USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=12 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 239 TYR OH : rot 180:sc= 1.1 USER MOD Set 1.2: A 265 LYS NZ :NH3+ -173:sc= 1.22 (180deg=0) USER MOD Set 2.1: A 254 THR OG1 : rot 8:sc= 1.11 USER MOD Set 2.2: A 285 HIS : no HD1:sc= 0.0297 K(o=1.1,f=-0.7) USER MOD Single : A 244 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 245 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 249 ASN : amide:sc= -1.26! K(o=-1.3!,f=-0.031) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ 144:sc= 1.19 (180deg=-0.205!) USER MOD Single : A 267 THR OG1 : rot 180:sc= 0.00233 USER MOD Single : A 268 LYS NZ :NH3+ -150:sc= -0.698! (180deg=-2.9!) USER MOD Single : A 270 ASN : amide:sc= -5.64! C(o=-5.6!,f=-11!) USER MOD Single : A 272 SER OG : rot 180:sc= 0 USER MOD Single : A 274 GLN : amide:sc= -7.49! K(o=-7.5!,f=-0.63) USER MOD Single : A 279 CYS SG : rot 81:sc= 1.25 USER MOD Single : A 280 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 282 LYS NZ :NH3+ -120:sc= 0.0346 (180deg=-0.458) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0 USER MOD Single : A 290 HIS : no HE2:sc= -2.07 K(o=-2.1,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 10.218 -6.281 0.767 1.00 0.00 N ATOM 9 CA PRO A 237 9.040 -5.441 0.555 1.00 0.00 C ATOM 10 C PRO A 237 8.937 -4.279 1.541 1.00 0.00 C ATOM 11 O PRO A 237 9.229 -4.426 2.730 1.00 0.00 O ATOM 12 CB PRO A 237 7.877 -6.424 0.791 1.00 0.00 C ATOM 13 CG PRO A 237 8.487 -7.793 0.902 1.00 0.00 C ATOM 14 CD PRO A 237 9.916 -7.667 0.464 1.00 0.00 C ATOM 0 HA PRO A 237 9.057 -4.971 -0.428 1.00 0.00 H new ATOM 0 HB2 PRO A 237 7.332 -6.168 1.699 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.163 -6.384 -0.031 1.00 0.00 H new ATOM 0 HG2 PRO A 237 8.428 -8.161 1.926 1.00 0.00 H new ATOM 0 HG3 PRO A 237 7.952 -8.507 0.275 1.00 0.00 H new ATOM 0 HD2 PRO A 237 10.568 -8.352 1.006 1.00 0.00 H new ATOM 0 HD3 PRO A 237 10.036 -7.885 -0.597 1.00 0.00 H new ATOM 22 N ILE A 238 8.488 -3.135 1.037 1.00 0.00 N ATOM 23 CA ILE A 238 8.502 -1.897 1.818 1.00 0.00 C ATOM 24 C ILE A 238 7.321 -1.841 2.769 1.00 0.00 C ATOM 25 O ILE A 238 6.320 -2.533 2.578 1.00 0.00 O ATOM 26 CB ILE A 238 8.472 -0.649 0.926 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.049 -0.190 0.626 1.00 0.00 C ATOM 28 CG2 ILE A 238 9.205 -0.921 -0.367 1.00 0.00 C ATOM 29 CD1 ILE A 238 7.035 0.876 -0.418 1.00 0.00 C ATOM 0 H ILE A 238 8.110 -3.036 0.095 1.00 0.00 H new ATOM 0 HA ILE A 238 9.435 -1.902 2.382 1.00 0.00 H new ATOM 0 HB ILE A 238 8.968 0.153 1.472 1.00 0.00 H new ATOM 0 HG12 ILE A 238 6.453 -1.039 0.291 1.00 0.00 H new ATOM 0 HG13 ILE A 238 6.585 0.185 1.538 1.00 0.00 H new ATOM 0 HG21 ILE A 238 9.179 -0.030 -0.994 1.00 0.00 H new ATOM 0 HG22 ILE A 238 10.241 -1.182 -0.150 1.00 0.00 H new ATOM 0 HG23 ILE A 238 8.725 -1.748 -0.891 1.00 0.00 H new ATOM 0 HD11 ILE A 238 6.007 1.183 -0.611 1.00 0.00 H new ATOM 0 HD12 ILE A 238 7.611 1.734 -0.070 1.00 0.00 H new ATOM 0 HD13 ILE A 238 7.477 0.491 -1.337 1.00 0.00 H new ATOM 41 N TYR A 239 7.433 -1.008 3.784 1.00 0.00 N ATOM 42 CA TYR A 239 6.324 -0.754 4.672 1.00 0.00 C ATOM 43 C TYR A 239 5.736 0.606 4.342 1.00 0.00 C ATOM 44 O TYR A 239 6.424 1.608 4.405 1.00 0.00 O ATOM 45 CB TYR A 239 6.793 -0.804 6.126 1.00 0.00 C ATOM 46 CG TYR A 239 7.128 -2.199 6.596 1.00 0.00 C ATOM 47 CD1 TYR A 239 6.126 -3.132 6.816 1.00 0.00 C ATOM 48 CD2 TYR A 239 8.444 -2.584 6.819 1.00 0.00 C ATOM 49 CE1 TYR A 239 6.422 -4.407 7.244 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.747 -3.862 7.247 1.00 0.00 C ATOM 51 CZ TYR A 239 7.732 -4.768 7.458 1.00 0.00 C ATOM 52 OH TYR A 239 8.027 -6.045 7.880 1.00 0.00 O ATOM 0 H TYR A 239 8.285 -0.496 4.012 1.00 0.00 H new ATOM 0 HA TYR A 239 5.559 -1.519 4.540 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.671 -0.169 6.240 1.00 0.00 H new ATOM 0 HB3 TYR A 239 6.015 -0.389 6.766 1.00 0.00 H new ATOM 0 HD1 TYR A 239 5.096 -2.854 6.649 1.00 0.00 H new ATOM 0 HD2 TYR A 239 9.241 -1.874 6.655 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.629 -5.121 7.411 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.775 -4.149 7.415 1.00 0.00 H new ATOM 0 HH TYR A 239 8.997 -6.140 7.983 1.00 0.00 H new ATOM 62 N ALA A 240 4.474 0.650 3.980 1.00 0.00 N ATOM 63 CA ALA A 240 3.873 1.904 3.578 1.00 0.00 C ATOM 64 C ALA A 240 2.815 2.322 4.574 1.00 0.00 C ATOM 65 O ALA A 240 1.810 1.634 4.754 1.00 0.00 O ATOM 66 CB ALA A 240 3.282 1.774 2.183 1.00 0.00 C ATOM 0 H ALA A 240 3.849 -0.156 3.955 1.00 0.00 H new ATOM 0 HA ALA A 240 4.642 2.676 3.556 1.00 0.00 H new ATOM 0 HB1 ALA A 240 2.832 2.722 1.889 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.070 1.512 1.477 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.520 0.995 2.182 1.00 0.00 H new ATOM 72 N ARG A 241 3.040 3.452 5.220 1.00 0.00 N ATOM 73 CA ARG A 241 2.101 3.948 6.199 1.00 0.00 C ATOM 74 C ARG A 241 0.985 4.665 5.475 1.00 0.00 C ATOM 75 O ARG A 241 1.140 5.808 5.058 1.00 0.00 O ATOM 76 CB ARG A 241 2.797 4.904 7.175 1.00 0.00 C ATOM 77 CG ARG A 241 2.405 4.657 8.631 1.00 0.00 C ATOM 78 CD ARG A 241 0.943 5.035 8.900 1.00 0.00 C ATOM 79 NE ARG A 241 0.789 6.451 9.232 1.00 0.00 N ATOM 80 CZ ARG A 241 0.245 6.889 10.370 1.00 0.00 C ATOM 81 NH1 ARG A 241 -0.091 6.028 11.323 1.00 0.00 N ATOM 82 NH2 ARG A 241 0.072 8.189 10.571 1.00 0.00 N ATOM 0 H ARG A 241 3.863 4.039 5.082 1.00 0.00 H new ATOM 0 HA ARG A 241 1.697 3.115 6.774 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.877 4.798 7.072 1.00 0.00 H new ATOM 0 HB3 ARG A 241 2.551 5.931 6.907 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.559 3.606 8.876 1.00 0.00 H new ATOM 0 HG3 ARG A 241 3.056 5.236 9.286 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.342 4.803 8.021 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.558 4.428 9.719 1.00 0.00 H new ATOM 0 HE ARG A 241 1.115 7.142 8.557 1.00 0.00 H new ATOM 0 HH11 ARG A 241 0.066 5.029 11.187 1.00 0.00 H new ATOM 0 HH12 ARG A 241 -0.506 6.365 12.191 1.00 0.00 H new ATOM 0 HH21 ARG A 241 0.355 8.858 9.855 1.00 0.00 H new ATOM 0 HH22 ARG A 241 -0.344 8.520 11.442 1.00 0.00 H new ATOM 96 N VAL A 242 -0.140 4.007 5.321 1.00 0.00 N ATOM 97 CA VAL A 242 -1.224 4.598 4.570 1.00 0.00 C ATOM 98 C VAL A 242 -1.952 5.622 5.422 1.00 0.00 C ATOM 99 O VAL A 242 -2.444 5.312 6.503 1.00 0.00 O ATOM 100 CB VAL A 242 -2.213 3.550 4.028 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.684 2.638 5.134 1.00 0.00 C ATOM 102 CG2 VAL A 242 -3.393 4.242 3.383 1.00 0.00 C ATOM 0 H VAL A 242 -0.328 3.078 5.698 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.782 5.091 3.704 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.702 2.944 3.280 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.382 1.905 4.729 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.828 2.122 5.569 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.183 3.227 5.904 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -4.089 3.495 3.002 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.898 4.865 4.122 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -3.044 4.866 2.560 1.00 0.00 H new ATOM 112 N ILE A 243 -2.001 6.848 4.927 1.00 0.00 N ATOM 113 CA ILE A 243 -2.564 7.954 5.679 1.00 0.00 C ATOM 114 C ILE A 243 -3.878 8.422 5.081 1.00 0.00 C ATOM 115 O ILE A 243 -4.452 9.417 5.525 1.00 0.00 O ATOM 116 CB ILE A 243 -1.563 9.133 5.764 1.00 0.00 C ATOM 117 CG1 ILE A 243 -1.087 9.597 4.371 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.378 8.731 6.623 1.00 0.00 C ATOM 119 CD1 ILE A 243 -2.052 10.524 3.665 1.00 0.00 C ATOM 0 H ILE A 243 -1.655 7.102 4.002 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.762 7.592 6.688 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.079 9.978 6.220 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -0.127 10.102 4.477 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -0.919 8.720 3.746 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.326 9.561 6.683 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.724 8.476 7.625 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.116 7.867 6.179 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -1.643 10.804 2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -3.007 10.017 3.525 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.202 11.420 4.267 1.00 0.00 H new ATOM 131 N GLN A 244 -4.360 7.691 4.087 1.00 0.00 N ATOM 132 CA GLN A 244 -5.552 8.089 3.360 1.00 0.00 C ATOM 133 C GLN A 244 -5.922 7.025 2.344 1.00 0.00 C ATOM 134 O GLN A 244 -5.375 6.981 1.241 1.00 0.00 O ATOM 135 CB GLN A 244 -5.297 9.424 2.662 1.00 0.00 C ATOM 136 CG GLN A 244 -6.437 9.902 1.777 1.00 0.00 C ATOM 137 CD GLN A 244 -6.214 11.309 1.260 1.00 0.00 C ATOM 138 OE1 GLN A 244 -5.077 11.755 1.093 1.00 0.00 O ATOM 139 NE2 GLN A 244 -7.298 12.015 0.992 1.00 0.00 N ATOM 0 H GLN A 244 -3.942 6.818 3.766 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.382 8.202 4.058 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -5.099 10.183 3.419 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -4.396 9.336 2.055 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -6.549 9.221 0.933 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -7.370 9.868 2.340 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -8.221 11.609 1.144 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -7.212 12.966 0.633 1.00 0.00 H new ATOM 148 N LYS A 245 -6.806 6.135 2.734 1.00 0.00 N ATOM 149 CA LYS A 245 -7.258 5.100 1.837 1.00 0.00 C ATOM 150 C LYS A 245 -8.709 4.728 2.097 1.00 0.00 C ATOM 151 O LYS A 245 -9.318 5.127 3.093 1.00 0.00 O ATOM 152 CB LYS A 245 -6.360 3.869 1.882 1.00 0.00 C ATOM 153 CG LYS A 245 -5.825 3.457 0.509 1.00 0.00 C ATOM 154 CD LYS A 245 -4.326 3.720 0.384 1.00 0.00 C ATOM 155 CE LYS A 245 -3.589 2.567 -0.287 1.00 0.00 C ATOM 156 NZ LYS A 245 -2.115 2.781 -0.312 1.00 0.00 N ATOM 0 H LYS A 245 -7.224 6.108 3.664 1.00 0.00 H new ATOM 0 HA LYS A 245 -7.194 5.510 0.829 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.519 4.066 2.547 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.918 3.037 2.311 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -6.024 2.398 0.344 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -6.357 4.006 -0.268 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -4.166 4.633 -0.190 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -3.905 3.889 1.375 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.811 1.640 0.241 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -3.955 2.449 -1.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.655 1.973 -0.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -1.900 3.652 -0.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -1.760 2.868 0.662 1.00 0.00 H new ATOM 170 N ARG A 246 -9.238 3.982 1.162 1.00 0.00 N ATOM 171 CA ARG A 246 -10.641 3.613 1.099 1.00 0.00 C ATOM 172 C ARG A 246 -10.800 2.132 1.437 1.00 0.00 C ATOM 173 O ARG A 246 -9.822 1.463 1.778 1.00 0.00 O ATOM 174 CB ARG A 246 -11.162 3.882 -0.311 1.00 0.00 C ATOM 175 CG ARG A 246 -10.316 3.219 -1.383 1.00 0.00 C ATOM 176 CD ARG A 246 -10.892 3.434 -2.771 1.00 0.00 C ATOM 177 NE ARG A 246 -12.115 2.666 -2.976 1.00 0.00 N ATOM 178 CZ ARG A 246 -12.606 2.363 -4.174 1.00 0.00 C ATOM 179 NH1 ARG A 246 -12.034 2.845 -5.271 1.00 0.00 N ATOM 180 NH2 ARG A 246 -13.679 1.592 -4.270 1.00 0.00 N ATOM 0 H ARG A 246 -8.689 3.598 0.393 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.210 4.202 1.818 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -12.188 3.523 -0.390 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -11.186 4.958 -0.486 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.303 3.618 -1.344 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.245 2.150 -1.181 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -11.100 4.494 -2.918 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -10.153 3.147 -3.519 1.00 0.00 H new ATOM 0 HE ARG A 246 -12.623 2.343 -2.153 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -11.216 3.449 -5.196 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -12.413 2.611 -6.189 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -14.126 1.233 -3.426 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -14.058 1.358 -5.187 1.00 0.00 H new ATOM 194 N VAL A 247 -12.026 1.622 1.350 1.00 0.00 N ATOM 195 CA VAL A 247 -12.281 0.204 1.595 1.00 0.00 C ATOM 196 C VAL A 247 -12.612 -0.532 0.283 1.00 0.00 C ATOM 197 O VAL A 247 -13.775 -0.837 0.000 1.00 0.00 O ATOM 198 CB VAL A 247 -13.432 -0.003 2.605 1.00 0.00 C ATOM 199 CG1 VAL A 247 -13.533 -1.466 3.016 1.00 0.00 C ATOM 200 CG2 VAL A 247 -13.248 0.885 3.826 1.00 0.00 C ATOM 0 H VAL A 247 -12.855 2.166 1.113 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.368 -0.213 2.020 1.00 0.00 H new ATOM 0 HB VAL A 247 -14.364 0.280 2.116 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -14.350 -1.589 3.727 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -13.724 -2.079 2.135 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -12.598 -1.779 3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -14.071 0.721 4.522 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -12.305 0.641 4.315 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -13.237 1.930 3.517 1.00 0.00 H new ATOM 210 N PRO A 248 -11.585 -0.793 -0.546 1.00 0.00 N ATOM 211 CA PRO A 248 -11.688 -1.548 -1.786 1.00 0.00 C ATOM 212 C PRO A 248 -11.431 -3.029 -1.538 1.00 0.00 C ATOM 213 O PRO A 248 -11.148 -3.433 -0.419 1.00 0.00 O ATOM 214 CB PRO A 248 -10.562 -0.960 -2.652 1.00 0.00 C ATOM 215 CG PRO A 248 -9.781 -0.055 -1.748 1.00 0.00 C ATOM 216 CD PRO A 248 -10.212 -0.378 -0.355 1.00 0.00 C ATOM 0 HA PRO A 248 -12.674 -1.476 -2.244 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -9.928 -1.749 -3.058 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -10.968 -0.409 -3.500 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.710 -0.214 -1.870 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -9.976 0.991 -1.982 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.605 -1.169 0.085 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -10.136 0.486 0.305 1.00 0.00 H new ATOM 224 N ASN A 249 -11.545 -3.837 -2.570 1.00 0.00 N ATOM 225 CA ASN A 249 -11.260 -5.261 -2.449 1.00 0.00 C ATOM 226 C ASN A 249 -10.419 -5.723 -3.627 1.00 0.00 C ATOM 227 O ASN A 249 -10.166 -4.958 -4.561 1.00 0.00 O ATOM 228 CB ASN A 249 -12.561 -6.073 -2.389 1.00 0.00 C ATOM 229 CG ASN A 249 -13.294 -5.958 -1.061 1.00 0.00 C ATOM 230 OD1 ASN A 249 -14.523 -5.968 -1.019 1.00 0.00 O ATOM 231 ND2 ASN A 249 -12.554 -5.873 0.033 1.00 0.00 N ATOM 0 H ASN A 249 -11.832 -3.539 -3.502 1.00 0.00 H new ATOM 0 HA ASN A 249 -10.707 -5.424 -1.524 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.223 -5.741 -3.189 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.333 -7.122 -2.578 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -13.001 -5.813 0.948 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -11.537 -5.867 -0.039 1.00 0.00 H new ATOM 238 N ALA A 250 -10.006 -6.984 -3.592 1.00 0.00 N ATOM 239 CA ALA A 250 -9.231 -7.578 -4.677 1.00 0.00 C ATOM 240 C ALA A 250 -10.082 -7.757 -5.932 1.00 0.00 C ATOM 241 O ALA A 250 -9.678 -8.408 -6.891 1.00 0.00 O ATOM 242 CB ALA A 250 -8.666 -8.912 -4.239 1.00 0.00 C ATOM 0 H ALA A 250 -10.196 -7.620 -2.818 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.412 -6.900 -4.918 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -8.089 -9.348 -5.055 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.019 -8.767 -3.374 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -9.483 -9.583 -3.973 1.00 0.00 H new ATOM 248 N TYR A 251 -11.269 -7.184 -5.906 1.00 0.00 N ATOM 249 CA TYR A 251 -12.162 -7.206 -7.044 1.00 0.00 C ATOM 250 C TYR A 251 -12.124 -5.852 -7.731 1.00 0.00 C ATOM 251 O TYR A 251 -12.742 -5.651 -8.774 1.00 0.00 O ATOM 252 CB TYR A 251 -13.593 -7.530 -6.606 1.00 0.00 C ATOM 253 CG TYR A 251 -13.727 -8.863 -5.909 1.00 0.00 C ATOM 254 CD1 TYR A 251 -13.220 -9.045 -4.634 1.00 0.00 C ATOM 255 CD2 TYR A 251 -14.363 -9.933 -6.522 1.00 0.00 C ATOM 256 CE1 TYR A 251 -13.338 -10.253 -3.983 1.00 0.00 C ATOM 257 CE2 TYR A 251 -14.487 -11.149 -5.880 1.00 0.00 C ATOM 258 CZ TYR A 251 -13.971 -11.303 -4.609 1.00 0.00 C ATOM 259 OH TYR A 251 -14.095 -12.510 -3.960 1.00 0.00 O ATOM 0 H TYR A 251 -11.640 -6.690 -5.094 1.00 0.00 H new ATOM 0 HA TYR A 251 -11.836 -7.982 -7.736 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -13.946 -6.744 -5.939 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -14.242 -7.521 -7.481 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -12.722 -8.224 -4.140 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -14.767 -9.813 -7.516 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -12.937 -10.376 -2.988 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -14.984 -11.974 -6.369 1.00 0.00 H new ATOM 0 HH TYR A 251 -14.567 -13.145 -4.538 1.00 0.00 H new ATOM 269 N ASP A 252 -11.380 -4.922 -7.134 1.00 0.00 N ATOM 270 CA ASP A 252 -11.290 -3.560 -7.665 1.00 0.00 C ATOM 271 C ASP A 252 -9.942 -3.375 -8.335 1.00 0.00 C ATOM 272 O ASP A 252 -9.094 -2.625 -7.852 1.00 0.00 O ATOM 273 CB ASP A 252 -11.474 -2.508 -6.561 1.00 0.00 C ATOM 274 CG ASP A 252 -11.700 -1.120 -7.133 1.00 0.00 C ATOM 275 OD1 ASP A 252 -12.159 -1.016 -8.290 1.00 0.00 O ATOM 276 OD2 ASP A 252 -11.431 -0.126 -6.435 1.00 0.00 O ATOM 0 H ASP A 252 -10.834 -5.084 -6.288 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.092 -3.421 -8.390 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -12.322 -2.784 -5.934 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -10.593 -2.497 -5.919 1.00 0.00 H new ATOM 281 N LYS A 253 -9.748 -4.075 -9.451 1.00 0.00 N ATOM 282 CA LYS A 253 -8.434 -4.187 -10.081 1.00 0.00 C ATOM 283 C LYS A 253 -7.429 -4.704 -9.057 1.00 0.00 C ATOM 284 O LYS A 253 -6.243 -4.400 -9.123 1.00 0.00 O ATOM 285 CB LYS A 253 -7.948 -2.845 -10.658 1.00 0.00 C ATOM 286 CG LYS A 253 -8.879 -2.215 -11.689 1.00 0.00 C ATOM 287 CD LYS A 253 -9.960 -1.367 -11.034 1.00 0.00 C ATOM 288 CE LYS A 253 -9.360 -0.216 -10.241 1.00 0.00 C ATOM 289 NZ LYS A 253 -10.403 0.586 -9.555 1.00 0.00 N ATOM 0 H LYS A 253 -10.490 -4.576 -9.940 1.00 0.00 H new ATOM 0 HA LYS A 253 -8.521 -4.885 -10.914 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -7.810 -2.142 -9.837 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -6.971 -2.996 -11.116 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -8.298 -1.597 -12.373 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -9.345 -3.000 -12.285 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -10.629 -0.973 -11.799 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -10.563 -1.990 -10.374 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -8.661 -0.609 -9.503 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -8.789 0.427 -10.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -10.044 0.907 -8.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -10.646 1.412 -10.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -11.251 0.002 -9.411 1.00 0.00 H new ATOM 303 N THR A 254 -7.943 -5.485 -8.105 1.00 0.00 N ATOM 304 CA THR A 254 -7.185 -5.984 -6.969 1.00 0.00 C ATOM 305 C THR A 254 -6.547 -4.834 -6.192 1.00 0.00 C ATOM 306 O THR A 254 -5.340 -4.591 -6.262 1.00 0.00 O ATOM 307 CB THR A 254 -6.123 -7.046 -7.347 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.129 -6.520 -8.245 1.00 0.00 O ATOM 309 CG2 THR A 254 -6.775 -8.261 -7.985 1.00 0.00 C ATOM 0 H THR A 254 -8.916 -5.791 -8.107 1.00 0.00 H new ATOM 0 HA THR A 254 -7.906 -6.492 -6.329 1.00 0.00 H new ATOM 0 HB THR A 254 -5.631 -7.338 -6.419 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.250 -5.552 -8.336 1.00 0.00 H new ATOM 0 HG21 THR A 254 -6.009 -8.992 -8.242 1.00 0.00 H new ATOM 0 HG22 THR A 254 -7.481 -8.706 -7.283 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.304 -7.958 -8.888 1.00 0.00 H new ATOM 317 N ALA A 255 -7.385 -4.115 -5.468 1.00 0.00 N ATOM 318 CA ALA A 255 -6.939 -2.978 -4.681 1.00 0.00 C ATOM 319 C ALA A 255 -6.978 -3.287 -3.184 1.00 0.00 C ATOM 320 O ALA A 255 -7.760 -4.121 -2.723 1.00 0.00 O ATOM 321 CB ALA A 255 -7.788 -1.770 -5.005 1.00 0.00 C ATOM 0 H ALA A 255 -8.386 -4.300 -5.408 1.00 0.00 H new ATOM 0 HA ALA A 255 -5.902 -2.763 -4.940 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.451 -0.919 -4.413 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -7.696 -1.534 -6.065 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -8.831 -1.985 -4.771 1.00 0.00 H new ATOM 327 N LEU A 256 -6.118 -2.601 -2.441 1.00 0.00 N ATOM 328 CA LEU A 256 -5.906 -2.862 -1.020 1.00 0.00 C ATOM 329 C LEU A 256 -7.016 -2.215 -0.189 1.00 0.00 C ATOM 330 O LEU A 256 -7.328 -1.049 -0.382 1.00 0.00 O ATOM 331 CB LEU A 256 -4.541 -2.274 -0.604 1.00 0.00 C ATOM 332 CG LEU A 256 -3.804 -2.950 0.564 1.00 0.00 C ATOM 333 CD1 LEU A 256 -4.721 -3.121 1.737 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.269 -4.297 0.163 1.00 0.00 C ATOM 0 H LEU A 256 -5.544 -1.843 -2.809 1.00 0.00 H new ATOM 0 HA LEU A 256 -5.921 -3.938 -0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -3.885 -2.297 -1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.691 -1.226 -0.346 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.971 -2.304 0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -4.182 -3.601 2.554 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -5.080 -2.145 2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -5.569 -3.742 1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.753 -4.750 1.009 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -4.094 -4.939 -0.145 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -2.571 -4.179 -0.666 1.00 0.00 H new ATOM 346 N ALA A 257 -7.586 -2.967 0.744 1.00 0.00 N ATOM 347 CA ALA A 257 -8.549 -2.423 1.691 1.00 0.00 C ATOM 348 C ALA A 257 -7.831 -1.970 2.946 1.00 0.00 C ATOM 349 O ALA A 257 -7.468 -2.784 3.802 1.00 0.00 O ATOM 350 CB ALA A 257 -9.611 -3.449 2.031 1.00 0.00 C ATOM 0 H ALA A 257 -7.396 -3.962 0.865 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.044 -1.567 1.233 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.319 -3.019 2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.139 -3.741 1.123 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.140 -4.326 2.475 1.00 0.00 H new ATOM 356 N LEU A 258 -7.620 -0.673 3.035 1.00 0.00 N ATOM 357 CA LEU A 258 -6.842 -0.092 4.124 1.00 0.00 C ATOM 358 C LEU A 258 -7.251 1.355 4.359 1.00 0.00 C ATOM 359 O LEU A 258 -7.998 1.933 3.575 1.00 0.00 O ATOM 360 CB LEU A 258 -5.328 -0.213 3.846 1.00 0.00 C ATOM 361 CG LEU A 258 -4.755 0.610 2.679 1.00 0.00 C ATOM 362 CD1 LEU A 258 -3.303 0.260 2.444 1.00 0.00 C ATOM 363 CD2 LEU A 258 -5.520 0.377 1.398 1.00 0.00 C ATOM 0 H LEU A 258 -7.977 0.008 2.364 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.053 -0.652 5.035 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -4.795 0.072 4.753 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.102 -1.263 3.660 1.00 0.00 H new ATOM 0 HG LEU A 258 -4.848 1.659 2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -2.916 0.852 1.615 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -2.727 0.475 3.344 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -3.219 -0.800 2.203 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -5.083 0.977 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -5.468 -0.678 1.130 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -6.562 0.664 1.539 1.00 0.00 H new ATOM 375 N GLU A 259 -6.764 1.939 5.433 1.00 0.00 N ATOM 376 CA GLU A 259 -7.306 3.188 5.927 1.00 0.00 C ATOM 377 C GLU A 259 -6.203 4.102 6.484 1.00 0.00 C ATOM 378 O GLU A 259 -5.061 3.679 6.648 1.00 0.00 O ATOM 379 CB GLU A 259 -8.330 2.833 7.009 1.00 0.00 C ATOM 380 CG GLU A 259 -8.882 4.010 7.771 1.00 0.00 C ATOM 381 CD GLU A 259 -9.918 3.600 8.792 1.00 0.00 C ATOM 382 OE1 GLU A 259 -11.056 3.269 8.400 1.00 0.00 O ATOM 383 OE2 GLU A 259 -9.595 3.600 9.997 1.00 0.00 O ATOM 0 H GLU A 259 -5.990 1.567 5.983 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.777 3.744 5.117 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.159 2.299 6.543 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -7.866 2.146 7.717 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -8.066 4.529 8.274 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -9.326 4.717 7.070 1.00 0.00 H new ATOM 390 N VAL A 260 -6.556 5.357 6.766 1.00 0.00 N ATOM 391 CA VAL A 260 -5.638 6.316 7.376 1.00 0.00 C ATOM 392 C VAL A 260 -5.039 5.796 8.690 1.00 0.00 C ATOM 393 O VAL A 260 -5.749 5.510 9.658 1.00 0.00 O ATOM 394 CB VAL A 260 -6.335 7.677 7.625 1.00 0.00 C ATOM 395 CG1 VAL A 260 -7.638 7.506 8.394 1.00 0.00 C ATOM 396 CG2 VAL A 260 -5.403 8.626 8.360 1.00 0.00 C ATOM 0 H VAL A 260 -7.484 5.735 6.578 1.00 0.00 H new ATOM 0 HA VAL A 260 -4.823 6.454 6.666 1.00 0.00 H new ATOM 0 HB VAL A 260 -6.578 8.107 6.653 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -8.099 8.481 8.550 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -8.316 6.871 7.824 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -7.433 7.043 9.359 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -5.909 9.577 8.526 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -5.123 8.191 9.320 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -4.507 8.792 7.762 1.00 0.00 H new ATOM 406 N GLY A 261 -3.724 5.656 8.686 1.00 0.00 N ATOM 407 CA GLY A 261 -2.983 5.310 9.878 1.00 0.00 C ATOM 408 C GLY A 261 -2.524 3.875 9.853 1.00 0.00 C ATOM 409 O GLY A 261 -1.830 3.421 10.762 1.00 0.00 O ATOM 0 H GLY A 261 -3.145 5.780 7.856 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.118 5.967 9.972 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.607 5.477 10.756 1.00 0.00 H new ATOM 413 N GLU A 262 -2.903 3.157 8.809 1.00 0.00 N ATOM 414 CA GLU A 262 -2.582 1.741 8.731 1.00 0.00 C ATOM 415 C GLU A 262 -1.255 1.526 8.023 1.00 0.00 C ATOM 416 O GLU A 262 -0.600 2.481 7.607 1.00 0.00 O ATOM 417 CB GLU A 262 -3.700 0.964 8.038 1.00 0.00 C ATOM 418 CG GLU A 262 -5.044 1.150 8.707 1.00 0.00 C ATOM 419 CD GLU A 262 -5.987 -0.005 8.445 1.00 0.00 C ATOM 420 OE1 GLU A 262 -5.954 -0.985 9.219 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.756 0.052 7.471 1.00 0.00 O ATOM 0 H GLU A 262 -3.426 3.524 8.014 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.489 1.361 9.748 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.769 1.285 6.999 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.448 -0.096 8.028 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -4.899 1.260 9.782 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.499 2.074 8.351 1.00 0.00 H new ATOM 428 N LEU A 263 -0.860 0.275 7.891 1.00 0.00 N ATOM 429 CA LEU A 263 0.420 -0.063 7.302 1.00 0.00 C ATOM 430 C LEU A 263 0.233 -1.157 6.265 1.00 0.00 C ATOM 431 O LEU A 263 -0.392 -2.181 6.531 1.00 0.00 O ATOM 432 CB LEU A 263 1.389 -0.499 8.416 1.00 0.00 C ATOM 433 CG LEU A 263 2.852 -0.787 8.020 1.00 0.00 C ATOM 434 CD1 LEU A 263 2.977 -2.055 7.187 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.442 0.395 7.271 1.00 0.00 C ATOM 0 H LEU A 263 -1.413 -0.530 8.187 1.00 0.00 H new ATOM 0 HA LEU A 263 0.845 0.805 6.798 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.395 0.279 9.179 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.984 -1.398 8.880 1.00 0.00 H new ATOM 0 HG LEU A 263 3.413 -0.942 8.941 1.00 0.00 H new ATOM 0 HD11 LEU A 263 4.023 -2.220 6.930 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.606 -2.905 7.760 1.00 0.00 H new ATOM 0 HD13 LEU A 263 2.392 -1.950 6.274 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.474 0.175 6.999 1.00 0.00 H new ATOM 0 HD22 LEU A 263 2.861 0.580 6.368 1.00 0.00 H new ATOM 0 HD23 LEU A 263 3.415 1.279 7.908 1.00 0.00 H new ATOM 447 N VAL A 264 0.782 -0.935 5.089 1.00 0.00 N ATOM 448 CA VAL A 264 0.708 -1.905 4.017 1.00 0.00 C ATOM 449 C VAL A 264 2.107 -2.261 3.530 1.00 0.00 C ATOM 450 O VAL A 264 2.857 -1.403 3.070 1.00 0.00 O ATOM 451 CB VAL A 264 -0.159 -1.394 2.843 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.230 0.019 2.440 1.00 0.00 C ATOM 453 CG2 VAL A 264 -0.048 -2.329 1.657 1.00 0.00 C ATOM 0 H VAL A 264 1.289 -0.083 4.850 1.00 0.00 H new ATOM 0 HA VAL A 264 0.230 -2.801 4.412 1.00 0.00 H new ATOM 0 HB VAL A 264 -1.195 -1.373 3.180 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -0.399 0.347 1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 264 0.093 0.690 3.288 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.275 0.034 2.130 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.664 -1.955 0.840 1.00 0.00 H new ATOM 0 HG22 VAL A 264 0.991 -2.383 1.333 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -0.391 -3.323 1.944 1.00 0.00 H new ATOM 463 N LYS A 265 2.464 -3.523 3.667 1.00 0.00 N ATOM 464 CA LYS A 265 3.760 -4.001 3.226 1.00 0.00 C ATOM 465 C LYS A 265 3.681 -4.400 1.761 1.00 0.00 C ATOM 466 O LYS A 265 3.226 -5.494 1.428 1.00 0.00 O ATOM 467 CB LYS A 265 4.198 -5.186 4.091 1.00 0.00 C ATOM 468 CG LYS A 265 5.594 -5.699 3.785 1.00 0.00 C ATOM 469 CD LYS A 265 6.024 -6.742 4.804 1.00 0.00 C ATOM 470 CE LYS A 265 7.471 -7.156 4.612 1.00 0.00 C ATOM 471 NZ LYS A 265 7.994 -7.872 5.805 1.00 0.00 N ATOM 0 H LYS A 265 1.870 -4.240 4.083 1.00 0.00 H new ATOM 0 HA LYS A 265 4.500 -3.208 3.332 1.00 0.00 H new ATOM 0 HB2 LYS A 265 4.153 -4.892 5.140 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.487 -6.001 3.958 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.616 -6.131 2.785 1.00 0.00 H new ATOM 0 HG3 LYS A 265 6.300 -4.868 3.789 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.891 -6.344 5.810 1.00 0.00 H new ATOM 0 HD3 LYS A 265 5.381 -7.618 4.720 1.00 0.00 H new ATOM 0 HE2 LYS A 265 7.554 -7.798 3.735 1.00 0.00 H new ATOM 0 HE3 LYS A 265 8.081 -6.273 4.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 9.015 -8.036 5.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 7.828 -7.297 6.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 7.505 -8.785 5.904 1.00 0.00 H new ATOM 485 N VAL A 266 4.087 -3.501 0.877 1.00 0.00 N ATOM 486 CA VAL A 266 3.966 -3.762 -0.541 1.00 0.00 C ATOM 487 C VAL A 266 5.053 -4.715 -1.016 1.00 0.00 C ATOM 488 O VAL A 266 6.257 -4.475 -0.840 1.00 0.00 O ATOM 489 CB VAL A 266 3.948 -2.465 -1.382 1.00 0.00 C ATOM 490 CG1 VAL A 266 2.954 -1.481 -0.808 1.00 0.00 C ATOM 491 CG2 VAL A 266 5.313 -1.827 -1.492 1.00 0.00 C ATOM 0 H VAL A 266 4.497 -2.598 1.116 1.00 0.00 H new ATOM 0 HA VAL A 266 3.001 -4.245 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 266 3.642 -2.743 -2.391 1.00 0.00 H new ATOM 0 HG11 VAL A 266 2.952 -0.573 -1.410 1.00 0.00 H new ATOM 0 HG12 VAL A 266 1.958 -1.924 -0.816 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.234 -1.236 0.217 1.00 0.00 H new ATOM 0 HG21 VAL A 266 5.243 -0.920 -2.093 1.00 0.00 H new ATOM 0 HG22 VAL A 266 5.678 -1.576 -0.496 1.00 0.00 H new ATOM 0 HG23 VAL A 266 6.003 -2.524 -1.966 1.00 0.00 H new ATOM 501 N THR A 267 4.601 -5.814 -1.600 1.00 0.00 N ATOM 502 CA THR A 267 5.473 -6.890 -2.019 1.00 0.00 C ATOM 503 C THR A 267 5.914 -6.703 -3.464 1.00 0.00 C ATOM 504 O THR A 267 6.873 -7.328 -3.923 1.00 0.00 O ATOM 505 CB THR A 267 4.757 -8.243 -1.865 1.00 0.00 C ATOM 506 OG1 THR A 267 3.522 -8.222 -2.594 1.00 0.00 O ATOM 507 CG2 THR A 267 4.469 -8.537 -0.401 1.00 0.00 C ATOM 0 H THR A 267 3.614 -5.981 -1.796 1.00 0.00 H new ATOM 0 HA THR A 267 6.358 -6.875 -1.383 1.00 0.00 H new ATOM 0 HB THR A 267 5.408 -9.023 -2.259 1.00 0.00 H new ATOM 0 HG1 THR A 267 3.069 -9.086 -2.495 1.00 0.00 H new ATOM 0 HG21 THR A 267 3.962 -9.498 -0.316 1.00 0.00 H new ATOM 0 HG22 THR A 267 5.406 -8.570 0.155 1.00 0.00 H new ATOM 0 HG23 THR A 267 3.832 -7.754 0.009 1.00 0.00 H new ATOM 515 N LYS A 268 5.221 -5.830 -4.180 1.00 0.00 N ATOM 516 CA LYS A 268 5.557 -5.569 -5.564 1.00 0.00 C ATOM 517 C LYS A 268 5.909 -4.109 -5.701 1.00 0.00 C ATOM 518 O LYS A 268 5.035 -3.255 -5.687 1.00 0.00 O ATOM 519 CB LYS A 268 4.376 -5.910 -6.465 1.00 0.00 C ATOM 520 CG LYS A 268 4.754 -6.236 -7.897 1.00 0.00 C ATOM 521 CD LYS A 268 5.298 -7.652 -8.027 1.00 0.00 C ATOM 522 CE LYS A 268 4.188 -8.699 -8.121 1.00 0.00 C ATOM 523 NZ LYS A 268 3.411 -8.857 -6.859 1.00 0.00 N ATOM 0 H LYS A 268 4.428 -5.295 -3.825 1.00 0.00 H new ATOM 0 HA LYS A 268 6.404 -6.187 -5.864 1.00 0.00 H new ATOM 0 HB2 LYS A 268 3.844 -6.761 -6.040 1.00 0.00 H new ATOM 0 HB3 LYS A 268 3.682 -5.069 -6.468 1.00 0.00 H new ATOM 0 HG2 LYS A 268 3.881 -6.121 -8.539 1.00 0.00 H new ATOM 0 HG3 LYS A 268 5.502 -5.525 -8.247 1.00 0.00 H new ATOM 0 HD2 LYS A 268 5.929 -7.715 -8.914 1.00 0.00 H new ATOM 0 HD3 LYS A 268 5.931 -7.875 -7.168 1.00 0.00 H new ATOM 0 HE2 LYS A 268 3.507 -8.423 -8.926 1.00 0.00 H new ATOM 0 HE3 LYS A 268 4.627 -9.659 -8.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 3.064 -9.835 -6.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 4.023 -8.644 -6.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 2.603 -8.202 -6.865 1.00 0.00 H new ATOM 537 N ILE A 269 7.185 -3.833 -5.842 1.00 0.00 N ATOM 538 CA ILE A 269 7.673 -2.464 -5.773 1.00 0.00 C ATOM 539 C ILE A 269 8.074 -1.887 -7.126 1.00 0.00 C ATOM 540 O ILE A 269 8.308 -2.613 -8.096 1.00 0.00 O ATOM 541 CB ILE A 269 8.829 -2.307 -4.756 1.00 0.00 C ATOM 542 CG1 ILE A 269 9.690 -3.572 -4.691 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.269 -1.969 -3.389 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.167 -4.009 -6.047 1.00 0.00 C ATOM 0 H ILE A 269 7.908 -4.534 -6.005 1.00 0.00 H new ATOM 0 HA ILE A 269 6.821 -1.882 -5.422 1.00 0.00 H new ATOM 0 HB ILE A 269 9.471 -1.491 -5.089 1.00 0.00 H new ATOM 0 HG12 ILE A 269 10.550 -3.390 -4.047 1.00 0.00 H new ATOM 0 HG13 ILE A 269 9.115 -4.377 -4.234 1.00 0.00 H new ATOM 0 HG21 ILE A 269 9.087 -1.860 -2.677 1.00 0.00 H new ATOM 0 HG22 ILE A 269 7.710 -1.035 -3.446 1.00 0.00 H new ATOM 0 HG23 ILE A 269 7.606 -2.769 -3.059 1.00 0.00 H new ATOM 0 HD11 ILE A 269 10.773 -4.910 -5.947 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.308 -4.219 -6.685 1.00 0.00 H new ATOM 0 HD13 ILE A 269 10.766 -3.216 -6.495 1.00 0.00 H new ATOM 556 N ASN A 270 8.110 -0.563 -7.173 1.00 0.00 N ATOM 557 CA ASN A 270 8.450 0.176 -8.381 1.00 0.00 C ATOM 558 C ASN A 270 9.212 1.440 -7.992 1.00 0.00 C ATOM 559 O ASN A 270 9.616 1.577 -6.838 1.00 0.00 O ATOM 560 CB ASN A 270 7.182 0.507 -9.178 1.00 0.00 C ATOM 561 CG ASN A 270 6.327 1.590 -8.549 1.00 0.00 C ATOM 562 OD1 ASN A 270 6.330 2.734 -8.991 1.00 0.00 O ATOM 563 ND2 ASN A 270 5.618 1.257 -7.492 1.00 0.00 N ATOM 0 H ASN A 270 7.903 0.032 -6.371 1.00 0.00 H new ATOM 0 HA ASN A 270 9.087 -0.433 -9.022 1.00 0.00 H new ATOM 0 HB2 ASN A 270 7.467 0.820 -10.182 1.00 0.00 H new ATOM 0 HB3 ASN A 270 6.584 -0.398 -9.284 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.051 1.959 -7.017 1.00 0.00 H new ATOM 0 HD22 ASN A 270 5.636 0.297 -7.148 1.00 0.00 H new ATOM 570 N VAL A 271 9.404 2.365 -8.924 1.00 0.00 N ATOM 571 CA VAL A 271 10.133 3.592 -8.615 1.00 0.00 C ATOM 572 C VAL A 271 9.184 4.773 -8.339 1.00 0.00 C ATOM 573 O VAL A 271 9.478 5.633 -7.508 1.00 0.00 O ATOM 574 CB VAL A 271 11.126 3.959 -9.747 1.00 0.00 C ATOM 575 CG1 VAL A 271 10.396 4.300 -11.037 1.00 0.00 C ATOM 576 CG2 VAL A 271 12.039 5.100 -9.322 1.00 0.00 C ATOM 0 H VAL A 271 9.072 2.293 -9.886 1.00 0.00 H new ATOM 0 HA VAL A 271 10.700 3.397 -7.705 1.00 0.00 H new ATOM 0 HB VAL A 271 11.745 3.083 -9.939 1.00 0.00 H new ATOM 0 HG11 VAL A 271 11.122 4.553 -11.810 1.00 0.00 H new ATOM 0 HG12 VAL A 271 9.807 3.442 -11.359 1.00 0.00 H new ATOM 0 HG13 VAL A 271 9.736 5.151 -10.867 1.00 0.00 H new ATOM 0 HG21 VAL A 271 12.726 5.338 -10.134 1.00 0.00 H new ATOM 0 HG22 VAL A 271 11.438 5.978 -9.086 1.00 0.00 H new ATOM 0 HG23 VAL A 271 12.608 4.802 -8.441 1.00 0.00 H new ATOM 586 N SER A 272 8.032 4.787 -9.002 1.00 0.00 N ATOM 587 CA SER A 272 7.111 5.921 -8.923 1.00 0.00 C ATOM 588 C SER A 272 6.293 5.905 -7.629 1.00 0.00 C ATOM 589 O SER A 272 5.842 6.948 -7.156 1.00 0.00 O ATOM 590 CB SER A 272 6.167 5.913 -10.127 1.00 0.00 C ATOM 591 OG SER A 272 6.886 5.757 -11.342 1.00 0.00 O ATOM 0 H SER A 272 7.712 4.026 -9.601 1.00 0.00 H new ATOM 0 HA SER A 272 7.711 6.831 -8.928 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.446 5.103 -10.022 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.600 6.843 -10.154 1.00 0.00 H new ATOM 0 HG SER A 272 6.259 5.753 -12.095 1.00 0.00 H new ATOM 597 N GLY A 273 6.088 4.721 -7.064 1.00 0.00 N ATOM 598 CA GLY A 273 5.312 4.609 -5.848 1.00 0.00 C ATOM 599 C GLY A 273 3.928 4.042 -6.097 1.00 0.00 C ATOM 600 O GLY A 273 3.104 3.971 -5.194 1.00 0.00 O ATOM 0 H GLY A 273 6.446 3.838 -7.428 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.841 3.971 -5.140 1.00 0.00 H new ATOM 0 HA3 GLY A 273 5.221 5.592 -5.386 1.00 0.00 H new ATOM 604 N GLN A 274 3.665 3.657 -7.341 1.00 0.00 N ATOM 605 CA GLN A 274 2.395 3.032 -7.697 1.00 0.00 C ATOM 606 C GLN A 274 2.568 1.524 -7.706 1.00 0.00 C ATOM 607 O GLN A 274 2.757 0.913 -8.757 1.00 0.00 O ATOM 608 CB GLN A 274 1.900 3.516 -9.064 1.00 0.00 C ATOM 609 CG GLN A 274 0.901 4.668 -9.008 1.00 0.00 C ATOM 610 CD GLN A 274 1.518 6.036 -8.740 1.00 0.00 C ATOM 611 OE1 GLN A 274 1.009 7.051 -9.211 1.00 0.00 O ATOM 612 NE2 GLN A 274 2.599 6.086 -7.977 1.00 0.00 N ATOM 0 H GLN A 274 4.314 3.766 -8.120 1.00 0.00 H new ATOM 0 HA GLN A 274 1.647 3.314 -6.956 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.760 3.827 -9.658 1.00 0.00 H new ATOM 0 HB3 GLN A 274 1.439 2.678 -9.586 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.360 4.708 -9.954 1.00 0.00 H new ATOM 0 HG3 GLN A 274 0.168 4.457 -8.230 1.00 0.00 H new ATOM 0 HE21 GLN A 274 2.998 5.226 -7.601 1.00 0.00 H new ATOM 0 HE22 GLN A 274 3.033 6.985 -7.765 1.00 0.00 H new ATOM 621 N TRP A 275 2.511 0.934 -6.527 1.00 0.00 N ATOM 622 CA TRP A 275 2.895 -0.458 -6.358 1.00 0.00 C ATOM 623 C TRP A 275 1.776 -1.293 -5.767 1.00 0.00 C ATOM 624 O TRP A 275 0.772 -0.768 -5.280 1.00 0.00 O ATOM 625 CB TRP A 275 4.146 -0.582 -5.480 1.00 0.00 C ATOM 626 CG TRP A 275 4.353 0.525 -4.499 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.448 1.067 -3.639 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.585 1.205 -4.267 1.00 0.00 C ATOM 629 NE1 TRP A 275 4.039 2.073 -2.916 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.354 2.164 -3.280 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.861 1.092 -4.814 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.354 3.010 -2.830 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.856 1.927 -4.366 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.600 2.877 -3.380 1.00 0.00 C ATOM 0 H TRP A 275 2.203 1.395 -5.671 1.00 0.00 H new ATOM 0 HA TRP A 275 3.114 -0.842 -7.354 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.094 -1.524 -4.934 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.020 -0.638 -6.129 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.419 0.753 -3.540 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.574 2.657 -2.221 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.065 0.358 -5.580 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 6.157 3.751 -2.069 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.849 1.846 -4.783 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.399 3.520 -3.043 1.00 0.00 H new ATOM 645 N GLU A 276 1.974 -2.601 -5.811 1.00 0.00 N ATOM 646 CA GLU A 276 1.011 -3.538 -5.281 1.00 0.00 C ATOM 647 C GLU A 276 1.334 -3.812 -3.829 1.00 0.00 C ATOM 648 O GLU A 276 2.455 -4.204 -3.488 1.00 0.00 O ATOM 649 CB GLU A 276 1.042 -4.831 -6.093 1.00 0.00 C ATOM 650 CG GLU A 276 0.013 -5.864 -5.673 1.00 0.00 C ATOM 651 CD GLU A 276 0.145 -7.141 -6.472 1.00 0.00 C ATOM 652 OE1 GLU A 276 0.968 -7.999 -6.095 1.00 0.00 O ATOM 653 OE2 GLU A 276 -0.551 -7.282 -7.498 1.00 0.00 O ATOM 0 H GLU A 276 2.804 -3.036 -6.214 1.00 0.00 H new ATOM 0 HA GLU A 276 0.008 -3.116 -5.349 1.00 0.00 H new ATOM 0 HB2 GLU A 276 0.886 -4.589 -7.144 1.00 0.00 H new ATOM 0 HB3 GLU A 276 2.035 -5.272 -6.011 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.131 -6.085 -4.612 1.00 0.00 H new ATOM 0 HG3 GLU A 276 -0.989 -5.454 -5.804 1.00 0.00 H new ATOM 660 N GLY A 277 0.343 -3.619 -2.993 1.00 0.00 N ATOM 661 CA GLY A 277 0.538 -3.705 -1.576 1.00 0.00 C ATOM 662 C GLY A 277 -0.100 -4.934 -0.985 1.00 0.00 C ATOM 663 O GLY A 277 -0.995 -5.529 -1.585 1.00 0.00 O ATOM 0 H GLY A 277 -0.612 -3.400 -3.278 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.606 -3.712 -1.358 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.122 -2.817 -1.100 1.00 0.00 H new ATOM 667 N GLU A 278 0.368 -5.323 0.182 1.00 0.00 N ATOM 668 CA GLU A 278 -0.257 -6.387 0.935 1.00 0.00 C ATOM 669 C GLU A 278 -0.233 -6.018 2.411 1.00 0.00 C ATOM 670 O GLU A 278 0.829 -5.800 2.990 1.00 0.00 O ATOM 671 CB GLU A 278 0.466 -7.713 0.693 1.00 0.00 C ATOM 672 CG GLU A 278 -0.155 -8.893 1.422 1.00 0.00 C ATOM 673 CD GLU A 278 0.501 -10.211 1.073 1.00 0.00 C ATOM 674 OE1 GLU A 278 1.501 -10.575 1.723 1.00 0.00 O ATOM 675 OE2 GLU A 278 0.019 -10.893 0.141 1.00 0.00 O ATOM 0 H GLU A 278 1.187 -4.913 0.632 1.00 0.00 H new ATOM 0 HA GLU A 278 -1.289 -6.512 0.609 1.00 0.00 H new ATOM 0 HB2 GLU A 278 0.473 -7.922 -0.377 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.505 -7.611 1.005 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -0.081 -8.729 2.497 1.00 0.00 H new ATOM 0 HG3 GLU A 278 -1.216 -8.946 1.180 1.00 0.00 H new ATOM 682 N CYS A 279 -1.402 -5.923 3.016 1.00 0.00 N ATOM 683 CA CYS A 279 -1.490 -5.532 4.405 1.00 0.00 C ATOM 684 C CYS A 279 -2.029 -6.675 5.241 1.00 0.00 C ATOM 685 O CYS A 279 -3.242 -6.874 5.305 1.00 0.00 O ATOM 686 CB CYS A 279 -2.400 -4.304 4.534 1.00 0.00 C ATOM 687 SG CYS A 279 -2.757 -3.805 6.232 1.00 0.00 S ATOM 0 H CYS A 279 -2.299 -6.111 2.568 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.494 -5.281 4.769 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -1.934 -3.467 4.014 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -3.341 -4.511 4.025 1.00 0.00 H new ATOM 0 HG CYS A 279 -1.761 -3.112 6.699 1.00 0.00 H new ATOM 693 N ASN A 280 -1.104 -7.418 5.857 1.00 0.00 N ATOM 694 CA ASN A 280 -1.422 -8.528 6.758 1.00 0.00 C ATOM 695 C ASN A 280 -2.692 -9.276 6.342 1.00 0.00 C ATOM 696 O ASN A 280 -3.644 -9.398 7.112 1.00 0.00 O ATOM 697 CB ASN A 280 -1.510 -8.021 8.204 1.00 0.00 C ATOM 698 CG ASN A 280 -0.132 -7.861 8.837 1.00 0.00 C ATOM 699 OD1 ASN A 280 0.375 -8.784 9.480 1.00 0.00 O ATOM 700 ND2 ASN A 280 0.491 -6.699 8.664 1.00 0.00 N ATOM 0 H ASN A 280 -0.102 -7.263 5.742 1.00 0.00 H new ATOM 0 HA ASN A 280 -0.612 -9.254 6.691 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -2.031 -7.064 8.222 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -2.103 -8.717 8.797 1.00 0.00 H new ATOM 0 HD21 ASN A 280 1.416 -6.551 9.068 1.00 0.00 H new ATOM 0 HD22 ASN A 280 0.044 -5.956 8.127 1.00 0.00 H new ATOM 707 N GLY A 281 -2.689 -9.777 5.110 1.00 0.00 N ATOM 708 CA GLY A 281 -3.828 -10.520 4.599 1.00 0.00 C ATOM 709 C GLY A 281 -4.496 -9.854 3.404 1.00 0.00 C ATOM 710 O GLY A 281 -4.901 -10.538 2.463 1.00 0.00 O ATOM 0 H GLY A 281 -1.914 -9.681 4.454 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -3.502 -11.520 4.313 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -4.562 -10.640 5.396 1.00 0.00 H new ATOM 714 N LYS A 282 -4.610 -8.530 3.424 1.00 0.00 N ATOM 715 CA LYS A 282 -5.212 -7.806 2.303 1.00 0.00 C ATOM 716 C LYS A 282 -4.212 -7.694 1.160 1.00 0.00 C ATOM 717 O LYS A 282 -3.034 -7.452 1.396 1.00 0.00 O ATOM 718 CB LYS A 282 -5.650 -6.386 2.699 1.00 0.00 C ATOM 719 CG LYS A 282 -6.794 -6.305 3.698 1.00 0.00 C ATOM 720 CD LYS A 282 -6.317 -6.529 5.118 1.00 0.00 C ATOM 721 CE LYS A 282 -7.393 -6.162 6.127 1.00 0.00 C ATOM 722 NZ LYS A 282 -7.758 -4.717 6.060 1.00 0.00 N ATOM 0 H LYS A 282 -4.298 -7.939 4.194 1.00 0.00 H new ATOM 0 HA LYS A 282 -6.092 -8.371 1.996 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.790 -5.863 3.116 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -5.942 -5.850 1.796 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.272 -5.328 3.625 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -7.550 -7.049 3.447 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -6.034 -7.574 5.248 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -5.424 -5.932 5.302 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -8.281 -6.768 5.946 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -7.044 -6.401 7.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -7.569 -4.268 6.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -7.191 -4.250 5.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -8.768 -4.624 5.830 1.00 0.00 H new ATOM 736 N ARG A 283 -4.674 -7.855 -0.070 1.00 0.00 N ATOM 737 CA ARG A 283 -3.808 -7.673 -1.227 1.00 0.00 C ATOM 738 C ARG A 283 -4.412 -6.640 -2.161 1.00 0.00 C ATOM 739 O ARG A 283 -5.587 -6.734 -2.516 1.00 0.00 O ATOM 740 CB ARG A 283 -3.608 -8.982 -1.982 1.00 0.00 C ATOM 741 CG ARG A 283 -3.299 -10.165 -1.091 1.00 0.00 C ATOM 742 CD ARG A 283 -2.421 -11.151 -1.817 1.00 0.00 C ATOM 743 NE ARG A 283 -2.983 -11.553 -3.104 1.00 0.00 N ATOM 744 CZ ARG A 283 -2.266 -11.640 -4.223 1.00 0.00 C ATOM 745 NH1 ARG A 283 -0.955 -11.435 -4.188 1.00 0.00 N ATOM 746 NH2 ARG A 283 -2.861 -11.948 -5.365 1.00 0.00 N ATOM 0 H ARG A 283 -5.636 -8.109 -0.293 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.836 -7.331 -0.870 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -4.508 -9.199 -2.557 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.795 -8.857 -2.697 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -2.802 -9.825 -0.183 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -4.226 -10.650 -0.784 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -1.437 -10.710 -1.975 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -2.278 -12.034 -1.194 1.00 0.00 H new ATOM 0 HE ARG A 283 -3.977 -11.779 -3.148 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -0.497 -11.211 -3.304 1.00 0.00 H new ATOM 0 HH12 ARG A 283 -0.405 -11.502 -5.045 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -3.866 -12.118 -5.387 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -2.314 -12.015 -6.223 1.00 0.00 H new ATOM 760 N GLY A 284 -3.621 -5.655 -2.551 1.00 0.00 N ATOM 761 CA GLY A 284 -4.130 -4.617 -3.425 1.00 0.00 C ATOM 762 C GLY A 284 -3.115 -3.533 -3.735 1.00 0.00 C ATOM 763 O GLY A 284 -2.324 -3.162 -2.877 1.00 0.00 O ATOM 0 H GLY A 284 -2.642 -5.554 -2.282 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -4.462 -5.070 -4.359 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -5.006 -4.162 -2.963 1.00 0.00 H new ATOM 767 N HIS A 285 -3.169 -2.984 -4.947 1.00 0.00 N ATOM 768 CA HIS A 285 -2.171 -1.999 -5.384 1.00 0.00 C ATOM 769 C HIS A 285 -2.740 -0.580 -5.362 1.00 0.00 C ATOM 770 O HIS A 285 -3.928 -0.385 -5.611 1.00 0.00 O ATOM 771 CB HIS A 285 -1.632 -2.337 -6.784 1.00 0.00 C ATOM 772 CG HIS A 285 -2.638 -2.260 -7.889 1.00 0.00 C ATOM 773 ND1 HIS A 285 -2.876 -1.112 -8.612 1.00 0.00 N ATOM 774 CD2 HIS A 285 -3.447 -3.205 -8.413 1.00 0.00 C ATOM 775 CE1 HIS A 285 -3.789 -1.356 -9.529 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.151 -2.619 -9.434 1.00 0.00 N ATOM 0 H HIS A 285 -3.885 -3.199 -5.641 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.343 -2.043 -4.677 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -0.811 -1.658 -7.014 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.216 -3.344 -6.762 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -3.525 -4.232 -8.088 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -4.176 -0.641 -10.240 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -4.841 -3.085 -10.023 1.00 0.00 H new ATOM 785 N PHE A 286 -1.879 0.403 -5.078 1.00 0.00 N ATOM 786 CA PHE A 286 -2.306 1.798 -4.936 1.00 0.00 C ATOM 787 C PHE A 286 -1.131 2.768 -5.125 1.00 0.00 C ATOM 788 O PHE A 286 0.032 2.353 -5.128 1.00 0.00 O ATOM 789 CB PHE A 286 -2.947 2.015 -3.562 1.00 0.00 C ATOM 790 CG PHE A 286 -4.422 1.738 -3.530 1.00 0.00 C ATOM 791 CD1 PHE A 286 -5.312 2.543 -4.226 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.914 0.674 -2.804 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.668 2.287 -4.196 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.269 0.415 -2.768 1.00 0.00 C ATOM 795 CZ PHE A 286 -7.148 1.220 -3.467 1.00 0.00 C ATOM 0 H PHE A 286 -0.879 0.257 -4.942 1.00 0.00 H new ATOM 0 HA PHE A 286 -3.040 2.003 -5.715 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.451 1.373 -2.835 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.773 3.045 -3.249 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.939 3.380 -4.798 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.233 0.038 -2.259 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -7.351 2.921 -4.742 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.643 -0.419 -2.192 1.00 0.00 H new ATOM 0 HZ PHE A 286 -8.208 1.014 -3.442 1.00 0.00 H new ATOM 805 N PRO A 287 -1.428 4.082 -5.288 1.00 0.00 N ATOM 806 CA PRO A 287 -0.420 5.114 -5.526 1.00 0.00 C ATOM 807 C PRO A 287 0.191 5.682 -4.241 1.00 0.00 C ATOM 808 O PRO A 287 -0.440 5.691 -3.175 1.00 0.00 O ATOM 809 CB PRO A 287 -1.201 6.216 -6.263 1.00 0.00 C ATOM 810 CG PRO A 287 -2.634 5.777 -6.292 1.00 0.00 C ATOM 811 CD PRO A 287 -2.768 4.669 -5.289 1.00 0.00 C ATOM 0 HA PRO A 287 0.427 4.710 -6.080 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -1.099 7.173 -5.750 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.817 6.353 -7.274 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -3.297 6.606 -6.044 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -2.913 5.433 -7.288 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -3.048 5.044 -4.305 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.528 3.945 -5.582 1.00 0.00 H new ATOM 819 N PHE A 288 1.420 6.176 -4.388 1.00 0.00 N ATOM 820 CA PHE A 288 2.225 6.724 -3.296 1.00 0.00 C ATOM 821 C PHE A 288 1.642 8.023 -2.734 1.00 0.00 C ATOM 822 O PHE A 288 1.890 8.372 -1.581 1.00 0.00 O ATOM 823 CB PHE A 288 3.629 6.994 -3.846 1.00 0.00 C ATOM 824 CG PHE A 288 4.669 7.322 -2.817 1.00 0.00 C ATOM 825 CD1 PHE A 288 5.422 6.315 -2.249 1.00 0.00 C ATOM 826 CD2 PHE A 288 4.914 8.635 -2.441 1.00 0.00 C ATOM 827 CE1 PHE A 288 6.401 6.603 -1.323 1.00 0.00 C ATOM 828 CE2 PHE A 288 5.889 8.931 -1.510 1.00 0.00 C ATOM 829 CZ PHE A 288 6.635 7.913 -0.949 1.00 0.00 C ATOM 0 H PHE A 288 1.895 6.207 -5.290 1.00 0.00 H new ATOM 0 HA PHE A 288 2.241 6.004 -2.478 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.958 6.117 -4.404 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.571 7.819 -4.555 1.00 0.00 H new ATOM 0 HD1 PHE A 288 5.242 5.289 -2.534 1.00 0.00 H new ATOM 0 HD2 PHE A 288 4.336 9.434 -2.881 1.00 0.00 H new ATOM 0 HE1 PHE A 288 6.986 5.805 -0.889 1.00 0.00 H new ATOM 0 HE2 PHE A 288 6.068 9.956 -1.221 1.00 0.00 H new ATOM 0 HZ PHE A 288 7.399 8.140 -0.220 1.00 0.00 H new ATOM 839 N THR A 289 0.846 8.709 -3.550 1.00 0.00 N ATOM 840 CA THR A 289 0.398 10.075 -3.265 1.00 0.00 C ATOM 841 C THR A 289 -0.256 10.222 -1.880 1.00 0.00 C ATOM 842 O THR A 289 -0.178 11.281 -1.261 1.00 0.00 O ATOM 843 CB THR A 289 -0.578 10.558 -4.363 1.00 0.00 C ATOM 844 OG1 THR A 289 -0.968 11.915 -4.142 1.00 0.00 O ATOM 845 CG2 THR A 289 -1.800 9.670 -4.436 1.00 0.00 C ATOM 0 H THR A 289 0.491 8.335 -4.430 1.00 0.00 H new ATOM 0 HA THR A 289 1.292 10.699 -3.260 1.00 0.00 H new ATOM 0 HB THR A 289 -0.053 10.500 -5.316 1.00 0.00 H new ATOM 0 HG1 THR A 289 -1.584 12.198 -4.850 1.00 0.00 H new ATOM 0 HG21 THR A 289 -2.468 10.034 -5.217 1.00 0.00 H new ATOM 0 HG22 THR A 289 -1.495 8.649 -4.666 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.319 9.686 -3.478 1.00 0.00 H new ATOM 853 N HIS A 290 -0.876 9.158 -1.385 1.00 0.00 N ATOM 854 CA HIS A 290 -1.533 9.202 -0.080 1.00 0.00 C ATOM 855 C HIS A 290 -0.961 8.143 0.854 1.00 0.00 C ATOM 856 O HIS A 290 -1.687 7.320 1.422 1.00 0.00 O ATOM 857 CB HIS A 290 -3.060 9.072 -0.222 1.00 0.00 C ATOM 858 CG HIS A 290 -3.537 7.911 -1.041 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.701 7.945 -1.774 1.00 0.00 N ATOM 860 CD2 HIS A 290 -3.009 6.680 -1.240 1.00 0.00 C ATOM 861 CE1 HIS A 290 -4.870 6.795 -2.388 1.00 0.00 C ATOM 862 NE2 HIS A 290 -3.855 6.003 -2.087 1.00 0.00 N ATOM 0 H HIS A 290 -0.939 8.259 -1.862 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.332 10.175 0.367 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.494 8.994 0.775 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.445 9.990 -0.666 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -5.336 8.741 -1.832 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -2.093 6.300 -0.813 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -5.699 6.540 -3.031 1.00 0.00 H new ATOM 871 N VAL A 291 0.354 8.166 0.996 1.00 0.00 N ATOM 872 CA VAL A 291 1.046 7.267 1.900 1.00 0.00 C ATOM 873 C VAL A 291 2.279 7.953 2.481 1.00 0.00 C ATOM 874 O VAL A 291 2.782 8.929 1.925 1.00 0.00 O ATOM 875 CB VAL A 291 1.450 5.951 1.181 1.00 0.00 C ATOM 876 CG1 VAL A 291 2.959 5.805 1.007 1.00 0.00 C ATOM 877 CG2 VAL A 291 0.878 4.748 1.908 1.00 0.00 C ATOM 0 H VAL A 291 0.967 8.805 0.490 1.00 0.00 H new ATOM 0 HA VAL A 291 0.365 7.011 2.712 1.00 0.00 H new ATOM 0 HB VAL A 291 1.024 6.001 0.179 1.00 0.00 H new ATOM 0 HG11 VAL A 291 3.177 4.866 0.498 1.00 0.00 H new ATOM 0 HG12 VAL A 291 3.339 6.636 0.413 1.00 0.00 H new ATOM 0 HG13 VAL A 291 3.440 5.808 1.985 1.00 0.00 H new ATOM 0 HG21 VAL A 291 1.172 3.836 1.389 1.00 0.00 H new ATOM 0 HG22 VAL A 291 1.260 4.724 2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -0.209 4.819 1.929 1.00 0.00 H new ATOM 887 N ARG A 292 2.732 7.440 3.605 1.00 0.00 N ATOM 888 CA ARG A 292 3.975 7.877 4.226 1.00 0.00 C ATOM 889 C ARG A 292 4.862 6.655 4.338 1.00 0.00 C ATOM 890 O ARG A 292 4.601 5.748 5.113 1.00 0.00 O ATOM 891 CB ARG A 292 3.753 8.499 5.613 1.00 0.00 C ATOM 892 CG ARG A 292 2.735 9.630 5.651 1.00 0.00 C ATOM 893 CD ARG A 292 2.912 10.621 4.513 1.00 0.00 C ATOM 894 NE ARG A 292 4.276 11.143 4.411 1.00 0.00 N ATOM 895 CZ ARG A 292 4.808 11.577 3.268 1.00 0.00 C ATOM 896 NH1 ARG A 292 4.104 11.503 2.145 1.00 0.00 N ATOM 897 NH2 ARG A 292 6.048 12.053 3.238 1.00 0.00 N ATOM 0 H ARG A 292 2.249 6.704 4.120 1.00 0.00 H new ATOM 0 HA ARG A 292 4.432 8.656 3.615 1.00 0.00 H new ATOM 0 HB2 ARG A 292 3.431 7.716 6.299 1.00 0.00 H new ATOM 0 HB3 ARG A 292 4.707 8.875 5.984 1.00 0.00 H new ATOM 0 HG2 ARG A 292 1.730 9.210 5.608 1.00 0.00 H new ATOM 0 HG3 ARG A 292 2.819 10.157 6.602 1.00 0.00 H new ATOM 0 HD2 ARG A 292 2.643 10.138 3.574 1.00 0.00 H new ATOM 0 HD3 ARG A 292 2.221 11.452 4.653 1.00 0.00 H new ATOM 0 HE ARG A 292 4.847 11.176 5.255 1.00 0.00 H new ATOM 0 HH11 ARG A 292 3.161 11.115 2.159 1.00 0.00 H new ATOM 0 HH12 ARG A 292 4.506 11.834 1.268 1.00 0.00 H new ATOM 0 HH21 ARG A 292 6.601 12.089 4.094 1.00 0.00 H new ATOM 0 HH22 ARG A 292 6.447 12.383 2.359 1.00 0.00 H new ATOM 911 N LEU A 293 5.892 6.629 3.552 1.00 0.00 N ATOM 912 CA LEU A 293 6.583 5.423 3.257 1.00 0.00 C ATOM 913 C LEU A 293 7.733 5.140 4.212 1.00 0.00 C ATOM 914 O LEU A 293 8.596 5.987 4.441 1.00 0.00 O ATOM 915 CB LEU A 293 7.054 5.622 1.847 1.00 0.00 C ATOM 916 CG LEU A 293 7.079 4.410 0.960 1.00 0.00 C ATOM 917 CD1 LEU A 293 8.166 3.478 1.409 1.00 0.00 C ATOM 918 CD2 LEU A 293 5.729 3.723 0.970 1.00 0.00 C ATOM 0 H LEU A 293 6.277 7.455 3.095 1.00 0.00 H new ATOM 0 HA LEU A 293 5.942 4.549 3.372 1.00 0.00 H new ATOM 0 HB2 LEU A 293 6.416 6.371 1.379 1.00 0.00 H new ATOM 0 HB3 LEU A 293 8.061 6.038 1.881 1.00 0.00 H new ATOM 0 HG LEU A 293 7.289 4.716 -0.065 1.00 0.00 H new ATOM 0 HD11 LEU A 293 8.182 2.600 0.764 1.00 0.00 H new ATOM 0 HD12 LEU A 293 9.128 3.987 1.352 1.00 0.00 H new ATOM 0 HD13 LEU A 293 7.979 3.169 2.437 1.00 0.00 H new ATOM 0 HD21 LEU A 293 5.762 2.846 0.323 1.00 0.00 H new ATOM 0 HD22 LEU A 293 5.485 3.415 1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 293 4.967 4.413 0.608 1.00 0.00 H new ATOM 930 N LEU A 294 7.716 3.944 4.781 1.00 0.00 N ATOM 931 CA LEU A 294 8.848 3.425 5.501 1.00 0.00 C ATOM 932 C LEU A 294 9.692 2.650 4.492 1.00 0.00 C ATOM 933 O LEU A 294 9.218 1.683 3.883 1.00 0.00 O ATOM 934 CB LEU A 294 8.379 2.496 6.629 1.00 0.00 C ATOM 935 CG LEU A 294 7.075 2.878 7.341 1.00 0.00 C ATOM 936 CD1 LEU A 294 6.834 1.974 8.538 1.00 0.00 C ATOM 937 CD2 LEU A 294 7.101 4.329 7.758 1.00 0.00 C ATOM 0 H LEU A 294 6.914 3.314 4.752 1.00 0.00 H new ATOM 0 HA LEU A 294 9.425 4.229 5.957 1.00 0.00 H new ATOM 0 HB2 LEU A 294 8.260 1.494 6.217 1.00 0.00 H new ATOM 0 HB3 LEU A 294 9.171 2.442 7.376 1.00 0.00 H new ATOM 0 HG LEU A 294 6.250 2.742 6.642 1.00 0.00 H new ATOM 0 HD11 LEU A 294 5.904 2.261 9.029 1.00 0.00 H new ATOM 0 HD12 LEU A 294 6.763 0.939 8.204 1.00 0.00 H new ATOM 0 HD13 LEU A 294 7.661 2.073 9.241 1.00 0.00 H new ATOM 0 HD21 LEU A 294 6.167 4.580 8.261 1.00 0.00 H new ATOM 0 HD22 LEU A 294 7.936 4.497 8.438 1.00 0.00 H new ATOM 0 HD23 LEU A 294 7.219 4.959 6.876 1.00 0.00 H new