C ATOM 1151 C THR A 327 -3.111 12.258 7.989 1.00 0.00 C ATOM 1152 O THR A 327 -3.041 11.332 8.795 1.00 0.00 O ATOM 1153 CB THR A 327 -5.455 11.856 7.233 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.426 10.961 8.352 1.00 0.00 O ATOM 1155 CG2 THR A 327 -6.269 11.239 6.106 1.00 0.00 C ATOM 0 H THR A 327 -3.073 10.362 6.267 1.00 0.00 H new ATOM 0 HA THR A 327 -4.012 13.117 6.240 1.00 0.00 H new ATOM 0 HB THR A 327 -5.926 12.793 7.529 1.00 0.00 H new ATOM 0 HG1 THR A 327 -4.550 10.524 8.399 1.00 0.00 H new ATOM 0 HG21 THR A 327 -7.279 11.030 6.459 1.00 0.00 H new ATOM 0 HG22 THR A 327 -6.314 11.933 5.267 1.00 0.00 H new ATOM 0 HG23 THR A 327 -5.798 10.310 5.783 1.00 0.00 H new ATOM 1163 N GLY A 328 -2.416 13.385 8.118 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.521 13.579 9.244 1.00 0.00 C ATOM 1165 C GLY A 328 -0.432 12.526 9.307 1.00 0.00 C ATOM 1166 O GLY A 328 0.524 12.563 8.531 1.00 0.00 O ATOM 0 H GLY A 328 -2.457 14.166 7.463 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -1.064 14.566 9.175 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -2.096 13.558 10.169 1.00 0.00 H new ATOM 1170 N THR A 329 -0.574 11.584 10.235 1.00 0.00 N ATOM 1171 CA THR A 329 0.407 10.519 10.398 1.00 0.00 C ATOM 1172 C THR A 329 -0.180 9.167 10.010 1.00 0.00 C ATOM 1173 O THR A 329 0.163 8.138 10.593 1.00 0.00 O ATOM 1174 CB THR A 329 0.920 10.446 11.849 1.00 0.00 C ATOM 1175 OG1 THR A 329 1.903 9.411 11.969 1.00 0.00 O ATOM 1176 CG2 THR A 329 -0.224 10.180 12.815 1.00 0.00 C ATOM 0 H THR A 329 -1.359 11.538 10.885 1.00 0.00 H new ATOM 0 HA THR A 329 1.241 10.753 9.736 1.00 0.00 H new ATOM 0 HB THR A 329 1.371 11.406 12.101 1.00 0.00 H new ATOM 0 HG1 THR A 329 1.517 8.558 11.679 1.00 0.00 H new ATOM 0 HG21 THR A 329 0.163 10.133 13.833 1.00 0.00 H new ATOM 0 HG22 THR A 329 -0.956 10.984 12.742 1.00 0.00 H new ATOM 0 HG23 THR A 329 -0.700 9.232 12.563 1.00 0.00 H new ATOM 1184 N LYS A 330 -1.067 9.174 9.021 1.00 0.00 N ATOM 1185 CA LYS A 330 -1.702 7.948 8.552 1.00 0.00 C ATOM 1186 C LYS A 330 -1.504 7.773 7.050 1.00 0.00 C ATOM 1187 O LYS A 330 -1.849 8.652 6.261 1.00 0.00 O ATOM 1188 CB LYS A 330 -3.196 7.964 8.882 1.00 0.00 C ATOM 1189 CG LYS A 330 -3.525 7.378 10.244 1.00 0.00 C ATOM 1190 CD LYS A 330 -3.411 5.863 10.241 1.00 0.00 C ATOM 1191 CE LYS A 330 -4.664 5.210 9.677 1.00 0.00 C ATOM 1192 NZ LYS A 330 -5.853 5.457 10.539 1.00 0.00 N ATOM 0 H LYS A 330 -1.363 10.016 8.528 1.00 0.00 H new ATOM 0 HA LYS A 330 -1.233 7.107 9.063 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -3.557 8.992 8.841 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -3.735 7.406 8.116 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -2.850 7.793 10.992 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -4.536 7.667 10.531 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -2.546 5.564 9.650 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -3.241 5.508 11.257 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -4.855 5.595 8.675 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -4.502 4.136 9.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -6.565 4.718 10.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -5.567 5.438 11.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -6.258 6.388 10.313 1.00 0.00 H new ATOM 1206 N THR A 331 -0.947 6.630 6.660 1.00 0.00 N ATOM 1207 CA THR A 331 -0.704 6.339 5.253 1.00 0.00 C ATOM 1208 C THR A 331 -1.230 4.958 4.878 1.00 0.00 C ATOM 1209 O THR A 331 -0.638 3.940 5.237 1.00 0.00 O ATOM 1210 CB THR A 331 0.797 6.414 4.916 1.00 0.00 C ATOM 1211 OG1 THR A 331 1.384 7.558 5.545 1.00 0.00 O ATOM 1212 CG2 THR A 331 1.010 6.491 3.411 1.00 0.00 C ATOM 0 H THR A 331 -0.656 5.891 7.300 1.00 0.00 H new ATOM 0 HA THR A 331 -1.237 7.096 4.677 1.00 0.00 H new ATOM 0 HB THR A 331 1.276 5.509 5.289 1.00 0.00 H new ATOM 0 HG1 THR A 331 2.335 7.388 5.711 1.00 0.00 H new ATOM 0 HG21 THR A 331 2.077 6.543 3.197 1.00 0.00 H new ATOM 0 HG22 THR A 331 0.588 5.604 2.938 1.00 0.00 H new ATOM 0 HG23 THR A 331 0.517 7.381 3.019 1.00 0.00 H new ATOM 1220 N SER A 332 -2.343 4.930 4.154 1.00 0.00 N ATOM 1221 CA SER A 332 -2.950 3.673 3.733 1.00 0.00 C ATOM 1222 C SER A 332 -2.207 3.085 2.537 1.00 0.00 C ATOM 1223 O SER A 332 -1.649 3.815 1.717 1.00 0.00 O ATOM 1224 CB SER A 332 -4.423 3.887 3.377 1.00 0.00 C ATOM 1225 OG SER A 332 -5.210 4.057 4.544 1.00 0.00 O ATOM 0 H SER A 332 -2.844 5.764 3.846 1.00 0.00 H new ATOM 0 HA SER A 332 -2.882 2.970 4.563 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.522 4.764 2.737 1.00 0.00 H new ATOM 0 HB3 SER A 332 -4.791 3.033 2.808 1.00 0.00 H new ATOM 0 HG SER A 332 -6.147 4.194 4.290 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.205 1.760 2.444 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.531 1.071 1.349 1.00 0.00 C ATOM 1233 C LEU A 333 -2.343 -0.132 0.880 1.00 0.00 C ATOM 1234 O LEU A 333 -2.832 -0.918 1.692 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.136 0.620 1.785 1.00 0.00 C ATOM 1236 CG LEU A 333 0.821 1.730 2.224 1.00 0.00 C ATOM 1237 CD1 LEU A 333 2.136 1.139 2.710 1.00 0.00 C ATOM 1238 CD2 LEU A 333 1.063 2.707 1.083 1.00 0.00 C ATOM 0 H LEU A 333 -2.662 1.141 3.113 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.437 1.769 0.517 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.245 -0.085 2.609 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.323 0.077 0.959 1.00 0.00 H new ATOM 0 HG LEU A 333 0.363 2.273 3.050 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.804 1.943 3.018 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.947 0.479 3.557 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.600 0.571 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.746 3.490 1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.500 2.177 0.237 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.116 3.155 0.781 1.00 0.00 H new ATOM 1250 N SER A 334 -2.480 -0.272 -0.434 1.00 0.00 N ATOM 1251 CA SER A 334 -3.234 -1.379 -1.011 1.00 0.00 C ATOM 1252 C SER A 334 -2.328 -2.273 -1.852 1.00 0.00 C ATOM 1253 O SER A 334 -1.577 -1.792 -2.700 1.00 0.00 O ATOM 1254 CB SER A 334 -4.385 -0.848 -1.869 1.00 0.00 C ATOM 1255 OG SER A 334 -5.254 -1.896 -2.261 1.00 0.00 O ATOM 0 H SER A 334 -2.079 0.367 -1.120 1.00 0.00 H new ATOM 0 HA SER A 334 -3.644 -1.972 -0.194 1.00 0.00 H new ATOM 0 HB2 SER A 334 -4.944 -0.098 -1.309 1.00 0.00 H new ATOM 0 HB3 SER A 334 -3.985 -0.353 -2.754 1.00 0.00 H new ATOM 0 HG SER A 334 -6.122 -1.522 -2.518 1.00 0.00 H new ATOM 1261 N MET A 335 -2.405 -3.577 -1.610 1.00 0.00 N ATOM 1262 CA MET A 335 -1.594 -4.540 -2.346 1.00 0.00 C ATOM 1263 C MET A 335 -2.398 -5.180 -3.474 1.00 0.00 C ATOM 1264 O MET A 335 -1.841 -5.584 -4.495 1.00 0.00 O ATOM 1265 CB MET A 335 -1.067 -5.622 -1.402 1.00 0.00 C ATOM 1266 CG MET A 335 0.129 -5.178 -0.576 1.00 0.00 C ATOM 1267 SD MET A 335 0.922 -6.546 0.291 1.00 0.00 S ATOM 1268 CE MET A 335 1.509 -7.526 -1.088 1.00 0.00 C ATOM 0 H MET A 335 -3.021 -3.991 -0.910 1.00 0.00 H new ATOM 0 HA MET A 335 -0.750 -4.007 -2.783 1.00 0.00 H new ATOM 0 HB2 MET A 335 -1.869 -5.928 -0.730 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.789 -6.499 -1.987 1.00 0.00 H new ATOM 0 HG2 MET A 335 0.857 -4.696 -1.228 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.193 -4.431 0.150 1.00 0.00 H new ATOM 0 HE1 MET A 335 2.361 -8.127 -0.771 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.711 -8.183 -1.434 1.00 0.00 H new ATOM 0 HE3 MET A 335 1.813 -6.866 -1.900 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.710 -5.269 -3.282 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.591 -5.859 -4.282 1.00 0.00 C ATOM 1280 C LYS A 336 -4.796 -4.907 -5.456 1.00 0.00 C ATOM 1281 O LYS A 336 -5.110 -5.334 -6.567 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.942 -6.213 -3.656 1.00 0.00 C ATOM 1283 CG LYS A 336 -6.714 -5.006 -3.153 1.00 0.00 C ATOM 1284 CD LYS A 336 -8.168 -5.349 -2.877 1.00 0.00 C ATOM 1285 CE LYS A 336 -8.877 -4.223 -2.140 1.00 0.00 C ATOM 1286 NZ LYS A 336 -10.029 -4.722 -1.340 1.00 0.00 N ATOM 0 H LYS A 336 -4.186 -4.940 -2.442 1.00 0.00 H new ATOM 0 HA LYS A 336 -4.120 -6.769 -4.653 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -6.548 -6.740 -4.393 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.779 -6.901 -2.827 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.249 -4.629 -2.242 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -6.662 -4.206 -3.892 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -8.681 -5.549 -3.818 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -8.221 -6.263 -2.285 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -8.170 -3.718 -1.482 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -9.228 -3.483 -2.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -10.239 -4.048 -0.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -10.862 -4.819 -1.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -9.792 -5.648 -0.930 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.616 -3.615 -5.202 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.779 -2.602 -6.239 1.00 0.00 C ATOM 1302 C ASP A 337 -3.452 -2.318 -6.934 1.00 0.00 C ATOM 1303 O ASP A 337 -3.321 -1.339 -7.669 1.00 0.00 O ATOM 1304 CB ASP A 337 -5.341 -1.313 -5.638 1.00 0.00 C ATOM 1305 CG ASP A 337 -6.185 -0.533 -6.626 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -5.687 -0.247 -7.736 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -7.343 -0.209 -6.291 1.00 0.00 O ATOM 0 H ASP A 337 -4.357 -3.245 -4.287 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.481 -2.985 -6.980 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -5.943 -1.556 -4.763 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -4.518 -0.687 -5.294 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.468 -3.180 -6.697 1.00 0.00 N ATOM 1313 CA VAL A 338 -1.150 -3.022 -7.300 1.00 0.00 C ATOM 1314 C VAL A 338 -0.687 -4.318 -7.956 1.00 0.00 C ATOM 1315 O VAL A 338 -0.994 -5.411 -7.479 1.00 0.00 O ATOM 1316 CB VAL A 338 -0.104 -2.585 -6.257 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.278 -2.507 -6.888 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.494 -1.251 -5.639 1.00 0.00 C ATOM 0 H VAL A 338 -2.559 -3.995 -6.091 1.00 0.00 H new ATOM 0 HA VAL A 338 -1.241 -2.246 -8.060 1.00 0.00 H new ATOM 0 HB VAL A 338 -0.073 -3.331 -5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 338 2.004 -2.197 -6.137 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.556 -3.486 -7.278 1.00 0.00 H new ATOM 0 HG13 VAL A 338 1.266 -1.782 -7.702 1.00 0.00 H new ATOM 0 HG21 VAL A 338 0.256 -0.957 -4.904 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.554 -0.492 -6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.463 -1.346 -5.150 1.00 0.00 H new ATOM 1328 N ASP A 339 0.053 -4.189 -9.051 1.00 0.00 N ATOM 1329 CA ASP A 339 0.561 -5.350 -9.773 1.00 0.00 C ATOM 1330 C ASP A 339 2.014 -5.628 -9.400 1.00 0.00 C ATOM 1331 O ASP A 339 2.917 -4.890 -9.793 1.00 0.00 O ATOM 1332 CB ASP A 339 0.441 -5.132 -11.282 1.00 0.00 C ATOM 1333 CG ASP A 339 0.354 -6.436 -12.050 1.00 0.00 C ATOM 1334 OD1 ASP A 339 -0.333 -7.362 -11.571 1.00 0.00 O ATOM 1335 OD2 ASP A 339 0.973 -6.530 -13.130 1.00 0.00 O ATOM 0 H ASP A 339 0.315 -3.291 -9.459 1.00 0.00 H new ATOM 0 HA ASP A 339 -0.040 -6.214 -9.490 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -0.444 -4.531 -11.490 1.00 0.00 H new ATOM 0 HB3 ASP A 339 1.302 -4.563 -11.634 1.00 0.00 H new ATOM 1340 N GLN A 340 2.230 -6.697 -8.640 1.00 0.00 N ATOM 1341 CA GLN A 340 3.573 -7.071 -8.213 1.00 0.00 C ATOM 1342 C GLN A 340 4.452 -7.407 -9.414 1.00 0.00 C ATOM 1343 O GLN A 340 5.677 -7.454 -9.304 1.00 0.00 O ATOM 1344 CB GLN A 340 3.514 -8.266 -7.260 1.00 0.00 C ATOM 1345 CG GLN A 340 2.601 -8.046 -6.065 1.00 0.00 C ATOM 1346 CD GLN A 340 3.030 -6.869 -5.211 1.00 0.00 C ATOM 1347 OE1 GLN A 340 4.198 -6.750 -4.839 1.00 0.00 O ATOM 1348 NE2 GLN A 340 2.086 -5.991 -4.895 1.00 0.00 N ATOM 0 H GLN A 340 1.493 -7.319 -8.308 1.00 0.00 H new ATOM 0 HA GLN A 340 4.011 -6.220 -7.691 1.00 0.00 H new ATOM 0 HB2 GLN A 340 3.173 -9.143 -7.811 1.00 0.00 H new ATOM 0 HB3 GLN A 340 4.520 -8.485 -6.903 1.00 0.00 H new ATOM 0 HG2 GLN A 340 1.582 -7.883 -6.416 1.00 0.00 H new ATOM 0 HG3 GLN A 340 2.586 -8.948 -5.453 1.00 0.00 H new ATOM 0 HE21 GLN A 340 1.131 -6.129 -5.225 1.00 0.00 H new ATOM 0 HE22 GLN A 340 2.316 -5.179 -4.322 1.00 0.00 H new ATOM 1357 N GLU A 341 3.818 -7.639 -10.559 1.00 0.00 N ATOM 1358 CA GLU A 341 4.543 -7.972 -11.779 1.00 0.00 C ATOM 1359 C GLU A 341 5.289 -6.754 -12.317 1.00 0.00 C ATOM 1360 O GLU A 341 6.520 -6.738 -12.369 1.00 0.00 O ATOM 1361 CB GLU A 341 3.580 -8.505 -12.842 1.00 0.00 C ATOM 1362 CG GLU A 341 2.319 -9.125 -12.265 1.00 0.00 C ATOM 1363 CD GLU A 341 2.614 -10.145 -11.181 1.00 0.00 C ATOM 1364 OE1 GLU A 341 3.757 -10.161 -10.678 1.00 0.00 O ATOM 1365 OE2 GLU A 341 1.703 -10.926 -10.837 1.00 0.00 O ATOM 0 H GLU A 341 2.804 -7.602 -10.667 1.00 0.00 H new ATOM 0 HA GLU A 341 5.271 -8.746 -11.539 1.00 0.00 H new ATOM 0 HB2 GLU A 341 3.301 -7.689 -13.509 1.00 0.00 H new ATOM 0 HB3 GLU A 341 4.097 -9.250 -13.447 1.00 0.00 H new ATOM 0 HG2 GLU A 341 1.686 -8.338 -11.855 1.00 0.00 H new ATOM 0 HG3 GLU A 341 1.755 -9.604 -13.065 1.00 0.00 H new ATOM 1372 N THR A 342 4.535 -5.735 -12.718 1.00 0.00 N ATOM 1373 CA THR A 342 5.123 -4.514 -13.254 1.00 0.00 C ATOM 1374 C THR A 342 4.917 -3.341 -12.303 1.00 0.00 C ATOM 1375 O THR A 342 5.779 -2.473 -12.176 1.00 0.00 O ATOM 1376 CB THR A 342 4.524 -4.158 -14.628 1.00 0.00 C ATOM 1377 OG1 THR A 342 4.843 -2.803 -14.966 1.00 0.00 O ATOM 1378 CG2 THR A 342 3.014 -4.343 -14.624 1.00 0.00 C ATOM 0 H THR A 342 3.516 -5.731 -12.682 1.00 0.00 H new ATOM 0 HA THR A 342 6.191 -4.702 -13.369 1.00 0.00 H new ATOM 0 HB THR A 342 4.955 -4.828 -15.372 1.00 0.00 H new ATOM 0 HG1 THR A 342 4.460 -2.585 -15.841 1.00 0.00 H new ATOM 0 HG21 THR A 342 2.613 -4.086 -15.604 1.00 0.00 H new ATOM 0 HG22 THR A 342 2.775 -5.382 -14.396 1.00 0.00 H new ATOM 0 HG23 THR A 342 2.570 -3.694 -13.869 1.00 0.00 H new ATOM 1386 N GLY A 343 3.767 -3.321 -11.635 1.00 0.00 N ATOM 1387 CA GLY A 343 3.469 -2.250 -10.703 1.00 0.00 C ATOM 1388 C GLY A 343 2.674 -1.129 -11.343 1.00 0.00 C ATOM 1389 O GLY A 343 2.828 0.036 -10.978 1.00 0.00 O ATOM 0 H GLY A 343 3.037 -4.028 -11.723 1.00 0.00 H new ATOM 0 HA2 GLY A 343 2.909 -2.652 -9.859 1.00 0.00 H new ATOM 0 HA3 GLY A 343 4.401 -1.849 -10.305 1.00 0.00 H new ATOM 1393 N GLU A 344 1.822 -1.482 -12.301 1.00 0.00 N ATOM 1394 CA GLU A 344 1.002 -0.496 -12.994 1.00 0.00 C ATOM 1395 C GLU A 344 -0.151 -0.029 -12.110 1.00 0.00 C ATOM 1396 O GLU A 344 -0.323 -0.511 -10.990 1.00 0.00 O ATOM 1397 CB GLU A 344 0.455 -1.081 -14.298 1.00 0.00 C ATOM 1398 CG GLU A 344 1.364 -0.857 -15.494 1.00 0.00 C ATOM 1399 CD GLU A 344 1.023 -1.760 -16.663 1.00 0.00 C ATOM 1400 OE1 GLU A 344 0.956 -2.991 -16.461 1.00 0.00 O ATOM 1401 OE2 GLU A 344 0.823 -1.238 -17.780 1.00 0.00 O ATOM 0 H GLU A 344 1.682 -2.443 -12.614 1.00 0.00 H new ATOM 0 HA GLU A 344 1.631 0.364 -13.225 1.00 0.00 H new ATOM 0 HB2 GLU A 344 0.297 -2.152 -14.168 1.00 0.00 H new ATOM 0 HB3 GLU A 344 -0.519 -0.638 -14.505 1.00 0.00 H new ATOM 0 HG2 GLU A 344 1.292 0.184 -15.810 1.00 0.00 H new ATOM 0 HG3 GLU A 344 2.398 -1.029 -15.197 1.00 0.00 H new ATOM 1408 N ASP A 345 -0.937 0.912 -12.621 1.00 0.00 N ATOM 1409 CA ASP A 345 -2.073 1.445 -11.879 1.00 0.00 C ATOM 1410 C ASP A 345 -3.340 0.650 -12.181 1.00 0.00 C ATOM 1411 O ASP A 345 -4.028 0.909 -13.170 1.00 0.00 O ATOM 1412 CB ASP A 345 -2.288 2.920 -12.223 1.00 0.00 C ATOM 1413 CG ASP A 345 -3.736 3.344 -12.076 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -4.376 2.935 -11.084 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -4.230 4.085 -12.952 1.00 0.00 O ATOM 0 H ASP A 345 -0.808 1.321 -13.546 1.00 0.00 H new ATOM 0 HA ASP A 345 -1.854 1.356 -10.815 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -1.665 3.536 -11.575 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -1.961 3.103 -13.247 1.00 0.00 H new