USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 479 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 279 CYS SG : rot 110:sc= 1.27 USER MOD Set 1.2: A 280 ASN : amide:sc= -0.191 X(o=1.1,f=1.2) USER MOD Set 1.3: A 282 LYS NZ :NH3+ -150:sc= 0.0352 (180deg=0) USER MOD Set 2.1: A 270 ASN : amide:sc= -6.35! C(o=-6.3!,f=-12!) USER MOD Set 2.2: A 272 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 254 THR OG1 : rot -4:sc= 1.21 USER MOD Set 3.2: A 285 HIS : no HD1:sc= 0.272 K(o=1.5,f=-0.85) USER MOD Single : A 239 TYR OH : rot 180:sc= 0 USER MOD Single : A 244 GLN : amide:sc= -0.647 K(o=-0.65,f=-0.018) USER MOD Single : A 245 LYS NZ :NH3+ -122:sc= -0.67 (180deg=-3.21!) USER MOD Single : A 249 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0756) USER MOD Single : A 265 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0565) USER MOD Single : A 267 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 LYS NZ :NH3+ 164:sc= 1.28 (180deg=1.14) USER MOD Single : A 274 GLN : amide:sc= -5.39! K(o=-5.4!,f=-1.2) USER MOD Single : A 289 THR OG1 : rot -20:sc= 0.331 USER MOD Single : A 290 HIS : no HE2:sc= -2.35 K(o=-2.4,f=-1) USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 10.279 -5.985 0.155 1.00 0.00 N ATOM 9 CA PRO A 237 9.004 -5.331 0.432 1.00 0.00 C ATOM 10 C PRO A 237 9.154 -4.187 1.420 1.00 0.00 C ATOM 11 O PRO A 237 9.808 -4.325 2.455 1.00 0.00 O ATOM 12 CB PRO A 237 8.138 -6.450 1.040 1.00 0.00 C ATOM 13 CG PRO A 237 8.922 -7.711 0.873 1.00 0.00 C ATOM 14 CD PRO A 237 10.360 -7.302 0.789 1.00 0.00 C ATOM 0 HA PRO A 237 8.573 -4.888 -0.466 1.00 0.00 H new ATOM 0 HB2 PRO A 237 7.931 -6.255 2.092 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.176 -6.518 0.533 1.00 0.00 H new ATOM 0 HG2 PRO A 237 8.758 -8.385 1.713 1.00 0.00 H new ATOM 0 HG3 PRO A 237 8.616 -8.243 -0.027 1.00 0.00 H new ATOM 0 HD2 PRO A 237 10.825 -7.250 1.773 1.00 0.00 H new ATOM 0 HD3 PRO A 237 10.947 -8.003 0.195 1.00 0.00 H new ATOM 22 N ILE A 238 8.542 -3.062 1.097 1.00 0.00 N ATOM 23 CA ILE A 238 8.566 -1.913 1.984 1.00 0.00 C ATOM 24 C ILE A 238 7.343 -1.951 2.877 1.00 0.00 C ATOM 25 O ILE A 238 6.405 -2.714 2.631 1.00 0.00 O ATOM 26 CB ILE A 238 8.589 -0.572 1.237 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.194 0.040 1.116 1.00 0.00 C ATOM 28 CG2 ILE A 238 9.215 -0.736 -0.133 1.00 0.00 C ATOM 29 CD1 ILE A 238 7.229 1.283 0.298 1.00 0.00 C ATOM 0 H ILE A 238 8.024 -2.919 0.230 1.00 0.00 H new ATOM 0 HA ILE A 238 9.487 -1.978 2.563 1.00 0.00 H new ATOM 0 HB ILE A 238 9.198 0.115 1.824 1.00 0.00 H new ATOM 0 HG12 ILE A 238 6.514 -0.681 0.661 1.00 0.00 H new ATOM 0 HG13 ILE A 238 6.803 0.264 2.109 1.00 0.00 H new ATOM 0 HG21 ILE A 238 9.222 0.225 -0.647 1.00 0.00 H new ATOM 0 HG22 ILE A 238 10.238 -1.097 -0.025 1.00 0.00 H new ATOM 0 HG23 ILE A 238 8.636 -1.454 -0.714 1.00 0.00 H new ATOM 0 HD11 ILE A 238 6.224 1.700 0.226 1.00 0.00 H new ATOM 0 HD12 ILE A 238 7.891 2.010 0.769 1.00 0.00 H new ATOM 0 HD13 ILE A 238 7.597 1.051 -0.701 1.00 0.00 H new ATOM 41 N TYR A 239 7.346 -1.134 3.894 1.00 0.00 N ATOM 42 CA TYR A 239 6.171 -0.933 4.696 1.00 0.00 C ATOM 43 C TYR A 239 5.608 0.432 4.364 1.00 0.00 C ATOM 44 O TYR A 239 6.329 1.401 4.377 1.00 0.00 O ATOM 45 CB TYR A 239 6.546 -1.034 6.163 1.00 0.00 C ATOM 46 CG TYR A 239 6.892 -2.441 6.579 1.00 0.00 C ATOM 47 CD1 TYR A 239 5.896 -3.387 6.760 1.00 0.00 C ATOM 48 CD2 TYR A 239 8.212 -2.829 6.771 1.00 0.00 C ATOM 49 CE1 TYR A 239 6.201 -4.684 7.122 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.528 -4.124 7.136 1.00 0.00 C ATOM 51 CZ TYR A 239 7.521 -5.049 7.309 1.00 0.00 C ATOM 52 OH TYR A 239 7.835 -6.343 7.658 1.00 0.00 O ATOM 0 H TYR A 239 8.158 -0.592 4.189 1.00 0.00 H new ATOM 0 HA TYR A 239 5.416 -1.691 4.490 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.396 -0.381 6.362 1.00 0.00 H new ATOM 0 HB3 TYR A 239 5.717 -0.673 6.772 1.00 0.00 H new ATOM 0 HD1 TYR A 239 4.864 -3.105 6.615 1.00 0.00 H new ATOM 0 HD2 TYR A 239 9.004 -2.107 6.633 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.413 -5.409 7.258 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.559 -4.410 7.285 1.00 0.00 H new ATOM 0 HH TYR A 239 8.807 -6.431 7.749 1.00 0.00 H new ATOM 62 N ALA A 240 4.345 0.519 4.035 1.00 0.00 N ATOM 63 CA ALA A 240 3.782 1.794 3.641 1.00 0.00 C ATOM 64 C ALA A 240 2.751 2.253 4.649 1.00 0.00 C ATOM 65 O ALA A 240 1.736 1.586 4.870 1.00 0.00 O ATOM 66 CB ALA A 240 3.181 1.698 2.248 1.00 0.00 C ATOM 0 H ALA A 240 3.691 -0.263 4.030 1.00 0.00 H new ATOM 0 HA ALA A 240 4.580 2.536 3.616 1.00 0.00 H new ATOM 0 HB1 ALA A 240 2.762 2.664 1.965 1.00 0.00 H new ATOM 0 HB2 ALA A 240 3.957 1.417 1.536 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.393 0.945 2.243 1.00 0.00 H new ATOM 72 N ARG A 241 3.025 3.390 5.265 1.00 0.00 N ATOM 73 CA ARG A 241 2.141 3.947 6.265 1.00 0.00 C ATOM 74 C ARG A 241 1.126 4.833 5.569 1.00 0.00 C ATOM 75 O ARG A 241 1.416 5.977 5.236 1.00 0.00 O ATOM 76 CB ARG A 241 2.960 4.770 7.260 1.00 0.00 C ATOM 77 CG ARG A 241 2.397 4.779 8.676 1.00 0.00 C ATOM 78 CD ARG A 241 0.999 5.397 8.745 1.00 0.00 C ATOM 79 NE ARG A 241 1.051 6.853 8.839 1.00 0.00 N ATOM 80 CZ ARG A 241 0.362 7.562 9.732 1.00 0.00 C ATOM 81 NH1 ARG A 241 -0.389 6.948 10.637 1.00 0.00 N ATOM 82 NH2 ARG A 241 0.452 8.884 9.736 1.00 0.00 N ATOM 0 H ARG A 241 3.861 3.947 5.086 1.00 0.00 H new ATOM 0 HA ARG A 241 1.626 3.152 6.804 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.977 4.379 7.288 1.00 0.00 H new ATOM 0 HB3 ARG A 241 3.023 5.797 6.900 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.359 3.758 9.055 1.00 0.00 H new ATOM 0 HG3 ARG A 241 3.070 5.336 9.328 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.431 5.111 7.860 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.467 4.996 9.608 1.00 0.00 H new ATOM 0 HE ARG A 241 1.649 7.356 8.184 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -0.440 5.929 10.651 1.00 0.00 H new ATOM 0 HH12 ARG A 241 -0.915 7.495 11.319 1.00 0.00 H new ATOM 0 HH21 ARG A 241 1.048 9.357 9.056 1.00 0.00 H new ATOM 0 HH22 ARG A 241 -0.075 9.429 10.419 1.00 0.00 H new ATOM 96 N VAL A 242 -0.069 4.324 5.370 1.00 0.00 N ATOM 97 CA VAL A 242 -1.047 5.042 4.577 1.00 0.00 C ATOM 98 C VAL A 242 -1.832 6.026 5.435 1.00 0.00 C ATOM 99 O VAL A 242 -2.392 5.663 6.469 1.00 0.00 O ATOM 100 CB VAL A 242 -1.996 4.088 3.820 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.745 3.171 4.772 1.00 0.00 C ATOM 102 CG2 VAL A 242 -2.957 4.885 2.958 1.00 0.00 C ATOM 0 H VAL A 242 -0.386 3.428 5.740 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.496 5.608 3.826 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.392 3.452 3.173 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.403 2.514 4.203 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -2.031 2.570 5.335 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.339 3.770 5.462 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.622 4.203 2.428 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.547 5.549 3.589 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.394 5.476 2.236 1.00 0.00 H new ATOM 112 N ILE A 243 -1.856 7.275 4.987 1.00 0.00 N ATOM 113 CA ILE A 243 -2.459 8.360 5.748 1.00 0.00 C ATOM 114 C ILE A 243 -3.854 8.691 5.234 1.00 0.00 C ATOM 115 O ILE A 243 -4.505 9.609 5.727 1.00 0.00 O ATOM 116 CB ILE A 243 -1.560 9.625 5.722 1.00 0.00 C ATOM 117 CG1 ILE A 243 -1.281 10.116 4.288 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.248 9.344 6.437 1.00 0.00 C ATOM 119 CD1 ILE A 243 -2.371 10.993 3.710 1.00 0.00 C ATOM 0 H ILE A 243 -1.461 7.562 4.092 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.550 8.022 6.780 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.101 10.418 6.238 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -0.343 10.670 4.282 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -1.144 9.251 3.640 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.377 10.237 6.414 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.450 9.068 7.472 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.270 8.525 5.938 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -2.097 11.295 2.699 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -3.308 10.437 3.681 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.494 11.879 4.333 1.00 0.00 H new ATOM 131 N GLN A 244 -4.309 7.922 4.258 1.00 0.00 N ATOM 132 CA GLN A 244 -5.589 8.158 3.606 1.00 0.00 C ATOM 133 C GLN A 244 -5.841 7.067 2.584 1.00 0.00 C ATOM 134 O GLN A 244 -5.184 7.010 1.545 1.00 0.00 O ATOM 135 CB GLN A 244 -5.624 9.533 2.926 1.00 0.00 C ATOM 136 CG GLN A 244 -6.881 9.775 2.096 1.00 0.00 C ATOM 137 CD GLN A 244 -8.168 9.732 2.908 1.00 0.00 C ATOM 138 OE1 GLN A 244 -9.210 9.313 2.407 1.00 0.00 O ATOM 139 NE2 GLN A 244 -8.117 10.187 4.150 1.00 0.00 N ATOM 0 H GLN A 244 -3.801 7.115 3.894 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.371 8.142 4.365 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -5.548 10.308 3.689 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -4.750 9.633 2.283 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -6.802 10.746 1.608 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -6.935 9.025 1.307 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -7.235 10.527 4.533 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -8.960 10.198 4.724 1.00 0.00 H new ATOM 148 N LYS A 245 -6.752 6.176 2.899 1.00 0.00 N ATOM 149 CA LYS A 245 -7.109 5.115 1.986 1.00 0.00 C ATOM 150 C LYS A 245 -8.595 4.825 2.116 1.00 0.00 C ATOM 151 O LYS A 245 -9.216 5.142 3.133 1.00 0.00 O ATOM 152 CB LYS A 245 -6.263 3.868 2.277 1.00 0.00 C ATOM 153 CG LYS A 245 -5.723 3.160 1.033 1.00 0.00 C ATOM 154 CD LYS A 245 -4.454 2.388 1.367 1.00 0.00 C ATOM 155 CE LYS A 245 -3.738 1.860 0.134 1.00 0.00 C ATOM 156 NZ LYS A 245 -2.453 1.195 0.489 1.00 0.00 N ATOM 0 H LYS A 245 -7.261 6.165 3.783 1.00 0.00 H new ATOM 0 HA LYS A 245 -6.906 5.419 0.959 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.423 4.155 2.909 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.865 3.162 2.848 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -6.477 2.479 0.639 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -5.516 3.892 0.252 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -3.777 3.036 1.924 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -4.705 1.552 2.020 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -4.383 1.152 -0.387 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -3.545 2.682 -0.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.670 1.664 -0.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -2.299 1.263 1.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -2.492 0.194 0.210 1.00 0.00 H new ATOM 170 N ARG A 246 -9.150 4.252 1.074 1.00 0.00 N ATOM 171 CA ARG A 246 -10.557 3.895 1.030 1.00 0.00 C ATOM 172 C ARG A 246 -10.683 2.395 1.225 1.00 0.00 C ATOM 173 O ARG A 246 -9.679 1.727 1.471 1.00 0.00 O ATOM 174 CB ARG A 246 -11.190 4.331 -0.294 1.00 0.00 C ATOM 175 CG ARG A 246 -10.619 3.650 -1.526 1.00 0.00 C ATOM 176 CD ARG A 246 -11.454 3.971 -2.756 1.00 0.00 C ATOM 177 NE ARG A 246 -10.824 3.518 -3.995 1.00 0.00 N ATOM 178 CZ ARG A 246 -11.485 2.935 -4.998 1.00 0.00 C ATOM 179 NH1 ARG A 246 -12.781 2.674 -4.888 1.00 0.00 N ATOM 180 NH2 ARG A 246 -10.849 2.606 -6.115 1.00 0.00 N ATOM 0 H ARG A 246 -8.638 4.017 0.224 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.091 4.412 1.828 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -12.261 4.135 -0.251 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -11.068 5.409 -0.402 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.591 3.976 -1.684 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.591 2.571 -1.371 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -12.434 3.503 -2.658 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -11.619 5.047 -2.808 1.00 0.00 H new ATOM 0 HE ARG A 246 -9.819 3.656 -4.100 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -13.280 2.919 -4.033 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -13.279 2.228 -5.659 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -9.852 2.798 -6.210 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -11.357 2.161 -6.879 1.00 0.00 H new ATOM 194 N VAL A 247 -11.895 1.860 1.117 1.00 0.00 N ATOM 195 CA VAL A 247 -12.131 0.449 1.404 1.00 0.00 C ATOM 196 C VAL A 247 -12.461 -0.348 0.135 1.00 0.00 C ATOM 197 O VAL A 247 -13.590 -0.803 -0.057 1.00 0.00 O ATOM 198 CB VAL A 247 -13.247 0.263 2.458 1.00 0.00 C ATOM 199 CG1 VAL A 247 -12.733 0.644 3.834 1.00 0.00 C ATOM 200 CG2 VAL A 247 -14.476 1.094 2.112 1.00 0.00 C ATOM 0 H VAL A 247 -12.726 2.379 0.834 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.201 0.056 1.815 1.00 0.00 H new ATOM 0 HB VAL A 247 -13.538 -0.788 2.460 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -13.527 0.509 4.569 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -11.886 0.010 4.094 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -12.417 1.687 3.828 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -15.243 0.942 2.871 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -14.204 2.149 2.077 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -14.862 0.786 1.140 1.00 0.00 H new ATOM 210 N PRO A 248 -11.465 -0.524 -0.746 1.00 0.00 N ATOM 211 CA PRO A 248 -11.579 -1.300 -1.958 1.00 0.00 C ATOM 212 C PRO A 248 -11.099 -2.735 -1.742 1.00 0.00 C ATOM 213 O PRO A 248 -9.969 -2.969 -1.317 1.00 0.00 O ATOM 214 CB PRO A 248 -10.651 -0.543 -2.916 1.00 0.00 C ATOM 215 CG PRO A 248 -9.757 0.302 -2.050 1.00 0.00 C ATOM 216 CD PRO A 248 -10.124 0.012 -0.635 1.00 0.00 C ATOM 0 HA PRO A 248 -12.602 -1.395 -2.323 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -10.066 -1.236 -3.521 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -11.224 0.076 -3.606 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.708 0.067 -2.233 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -9.890 1.360 -2.274 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.440 -0.704 -0.180 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -10.099 0.911 -0.020 1.00 0.00 H new ATOM 224 N ASN A 249 -11.953 -3.688 -2.044 1.00 0.00 N ATOM 225 CA ASN A 249 -11.662 -5.090 -1.783 1.00 0.00 C ATOM 226 C ASN A 249 -10.785 -5.679 -2.878 1.00 0.00 C ATOM 227 O ASN A 249 -10.456 -5.008 -3.858 1.00 0.00 O ATOM 228 CB ASN A 249 -12.960 -5.894 -1.658 1.00 0.00 C ATOM 229 CG ASN A 249 -13.609 -5.766 -0.290 1.00 0.00 C ATOM 230 OD1 ASN A 249 -13.433 -4.768 0.412 1.00 0.00 O ATOM 231 ND2 ASN A 249 -14.374 -6.776 0.096 1.00 0.00 N ATOM 0 H ASN A 249 -12.863 -3.521 -2.474 1.00 0.00 H new ATOM 0 HA ASN A 249 -11.119 -5.149 -0.840 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.663 -5.559 -2.420 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.750 -6.945 -1.858 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -14.842 -6.744 1.002 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -14.496 -7.585 -0.513 1.00 0.00 H new ATOM 238 N ALA A 250 -10.402 -6.940 -2.712 1.00 0.00 N ATOM 239 CA ALA A 250 -9.605 -7.645 -3.715 1.00 0.00 C ATOM 240 C ALA A 250 -10.409 -7.885 -4.995 1.00 0.00 C ATOM 241 O ALA A 250 -9.945 -8.539 -5.924 1.00 0.00 O ATOM 242 CB ALA A 250 -9.107 -8.963 -3.153 1.00 0.00 C ATOM 0 H ALA A 250 -10.631 -7.499 -1.890 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.750 -7.019 -3.969 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -8.515 -9.480 -3.908 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.490 -8.774 -2.274 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -9.958 -9.583 -2.872 1.00 0.00 H new ATOM 248 N TYR A 251 -11.616 -7.347 -5.029 1.00 0.00 N ATOM 249 CA TYR A 251 -12.473 -7.429 -6.201 1.00 0.00 C ATOM 250 C TYR A 251 -12.525 -6.074 -6.890 1.00 0.00 C ATOM 251 O TYR A 251 -13.261 -5.870 -7.854 1.00 0.00 O ATOM 252 CB TYR A 251 -13.880 -7.892 -5.816 1.00 0.00 C ATOM 253 CG TYR A 251 -13.933 -9.332 -5.355 1.00 0.00 C ATOM 254 CD1 TYR A 251 -13.460 -9.699 -4.101 1.00 0.00 C ATOM 255 CD2 TYR A 251 -14.448 -10.326 -6.178 1.00 0.00 C ATOM 256 CE1 TYR A 251 -13.499 -11.014 -3.680 1.00 0.00 C ATOM 257 CE2 TYR A 251 -14.491 -11.642 -5.764 1.00 0.00 C ATOM 258 CZ TYR A 251 -14.013 -11.980 -4.516 1.00 0.00 C ATOM 259 OH TYR A 251 -14.049 -13.291 -4.102 1.00 0.00 O ATOM 0 H TYR A 251 -12.030 -6.841 -4.246 1.00 0.00 H new ATOM 0 HA TYR A 251 -12.058 -8.164 -6.890 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -14.261 -7.250 -5.022 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -14.543 -7.768 -6.673 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -13.055 -8.943 -3.444 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -14.821 -10.065 -7.157 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -13.129 -11.283 -2.702 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -14.897 -12.403 -6.414 1.00 0.00 H new ATOM 0 HH TYR A 251 -14.442 -13.846 -4.808 1.00 0.00 H new ATOM 269 N ASP A 252 -11.718 -5.149 -6.386 1.00 0.00 N ATOM 270 CA ASP A 252 -11.613 -3.817 -6.952 1.00 0.00 C ATOM 271 C ASP A 252 -10.357 -3.746 -7.793 1.00 0.00 C ATOM 272 O ASP A 252 -9.492 -2.898 -7.573 1.00 0.00 O ATOM 273 CB ASP A 252 -11.566 -2.762 -5.845 1.00 0.00 C ATOM 274 CG ASP A 252 -12.934 -2.448 -5.273 1.00 0.00 C ATOM 275 OD1 ASP A 252 -13.604 -1.534 -5.803 1.00 0.00 O ATOM 276 OD2 ASP A 252 -13.347 -3.102 -4.293 1.00 0.00 O ATOM 0 H ASP A 252 -11.120 -5.304 -5.574 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.487 -3.616 -7.571 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -10.914 -3.111 -5.044 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -11.124 -1.847 -6.240 1.00 0.00 H new ATOM 281 N LYS A 253 -10.264 -4.666 -8.756 1.00 0.00 N ATOM 282 CA LYS A 253 -9.035 -4.888 -9.512 1.00 0.00 C ATOM 283 C LYS A 253 -7.929 -5.264 -8.534 1.00 0.00 C ATOM 284 O LYS A 253 -6.749 -5.016 -8.781 1.00 0.00 O ATOM 285 CB LYS A 253 -8.629 -3.657 -10.347 1.00 0.00 C ATOM 286 CG LYS A 253 -9.689 -3.191 -11.341 1.00 0.00 C ATOM 287 CD LYS A 253 -10.711 -2.279 -10.678 1.00 0.00 C ATOM 288 CE LYS A 253 -11.865 -1.940 -11.605 1.00 0.00 C ATOM 289 NZ LYS A 253 -11.407 -1.279 -12.854 1.00 0.00 N ATOM 0 H LYS A 253 -11.036 -5.274 -9.031 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.204 -5.697 -10.223 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -8.397 -2.835 -9.670 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -7.714 -3.889 -10.892 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -9.209 -2.663 -12.166 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -10.195 -4.057 -11.768 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -11.098 -2.762 -9.781 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -10.221 -1.359 -10.359 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -12.407 -2.852 -11.856 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -12.566 -1.286 -11.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -12.232 -0.960 -13.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -10.812 -0.460 -12.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -10.856 -1.954 -13.422 1.00 0.00 H new ATOM 303 N THR A 254 -8.363 -5.850 -7.412 1.00 0.00 N ATOM 304 CA THR A 254 -7.515 -6.242 -6.302 1.00 0.00 C ATOM 305 C THR A 254 -6.821 -5.027 -5.702 1.00 0.00 C ATOM 306 O THR A 254 -5.705 -4.666 -6.067 1.00 0.00 O ATOM 307 CB THR A 254 -6.495 -7.350 -6.656 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.467 -6.869 -7.529 1.00 0.00 O ATOM 309 CG2 THR A 254 -7.184 -8.534 -7.311 1.00 0.00 C ATOM 0 H THR A 254 -9.347 -6.067 -7.256 1.00 0.00 H new ATOM 0 HA THR A 254 -8.176 -6.681 -5.555 1.00 0.00 H new ATOM 0 HB THR A 254 -6.038 -7.665 -5.718 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.657 -5.940 -7.778 1.00 0.00 H new ATOM 0 HG21 THR A 254 -6.445 -9.299 -7.550 1.00 0.00 H new ATOM 0 HG22 THR A 254 -7.926 -8.947 -6.627 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.677 -8.207 -8.227 1.00 0.00 H new ATOM 317 N ALA A 255 -7.522 -4.373 -4.801 1.00 0.00 N ATOM 318 CA ALA A 255 -6.983 -3.207 -4.124 1.00 0.00 C ATOM 319 C ALA A 255 -6.882 -3.432 -2.615 1.00 0.00 C ATOM 320 O ALA A 255 -7.439 -4.387 -2.076 1.00 0.00 O ATOM 321 CB ALA A 255 -7.838 -1.996 -4.434 1.00 0.00 C ATOM 0 H ALA A 255 -8.468 -4.627 -4.518 1.00 0.00 H new ATOM 0 HA ALA A 255 -5.972 -3.032 -4.491 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.431 -1.123 -3.924 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -7.842 -1.819 -5.510 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -8.858 -2.173 -4.092 1.00 0.00 H new ATOM 327 N LEU A 256 -6.135 -2.553 -1.953 1.00 0.00 N ATOM 328 CA LEU A 256 -5.967 -2.603 -0.503 1.00 0.00 C ATOM 329 C LEU A 256 -7.067 -1.809 0.193 1.00 0.00 C ATOM 330 O LEU A 256 -7.100 -0.580 0.101 1.00 0.00 O ATOM 331 CB LEU A 256 -4.604 -2.020 -0.074 1.00 0.00 C ATOM 332 CG LEU A 256 -3.379 -2.894 -0.297 1.00 0.00 C ATOM 333 CD1 LEU A 256 -3.475 -4.141 0.561 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.242 -3.256 -1.749 1.00 0.00 C ATOM 0 H LEU A 256 -5.631 -1.789 -2.404 1.00 0.00 H new ATOM 0 HA LEU A 256 -6.020 -3.652 -0.212 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -4.453 -1.082 -0.609 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.658 -1.777 0.987 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.490 -2.335 -0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -2.595 -4.764 0.398 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -3.528 -3.856 1.612 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -4.371 -4.700 0.291 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.360 -3.881 -1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -4.128 -3.802 -2.073 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -3.139 -2.347 -2.342 1.00 0.00 H new ATOM 346 N ALA A 257 -7.938 -2.501 0.914 1.00 0.00 N ATOM 347 CA ALA A 257 -9.004 -1.844 1.662 1.00 0.00 C ATOM 348 C ALA A 257 -8.477 -1.338 2.992 1.00 0.00 C ATOM 349 O ALA A 257 -8.625 -1.983 4.034 1.00 0.00 O ATOM 350 CB ALA A 257 -10.169 -2.792 1.855 1.00 0.00 C ATOM 0 H ALA A 257 -7.929 -3.518 0.998 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.361 -0.985 1.094 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.958 -2.290 2.415 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.553 -3.099 0.882 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.836 -3.671 2.407 1.00 0.00 H new ATOM 356 N LEU A 258 -7.848 -0.178 2.930 1.00 0.00 N ATOM 357 CA LEU A 258 -7.112 0.384 4.066 1.00 0.00 C ATOM 358 C LEU A 258 -7.670 1.762 4.398 1.00 0.00 C ATOM 359 O LEU A 258 -8.585 2.230 3.737 1.00 0.00 O ATOM 360 CB LEU A 258 -5.606 0.487 3.745 1.00 0.00 C ATOM 361 CG LEU A 258 -4.779 -0.813 3.789 1.00 0.00 C ATOM 362 CD1 LEU A 258 -5.442 -1.912 2.999 1.00 0.00 C ATOM 363 CD2 LEU A 258 -3.397 -0.570 3.215 1.00 0.00 C ATOM 0 H LEU A 258 -7.828 0.407 2.094 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.233 -0.276 4.925 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -5.503 0.918 2.749 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.160 1.193 4.445 1.00 0.00 H new ATOM 0 HG LEU A 258 -4.706 -1.120 4.832 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.834 -2.815 3.050 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -6.429 -2.115 3.415 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -5.544 -1.602 1.959 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -2.821 -1.494 3.251 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -3.486 -0.237 2.181 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -2.890 0.197 3.800 1.00 0.00 H new ATOM 375 N GLU A 259 -7.153 2.406 5.428 1.00 0.00 N ATOM 376 CA GLU A 259 -7.631 3.730 5.782 1.00 0.00 C ATOM 377 C GLU A 259 -6.491 4.611 6.284 1.00 0.00 C ATOM 378 O GLU A 259 -5.318 4.256 6.172 1.00 0.00 O ATOM 379 CB GLU A 259 -8.732 3.633 6.837 1.00 0.00 C ATOM 380 CG GLU A 259 -8.240 3.207 8.209 1.00 0.00 C ATOM 381 CD GLU A 259 -9.359 3.103 9.218 1.00 0.00 C ATOM 382 OE1 GLU A 259 -9.916 4.152 9.601 1.00 0.00 O ATOM 383 OE2 GLU A 259 -9.685 1.976 9.638 1.00 0.00 O ATOM 0 H GLU A 259 -6.413 2.041 6.027 1.00 0.00 H new ATOM 0 HA GLU A 259 -8.043 4.191 4.884 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.224 4.602 6.924 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -9.485 2.923 6.496 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -7.737 2.243 8.128 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -7.500 3.924 8.565 1.00 0.00 H new ATOM 390 N VAL A 260 -6.852 5.758 6.837 1.00 0.00 N ATOM 391 CA VAL A 260 -5.884 6.679 7.420 1.00 0.00 C ATOM 392 C VAL A 260 -5.192 6.089 8.655 1.00 0.00 C ATOM 393 O VAL A 260 -5.839 5.695 9.626 1.00 0.00 O ATOM 394 CB VAL A 260 -6.549 8.029 7.788 1.00 0.00 C ATOM 395 CG1 VAL A 260 -7.852 7.801 8.541 1.00 0.00 C ATOM 396 CG2 VAL A 260 -5.602 8.899 8.610 1.00 0.00 C ATOM 0 H VAL A 260 -7.819 6.078 6.895 1.00 0.00 H new ATOM 0 HA VAL A 260 -5.123 6.851 6.658 1.00 0.00 H new ATOM 0 HB VAL A 260 -6.775 8.555 6.860 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -8.302 8.762 8.789 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -8.538 7.230 7.916 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -7.650 7.247 9.458 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -6.093 9.841 8.855 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -5.336 8.378 9.530 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -4.699 9.100 8.033 1.00 0.00 H new ATOM 406 N GLY A 261 -3.872 5.995 8.581 1.00 0.00 N ATOM 407 CA GLY A 261 -3.073 5.633 9.731 1.00 0.00 C ATOM 408 C GLY A 261 -2.598 4.204 9.676 1.00 0.00 C ATOM 409 O GLY A 261 -1.854 3.755 10.548 1.00 0.00 O ATOM 0 H GLY A 261 -3.335 6.166 7.731 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.211 6.297 9.794 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.658 5.783 10.638 1.00 0.00 H new ATOM 413 N GLU A 262 -3.005 3.494 8.641 1.00 0.00 N ATOM 414 CA GLU A 262 -2.756 2.064 8.572 1.00 0.00 C ATOM 415 C GLU A 262 -1.416 1.769 7.920 1.00 0.00 C ATOM 416 O GLU A 262 -0.729 2.672 7.450 1.00 0.00 O ATOM 417 CB GLU A 262 -3.873 1.359 7.812 1.00 0.00 C ATOM 418 CG GLU A 262 -5.230 1.556 8.449 1.00 0.00 C ATOM 419 CD GLU A 262 -6.158 0.391 8.191 1.00 0.00 C ATOM 420 OE1 GLU A 262 -6.452 0.108 7.016 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.576 -0.264 9.170 1.00 0.00 O ATOM 0 H GLU A 262 -3.506 3.879 7.841 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.730 1.684 9.593 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.900 1.731 6.788 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.653 0.293 7.758 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -5.109 1.690 9.524 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.681 2.470 8.063 1.00 0.00 H new ATOM 428 N LEU A 263 -1.049 0.502 7.902 1.00 0.00 N ATOM 429 CA LEU A 263 0.202 0.082 7.310 1.00 0.00 C ATOM 430 C LEU A 263 -0.033 -1.073 6.348 1.00 0.00 C ATOM 431 O LEU A 263 -1.045 -1.766 6.426 1.00 0.00 O ATOM 432 CB LEU A 263 1.188 -0.333 8.399 1.00 0.00 C ATOM 433 CG LEU A 263 2.565 -0.761 7.890 1.00 0.00 C ATOM 434 CD1 LEU A 263 3.379 0.453 7.479 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.305 -1.574 8.929 1.00 0.00 C ATOM 0 H LEU A 263 -1.605 -0.258 8.294 1.00 0.00 H new ATOM 0 HA LEU A 263 0.625 0.920 6.755 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.315 0.500 9.091 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.755 -1.156 8.967 1.00 0.00 H new ATOM 0 HG LEU A 263 2.419 -1.394 7.015 1.00 0.00 H new ATOM 0 HD11 LEU A 263 4.356 0.131 7.119 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.858 0.988 6.685 1.00 0.00 H new ATOM 0 HD13 LEU A 263 3.508 1.112 8.337 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.280 -1.863 8.538 1.00 0.00 H new ATOM 0 HD22 LEU A 263 3.439 -0.977 9.831 1.00 0.00 H new ATOM 0 HD23 LEU A 263 2.730 -2.469 9.168 1.00 0.00 H new ATOM 447 N VAL A 264 0.905 -1.261 5.441 1.00 0.00 N ATOM 448 CA VAL A 264 0.829 -2.312 4.445 1.00 0.00 C ATOM 449 C VAL A 264 2.248 -2.718 4.075 1.00 0.00 C ATOM 450 O VAL A 264 3.159 -1.908 4.173 1.00 0.00 O ATOM 451 CB VAL A 264 0.055 -1.836 3.184 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.833 -0.788 2.423 1.00 0.00 C ATOM 453 CG2 VAL A 264 -0.271 -2.991 2.260 1.00 0.00 C ATOM 0 H VAL A 264 1.745 -0.687 5.374 1.00 0.00 H new ATOM 0 HA VAL A 264 0.286 -3.164 4.855 1.00 0.00 H new ATOM 0 HB VAL A 264 -0.878 -1.397 3.538 1.00 0.00 H new ATOM 0 HG11 VAL A 264 0.264 -0.477 1.547 1.00 0.00 H new ATOM 0 HG12 VAL A 264 1.008 0.074 3.067 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.789 -1.204 2.105 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.812 -2.619 1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 264 0.653 -3.469 1.936 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -0.889 -3.717 2.789 1.00 0.00 H new ATOM 463 N LYS A 265 2.455 -3.953 3.687 1.00 0.00 N ATOM 464 CA LYS A 265 3.769 -4.373 3.245 1.00 0.00 C ATOM 465 C LYS A 265 3.734 -4.634 1.751 1.00 0.00 C ATOM 466 O LYS A 265 3.293 -5.694 1.312 1.00 0.00 O ATOM 467 CB LYS A 265 4.237 -5.629 3.984 1.00 0.00 C ATOM 468 CG LYS A 265 5.709 -5.925 3.747 1.00 0.00 C ATOM 469 CD LYS A 265 5.998 -7.414 3.605 1.00 0.00 C ATOM 470 CE LYS A 265 6.171 -8.106 4.947 1.00 0.00 C ATOM 471 NZ LYS A 265 4.874 -8.430 5.599 1.00 0.00 N ATOM 0 H LYS A 265 1.741 -4.681 3.667 1.00 0.00 H new ATOM 0 HA LYS A 265 4.478 -3.575 3.468 1.00 0.00 H new ATOM 0 HB2 LYS A 265 4.061 -5.505 5.053 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.641 -6.482 3.660 1.00 0.00 H new ATOM 0 HG2 LYS A 265 6.038 -5.408 2.845 1.00 0.00 H new ATOM 0 HG3 LYS A 265 6.293 -5.524 4.575 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.183 -7.888 3.058 1.00 0.00 H new ATOM 0 HD3 LYS A 265 6.902 -7.550 3.011 1.00 0.00 H new ATOM 0 HE2 LYS A 265 6.741 -9.024 4.806 1.00 0.00 H new ATOM 0 HE3 LYS A 265 6.755 -7.466 5.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 5.047 -9.003 6.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 4.391 -7.549 5.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 4.276 -8.964 4.937 1.00 0.00 H new ATOM 485 N VAL A 266 4.166 -3.663 0.964 1.00 0.00 N ATOM 486 CA VAL A 266 4.136 -3.814 -0.473 1.00 0.00 C ATOM 487 C VAL A 266 5.238 -4.758 -0.931 1.00 0.00 C ATOM 488 O VAL A 266 6.435 -4.484 -0.790 1.00 0.00 O ATOM 489 CB VAL A 266 4.206 -2.450 -1.198 1.00 0.00 C ATOM 490 CG1 VAL A 266 3.110 -1.536 -0.687 1.00 0.00 C ATOM 491 CG2 VAL A 266 5.560 -1.788 -1.051 1.00 0.00 C ATOM 0 H VAL A 266 4.537 -2.772 1.295 1.00 0.00 H new ATOM 0 HA VAL A 266 3.178 -4.258 -0.745 1.00 0.00 H new ATOM 0 HB VAL A 266 4.058 -2.636 -2.262 1.00 0.00 H new ATOM 0 HG11 VAL A 266 3.166 -0.577 -1.202 1.00 0.00 H new ATOM 0 HG12 VAL A 266 2.138 -1.993 -0.875 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.237 -1.380 0.384 1.00 0.00 H new ATOM 0 HG21 VAL A 266 5.558 -0.834 -1.578 1.00 0.00 H new ATOM 0 HG22 VAL A 266 5.770 -1.619 0.005 1.00 0.00 H new ATOM 0 HG23 VAL A 266 6.329 -2.434 -1.475 1.00 0.00 H new ATOM 501 N THR A 267 4.810 -5.897 -1.443 1.00 0.00 N ATOM 502 CA THR A 267 5.713 -6.962 -1.821 1.00 0.00 C ATOM 503 C THR A 267 6.107 -6.850 -3.272 1.00 0.00 C ATOM 504 O THR A 267 6.878 -7.664 -3.783 1.00 0.00 O ATOM 505 CB THR A 267 5.072 -8.332 -1.553 1.00 0.00 C ATOM 506 OG1 THR A 267 3.826 -8.425 -2.253 1.00 0.00 O ATOM 507 CG2 THR A 267 4.829 -8.526 -0.066 1.00 0.00 C ATOM 0 H THR A 267 3.826 -6.108 -1.608 1.00 0.00 H new ATOM 0 HA THR A 267 6.613 -6.868 -1.213 1.00 0.00 H new ATOM 0 HB THR A 267 5.752 -9.108 -1.903 1.00 0.00 H new ATOM 0 HG1 THR A 267 3.419 -9.300 -2.082 1.00 0.00 H new ATOM 0 HG21 THR A 267 4.374 -9.502 0.104 1.00 0.00 H new ATOM 0 HG22 THR A 267 5.777 -8.469 0.468 1.00 0.00 H new ATOM 0 HG23 THR A 267 4.160 -7.746 0.298 1.00 0.00 H new ATOM 515 N LYS A 268 5.596 -5.834 -3.938 1.00 0.00 N ATOM 516 CA LYS A 268 6.040 -5.568 -5.277 1.00 0.00 C ATOM 517 C LYS A 268 6.253 -4.092 -5.447 1.00 0.00 C ATOM 518 O LYS A 268 5.310 -3.317 -5.539 1.00 0.00 O ATOM 519 CB LYS A 268 5.072 -6.109 -6.312 1.00 0.00 C ATOM 520 CG LYS A 268 5.787 -6.868 -7.407 1.00 0.00 C ATOM 521 CD LYS A 268 6.820 -5.994 -8.081 1.00 0.00 C ATOM 522 CE LYS A 268 6.162 -4.877 -8.875 1.00 0.00 C ATOM 523 NZ LYS A 268 7.152 -4.045 -9.601 1.00 0.00 N ATOM 0 H LYS A 268 4.888 -5.195 -3.577 1.00 0.00 H new ATOM 0 HA LYS A 268 6.985 -6.086 -5.438 1.00 0.00 H new ATOM 0 HB2 LYS A 268 4.350 -6.766 -5.826 1.00 0.00 H new ATOM 0 HB3 LYS A 268 4.509 -5.284 -6.749 1.00 0.00 H new ATOM 0 HG2 LYS A 268 6.269 -7.751 -6.988 1.00 0.00 H new ATOM 0 HG3 LYS A 268 5.064 -7.219 -8.144 1.00 0.00 H new ATOM 0 HD2 LYS A 268 7.485 -5.567 -7.330 1.00 0.00 H new ATOM 0 HD3 LYS A 268 7.436 -6.601 -8.744 1.00 0.00 H new ATOM 0 HE2 LYS A 268 5.459 -5.307 -9.588 1.00 0.00 H new ATOM 0 HE3 LYS A 268 5.585 -4.245 -8.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 6.666 -3.482 -10.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 7.628 -3.408 -8.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 7.857 -4.661 -10.054 1.00 0.00 H new ATOM 537 N ILE A 269 7.512 -3.731 -5.506 1.00 0.00 N ATOM 538 CA ILE A 269 7.920 -2.340 -5.460 1.00 0.00 C ATOM 539 C ILE A 269 8.333 -1.795 -6.816 1.00 0.00 C ATOM 540 O ILE A 269 8.596 -2.544 -7.759 1.00 0.00 O ATOM 541 CB ILE A 269 9.033 -2.098 -4.416 1.00 0.00 C ATOM 542 CG1 ILE A 269 9.981 -3.296 -4.324 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.405 -1.807 -3.070 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.519 -3.706 -5.663 1.00 0.00 C ATOM 0 H ILE A 269 8.286 -4.390 -5.587 1.00 0.00 H new ATOM 0 HA ILE A 269 7.034 -1.787 -5.150 1.00 0.00 H new ATOM 0 HB ILE A 269 9.626 -1.239 -4.731 1.00 0.00 H new ATOM 0 HG12 ILE A 269 10.811 -3.048 -3.663 1.00 0.00 H new ATOM 0 HG13 ILE A 269 9.455 -4.138 -3.874 1.00 0.00 H new ATOM 0 HG21 ILE A 269 9.189 -1.636 -2.332 1.00 0.00 H new ATOM 0 HG22 ILE A 269 7.778 -0.919 -3.146 1.00 0.00 H new ATOM 0 HG23 ILE A 269 7.795 -2.656 -2.762 1.00 0.00 H new ATOM 0 HD11 ILE A 269 11.186 -4.560 -5.541 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.693 -3.981 -6.318 1.00 0.00 H new ATOM 0 HD13 ILE A 269 11.070 -2.875 -6.104 1.00 0.00 H new ATOM 556 N ASN A 270 8.329 -0.478 -6.912 1.00 0.00 N ATOM 557 CA ASN A 270 8.627 0.204 -8.158 1.00 0.00 C ATOM 558 C ASN A 270 9.334 1.522 -7.869 1.00 0.00 C ATOM 559 O ASN A 270 9.421 1.942 -6.721 1.00 0.00 O ATOM 560 CB ASN A 270 7.339 0.425 -8.951 1.00 0.00 C ATOM 561 CG ASN A 270 6.470 1.530 -8.393 1.00 0.00 C ATOM 562 OD1 ASN A 270 6.458 2.639 -8.906 1.00 0.00 O ATOM 563 ND2 ASN A 270 5.768 1.255 -7.312 1.00 0.00 N ATOM 0 H ASN A 270 8.120 0.146 -6.133 1.00 0.00 H new ATOM 0 HA ASN A 270 9.293 -0.412 -8.762 1.00 0.00 H new ATOM 0 HB2 ASN A 270 7.594 0.660 -9.984 1.00 0.00 H new ATOM 0 HB3 ASN A 270 6.768 -0.503 -8.967 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.193 1.978 -6.880 1.00 0.00 H new ATOM 0 HD22 ASN A 270 5.799 0.319 -6.908 1.00 0.00 H new ATOM 570 N VAL A 271 9.822 2.176 -8.911 1.00 0.00 N ATOM 571 CA VAL A 271 10.596 3.405 -8.746 1.00 0.00 C ATOM 572 C VAL A 271 9.712 4.656 -8.687 1.00 0.00 C ATOM 573 O VAL A 271 10.219 5.776 -8.659 1.00 0.00 O ATOM 574 CB VAL A 271 11.629 3.570 -9.883 1.00 0.00 C ATOM 575 CG1 VAL A 271 12.656 2.450 -9.841 1.00 0.00 C ATOM 576 CG2 VAL A 271 10.938 3.615 -11.239 1.00 0.00 C ATOM 0 H VAL A 271 9.699 1.881 -9.879 1.00 0.00 H new ATOM 0 HA VAL A 271 11.112 3.308 -7.791 1.00 0.00 H new ATOM 0 HB VAL A 271 12.149 4.517 -9.735 1.00 0.00 H new ATOM 0 HG11 VAL A 271 13.374 2.585 -10.650 1.00 0.00 H new ATOM 0 HG12 VAL A 271 13.178 2.471 -8.885 1.00 0.00 H new ATOM 0 HG13 VAL A 271 12.153 1.490 -9.959 1.00 0.00 H new ATOM 0 HG21 VAL A 271 11.685 3.732 -12.024 1.00 0.00 H new ATOM 0 HG22 VAL A 271 10.387 2.688 -11.397 1.00 0.00 H new ATOM 0 HG23 VAL A 271 10.247 4.458 -11.267 1.00 0.00 H new ATOM 586 N SER A 272 8.398 4.473 -8.685 1.00 0.00 N ATOM 587 CA SER A 272 7.479 5.606 -8.638 1.00 0.00 C ATOM 588 C SER A 272 6.724 5.673 -7.310 1.00 0.00 C ATOM 589 O SER A 272 6.567 6.743 -6.735 1.00 0.00 O ATOM 590 CB SER A 272 6.478 5.530 -9.791 1.00 0.00 C ATOM 591 OG SER A 272 7.126 5.193 -11.007 1.00 0.00 O ATOM 0 H SER A 272 7.946 3.559 -8.715 1.00 0.00 H new ATOM 0 HA SER A 272 8.079 6.511 -8.733 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.713 4.787 -9.565 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.970 6.488 -9.899 1.00 0.00 H new ATOM 0 HG SER A 272 6.465 5.149 -11.729 1.00 0.00 H new ATOM 597 N GLY A 273 6.249 4.525 -6.829 1.00 0.00 N ATOM 598 CA GLY A 273 5.434 4.506 -5.631 1.00 0.00 C ATOM 599 C GLY A 273 4.057 3.924 -5.889 1.00 0.00 C ATOM 600 O GLY A 273 3.226 3.854 -4.994 1.00 0.00 O ATOM 0 H GLY A 273 6.415 3.611 -7.249 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.936 3.921 -4.860 1.00 0.00 H new ATOM 0 HA3 GLY A 273 5.332 5.521 -5.246 1.00 0.00 H new ATOM 604 N GLN A 274 3.808 3.539 -7.134 1.00 0.00 N ATOM 605 CA GLN A 274 2.542 2.920 -7.509 1.00 0.00 C ATOM 606 C GLN A 274 2.723 1.419 -7.536 1.00 0.00 C ATOM 607 O GLN A 274 2.872 0.803 -8.593 1.00 0.00 O ATOM 608 CB GLN A 274 2.049 3.439 -8.867 1.00 0.00 C ATOM 609 CG GLN A 274 1.632 4.903 -8.835 1.00 0.00 C ATOM 610 CD GLN A 274 2.793 5.869 -8.995 1.00 0.00 C ATOM 611 OE1 GLN A 274 3.049 6.377 -10.086 1.00 0.00 O ATOM 612 NE2 GLN A 274 3.558 6.055 -7.934 1.00 0.00 N ATOM 0 H GLN A 274 4.468 3.645 -7.904 1.00 0.00 H new ATOM 0 HA GLN A 274 1.782 3.182 -6.773 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.839 3.309 -9.607 1.00 0.00 H new ATOM 0 HB3 GLN A 274 1.203 2.834 -9.194 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.908 5.083 -9.629 1.00 0.00 H new ATOM 0 HG3 GLN A 274 1.127 5.108 -7.891 1.00 0.00 H new ATOM 0 HE21 GLN A 274 3.313 5.617 -7.046 1.00 0.00 H new ATOM 0 HE22 GLN A 274 4.393 6.636 -8.003 1.00 0.00 H new ATOM 621 N TRP A 275 2.729 0.841 -6.355 1.00 0.00 N ATOM 622 CA TRP A 275 3.154 -0.530 -6.188 1.00 0.00 C ATOM 623 C TRP A 275 2.048 -1.418 -5.660 1.00 0.00 C ATOM 624 O TRP A 275 0.990 -0.946 -5.238 1.00 0.00 O ATOM 625 CB TRP A 275 4.364 -0.604 -5.259 1.00 0.00 C ATOM 626 CG TRP A 275 4.494 0.520 -4.280 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.554 1.012 -3.423 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.678 1.275 -4.046 1.00 0.00 C ATOM 629 NE1 TRP A 275 4.092 2.028 -2.674 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.398 2.200 -3.036 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.948 1.249 -4.599 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.353 3.089 -2.567 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.897 2.127 -4.140 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.599 3.035 -3.126 1.00 0.00 C ATOM 0 H TRP A 275 2.442 1.303 -5.492 1.00 0.00 H new ATOM 0 HA TRP A 275 3.427 -0.898 -7.177 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.318 -1.542 -4.705 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.267 -0.638 -5.869 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.538 0.655 -3.345 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.598 2.567 -1.963 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.188 0.546 -5.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 6.120 3.799 -1.787 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.888 2.114 -4.570 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.367 3.709 -2.775 1.00 0.00 H new ATOM 645 N GLU A 276 2.312 -2.717 -5.685 1.00 0.00 N ATOM 646 CA GLU A 276 1.355 -3.692 -5.219 1.00 0.00 C ATOM 647 C GLU A 276 1.588 -3.955 -3.743 1.00 0.00 C ATOM 648 O GLU A 276 2.703 -4.292 -3.319 1.00 0.00 O ATOM 649 CB GLU A 276 1.470 -4.981 -6.036 1.00 0.00 C ATOM 650 CG GLU A 276 1.335 -4.744 -7.532 1.00 0.00 C ATOM 651 CD GLU A 276 1.391 -6.021 -8.347 1.00 0.00 C ATOM 652 OE1 GLU A 276 2.495 -6.573 -8.522 1.00 0.00 O ATOM 653 OE2 GLU A 276 0.330 -6.465 -8.834 1.00 0.00 O ATOM 0 H GLU A 276 3.187 -3.114 -6.026 1.00 0.00 H new ATOM 0 HA GLU A 276 0.344 -3.306 -5.351 1.00 0.00 H new ATOM 0 HB2 GLU A 276 2.433 -5.450 -5.832 1.00 0.00 H new ATOM 0 HB3 GLU A 276 0.699 -5.681 -5.713 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.391 -4.236 -7.729 1.00 0.00 H new ATOM 0 HG3 GLU A 276 2.131 -4.076 -7.861 1.00 0.00 H new ATOM 660 N GLY A 277 0.521 -3.805 -2.977 1.00 0.00 N ATOM 661 CA GLY A 277 0.614 -3.826 -1.540 1.00 0.00 C ATOM 662 C GLY A 277 -0.036 -5.047 -0.943 1.00 0.00 C ATOM 663 O GLY A 277 -1.030 -5.546 -1.471 1.00 0.00 O ATOM 0 H GLY A 277 -0.424 -3.667 -3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.663 -3.795 -1.245 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.142 -2.931 -1.134 1.00 0.00 H new ATOM 667 N GLU A 278 0.520 -5.536 0.150 1.00 0.00 N ATOM 668 CA GLU A 278 -0.103 -6.616 0.885 1.00 0.00 C ATOM 669 C GLU A 278 -0.093 -6.279 2.368 1.00 0.00 C ATOM 670 O GLU A 278 0.961 -6.150 2.984 1.00 0.00 O ATOM 671 CB GLU A 278 0.620 -7.935 0.604 1.00 0.00 C ATOM 672 CG GLU A 278 -0.113 -9.163 1.109 1.00 0.00 C ATOM 673 CD GLU A 278 0.142 -9.446 2.574 1.00 0.00 C ATOM 674 OE1 GLU A 278 1.304 -9.735 2.932 1.00 0.00 O ATOM 675 OE2 GLU A 278 -0.813 -9.392 3.374 1.00 0.00 O ATOM 0 H GLU A 278 1.399 -5.202 0.546 1.00 0.00 H new ATOM 0 HA GLU A 278 -1.137 -6.736 0.562 1.00 0.00 H new ATOM 0 HB2 GLU A 278 0.771 -8.032 -0.471 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.608 -7.900 1.063 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -1.183 -9.030 0.952 1.00 0.00 H new ATOM 0 HG3 GLU A 278 0.191 -10.028 0.520 1.00 0.00 H new ATOM 682 N CYS A 279 -1.272 -6.135 2.933 1.00 0.00 N ATOM 683 CA CYS A 279 -1.413 -5.764 4.327 1.00 0.00 C ATOM 684 C CYS A 279 -2.070 -6.888 5.098 1.00 0.00 C ATOM 685 O CYS A 279 -3.288 -7.062 5.077 1.00 0.00 O ATOM 686 CB CYS A 279 -2.239 -4.473 4.437 1.00 0.00 C ATOM 687 SG CYS A 279 -2.796 -4.054 6.106 1.00 0.00 S ATOM 0 H CYS A 279 -2.156 -6.271 2.443 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.427 -5.585 4.756 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -1.643 -3.646 4.052 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -3.113 -4.564 3.792 1.00 0.00 H new ATOM 0 HG CYS A 279 -2.147 -3.011 6.531 1.00 0.00 H new ATOM 693 N ASN A 280 -1.188 -7.650 5.765 1.00 0.00 N ATOM 694 CA ASN A 280 -1.534 -8.745 6.674 1.00 0.00 C ATOM 695 C ASN A 280 -2.816 -9.473 6.289 1.00 0.00 C ATOM 696 O ASN A 280 -3.725 -9.616 7.107 1.00 0.00 O ATOM 697 CB ASN A 280 -1.579 -8.259 8.135 1.00 0.00 C ATOM 698 CG ASN A 280 -2.056 -6.825 8.295 1.00 0.00 C ATOM 699 OD1 ASN A 280 -3.253 -6.566 8.435 1.00 0.00 O ATOM 700 ND2 ASN A 280 -1.117 -5.883 8.285 1.00 0.00 N ATOM 0 H ASN A 280 -0.181 -7.513 5.680 1.00 0.00 H new ATOM 0 HA ASN A 280 -0.736 -9.481 6.579 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -2.236 -8.915 8.705 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -0.583 -8.350 8.568 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -1.377 -4.903 8.396 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -0.137 -6.141 8.166 1.00 0.00 H new ATOM 707 N GLY A 281 -2.854 -9.973 5.054 1.00 0.00 N ATOM 708 CA GLY A 281 -3.991 -10.748 4.590 1.00 0.00 C ATOM 709 C GLY A 281 -4.734 -10.101 3.430 1.00 0.00 C ATOM 710 O GLY A 281 -5.541 -10.753 2.766 1.00 0.00 O ATOM 0 H GLY A 281 -2.112 -9.853 4.364 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -3.647 -11.736 4.285 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -4.684 -10.894 5.419 1.00 0.00 H new ATOM 714 N LYS A 282 -4.471 -8.826 3.177 1.00 0.00 N ATOM 715 CA LYS A 282 -5.096 -8.127 2.055 1.00 0.00 C ATOM 716 C LYS A 282 -4.062 -7.877 0.966 1.00 0.00 C ATOM 717 O LYS A 282 -3.005 -7.334 1.244 1.00 0.00 O ATOM 718 CB LYS A 282 -5.656 -6.781 2.522 1.00 0.00 C ATOM 719 CG LYS A 282 -6.459 -6.861 3.807 1.00 0.00 C ATOM 720 CD LYS A 282 -6.109 -5.708 4.731 1.00 0.00 C ATOM 721 CE LYS A 282 -6.823 -5.814 6.067 1.00 0.00 C ATOM 722 NZ LYS A 282 -6.351 -4.778 7.025 1.00 0.00 N ATOM 0 H LYS A 282 -3.832 -8.254 3.729 1.00 0.00 H new ATOM 0 HA LYS A 282 -5.905 -8.745 1.665 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.830 -6.085 2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -6.288 -6.369 1.735 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.524 -6.839 3.578 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -6.260 -7.808 4.308 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -5.032 -5.690 4.896 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -6.374 -4.766 4.252 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -7.897 -5.708 5.915 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -6.658 -6.804 6.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -6.430 -5.141 7.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -5.358 -4.545 6.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -6.934 -3.923 6.927 1.00 0.00 H new ATOM 736 N ARG A 283 -4.358 -8.249 -0.269 1.00 0.00 N ATOM 737 CA ARG A 283 -3.407 -8.026 -1.352 1.00 0.00 C ATOM 738 C ARG A 283 -4.030 -7.198 -2.470 1.00 0.00 C ATOM 739 O ARG A 283 -5.218 -7.326 -2.767 1.00 0.00 O ATOM 740 CB ARG A 283 -2.854 -9.366 -1.874 1.00 0.00 C ATOM 741 CG ARG A 283 -3.867 -10.281 -2.544 1.00 0.00 C ATOM 742 CD ARG A 283 -4.062 -9.892 -3.988 1.00 0.00 C ATOM 743 NE ARG A 283 -2.893 -10.196 -4.817 1.00 0.00 N ATOM 744 CZ ARG A 283 -2.525 -9.470 -5.873 1.00 0.00 C ATOM 745 NH1 ARG A 283 -3.214 -8.387 -6.214 1.00 0.00 N ATOM 746 NH2 ARG A 283 -1.468 -9.822 -6.595 1.00 0.00 N ATOM 0 H ARG A 283 -5.231 -8.698 -0.546 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.568 -7.453 -0.958 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -2.055 -9.156 -2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.404 -9.902 -1.039 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -3.527 -11.315 -2.483 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -4.819 -10.227 -2.016 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -4.931 -10.415 -4.387 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -4.277 -8.825 -4.047 1.00 0.00 H new ATOM 0 HE ARG A 283 -2.328 -11.009 -4.572 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -4.028 -8.108 -5.667 1.00 0.00 H new ATOM 0 HH12 ARG A 283 -2.929 -7.835 -7.023 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -0.932 -10.652 -6.343 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -1.192 -9.262 -7.402 1.00 0.00 H new ATOM 760 N GLY A 284 -3.221 -6.342 -3.073 1.00 0.00 N ATOM 761 CA GLY A 284 -3.685 -5.519 -4.171 1.00 0.00 C ATOM 762 C GLY A 284 -2.619 -4.556 -4.657 1.00 0.00 C ATOM 763 O GLY A 284 -1.439 -4.880 -4.635 1.00 0.00 O ATOM 0 H GLY A 284 -2.243 -6.201 -2.820 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -3.997 -6.159 -4.996 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -4.563 -4.956 -3.855 1.00 0.00 H new ATOM 767 N HIS A 285 -3.032 -3.366 -5.076 1.00 0.00 N ATOM 768 CA HIS A 285 -2.095 -2.359 -5.585 1.00 0.00 C ATOM 769 C HIS A 285 -2.612 -0.948 -5.310 1.00 0.00 C ATOM 770 O HIS A 285 -3.821 -0.725 -5.308 1.00 0.00 O ATOM 771 CB HIS A 285 -1.830 -2.550 -7.086 1.00 0.00 C ATOM 772 CG HIS A 285 -3.055 -2.518 -7.947 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.438 -1.410 -8.672 1.00 0.00 N ATOM 774 CD2 HIS A 285 -3.980 -3.471 -8.208 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.545 -1.680 -9.335 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.895 -2.925 -9.072 1.00 0.00 N ATOM 0 H HIS A 285 -4.008 -3.070 -5.075 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.151 -2.491 -5.057 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.146 -1.771 -7.422 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.324 -3.504 -7.233 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -3.995 -4.475 -7.810 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -5.075 -0.998 -9.983 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.713 -3.403 -9.450 1.00 0.00 H new ATOM 785 N PHE A 286 -1.695 -0.003 -5.083 1.00 0.00 N ATOM 786 CA PHE A 286 -2.061 1.384 -4.776 1.00 0.00 C ATOM 787 C PHE A 286 -0.888 2.346 -5.000 1.00 0.00 C ATOM 788 O PHE A 286 0.274 1.951 -4.908 1.00 0.00 O ATOM 789 CB PHE A 286 -2.539 1.499 -3.326 1.00 0.00 C ATOM 790 CG PHE A 286 -4.036 1.494 -3.180 1.00 0.00 C ATOM 791 CD1 PHE A 286 -4.781 2.596 -3.558 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.696 0.398 -2.655 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.152 2.607 -3.422 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.070 0.406 -2.515 1.00 0.00 C ATOM 795 CZ PHE A 286 -6.796 1.511 -2.897 1.00 0.00 C ATOM 0 H PHE A 286 -0.690 -0.174 -5.106 1.00 0.00 H new ATOM 0 HA PHE A 286 -2.867 1.663 -5.455 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.124 0.672 -2.749 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.144 2.419 -2.894 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.280 3.462 -3.966 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.132 -0.472 -2.352 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -6.719 3.474 -3.727 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.575 -0.456 -2.105 1.00 0.00 H new ATOM 0 HZ PHE A 286 -7.870 1.517 -2.785 1.00 0.00 H new ATOM 805 N PRO A 287 -1.194 3.631 -5.284 1.00 0.00 N ATOM 806 CA PRO A 287 -0.188 4.667 -5.507 1.00 0.00 C ATOM 807 C PRO A 287 0.239 5.358 -4.210 1.00 0.00 C ATOM 808 O PRO A 287 -0.435 5.242 -3.179 1.00 0.00 O ATOM 809 CB PRO A 287 -0.924 5.639 -6.422 1.00 0.00 C ATOM 810 CG PRO A 287 -2.358 5.546 -6.017 1.00 0.00 C ATOM 811 CD PRO A 287 -2.560 4.173 -5.423 1.00 0.00 C ATOM 0 HA PRO A 287 0.739 4.272 -5.922 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.546 6.655 -6.304 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.792 5.370 -7.470 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.605 6.321 -5.291 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -3.012 5.695 -6.876 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -3.066 4.227 -4.459 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.173 3.546 -6.070 1.00 0.00 H new ATOM 819 N PHE A 288 1.355 6.088 -4.267 1.00 0.00 N ATOM 820 CA PHE A 288 1.956 6.666 -3.064 1.00 0.00 C ATOM 821 C PHE A 288 1.392 8.052 -2.727 1.00 0.00 C ATOM 822 O PHE A 288 1.735 8.630 -1.698 1.00 0.00 O ATOM 823 CB PHE A 288 3.483 6.723 -3.177 1.00 0.00 C ATOM 824 CG PHE A 288 4.003 7.843 -4.026 1.00 0.00 C ATOM 825 CD1 PHE A 288 3.839 7.805 -5.390 1.00 0.00 C ATOM 826 CD2 PHE A 288 4.666 8.920 -3.461 1.00 0.00 C ATOM 827 CE1 PHE A 288 4.322 8.820 -6.193 1.00 0.00 C ATOM 828 CE2 PHE A 288 5.152 9.943 -4.252 1.00 0.00 C ATOM 829 CZ PHE A 288 4.978 9.893 -5.622 1.00 0.00 C ATOM 0 H PHE A 288 1.859 6.292 -5.130 1.00 0.00 H new ATOM 0 HA PHE A 288 1.690 6.002 -2.242 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.905 6.816 -2.176 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.840 5.778 -3.587 1.00 0.00 H new ATOM 0 HD1 PHE A 288 3.325 6.969 -5.841 1.00 0.00 H new ATOM 0 HD2 PHE A 288 4.804 8.960 -2.391 1.00 0.00 H new ATOM 0 HE1 PHE A 288 4.187 8.775 -7.264 1.00 0.00 H new ATOM 0 HE2 PHE A 288 5.666 10.779 -3.801 1.00 0.00 H new ATOM 0 HZ PHE A 288 5.354 10.691 -6.245 1.00 0.00 H new ATOM 839 N THR A 289 0.535 8.574 -3.595 1.00 0.00 N ATOM 840 CA THR A 289 -0.040 9.917 -3.435 1.00 0.00 C ATOM 841 C THR A 289 -0.782 10.116 -2.098 1.00 0.00 C ATOM 842 O THR A 289 -1.118 11.243 -1.734 1.00 0.00 O ATOM 843 CB THR A 289 -1.007 10.222 -4.603 1.00 0.00 C ATOM 844 OG1 THR A 289 -1.635 11.500 -4.428 1.00 0.00 O ATOM 845 CG2 THR A 289 -2.068 9.139 -4.718 1.00 0.00 C ATOM 0 H THR A 289 0.215 8.085 -4.431 1.00 0.00 H new ATOM 0 HA THR A 289 0.802 10.609 -3.439 1.00 0.00 H new ATOM 0 HB THR A 289 -0.422 10.243 -5.522 1.00 0.00 H new ATOM 0 HG1 THR A 289 -1.582 11.764 -3.486 1.00 0.00 H new ATOM 0 HG21 THR A 289 -2.738 9.372 -5.545 1.00 0.00 H new ATOM 0 HG22 THR A 289 -1.588 8.177 -4.900 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.640 9.090 -3.791 1.00 0.00 H new ATOM 853 N HIS A 290 -1.022 9.037 -1.369 1.00 0.00 N ATOM 854 CA HIS A 290 -1.796 9.101 -0.132 1.00 0.00 C ATOM 855 C HIS A 290 -1.111 8.332 0.983 1.00 0.00 C ATOM 856 O HIS A 290 -1.773 7.771 1.859 1.00 0.00 O ATOM 857 CB HIS A 290 -3.200 8.525 -0.353 1.00 0.00 C ATOM 858 CG HIS A 290 -3.217 7.152 -0.962 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.061 6.807 -1.985 1.00 0.00 N ATOM 860 CD2 HIS A 290 -2.486 6.040 -0.692 1.00 0.00 C ATOM 861 CE1 HIS A 290 -3.854 5.552 -2.321 1.00 0.00 C ATOM 862 NE2 HIS A 290 -2.896 5.055 -1.558 1.00 0.00 N ATOM 0 H HIS A 290 -0.692 8.103 -1.611 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.870 10.149 0.158 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.721 8.492 0.604 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.760 9.202 -0.997 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -4.744 7.428 -2.419 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -1.722 5.947 0.065 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -4.382 5.015 -3.095 1.00 0.00 H new ATOM 871 N VAL A 291 0.203 8.280 0.954 1.00 0.00 N ATOM 872 CA VAL A 291 0.906 7.404 1.862 1.00 0.00 C ATOM 873 C VAL A 291 2.258 7.978 2.279 1.00 0.00 C ATOM 874 O VAL A 291 2.831 8.830 1.602 1.00 0.00 O ATOM 875 CB VAL A 291 1.070 6.015 1.206 1.00 0.00 C ATOM 876 CG1 VAL A 291 2.068 6.047 0.078 1.00 0.00 C ATOM 877 CG2 VAL A 291 1.422 4.948 2.216 1.00 0.00 C ATOM 0 H VAL A 291 0.795 8.822 0.325 1.00 0.00 H new ATOM 0 HA VAL A 291 0.316 7.307 2.773 1.00 0.00 H new ATOM 0 HB VAL A 291 0.100 5.752 0.783 1.00 0.00 H new ATOM 0 HG11 VAL A 291 2.156 5.052 -0.358 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.732 6.749 -0.685 1.00 0.00 H new ATOM 0 HG13 VAL A 291 3.039 6.363 0.460 1.00 0.00 H new ATOM 0 HG21 VAL A 291 1.527 3.988 1.710 1.00 0.00 H new ATOM 0 HG22 VAL A 291 2.362 5.206 2.705 1.00 0.00 H new ATOM 0 HG23 VAL A 291 0.631 4.879 2.963 1.00 0.00 H new ATOM 887 N ARG A 292 2.736 7.504 3.411 1.00 0.00 N ATOM 888 CA ARG A 292 4.025 7.893 3.952 1.00 0.00 C ATOM 889 C ARG A 292 4.813 6.628 4.204 1.00 0.00 C ATOM 890 O ARG A 292 4.480 5.853 5.088 1.00 0.00 O ATOM 891 CB ARG A 292 3.860 8.693 5.247 1.00 0.00 C ATOM 892 CG ARG A 292 5.141 9.374 5.695 1.00 0.00 C ATOM 893 CD ARG A 292 5.621 10.359 4.643 1.00 0.00 C ATOM 894 NE ARG A 292 6.922 10.939 4.968 1.00 0.00 N ATOM 895 CZ ARG A 292 7.543 11.830 4.197 1.00 0.00 C ATOM 896 NH1 ARG A 292 6.962 12.264 3.085 1.00 0.00 N ATOM 897 NH2 ARG A 292 8.741 12.288 4.536 1.00 0.00 N ATOM 0 H ARG A 292 2.235 6.829 3.989 1.00 0.00 H new ATOM 0 HA ARG A 292 4.549 8.536 3.245 1.00 0.00 H new ATOM 0 HB2 ARG A 292 3.086 9.447 5.105 1.00 0.00 H new ATOM 0 HB3 ARG A 292 3.515 8.026 6.037 1.00 0.00 H new ATOM 0 HG2 ARG A 292 4.972 9.895 6.638 1.00 0.00 H new ATOM 0 HG3 ARG A 292 5.912 8.625 5.878 1.00 0.00 H new ATOM 0 HD2 ARG A 292 5.683 9.854 3.679 1.00 0.00 H new ATOM 0 HD3 ARG A 292 4.887 11.158 4.537 1.00 0.00 H new ATOM 0 HE ARG A 292 7.379 10.646 5.831 1.00 0.00 H new ATOM 0 HH11 ARG A 292 6.040 11.915 2.821 1.00 0.00 H new ATOM 0 HH12 ARG A 292 7.437 12.946 2.494 1.00 0.00 H new ATOM 0 HH21 ARG A 292 9.190 11.958 5.390 1.00 0.00 H new ATOM 0 HH22 ARG A 292 9.213 12.970 3.942 1.00 0.00 H new ATOM 911 N LEU A 293 5.838 6.394 3.421 1.00 0.00 N ATOM 912 CA LEU A 293 6.430 5.082 3.399 1.00 0.00 C ATOM 913 C LEU A 293 7.482 4.884 4.469 1.00 0.00 C ATOM 914 O LEU A 293 8.154 5.822 4.903 1.00 0.00 O ATOM 915 CB LEU A 293 7.062 4.770 2.050 1.00 0.00 C ATOM 916 CG LEU A 293 6.230 5.066 0.798 1.00 0.00 C ATOM 917 CD1 LEU A 293 4.790 4.639 0.996 1.00 0.00 C ATOM 918 CD2 LEU A 293 6.315 6.537 0.412 1.00 0.00 C ATOM 0 H LEU A 293 6.271 7.080 2.803 1.00 0.00 H new ATOM 0 HA LEU A 293 5.602 4.400 3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 293 7.993 5.331 1.976 1.00 0.00 H new ATOM 0 HB3 LEU A 293 7.325 3.712 2.038 1.00 0.00 H new ATOM 0 HG LEU A 293 6.647 4.485 -0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 293 4.218 4.859 0.094 1.00 0.00 H new ATOM 0 HD12 LEU A 293 4.752 3.568 1.198 1.00 0.00 H new ATOM 0 HD13 LEU A 293 4.362 5.182 1.839 1.00 0.00 H new ATOM 0 HD21 LEU A 293 5.714 6.714 -0.480 1.00 0.00 H new ATOM 0 HD22 LEU A 293 5.939 7.150 1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 293 7.353 6.800 0.208 1.00 0.00 H new ATOM 930 N LEU A 294 7.585 3.639 4.888 1.00 0.00 N ATOM 931 CA LEU A 294 8.707 3.144 5.630 1.00 0.00 C ATOM 932 C LEU A 294 9.571 2.418 4.608 1.00 0.00 C ATOM 933 O LEU A 294 9.106 1.486 3.945 1.00 0.00 O ATOM 934 CB LEU A 294 8.234 2.172 6.717 1.00 0.00 C ATOM 935 CG LEU A 294 6.993 2.584 7.516 1.00 0.00 C ATOM 936 CD1 LEU A 294 6.779 1.643 8.691 1.00 0.00 C ATOM 937 CD2 LEU A 294 7.114 4.015 7.988 1.00 0.00 C ATOM 0 H LEU A 294 6.869 2.933 4.713 1.00 0.00 H new ATOM 0 HA LEU A 294 9.254 3.943 6.131 1.00 0.00 H new ATOM 0 HB2 LEU A 294 8.032 1.209 6.248 1.00 0.00 H new ATOM 0 HB3 LEU A 294 9.055 2.020 7.418 1.00 0.00 H new ATOM 0 HG LEU A 294 6.124 2.516 6.862 1.00 0.00 H new ATOM 0 HD11 LEU A 294 5.893 1.951 9.247 1.00 0.00 H new ATOM 0 HD12 LEU A 294 6.641 0.626 8.323 1.00 0.00 H new ATOM 0 HD13 LEU A 294 7.649 1.676 9.347 1.00 0.00 H new ATOM 0 HD21 LEU A 294 6.223 4.288 8.553 1.00 0.00 H new ATOM 0 HD22 LEU A 294 7.993 4.115 8.625 1.00 0.00 H new ATOM 0 HD23 LEU A 294 7.214 4.675 7.126 1.00 0.00 H new