USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=21 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 -31:sc= 0.271 USER MOD Set 1.2: A 336 LYS NZ :NH3+ -169:sc= 0.179 (180deg=0.137) 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= -0.315 X(o=-0.31,f=-0.014) 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 274 SER OG : rot 29:sc= 0.189 USER MOD Single : A 276 MET CE :methyl -164:sc= -0.1 (180deg=-0.856) USER MOD Single : A 277 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.33) USER MOD Single : A 280 CYS SG : rot 26:sc= -0.485 USER MOD Single : A 283 GLN : amide:sc= -2.99 K(o=-3,f=-3.6!) USER MOD Single : A 289 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.608) USER MOD Single : A 296 HIS : no HD1:sc= -0.658 X(o=-0.66,f=-0.61) USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0715) USER MOD Single : A 317 GLN : amide:sc= -0.383 X(o=-0.38,f=0) USER MOD Single : A 320 LYS NZ :NH3+ -149:sc= -1.34 (180deg=-4.23!) USER MOD Single : A 322 LYS NZ :NH3+ 166:sc= -0.0423 (180deg=-0.296) 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 -62:sc= 0.863 USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 331 THR OG1 : rot 170:sc= 0.0799 USER MOD Single : A 332 SER OG : rot -55:sc= -0.283 USER MOD Single : A 334 SER OG : rot 180:sc= -0.27 USER MOD Single : A 335 MET CE :methyl 161:sc= -0.197 (180deg=-0.988) USER MOD Single : A 340 GLN : amide:sc= 1.26 K(o=1.3,f=-3.1!) USER MOD Single : A 342 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.612 15.082 -0.099 1.00 0.00 N ATOM 67 CA GLU A 260 8.567 14.959 1.353 1.00 0.00 C ATOM 68 C GLU A 260 7.439 14.027 1.786 1.00 0.00 C ATOM 69 O GLU A 260 7.639 13.134 2.608 1.00 0.00 O ATOM 70 CB GLU A 260 8.384 16.334 1.998 1.00 0.00 C ATOM 71 CG GLU A 260 8.624 16.339 3.499 1.00 0.00 C ATOM 72 CD GLU A 260 10.094 16.225 3.854 1.00 0.00 C ATOM 73 OE1 GLU A 260 10.867 15.702 3.025 1.00 0.00 O ATOM 74 OE2 GLU A 260 10.471 16.660 4.963 1.00 0.00 O ATOM 0 HA GLU A 260 9.514 14.533 1.685 1.00 0.00 H new ATOM 0 HB2 GLU A 260 9.067 17.041 1.527 1.00 0.00 H new ATOM 0 HB3 GLU A 260 7.372 16.688 1.799 1.00 0.00 H new ATOM 0 HG2 GLU A 260 8.221 17.258 3.925 1.00 0.00 H new ATOM 0 HG3 GLU A 260 8.079 15.512 3.953 1.00 0.00 H new ATOM 81 N GLU A 261 6.253 14.244 1.226 1.00 0.00 N ATOM 82 CA GLU A 261 5.092 13.425 1.555 1.00 0.00 C ATOM 83 C GLU A 261 4.595 12.668 0.327 1.00 0.00 C ATOM 84 O GLU A 261 4.751 13.109 -0.811 1.00 0.00 O ATOM 85 CB GLU A 261 3.968 14.297 2.120 1.00 0.00 C ATOM 86 CG GLU A 261 4.339 15.006 3.411 1.00 0.00 C ATOM 87 CD GLU A 261 3.551 16.284 3.622 1.00 0.00 C ATOM 88 OE1 GLU A 261 2.304 16.215 3.641 1.00 0.00 O ATOM 89 OE2 GLU A 261 4.180 17.353 3.766 1.00 0.00 O ATOM 0 H GLU A 261 6.071 14.979 0.543 1.00 0.00 H new ATOM 0 HA GLU A 261 5.394 12.699 2.310 1.00 0.00 H new ATOM 0 HB2 GLU A 261 3.687 15.041 1.375 1.00 0.00 H new ATOM 0 HB3 GLU A 261 3.090 13.675 2.296 1.00 0.00 H new ATOM 0 HG2 GLU A 261 4.167 14.335 4.252 1.00 0.00 H new ATOM 0 HG3 GLU A 261 5.404 15.238 3.401 1.00 0.00 H new ATOM 96 N PRO A 262 3.981 11.498 0.562 1.00 0.00 N ATOM 97 CA PRO A 262 3.449 10.654 -0.511 1.00 0.00 C ATOM 98 C PRO A 262 2.227 11.272 -1.183 1.00 0.00 C ATOM 99 O PRO A 262 1.470 12.014 -0.556 1.00 0.00 O ATOM 100 CB PRO A 262 3.065 9.361 0.212 1.00 0.00 C ATOM 101 CG PRO A 262 2.813 9.775 1.620 1.00 0.00 C ATOM 102 CD PRO A 262 3.760 10.910 1.894 1.00 0.00 C ATOM 0 HA PRO A 262 4.173 10.511 -1.314 1.00 0.00 H new ATOM 0 HB2 PRO A 262 2.179 8.907 -0.232 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.864 8.622 0.154 1.00 0.00 H new ATOM 0 HG2 PRO A 262 1.778 10.089 1.755 1.00 0.00 H new ATOM 0 HG3 PRO A 262 2.987 8.947 2.307 1.00 0.00 H new ATOM 0 HD2 PRO A 262 3.330 11.634 2.587 1.00 0.00 H new ATOM 0 HD3 PRO A 262 4.691 10.558 2.338 1.00 0.00 H new ATOM 110 N THR A 263 2.039 10.961 -2.461 1.00 0.00 N ATOM 111 CA THR A 263 0.909 11.486 -3.218 1.00 0.00 C ATOM 112 C THR A 263 -0.206 10.452 -3.329 1.00 0.00 C ATOM 113 O THR A 263 0.035 9.303 -3.698 1.00 0.00 O ATOM 114 CB THR A 263 1.334 11.921 -4.633 1.00 0.00 C ATOM 115 OG1 THR A 263 2.358 12.918 -4.552 1.00 0.00 O ATOM 116 CG2 THR A 263 0.147 12.467 -5.411 1.00 0.00 C ATOM 0 H THR A 263 2.655 10.348 -2.994 1.00 0.00 H new ATOM 0 HA THR A 263 0.541 12.356 -2.674 1.00 0.00 H new ATOM 0 HB THR A 263 1.720 11.047 -5.157 1.00 0.00 H new ATOM 0 HG1 THR A 263 2.624 13.188 -5.456 1.00 0.00 H new ATOM 0 HG21 THR A 263 0.472 12.768 -6.407 1.00 0.00 H new ATOM 0 HG22 THR A 263 -0.618 11.695 -5.496 1.00 0.00 H new ATOM 0 HG23 THR A 263 -0.265 13.330 -4.888 1.00 0.00 H new ATOM 124 N ILE A 264 -1.426 10.869 -3.009 1.00 0.00 N ATOM 125 CA ILE A 264 -2.579 9.979 -3.076 1.00 0.00 C ATOM 126 C ILE A 264 -2.885 9.583 -4.516 1.00 0.00 C ATOM 127 O ILE A 264 -2.946 10.432 -5.405 1.00 0.00 O ATOM 128 CB ILE A 264 -3.830 10.630 -2.457 1.00 0.00 C ATOM 129 CG1 ILE A 264 -3.588 10.948 -0.980 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.036 9.718 -2.618 1.00 0.00 C ATOM 131 CD1 ILE A 264 -4.635 11.861 -0.380 1.00 0.00 C ATOM 0 H ILE A 264 -1.642 11.817 -2.701 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.323 9.088 -2.503 1.00 0.00 H new ATOM 0 HB ILE A 264 -4.033 11.564 -2.981 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -3.563 10.016 -0.415 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -2.608 11.412 -0.872 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -5.912 10.192 -2.176 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.217 9.538 -3.678 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -4.844 8.769 -2.116 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -4.400 12.044 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -4.645 12.808 -0.920 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -5.615 11.390 -0.456 1.00 0.00 H new ATOM 143 N GLY A 265 -3.079 8.287 -4.740 1.00 0.00 N ATOM 144 CA GLY A 265 -3.378 7.800 -6.074 1.00 0.00 C ATOM 145 C GLY A 265 -2.139 7.342 -6.816 1.00 0.00 C ATOM 146 O GLY A 265 -2.235 6.726 -7.878 1.00 0.00 O ATOM 0 H GLY A 265 -3.034 7.565 -4.021 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -4.083 6.972 -6.005 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -3.868 8.589 -6.644 1.00 0.00 H new ATOM 150 N ASP A 266 -0.972 7.643 -6.257 1.00 0.00 N ATOM 151 CA ASP A 266 0.293 7.258 -6.873 1.00 0.00 C ATOM 152 C ASP A 266 0.785 5.926 -6.317 1.00 0.00 C ATOM 153 O ASP A 266 0.548 5.603 -5.152 1.00 0.00 O ATOM 154 CB ASP A 266 1.347 8.342 -6.644 1.00 0.00 C ATOM 155 CG ASP A 266 1.347 9.391 -7.738 1.00 0.00 C ATOM 156 OD1 ASP A 266 0.248 9.781 -8.185 1.00 0.00 O ATOM 157 OD2 ASP A 266 2.446 9.822 -8.148 1.00 0.00 O ATOM 0 H ASP A 266 -0.876 8.152 -5.379 1.00 0.00 H new ATOM 0 HA ASP A 266 0.127 7.144 -7.944 1.00 0.00 H new ATOM 0 HB2 ASP A 266 1.166 8.824 -5.683 1.00 0.00 H new ATOM 0 HB3 ASP A 266 2.333 7.880 -6.588 1.00 0.00 H new ATOM 162 N ILE A 267 1.470 5.156 -7.157 1.00 0.00 N ATOM 163 CA ILE A 267 1.995 3.860 -6.748 1.00 0.00 C ATOM 164 C ILE A 267 3.454 3.968 -6.318 1.00 0.00 C ATOM 165 O ILE A 267 4.288 4.508 -7.045 1.00 0.00 O ATOM 166 CB ILE A 267 1.881 2.824 -7.882 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.414 2.607 -8.260 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.527 1.510 -7.466 1.00 0.00 C ATOM 169 CD1 ILE A 267 0.218 1.592 -9.364 1.00 0.00 C ATOM 0 H ILE A 267 1.674 5.408 -8.124 1.00 0.00 H new ATOM 0 HA ILE A 267 1.393 3.529 -5.902 1.00 0.00 H new ATOM 0 HB ILE A 267 2.409 3.205 -8.756 1.00 0.00 H new ATOM 0 HG12 ILE A 267 -0.136 2.282 -7.377 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -0.017 3.558 -8.572 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.438 0.788 -8.278 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.581 1.677 -7.243 1.00 0.00 H new ATOM 0 HG23 ILE A 267 2.025 1.122 -6.579 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -0.846 1.490 -9.579 1.00 0.00 H new ATOM 0 HD12 ILE A 267 0.740 1.925 -10.261 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.619 0.629 -9.048 1.00 0.00 H new ATOM 181 N TYR A 268 3.755 3.449 -5.133 1.00 0.00 N ATOM 182 CA TYR A 268 5.114 3.488 -4.605 1.00 0.00 C ATOM 183 C TYR A 268 5.584 2.092 -4.208 1.00 0.00 C ATOM 184 O TYR A 268 4.782 1.169 -4.076 1.00 0.00 O ATOM 185 CB TYR A 268 5.188 4.426 -3.399 1.00 0.00 C ATOM 186 CG TYR A 268 4.994 5.883 -3.752 1.00 0.00 C ATOM 187 CD1 TYR A 268 3.723 6.403 -3.963 1.00 0.00 C ATOM 188 CD2 TYR A 268 6.081 6.740 -3.873 1.00 0.00 C ATOM 189 CE1 TYR A 268 3.541 7.734 -4.287 1.00 0.00 C ATOM 190 CE2 TYR A 268 5.908 8.072 -4.195 1.00 0.00 C ATOM 191 CZ TYR A 268 4.636 8.564 -4.401 1.00 0.00 C ATOM 192 OH TYR A 268 4.459 9.891 -4.722 1.00 0.00 O ATOM 0 H TYR A 268 3.077 2.997 -4.520 1.00 0.00 H new ATOM 0 HA TYR A 268 5.771 3.863 -5.389 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.429 4.132 -2.674 1.00 0.00 H new ATOM 0 HB3 TYR A 268 6.156 4.304 -2.914 1.00 0.00 H new ATOM 0 HD1 TYR A 268 2.863 5.756 -3.872 1.00 0.00 H new ATOM 0 HD2 TYR A 268 7.078 6.358 -3.713 1.00 0.00 H new ATOM 0 HE1 TYR A 268 2.546 8.122 -4.450 1.00 0.00 H new ATOM 0 HE2 TYR A 268 6.764 8.725 -4.285 1.00 0.00 H new ATOM 0 HH TYR A 268 5.331 10.337 -4.762 1.00 0.00 H new ATOM 202 N ASN A 269 6.892 1.947 -4.019 1.00 0.00 N ATOM 203 CA ASN A 269 7.471 0.664 -3.636 1.00 0.00 C ATOM 204 C ASN A 269 7.621 0.565 -2.121 1.00 0.00 C ATOM 205 O ASN A 269 8.063 1.508 -1.468 1.00 0.00 O ATOM 206 CB ASN A 269 8.832 0.475 -4.309 1.00 0.00 C ATOM 207 CG ASN A 269 8.848 0.985 -5.736 1.00 0.00 C ATOM 208 OD1 ASN A 269 9.166 2.147 -5.989 1.00 0.00 O ATOM 209 ND2 ASN A 269 8.503 0.116 -6.679 1.00 0.00 N ATOM 0 H ASN A 269 7.570 2.701 -4.125 1.00 0.00 H new ATOM 0 HA ASN A 269 6.796 -0.125 -3.968 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.595 0.996 -3.731 1.00 0.00 H new ATOM 0 HB3 ASN A 269 9.094 -0.583 -4.301 1.00 0.00 H new ATOM 0 HD21 ASN A 269 8.495 0.402 -7.658 1.00 0.00 H new ATOM 0 HD22 ASN A 269 8.246 -0.838 -6.424 1.00 0.00 H new ATOM 216 N GLY A 270 7.249 -0.586 -1.569 1.00 0.00 N ATOM 217 CA GLY A 270 7.351 -0.788 -0.136 1.00 0.00 C ATOM 218 C GLY A 270 7.659 -2.228 0.227 1.00 0.00 C ATOM 219 O GLY A 270 7.548 -3.124 -0.610 1.00 0.00 O ATOM 0 H GLY A 270 6.879 -1.382 -2.089 1.00 0.00 H new ATOM 0 HA2 GLY A 270 8.131 -0.141 0.264 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.416 -0.489 0.337 1.00 0.00 H new ATOM 223 N LYS A 271 8.050 -2.450 1.477 1.00 0.00 N ATOM 224 CA LYS A 271 8.377 -3.790 1.949 1.00 0.00 C ATOM 225 C LYS A 271 7.674 -4.088 3.270 1.00 0.00 C ATOM 226 O LYS A 271 7.494 -3.200 4.103 1.00 0.00 O ATOM 227 CB LYS A 271 9.891 -3.938 2.121 1.00 0.00 C ATOM 228 CG LYS A 271 10.306 -5.261 2.741 1.00 0.00 C ATOM 229 CD LYS A 271 11.661 -5.156 3.422 1.00 0.00 C ATOM 230 CE LYS A 271 11.553 -4.474 4.777 1.00 0.00 C ATOM 231 NZ LYS A 271 12.889 -4.100 5.318 1.00 0.00 N ATOM 0 H LYS A 271 8.148 -1.719 2.182 1.00 0.00 H new ATOM 0 HA LYS A 271 8.030 -4.505 1.203 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.371 -3.836 1.147 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.259 -3.123 2.744 1.00 0.00 H new ATOM 0 HG2 LYS A 271 9.556 -5.575 3.467 1.00 0.00 H new ATOM 0 HG3 LYS A 271 10.344 -6.030 1.969 1.00 0.00 H new ATOM 0 HD2 LYS A 271 12.084 -6.153 3.548 1.00 0.00 H new ATOM 0 HD3 LYS A 271 12.347 -4.597 2.786 1.00 0.00 H new ATOM 0 HE2 LYS A 271 10.935 -3.581 4.686 1.00 0.00 H new ATOM 0 HE3 LYS A 271 11.050 -5.139 5.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 12.772 -3.638 6.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 13.470 -4.955 5.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 13.359 -3.445 4.661 1.00 0.00 H new ATOM 245 N VAL A 272 7.278 -5.344 3.454 1.00 0.00 N ATOM 246 CA VAL A 272 6.597 -5.759 4.675 1.00 0.00 C ATOM 247 C VAL A 272 7.562 -5.808 5.854 1.00 0.00 C ATOM 248 O VAL A 272 8.540 -6.557 5.840 1.00 0.00 O ATOM 249 CB VAL A 272 5.938 -7.141 4.507 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.573 -7.727 5.862 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.712 -7.041 3.612 1.00 0.00 C ATOM 0 H VAL A 272 7.417 -6.091 2.774 1.00 0.00 H new ATOM 0 HA VAL A 272 5.824 -5.017 4.874 1.00 0.00 H new ATOM 0 HB VAL A 272 6.654 -7.810 4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.109 -8.703 5.723 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.474 -7.836 6.466 1.00 0.00 H new ATOM 0 HG13 VAL A 272 4.874 -7.062 6.370 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.259 -8.026 3.504 1.00 0.00 H new ATOM 0 HG22 VAL A 272 3.990 -6.357 4.058 1.00 0.00 H new ATOM 0 HG23 VAL A 272 5.007 -6.668 2.631 1.00 0.00 H new ATOM 261 N THR A 273 7.282 -5.004 6.875 1.00 0.00 N ATOM 262 CA THR A 273 8.125 -4.955 8.062 1.00 0.00 C ATOM 263 C THR A 273 7.563 -5.835 9.173 1.00 0.00 C ATOM 264 O THR A 273 8.313 -6.415 9.958 1.00 0.00 O ATOM 265 CB THR A 273 8.271 -3.515 8.588 1.00 0.00 C ATOM 266 OG1 THR A 273 6.978 -2.933 8.790 1.00 0.00 O ATOM 267 CG2 THR A 273 9.070 -2.661 7.615 1.00 0.00 C ATOM 0 H THR A 273 6.477 -4.378 6.903 1.00 0.00 H new ATOM 0 HA THR A 273 9.106 -5.328 7.768 1.00 0.00 H new ATOM 0 HB THR A 273 8.805 -3.552 9.538 1.00 0.00 H new ATOM 0 HG1 THR A 273 7.080 -2.018 9.126 1.00 0.00 H new ATOM 0 HG21 THR A 273 9.160 -1.648 8.008 1.00 0.00 H new ATOM 0 HG22 THR A 273 10.064 -3.090 7.486 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.560 -2.632 6.652 1.00 0.00 H new ATOM 275 N SER A 274 6.238 -5.930 9.233 1.00 0.00 N ATOM 276 CA SER A 274 5.576 -6.737 10.251 1.00 0.00 C ATOM 277 C SER A 274 4.231 -7.251 9.745 1.00 0.00 C ATOM 278 O SER A 274 3.393 -6.477 9.282 1.00 0.00 O ATOM 279 CB SER A 274 5.374 -5.921 11.529 1.00 0.00 C ATOM 280 OG SER A 274 6.496 -6.033 12.387 1.00 0.00 O ATOM 0 H SER A 274 5.603 -5.458 8.589 1.00 0.00 H new ATOM 0 HA SER A 274 6.214 -7.593 10.473 1.00 0.00 H new ATOM 0 HB2 SER A 274 5.210 -4.874 11.274 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.480 -6.266 12.047 1.00 0.00 H new ATOM 0 HG SER A 274 7.302 -6.192 11.853 1.00 0.00 H new ATOM 286 N ILE A 275 4.033 -8.562 9.837 1.00 0.00 N ATOM 287 CA ILE A 275 2.791 -9.180 9.390 1.00 0.00 C ATOM 288 C ILE A 275 1.809 -9.338 10.546 1.00 0.00 C ATOM 289 O ILE A 275 2.133 -9.937 11.572 1.00 0.00 O ATOM 290 CB ILE A 275 3.045 -10.560 8.755 1.00 0.00 C ATOM 291 CG1 ILE A 275 3.924 -10.418 7.510 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.727 -11.233 8.405 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.396 -10.264 7.824 1.00 0.00 C ATOM 0 H ILE A 275 4.717 -9.216 10.217 1.00 0.00 H new ATOM 0 HA ILE A 275 2.361 -8.517 8.639 1.00 0.00 H new ATOM 0 HB ILE A 275 3.569 -11.186 9.478 1.00 0.00 H new ATOM 0 HG12 ILE A 275 3.786 -11.294 6.876 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.591 -9.553 6.936 1.00 0.00 H new ATOM 0 HG21 ILE A 275 1.924 -12.207 7.957 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.133 -11.363 9.310 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.178 -10.612 7.697 1.00 0.00 H new ATOM 0 HD11 ILE A 275 5.958 -10.169 6.895 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.547 -9.372 8.433 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.745 -11.140 8.371 1.00 0.00 H new ATOM 305 N MET A 276 0.607 -8.799 10.372 1.00 0.00 N ATOM 306 CA MET A 276 -0.424 -8.883 11.401 1.00 0.00 C ATOM 307 C MET A 276 -1.542 -9.829 10.973 1.00 0.00 C ATOM 308 O MET A 276 -1.784 -10.018 9.781 1.00 0.00 O ATOM 309 CB MET A 276 -0.998 -7.496 11.693 1.00 0.00 C ATOM 310 CG MET A 276 0.057 -6.469 12.073 1.00 0.00 C ATOM 311 SD MET A 276 0.959 -6.921 13.568 1.00 0.00 S ATOM 312 CE MET A 276 2.105 -5.551 13.699 1.00 0.00 C ATOM 0 H MET A 276 0.323 -8.300 9.529 1.00 0.00 H new ATOM 0 HA MET A 276 0.034 -9.276 12.308 1.00 0.00 H new ATOM 0 HB2 MET A 276 -1.537 -7.143 10.814 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.724 -7.575 12.502 1.00 0.00 H new ATOM 0 HG2 MET A 276 0.761 -6.355 11.249 1.00 0.00 H new ATOM 0 HG3 MET A 276 -0.421 -5.500 12.220 1.00 0.00 H new ATOM 0 HE1 MET A 276 2.907 -5.813 14.389 1.00 0.00 H new ATOM 0 HE2 MET A 276 2.526 -5.334 12.717 1.00 0.00 H new ATOM 0 HE3 MET A 276 1.579 -4.671 14.071 1.00 0.00 H new ATOM 322 N GLN A 277 -2.219 -10.419 11.953 1.00 0.00 N ATOM 323 CA GLN A 277 -3.310 -11.346 11.676 1.00 0.00 C ATOM 324 C GLN A 277 -4.350 -10.705 10.764 1.00 0.00 C ATOM 325 O GLN A 277 -5.052 -11.395 10.024 1.00 0.00 O ATOM 326 CB GLN A 277 -3.968 -11.797 12.982 1.00 0.00 C ATOM 327 CG GLN A 277 -3.176 -12.859 13.727 1.00 0.00 C ATOM 328 CD GLN A 277 -3.148 -14.187 12.995 1.00 0.00 C ATOM 329 OE1 GLN A 277 -2.235 -14.460 12.215 1.00 0.00 O ATOM 330 NE2 GLN A 277 -4.151 -15.021 13.243 1.00 0.00 N ATOM 0 H GLN A 277 -2.031 -10.272 12.945 1.00 0.00 H new ATOM 0 HA GLN A 277 -2.894 -12.216 11.167 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -4.099 -10.931 13.631 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -4.963 -12.185 12.763 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -2.155 -12.508 13.875 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -3.610 -13.003 14.717 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -4.887 -14.754 13.897 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -4.186 -15.929 12.780 1.00 0.00 H new ATOM 339 N PHE A 278 -4.446 -9.381 10.822 1.00 0.00 N ATOM 340 CA PHE A 278 -5.402 -8.646 10.002 1.00 0.00 C ATOM 341 C PHE A 278 -4.770 -8.222 8.679 1.00 0.00 C ATOM 342 O PHE A 278 -5.243 -8.594 7.606 1.00 0.00 O ATOM 343 CB PHE A 278 -5.912 -7.415 10.755 1.00 0.00 C ATOM 344 CG PHE A 278 -4.911 -6.844 11.718 1.00 0.00 C ATOM 345 CD1 PHE A 278 -4.833 -7.318 13.018 1.00 0.00 C ATOM 346 CD2 PHE A 278 -4.049 -5.834 11.324 1.00 0.00 C ATOM 347 CE1 PHE A 278 -3.912 -6.795 13.907 1.00 0.00 C ATOM 348 CE2 PHE A 278 -3.127 -5.307 12.208 1.00 0.00 C ATOM 349 CZ PHE A 278 -3.059 -5.787 13.502 1.00 0.00 C ATOM 0 H PHE A 278 -3.873 -8.795 11.429 1.00 0.00 H new ATOM 0 HA PHE A 278 -6.243 -9.306 9.788 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -6.189 -6.647 10.033 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.817 -7.682 11.300 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -5.499 -8.105 13.340 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -4.098 -5.454 10.314 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -3.860 -7.174 14.917 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -2.460 -4.520 11.888 1.00 0.00 H new ATOM 0 HZ PHE A 278 -2.341 -5.375 14.195 1.00 0.00 H new ATOM 359 N GLY A 279 -3.699 -7.439 8.766 1.00 0.00 N ATOM 360 CA GLY A 279 -3.020 -6.976 7.569 1.00 0.00 C ATOM 361 C GLY A 279 -1.512 -7.005 7.711 1.00 0.00 C ATOM 362 O GLY A 279 -0.980 -7.618 8.637 1.00 0.00 O ATOM 0 H GLY A 279 -3.290 -7.117 9.643 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.314 -7.599 6.724 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.341 -5.959 7.343 1.00 0.00 H new ATOM 366 N CYS A 280 -0.820 -6.343 6.790 1.00 0.00 N ATOM 367 CA CYS A 280 0.638 -6.298 6.815 1.00 0.00 C ATOM 368 C CYS A 280 1.139 -4.860 6.737 1.00 0.00 C ATOM 369 O CYS A 280 0.660 -4.067 5.925 1.00 0.00 O ATOM 370 CB CYS A 280 1.214 -7.115 5.656 1.00 0.00 C ATOM 371 SG CYS A 280 0.945 -6.377 4.028 1.00 0.00 S ATOM 0 H CYS A 280 -1.245 -5.830 6.017 1.00 0.00 H new ATOM 0 HA CYS A 280 0.974 -6.730 7.758 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.285 -7.243 5.813 1.00 0.00 H new ATOM 0 HB3 CYS A 280 0.769 -8.110 5.670 1.00 0.00 H new ATOM 0 HG CYS A 280 0.818 -5.089 4.151 1.00 0.00 H new ATOM 377 N PHE A 281 2.104 -4.528 7.588 1.00 0.00 N ATOM 378 CA PHE A 281 2.669 -3.184 7.618 1.00 0.00 C ATOM 379 C PHE A 281 3.809 -3.050 6.612 1.00 0.00 C ATOM 380 O PHE A 281 4.899 -3.585 6.818 1.00 0.00 O ATOM 381 CB PHE A 281 3.172 -2.850 9.024 1.00 0.00 C ATOM 382 CG PHE A 281 2.081 -2.431 9.967 1.00 0.00 C ATOM 383 CD1 PHE A 281 1.552 -1.151 9.911 1.00 0.00 C ATOM 384 CD2 PHE A 281 1.584 -3.316 10.910 1.00 0.00 C ATOM 385 CE1 PHE A 281 0.548 -0.762 10.777 1.00 0.00 C ATOM 386 CE2 PHE A 281 0.579 -2.933 11.778 1.00 0.00 C ATOM 387 CZ PHE A 281 0.061 -1.654 11.713 1.00 0.00 C ATOM 0 H PHE A 281 2.511 -5.172 8.266 1.00 0.00 H new ATOM 0 HA PHE A 281 1.883 -2.481 7.345 1.00 0.00 H new ATOM 0 HB2 PHE A 281 3.682 -3.721 9.435 1.00 0.00 H new ATOM 0 HB3 PHE A 281 3.910 -2.051 8.957 1.00 0.00 H new ATOM 0 HD1 PHE A 281 1.929 -0.449 9.182 1.00 0.00 H new ATOM 0 HD2 PHE A 281 1.986 -4.317 10.967 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.144 0.238 10.722 1.00 0.00 H new ATOM 0 HE2 PHE A 281 0.199 -3.633 12.507 1.00 0.00 H new ATOM 0 HZ PHE A 281 -0.723 -1.352 12.392 1.00 0.00 H new ATOM 397 N VAL A 282 3.549 -2.333 5.524 1.00 0.00 N ATOM 398 CA VAL A 282 4.552 -2.127 4.486 1.00 0.00 C ATOM 399 C VAL A 282 5.118 -0.713 4.541 1.00 0.00 C ATOM 400 O VAL A 282 4.370 0.264 4.580 1.00 0.00 O ATOM 401 CB VAL A 282 3.969 -2.381 3.083 1.00 0.00 C ATOM 402 CG1 VAL A 282 5.019 -2.124 2.013 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.427 -3.799 2.981 1.00 0.00 C ATOM 0 H VAL A 282 2.652 -1.885 5.338 1.00 0.00 H new ATOM 0 HA VAL A 282 5.352 -2.843 4.673 1.00 0.00 H new ATOM 0 HB VAL A 282 3.143 -1.688 2.920 1.00 0.00 H new ATOM 0 HG11 VAL A 282 4.588 -2.309 1.029 1.00 0.00 H new ATOM 0 HG12 VAL A 282 5.355 -1.089 2.074 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.868 -2.790 2.169 1.00 0.00 H new ATOM 0 HG21 VAL A 282 3.019 -3.962 1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 282 4.232 -4.510 3.164 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.641 -3.942 3.722 1.00 0.00 H new ATOM 413 N GLN A 283 6.443 -0.611 4.542 1.00 0.00 N ATOM 414 CA GLN A 283 7.109 0.686 4.592 1.00 0.00 C ATOM 415 C GLN A 283 7.440 1.182 3.189 1.00 0.00 C ATOM 416 O GLN A 283 8.027 0.456 2.385 1.00 0.00 O ATOM 417 CB GLN A 283 8.386 0.595 5.429 1.00 0.00 C ATOM 418 CG GLN A 283 8.864 1.937 5.959 1.00 0.00 C ATOM 419 CD GLN A 283 8.252 2.285 7.302 1.00 0.00 C ATOM 420 OE1 GLN A 283 7.910 1.401 8.088 1.00 0.00 O ATOM 421 NE2 GLN A 283 8.112 3.577 7.571 1.00 0.00 N ATOM 0 H GLN A 283 7.076 -1.410 4.509 1.00 0.00 H new ATOM 0 HA GLN A 283 6.428 1.398 5.058 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.212 -0.077 6.269 1.00 0.00 H new ATOM 0 HB3 GLN A 283 9.176 0.151 4.824 1.00 0.00 H new ATOM 0 HG2 GLN A 283 9.950 1.921 6.052 1.00 0.00 H new ATOM 0 HG3 GLN A 283 8.617 2.717 5.238 1.00 0.00 H new ATOM 0 HE21 GLN A 283 8.410 4.275 6.889 1.00 0.00 H new ATOM 0 HE22 GLN A 283 7.707 3.872 8.459 1.00 0.00 H new ATOM 430 N LEU A 284 7.060 2.422 2.900 1.00 0.00 N ATOM 431 CA LEU A 284 7.317 3.016 1.592 1.00 0.00 C ATOM 432 C LEU A 284 8.784 3.408 1.451 1.00 0.00 C ATOM 433 O LEU A 284 9.419 3.828 2.417 1.00 0.00 O ATOM 434 CB LEU A 284 6.426 4.242 1.384 1.00 0.00 C ATOM 435 CG LEU A 284 4.919 3.999 1.470 1.00 0.00 C ATOM 436 CD1 LEU A 284 4.160 5.313 1.368 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.471 3.037 0.380 1.00 0.00 C ATOM 0 H LEU A 284 6.573 3.036 3.553 1.00 0.00 H new ATOM 0 HA LEU A 284 7.085 2.272 0.830 1.00 0.00 H new ATOM 0 HB2 LEU A 284 6.696 4.992 2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 284 6.650 4.667 0.406 1.00 0.00 H new ATOM 0 HG LEU A 284 4.698 3.549 2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 284 3.089 5.120 1.431 1.00 0.00 H new ATOM 0 HD12 LEU A 284 4.459 5.970 2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 284 4.387 5.791 0.415 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.396 2.876 0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 284 4.706 3.459 -0.597 1.00 0.00 H new ATOM 0 HD23 LEU A 284 4.990 2.086 0.498 1.00 0.00 H new ATOM 449 N GLU A 285 9.314 3.270 0.240 1.00 0.00 N ATOM 450 CA GLU A 285 10.706 3.612 -0.028 1.00 0.00 C ATOM 451 C GLU A 285 10.801 4.826 -0.948 1.00 0.00 C ATOM 452 O GLU A 285 9.794 5.304 -1.468 1.00 0.00 O ATOM 453 CB GLU A 285 11.435 2.423 -0.657 1.00 0.00 C ATOM 454 CG GLU A 285 11.637 1.259 0.298 1.00 0.00 C ATOM 455 CD GLU A 285 12.463 0.142 -0.310 1.00 0.00 C ATOM 456 OE1 GLU A 285 11.920 -0.610 -1.147 1.00 0.00 O ATOM 457 OE2 GLU A 285 13.652 0.020 0.050 1.00 0.00 O ATOM 0 H GLU A 285 8.801 2.924 -0.571 1.00 0.00 H new ATOM 0 HA GLU A 285 11.181 3.859 0.921 1.00 0.00 H new ATOM 0 HB2 GLU A 285 10.870 2.078 -1.523 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.407 2.755 -1.022 1.00 0.00 H new ATOM 0 HG2 GLU A 285 12.128 1.617 1.203 1.00 0.00 H new ATOM 0 HG3 GLU A 285 10.665 0.866 0.597 1.00 0.00 H new ATOM 464 N GLY A 286 12.020 5.319 -1.143 1.00 0.00 N ATOM 465 CA GLY A 286 12.226 6.473 -1.999 1.00 0.00 C ATOM 466 C GLY A 286 11.918 7.780 -1.295 1.00 0.00 C ATOM 467 O GLY A 286 12.718 8.716 -1.330 1.00 0.00 O ATOM 0 H GLY A 286 12.869 4.940 -0.723 1.00 0.00 H new ATOM 0 HA2 GLY A 286 13.260 6.485 -2.345 1.00 0.00 H new ATOM 0 HA3 GLY A 286 11.595 6.383 -2.883 1.00 0.00 H new ATOM 471 N LEU A 287 10.755 7.846 -0.656 1.00 0.00 N ATOM 472 CA LEU A 287 10.342 9.049 0.058 1.00 0.00 C ATOM 473 C LEU A 287 11.314 9.372 1.188 1.00 0.00 C ATOM 474 O LEU A 287 11.681 8.498 1.974 1.00 0.00 O ATOM 475 CB LEU A 287 8.930 8.873 0.620 1.00 0.00 C ATOM 476 CG LEU A 287 7.804 8.786 -0.411 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.503 8.364 0.254 1.00 0.00 C ATOM 478 CD2 LEU A 287 7.632 10.118 -1.127 1.00 0.00 C ATOM 0 H LEU A 287 10.082 7.081 -0.618 1.00 0.00 H new ATOM 0 HA LEU A 287 10.345 9.880 -0.648 1.00 0.00 H new ATOM 0 HB2 LEU A 287 8.912 7.967 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.720 9.708 1.289 1.00 0.00 H new ATOM 0 HG LEU A 287 8.072 8.031 -1.150 1.00 0.00 H new ATOM 0 HD11 LEU A 287 5.713 8.307 -0.495 1.00 0.00 H new ATOM 0 HD12 LEU A 287 6.632 7.387 0.719 1.00 0.00 H new ATOM 0 HD13 LEU A 287 6.230 9.095 1.015 1.00 0.00 H new ATOM 0 HD21 LEU A 287 6.827 10.037 -1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 287 7.387 10.893 -0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 287 8.559 10.379 -1.637 1.00 0.00 H new ATOM 490 N ARG A 288 11.727 10.633 1.265 1.00 0.00 N ATOM 491 CA ARG A 288 12.656 11.071 2.299 1.00 0.00 C ATOM 492 C ARG A 288 12.245 10.528 3.665 1.00 0.00 C ATOM 493 O ARG A 288 13.049 9.918 4.370 1.00 0.00 O ATOM 494 CB ARG A 288 12.718 12.599 2.345 1.00 0.00 C ATOM 495 CG ARG A 288 13.623 13.204 1.283 1.00 0.00 C ATOM 496 CD ARG A 288 15.088 12.924 1.575 1.00 0.00 C ATOM 497 NE ARG A 288 15.670 13.926 2.464 1.00 0.00 N ATOM 498 CZ ARG A 288 15.664 13.826 3.789 1.00 0.00 C ATOM 499 NH1 ARG A 288 15.109 12.774 4.375 1.00 0.00 N ATOM 500 NH2 ARG A 288 16.214 14.779 4.530 1.00 0.00 N ATOM 0 H ARG A 288 11.433 11.369 0.623 1.00 0.00 H new ATOM 0 HA ARG A 288 13.644 10.681 2.053 1.00 0.00 H new ATOM 0 HB2 ARG A 288 11.711 12.999 2.223 1.00 0.00 H new ATOM 0 HB3 ARG A 288 13.068 12.911 3.329 1.00 0.00 H new ATOM 0 HG2 ARG A 288 13.361 12.798 0.306 1.00 0.00 H new ATOM 0 HG3 ARG A 288 13.460 14.281 1.235 1.00 0.00 H new ATOM 0 HD2 ARG A 288 15.185 11.937 2.028 1.00 0.00 H new ATOM 0 HD3 ARG A 288 15.646 12.902 0.639 1.00 0.00 H new ATOM 0 HE ARG A 288 16.105 14.748 2.045 1.00 0.00 H new ATOM 0 HH11 ARG A 288 14.685 12.039 3.809 1.00 0.00 H new ATOM 0 HH12 ARG A 288 15.106 12.700 5.392 1.00 0.00 H new ATOM 0 HH21 ARG A 288 16.642 15.590 4.083 1.00 0.00 H new ATOM 0 HH22 ARG A 288 16.209 14.701 5.547 1.00 0.00 H new ATOM 514 N LYS A 289 10.988 10.753 4.032 1.00 0.00 N ATOM 515 CA LYS A 289 10.469 10.286 5.312 1.00 0.00 C ATOM 516 C LYS A 289 9.726 8.964 5.148 1.00 0.00 C ATOM 517 O LYS A 289 8.517 8.945 4.920 1.00 0.00 O ATOM 518 CB LYS A 289 9.535 11.335 5.920 1.00 0.00 C ATOM 519 CG LYS A 289 9.525 11.333 7.439 1.00 0.00 C ATOM 520 CD LYS A 289 8.324 12.082 7.990 1.00 0.00 C ATOM 521 CE LYS A 289 8.546 13.587 7.966 1.00 0.00 C ATOM 522 NZ LYS A 289 8.107 14.192 6.679 1.00 0.00 N ATOM 0 H LYS A 289 10.309 11.256 3.461 1.00 0.00 H new ATOM 0 HA LYS A 289 11.314 10.128 5.982 1.00 0.00 H new ATOM 0 HB2 LYS A 289 9.834 12.323 5.568 1.00 0.00 H new ATOM 0 HB3 LYS A 289 8.522 11.161 5.558 1.00 0.00 H new ATOM 0 HG2 LYS A 289 9.512 10.305 7.802 1.00 0.00 H new ATOM 0 HG3 LYS A 289 10.442 11.791 7.810 1.00 0.00 H new ATOM 0 HD2 LYS A 289 7.439 11.834 7.404 1.00 0.00 H new ATOM 0 HD3 LYS A 289 8.130 11.758 9.012 1.00 0.00 H new ATOM 0 HE2 LYS A 289 8.000 14.048 8.789 1.00 0.00 H new ATOM 0 HE3 LYS A 289 9.603 13.801 8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 8.884 14.755 6.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 7.845 13.438 6.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 7.285 14.806 6.847 1.00 0.00 H new ATOM 536 N ARG A 290 10.458 7.861 5.266 1.00 0.00 N ATOM 537 CA ARG A 290 9.869 6.534 5.131 1.00 0.00 C ATOM 538 C ARG A 290 8.544 6.449 5.884 1.00 0.00 C ATOM 539 O ARG A 290 8.505 6.577 7.108 1.00 0.00 O ATOM 540 CB ARG A 290 10.834 5.468 5.654 1.00 0.00 C ATOM 541 CG ARG A 290 11.068 5.541 7.153 1.00 0.00 C ATOM 542 CD ARG A 290 12.425 4.968 7.534 1.00 0.00 C ATOM 543 NE ARG A 290 12.643 4.991 8.977 1.00 0.00 N ATOM 544 CZ ARG A 290 13.791 4.649 9.552 1.00 0.00 C ATOM 545 NH1 ARG A 290 14.818 4.260 8.810 1.00 0.00 N ATOM 546 NH2 ARG A 290 13.913 4.697 10.873 1.00 0.00 N ATOM 0 H ARG A 290 11.460 7.860 5.455 1.00 0.00 H new ATOM 0 HA ARG A 290 9.679 6.354 4.073 1.00 0.00 H new ATOM 0 HB2 ARG A 290 10.443 4.482 5.404 1.00 0.00 H new ATOM 0 HB3 ARG A 290 11.790 5.572 5.140 1.00 0.00 H new ATOM 0 HG2 ARG A 290 11.004 6.578 7.482 1.00 0.00 H new ATOM 0 HG3 ARG A 290 10.282 4.993 7.672 1.00 0.00 H new ATOM 0 HD2 ARG A 290 12.500 3.942 7.172 1.00 0.00 H new ATOM 0 HD3 ARG A 290 13.211 5.539 7.039 1.00 0.00 H new ATOM 0 HE ARG A 290 11.872 5.286 9.577 1.00 0.00 H new ATOM 0 HH11 ARG A 290 14.728 4.223 7.795 1.00 0.00 H new ATOM 0 HH12 ARG A 290 15.698 3.998 9.254 1.00 0.00 H new ATOM 0 HH21 ARG A 290 13.125 4.997 11.447 1.00 0.00 H new ATOM 0 HH22 ARG A 290 14.795 4.434 11.314 1.00 0.00 H new ATOM 560 N TRP A 291 7.462 6.234 5.145 1.00 0.00 N ATOM 561 CA TRP A 291 6.136 6.133 5.743 1.00 0.00 C ATOM 562 C TRP A 291 5.764 4.676 5.999 1.00 0.00 C ATOM 563 O TRP A 291 6.144 3.787 5.238 1.00 0.00 O ATOM 564 CB TRP A 291 5.093 6.785 4.834 1.00 0.00 C ATOM 565 CG TRP A 291 5.068 8.280 4.936 1.00 0.00 C ATOM 566 CD1 TRP A 291 5.578 9.172 4.037 1.00 0.00 C ATOM 567 CD2 TRP A 291 4.505 9.057 5.999 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.367 10.457 4.477 1.00 0.00 N ATOM 569 CE2 TRP A 291 4.710 10.413 5.678 1.00 0.00 C ATOM 570 CE3 TRP A 291 3.847 8.739 7.190 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.280 11.447 6.506 1.00 0.00 C ATOM 572 CZ3 TRP A 291 3.421 9.766 8.011 1.00 0.00 C ATOM 573 CH2 TRP A 291 3.638 11.107 7.665 1.00 0.00 C ATOM 0 H TRP A 291 7.477 6.126 4.131 1.00 0.00 H new ATOM 0 HA TRP A 291 6.155 6.658 6.698 1.00 0.00 H new ATOM 0 HB2 TRP A 291 5.294 6.502 3.801 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.107 6.394 5.086 1.00 0.00 H new ATOM 0 HD1 TRP A 291 6.074 8.907 3.115 1.00 0.00 H new ATOM 0 HE1 TRP A 291 5.653 11.305 3.989 1.00 0.00 H new ATOM 0 HE3 TRP A 291 3.674 7.709 7.464 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.448 12.481 6.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 2.912 9.531 8.934 1.00 0.00 H new ATOM 0 HH2 TRP A 291 3.291 11.887 8.327 1.00 0.00 H new ATOM 584 N GLU A 292 5.020 4.440 7.075 1.00 0.00 N ATOM 585 CA GLU A 292 4.599 3.091 7.431 1.00 0.00 C ATOM 586 C GLU A 292 3.081 2.956 7.353 1.00 0.00 C ATOM 587 O GLU A 292 2.350 3.606 8.099 1.00 0.00 O ATOM 588 CB GLU A 292 5.081 2.736 8.839 1.00 0.00 C ATOM 589 CG GLU A 292 4.687 1.337 9.283 1.00 0.00 C ATOM 590 CD GLU A 292 4.798 1.149 10.784 1.00 0.00 C ATOM 591 OE1 GLU A 292 5.599 1.871 11.414 1.00 0.00 O ATOM 592 OE2 GLU A 292 4.085 0.280 11.328 1.00 0.00 O ATOM 0 H GLU A 292 4.697 5.166 7.715 1.00 0.00 H new ATOM 0 HA GLU A 292 5.046 2.399 6.717 1.00 0.00 H new ATOM 0 HB2 GLU A 292 6.167 2.828 8.876 1.00 0.00 H new ATOM 0 HB3 GLU A 292 4.676 3.460 9.546 1.00 0.00 H new ATOM 0 HG2 GLU A 292 3.663 1.135 8.970 1.00 0.00 H new ATOM 0 HG3 GLU A 292 5.323 0.608 8.781 1.00 0.00 H new ATOM 599 N GLY A 293 2.613 2.108 6.441 1.00 0.00 N ATOM 600 CA GLY A 293 1.186 1.904 6.281 1.00 0.00 C ATOM 601 C GLY A 293 0.773 0.467 6.535 1.00 0.00 C ATOM 602 O GLY A 293 1.618 -0.428 6.594 1.00 0.00 O ATOM 0 H GLY A 293 3.198 1.559 5.811 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.649 2.560 6.967 1.00 0.00 H new ATOM 0 HA3 GLY A 293 0.892 2.190 5.271 1.00 0.00 H new ATOM 606 N LEU A 294 -0.527 0.245 6.687 1.00 0.00 N ATOM 607 CA LEU A 294 -1.051 -1.093 6.938 1.00 0.00 C ATOM 608 C LEU A 294 -1.966 -1.542 5.803 1.00 0.00 C ATOM 609 O LEU A 294 -2.803 -0.774 5.326 1.00 0.00 O ATOM 610 CB LEU A 294 -1.811 -1.125 8.264 1.00 0.00 C ATOM 611 CG LEU A 294 -2.518 -2.438 8.602 1.00 0.00 C ATOM 612 CD1 LEU A 294 -1.527 -3.448 9.160 1.00 0.00 C ATOM 613 CD2 LEU A 294 -3.649 -2.196 9.591 1.00 0.00 C ATOM 0 H LEU A 294 -1.239 0.974 6.641 1.00 0.00 H new ATOM 0 HA LEU A 294 -0.208 -1.781 6.994 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -1.110 -0.896 9.067 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.554 -0.328 8.253 1.00 0.00 H new ATOM 0 HG LEU A 294 -2.945 -2.845 7.686 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -2.047 -4.377 9.395 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -0.751 -3.644 8.420 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -1.071 -3.048 10.066 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -4.141 -3.141 9.820 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -3.245 -1.766 10.507 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -4.372 -1.507 9.155 1.00 0.00 H new ATOM 625 N VAL A 295 -1.804 -2.790 5.376 1.00 0.00 N ATOM 626 CA VAL A 295 -2.618 -3.342 4.300 1.00 0.00 C ATOM 627 C VAL A 295 -3.617 -4.362 4.834 1.00 0.00 C ATOM 628 O VAL A 295 -3.255 -5.497 5.147 1.00 0.00 O ATOM 629 CB VAL A 295 -1.744 -4.011 3.222 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.605 -4.517 2.075 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.685 -3.043 2.718 1.00 0.00 C ATOM 0 H VAL A 295 -1.116 -3.438 5.759 1.00 0.00 H new ATOM 0 HA VAL A 295 -3.159 -2.508 3.853 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.238 -4.866 3.669 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -1.970 -4.986 1.323 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.321 -5.247 2.452 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -3.141 -3.681 1.626 1.00 0.00 H new ATOM 0 HG21 VAL A 295 -0.077 -3.533 1.957 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -1.169 -2.166 2.287 1.00 0.00 H new ATOM 0 HG23 VAL A 295 -0.049 -2.735 3.548 1.00 0.00 H new ATOM 641 N HIS A 296 -4.877 -3.951 4.936 1.00 0.00 N ATOM 642 CA HIS A 296 -5.930 -4.830 5.432 1.00 0.00 C ATOM 643 C HIS A 296 -5.896 -6.177 4.716 1.00 0.00 C ATOM 644 O HIS A 296 -5.220 -6.332 3.698 1.00 0.00 O ATOM 645 CB HIS A 296 -7.300 -4.175 5.245 1.00 0.00 C ATOM 646 CG HIS A 296 -8.375 -4.786 6.090 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.577 -5.225 5.576 1.00 0.00 N ATOM 648 CD2 HIS A 296 -8.424 -5.030 7.420 1.00 0.00 C ATOM 649 CE1 HIS A 296 -10.319 -5.712 6.554 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.643 -5.606 7.684 1.00 0.00 N ATOM 0 H HIS A 296 -5.194 -3.015 4.682 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.757 -4.999 6.495 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -7.222 -3.114 5.482 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.588 -4.247 4.196 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.649 -4.812 8.140 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -11.311 -6.127 6.448 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.972 -5.903 8.602 1.00 0.00 H new ATOM 658 N ILE A 297 -6.627 -7.147 5.255 1.00 0.00 N ATOM 659 CA ILE A 297 -6.679 -8.479 4.667 1.00 0.00 C ATOM 660 C ILE A 297 -7.349 -8.451 3.298 1.00 0.00 C ATOM 661 O ILE A 297 -6.941 -9.163 2.381 1.00 0.00 O ATOM 662 CB ILE A 297 -7.436 -9.466 5.576 1.00 0.00 C ATOM 663 CG1 ILE A 297 -7.454 -10.861 4.948 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.854 -8.974 5.827 1.00 0.00 C ATOM 665 CD1 ILE A 297 -6.273 -11.718 5.346 1.00 0.00 C ATOM 0 H ILE A 297 -7.191 -7.035 6.097 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.648 -8.815 4.557 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.918 -9.526 6.533 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -8.374 -11.369 5.236 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -7.471 -10.762 3.863 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -9.376 -9.682 6.471 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.820 -7.999 6.313 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -9.383 -8.889 4.878 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -6.352 -12.692 4.864 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -5.349 -11.232 5.033 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -6.266 -11.848 6.428 1.00 0.00 H new ATOM 677 N SER A 298 -8.379 -7.621 3.166 1.00 0.00 N ATOM 678 CA SER A 298 -9.108 -7.500 1.909 1.00 0.00 C ATOM 679 C SER A 298 -8.298 -6.708 0.886 1.00 0.00 C ATOM 680 O SER A 298 -8.722 -6.536 -0.256 1.00 0.00 O ATOM 681 CB SER A 298 -10.460 -6.823 2.142 1.00 0.00 C ATOM 682 OG SER A 298 -11.276 -6.905 0.986 1.00 0.00 O ATOM 0 H SER A 298 -8.727 -7.022 3.915 1.00 0.00 H new ATOM 0 HA SER A 298 -9.276 -8.503 1.516 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.967 -7.295 2.983 1.00 0.00 H new ATOM 0 HB3 SER A 298 -10.306 -5.778 2.409 1.00 0.00 H new ATOM 0 HG SER A 298 -10.710 -6.907 0.186 1.00 0.00 H new ATOM 688 N GLU A 299 -7.132 -6.229 1.307 1.00 0.00 N ATOM 689 CA GLU A 299 -6.263 -5.454 0.428 1.00 0.00 C ATOM 690 C GLU A 299 -5.033 -6.264 0.028 1.00 0.00 C ATOM 691 O GLU A 299 -3.933 -5.723 -0.095 1.00 0.00 O ATOM 692 CB GLU A 299 -5.833 -4.157 1.115 1.00 0.00 C ATOM 693 CG GLU A 299 -6.982 -3.198 1.379 1.00 0.00 C ATOM 694 CD GLU A 299 -6.513 -1.862 1.922 1.00 0.00 C ATOM 695 OE1 GLU A 299 -5.597 -1.265 1.319 1.00 0.00 O ATOM 696 OE2 GLU A 299 -7.062 -1.413 2.950 1.00 0.00 O ATOM 0 H GLU A 299 -6.767 -6.363 2.250 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.824 -5.210 -0.474 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.349 -4.400 2.061 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -5.089 -3.657 0.495 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -7.535 -3.036 0.454 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -7.674 -3.652 2.089 1.00 0.00 H new ATOM 703 N LEU A 300 -5.226 -7.562 -0.173 1.00 0.00 N ATOM 704 CA LEU A 300 -4.133 -8.448 -0.559 1.00 0.00 C ATOM 705 C LEU A 300 -4.501 -9.260 -1.796 1.00 0.00 C ATOM 706 O LEU A 300 -3.874 -9.126 -2.847 1.00 0.00 O ATOM 707 CB LEU A 300 -3.780 -9.387 0.596 1.00 0.00 C ATOM 708 CG LEU A 300 -3.464 -8.718 1.934 1.00 0.00 C ATOM 709 CD1 LEU A 300 -3.362 -9.757 3.040 1.00 0.00 C ATOM 710 CD2 LEU A 300 -2.177 -7.912 1.836 1.00 0.00 C ATOM 0 H LEU A 300 -6.129 -8.025 -0.075 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.265 -7.832 -0.797 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -4.612 -10.076 0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -2.919 -9.986 0.300 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.278 -8.036 2.179 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -3.137 -9.262 3.985 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -4.309 -10.290 3.127 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -2.567 -10.464 2.803 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -1.967 -7.443 2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.353 -8.573 1.568 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.287 -7.142 1.073 1.00 0.00 H new ATOM 856 N VAL A 309 -2.787 -13.378 6.098 1.00 0.00 N ATOM 857 CA VAL A 309 -1.742 -12.483 5.616 1.00 0.00 C ATOM 858 C VAL A 309 -0.373 -13.150 5.680 1.00 0.00 C ATOM 859 O VAL A 309 0.470 -12.946 4.807 1.00 0.00 O ATOM 860 CB VAL A 309 -1.703 -11.177 6.432 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.696 -10.205 5.836 1.00 0.00 C ATOM 862 CG2 VAL A 309 -3.087 -10.549 6.499 1.00 0.00 C ATOM 0 HA VAL A 309 -1.980 -12.249 4.578 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.387 -11.413 7.448 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.682 -9.288 6.426 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.296 -10.657 5.845 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -0.979 -9.972 4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -3.041 -9.627 7.079 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.434 -10.326 5.490 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.779 -11.243 6.976 1.00 0.00 H new ATOM 872 N ALA A 310 -0.158 -13.950 6.720 1.00 0.00 N ATOM 873 CA ALA A 310 1.107 -14.650 6.897 1.00 0.00 C ATOM 874 C ALA A 310 1.547 -15.325 5.602 1.00 0.00 C ATOM 875 O ALA A 310 2.647 -15.082 5.106 1.00 0.00 O ATOM 876 CB ALA A 310 0.992 -15.674 8.016 1.00 0.00 C ATOM 0 H ALA A 310 -0.845 -14.129 7.453 1.00 0.00 H new ATOM 0 HA ALA A 310 1.865 -13.916 7.169 1.00 0.00 H new ATOM 0 HB1 ALA A 310 1.945 -16.189 8.137 1.00 0.00 H new ATOM 0 HB2 ALA A 310 0.732 -15.169 8.946 1.00 0.00 H new ATOM 0 HB3 ALA A 310 0.217 -16.399 7.768 1.00 0.00 H new ATOM 882 N ASP A 311 0.681 -16.175 5.060 1.00 0.00 N ATOM 883 CA ASP A 311 0.980 -16.886 3.823 1.00 0.00 C ATOM 884 C ASP A 311 0.930 -15.940 2.627 1.00 0.00 C ATOM 885 O ASP A 311 1.534 -16.203 1.587 1.00 0.00 O ATOM 886 CB ASP A 311 -0.006 -18.037 3.620 1.00 0.00 C ATOM 887 CG ASP A 311 0.421 -19.299 4.344 1.00 0.00 C ATOM 888 OD1 ASP A 311 1.601 -19.688 4.215 1.00 0.00 O ATOM 889 OD2 ASP A 311 -0.426 -19.897 5.040 1.00 0.00 O ATOM 0 H ASP A 311 -0.234 -16.388 5.458 1.00 0.00 H new ATOM 0 HA ASP A 311 1.989 -17.292 3.901 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -0.991 -17.734 3.974 1.00 0.00 H new ATOM 0 HB3 ASP A 311 -0.101 -18.247 2.555 1.00 0.00 H new ATOM 894 N VAL A 312 0.204 -14.837 2.782 1.00 0.00 N ATOM 895 CA VAL A 312 0.074 -13.851 1.715 1.00 0.00 C ATOM 896 C VAL A 312 1.377 -13.087 1.512 1.00 0.00 C ATOM 897 O VAL A 312 1.766 -12.789 0.382 1.00 0.00 O ATOM 898 CB VAL A 312 -1.056 -12.848 2.013 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.145 -11.802 0.912 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.382 -13.573 2.180 1.00 0.00 C ATOM 0 H VAL A 312 -0.303 -14.604 3.636 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.168 -14.399 0.804 1.00 0.00 H new ATOM 0 HB VAL A 312 -0.828 -12.338 2.949 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -1.949 -11.102 1.139 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.201 -11.262 0.846 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -1.349 -12.292 -0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.169 -12.849 2.390 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.620 -14.112 1.263 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.309 -14.279 3.007 1.00 0.00 H new ATOM 910 N VAL A 313 2.050 -12.771 2.614 1.00 0.00 N ATOM 911 CA VAL A 313 3.312 -12.042 2.557 1.00 0.00 C ATOM 912 C VAL A 313 4.260 -12.499 3.660 1.00 0.00 C ATOM 913 O VAL A 313 3.830 -13.036 4.680 1.00 0.00 O ATOM 914 CB VAL A 313 3.089 -10.523 2.684 1.00 0.00 C ATOM 915 CG1 VAL A 313 2.291 -10.000 1.499 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.389 -10.195 3.994 1.00 0.00 C ATOM 0 H VAL A 313 1.742 -13.008 3.557 1.00 0.00 H new ATOM 0 HA VAL A 313 3.758 -12.256 1.586 1.00 0.00 H new ATOM 0 HB VAL A 313 4.061 -10.029 2.684 1.00 0.00 H new ATOM 0 HG11 VAL A 313 2.143 -8.925 1.606 1.00 0.00 H new ATOM 0 HG12 VAL A 313 2.835 -10.202 0.576 1.00 0.00 H new ATOM 0 HG13 VAL A 313 1.322 -10.498 1.465 1.00 0.00 H new ATOM 0 HG21 VAL A 313 2.240 -9.118 4.067 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.423 -10.698 4.026 1.00 0.00 H new ATOM 0 HG23 VAL A 313 3.002 -10.534 4.829 1.00 0.00 H new ATOM 926 N SER A 314 5.554 -12.280 3.448 1.00 0.00 N ATOM 927 CA SER A 314 6.565 -12.672 4.423 1.00 0.00 C ATOM 928 C SER A 314 7.245 -11.446 5.024 1.00 0.00 C ATOM 929 O SER A 314 7.145 -10.341 4.490 1.00 0.00 O ATOM 930 CB SER A 314 7.610 -13.579 3.770 1.00 0.00 C ATOM 931 OG SER A 314 7.168 -14.926 3.739 1.00 0.00 O ATOM 0 H SER A 314 5.927 -11.833 2.610 1.00 0.00 H new ATOM 0 HA SER A 314 6.068 -13.220 5.224 1.00 0.00 H new ATOM 0 HB2 SER A 314 7.811 -13.235 2.755 1.00 0.00 H new ATOM 0 HB3 SER A 314 8.548 -13.513 4.321 1.00 0.00 H new ATOM 0 HG SER A 314 7.852 -15.485 3.316 1.00 0.00 H new ATOM 937 N LYS A 315 7.937 -11.648 6.140 1.00 0.00 N ATOM 938 CA LYS A 315 8.636 -10.561 6.815 1.00 0.00 C ATOM 939 C LYS A 315 9.862 -10.125 6.020 1.00 0.00 C ATOM 940 O LYS A 315 10.709 -10.945 5.667 1.00 0.00 O ATOM 941 CB LYS A 315 9.055 -10.993 8.223 1.00 0.00 C ATOM 942 CG LYS A 315 9.880 -9.951 8.958 1.00 0.00 C ATOM 943 CD LYS A 315 10.184 -10.385 10.382 1.00 0.00 C ATOM 944 CE LYS A 315 11.212 -11.506 10.416 1.00 0.00 C ATOM 945 NZ LYS A 315 12.579 -11.015 10.087 1.00 0.00 N ATOM 0 H LYS A 315 8.029 -12.555 6.597 1.00 0.00 H new ATOM 0 HA LYS A 315 7.953 -9.715 6.889 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.162 -11.215 8.807 1.00 0.00 H new ATOM 0 HB3 LYS A 315 9.629 -11.917 8.155 1.00 0.00 H new ATOM 0 HG2 LYS A 315 10.813 -9.780 8.422 1.00 0.00 H new ATOM 0 HG3 LYS A 315 9.342 -9.003 8.972 1.00 0.00 H new ATOM 0 HD2 LYS A 315 10.554 -9.533 10.952 1.00 0.00 H new ATOM 0 HD3 LYS A 315 9.266 -10.717 10.866 1.00 0.00 H new ATOM 0 HE2 LYS A 315 11.219 -11.963 11.406 1.00 0.00 H new ATOM 0 HE3 LYS A 315 10.925 -12.283 9.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 13.275 -11.758 10.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 12.628 -10.774 9.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 12.790 -10.170 10.655 1.00 0.00 H new ATOM 959 N GLY A 316 9.952 -8.828 5.742 1.00 0.00 N ATOM 960 CA GLY A 316 11.079 -8.306 4.992 1.00 0.00 C ATOM 961 C GLY A 316 11.021 -8.679 3.524 1.00 0.00 C ATOM 962 O GLY A 316 12.051 -8.936 2.902 1.00 0.00 O ATOM 0 H GLY A 316 9.264 -8.129 6.023 1.00 0.00 H new ATOM 0 HA2 GLY A 316 11.103 -7.220 5.087 1.00 0.00 H new ATOM 0 HA3 GLY A 316 12.005 -8.685 5.424 1.00 0.00 H new ATOM 966 N GLN A 317 9.813 -8.710 2.970 1.00 0.00 N ATOM 967 CA GLN A 317 9.625 -9.057 1.567 1.00 0.00 C ATOM 968 C GLN A 317 9.299 -7.818 0.739 1.00 0.00 C ATOM 969 O GLN A 317 8.437 -7.021 1.109 1.00 0.00 O ATOM 970 CB GLN A 317 8.508 -10.092 1.420 1.00 0.00 C ATOM 971 CG GLN A 317 8.337 -10.605 -0.001 1.00 0.00 C ATOM 972 CD GLN A 317 7.097 -11.461 -0.166 1.00 0.00 C ATOM 973 OE1 GLN A 317 7.145 -12.681 -0.002 1.00 0.00 O ATOM 974 NE2 GLN A 317 5.978 -10.826 -0.493 1.00 0.00 N ATOM 0 H GLN A 317 8.950 -8.499 3.472 1.00 0.00 H new ATOM 0 HA GLN A 317 10.557 -9.484 1.197 1.00 0.00 H new ATOM 0 HB2 GLN A 317 8.716 -10.935 2.079 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.569 -9.651 1.754 1.00 0.00 H new ATOM 0 HG2 GLN A 317 8.283 -9.758 -0.685 1.00 0.00 H new ATOM 0 HG3 GLN A 317 9.215 -11.186 -0.282 1.00 0.00 H new ATOM 0 HE21 GLN A 317 5.984 -9.814 -0.619 1.00 0.00 H new ATOM 0 HE22 GLN A 317 5.112 -11.350 -0.618 1.00 0.00 H new ATOM 983 N ARG A 318 9.993 -7.663 -0.384 1.00 0.00 N ATOM 984 CA ARG A 318 9.778 -6.520 -1.263 1.00 0.00 C ATOM 985 C ARG A 318 8.469 -6.667 -2.035 1.00 0.00 C ATOM 986 O ARG A 318 8.157 -7.740 -2.550 1.00 0.00 O ATOM 987 CB ARG A 318 10.945 -6.375 -2.241 1.00 0.00 C ATOM 988 CG ARG A 318 11.039 -7.508 -3.250 1.00 0.00 C ATOM 989 CD ARG A 318 12.170 -7.279 -4.241 1.00 0.00 C ATOM 990 NE ARG A 318 12.524 -8.501 -4.958 1.00 0.00 N ATOM 991 CZ ARG A 318 13.159 -8.510 -6.125 1.00 0.00 C ATOM 992 NH1 ARG A 318 13.507 -7.369 -6.703 1.00 0.00 N ATOM 993 NH2 ARG A 318 13.447 -9.663 -6.716 1.00 0.00 N ATOM 0 H ARG A 318 10.709 -8.314 -0.706 1.00 0.00 H new ATOM 0 HA ARG A 318 9.717 -5.624 -0.645 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.844 -5.431 -2.776 1.00 0.00 H new ATOM 0 HB3 ARG A 318 11.876 -6.324 -1.677 1.00 0.00 H new ATOM 0 HG2 ARG A 318 11.198 -8.451 -2.726 1.00 0.00 H new ATOM 0 HG3 ARG A 318 10.095 -7.597 -3.788 1.00 0.00 H new ATOM 0 HD2 ARG A 318 11.875 -6.511 -4.956 1.00 0.00 H new ATOM 0 HD3 ARG A 318 13.045 -6.903 -3.712 1.00 0.00 H new ATOM 0 HE ARG A 318 12.270 -9.396 -4.540 1.00 0.00 H new ATOM 0 HH11 ARG A 318 13.287 -6.481 -6.252 1.00 0.00 H new ATOM 0 HH12 ARG A 318 13.994 -7.379 -7.599 1.00 0.00 H new ATOM 0 HH21 ARG A 318 13.181 -10.543 -6.274 1.00 0.00 H new ATOM 0 HH22 ARG A 318 13.935 -9.669 -7.612 1.00 0.00 H new ATOM 1007 N VAL A 319 7.707 -5.580 -2.109 1.00 0.00 N ATOM 1008 CA VAL A 319 6.433 -5.587 -2.818 1.00 0.00 C ATOM 1009 C VAL A 319 6.053 -4.185 -3.280 1.00 0.00 C ATOM 1010 O VAL A 319 6.685 -3.200 -2.895 1.00 0.00 O ATOM 1011 CB VAL A 319 5.303 -6.149 -1.935 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.464 -7.650 -1.753 1.00 0.00 C ATOM 1013 CG2 VAL A 319 5.277 -5.440 -0.589 1.00 0.00 C ATOM 0 H VAL A 319 7.950 -4.684 -1.687 1.00 0.00 H new ATOM 0 HA VAL A 319 6.559 -6.231 -3.688 1.00 0.00 H new ATOM 0 HB VAL A 319 4.351 -5.968 -2.434 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.657 -8.029 -1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 319 5.429 -8.140 -2.726 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.422 -7.858 -1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.473 -5.849 0.022 1.00 0.00 H new ATOM 0 HG22 VAL A 319 6.230 -5.588 -0.081 1.00 0.00 H new ATOM 0 HG23 VAL A 319 5.110 -4.374 -0.742 1.00 0.00 H new ATOM 1023 N LYS A 320 5.017 -4.100 -4.107 1.00 0.00 N ATOM 1024 CA LYS A 320 4.550 -2.819 -4.621 1.00 0.00 C ATOM 1025 C LYS A 320 3.167 -2.482 -4.070 1.00 0.00 C ATOM 1026 O LYS A 320 2.259 -3.313 -4.096 1.00 0.00 O ATOM 1027 CB LYS A 320 4.508 -2.844 -6.150 1.00 0.00 C ATOM 1028 CG LYS A 320 5.776 -3.390 -6.784 1.00 0.00 C ATOM 1029 CD LYS A 320 5.792 -3.161 -8.286 1.00 0.00 C ATOM 1030 CE LYS A 320 6.339 -1.786 -8.635 1.00 0.00 C ATOM 1031 NZ LYS A 320 5.366 -0.704 -8.318 1.00 0.00 N ATOM 0 H LYS A 320 4.484 -4.905 -4.436 1.00 0.00 H new ATOM 0 HA LYS A 320 5.249 -2.049 -4.295 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.661 -3.450 -6.472 1.00 0.00 H new ATOM 0 HB3 LYS A 320 4.335 -1.832 -6.517 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.645 -2.911 -6.333 1.00 0.00 H new ATOM 0 HG3 LYS A 320 5.857 -4.457 -6.577 1.00 0.00 H new ATOM 0 HD2 LYS A 320 6.400 -3.928 -8.765 1.00 0.00 H new ATOM 0 HD3 LYS A 320 4.781 -3.263 -8.681 1.00 0.00 H new ATOM 0 HE2 LYS A 320 7.265 -1.614 -8.086 1.00 0.00 H new ATOM 0 HE3 LYS A 320 6.586 -1.752 -9.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 5.490 0.082 -8.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 4.397 -1.075 -8.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 5.530 -0.362 -7.349 1.00 0.00 H new ATOM 1045 N VAL A 321 3.015 -1.259 -3.572 1.00 0.00 N ATOM 1046 CA VAL A 321 1.743 -0.812 -3.018 1.00 0.00 C ATOM 1047 C VAL A 321 1.401 0.596 -3.492 1.00 0.00 C ATOM 1048 O VAL A 321 2.265 1.328 -3.973 1.00 0.00 O ATOM 1049 CB VAL A 321 1.764 -0.833 -1.478 1.00 0.00 C ATOM 1050 CG1 VAL A 321 2.032 -2.240 -0.966 1.00 0.00 C ATOM 1051 CG2 VAL A 321 2.802 0.144 -0.947 1.00 0.00 C ATOM 0 H VAL A 321 3.757 -0.560 -3.541 1.00 0.00 H new ATOM 0 HA VAL A 321 0.981 -1.506 -3.373 1.00 0.00 H new ATOM 0 HB VAL A 321 0.785 -0.521 -1.114 1.00 0.00 H new ATOM 0 HG11 VAL A 321 2.043 -2.235 0.124 1.00 0.00 H new ATOM 0 HG12 VAL A 321 1.248 -2.911 -1.318 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.997 -2.584 -1.337 1.00 0.00 H new ATOM 0 HG21 VAL A 321 2.804 0.117 0.143 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.788 -0.135 -1.319 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.559 1.152 -1.284 1.00 0.00 H new ATOM 1061 N LYS A 322 0.133 0.969 -3.352 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.325 2.291 -3.764 1.00 0.00 C ATOM 1063 C LYS A 322 -0.853 3.080 -2.570 1.00 0.00 C ATOM 1064 O LYS A 322 -1.457 2.516 -1.658 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.417 2.165 -4.829 1.00 0.00 C ATOM 1066 CG LYS A 322 -1.830 3.495 -5.436 1.00 0.00 C ATOM 1067 CD LYS A 322 -2.652 3.300 -6.699 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.974 2.609 -6.403 1.00 0.00 C ATOM 1069 NZ LYS A 322 -4.816 3.401 -5.464 1.00 0.00 N ATOM 0 H LYS A 322 -0.595 0.375 -2.956 1.00 0.00 H new ATOM 0 HA LYS A 322 0.525 2.828 -4.185 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -1.065 1.507 -5.623 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.292 1.690 -4.386 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -2.409 4.064 -4.708 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -0.941 4.083 -5.666 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -2.842 4.268 -7.164 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -2.084 2.708 -7.416 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -4.518 2.452 -7.334 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -3.782 1.625 -5.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -5.787 3.029 -5.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -4.424 3.331 -4.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -4.825 4.397 -5.762 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.622 4.389 -2.583 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.077 5.256 -1.503 1.00 0.00 C ATOM 1085 C VAL A 323 -2.566 5.554 -1.627 1.00 0.00 C ATOM 1086 O VAL A 323 -2.986 6.328 -2.489 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.298 6.585 -1.485 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -0.657 7.398 -0.250 1.00 0.00 C ATOM 1089 CG2 VAL A 323 1.200 6.326 -1.545 1.00 0.00 C ATOM 0 H VAL A 323 -0.122 4.872 -3.330 1.00 0.00 H new ATOM 0 HA VAL A 323 -0.893 4.723 -0.570 1.00 0.00 H new ATOM 0 HB VAL A 323 -0.579 7.162 -2.366 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.097 8.333 -0.255 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -1.725 7.615 -0.255 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -0.406 6.829 0.645 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.734 7.276 -1.531 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.501 5.728 -0.685 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.440 5.788 -2.462 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.362 4.936 -0.762 1.00 0.00 N ATOM 1100 CA LEU A 324 -4.807 5.135 -0.773 1.00 0.00 C ATOM 1101 C LEU A 324 -5.173 6.504 -0.207 1.00 0.00 C ATOM 1102 O LEU A 324 -5.917 7.264 -0.827 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.500 4.035 0.033 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.439 2.628 -0.561 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -5.781 1.587 0.494 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -6.380 2.511 -1.752 1.00 0.00 C ATOM 0 H LEU A 324 -3.031 4.292 -0.043 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.147 5.087 -1.807 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -5.056 4.007 1.028 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.547 4.309 0.159 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.422 2.444 -0.907 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -5.732 0.592 0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -5.068 1.654 1.316 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -6.788 1.768 0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -6.324 1.503 -2.163 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -7.401 2.715 -1.430 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -6.090 3.231 -2.517 1.00 0.00 H new ATOM 1118 N SER A 325 -4.643 6.811 0.972 1.00 0.00 N ATOM 1119 CA SER A 325 -4.915 8.088 1.623 1.00 0.00 C ATOM 1120 C SER A 325 -3.859 8.394 2.681 1.00 0.00 C ATOM 1121 O SER A 325 -3.297 7.487 3.294 1.00 0.00 O ATOM 1122 CB SER A 325 -6.305 8.072 2.262 1.00 0.00 C ATOM 1123 OG SER A 325 -6.695 9.373 2.666 1.00 0.00 O ATOM 0 H SER A 325 -4.023 6.194 1.496 1.00 0.00 H new ATOM 0 HA SER A 325 -4.881 8.870 0.864 1.00 0.00 H new ATOM 0 HB2 SER A 325 -7.031 7.675 1.552 1.00 0.00 H new ATOM 0 HB3 SER A 325 -6.305 7.405 3.124 1.00 0.00 H new ATOM 0 HG SER A 325 -7.587 9.336 3.070 1.00 0.00 H new ATOM 1129 N PHE A 326 -3.596 9.680 2.889 1.00 0.00 N ATOM 1130 CA PHE A 326 -2.607 10.107 3.872 1.00 0.00 C ATOM 1131 C PHE A 326 -3.200 11.139 4.827 1.00 0.00 C ATOM 1132 O PHE A 326 -3.636 12.212 4.409 1.00 0.00 O ATOM 1133 CB PHE A 326 -1.379 10.692 3.171 1.00 0.00 C ATOM 1134 CG PHE A 326 -0.591 11.638 4.031 1.00 0.00 C ATOM 1135 CD1 PHE A 326 -0.091 11.229 5.256 1.00 0.00 C ATOM 1136 CD2 PHE A 326 -0.351 12.938 3.614 1.00 0.00 C ATOM 1137 CE1 PHE A 326 0.634 12.097 6.050 1.00 0.00 C ATOM 1138 CE2 PHE A 326 0.374 13.810 4.403 1.00 0.00 C ATOM 1139 CZ PHE A 326 0.866 13.390 5.623 1.00 0.00 C ATOM 0 H PHE A 326 -4.053 10.444 2.391 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.305 9.233 4.450 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -0.730 9.877 2.853 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -1.700 11.214 2.270 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -0.270 10.219 5.595 1.00 0.00 H new ATOM 0 HD2 PHE A 326 -0.735 13.273 2.662 1.00 0.00 H new ATOM 0 HE1 PHE A 326 1.019 11.765 7.003 1.00 0.00 H new ATOM 0 HE2 PHE A 326 0.556 14.820 4.066 1.00 0.00 H new ATOM 0 HZ PHE A 326 1.431 14.071 6.242 1.00 0.00 H new ATOM 1149 N THR A 327 -3.215 10.806 6.114 1.00 0.00 N ATOM 1150 CA THR A 327 -3.756 11.701 7.129 1.00 0.00 C ATOM 1151 C THR A 327 -2.966 11.600 8.429 1.00 0.00 C ATOM 1152 O THR A 327 -2.973 10.563 9.092 1.00 0.00 O ATOM 1153 CB THR A 327 -5.238 11.394 7.417 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.757 12.332 8.366 1.00 0.00 O ATOM 1155 CG2 THR A 327 -5.403 9.979 7.952 1.00 0.00 C ATOM 0 H THR A 327 -2.858 9.922 6.478 1.00 0.00 H new ATOM 0 HA THR A 327 -3.672 12.713 6.734 1.00 0.00 H new ATOM 0 HB THR A 327 -5.793 11.479 6.482 1.00 0.00 H new ATOM 0 HG1 THR A 327 -6.700 12.131 8.543 1.00 0.00 H new ATOM 0 HG21 THR A 327 -6.457 9.785 8.148 1.00 0.00 H new ATOM 0 HG22 THR A 327 -5.034 9.266 7.215 1.00 0.00 H new ATOM 0 HG23 THR A 327 -4.836 9.871 8.877 1.00 0.00 H new ATOM 1163 N GLY A 328 -2.286 12.684 8.789 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.501 12.696 10.010 1.00 0.00 C ATOM 1165 C GLY A 328 -0.530 11.534 10.086 1.00 0.00 C ATOM 1166 O GLY A 328 0.065 11.145 9.080 1.00 0.00 O ATOM 0 H GLY A 328 -2.265 13.554 8.257 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -0.947 13.633 10.073 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -2.171 12.663 10.869 1.00 0.00 H new ATOM 1170 N THR A 329 -0.367 10.979 11.282 1.00 0.00 N ATOM 1171 CA THR A 329 0.541 9.857 11.487 1.00 0.00 C ATOM 1172 C THR A 329 -0.130 8.535 11.130 1.00 0.00 C ATOM 1173 O THR A 329 0.003 7.545 11.849 1.00 0.00 O ATOM 1174 CB THR A 329 1.034 9.792 12.945 1.00 0.00 C ATOM 1175 OG1 THR A 329 1.961 8.712 13.100 1.00 0.00 O ATOM 1176 CG2 THR A 329 -0.133 9.607 13.903 1.00 0.00 C ATOM 0 H THR A 329 -0.852 11.288 12.124 1.00 0.00 H new ATOM 0 HA THR A 329 1.395 10.017 10.829 1.00 0.00 H new ATOM 0 HB THR A 329 1.530 10.733 13.180 1.00 0.00 H new ATOM 0 HG1 THR A 329 1.513 7.865 12.897 1.00 0.00 H new ATOM 0 HG21 THR A 329 0.240 9.564 14.926 1.00 0.00 H new ATOM 0 HG22 THR A 329 -0.822 10.445 13.803 1.00 0.00 H new ATOM 0 HG23 THR A 329 -0.654 8.679 13.667 1.00 0.00 H new ATOM 1184 N LYS A 330 -0.851 8.525 10.014 1.00 0.00 N ATOM 1185 CA LYS A 330 -1.541 7.324 9.559 1.00 0.00 C ATOM 1186 C LYS A 330 -1.600 7.275 8.035 1.00 0.00 C ATOM 1187 O LYS A 330 -2.254 8.104 7.401 1.00 0.00 O ATOM 1188 CB LYS A 330 -2.958 7.276 10.136 1.00 0.00 C ATOM 1189 CG LYS A 330 -3.686 5.974 9.852 1.00 0.00 C ATOM 1190 CD LYS A 330 -5.028 5.919 10.564 1.00 0.00 C ATOM 1191 CE LYS A 330 -4.859 5.653 12.052 1.00 0.00 C ATOM 1192 NZ LYS A 330 -6.060 4.993 12.637 1.00 0.00 N ATOM 0 H LYS A 330 -0.973 9.336 9.408 1.00 0.00 H new ATOM 0 HA LYS A 330 -0.981 6.458 9.912 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -2.908 7.427 11.214 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -3.537 8.103 9.725 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -3.838 5.868 8.778 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -3.069 5.134 10.171 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -5.557 6.861 10.419 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -5.644 5.137 10.121 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -3.984 5.023 12.211 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -4.673 6.594 12.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -5.906 4.829 13.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -6.890 5.606 12.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -6.223 4.083 12.160 1.00 0.00 H new ATOM 1206 N THR A 331 -0.915 6.296 7.453 1.00 0.00 N ATOM 1207 CA THR A 331 -0.890 6.138 6.004 1.00 0.00 C ATOM 1208 C THR A 331 -1.520 4.815 5.584 1.00 0.00 C ATOM 1209 O THR A 331 -1.361 3.799 6.260 1.00 0.00 O ATOM 1210 CB THR A 331 0.548 6.206 5.456 1.00 0.00 C ATOM 1211 OG1 THR A 331 1.309 7.169 6.194 1.00 0.00 O ATOM 1212 CG2 THR A 331 0.549 6.574 3.981 1.00 0.00 C ATOM 0 H THR A 331 -0.370 5.601 7.963 1.00 0.00 H new ATOM 0 HA THR A 331 -1.469 6.962 5.586 1.00 0.00 H new ATOM 0 HB THR A 331 1.002 5.222 5.568 1.00 0.00 H new ATOM 0 HG1 THR A 331 2.256 7.091 5.954 1.00 0.00 H new ATOM 0 HG21 THR A 331 1.576 6.616 3.617 1.00 0.00 H new ATOM 0 HG22 THR A 331 -0.005 5.823 3.418 1.00 0.00 H new ATOM 0 HG23 THR A 331 0.077 7.548 3.849 1.00 0.00 H new ATOM 1220 N SER A 332 -2.234 4.835 4.463 1.00 0.00 N ATOM 1221 CA SER A 332 -2.891 3.636 3.955 1.00 0.00 C ATOM 1222 C SER A 332 -2.259 3.186 2.641 1.00 0.00 C ATOM 1223 O SER A 332 -1.909 4.008 1.793 1.00 0.00 O ATOM 1224 CB SER A 332 -4.385 3.895 3.753 1.00 0.00 C ATOM 1225 OG SER A 332 -4.600 5.046 2.955 1.00 0.00 O ATOM 0 H SER A 332 -2.372 5.667 3.890 1.00 0.00 H new ATOM 0 HA SER A 332 -2.763 2.842 4.690 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.847 3.029 3.279 1.00 0.00 H new ATOM 0 HB3 SER A 332 -4.869 4.024 4.721 1.00 0.00 H new ATOM 0 HG SER A 332 -4.139 5.812 3.355 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.116 1.876 2.480 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.526 1.314 1.269 1.00 0.00 C ATOM 1233 C LEU A 333 -2.348 0.135 0.759 1.00 0.00 C ATOM 1234 O LEU A 333 -3.059 -0.516 1.524 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.087 0.868 1.539 1.00 0.00 C ATOM 1236 CG LEU A 333 0.815 1.892 2.228 1.00 0.00 C ATOM 1237 CD1 LEU A 333 2.056 1.217 2.792 1.00 0.00 C ATOM 1238 CD2 LEU A 333 1.201 3.000 1.260 1.00 0.00 C ATOM 0 H LEU A 333 -2.400 1.182 3.172 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.523 2.089 0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.116 -0.032 2.153 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.371 0.591 0.589 1.00 0.00 H new ATOM 0 HG LEU A 333 0.261 2.337 3.055 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.686 1.962 3.279 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.760 0.461 3.519 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.612 0.744 1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.843 3.720 1.768 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.735 2.572 0.412 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.301 3.503 0.906 1.00 0.00 H new ATOM 1250 N SER A 334 -2.245 -0.135 -0.538 1.00 0.00 N ATOM 1251 CA SER A 334 -2.980 -1.234 -1.152 1.00 0.00 C ATOM 1252 C SER A 334 -2.048 -2.123 -1.969 1.00 0.00 C ATOM 1253 O SER A 334 -1.075 -1.647 -2.554 1.00 0.00 O ATOM 1254 CB SER A 334 -4.099 -0.693 -2.044 1.00 0.00 C ATOM 1255 OG SER A 334 -3.592 0.224 -2.997 1.00 0.00 O ATOM 0 H SER A 334 -1.659 0.393 -1.185 1.00 0.00 H new ATOM 0 HA SER A 334 -3.419 -1.834 -0.355 1.00 0.00 H new ATOM 0 HB2 SER A 334 -4.592 -1.519 -2.556 1.00 0.00 H new ATOM 0 HB3 SER A 334 -4.854 -0.203 -1.429 1.00 0.00 H new ATOM 0 HG SER A 334 -4.326 0.554 -3.556 1.00 0.00 H new ATOM 1261 N MET A 335 -2.352 -3.416 -2.005 1.00 0.00 N ATOM 1262 CA MET A 335 -1.542 -4.371 -2.751 1.00 0.00 C ATOM 1263 C MET A 335 -2.365 -5.043 -3.846 1.00 0.00 C ATOM 1264 O MET A 335 -1.992 -5.023 -5.019 1.00 0.00 O ATOM 1265 CB MET A 335 -0.965 -5.429 -1.809 1.00 0.00 C ATOM 1266 CG MET A 335 0.245 -4.949 -1.024 1.00 0.00 C ATOM 1267 SD MET A 335 1.037 -6.272 -0.090 1.00 0.00 S ATOM 1268 CE MET A 335 1.571 -7.351 -1.416 1.00 0.00 C ATOM 0 H MET A 335 -3.154 -3.826 -1.526 1.00 0.00 H new ATOM 0 HA MET A 335 -0.722 -3.826 -3.219 1.00 0.00 H new ATOM 0 HB2 MET A 335 -1.740 -5.743 -1.110 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.685 -6.308 -2.390 1.00 0.00 H new ATOM 0 HG2 MET A 335 0.969 -4.511 -1.711 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.062 -4.159 -0.339 1.00 0.00 H new ATOM 0 HE1 MET A 335 2.350 -8.020 -1.050 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.724 -7.939 -1.770 1.00 0.00 H new ATOM 0 HE3 MET A 335 1.964 -6.751 -2.237 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.487 -5.638 -3.455 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.364 -6.316 -4.403 1.00 0.00 C ATOM 1280 C LYS A 336 -4.653 -5.427 -5.609 1.00 0.00 C ATOM 1281 O LYS A 336 -4.817 -5.916 -6.727 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.677 -6.711 -3.722 1.00 0.00 C ATOM 1283 CG LYS A 336 -6.593 -5.534 -3.437 1.00 0.00 C ATOM 1284 CD LYS A 336 -8.000 -5.993 -3.091 1.00 0.00 C ATOM 1285 CE LYS A 336 -8.854 -4.840 -2.587 1.00 0.00 C ATOM 1286 NZ LYS A 336 -10.270 -5.249 -2.378 1.00 0.00 N ATOM 0 H LYS A 336 -3.811 -5.665 -2.488 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.856 -7.216 -4.750 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -6.204 -7.426 -4.354 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.452 -7.220 -2.785 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.188 -4.948 -2.612 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -6.627 -4.879 -4.308 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -8.467 -6.435 -3.971 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -7.953 -6.772 -2.330 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -8.442 -4.466 -1.650 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -8.815 -4.019 -3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -10.855 -4.404 -2.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -10.614 -5.752 -3.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -10.332 -5.876 -1.551 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.712 -4.121 -5.374 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.978 -3.164 -6.442 1.00 0.00 C ATOM 1302 C ASP A 337 -3.718 -2.898 -7.260 1.00 0.00 C ATOM 1303 O ASP A 337 -3.791 -2.482 -8.416 1.00 0.00 O ATOM 1304 CB ASP A 337 -5.509 -1.853 -5.860 1.00 0.00 C ATOM 1305 CG ASP A 337 -7.020 -1.844 -5.739 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -7.687 -2.489 -6.576 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -7.536 -1.193 -4.807 1.00 0.00 O ATOM 0 H ASP A 337 -4.579 -3.701 -4.454 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.733 -3.593 -7.101 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -5.068 -1.690 -4.877 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -5.193 -1.024 -6.493 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.561 -3.140 -6.651 1.00 0.00 N ATOM 1313 CA VAL A 338 -1.284 -2.927 -7.322 1.00 0.00 C ATOM 1314 C VAL A 338 -0.686 -4.247 -7.797 1.00 0.00 C ATOM 1315 O VAL A 338 -0.203 -5.045 -6.994 1.00 0.00 O ATOM 1316 CB VAL A 338 -0.275 -2.221 -6.397 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.094 -2.148 -7.058 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.773 -0.832 -6.028 1.00 0.00 C ATOM 0 H VAL A 338 -2.482 -3.484 -5.694 1.00 0.00 H new ATOM 0 HA VAL A 338 -1.481 -2.290 -8.184 1.00 0.00 H new ATOM 0 HB VAL A 338 -0.179 -2.803 -5.480 1.00 0.00 H new ATOM 0 HG11 VAL A 338 1.794 -1.646 -6.390 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.451 -3.156 -7.267 1.00 0.00 H new ATOM 0 HG13 VAL A 338 1.018 -1.589 -7.991 1.00 0.00 H new ATOM 0 HG21 VAL A 338 -0.048 -0.347 -5.374 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.899 -0.238 -6.933 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.730 -0.914 -5.512 1.00 0.00 H new ATOM 1328 N ASP A 339 -0.721 -4.469 -9.106 1.00 0.00 N ATOM 1329 CA ASP A 339 -0.181 -5.692 -9.688 1.00 0.00 C ATOM 1330 C ASP A 339 1.251 -5.931 -9.219 1.00 0.00 C ATOM 1331 O ASP A 339 2.094 -5.037 -9.291 1.00 0.00 O ATOM 1332 CB ASP A 339 -0.224 -5.617 -11.215 1.00 0.00 C ATOM 1333 CG ASP A 339 -0.369 -6.982 -11.858 1.00 0.00 C ATOM 1334 OD1 ASP A 339 0.474 -7.861 -11.582 1.00 0.00 O ATOM 1335 OD2 ASP A 339 -1.327 -7.172 -12.637 1.00 0.00 O ATOM 0 H ASP A 339 -1.117 -3.818 -9.784 1.00 0.00 H new ATOM 0 HA ASP A 339 -0.798 -6.527 -9.355 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -1.057 -4.984 -11.521 1.00 0.00 H new ATOM 0 HB3 ASP A 339 0.688 -5.142 -11.578 1.00 0.00 H new ATOM 1340 N GLN A 340 1.516 -7.141 -8.738 1.00 0.00 N ATOM 1341 CA GLN A 340 2.845 -7.496 -8.255 1.00 0.00 C ATOM 1342 C GLN A 340 3.741 -7.942 -9.405 1.00 0.00 C ATOM 1343 O GLN A 340 4.464 -8.932 -9.293 1.00 0.00 O ATOM 1344 CB GLN A 340 2.751 -8.605 -7.206 1.00 0.00 C ATOM 1345 CG GLN A 340 2.042 -8.178 -5.931 1.00 0.00 C ATOM 1346 CD GLN A 340 2.721 -7.007 -5.250 1.00 0.00 C ATOM 1347 OE1 GLN A 340 3.751 -7.167 -4.594 1.00 0.00 O ATOM 1348 NE2 GLN A 340 2.147 -5.819 -5.401 1.00 0.00 N ATOM 0 H GLN A 340 0.829 -7.892 -8.672 1.00 0.00 H new ATOM 0 HA GLN A 340 3.286 -6.610 -7.798 1.00 0.00 H new ATOM 0 HB2 GLN A 340 2.225 -9.457 -7.636 1.00 0.00 H new ATOM 0 HB3 GLN A 340 3.756 -8.944 -6.957 1.00 0.00 H new ATOM 0 HG2 GLN A 340 1.012 -7.910 -6.165 1.00 0.00 H new ATOM 0 HG3 GLN A 340 2.003 -9.021 -5.242 1.00 0.00 H new ATOM 0 HE21 GLN A 340 1.294 -5.731 -5.953 1.00 0.00 H new ATOM 0 HE22 GLN A 340 2.559 -4.994 -4.965 1.00 0.00 H new ATOM 1357 N GLU A 341 3.688 -7.206 -10.511 1.00 0.00 N ATOM 1358 CA GLU A 341 4.495 -7.528 -11.682 1.00 0.00 C ATOM 1359 C GLU A 341 5.266 -6.303 -12.165 1.00 0.00 C ATOM 1360 O GLU A 341 6.494 -6.324 -12.256 1.00 0.00 O ATOM 1361 CB GLU A 341 3.607 -8.063 -12.808 1.00 0.00 C ATOM 1362 CG GLU A 341 4.296 -8.094 -14.162 1.00 0.00 C ATOM 1363 CD GLU A 341 3.759 -9.189 -15.064 1.00 0.00 C ATOM 1364 OE1 GLU A 341 2.788 -8.925 -15.804 1.00 0.00 O ATOM 1365 OE2 GLU A 341 4.310 -10.309 -15.030 1.00 0.00 O ATOM 0 H GLU A 341 3.095 -6.383 -10.620 1.00 0.00 H new ATOM 0 HA GLU A 341 5.212 -8.298 -11.398 1.00 0.00 H new ATOM 0 HB2 GLU A 341 3.279 -9.071 -12.553 1.00 0.00 H new ATOM 0 HB3 GLU A 341 2.712 -7.445 -12.879 1.00 0.00 H new ATOM 0 HG2 GLU A 341 4.169 -7.129 -14.653 1.00 0.00 H new ATOM 0 HG3 GLU A 341 5.367 -8.239 -14.018 1.00 0.00 H new ATOM 1372 N THR A 342 4.536 -5.236 -12.475 1.00 0.00 N ATOM 1373 CA THR A 342 5.150 -4.003 -12.951 1.00 0.00 C ATOM 1374 C THR A 342 4.755 -2.819 -12.076 1.00 0.00 C ATOM 1375 O THR A 342 5.537 -1.890 -11.882 1.00 0.00 O ATOM 1376 CB THR A 342 4.753 -3.704 -14.409 1.00 0.00 C ATOM 1377 OG1 THR A 342 5.386 -2.498 -14.852 1.00 0.00 O ATOM 1378 CG2 THR A 342 3.243 -3.568 -14.542 1.00 0.00 C ATOM 0 H THR A 342 3.519 -5.201 -12.405 1.00 0.00 H new ATOM 0 HA THR A 342 6.229 -4.147 -12.898 1.00 0.00 H new ATOM 0 HB THR A 342 5.083 -4.537 -15.030 1.00 0.00 H new ATOM 0 HG1 THR A 342 5.130 -2.316 -15.780 1.00 0.00 H new ATOM 0 HG21 THR A 342 2.987 -3.357 -15.580 1.00 0.00 H new ATOM 0 HG22 THR A 342 2.765 -4.497 -14.232 1.00 0.00 H new ATOM 0 HG23 THR A 342 2.894 -2.752 -13.909 1.00 0.00 H new ATOM 1386 N GLY A 343 3.535 -2.860 -11.549 1.00 0.00 N ATOM 1387 CA GLY A 343 3.057 -1.784 -10.699 1.00 0.00 C ATOM 1388 C GLY A 343 1.997 -0.938 -11.376 1.00 0.00 C ATOM 1389 O GLY A 343 1.893 0.261 -11.117 1.00 0.00 O ATOM 0 H GLY A 343 2.869 -3.619 -11.695 1.00 0.00 H new ATOM 0 HA2 GLY A 343 2.649 -2.205 -9.780 1.00 0.00 H new ATOM 0 HA3 GLY A 343 3.896 -1.150 -10.414 1.00 0.00 H new ATOM 1393 N GLU A 344 1.211 -1.562 -12.247 1.00 0.00 N ATOM 1394 CA GLU A 344 0.156 -0.856 -12.965 1.00 0.00 C ATOM 1395 C GLU A 344 -1.042 -0.598 -12.055 1.00 0.00 C ATOM 1396 O GLU A 344 -1.399 -1.437 -11.228 1.00 0.00 O ATOM 1397 CB GLU A 344 -0.284 -1.660 -14.190 1.00 0.00 C ATOM 1398 CG GLU A 344 -1.204 -0.892 -15.124 1.00 0.00 C ATOM 1399 CD GLU A 344 -1.398 -1.590 -16.456 1.00 0.00 C ATOM 1400 OE1 GLU A 344 -2.135 -2.598 -16.497 1.00 0.00 O ATOM 1401 OE2 GLU A 344 -0.813 -1.128 -17.458 1.00 0.00 O ATOM 0 H GLU A 344 1.284 -2.554 -12.473 1.00 0.00 H new ATOM 0 HA GLU A 344 0.555 0.104 -13.294 1.00 0.00 H new ATOM 0 HB2 GLU A 344 0.600 -1.976 -14.743 1.00 0.00 H new ATOM 0 HB3 GLU A 344 -0.792 -2.565 -13.857 1.00 0.00 H new ATOM 0 HG2 GLU A 344 -2.173 -0.758 -14.644 1.00 0.00 H new ATOM 0 HG3 GLU A 344 -0.793 0.103 -15.296 1.00 0.00 H new ATOM 1408 N ASP A 345 -1.658 0.568 -12.215 1.00 0.00 N ATOM 1409 CA ASP A 345 -2.816 0.938 -11.410 1.00 0.00 C ATOM 1410 C ASP A 345 -4.058 0.176 -11.862 1.00 0.00 C ATOM 1411 O ASP A 345 -4.605 0.440 -12.934 1.00 0.00 O ATOM 1412 CB ASP A 345 -3.066 2.444 -11.498 1.00 0.00 C ATOM 1413 CG ASP A 345 -4.499 2.813 -11.171 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -4.990 2.397 -10.101 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -5.131 3.519 -11.986 1.00 0.00 O ATOM 0 H ASP A 345 -1.375 1.273 -12.895 1.00 0.00 H new ATOM 0 HA ASP A 345 -2.606 0.673 -10.374 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -2.395 2.961 -10.812 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -2.825 2.791 -12.503 1.00 0.00 H new