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 245 LYS NZ :NH3+ -128:sc= -1.65 (180deg=-2.96!) USER MOD Set 1.2: A 290 HIS : no HD1:sc= -1.89! K(o=-3.5!,f=-2.8) USER MOD Set 2.1: A 279 CYS SG : rot 67:sc= 0.834 USER MOD Set 2.2: A 282 LYS NZ :NH3+ -155:sc= 0.098 (180deg=0) USER MOD Set 3.1: A 270 ASN : amide:sc= -1.82 K(o=-1.8,f=-10!) USER MOD Set 3.2: A 272 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 239 TYR OH : rot 180:sc= 0.823 USER MOD Set 4.2: A 265 LYS NZ :NH3+ 158:sc= 1.54 (180deg=-0.25) USER MOD Single : A 244 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 249 ASN : amide:sc= -0.861 K(o=-0.86,f=-0.00051) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ -151:sc= 1.19 (180deg=1.12) USER MOD Single : A 254 THR OG1 : rot 1:sc= 1.06 USER MOD Single : A 267 THR OG1 : rot 180:sc= 0.00094 USER MOD Single : A 268 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0422) USER MOD Single : A 274 GLN : amide:sc= -1.82 K(o=-1.8,f=-0.53) USER MOD Single : A 280 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 285 HIS : no HD1:sc= 0.405 K(o=0.41,f=-3.7!) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 10.387 -5.851 0.202 1.00 0.00 N ATOM 9 CA PRO A 237 9.096 -5.200 0.450 1.00 0.00 C ATOM 10 C PRO A 237 9.228 -3.950 1.315 1.00 0.00 C ATOM 11 O PRO A 237 9.838 -3.998 2.387 1.00 0.00 O ATOM 12 CB PRO A 237 8.297 -6.270 1.216 1.00 0.00 C ATOM 13 CG PRO A 237 9.066 -7.536 1.037 1.00 0.00 C ATOM 14 CD PRO A 237 10.497 -7.115 0.928 1.00 0.00 C ATOM 0 HA PRO A 237 8.632 -4.869 -0.479 1.00 0.00 H new ATOM 0 HB2 PRO A 237 8.204 -6.012 2.271 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.286 -6.364 0.820 1.00 0.00 H new ATOM 0 HG2 PRO A 237 8.917 -8.210 1.881 1.00 0.00 H new ATOM 0 HG3 PRO A 237 8.743 -8.069 0.143 1.00 0.00 H new ATOM 0 HD2 PRO A 237 10.960 -6.985 1.906 1.00 0.00 H new ATOM 0 HD3 PRO A 237 11.097 -7.846 0.386 1.00 0.00 H new ATOM 22 N ILE A 238 8.648 -2.838 0.871 1.00 0.00 N ATOM 23 CA ILE A 238 8.641 -1.635 1.700 1.00 0.00 C ATOM 24 C ILE A 238 7.404 -1.627 2.584 1.00 0.00 C ATOM 25 O ILE A 238 6.359 -2.178 2.222 1.00 0.00 O ATOM 26 CB ILE A 238 8.768 -0.297 0.897 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.639 0.700 1.241 1.00 0.00 C ATOM 28 CG2 ILE A 238 8.824 -0.548 -0.596 1.00 0.00 C ATOM 29 CD1 ILE A 238 6.521 0.764 0.244 1.00 0.00 C ATOM 0 H ILE A 238 8.188 -2.744 -0.034 1.00 0.00 H new ATOM 0 HA ILE A 238 9.539 -1.680 2.316 1.00 0.00 H new ATOM 0 HB ILE A 238 9.710 0.159 1.201 1.00 0.00 H new ATOM 0 HG12 ILE A 238 7.224 0.433 2.213 1.00 0.00 H new ATOM 0 HG13 ILE A 238 8.072 1.695 1.342 1.00 0.00 H new ATOM 0 HG21 ILE A 238 8.912 0.403 -1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 238 9.687 -1.172 -0.828 1.00 0.00 H new ATOM 0 HG23 ILE A 238 7.913 -1.055 -0.914 1.00 0.00 H new ATOM 0 HD11 ILE A 238 5.780 1.491 0.575 1.00 0.00 H new ATOM 0 HD12 ILE A 238 6.916 1.064 -0.727 1.00 0.00 H new ATOM 0 HD13 ILE A 238 6.054 -0.217 0.158 1.00 0.00 H new ATOM 41 N TYR A 239 7.530 -1.027 3.750 1.00 0.00 N ATOM 42 CA TYR A 239 6.420 -0.934 4.671 1.00 0.00 C ATOM 43 C TYR A 239 5.756 0.400 4.474 1.00 0.00 C ATOM 44 O TYR A 239 6.380 1.418 4.657 1.00 0.00 O ATOM 45 CB TYR A 239 6.911 -1.078 6.112 1.00 0.00 C ATOM 46 CG TYR A 239 7.156 -2.513 6.505 1.00 0.00 C ATOM 47 CD1 TYR A 239 6.150 -3.460 6.376 1.00 0.00 C ATOM 48 CD2 TYR A 239 8.393 -2.925 6.981 1.00 0.00 C ATOM 49 CE1 TYR A 239 6.370 -4.779 6.708 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.619 -4.245 7.323 1.00 0.00 C ATOM 51 CZ TYR A 239 7.604 -5.167 7.182 1.00 0.00 C ATOM 52 OH TYR A 239 7.825 -6.486 7.503 1.00 0.00 O ATOM 0 H TYR A 239 8.393 -0.596 4.081 1.00 0.00 H new ATOM 0 HA TYR A 239 5.708 -1.736 4.479 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.833 -0.510 6.235 1.00 0.00 H new ATOM 0 HB3 TYR A 239 6.175 -0.642 6.787 1.00 0.00 H new ATOM 0 HD1 TYR A 239 5.180 -3.159 6.010 1.00 0.00 H new ATOM 0 HD2 TYR A 239 9.190 -2.204 7.086 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.579 -5.505 6.597 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.584 -4.552 7.698 1.00 0.00 H new ATOM 0 HH TYR A 239 8.745 -6.595 7.821 1.00 0.00 H new ATOM 62 N ALA A 240 4.503 0.418 4.106 1.00 0.00 N ATOM 63 CA ALA A 240 3.888 1.672 3.741 1.00 0.00 C ATOM 64 C ALA A 240 2.804 2.064 4.722 1.00 0.00 C ATOM 65 O ALA A 240 1.809 1.361 4.901 1.00 0.00 O ATOM 66 CB ALA A 240 3.361 1.603 2.319 1.00 0.00 C ATOM 0 H ALA A 240 3.897 -0.400 4.050 1.00 0.00 H new ATOM 0 HA ALA A 240 4.647 2.453 3.784 1.00 0.00 H new ATOM 0 HB1 ALA A 240 2.899 2.555 2.055 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.185 1.397 1.635 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.620 0.807 2.244 1.00 0.00 H new ATOM 72 N ARG A 241 3.027 3.196 5.358 1.00 0.00 N ATOM 73 CA ARG A 241 2.094 3.756 6.306 1.00 0.00 C ATOM 74 C ARG A 241 1.005 4.465 5.530 1.00 0.00 C ATOM 75 O ARG A 241 1.201 5.577 5.052 1.00 0.00 O ATOM 76 CB ARG A 241 2.835 4.750 7.198 1.00 0.00 C ATOM 77 CG ARG A 241 2.392 4.764 8.654 1.00 0.00 C ATOM 78 CD ARG A 241 0.987 5.331 8.849 1.00 0.00 C ATOM 79 NE ARG A 241 0.698 5.564 10.263 1.00 0.00 N ATOM 80 CZ ARG A 241 0.384 6.754 10.774 1.00 0.00 C ATOM 81 NH1 ARG A 241 0.446 7.841 10.015 1.00 0.00 N ATOM 82 NH2 ARG A 241 0.045 6.861 12.053 1.00 0.00 N ATOM 0 H ARG A 241 3.870 3.756 5.228 1.00 0.00 H new ATOM 0 HA ARG A 241 1.655 2.977 6.930 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.901 4.524 7.161 1.00 0.00 H new ATOM 0 HB3 ARG A 241 2.707 5.751 6.785 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.425 3.748 9.047 1.00 0.00 H new ATOM 0 HG3 ARG A 241 3.099 5.354 9.237 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.890 6.266 8.297 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.253 4.639 8.435 1.00 0.00 H new ATOM 0 HE ARG A 241 0.739 4.767 10.898 1.00 0.00 H new ATOM 0 HH11 ARG A 241 0.734 7.766 9.039 1.00 0.00 H new ATOM 0 HH12 ARG A 241 0.205 8.751 10.407 1.00 0.00 H new ATOM 0 HH21 ARG A 241 0.025 6.032 12.646 1.00 0.00 H new ATOM 0 HH22 ARG A 241 -0.195 7.773 12.442 1.00 0.00 H new ATOM 96 N VAL A 242 -0.134 3.834 5.395 1.00 0.00 N ATOM 97 CA VAL A 242 -1.196 4.418 4.611 1.00 0.00 C ATOM 98 C VAL A 242 -1.943 5.453 5.430 1.00 0.00 C ATOM 99 O VAL A 242 -2.531 5.141 6.460 1.00 0.00 O ATOM 100 CB VAL A 242 -2.163 3.361 4.046 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.733 2.494 5.143 1.00 0.00 C ATOM 102 CG2 VAL A 242 -3.277 4.036 3.277 1.00 0.00 C ATOM 0 H VAL A 242 -0.350 2.928 5.811 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.735 4.907 3.753 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.602 2.716 3.370 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.411 1.759 4.710 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.922 1.980 5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.278 3.117 5.853 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.956 3.280 2.881 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.825 4.704 3.942 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.854 4.611 2.453 1.00 0.00 H new ATOM 112 N ILE A 243 -1.898 6.694 4.969 1.00 0.00 N ATOM 113 CA ILE A 243 -2.428 7.814 5.727 1.00 0.00 C ATOM 114 C ILE A 243 -3.751 8.308 5.164 1.00 0.00 C ATOM 115 O ILE A 243 -4.349 9.233 5.705 1.00 0.00 O ATOM 116 CB ILE A 243 -1.401 8.974 5.782 1.00 0.00 C ATOM 117 CG1 ILE A 243 -1.003 9.463 4.375 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.167 8.537 6.553 1.00 0.00 C ATOM 119 CD1 ILE A 243 -1.928 10.514 3.816 1.00 0.00 C ATOM 0 H ILE A 243 -1.497 6.950 4.067 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.614 7.457 6.740 1.00 0.00 H new ATOM 0 HB ILE A 243 -1.876 9.811 6.295 1.00 0.00 H new ATOM 0 HG12 ILE A 243 0.009 9.865 4.412 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -0.983 8.611 3.696 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.550 9.357 6.587 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.451 8.261 7.568 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.287 7.679 6.057 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -1.586 10.810 2.824 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -2.938 10.110 3.746 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -1.930 11.384 4.473 1.00 0.00 H new ATOM 131 N GLN A 244 -4.217 7.655 4.105 1.00 0.00 N ATOM 132 CA GLN A 244 -5.405 8.089 3.364 1.00 0.00 C ATOM 133 C GLN A 244 -5.775 7.033 2.344 1.00 0.00 C ATOM 134 O GLN A 244 -5.221 7.008 1.246 1.00 0.00 O ATOM 135 CB GLN A 244 -5.138 9.401 2.618 1.00 0.00 C ATOM 136 CG GLN A 244 -5.385 10.671 3.421 1.00 0.00 C ATOM 137 CD GLN A 244 -4.991 11.923 2.659 1.00 0.00 C ATOM 138 OE1 GLN A 244 -4.095 11.896 1.811 1.00 0.00 O ATOM 139 NE2 GLN A 244 -5.642 13.032 2.964 1.00 0.00 N ATOM 0 H GLN A 244 -3.785 6.809 3.733 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.214 8.239 4.079 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -4.102 9.402 2.278 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -5.766 9.427 1.727 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -6.440 10.729 3.689 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -4.822 10.624 4.353 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -6.377 13.014 3.671 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -5.409 13.906 2.492 1.00 0.00 H new ATOM 148 N LYS A 245 -6.668 6.138 2.701 1.00 0.00 N ATOM 149 CA LYS A 245 -7.078 5.105 1.776 1.00 0.00 C ATOM 150 C LYS A 245 -8.537 4.731 1.972 1.00 0.00 C ATOM 151 O LYS A 245 -9.157 5.065 2.982 1.00 0.00 O ATOM 152 CB LYS A 245 -6.198 3.875 1.893 1.00 0.00 C ATOM 153 CG LYS A 245 -5.684 3.350 0.557 1.00 0.00 C ATOM 154 CD LYS A 245 -4.374 4.005 0.149 1.00 0.00 C ATOM 155 CE LYS A 245 -3.433 3.006 -0.521 1.00 0.00 C ATOM 156 NZ LYS A 245 -2.142 3.631 -0.919 1.00 0.00 N ATOM 0 H LYS A 245 -7.120 6.103 3.615 1.00 0.00 H new ATOM 0 HA LYS A 245 -6.963 5.512 0.771 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.346 4.110 2.531 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.760 3.085 2.390 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -5.544 2.271 0.622 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -6.433 3.528 -0.214 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -4.576 4.830 -0.534 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -3.889 4.430 1.028 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.239 2.178 0.161 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -3.919 2.586 -1.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.952 3.427 -1.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -2.197 4.660 -0.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -1.374 3.243 -0.335 1.00 0.00 H new ATOM 170 N ARG A 246 -9.048 4.029 0.985 1.00 0.00 N ATOM 171 CA ARG A 246 -10.452 3.671 0.893 1.00 0.00 C ATOM 172 C ARG A 246 -10.655 2.216 1.306 1.00 0.00 C ATOM 173 O ARG A 246 -9.697 1.523 1.664 1.00 0.00 O ATOM 174 CB ARG A 246 -10.926 3.885 -0.547 1.00 0.00 C ATOM 175 CG ARG A 246 -10.124 3.099 -1.574 1.00 0.00 C ATOM 176 CD ARG A 246 -10.532 3.461 -2.996 1.00 0.00 C ATOM 177 NE ARG A 246 -11.457 2.495 -3.586 1.00 0.00 N ATOM 178 CZ ARG A 246 -12.720 2.763 -3.919 1.00 0.00 C ATOM 179 NH1 ARG A 246 -13.255 3.955 -3.657 1.00 0.00 N ATOM 180 NH2 ARG A 246 -13.444 1.832 -4.520 1.00 0.00 N ATOM 0 H ARG A 246 -8.489 3.682 0.205 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.034 4.300 1.566 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -11.975 3.600 -0.622 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -10.866 4.947 -0.787 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.061 3.298 -1.437 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.271 2.031 -1.413 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -10.996 4.447 -2.995 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -9.640 3.529 -3.618 1.00 0.00 H new ATOM 0 HE ARG A 246 -11.112 1.550 -3.755 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -12.697 4.674 -3.197 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -14.222 4.148 -3.917 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -13.035 0.920 -4.724 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -14.411 2.026 -4.779 1.00 0.00 H new ATOM 194 N VAL A 247 -11.894 1.745 1.231 1.00 0.00 N ATOM 195 CA VAL A 247 -12.211 0.372 1.590 1.00 0.00 C ATOM 196 C VAL A 247 -12.585 -0.417 0.333 1.00 0.00 C ATOM 197 O VAL A 247 -13.756 -0.734 0.098 1.00 0.00 O ATOM 198 CB VAL A 247 -13.363 0.297 2.618 1.00 0.00 C ATOM 199 CG1 VAL A 247 -13.547 -1.130 3.117 1.00 0.00 C ATOM 200 CG2 VAL A 247 -13.111 1.245 3.783 1.00 0.00 C ATOM 0 H VAL A 247 -12.695 2.296 0.924 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.326 -0.064 2.053 1.00 0.00 H new ATOM 0 HB VAL A 247 -14.282 0.607 2.120 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -14.363 -1.160 3.839 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -13.783 -1.782 2.276 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -12.628 -1.470 3.593 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -13.935 1.175 4.494 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -12.180 0.972 4.279 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -13.038 2.267 3.411 1.00 0.00 H new ATOM 210 N PRO A 248 -11.586 -0.721 -0.503 1.00 0.00 N ATOM 211 CA PRO A 248 -11.757 -1.441 -1.739 1.00 0.00 C ATOM 212 C PRO A 248 -11.484 -2.925 -1.535 1.00 0.00 C ATOM 213 O PRO A 248 -11.103 -3.342 -0.450 1.00 0.00 O ATOM 214 CB PRO A 248 -10.705 -0.783 -2.623 1.00 0.00 C ATOM 215 CG PRO A 248 -9.624 -0.335 -1.691 1.00 0.00 C ATOM 216 CD PRO A 248 -10.173 -0.431 -0.296 1.00 0.00 C ATOM 0 HA PRO A 248 -12.762 -1.397 -2.158 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -10.320 -1.484 -3.363 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -11.125 0.060 -3.171 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.738 -0.961 -1.800 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -9.321 0.688 -1.916 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.682 -1.219 0.275 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -10.031 0.498 0.256 1.00 0.00 H new ATOM 224 N ASN A 249 -11.682 -3.726 -2.557 1.00 0.00 N ATOM 225 CA ASN A 249 -11.488 -5.162 -2.423 1.00 0.00 C ATOM 226 C ASN A 249 -10.738 -5.706 -3.624 1.00 0.00 C ATOM 227 O ASN A 249 -10.449 -4.971 -4.569 1.00 0.00 O ATOM 228 CB ASN A 249 -12.838 -5.889 -2.296 1.00 0.00 C ATOM 229 CG ASN A 249 -13.607 -5.558 -1.027 1.00 0.00 C ATOM 230 OD1 ASN A 249 -14.835 -5.464 -1.047 1.00 0.00 O ATOM 231 ND2 ASN A 249 -12.907 -5.402 0.087 1.00 0.00 N ATOM 0 H ASN A 249 -11.975 -3.417 -3.484 1.00 0.00 H new ATOM 0 HA ASN A 249 -10.905 -5.338 -1.519 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.456 -5.637 -3.158 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.664 -6.964 -2.332 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -13.384 -5.197 0.965 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -11.891 -5.487 0.067 1.00 0.00 H new ATOM 238 N ALA A 250 -10.427 -6.997 -3.588 1.00 0.00 N ATOM 239 CA ALA A 250 -9.847 -7.685 -4.737 1.00 0.00 C ATOM 240 C ALA A 250 -10.801 -7.653 -5.935 1.00 0.00 C ATOM 241 O ALA A 250 -10.451 -8.051 -7.040 1.00 0.00 O ATOM 242 CB ALA A 250 -9.511 -9.119 -4.370 1.00 0.00 C ATOM 0 H ALA A 250 -10.568 -7.591 -2.771 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.931 -7.166 -5.020 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -9.079 -9.624 -5.234 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.794 -9.126 -3.549 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -10.419 -9.638 -4.063 1.00 0.00 H new ATOM 248 N TYR A 251 -12.008 -7.171 -5.695 1.00 0.00 N ATOM 249 CA TYR A 251 -13.001 -7.004 -6.746 1.00 0.00 C ATOM 250 C TYR A 251 -12.973 -5.577 -7.278 1.00 0.00 C ATOM 251 O TYR A 251 -13.710 -5.233 -8.199 1.00 0.00 O ATOM 252 CB TYR A 251 -14.403 -7.322 -6.224 1.00 0.00 C ATOM 253 CG TYR A 251 -14.611 -8.768 -5.842 1.00 0.00 C ATOM 254 CD1 TYR A 251 -14.067 -9.280 -4.676 1.00 0.00 C ATOM 255 CD2 TYR A 251 -15.367 -9.614 -6.642 1.00 0.00 C ATOM 256 CE1 TYR A 251 -14.268 -10.597 -4.312 1.00 0.00 C ATOM 257 CE2 TYR A 251 -15.571 -10.932 -6.289 1.00 0.00 C ATOM 258 CZ TYR A 251 -15.021 -11.419 -5.124 1.00 0.00 C ATOM 259 OH TYR A 251 -15.235 -12.731 -4.763 1.00 0.00 O ATOM 0 H TYR A 251 -12.328 -6.885 -4.770 1.00 0.00 H new ATOM 0 HA TYR A 251 -12.757 -7.697 -7.551 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -14.605 -6.696 -5.355 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -15.132 -7.052 -6.988 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -13.475 -8.638 -4.040 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -15.802 -9.235 -7.555 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -13.839 -10.980 -3.398 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -16.159 -11.579 -6.923 1.00 0.00 H new ATOM 0 HH TYR A 251 -15.786 -13.172 -5.443 1.00 0.00 H new ATOM 269 N ASP A 252 -12.121 -4.743 -6.690 1.00 0.00 N ATOM 270 CA ASP A 252 -12.033 -3.335 -7.080 1.00 0.00 C ATOM 271 C ASP A 252 -10.768 -3.121 -7.892 1.00 0.00 C ATOM 272 O ASP A 252 -9.865 -2.399 -7.472 1.00 0.00 O ATOM 273 CB ASP A 252 -12.031 -2.418 -5.846 1.00 0.00 C ATOM 274 CG ASP A 252 -12.196 -0.953 -6.212 1.00 0.00 C ATOM 275 OD1 ASP A 252 -12.795 -0.665 -7.267 1.00 0.00 O ATOM 276 OD2 ASP A 252 -11.747 -0.085 -5.435 1.00 0.00 O ATOM 0 H ASP A 252 -11.482 -5.014 -5.943 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.906 -3.082 -7.682 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -12.837 -2.715 -5.175 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -11.097 -2.550 -5.300 1.00 0.00 H new ATOM 281 N LYS A 253 -10.707 -3.769 -9.053 1.00 0.00 N ATOM 282 CA LYS A 253 -9.477 -3.839 -9.838 1.00 0.00 C ATOM 283 C LYS A 253 -8.374 -4.447 -8.977 1.00 0.00 C ATOM 284 O LYS A 253 -7.196 -4.131 -9.134 1.00 0.00 O ATOM 285 CB LYS A 253 -9.051 -2.454 -10.360 1.00 0.00 C ATOM 286 CG LYS A 253 -10.024 -1.826 -11.354 1.00 0.00 C ATOM 287 CD LYS A 253 -11.195 -1.131 -10.664 1.00 0.00 C ATOM 288 CE LYS A 253 -10.746 0.102 -9.892 1.00 0.00 C ATOM 289 NZ LYS A 253 -11.891 0.826 -9.280 1.00 0.00 N ATOM 0 H LYS A 253 -11.499 -4.255 -9.473 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.657 -4.467 -10.711 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -8.933 -1.780 -9.511 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -8.074 -2.543 -10.834 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -9.491 -1.105 -11.973 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -10.406 -2.598 -12.021 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -11.937 -0.843 -11.409 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -11.682 -1.829 -9.983 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -10.046 -0.195 -9.111 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -10.210 0.774 -10.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -11.662 1.838 -9.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -12.736 0.706 -9.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -12.078 0.442 -8.332 1.00 0.00 H new ATOM 303 N THR A 254 -8.798 -5.324 -8.067 1.00 0.00 N ATOM 304 CA THR A 254 -7.944 -5.932 -7.056 1.00 0.00 C ATOM 305 C THR A 254 -7.175 -4.874 -6.270 1.00 0.00 C ATOM 306 O THR A 254 -5.946 -4.812 -6.290 1.00 0.00 O ATOM 307 CB THR A 254 -6.980 -6.989 -7.633 1.00 0.00 C ATOM 308 OG1 THR A 254 -6.001 -6.398 -8.502 1.00 0.00 O ATOM 309 CG2 THR A 254 -7.742 -8.060 -8.397 1.00 0.00 C ATOM 0 H THR A 254 -9.768 -5.636 -8.014 1.00 0.00 H new ATOM 0 HA THR A 254 -8.613 -6.457 -6.374 1.00 0.00 H new ATOM 0 HB THR A 254 -6.466 -7.442 -6.785 1.00 0.00 H new ATOM 0 HG1 THR A 254 -6.138 -5.428 -8.538 1.00 0.00 H new ATOM 0 HG21 THR A 254 -7.040 -8.793 -8.794 1.00 0.00 H new ATOM 0 HG22 THR A 254 -8.444 -8.556 -7.726 1.00 0.00 H new ATOM 0 HG23 THR A 254 -8.290 -7.600 -9.220 1.00 0.00 H new ATOM 317 N ALA A 255 -7.917 -4.039 -5.572 1.00 0.00 N ATOM 318 CA ALA A 255 -7.331 -2.960 -4.805 1.00 0.00 C ATOM 319 C ALA A 255 -7.163 -3.348 -3.341 1.00 0.00 C ATOM 320 O ALA A 255 -7.917 -4.163 -2.810 1.00 0.00 O ATOM 321 CB ALA A 255 -8.180 -1.716 -4.932 1.00 0.00 C ATOM 0 H ALA A 255 -8.935 -4.088 -5.520 1.00 0.00 H new ATOM 0 HA ALA A 255 -6.339 -2.755 -5.207 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.732 -0.909 -4.352 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -8.238 -1.421 -5.980 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -9.183 -1.920 -4.556 1.00 0.00 H new ATOM 327 N LEU A 256 -6.157 -2.759 -2.710 1.00 0.00 N ATOM 328 CA LEU A 256 -5.842 -3.031 -1.316 1.00 0.00 C ATOM 329 C LEU A 256 -6.881 -2.346 -0.431 1.00 0.00 C ATOM 330 O LEU A 256 -7.168 -1.178 -0.623 1.00 0.00 O ATOM 331 CB LEU A 256 -4.426 -2.490 -1.008 1.00 0.00 C ATOM 332 CG LEU A 256 -3.678 -3.116 0.181 1.00 0.00 C ATOM 333 CD1 LEU A 256 -4.503 -3.034 1.424 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.368 -4.562 -0.077 1.00 0.00 C ATOM 0 H LEU A 256 -5.537 -2.079 -3.150 1.00 0.00 H new ATOM 0 HA LEU A 256 -5.862 -4.103 -1.121 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -3.813 -2.621 -1.900 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.505 -1.417 -0.830 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.751 -2.557 0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -3.956 -3.482 2.254 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -4.715 -1.989 1.651 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -5.440 -3.571 1.275 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.839 -4.979 0.780 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -4.297 -5.111 -0.233 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -2.743 -4.647 -0.966 1.00 0.00 H new ATOM 346 N ALA A 257 -7.441 -3.072 0.521 1.00 0.00 N ATOM 347 CA ALA A 257 -8.365 -2.493 1.479 1.00 0.00 C ATOM 348 C ALA A 257 -7.603 -2.003 2.689 1.00 0.00 C ATOM 349 O ALA A 257 -7.155 -2.793 3.519 1.00 0.00 O ATOM 350 CB ALA A 257 -9.421 -3.498 1.890 1.00 0.00 C ATOM 0 H ALA A 257 -7.270 -4.069 0.651 1.00 0.00 H new ATOM 0 HA ALA A 257 -8.871 -1.650 1.009 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.100 -3.039 2.608 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -9.982 -3.816 1.011 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -8.941 -4.364 2.347 1.00 0.00 H new ATOM 356 N LEU A 258 -7.443 -0.700 2.769 1.00 0.00 N ATOM 357 CA LEU A 258 -6.637 -0.095 3.829 1.00 0.00 C ATOM 358 C LEU A 258 -7.102 1.323 4.104 1.00 0.00 C ATOM 359 O LEU A 258 -7.821 1.907 3.312 1.00 0.00 O ATOM 360 CB LEU A 258 -5.129 -0.143 3.495 1.00 0.00 C ATOM 361 CG LEU A 258 -4.646 0.651 2.267 1.00 0.00 C ATOM 362 CD1 LEU A 258 -3.184 0.378 1.994 1.00 0.00 C ATOM 363 CD2 LEU A 258 -5.427 0.298 1.026 1.00 0.00 C ATOM 0 H LEU A 258 -7.856 -0.032 2.118 1.00 0.00 H new ATOM 0 HA LEU A 258 -6.779 -0.681 4.737 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -4.580 0.217 4.365 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -4.850 -1.187 3.352 1.00 0.00 H new ATOM 0 HG LEU A 258 -4.799 1.705 2.500 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -2.864 0.949 1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -2.591 0.674 2.859 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -3.042 -0.686 1.803 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -5.054 0.881 0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -5.310 -0.764 0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -6.482 0.523 1.184 1.00 0.00 H new ATOM 375 N GLU A 259 -6.691 1.872 5.224 1.00 0.00 N ATOM 376 CA GLU A 259 -7.308 3.072 5.742 1.00 0.00 C ATOM 377 C GLU A 259 -6.265 4.002 6.375 1.00 0.00 C ATOM 378 O GLU A 259 -5.097 3.646 6.485 1.00 0.00 O ATOM 379 CB GLU A 259 -8.365 2.633 6.761 1.00 0.00 C ATOM 380 CG GLU A 259 -9.034 3.761 7.504 1.00 0.00 C ATOM 381 CD GLU A 259 -10.134 3.282 8.424 1.00 0.00 C ATOM 382 OE1 GLU A 259 -11.102 2.672 7.931 1.00 0.00 O ATOM 383 OE2 GLU A 259 -10.029 3.512 9.645 1.00 0.00 O ATOM 0 H GLU A 259 -5.930 1.506 5.795 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.774 3.642 4.938 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.130 2.054 6.244 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -7.896 1.967 7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -8.287 4.300 8.087 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -9.449 4.468 6.786 1.00 0.00 H new ATOM 390 N VAL A 260 -6.700 5.190 6.789 1.00 0.00 N ATOM 391 CA VAL A 260 -5.827 6.172 7.417 1.00 0.00 C ATOM 392 C VAL A 260 -5.133 5.617 8.663 1.00 0.00 C ATOM 393 O VAL A 260 -5.779 5.221 9.634 1.00 0.00 O ATOM 394 CB VAL A 260 -6.616 7.435 7.813 1.00 0.00 C ATOM 395 CG1 VAL A 260 -5.719 8.432 8.530 1.00 0.00 C ATOM 396 CG2 VAL A 260 -7.262 8.069 6.591 1.00 0.00 C ATOM 0 H VAL A 260 -7.669 5.497 6.697 1.00 0.00 H new ATOM 0 HA VAL A 260 -5.067 6.423 6.678 1.00 0.00 H new ATOM 0 HB VAL A 260 -7.407 7.139 8.502 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -6.299 9.315 8.799 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -5.315 7.974 9.433 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -4.900 8.723 7.873 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -7.814 8.959 6.892 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -6.490 8.346 5.874 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -7.946 7.356 6.130 1.00 0.00 H new ATOM 406 N GLY A 261 -3.815 5.568 8.591 1.00 0.00 N ATOM 407 CA GLY A 261 -2.988 5.265 9.736 1.00 0.00 C ATOM 408 C GLY A 261 -2.552 3.824 9.767 1.00 0.00 C ATOM 409 O GLY A 261 -1.813 3.411 10.663 1.00 0.00 O ATOM 0 H GLY A 261 -3.291 5.738 7.733 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.108 5.907 9.724 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.538 5.495 10.649 1.00 0.00 H new ATOM 413 N GLU A 262 -3.009 3.050 8.796 1.00 0.00 N ATOM 414 CA GLU A 262 -2.701 1.627 8.780 1.00 0.00 C ATOM 415 C GLU A 262 -1.346 1.387 8.133 1.00 0.00 C ATOM 416 O GLU A 262 -0.702 2.318 7.646 1.00 0.00 O ATOM 417 CB GLU A 262 -3.789 0.838 8.049 1.00 0.00 C ATOM 418 CG GLU A 262 -5.178 1.071 8.609 1.00 0.00 C ATOM 419 CD GLU A 262 -6.146 -0.030 8.217 1.00 0.00 C ATOM 420 OE1 GLU A 262 -6.464 -0.147 7.021 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.590 -0.783 9.107 1.00 0.00 O ATOM 0 H GLU A 262 -3.585 3.375 8.020 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.664 1.276 9.811 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.780 1.112 6.994 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.556 -0.225 8.105 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -5.124 1.135 9.696 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.556 2.029 8.252 1.00 0.00 H new ATOM 428 N LEU A 263 -0.911 0.144 8.132 1.00 0.00 N ATOM 429 CA LEU A 263 0.366 -0.201 7.544 1.00 0.00 C ATOM 430 C LEU A 263 0.219 -1.379 6.598 1.00 0.00 C ATOM 431 O LEU A 263 -0.690 -2.201 6.746 1.00 0.00 O ATOM 432 CB LEU A 263 1.391 -0.538 8.623 1.00 0.00 C ATOM 433 CG LEU A 263 2.763 -0.926 8.077 1.00 0.00 C ATOM 434 CD1 LEU A 263 3.534 0.308 7.642 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.554 -1.721 9.087 1.00 0.00 C ATOM 0 H LEU A 263 -1.422 -0.643 8.531 1.00 0.00 H new ATOM 0 HA LEU A 263 0.717 0.666 6.984 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.504 0.322 9.283 1.00 0.00 H new ATOM 0 HB3 LEU A 263 1.008 -1.358 9.230 1.00 0.00 H new ATOM 0 HG LEU A 263 2.606 -1.562 7.205 1.00 0.00 H new ATOM 0 HD11 LEU A 263 4.509 0.011 7.256 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.978 0.828 6.862 1.00 0.00 H new ATOM 0 HD13 LEU A 263 3.669 0.972 8.496 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.525 -1.981 8.666 1.00 0.00 H new ATOM 0 HD22 LEU A 263 3.697 -1.125 9.988 1.00 0.00 H new ATOM 0 HD23 LEU A 263 3.012 -2.633 9.338 1.00 0.00 H new ATOM 447 N VAL A 264 1.130 -1.462 5.640 1.00 0.00 N ATOM 448 CA VAL A 264 1.109 -2.513 4.636 1.00 0.00 C ATOM 449 C VAL A 264 2.531 -2.898 4.265 1.00 0.00 C ATOM 450 O VAL A 264 3.475 -2.142 4.498 1.00 0.00 O ATOM 451 CB VAL A 264 0.351 -2.103 3.344 1.00 0.00 C ATOM 452 CG1 VAL A 264 -1.060 -1.637 3.652 1.00 0.00 C ATOM 453 CG2 VAL A 264 1.107 -1.035 2.575 1.00 0.00 C ATOM 0 H VAL A 264 1.903 -0.804 5.537 1.00 0.00 H new ATOM 0 HA VAL A 264 0.578 -3.356 5.079 1.00 0.00 H new ATOM 0 HB VAL A 264 0.284 -2.991 2.716 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -1.561 -1.358 2.725 1.00 0.00 H new ATOM 0 HG12 VAL A 264 -1.612 -2.443 4.135 1.00 0.00 H new ATOM 0 HG13 VAL A 264 -1.021 -0.775 4.318 1.00 0.00 H new ATOM 0 HG21 VAL A 264 0.550 -0.770 1.676 1.00 0.00 H new ATOM 0 HG22 VAL A 264 1.226 -0.151 3.202 1.00 0.00 H new ATOM 0 HG23 VAL A 264 2.089 -1.415 2.294 1.00 0.00 H new ATOM 463 N LYS A 265 2.673 -4.070 3.694 1.00 0.00 N ATOM 464 CA LYS A 265 3.951 -4.558 3.231 1.00 0.00 C ATOM 465 C LYS A 265 3.879 -4.762 1.726 1.00 0.00 C ATOM 466 O LYS A 265 3.363 -5.773 1.255 1.00 0.00 O ATOM 467 CB LYS A 265 4.276 -5.875 3.931 1.00 0.00 C ATOM 468 CG LYS A 265 5.657 -6.415 3.623 1.00 0.00 C ATOM 469 CD LYS A 265 5.904 -7.718 4.367 1.00 0.00 C ATOM 470 CE LYS A 265 7.339 -8.195 4.222 1.00 0.00 C ATOM 471 NZ LYS A 265 8.299 -7.275 4.884 1.00 0.00 N ATOM 0 H LYS A 265 1.900 -4.717 3.536 1.00 0.00 H new ATOM 0 HA LYS A 265 4.737 -3.838 3.461 1.00 0.00 H new ATOM 0 HB2 LYS A 265 4.185 -5.734 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.534 -6.620 3.643 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.758 -6.579 2.550 1.00 0.00 H new ATOM 0 HG3 LYS A 265 6.411 -5.681 3.906 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.673 -7.581 5.423 1.00 0.00 H new ATOM 0 HD3 LYS A 265 5.228 -8.485 3.989 1.00 0.00 H new ATOM 0 HE2 LYS A 265 7.435 -9.192 4.653 1.00 0.00 H new ATOM 0 HE3 LYS A 265 7.588 -8.280 3.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 9.180 -7.785 5.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 8.504 -6.475 4.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 7.885 -6.920 5.770 1.00 0.00 H new ATOM 485 N VAL A 266 4.363 -3.796 0.966 1.00 0.00 N ATOM 486 CA VAL A 266 4.256 -3.875 -0.477 1.00 0.00 C ATOM 487 C VAL A 266 5.343 -4.777 -1.039 1.00 0.00 C ATOM 488 O VAL A 266 6.542 -4.562 -0.815 1.00 0.00 O ATOM 489 CB VAL A 266 4.289 -2.482 -1.138 1.00 0.00 C ATOM 490 CG1 VAL A 266 3.322 -1.548 -0.441 1.00 0.00 C ATOM 491 CG2 VAL A 266 5.682 -1.889 -1.165 1.00 0.00 C ATOM 0 H VAL A 266 4.828 -2.959 1.319 1.00 0.00 H new ATOM 0 HA VAL A 266 3.286 -4.311 -0.714 1.00 0.00 H new ATOM 0 HB VAL A 266 3.979 -2.607 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 266 3.355 -0.568 -0.917 1.00 0.00 H new ATOM 0 HG12 VAL A 266 2.312 -1.952 -0.511 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.602 -1.451 0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 266 5.651 -0.909 -1.640 1.00 0.00 H new ATOM 0 HG22 VAL A 266 6.054 -1.786 -0.145 1.00 0.00 H new ATOM 0 HG23 VAL A 266 6.346 -2.545 -1.729 1.00 0.00 H new ATOM 501 N THR A 267 4.904 -5.809 -1.736 1.00 0.00 N ATOM 502 CA THR A 267 5.798 -6.831 -2.240 1.00 0.00 C ATOM 503 C THR A 267 6.113 -6.598 -3.705 1.00 0.00 C ATOM 504 O THR A 267 6.933 -7.300 -4.296 1.00 0.00 O ATOM 505 CB THR A 267 5.178 -8.225 -2.043 1.00 0.00 C ATOM 506 OG1 THR A 267 3.861 -8.259 -2.612 1.00 0.00 O ATOM 507 CG2 THR A 267 5.092 -8.564 -0.563 1.00 0.00 C ATOM 0 H THR A 267 3.922 -5.961 -1.967 1.00 0.00 H new ATOM 0 HA THR A 267 6.730 -6.777 -1.678 1.00 0.00 H new ATOM 0 HB THR A 267 5.813 -8.958 -2.541 1.00 0.00 H new ATOM 0 HG1 THR A 267 3.473 -9.150 -2.485 1.00 0.00 H new ATOM 0 HG21 THR A 267 4.651 -9.553 -0.441 1.00 0.00 H new ATOM 0 HG22 THR A 267 6.092 -8.557 -0.129 1.00 0.00 H new ATOM 0 HG23 THR A 267 4.471 -7.825 -0.056 1.00 0.00 H new ATOM 515 N LYS A 268 5.464 -5.604 -4.294 1.00 0.00 N ATOM 516 CA LYS A 268 5.787 -5.220 -5.652 1.00 0.00 C ATOM 517 C LYS A 268 6.258 -3.783 -5.635 1.00 0.00 C ATOM 518 O LYS A 268 5.457 -2.863 -5.507 1.00 0.00 O ATOM 519 CB LYS A 268 4.576 -5.380 -6.570 1.00 0.00 C ATOM 520 CG LYS A 268 4.946 -5.510 -8.037 1.00 0.00 C ATOM 521 CD LYS A 268 5.781 -6.758 -8.281 1.00 0.00 C ATOM 522 CE LYS A 268 5.019 -8.018 -7.904 1.00 0.00 C ATOM 523 NZ LYS A 268 3.866 -8.269 -8.809 1.00 0.00 N ATOM 0 H LYS A 268 4.722 -5.058 -3.857 1.00 0.00 H new ATOM 0 HA LYS A 268 6.573 -5.868 -6.041 1.00 0.00 H new ATOM 0 HB2 LYS A 268 4.012 -6.262 -6.265 1.00 0.00 H new ATOM 0 HB3 LYS A 268 3.917 -4.521 -6.444 1.00 0.00 H new ATOM 0 HG2 LYS A 268 4.040 -5.550 -8.642 1.00 0.00 H new ATOM 0 HG3 LYS A 268 5.502 -4.628 -8.355 1.00 0.00 H new ATOM 0 HD2 LYS A 268 6.069 -6.806 -9.331 1.00 0.00 H new ATOM 0 HD3 LYS A 268 6.702 -6.701 -7.701 1.00 0.00 H new ATOM 0 HE2 LYS A 268 5.695 -8.872 -7.934 1.00 0.00 H new ATOM 0 HE3 LYS A 268 4.661 -7.931 -6.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 3.448 -9.196 -8.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 3.151 -7.526 -8.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 4.192 -8.261 -9.797 1.00 0.00 H new ATOM 537 N ILE A 269 7.555 -3.596 -5.786 1.00 0.00 N ATOM 538 CA ILE A 269 8.170 -2.315 -5.509 1.00 0.00 C ATOM 539 C ILE A 269 8.747 -1.687 -6.766 1.00 0.00 C ATOM 540 O ILE A 269 9.170 -2.384 -7.686 1.00 0.00 O ATOM 541 CB ILE A 269 9.253 -2.395 -4.408 1.00 0.00 C ATOM 542 CG1 ILE A 269 10.302 -3.465 -4.683 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.594 -2.671 -3.080 1.00 0.00 C ATOM 544 CD1 ILE A 269 9.780 -4.867 -4.494 1.00 0.00 C ATOM 0 H ILE A 269 8.204 -4.318 -6.100 1.00 0.00 H new ATOM 0 HA ILE A 269 7.370 -1.676 -5.134 1.00 0.00 H new ATOM 0 HB ILE A 269 9.770 -1.435 -4.394 1.00 0.00 H new ATOM 0 HG12 ILE A 269 10.667 -3.354 -5.704 1.00 0.00 H new ATOM 0 HG13 ILE A 269 11.154 -3.309 -4.021 1.00 0.00 H new ATOM 0 HG21 ILE A 269 9.355 -2.728 -2.301 1.00 0.00 H new ATOM 0 HG22 ILE A 269 7.895 -1.868 -2.847 1.00 0.00 H new ATOM 0 HG23 ILE A 269 8.055 -3.617 -3.131 1.00 0.00 H new ATOM 0 HD11 ILE A 269 10.575 -5.583 -4.705 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.441 -4.994 -3.466 1.00 0.00 H new ATOM 0 HD13 ILE A 269 8.946 -5.040 -5.175 1.00 0.00 H new ATOM 556 N ASN A 270 8.747 -0.365 -6.791 1.00 0.00 N ATOM 557 CA ASN A 270 9.151 0.390 -7.967 1.00 0.00 C ATOM 558 C ASN A 270 9.884 1.657 -7.542 1.00 0.00 C ATOM 559 O ASN A 270 10.218 1.815 -6.370 1.00 0.00 O ATOM 560 CB ASN A 270 7.925 0.729 -8.821 1.00 0.00 C ATOM 561 CG ASN A 270 6.990 1.715 -8.148 1.00 0.00 C ATOM 562 OD1 ASN A 270 6.967 2.894 -8.482 1.00 0.00 O ATOM 563 ND2 ASN A 270 6.242 1.253 -7.167 1.00 0.00 N ATOM 0 H ASN A 270 8.468 0.215 -6.000 1.00 0.00 H new ATOM 0 HA ASN A 270 9.829 -0.216 -8.569 1.00 0.00 H new ATOM 0 HB2 ASN A 270 8.256 1.142 -9.774 1.00 0.00 H new ATOM 0 HB3 ASN A 270 7.379 -0.188 -9.043 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.620 1.883 -6.660 1.00 0.00 H new ATOM 0 HD22 ASN A 270 6.285 0.266 -6.914 1.00 0.00 H new ATOM 570 N VAL A 271 10.115 2.564 -8.482 1.00 0.00 N ATOM 571 CA VAL A 271 10.856 3.785 -8.188 1.00 0.00 C ATOM 572 C VAL A 271 9.935 4.992 -7.997 1.00 0.00 C ATOM 573 O VAL A 271 10.318 5.973 -7.358 1.00 0.00 O ATOM 574 CB VAL A 271 11.884 4.094 -9.296 1.00 0.00 C ATOM 575 CG1 VAL A 271 12.948 3.011 -9.346 1.00 0.00 C ATOM 576 CG2 VAL A 271 11.201 4.235 -10.648 1.00 0.00 C ATOM 0 H VAL A 271 9.802 2.479 -9.449 1.00 0.00 H new ATOM 0 HA VAL A 271 11.380 3.606 -7.249 1.00 0.00 H new ATOM 0 HB VAL A 271 12.364 5.044 -9.061 1.00 0.00 H new ATOM 0 HG11 VAL A 271 13.666 3.243 -10.132 1.00 0.00 H new ATOM 0 HG12 VAL A 271 13.463 2.963 -8.387 1.00 0.00 H new ATOM 0 HG13 VAL A 271 12.479 2.049 -9.555 1.00 0.00 H new ATOM 0 HG21 VAL A 271 11.948 4.453 -11.412 1.00 0.00 H new ATOM 0 HG22 VAL A 271 10.689 3.305 -10.896 1.00 0.00 H new ATOM 0 HG23 VAL A 271 10.477 5.048 -10.607 1.00 0.00 H new ATOM 586 N SER A 272 8.722 4.915 -8.529 1.00 0.00 N ATOM 587 CA SER A 272 7.807 6.049 -8.494 1.00 0.00 C ATOM 588 C SER A 272 7.094 6.141 -7.150 1.00 0.00 C ATOM 589 O SER A 272 7.014 7.213 -6.552 1.00 0.00 O ATOM 590 CB SER A 272 6.768 5.912 -9.608 1.00 0.00 C ATOM 591 OG SER A 272 7.361 5.413 -10.798 1.00 0.00 O ATOM 0 H SER A 272 8.350 4.083 -8.988 1.00 0.00 H new ATOM 0 HA SER A 272 8.391 6.957 -8.640 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.971 5.242 -9.286 1.00 0.00 H new ATOM 0 HB3 SER A 272 6.310 6.881 -9.804 1.00 0.00 H new ATOM 0 HG SER A 272 6.677 5.332 -11.495 1.00 0.00 H new ATOM 597 N GLY A 273 6.606 5.008 -6.659 1.00 0.00 N ATOM 598 CA GLY A 273 5.870 5.006 -5.413 1.00 0.00 C ATOM 599 C GLY A 273 4.503 4.362 -5.543 1.00 0.00 C ATOM 600 O GLY A 273 3.814 4.158 -4.548 1.00 0.00 O ATOM 0 H GLY A 273 6.707 4.094 -7.101 1.00 0.00 H new ATOM 0 HA2 GLY A 273 6.447 4.475 -4.656 1.00 0.00 H new ATOM 0 HA3 GLY A 273 5.752 6.032 -5.063 1.00 0.00 H new ATOM 604 N GLN A 274 4.090 4.051 -6.764 1.00 0.00 N ATOM 605 CA GLN A 274 2.853 3.306 -6.958 1.00 0.00 C ATOM 606 C GLN A 274 3.168 1.825 -6.971 1.00 0.00 C ATOM 607 O GLN A 274 3.699 1.308 -7.950 1.00 0.00 O ATOM 608 CB GLN A 274 2.145 3.705 -8.262 1.00 0.00 C ATOM 609 CG GLN A 274 0.775 3.051 -8.436 1.00 0.00 C ATOM 610 CD GLN A 274 0.801 1.745 -9.227 1.00 0.00 C ATOM 611 OE1 GLN A 274 0.630 1.748 -10.447 1.00 0.00 O ATOM 612 NE2 GLN A 274 1.038 0.625 -8.554 1.00 0.00 N ATOM 0 H GLN A 274 4.583 4.298 -7.622 1.00 0.00 H new ATOM 0 HA GLN A 274 2.176 3.541 -6.136 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.027 4.788 -8.285 1.00 0.00 H new ATOM 0 HB3 GLN A 274 2.778 3.435 -9.107 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.349 2.858 -7.451 1.00 0.00 H new ATOM 0 HG3 GLN A 274 0.110 3.754 -8.938 1.00 0.00 H new ATOM 0 HE21 GLN A 274 1.175 0.656 -7.544 1.00 0.00 H new ATOM 0 HE22 GLN A 274 1.083 -0.267 -9.047 1.00 0.00 H new ATOM 621 N TRP A 275 2.844 1.140 -5.892 1.00 0.00 N ATOM 622 CA TRP A 275 3.198 -0.263 -5.779 1.00 0.00 C ATOM 623 C TRP A 275 1.973 -1.134 -5.724 1.00 0.00 C ATOM 624 O TRP A 275 0.839 -0.654 -5.645 1.00 0.00 O ATOM 625 CB TRP A 275 4.016 -0.565 -4.524 1.00 0.00 C ATOM 626 CG TRP A 275 4.477 0.611 -3.757 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.744 1.379 -2.917 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.799 1.117 -3.728 1.00 0.00 C ATOM 629 NE1 TRP A 275 4.538 2.356 -2.373 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.808 2.210 -2.858 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.969 0.746 -4.366 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.958 2.939 -2.603 1.00 0.00 C ATOM 633 CZ3 TRP A 275 8.116 1.466 -4.117 1.00 0.00 C ATOM 634 CH2 TRP A 275 8.104 2.553 -3.240 1.00 0.00 C ATOM 0 H TRP A 275 2.343 1.524 -5.091 1.00 0.00 H new ATOM 0 HA TRP A 275 3.793 -0.479 -6.666 1.00 0.00 H new ATOM 0 HB2 TRP A 275 3.416 -1.192 -3.865 1.00 0.00 H new ATOM 0 HB3 TRP A 275 4.888 -1.150 -4.814 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.693 1.243 -2.707 1.00 0.00 H new ATOM 0 HE1 TRP A 275 4.232 3.073 -1.715 1.00 0.00 H new ATOM 0 HE3 TRP A 275 6.983 -0.093 -5.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 6.949 3.781 -1.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 9.037 1.186 -4.606 1.00 0.00 H new ATOM 0 HH2 TRP A 275 9.018 3.099 -3.062 1.00 0.00 H new ATOM 645 N GLU A 276 2.227 -2.425 -5.758 1.00 0.00 N ATOM 646 CA GLU A 276 1.228 -3.392 -5.406 1.00 0.00 C ATOM 647 C GLU A 276 1.478 -3.755 -3.952 1.00 0.00 C ATOM 648 O GLU A 276 2.583 -4.175 -3.577 1.00 0.00 O ATOM 649 CB GLU A 276 1.331 -4.608 -6.331 1.00 0.00 C ATOM 650 CG GLU A 276 0.198 -5.608 -6.198 1.00 0.00 C ATOM 651 CD GLU A 276 0.231 -6.647 -7.299 1.00 0.00 C ATOM 652 OE1 GLU A 276 -0.142 -6.315 -8.444 1.00 0.00 O ATOM 653 OE2 GLU A 276 0.646 -7.793 -7.037 1.00 0.00 O ATOM 0 H GLU A 276 3.126 -2.824 -6.029 1.00 0.00 H new ATOM 0 HA GLU A 276 0.217 -3.001 -5.523 1.00 0.00 H new ATOM 0 HB2 GLU A 276 1.369 -4.259 -7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 276 2.273 -5.119 -6.132 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.263 -6.103 -5.229 1.00 0.00 H new ATOM 0 HG3 GLU A 276 -0.756 -5.082 -6.224 1.00 0.00 H new ATOM 660 N GLY A 277 0.452 -3.589 -3.148 1.00 0.00 N ATOM 661 CA GLY A 277 0.610 -3.643 -1.721 1.00 0.00 C ATOM 662 C GLY A 277 -0.017 -4.880 -1.136 1.00 0.00 C ATOM 663 O GLY A 277 -0.990 -5.401 -1.681 1.00 0.00 O ATOM 0 H GLY A 277 -0.502 -3.415 -3.464 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.671 -3.620 -1.472 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.158 -2.759 -1.271 1.00 0.00 H new ATOM 667 N GLU A 278 0.541 -5.370 -0.048 1.00 0.00 N ATOM 668 CA GLU A 278 -0.080 -6.447 0.687 1.00 0.00 C ATOM 669 C GLU A 278 -0.193 -6.042 2.143 1.00 0.00 C ATOM 670 O GLU A 278 0.809 -5.818 2.805 1.00 0.00 O ATOM 671 CB GLU A 278 0.745 -7.731 0.566 1.00 0.00 C ATOM 672 CG GLU A 278 0.036 -8.954 1.120 1.00 0.00 C ATOM 673 CD GLU A 278 0.932 -10.170 1.189 1.00 0.00 C ATOM 674 OE1 GLU A 278 1.397 -10.636 0.128 1.00 0.00 O ATOM 675 OE2 GLU A 278 1.160 -10.676 2.302 1.00 0.00 O ATOM 0 H GLU A 278 1.422 -5.039 0.345 1.00 0.00 H new ATOM 0 HA GLU A 278 -1.070 -6.640 0.274 1.00 0.00 H new ATOM 0 HB2 GLU A 278 0.985 -7.903 -0.483 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.690 -7.598 1.092 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -0.341 -8.729 2.118 1.00 0.00 H new ATOM 0 HG3 GLU A 278 -0.829 -9.181 0.496 1.00 0.00 H new ATOM 682 N CYS A 279 -1.402 -5.946 2.651 1.00 0.00 N ATOM 683 CA CYS A 279 -1.569 -5.575 4.035 1.00 0.00 C ATOM 684 C CYS A 279 -1.865 -6.809 4.850 1.00 0.00 C ATOM 685 O CYS A 279 -3.019 -7.221 4.966 1.00 0.00 O ATOM 686 CB CYS A 279 -2.701 -4.557 4.190 1.00 0.00 C ATOM 687 SG CYS A 279 -2.990 -4.012 5.893 1.00 0.00 S ATOM 0 H CYS A 279 -2.267 -6.116 2.137 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.648 -5.114 4.392 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -2.476 -3.685 3.576 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -3.621 -4.993 3.800 1.00 0.00 H new ATOM 0 HG CYS A 279 -1.966 -3.327 6.309 1.00 0.00 H new ATOM 693 N ASN A 280 -0.799 -7.367 5.420 1.00 0.00 N ATOM 694 CA ASN A 280 -0.873 -8.506 6.328 1.00 0.00 C ATOM 695 C ASN A 280 -1.967 -9.496 5.913 1.00 0.00 C ATOM 696 O ASN A 280 -2.857 -9.829 6.696 1.00 0.00 O ATOM 697 CB ASN A 280 -1.072 -7.983 7.754 1.00 0.00 C ATOM 698 CG ASN A 280 0.093 -7.121 8.184 1.00 0.00 C ATOM 699 OD1 ASN A 280 1.242 -7.388 7.837 1.00 0.00 O ATOM 700 ND2 ASN A 280 -0.193 -6.061 8.914 1.00 0.00 N ATOM 0 H ASN A 280 0.152 -7.035 5.261 1.00 0.00 H new ATOM 0 HA ASN A 280 0.061 -9.067 6.284 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -1.995 -7.406 7.808 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -1.181 -8.822 8.441 1.00 0.00 H new ATOM 0 HD21 ASN A 280 0.551 -5.430 9.210 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -1.159 -5.872 9.183 1.00 0.00 H new ATOM 707 N GLY A 281 -1.886 -9.955 4.664 1.00 0.00 N ATOM 708 CA GLY A 281 -2.876 -10.879 4.137 1.00 0.00 C ATOM 709 C GLY A 281 -3.677 -10.308 2.969 1.00 0.00 C ATOM 710 O GLY A 281 -3.943 -11.016 1.999 1.00 0.00 O ATOM 0 H GLY A 281 -1.149 -9.701 4.007 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -2.375 -11.791 3.813 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -3.562 -11.159 4.936 1.00 0.00 H new ATOM 714 N LYS A 282 -4.055 -9.033 3.047 1.00 0.00 N ATOM 715 CA LYS A 282 -4.829 -8.391 1.979 1.00 0.00 C ATOM 716 C LYS A 282 -3.925 -8.057 0.794 1.00 0.00 C ATOM 717 O LYS A 282 -2.809 -7.597 0.995 1.00 0.00 O ATOM 718 CB LYS A 282 -5.453 -7.096 2.499 1.00 0.00 C ATOM 719 CG LYS A 282 -6.146 -7.240 3.841 1.00 0.00 C ATOM 720 CD LYS A 282 -6.023 -5.960 4.645 1.00 0.00 C ATOM 721 CE LYS A 282 -6.681 -6.081 6.006 1.00 0.00 C ATOM 722 NZ LYS A 282 -6.417 -4.889 6.856 1.00 0.00 N ATOM 0 H LYS A 282 -3.840 -8.423 3.836 1.00 0.00 H new ATOM 0 HA LYS A 282 -5.610 -9.081 1.658 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.674 -6.338 2.583 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -6.174 -6.732 1.767 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.198 -7.481 3.689 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -5.706 -8.068 4.396 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -4.969 -5.711 4.772 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -6.480 -5.139 4.093 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -7.756 -6.206 5.880 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -6.313 -6.975 6.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -6.492 -5.154 7.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -5.460 -4.531 6.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -7.114 -4.148 6.641 1.00 0.00 H new ATOM 736 N ARG A 283 -4.390 -8.270 -0.432 1.00 0.00 N ATOM 737 CA ARG A 283 -3.597 -7.899 -1.604 1.00 0.00 C ATOM 738 C ARG A 283 -4.346 -6.925 -2.507 1.00 0.00 C ATOM 739 O ARG A 283 -5.502 -7.145 -2.867 1.00 0.00 O ATOM 740 CB ARG A 283 -3.175 -9.126 -2.398 1.00 0.00 C ATOM 741 CG ARG A 283 -2.252 -10.042 -1.616 1.00 0.00 C ATOM 742 CD ARG A 283 -1.357 -10.846 -2.533 1.00 0.00 C ATOM 743 NE ARG A 283 -0.253 -11.462 -1.797 1.00 0.00 N ATOM 744 CZ ARG A 283 0.249 -12.672 -2.035 1.00 0.00 C ATOM 745 NH1 ARG A 283 -0.219 -13.427 -3.020 1.00 0.00 N ATOM 746 NH2 ARG A 283 1.241 -13.113 -1.277 1.00 0.00 N ATOM 0 H ARG A 283 -5.296 -8.690 -0.641 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.702 -7.400 -1.233 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -4.063 -9.682 -2.698 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.674 -8.807 -3.312 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -1.639 -9.449 -0.937 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -2.845 -10.719 -1.001 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -1.943 -11.620 -3.028 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -0.959 -10.199 -3.314 1.00 0.00 H new ATOM 0 HE ARG A 283 0.166 -10.921 -1.041 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -0.976 -13.083 -3.611 1.00 0.00 H new ATOM 0 HH12 ARG A 283 0.178 -14.351 -3.187 1.00 0.00 H new ATOM 0 HH21 ARG A 283 1.608 -12.528 -0.526 1.00 0.00 H new ATOM 0 HH22 ARG A 283 1.638 -14.037 -1.444 1.00 0.00 H new ATOM 760 N GLY A 284 -3.658 -5.848 -2.851 1.00 0.00 N ATOM 761 CA GLY A 284 -4.203 -4.816 -3.713 1.00 0.00 C ATOM 762 C GLY A 284 -3.094 -3.977 -4.337 1.00 0.00 C ATOM 763 O GLY A 284 -1.931 -4.326 -4.212 1.00 0.00 O ATOM 0 H GLY A 284 -2.704 -5.666 -2.539 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -4.802 -5.275 -4.500 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -4.870 -4.173 -3.138 1.00 0.00 H new ATOM 767 N HIS A 285 -3.433 -2.877 -5.010 1.00 0.00 N ATOM 768 CA HIS A 285 -2.407 -1.975 -5.561 1.00 0.00 C ATOM 769 C HIS A 285 -2.890 -0.523 -5.553 1.00 0.00 C ATOM 770 O HIS A 285 -4.052 -0.255 -5.855 1.00 0.00 O ATOM 771 CB HIS A 285 -1.986 -2.394 -6.982 1.00 0.00 C ATOM 772 CG HIS A 285 -3.097 -2.425 -7.992 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.207 -1.515 -9.025 1.00 0.00 N ATOM 774 CD2 HIS A 285 -4.139 -3.273 -8.132 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.268 -1.804 -9.752 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.849 -2.866 -9.231 1.00 0.00 N ATOM 0 H HIS A 285 -4.395 -2.587 -5.188 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.531 -2.051 -4.917 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.216 -1.708 -7.333 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.533 -3.384 -6.933 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -4.370 -4.115 -7.496 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -4.603 -1.263 -10.625 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.693 -3.314 -9.589 1.00 0.00 H new ATOM 785 N PHE A 286 -1.986 0.407 -5.211 1.00 0.00 N ATOM 786 CA PHE A 286 -2.331 1.829 -5.054 1.00 0.00 C ATOM 787 C PHE A 286 -1.088 2.726 -5.172 1.00 0.00 C ATOM 788 O PHE A 286 0.044 2.236 -5.147 1.00 0.00 O ATOM 789 CB PHE A 286 -2.995 2.066 -3.696 1.00 0.00 C ATOM 790 CG PHE A 286 -4.468 1.766 -3.659 1.00 0.00 C ATOM 791 CD1 PHE A 286 -5.376 2.593 -4.299 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.936 0.664 -2.978 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.731 2.320 -4.262 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.290 0.385 -2.932 1.00 0.00 C ATOM 795 CZ PHE A 286 -7.188 1.213 -3.577 1.00 0.00 C ATOM 0 H PHE A 286 -1.003 0.198 -5.037 1.00 0.00 H new ATOM 0 HA PHE A 286 -3.024 2.088 -5.855 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.493 1.451 -2.949 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.842 3.106 -3.408 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -5.021 3.462 -4.834 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.238 0.011 -2.475 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -7.429 2.971 -4.767 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.645 -0.480 -2.392 1.00 0.00 H new ATOM 0 HZ PHE A 286 -8.245 0.994 -3.545 1.00 0.00 H new ATOM 805 N PRO A 287 -1.289 4.065 -5.278 1.00 0.00 N ATOM 806 CA PRO A 287 -0.212 5.031 -5.457 1.00 0.00 C ATOM 807 C PRO A 287 0.263 5.643 -4.134 1.00 0.00 C ATOM 808 O PRO A 287 -0.391 5.487 -3.091 1.00 0.00 O ATOM 809 CB PRO A 287 -0.873 6.101 -6.335 1.00 0.00 C ATOM 810 CG PRO A 287 -2.359 5.906 -6.206 1.00 0.00 C ATOM 811 CD PRO A 287 -2.582 4.763 -5.254 1.00 0.00 C ATOM 0 HA PRO A 287 0.682 4.580 -5.887 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.584 7.101 -6.011 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.558 5.999 -7.373 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.834 6.814 -5.834 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -2.803 5.689 -7.177 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -2.835 5.113 -4.253 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.397 4.117 -5.581 1.00 0.00 H new ATOM 819 N PHE A 288 1.392 6.353 -4.187 1.00 0.00 N ATOM 820 CA PHE A 288 2.019 6.893 -2.979 1.00 0.00 C ATOM 821 C PHE A 288 1.465 8.260 -2.602 1.00 0.00 C ATOM 822 O PHE A 288 1.712 8.743 -1.497 1.00 0.00 O ATOM 823 CB PHE A 288 3.539 6.984 -3.123 1.00 0.00 C ATOM 824 CG PHE A 288 3.992 8.005 -4.123 1.00 0.00 C ATOM 825 CD1 PHE A 288 3.922 7.714 -5.460 1.00 0.00 C ATOM 826 CD2 PHE A 288 4.483 9.239 -3.729 1.00 0.00 C ATOM 827 CE1 PHE A 288 4.329 8.627 -6.413 1.00 0.00 C ATOM 828 CE2 PHE A 288 4.895 10.163 -4.671 1.00 0.00 C ATOM 829 CZ PHE A 288 4.818 9.857 -6.015 1.00 0.00 C ATOM 0 H PHE A 288 1.890 6.567 -5.051 1.00 0.00 H new ATOM 0 HA PHE A 288 1.779 6.192 -2.179 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.973 7.223 -2.152 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.926 6.007 -3.414 1.00 0.00 H new ATOM 0 HD1 PHE A 288 3.542 6.753 -5.774 1.00 0.00 H new ATOM 0 HD2 PHE A 288 4.544 9.481 -2.678 1.00 0.00 H new ATOM 0 HE1 PHE A 288 4.266 8.381 -7.463 1.00 0.00 H new ATOM 0 HE2 PHE A 288 5.277 11.123 -4.356 1.00 0.00 H new ATOM 0 HZ PHE A 288 5.139 10.577 -6.753 1.00 0.00 H new ATOM 839 N THR A 289 0.716 8.873 -3.514 1.00 0.00 N ATOM 840 CA THR A 289 0.147 10.199 -3.289 1.00 0.00 C ATOM 841 C THR A 289 -0.583 10.288 -1.943 1.00 0.00 C ATOM 842 O THR A 289 -0.572 11.332 -1.291 1.00 0.00 O ATOM 843 CB THR A 289 -0.810 10.595 -4.436 1.00 0.00 C ATOM 844 OG1 THR A 289 -1.431 11.858 -4.164 1.00 0.00 O ATOM 845 CG2 THR A 289 -1.876 9.529 -4.647 1.00 0.00 C ATOM 0 H THR A 289 0.487 8.469 -4.422 1.00 0.00 H new ATOM 0 HA THR A 289 0.981 10.901 -3.267 1.00 0.00 H new ATOM 0 HB THR A 289 -0.219 10.682 -5.348 1.00 0.00 H new ATOM 0 HG1 THR A 289 -2.032 12.093 -4.902 1.00 0.00 H new ATOM 0 HG21 THR A 289 -2.537 9.831 -5.459 1.00 0.00 H new ATOM 0 HG22 THR A 289 -1.399 8.582 -4.900 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.457 9.409 -3.732 1.00 0.00 H new ATOM 853 N HIS A 290 -1.203 9.194 -1.516 1.00 0.00 N ATOM 854 CA HIS A 290 -1.872 9.174 -0.225 1.00 0.00 C ATOM 855 C HIS A 290 -1.382 8.024 0.645 1.00 0.00 C ATOM 856 O HIS A 290 -2.150 7.161 1.073 1.00 0.00 O ATOM 857 CB HIS A 290 -3.403 9.197 -0.379 1.00 0.00 C ATOM 858 CG HIS A 290 -4.008 8.247 -1.373 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.951 8.657 -2.288 1.00 0.00 N ATOM 860 CD2 HIS A 290 -3.873 6.912 -1.555 1.00 0.00 C ATOM 861 CE1 HIS A 290 -5.375 7.623 -2.980 1.00 0.00 C ATOM 862 NE2 HIS A 290 -4.738 6.547 -2.562 1.00 0.00 N ATOM 0 H HIS A 290 -1.255 8.320 -2.039 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.603 10.090 0.301 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.844 8.991 0.596 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.699 10.209 -0.655 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -3.210 6.255 -1.011 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -6.121 7.650 -3.761 1.00 0.00 H new ATOM 0 HE2 HIS A 290 -4.865 5.602 -2.924 1.00 0.00 H new ATOM 871 N VAL A 291 -0.069 8.021 0.862 1.00 0.00 N ATOM 872 CA VAL A 291 0.585 7.174 1.854 1.00 0.00 C ATOM 873 C VAL A 291 1.890 7.816 2.290 1.00 0.00 C ATOM 874 O VAL A 291 2.332 8.810 1.718 1.00 0.00 O ATOM 875 CB VAL A 291 0.919 5.744 1.360 1.00 0.00 C ATOM 876 CG1 VAL A 291 -0.254 4.817 1.484 1.00 0.00 C ATOM 877 CG2 VAL A 291 1.412 5.769 -0.067 1.00 0.00 C ATOM 0 H VAL A 291 0.579 8.616 0.346 1.00 0.00 H new ATOM 0 HA VAL A 291 -0.133 7.082 2.669 1.00 0.00 H new ATOM 0 HB VAL A 291 1.713 5.364 2.003 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.026 3.826 1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 291 -0.558 4.753 2.529 1.00 0.00 H new ATOM 0 HG13 VAL A 291 -1.083 5.197 0.887 1.00 0.00 H new ATOM 0 HG21 VAL A 291 1.640 4.754 -0.391 1.00 0.00 H new ATOM 0 HG22 VAL A 291 0.641 6.191 -0.711 1.00 0.00 H new ATOM 0 HG23 VAL A 291 2.312 6.381 -0.130 1.00 0.00 H new ATOM 887 N ARG A 292 2.478 7.242 3.314 1.00 0.00 N ATOM 888 CA ARG A 292 3.806 7.609 3.770 1.00 0.00 C ATOM 889 C ARG A 292 4.602 6.331 3.908 1.00 0.00 C ATOM 890 O ARG A 292 4.365 5.548 4.818 1.00 0.00 O ATOM 891 CB ARG A 292 3.745 8.330 5.121 1.00 0.00 C ATOM 892 CG ARG A 292 2.935 9.614 5.100 1.00 0.00 C ATOM 893 CD ARG A 292 3.500 10.615 4.109 1.00 0.00 C ATOM 894 NE ARG A 292 4.861 11.026 4.444 1.00 0.00 N ATOM 895 CZ ARG A 292 5.621 11.790 3.658 1.00 0.00 C ATOM 896 NH1 ARG A 292 5.154 12.222 2.491 1.00 0.00 N ATOM 897 NH2 ARG A 292 6.850 12.118 4.037 1.00 0.00 N ATOM 0 H ARG A 292 2.046 6.498 3.862 1.00 0.00 H new ATOM 0 HA ARG A 292 4.270 8.289 3.056 1.00 0.00 H new ATOM 0 HB2 ARG A 292 3.318 7.655 5.862 1.00 0.00 H new ATOM 0 HB3 ARG A 292 4.760 8.558 5.446 1.00 0.00 H new ATOM 0 HG2 ARG A 292 1.901 9.388 4.840 1.00 0.00 H new ATOM 0 HG3 ARG A 292 2.924 10.055 6.097 1.00 0.00 H new ATOM 0 HD2 ARG A 292 3.491 10.178 3.111 1.00 0.00 H new ATOM 0 HD3 ARG A 292 2.856 11.494 4.078 1.00 0.00 H new ATOM 0 HE ARG A 292 5.253 10.710 5.331 1.00 0.00 H new ATOM 0 HH11 ARG A 292 4.211 11.969 2.194 1.00 0.00 H new ATOM 0 HH12 ARG A 292 5.738 12.806 1.893 1.00 0.00 H new ATOM 0 HH21 ARG A 292 7.214 11.786 4.930 1.00 0.00 H new ATOM 0 HH22 ARG A 292 7.430 12.702 3.435 1.00 0.00 H new ATOM 911 N LEU A 293 5.539 6.097 3.020 1.00 0.00 N ATOM 912 CA LEU A 293 6.160 4.797 2.972 1.00 0.00 C ATOM 913 C LEU A 293 7.445 4.750 3.774 1.00 0.00 C ATOM 914 O LEU A 293 8.343 5.578 3.604 1.00 0.00 O ATOM 915 CB LEU A 293 6.404 4.277 1.544 1.00 0.00 C ATOM 916 CG LEU A 293 6.136 5.197 0.340 1.00 0.00 C ATOM 917 CD1 LEU A 293 4.673 5.569 0.235 1.00 0.00 C ATOM 918 CD2 LEU A 293 7.007 6.441 0.355 1.00 0.00 C ATOM 0 H LEU A 293 5.881 6.772 2.336 1.00 0.00 H new ATOM 0 HA LEU A 293 5.435 4.126 3.432 1.00 0.00 H new ATOM 0 HB2 LEU A 293 7.446 3.961 1.486 1.00 0.00 H new ATOM 0 HB3 LEU A 293 5.792 3.384 1.414 1.00 0.00 H new ATOM 0 HG LEU A 293 6.405 4.624 -0.547 1.00 0.00 H new ATOM 0 HD11 LEU A 293 4.524 6.219 -0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 293 4.075 4.665 0.116 1.00 0.00 H new ATOM 0 HD13 LEU A 293 4.364 6.091 1.141 1.00 0.00 H new ATOM 0 HD21 LEU A 293 6.778 7.056 -0.516 1.00 0.00 H new ATOM 0 HD22 LEU A 293 6.812 7.011 1.263 1.00 0.00 H new ATOM 0 HD23 LEU A 293 8.057 6.150 0.328 1.00 0.00 H new ATOM 930 N LEU A 294 7.498 3.772 4.658 1.00 0.00 N ATOM 931 CA LEU A 294 8.694 3.438 5.384 1.00 0.00 C ATOM 932 C LEU A 294 9.592 2.690 4.412 1.00 0.00 C ATOM 933 O LEU A 294 9.202 1.654 3.862 1.00 0.00 O ATOM 934 CB LEU A 294 8.342 2.534 6.577 1.00 0.00 C ATOM 935 CG LEU A 294 7.076 2.899 7.359 1.00 0.00 C ATOM 936 CD1 LEU A 294 6.934 2.027 8.593 1.00 0.00 C ATOM 937 CD2 LEU A 294 7.086 4.360 7.739 1.00 0.00 C ATOM 0 H LEU A 294 6.698 3.184 4.890 1.00 0.00 H new ATOM 0 HA LEU A 294 9.188 4.329 5.771 1.00 0.00 H new ATOM 0 HB2 LEU A 294 8.235 1.513 6.212 1.00 0.00 H new ATOM 0 HB3 LEU A 294 9.184 2.539 7.269 1.00 0.00 H new ATOM 0 HG LEU A 294 6.216 2.719 6.714 1.00 0.00 H new ATOM 0 HD11 LEU A 294 6.028 2.304 9.132 1.00 0.00 H new ATOM 0 HD12 LEU A 294 6.872 0.981 8.294 1.00 0.00 H new ATOM 0 HD13 LEU A 294 7.799 2.169 9.240 1.00 0.00 H new ATOM 0 HD21 LEU A 294 6.178 4.598 8.293 1.00 0.00 H new ATOM 0 HD22 LEU A 294 7.956 4.568 8.361 1.00 0.00 H new ATOM 0 HD23 LEU A 294 7.131 4.970 6.837 1.00 0.00 H new