USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 479 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 279 CYS SG : rot 124:sc= 1.21 USER MOD Set 1.2: A 280 ASN : amide:sc= 0 X(o=1.2,f=1.2) USER MOD Single : A 239 TYR OH : rot 180:sc= 0 USER MOD Single : A 244 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 245 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 249 ASN : amide:sc=-0.00458 X(o=-0.0046,f=-0.0046) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 254 THR OG1 : rot -47:sc= 0.921 USER MOD Single : A 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 267 THR OG1 : rot 180:sc= 0.00631 USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 270 ASN : amide:sc= -0.554! K(o=-0.55!,f=0.036) USER MOD Single : A 272 SER OG : rot 180:sc= 0.0284 USER MOD Single : A 274 GLN : amide:sc= -0.641 X(o=-0.64,f=-0.16) USER MOD Single : A 282 LYS NZ :NH3+ -156:sc= -0.136 (180deg=-0.639) USER MOD Single : A 285 HIS : no HD1:sc= 0.374 K(o=0.37,f=-1.7) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0 USER MOD Single : A 290 HIS : no HE2:sc= -3.45! C(o=-3.5!,f=-6.9!) USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 10.247 -5.752 0.261 1.00 0.00 N ATOM 9 CA PRO A 237 8.986 -5.045 0.428 1.00 0.00 C ATOM 10 C PRO A 237 9.090 -3.920 1.451 1.00 0.00 C ATOM 11 O PRO A 237 9.606 -4.126 2.551 1.00 0.00 O ATOM 12 CB PRO A 237 8.021 -6.135 0.932 1.00 0.00 C ATOM 13 CG PRO A 237 8.803 -7.410 0.949 1.00 0.00 C ATOM 14 CD PRO A 237 10.249 -7.021 0.985 1.00 0.00 C ATOM 0 HA PRO A 237 8.663 -4.568 -0.497 1.00 0.00 H new ATOM 0 HB2 PRO A 237 7.648 -5.894 1.927 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.153 -6.219 0.278 1.00 0.00 H new ATOM 0 HG2 PRO A 237 8.542 -8.014 1.818 1.00 0.00 H new ATOM 0 HG3 PRO A 237 8.585 -8.011 0.066 1.00 0.00 H new ATOM 0 HD2 PRO A 237 10.614 -6.907 2.006 1.00 0.00 H new ATOM 0 HD3 PRO A 237 10.883 -7.764 0.501 1.00 0.00 H new ATOM 22 N ILE A 238 8.603 -2.735 1.099 1.00 0.00 N ATOM 23 CA ILE A 238 8.609 -1.628 2.057 1.00 0.00 C ATOM 24 C ILE A 238 7.348 -1.682 2.905 1.00 0.00 C ATOM 25 O ILE A 238 6.378 -2.362 2.554 1.00 0.00 O ATOM 26 CB ILE A 238 8.713 -0.216 1.404 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.338 0.410 1.133 1.00 0.00 C ATOM 28 CG2 ILE A 238 9.507 -0.277 0.118 1.00 0.00 C ATOM 29 CD1 ILE A 238 6.630 -0.137 -0.081 1.00 0.00 C ATOM 0 H ILE A 238 8.209 -2.516 0.184 1.00 0.00 H new ATOM 0 HA ILE A 238 9.507 -1.761 2.661 1.00 0.00 H new ATOM 0 HB ILE A 238 9.230 0.420 2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 238 6.705 0.257 2.007 1.00 0.00 H new ATOM 0 HG13 ILE A 238 7.460 1.486 1.012 1.00 0.00 H new ATOM 0 HG21 ILE A 238 9.567 0.719 -0.320 1.00 0.00 H new ATOM 0 HG22 ILE A 238 10.512 -0.642 0.328 1.00 0.00 H new ATOM 0 HG23 ILE A 238 9.015 -0.952 -0.582 1.00 0.00 H new ATOM 0 HD11 ILE A 238 5.668 0.361 -0.196 1.00 0.00 H new ATOM 0 HD12 ILE A 238 7.239 0.040 -0.968 1.00 0.00 H new ATOM 0 HD13 ILE A 238 6.471 -1.208 0.042 1.00 0.00 H new ATOM 41 N TYR A 239 7.360 -0.974 4.014 1.00 0.00 N ATOM 42 CA TYR A 239 6.164 -0.803 4.805 1.00 0.00 C ATOM 43 C TYR A 239 5.648 0.600 4.579 1.00 0.00 C ATOM 44 O TYR A 239 6.363 1.562 4.794 1.00 0.00 O ATOM 45 CB TYR A 239 6.435 -1.045 6.290 1.00 0.00 C ATOM 46 CG TYR A 239 6.727 -2.489 6.626 1.00 0.00 C ATOM 47 CD1 TYR A 239 5.723 -3.448 6.569 1.00 0.00 C ATOM 48 CD2 TYR A 239 7.998 -2.890 7.011 1.00 0.00 C ATOM 49 CE1 TYR A 239 5.980 -4.767 6.886 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.264 -4.208 7.328 1.00 0.00 C ATOM 51 CZ TYR A 239 7.251 -5.142 7.265 1.00 0.00 C ATOM 52 OH TYR A 239 7.507 -6.457 7.585 1.00 0.00 O ATOM 0 H TYR A 239 8.187 -0.508 4.387 1.00 0.00 H new ATOM 0 HA TYR A 239 5.417 -1.535 4.497 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.280 -0.431 6.601 1.00 0.00 H new ATOM 0 HB3 TYR A 239 5.571 -0.714 6.867 1.00 0.00 H new ATOM 0 HD1 TYR A 239 4.726 -3.157 6.272 1.00 0.00 H new ATOM 0 HD2 TYR A 239 8.792 -2.160 7.064 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.189 -5.501 6.837 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.259 -4.505 7.623 1.00 0.00 H new ATOM 0 HH TYR A 239 8.451 -6.556 7.830 1.00 0.00 H new ATOM 62 N ALA A 240 4.418 0.729 4.147 1.00 0.00 N ATOM 63 CA ALA A 240 3.902 2.029 3.787 1.00 0.00 C ATOM 64 C ALA A 240 2.823 2.465 4.750 1.00 0.00 C ATOM 65 O ALA A 240 1.790 1.808 4.889 1.00 0.00 O ATOM 66 CB ALA A 240 3.365 2.009 2.365 1.00 0.00 C ATOM 0 H ALA A 240 3.759 -0.042 4.036 1.00 0.00 H new ATOM 0 HA ALA A 240 4.719 2.748 3.843 1.00 0.00 H new ATOM 0 HB1 ALA A 240 2.979 2.996 2.108 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.167 1.742 1.677 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.563 1.275 2.289 1.00 0.00 H new ATOM 72 N ARG A 241 3.086 3.571 5.421 1.00 0.00 N ATOM 73 CA ARG A 241 2.124 4.169 6.317 1.00 0.00 C ATOM 74 C ARG A 241 1.071 4.870 5.480 1.00 0.00 C ATOM 75 O ARG A 241 1.291 5.970 4.989 1.00 0.00 O ATOM 76 CB ARG A 241 2.834 5.184 7.218 1.00 0.00 C ATOM 77 CG ARG A 241 2.636 4.956 8.711 1.00 0.00 C ATOM 78 CD ARG A 241 1.163 4.988 9.115 1.00 0.00 C ATOM 79 NE ARG A 241 0.999 4.984 10.565 1.00 0.00 N ATOM 80 CZ ARG A 241 0.627 6.052 11.269 1.00 0.00 C ATOM 81 NH1 ARG A 241 0.542 7.239 10.682 1.00 0.00 N ATOM 82 NH2 ARG A 241 0.386 5.941 12.570 1.00 0.00 N ATOM 0 H ARG A 241 3.970 4.076 5.358 1.00 0.00 H new ATOM 0 HA ARG A 241 1.658 3.408 6.942 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.901 5.160 6.999 1.00 0.00 H new ATOM 0 HB3 ARG A 241 2.479 6.184 6.967 1.00 0.00 H new ATOM 0 HG2 ARG A 241 3.065 3.993 8.989 1.00 0.00 H new ATOM 0 HG3 ARG A 241 3.179 5.720 9.268 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.691 5.878 8.698 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.650 4.126 8.689 1.00 0.00 H new ATOM 0 HE ARG A 241 1.179 4.115 11.068 1.00 0.00 H new ATOM 0 HH11 ARG A 241 0.762 7.335 9.691 1.00 0.00 H new ATOM 0 HH12 ARG A 241 0.257 8.056 11.222 1.00 0.00 H new ATOM 0 HH21 ARG A 241 0.486 5.037 13.032 1.00 0.00 H new ATOM 0 HH22 ARG A 241 0.101 6.760 13.108 1.00 0.00 H new ATOM 96 N VAL A 242 -0.070 4.247 5.308 1.00 0.00 N ATOM 97 CA VAL A 242 -1.093 4.828 4.466 1.00 0.00 C ATOM 98 C VAL A 242 -1.890 5.855 5.247 1.00 0.00 C ATOM 99 O VAL A 242 -2.484 5.543 6.269 1.00 0.00 O ATOM 100 CB VAL A 242 -2.030 3.771 3.850 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.594 2.842 4.907 1.00 0.00 C ATOM 102 CG2 VAL A 242 -3.151 4.452 3.097 1.00 0.00 C ATOM 0 H VAL A 242 -0.314 3.352 5.731 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.585 5.317 3.635 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.446 3.166 3.157 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.250 2.110 4.436 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.777 2.326 5.411 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.161 3.421 5.636 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.809 3.698 2.664 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.720 5.081 3.782 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.733 5.068 2.301 1.00 0.00 H new ATOM 112 N ILE A 243 -1.884 7.085 4.757 1.00 0.00 N ATOM 113 CA ILE A 243 -2.519 8.189 5.459 1.00 0.00 C ATOM 114 C ILE A 243 -3.823 8.602 4.795 1.00 0.00 C ATOM 115 O ILE A 243 -4.405 9.630 5.142 1.00 0.00 O ATOM 116 CB ILE A 243 -1.564 9.404 5.578 1.00 0.00 C ATOM 117 CG1 ILE A 243 -0.981 9.831 4.218 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.442 9.075 6.544 1.00 0.00 C ATOM 119 CD1 ILE A 243 -1.934 10.625 3.351 1.00 0.00 C ATOM 0 H ILE A 243 -1.445 7.344 3.873 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.752 7.836 6.464 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.148 10.245 5.953 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -0.085 10.427 4.391 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -0.671 8.939 3.673 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.229 9.930 6.627 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.861 8.846 7.524 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.113 8.212 6.176 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -1.443 10.884 2.413 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -2.821 10.027 3.143 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.226 11.537 3.872 1.00 0.00 H new ATOM 131 N GLN A 244 -4.284 7.788 3.851 1.00 0.00 N ATOM 132 CA GLN A 244 -5.485 8.106 3.088 1.00 0.00 C ATOM 133 C GLN A 244 -5.818 6.974 2.137 1.00 0.00 C ATOM 134 O GLN A 244 -5.256 6.893 1.048 1.00 0.00 O ATOM 135 CB GLN A 244 -5.272 9.379 2.273 1.00 0.00 C ATOM 136 CG GLN A 244 -6.207 10.518 2.636 1.00 0.00 C ATOM 137 CD GLN A 244 -6.070 11.686 1.680 1.00 0.00 C ATOM 138 OE1 GLN A 244 -6.761 11.752 0.662 1.00 0.00 O ATOM 139 NE2 GLN A 244 -5.181 12.613 1.997 1.00 0.00 N ATOM 0 H GLN A 244 -3.844 6.904 3.596 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.305 8.251 3.792 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -4.243 9.713 2.406 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -5.397 9.145 1.216 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -7.236 10.160 2.627 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -5.995 10.853 3.651 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -4.629 12.520 2.850 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -5.048 13.421 1.389 1.00 0.00 H new ATOM 148 N LYS A 245 -6.685 6.076 2.547 1.00 0.00 N ATOM 149 CA LYS A 245 -7.143 5.037 1.649 1.00 0.00 C ATOM 150 C LYS A 245 -8.588 4.653 1.942 1.00 0.00 C ATOM 151 O LYS A 245 -9.142 4.999 2.985 1.00 0.00 O ATOM 152 CB LYS A 245 -6.229 3.812 1.687 1.00 0.00 C ATOM 153 CG LYS A 245 -5.705 3.392 0.311 1.00 0.00 C ATOM 154 CD LYS A 245 -4.227 3.732 0.145 1.00 0.00 C ATOM 155 CE LYS A 245 -3.365 2.492 -0.100 1.00 0.00 C ATOM 156 NZ LYS A 245 -1.908 2.792 -0.008 1.00 0.00 N ATOM 0 H LYS A 245 -7.084 6.042 3.485 1.00 0.00 H new ATOM 0 HA LYS A 245 -7.102 5.442 0.638 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.382 4.022 2.340 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.773 2.977 2.129 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -5.849 2.320 0.178 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -6.283 3.891 -0.467 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -4.108 4.424 -0.689 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -3.873 4.246 1.039 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.623 1.723 0.628 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -3.589 2.085 -1.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.363 1.923 -0.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -1.655 3.507 -0.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -1.688 3.156 0.941 1.00 0.00 H new ATOM 170 N ARG A 246 -9.182 3.959 0.994 1.00 0.00 N ATOM 171 CA ARG A 246 -10.573 3.541 1.065 1.00 0.00 C ATOM 172 C ARG A 246 -10.644 2.075 1.475 1.00 0.00 C ATOM 173 O ARG A 246 -9.614 1.453 1.736 1.00 0.00 O ATOM 174 CB ARG A 246 -11.229 3.727 -0.302 1.00 0.00 C ATOM 175 CG ARG A 246 -10.586 2.883 -1.393 1.00 0.00 C ATOM 176 CD ARG A 246 -11.312 3.025 -2.721 1.00 0.00 C ATOM 177 NE ARG A 246 -12.615 2.358 -2.720 1.00 0.00 N ATOM 178 CZ ARG A 246 -12.991 1.462 -3.636 1.00 0.00 C ATOM 179 NH1 ARG A 246 -12.172 1.130 -4.625 1.00 0.00 N ATOM 180 NH2 ARG A 246 -14.189 0.894 -3.572 1.00 0.00 N ATOM 0 H ARG A 246 -8.709 3.664 0.140 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.099 4.146 1.803 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -12.286 3.471 -0.229 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -11.174 4.778 -0.585 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.544 3.180 -1.515 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.586 1.836 -1.089 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -11.449 4.083 -2.946 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -10.694 2.608 -3.516 1.00 0.00 H new ATOM 0 HE ARG A 246 -13.274 2.591 -1.977 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -11.249 1.560 -4.689 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -12.465 0.445 -5.322 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -14.831 1.141 -2.819 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -14.468 0.211 -4.276 1.00 0.00 H new ATOM 194 N VAL A 247 -11.852 1.527 1.545 1.00 0.00 N ATOM 195 CA VAL A 247 -12.022 0.102 1.808 1.00 0.00 C ATOM 196 C VAL A 247 -12.410 -0.651 0.524 1.00 0.00 C ATOM 197 O VAL A 247 -13.591 -0.896 0.258 1.00 0.00 O ATOM 198 CB VAL A 247 -13.072 -0.157 2.911 1.00 0.00 C ATOM 199 CG1 VAL A 247 -13.171 -1.643 3.228 1.00 0.00 C ATOM 200 CG2 VAL A 247 -12.731 0.629 4.169 1.00 0.00 C ATOM 0 H VAL A 247 -12.723 2.044 1.424 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.062 -0.274 2.162 1.00 0.00 H new ATOM 0 HB VAL A 247 -14.040 0.180 2.541 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -13.917 -1.800 4.007 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -13.464 -2.188 2.331 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -12.203 -2.007 3.573 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -13.482 0.434 4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -11.751 0.322 4.535 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -12.715 1.694 3.939 1.00 0.00 H new ATOM 210 N PRO A 248 -11.406 -0.981 -0.304 1.00 0.00 N ATOM 211 CA PRO A 248 -11.548 -1.787 -1.506 1.00 0.00 C ATOM 212 C PRO A 248 -11.339 -3.272 -1.223 1.00 0.00 C ATOM 213 O PRO A 248 -10.997 -3.663 -0.113 1.00 0.00 O ATOM 214 CB PRO A 248 -10.412 -1.278 -2.405 1.00 0.00 C ATOM 215 CG PRO A 248 -9.601 -0.341 -1.564 1.00 0.00 C ATOM 216 CD PRO A 248 -10.026 -0.572 -0.153 1.00 0.00 C ATOM 0 HA PRO A 248 -12.543 -1.698 -1.942 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -9.801 -2.105 -2.766 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -10.809 -0.768 -3.283 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.535 -0.533 -1.686 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -9.774 0.694 -1.858 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.425 -1.342 0.331 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -9.934 0.330 0.451 1.00 0.00 H new ATOM 224 N ASN A 249 -11.538 -4.096 -2.231 1.00 0.00 N ATOM 225 CA ASN A 249 -11.308 -5.526 -2.103 1.00 0.00 C ATOM 226 C ASN A 249 -10.623 -6.060 -3.351 1.00 0.00 C ATOM 227 O ASN A 249 -10.315 -5.296 -4.270 1.00 0.00 O ATOM 228 CB ASN A 249 -12.607 -6.299 -1.847 1.00 0.00 C ATOM 229 CG ASN A 249 -13.236 -5.981 -0.505 1.00 0.00 C ATOM 230 OD1 ASN A 249 -12.875 -6.566 0.515 1.00 0.00 O ATOM 231 ND2 ASN A 249 -14.199 -5.073 -0.497 1.00 0.00 N ATOM 0 H ASN A 249 -11.860 -3.801 -3.153 1.00 0.00 H new ATOM 0 HA ASN A 249 -10.661 -5.675 -1.238 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.320 -6.070 -2.639 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.403 -7.368 -1.901 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -14.670 -4.837 0.376 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -14.470 -4.609 -1.364 1.00 0.00 H new ATOM 238 N ALA A 250 -10.348 -7.357 -3.374 1.00 0.00 N ATOM 239 CA ALA A 250 -9.756 -8.005 -4.543 1.00 0.00 C ATOM 240 C ALA A 250 -10.612 -7.808 -5.801 1.00 0.00 C ATOM 241 O ALA A 250 -10.166 -8.071 -6.914 1.00 0.00 O ATOM 242 CB ALA A 250 -9.565 -9.489 -4.276 1.00 0.00 C ATOM 0 H ALA A 250 -10.526 -7.987 -2.592 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.788 -7.537 -4.723 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -9.123 -9.963 -5.153 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.904 -9.622 -3.420 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -10.531 -9.948 -4.064 1.00 0.00 H new ATOM 248 N TYR A 251 -11.835 -7.338 -5.628 1.00 0.00 N ATOM 249 CA TYR A 251 -12.732 -7.121 -6.755 1.00 0.00 C ATOM 250 C TYR A 251 -12.591 -5.697 -7.283 1.00 0.00 C ATOM 251 O TYR A 251 -13.160 -5.348 -8.319 1.00 0.00 O ATOM 252 CB TYR A 251 -14.186 -7.392 -6.360 1.00 0.00 C ATOM 253 CG TYR A 251 -14.440 -8.805 -5.888 1.00 0.00 C ATOM 254 CD1 TYR A 251 -13.985 -9.228 -4.648 1.00 0.00 C ATOM 255 CD2 TYR A 251 -15.144 -9.711 -6.672 1.00 0.00 C ATOM 256 CE1 TYR A 251 -14.223 -10.511 -4.198 1.00 0.00 C ATOM 257 CE2 TYR A 251 -15.384 -10.998 -6.231 1.00 0.00 C ATOM 258 CZ TYR A 251 -14.921 -11.393 -4.993 1.00 0.00 C ATOM 259 OH TYR A 251 -15.165 -12.671 -4.543 1.00 0.00 O ATOM 0 H TYR A 251 -12.232 -7.099 -4.719 1.00 0.00 H new ATOM 0 HA TYR A 251 -12.454 -7.820 -7.544 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -14.473 -6.698 -5.569 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -14.829 -7.184 -7.215 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -13.434 -8.541 -4.023 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -15.509 -9.404 -7.641 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -13.864 -10.822 -3.228 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -15.931 -11.691 -6.852 1.00 0.00 H new ATOM 0 HH TYR A 251 -15.670 -13.166 -5.222 1.00 0.00 H new ATOM 269 N ASP A 252 -11.799 -4.885 -6.584 1.00 0.00 N ATOM 270 CA ASP A 252 -11.574 -3.498 -6.975 1.00 0.00 C ATOM 271 C ASP A 252 -10.353 -3.423 -7.860 1.00 0.00 C ATOM 272 O ASP A 252 -9.463 -2.599 -7.643 1.00 0.00 O ATOM 273 CB ASP A 252 -11.365 -2.603 -5.751 1.00 0.00 C ATOM 274 CG ASP A 252 -12.661 -2.181 -5.094 1.00 0.00 C ATOM 275 OD1 ASP A 252 -13.262 -1.184 -5.540 1.00 0.00 O ATOM 276 OD2 ASP A 252 -13.073 -2.830 -4.115 1.00 0.00 O ATOM 0 H ASP A 252 -11.301 -5.168 -5.740 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.455 -3.145 -7.511 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -10.751 -3.132 -5.022 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -10.810 -1.714 -6.050 1.00 0.00 H new ATOM 281 N LYS A 253 -10.315 -4.306 -8.855 1.00 0.00 N ATOM 282 CA LYS A 253 -9.106 -4.542 -9.632 1.00 0.00 C ATOM 283 C LYS A 253 -7.998 -4.999 -8.688 1.00 0.00 C ATOM 284 O LYS A 253 -6.815 -4.837 -8.967 1.00 0.00 O ATOM 285 CB LYS A 253 -8.673 -3.289 -10.417 1.00 0.00 C ATOM 286 CG LYS A 253 -9.549 -2.966 -11.627 1.00 0.00 C ATOM 287 CD LYS A 253 -10.923 -2.439 -11.235 1.00 0.00 C ATOM 288 CE LYS A 253 -10.827 -1.102 -10.519 1.00 0.00 C ATOM 289 NZ LYS A 253 -12.166 -0.553 -10.180 1.00 0.00 N ATOM 0 H LYS A 253 -11.114 -4.872 -9.142 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.309 -5.318 -10.370 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -8.678 -2.433 -9.742 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -7.645 -3.424 -10.754 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -9.044 -2.226 -12.248 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -9.668 -3.864 -12.234 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -11.540 -2.331 -12.127 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -11.420 -3.163 -10.590 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -10.243 -1.221 -9.607 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -10.293 -0.391 -11.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -12.054 0.359 -9.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -12.715 -0.415 -11.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -12.667 -1.219 -9.557 1.00 0.00 H new ATOM 303 N THR A 254 -8.433 -5.567 -7.561 1.00 0.00 N ATOM 304 CA THR A 254 -7.576 -6.031 -6.482 1.00 0.00 C ATOM 305 C THR A 254 -6.843 -4.864 -5.830 1.00 0.00 C ATOM 306 O THR A 254 -5.703 -4.543 -6.162 1.00 0.00 O ATOM 307 CB THR A 254 -6.582 -7.145 -6.901 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.504 -6.643 -7.702 1.00 0.00 O ATOM 309 CG2 THR A 254 -7.280 -8.251 -7.670 1.00 0.00 C ATOM 0 H THR A 254 -9.424 -5.719 -7.374 1.00 0.00 H new ATOM 0 HA THR A 254 -8.242 -6.489 -5.751 1.00 0.00 H new ATOM 0 HB THR A 254 -6.174 -7.542 -5.971 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.862 -6.058 -8.403 1.00 0.00 H new ATOM 0 HG21 THR A 254 -6.554 -9.015 -7.948 1.00 0.00 H new ATOM 0 HG22 THR A 254 -8.054 -8.696 -7.045 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.734 -7.837 -8.570 1.00 0.00 H new ATOM 317 N ALA A 255 -7.524 -4.210 -4.909 1.00 0.00 N ATOM 318 CA ALA A 255 -6.939 -3.083 -4.199 1.00 0.00 C ATOM 319 C ALA A 255 -6.938 -3.314 -2.684 1.00 0.00 C ATOM 320 O ALA A 255 -7.701 -4.132 -2.166 1.00 0.00 O ATOM 321 CB ALA A 255 -7.675 -1.810 -4.566 1.00 0.00 C ATOM 0 H ALA A 255 -8.480 -4.436 -4.634 1.00 0.00 H new ATOM 0 HA ALA A 255 -5.897 -2.983 -4.503 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.234 -0.968 -4.032 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -7.596 -1.641 -5.640 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -8.725 -1.905 -4.290 1.00 0.00 H new ATOM 327 N LEU A 256 -6.066 -2.578 -1.992 1.00 0.00 N ATOM 328 CA LEU A 256 -5.849 -2.745 -0.546 1.00 0.00 C ATOM 329 C LEU A 256 -6.944 -2.092 0.279 1.00 0.00 C ATOM 330 O LEU A 256 -7.171 -0.891 0.158 1.00 0.00 O ATOM 331 CB LEU A 256 -4.528 -2.108 -0.100 1.00 0.00 C ATOM 332 CG LEU A 256 -3.389 -3.053 0.252 1.00 0.00 C ATOM 333 CD1 LEU A 256 -3.848 -4.116 1.225 1.00 0.00 C ATOM 334 CD2 LEU A 256 -2.843 -3.683 -0.987 1.00 0.00 C ATOM 0 H LEU A 256 -5.489 -1.850 -2.413 1.00 0.00 H new ATOM 0 HA LEU A 256 -5.841 -3.822 -0.379 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -4.185 -1.446 -0.896 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.730 -1.483 0.770 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.600 -2.474 0.732 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -3.015 -4.778 1.460 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -4.204 -3.642 2.140 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -4.656 -4.694 0.777 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.028 -4.357 -0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -3.632 -4.245 -1.487 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -2.470 -2.907 -1.656 1.00 0.00 H new ATOM 346 N ALA A 257 -7.585 -2.873 1.136 1.00 0.00 N ATOM 347 CA ALA A 257 -8.547 -2.345 2.091 1.00 0.00 C ATOM 348 C ALA A 257 -7.853 -1.832 3.343 1.00 0.00 C ATOM 349 O ALA A 257 -7.584 -2.582 4.286 1.00 0.00 O ATOM 350 CB ALA A 257 -9.571 -3.399 2.436 1.00 0.00 C ATOM 0 H ALA A 257 -7.454 -3.883 1.189 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.059 -1.501 1.630 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.285 -2.992 3.152 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.097 -3.705 1.532 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.071 -4.263 2.874 1.00 0.00 H new ATOM 356 N LEU A 258 -7.575 -0.546 3.333 1.00 0.00 N ATOM 357 CA LEU A 258 -6.854 0.119 4.422 1.00 0.00 C ATOM 358 C LEU A 258 -7.204 1.607 4.436 1.00 0.00 C ATOM 359 O LEU A 258 -7.799 2.102 3.490 1.00 0.00 O ATOM 360 CB LEU A 258 -5.335 -0.102 4.274 1.00 0.00 C ATOM 361 CG LEU A 258 -4.858 -0.430 2.868 1.00 0.00 C ATOM 362 CD1 LEU A 258 -5.179 0.689 1.914 1.00 0.00 C ATOM 363 CD2 LEU A 258 -3.375 -0.708 2.857 1.00 0.00 C ATOM 0 H LEU A 258 -7.839 0.079 2.571 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.157 -0.313 5.375 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -4.819 0.796 4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.036 -0.912 4.939 1.00 0.00 H new ATOM 0 HG LEU A 258 -5.385 -1.326 2.540 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.827 0.428 0.916 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -6.257 0.848 1.889 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -4.686 1.603 2.246 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.056 -0.940 1.841 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -2.838 0.170 3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -3.159 -1.555 3.508 1.00 0.00 H new ATOM 375 N GLU A 259 -6.843 2.325 5.490 1.00 0.00 N ATOM 376 CA GLU A 259 -7.295 3.704 5.641 1.00 0.00 C ATOM 377 C GLU A 259 -6.202 4.601 6.229 1.00 0.00 C ATOM 378 O GLU A 259 -5.031 4.225 6.266 1.00 0.00 O ATOM 379 CB GLU A 259 -8.535 3.745 6.537 1.00 0.00 C ATOM 380 CG GLU A 259 -8.249 3.400 7.989 1.00 0.00 C ATOM 381 CD GLU A 259 -9.482 3.487 8.864 1.00 0.00 C ATOM 382 OE1 GLU A 259 -10.389 2.640 8.717 1.00 0.00 O ATOM 383 OE2 GLU A 259 -9.550 4.402 9.709 1.00 0.00 O ATOM 0 H GLU A 259 -6.247 1.984 6.244 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.539 4.085 4.649 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -8.975 4.741 6.489 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -9.278 3.049 6.147 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -7.839 2.391 8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -7.486 4.076 8.375 1.00 0.00 H new ATOM 390 N VAL A 260 -6.606 5.785 6.685 1.00 0.00 N ATOM 391 CA VAL A 260 -5.689 6.753 7.289 1.00 0.00 C ATOM 392 C VAL A 260 -4.976 6.198 8.532 1.00 0.00 C ATOM 393 O VAL A 260 -5.610 5.829 9.520 1.00 0.00 O ATOM 394 CB VAL A 260 -6.430 8.048 7.691 1.00 0.00 C ATOM 395 CG1 VAL A 260 -5.450 9.083 8.222 1.00 0.00 C ATOM 396 CG2 VAL A 260 -7.215 8.610 6.516 1.00 0.00 C ATOM 0 H VAL A 260 -7.575 6.101 6.647 1.00 0.00 H new ATOM 0 HA VAL A 260 -4.942 6.968 6.525 1.00 0.00 H new ATOM 0 HB VAL A 260 -7.135 7.802 8.485 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -5.991 9.988 8.500 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -4.938 8.684 9.097 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -4.718 9.321 7.450 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -7.728 9.521 6.824 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -6.532 8.837 5.697 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -7.948 7.875 6.184 1.00 0.00 H new ATOM 406 N GLY A 261 -3.653 6.124 8.451 1.00 0.00 N ATOM 407 CA GLY A 261 -2.829 5.813 9.604 1.00 0.00 C ATOM 408 C GLY A 261 -2.466 4.351 9.666 1.00 0.00 C ATOM 409 O GLY A 261 -1.792 3.905 10.594 1.00 0.00 O ATOM 0 H GLY A 261 -3.128 6.277 7.590 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -1.918 6.411 9.570 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.360 6.093 10.514 1.00 0.00 H new ATOM 413 N GLU A 262 -2.935 3.596 8.689 1.00 0.00 N ATOM 414 CA GLU A 262 -2.719 2.163 8.681 1.00 0.00 C ATOM 415 C GLU A 262 -1.424 1.826 7.957 1.00 0.00 C ATOM 416 O GLU A 262 -0.684 2.719 7.543 1.00 0.00 O ATOM 417 CB GLU A 262 -3.902 1.451 8.037 1.00 0.00 C ATOM 418 CG GLU A 262 -5.217 1.763 8.719 1.00 0.00 C ATOM 419 CD GLU A 262 -6.201 0.621 8.620 1.00 0.00 C ATOM 420 OE1 GLU A 262 -6.657 0.321 7.503 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.501 -0.005 9.659 1.00 0.00 O ATOM 0 H GLU A 262 -3.466 3.951 7.894 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.633 1.817 9.711 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.965 1.738 6.987 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.731 0.375 8.063 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -5.034 1.991 9.769 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.653 2.655 8.270 1.00 0.00 H new ATOM 428 N LEU A 263 -1.145 0.545 7.803 1.00 0.00 N ATOM 429 CA LEU A 263 0.095 0.121 7.191 1.00 0.00 C ATOM 430 C LEU A 263 -0.152 -0.898 6.090 1.00 0.00 C ATOM 431 O LEU A 263 -1.203 -1.531 6.038 1.00 0.00 O ATOM 432 CB LEU A 263 1.030 -0.464 8.246 1.00 0.00 C ATOM 433 CG LEU A 263 2.368 -0.954 7.704 1.00 0.00 C ATOM 434 CD1 LEU A 263 3.215 0.218 7.258 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.108 -1.784 8.723 1.00 0.00 C ATOM 0 H LEU A 263 -1.760 -0.216 8.093 1.00 0.00 H new ATOM 0 HA LEU A 263 0.564 0.996 6.742 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.216 0.293 9.008 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.526 -1.295 8.739 1.00 0.00 H new ATOM 0 HG LEU A 263 2.166 -1.592 6.843 1.00 0.00 H new ATOM 0 HD11 LEU A 263 4.167 -0.147 6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.693 0.767 6.474 1.00 0.00 H new ATOM 0 HD13 LEU A 263 3.395 0.880 8.105 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.057 -2.116 8.302 1.00 0.00 H new ATOM 0 HD22 LEU A 263 3.296 -1.184 9.613 1.00 0.00 H new ATOM 0 HD23 LEU A 263 2.506 -2.652 8.991 1.00 0.00 H new ATOM 447 N VAL A 264 0.827 -1.034 5.211 1.00 0.00 N ATOM 448 CA VAL A 264 0.761 -1.976 4.107 1.00 0.00 C ATOM 449 C VAL A 264 2.168 -2.414 3.709 1.00 0.00 C ATOM 450 O VAL A 264 3.067 -1.587 3.590 1.00 0.00 O ATOM 451 CB VAL A 264 0.016 -1.383 2.885 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.528 0.007 2.540 1.00 0.00 C ATOM 453 CG2 VAL A 264 0.133 -2.299 1.680 1.00 0.00 C ATOM 0 H VAL A 264 1.691 -0.493 5.243 1.00 0.00 H new ATOM 0 HA VAL A 264 0.194 -2.844 4.445 1.00 0.00 H new ATOM 0 HB VAL A 264 -1.036 -1.298 3.158 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -0.017 0.392 1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 264 0.378 0.672 3.391 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.591 -0.045 2.303 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.399 -1.860 0.836 1.00 0.00 H new ATOM 0 HG22 VAL A 264 1.184 -2.426 1.420 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -0.302 -3.270 1.917 1.00 0.00 H new ATOM 463 N LYS A 265 2.359 -3.707 3.524 1.00 0.00 N ATOM 464 CA LYS A 265 3.649 -4.232 3.113 1.00 0.00 C ATOM 465 C LYS A 265 3.672 -4.422 1.601 1.00 0.00 C ATOM 466 O LYS A 265 3.194 -5.424 1.078 1.00 0.00 O ATOM 467 CB LYS A 265 3.927 -5.557 3.821 1.00 0.00 C ATOM 468 CG LYS A 265 5.282 -6.152 3.490 1.00 0.00 C ATOM 469 CD LYS A 265 5.486 -7.478 4.204 1.00 0.00 C ATOM 470 CE LYS A 265 6.841 -8.087 3.890 1.00 0.00 C ATOM 471 NZ LYS A 265 6.982 -9.449 4.465 1.00 0.00 N ATOM 0 H LYS A 265 1.636 -4.415 3.652 1.00 0.00 H new ATOM 0 HA LYS A 265 4.428 -3.522 3.390 1.00 0.00 H new ATOM 0 HB2 LYS A 265 3.860 -5.404 4.898 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.150 -6.273 3.552 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.365 -6.299 2.413 1.00 0.00 H new ATOM 0 HG3 LYS A 265 6.069 -5.455 3.778 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.396 -7.329 5.280 1.00 0.00 H new ATOM 0 HD3 LYS A 265 4.699 -8.173 3.911 1.00 0.00 H new ATOM 0 HE2 LYS A 265 6.977 -8.133 2.809 1.00 0.00 H new ATOM 0 HE3 LYS A 265 7.628 -7.444 4.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 7.920 -9.830 4.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 6.878 -9.402 5.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 6.247 -10.070 4.071 1.00 0.00 H new ATOM 485 N VAL A 266 4.207 -3.445 0.900 1.00 0.00 N ATOM 486 CA VAL A 266 4.254 -3.503 -0.546 1.00 0.00 C ATOM 487 C VAL A 266 5.349 -4.430 -1.028 1.00 0.00 C ATOM 488 O VAL A 266 6.541 -4.158 -0.845 1.00 0.00 O ATOM 489 CB VAL A 266 4.449 -2.110 -1.146 1.00 0.00 C ATOM 490 CG1 VAL A 266 4.776 -2.194 -2.629 1.00 0.00 C ATOM 491 CG2 VAL A 266 3.203 -1.284 -0.907 1.00 0.00 C ATOM 0 H VAL A 266 4.615 -2.603 1.306 1.00 0.00 H new ATOM 0 HA VAL A 266 3.296 -3.899 -0.883 1.00 0.00 H new ATOM 0 HB VAL A 266 5.295 -1.626 -0.657 1.00 0.00 H new ATOM 0 HG11 VAL A 266 4.909 -1.189 -3.030 1.00 0.00 H new ATOM 0 HG12 VAL A 266 5.694 -2.765 -2.767 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.959 -2.688 -3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 266 3.338 -0.290 -1.333 1.00 0.00 H new ATOM 0 HG22 VAL A 266 2.349 -1.769 -1.380 1.00 0.00 H new ATOM 0 HG23 VAL A 266 3.024 -1.198 0.165 1.00 0.00 H new ATOM 501 N THR A 267 4.922 -5.507 -1.671 1.00 0.00 N ATOM 502 CA THR A 267 5.812 -6.562 -2.107 1.00 0.00 C ATOM 503 C THR A 267 6.322 -6.313 -3.517 1.00 0.00 C ATOM 504 O THR A 267 7.239 -6.995 -3.986 1.00 0.00 O ATOM 505 CB THR A 267 5.088 -7.916 -2.043 1.00 0.00 C ATOM 506 OG1 THR A 267 3.870 -7.847 -2.795 1.00 0.00 O ATOM 507 CG2 THR A 267 4.767 -8.278 -0.602 1.00 0.00 C ATOM 0 H THR A 267 3.942 -5.670 -1.904 1.00 0.00 H new ATOM 0 HA THR A 267 6.672 -6.575 -1.437 1.00 0.00 H new ATOM 0 HB THR A 267 5.740 -8.680 -2.465 1.00 0.00 H new ATOM 0 HG1 THR A 267 3.411 -8.712 -2.754 1.00 0.00 H new ATOM 0 HG21 THR A 267 4.254 -9.240 -0.574 1.00 0.00 H new ATOM 0 HG22 THR A 267 5.692 -8.343 -0.029 1.00 0.00 H new ATOM 0 HG23 THR A 267 4.124 -7.512 -0.169 1.00 0.00 H new ATOM 515 N LYS A 268 5.739 -5.337 -4.197 1.00 0.00 N ATOM 516 CA LYS A 268 6.212 -4.980 -5.519 1.00 0.00 C ATOM 517 C LYS A 268 6.487 -3.498 -5.563 1.00 0.00 C ATOM 518 O LYS A 268 5.566 -2.699 -5.620 1.00 0.00 O ATOM 519 CB LYS A 268 5.191 -5.356 -6.589 1.00 0.00 C ATOM 520 CG LYS A 268 5.775 -5.365 -7.992 1.00 0.00 C ATOM 521 CD LYS A 268 6.999 -6.264 -8.061 1.00 0.00 C ATOM 522 CE LYS A 268 6.654 -7.692 -7.684 1.00 0.00 C ATOM 523 NZ LYS A 268 7.862 -8.558 -7.638 1.00 0.00 N ATOM 0 H LYS A 268 4.949 -4.787 -3.859 1.00 0.00 H new ATOM 0 HA LYS A 268 7.129 -5.532 -5.724 1.00 0.00 H new ATOM 0 HB2 LYS A 268 4.785 -6.342 -6.365 1.00 0.00 H new ATOM 0 HB3 LYS A 268 4.359 -4.653 -6.552 1.00 0.00 H new ATOM 0 HG2 LYS A 268 5.023 -5.711 -8.701 1.00 0.00 H new ATOM 0 HG3 LYS A 268 6.046 -4.351 -8.285 1.00 0.00 H new ATOM 0 HD2 LYS A 268 7.413 -6.241 -9.069 1.00 0.00 H new ATOM 0 HD3 LYS A 268 7.770 -5.885 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS A 268 6.162 -7.702 -6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 268 5.944 -8.097 -8.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 7.585 -9.526 -7.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 8.318 -8.568 -8.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 8.529 -8.186 -6.932 1.00 0.00 H new ATOM 537 N ILE A 269 7.758 -3.149 -5.558 1.00 0.00 N ATOM 538 CA ILE A 269 8.164 -1.762 -5.390 1.00 0.00 C ATOM 539 C ILE A 269 8.791 -1.143 -6.640 1.00 0.00 C ATOM 540 O ILE A 269 9.520 -1.787 -7.393 1.00 0.00 O ATOM 541 CB ILE A 269 9.094 -1.572 -4.166 1.00 0.00 C ATOM 542 CG1 ILE A 269 9.952 -2.816 -3.913 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.265 -1.242 -2.940 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.727 -3.245 -5.125 1.00 0.00 C ATOM 0 H ILE A 269 8.531 -3.805 -5.668 1.00 0.00 H new ATOM 0 HA ILE A 269 7.235 -1.221 -5.209 1.00 0.00 H new ATOM 0 HB ILE A 269 9.771 -0.745 -4.378 1.00 0.00 H new ATOM 0 HG12 ILE A 269 10.646 -2.613 -3.097 1.00 0.00 H new ATOM 0 HG13 ILE A 269 9.310 -3.635 -3.590 1.00 0.00 H new ATOM 0 HG21 ILE A 269 8.923 -1.109 -2.081 1.00 0.00 H new ATOM 0 HG22 ILE A 269 7.707 -0.322 -3.115 1.00 0.00 H new ATOM 0 HG23 ILE A 269 7.569 -2.057 -2.741 1.00 0.00 H new ATOM 0 HD11 ILE A 269 11.316 -4.130 -4.886 1.00 0.00 H new ATOM 0 HD12 ILE A 269 10.036 -3.477 -5.935 1.00 0.00 H new ATOM 0 HD13 ILE A 269 11.393 -2.440 -5.435 1.00 0.00 H new ATOM 556 N ASN A 270 8.431 0.112 -6.866 1.00 0.00 N ATOM 557 CA ASN A 270 8.952 0.904 -7.980 1.00 0.00 C ATOM 558 C ASN A 270 9.024 2.383 -7.602 1.00 0.00 C ATOM 559 O ASN A 270 8.109 2.916 -6.975 1.00 0.00 O ATOM 560 CB ASN A 270 8.118 0.710 -9.256 1.00 0.00 C ATOM 561 CG ASN A 270 6.611 0.683 -9.033 1.00 0.00 C ATOM 562 OD1 ASN A 270 5.893 -0.014 -9.747 1.00 0.00 O ATOM 563 ND2 ASN A 270 6.112 1.437 -8.063 1.00 0.00 N ATOM 0 H ASN A 270 7.765 0.616 -6.280 1.00 0.00 H new ATOM 0 HA ASN A 270 9.961 0.549 -8.191 1.00 0.00 H new ATOM 0 HB2 ASN A 270 8.354 1.513 -9.954 1.00 0.00 H new ATOM 0 HB3 ASN A 270 8.418 -0.224 -9.732 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.106 1.449 -7.893 1.00 0.00 H new ATOM 0 HD22 ASN A 270 6.734 2.005 -7.487 1.00 0.00 H new ATOM 570 N VAL A 271 10.090 3.045 -8.031 1.00 0.00 N ATOM 571 CA VAL A 271 10.396 4.422 -7.627 1.00 0.00 C ATOM 572 C VAL A 271 9.278 5.416 -7.984 1.00 0.00 C ATOM 573 O VAL A 271 9.247 6.533 -7.467 1.00 0.00 O ATOM 574 CB VAL A 271 11.727 4.887 -8.272 1.00 0.00 C ATOM 575 CG1 VAL A 271 11.584 5.016 -9.784 1.00 0.00 C ATOM 576 CG2 VAL A 271 12.217 6.192 -7.658 1.00 0.00 C ATOM 0 H VAL A 271 10.774 2.645 -8.673 1.00 0.00 H new ATOM 0 HA VAL A 271 10.487 4.413 -6.541 1.00 0.00 H new ATOM 0 HB VAL A 271 12.477 4.124 -8.066 1.00 0.00 H new ATOM 0 HG11 VAL A 271 12.531 5.343 -10.212 1.00 0.00 H new ATOM 0 HG12 VAL A 271 11.309 4.050 -10.207 1.00 0.00 H new ATOM 0 HG13 VAL A 271 10.809 5.747 -10.015 1.00 0.00 H new ATOM 0 HG21 VAL A 271 13.152 6.489 -8.133 1.00 0.00 H new ATOM 0 HG22 VAL A 271 11.469 6.970 -7.811 1.00 0.00 H new ATOM 0 HG23 VAL A 271 12.381 6.052 -6.590 1.00 0.00 H new ATOM 586 N SER A 272 8.359 5.008 -8.851 1.00 0.00 N ATOM 587 CA SER A 272 7.280 5.881 -9.302 1.00 0.00 C ATOM 588 C SER A 272 6.377 6.318 -8.161 1.00 0.00 C ATOM 589 O SER A 272 5.892 7.447 -8.138 1.00 0.00 O ATOM 590 CB SER A 272 6.433 5.157 -10.333 1.00 0.00 C ATOM 591 OG SER A 272 7.255 4.342 -11.151 1.00 0.00 O ATOM 0 H SER A 272 8.339 4.073 -9.258 1.00 0.00 H new ATOM 0 HA SER A 272 7.745 6.768 -9.731 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.682 4.545 -9.834 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.897 5.880 -10.948 1.00 0.00 H new ATOM 0 HG SER A 272 6.701 3.877 -11.812 1.00 0.00 H new ATOM 597 N GLY A 273 6.154 5.420 -7.212 1.00 0.00 N ATOM 598 CA GLY A 273 5.159 5.672 -6.207 1.00 0.00 C ATOM 599 C GLY A 273 3.808 5.170 -6.653 1.00 0.00 C ATOM 600 O GLY A 273 2.794 5.810 -6.438 1.00 0.00 O ATOM 0 H GLY A 273 6.644 4.529 -7.126 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.444 5.183 -5.276 1.00 0.00 H new ATOM 0 HA3 GLY A 273 5.105 6.741 -6.002 1.00 0.00 H new ATOM 604 N GLN A 274 3.811 4.058 -7.349 1.00 0.00 N ATOM 605 CA GLN A 274 2.583 3.356 -7.684 1.00 0.00 C ATOM 606 C GLN A 274 2.904 1.881 -7.749 1.00 0.00 C ATOM 607 O GLN A 274 3.417 1.395 -8.751 1.00 0.00 O ATOM 608 CB GLN A 274 2.005 3.866 -9.009 1.00 0.00 C ATOM 609 CG GLN A 274 0.559 3.450 -9.254 1.00 0.00 C ATOM 610 CD GLN A 274 0.429 2.093 -9.921 1.00 0.00 C ATOM 611 OE1 GLN A 274 0.411 1.996 -11.147 1.00 0.00 O ATOM 612 NE2 GLN A 274 0.336 1.040 -9.125 1.00 0.00 N ATOM 0 H GLN A 274 4.658 3.611 -7.700 1.00 0.00 H new ATOM 0 HA GLN A 274 1.821 3.536 -6.926 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.067 4.954 -9.026 1.00 0.00 H new ATOM 0 HB3 GLN A 274 2.622 3.498 -9.829 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.027 3.432 -8.303 1.00 0.00 H new ATOM 0 HG3 GLN A 274 0.073 4.201 -9.877 1.00 0.00 H new ATOM 0 HE21 GLN A 274 0.355 1.163 -8.113 1.00 0.00 H new ATOM 0 HE22 GLN A 274 0.245 0.106 -9.524 1.00 0.00 H new ATOM 621 N TRP A 275 2.641 1.181 -6.667 1.00 0.00 N ATOM 622 CA TRP A 275 3.118 -0.180 -6.520 1.00 0.00 C ATOM 623 C TRP A 275 2.044 -1.122 -6.009 1.00 0.00 C ATOM 624 O TRP A 275 0.944 -0.700 -5.635 1.00 0.00 O ATOM 625 CB TRP A 275 4.322 -0.216 -5.577 1.00 0.00 C ATOM 626 CG TRP A 275 4.367 0.885 -4.567 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.357 1.348 -3.773 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.522 1.645 -4.232 1.00 0.00 C ATOM 629 NE1 TRP A 275 3.817 2.388 -2.999 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.148 2.575 -3.258 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.837 1.628 -4.676 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.050 3.482 -2.721 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.734 2.523 -4.145 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.338 3.441 -3.175 1.00 0.00 C ATOM 0 H TRP A 275 2.100 1.530 -5.876 1.00 0.00 H new ATOM 0 HA TRP A 275 3.409 -0.523 -7.513 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.324 -1.171 -5.052 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.233 -0.178 -6.174 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.350 0.957 -3.755 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.258 2.931 -2.340 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.151 0.920 -5.429 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 5.745 4.196 -1.970 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.759 2.515 -4.484 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.063 4.134 -2.774 1.00 0.00 H new ATOM 645 N GLU A 276 2.384 -2.403 -5.993 1.00 0.00 N ATOM 646 CA GLU A 276 1.476 -3.430 -5.533 1.00 0.00 C ATOM 647 C GLU A 276 1.666 -3.638 -4.039 1.00 0.00 C ATOM 648 O GLU A 276 2.756 -4.002 -3.592 1.00 0.00 O ATOM 649 CB GLU A 276 1.785 -4.740 -6.253 1.00 0.00 C ATOM 650 CG GLU A 276 1.910 -4.629 -7.766 1.00 0.00 C ATOM 651 CD GLU A 276 0.597 -4.359 -8.462 1.00 0.00 C ATOM 652 OE1 GLU A 276 -0.264 -5.264 -8.487 1.00 0.00 O ATOM 653 OE2 GLU A 276 0.431 -3.256 -9.019 1.00 0.00 O ATOM 0 H GLU A 276 3.293 -2.753 -6.298 1.00 0.00 H new ATOM 0 HA GLU A 276 0.450 -3.124 -5.740 1.00 0.00 H new ATOM 0 HB2 GLU A 276 2.716 -5.145 -5.855 1.00 0.00 H new ATOM 0 HB3 GLU A 276 1.000 -5.459 -6.020 1.00 0.00 H new ATOM 0 HG2 GLU A 276 2.611 -3.829 -8.007 1.00 0.00 H new ATOM 0 HG3 GLU A 276 2.335 -5.554 -8.156 1.00 0.00 H new ATOM 660 N GLY A 277 0.590 -3.489 -3.284 1.00 0.00 N ATOM 661 CA GLY A 277 0.677 -3.569 -1.847 1.00 0.00 C ATOM 662 C GLY A 277 0.114 -4.878 -1.333 1.00 0.00 C ATOM 663 O GLY A 277 -0.620 -5.564 -2.049 1.00 0.00 O ATOM 0 H GLY A 277 -0.347 -3.313 -3.646 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.718 -3.472 -1.538 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.133 -2.737 -1.401 1.00 0.00 H new ATOM 667 N GLU A 278 0.456 -5.230 -0.110 1.00 0.00 N ATOM 668 CA GLU A 278 -0.107 -6.402 0.538 1.00 0.00 C ATOM 669 C GLU A 278 -0.106 -6.155 2.038 1.00 0.00 C ATOM 670 O GLU A 278 0.940 -5.913 2.630 1.00 0.00 O ATOM 671 CB GLU A 278 0.727 -7.642 0.183 1.00 0.00 C ATOM 672 CG GLU A 278 0.040 -8.981 0.429 1.00 0.00 C ATOM 673 CD GLU A 278 -0.220 -9.283 1.894 1.00 0.00 C ATOM 674 OE1 GLU A 278 0.748 -9.389 2.673 1.00 0.00 O ATOM 675 OE2 GLU A 278 -1.399 -9.439 2.270 1.00 0.00 O ATOM 0 H GLU A 278 1.127 -4.717 0.461 1.00 0.00 H new ATOM 0 HA GLU A 278 -1.128 -6.579 0.199 1.00 0.00 H new ATOM 0 HB2 GLU A 278 1.006 -7.583 -0.869 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.652 -7.615 0.760 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -0.909 -8.995 -0.108 1.00 0.00 H new ATOM 0 HG3 GLU A 278 0.656 -9.776 0.009 1.00 0.00 H new ATOM 682 N CYS A 279 -1.267 -6.179 2.657 1.00 0.00 N ATOM 683 CA CYS A 279 -1.332 -5.905 4.072 1.00 0.00 C ATOM 684 C CYS A 279 -1.965 -7.062 4.811 1.00 0.00 C ATOM 685 O CYS A 279 -3.188 -7.177 4.866 1.00 0.00 O ATOM 686 CB CYS A 279 -2.119 -4.620 4.335 1.00 0.00 C ATOM 687 SG CYS A 279 -2.297 -4.209 6.087 1.00 0.00 S ATOM 0 H CYS A 279 -2.162 -6.382 2.211 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.314 -5.773 4.439 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -1.623 -3.793 3.827 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -3.111 -4.717 3.893 1.00 0.00 H new ATOM 0 HG CYS A 279 -1.830 -3.015 6.302 1.00 0.00 H new ATOM 693 N ASN A 280 -1.110 -7.910 5.371 1.00 0.00 N ATOM 694 CA ASN A 280 -1.523 -8.960 6.293 1.00 0.00 C ATOM 695 C ASN A 280 -2.758 -9.717 5.797 1.00 0.00 C ATOM 696 O ASN A 280 -3.733 -9.893 6.532 1.00 0.00 O ATOM 697 CB ASN A 280 -1.767 -8.356 7.683 1.00 0.00 C ATOM 698 CG ASN A 280 -0.470 -7.982 8.387 1.00 0.00 C ATOM 699 OD1 ASN A 280 0.090 -8.786 9.132 1.00 0.00 O ATOM 700 ND2 ASN A 280 0.031 -6.771 8.154 1.00 0.00 N ATOM 0 H ASN A 280 -0.105 -7.888 5.197 1.00 0.00 H new ATOM 0 HA ASN A 280 -0.717 -9.692 6.353 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -2.394 -7.470 7.586 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -2.317 -9.070 8.295 1.00 0.00 H new ATOM 0 HD21 ASN A 280 0.904 -6.486 8.598 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -0.458 -6.128 7.531 1.00 0.00 H new ATOM 707 N GLY A 281 -2.713 -10.159 4.546 1.00 0.00 N ATOM 708 CA GLY A 281 -3.802 -10.941 3.999 1.00 0.00 C ATOM 709 C GLY A 281 -4.508 -10.263 2.842 1.00 0.00 C ATOM 710 O GLY A 281 -5.066 -10.934 1.976 1.00 0.00 O ATOM 0 H GLY A 281 -1.941 -9.989 3.901 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -3.416 -11.904 3.665 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -4.526 -11.144 4.788 1.00 0.00 H new ATOM 714 N LYS A 282 -4.487 -8.940 2.809 1.00 0.00 N ATOM 715 CA LYS A 282 -5.147 -8.211 1.733 1.00 0.00 C ATOM 716 C LYS A 282 -4.148 -7.882 0.632 1.00 0.00 C ATOM 717 O LYS A 282 -3.093 -7.312 0.896 1.00 0.00 O ATOM 718 CB LYS A 282 -5.779 -6.906 2.239 1.00 0.00 C ATOM 719 CG LYS A 282 -6.824 -7.071 3.336 1.00 0.00 C ATOM 720 CD LYS A 282 -6.182 -7.344 4.686 1.00 0.00 C ATOM 721 CE LYS A 282 -7.168 -7.180 5.832 1.00 0.00 C ATOM 722 NZ LYS A 282 -7.747 -5.811 5.873 1.00 0.00 N ATOM 0 H LYS A 282 -4.027 -8.353 3.505 1.00 0.00 H new ATOM 0 HA LYS A 282 -5.937 -8.852 1.343 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.986 -6.258 2.610 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -6.240 -6.394 1.395 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.432 -6.169 3.398 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -7.495 -7.891 3.079 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -5.779 -8.357 4.697 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -5.342 -6.665 4.831 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -7.970 -7.911 5.728 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -6.666 -7.390 6.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -8.071 -5.600 6.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -7.023 -5.119 5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -8.552 -5.755 5.218 1.00 0.00 H new ATOM 736 N ARG A 283 -4.491 -8.219 -0.603 1.00 0.00 N ATOM 737 CA ARG A 283 -3.618 -7.935 -1.733 1.00 0.00 C ATOM 738 C ARG A 283 -4.224 -6.826 -2.579 1.00 0.00 C ATOM 739 O ARG A 283 -5.430 -6.818 -2.834 1.00 0.00 O ATOM 740 CB ARG A 283 -3.381 -9.181 -2.598 1.00 0.00 C ATOM 741 CG ARG A 283 -2.720 -10.344 -1.867 1.00 0.00 C ATOM 742 CD ARG A 283 -3.724 -11.131 -1.047 1.00 0.00 C ATOM 743 NE ARG A 283 -4.724 -11.789 -1.889 1.00 0.00 N ATOM 744 CZ ARG A 283 -5.962 -12.082 -1.491 1.00 0.00 C ATOM 745 NH1 ARG A 283 -6.361 -11.794 -0.259 1.00 0.00 N ATOM 746 NH2 ARG A 283 -6.797 -12.682 -2.328 1.00 0.00 N ATOM 0 H ARG A 283 -5.364 -8.687 -0.848 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.652 -7.617 -1.340 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -4.338 -9.517 -2.998 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.759 -8.903 -3.449 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -2.242 -11.005 -2.590 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -1.934 -9.965 -1.214 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -3.200 -11.880 -0.454 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -4.224 -10.462 -0.346 1.00 0.00 H new ATOM 0 HE ARG A 283 -4.457 -12.039 -2.841 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -5.718 -11.344 0.393 1.00 0.00 H new ATOM 0 HH12 ARG A 283 -7.310 -12.022 0.036 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -6.491 -12.918 -3.272 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -7.745 -12.908 -2.028 1.00 0.00 H new ATOM 760 N GLY A 284 -3.392 -5.888 -2.995 1.00 0.00 N ATOM 761 CA GLY A 284 -3.881 -4.750 -3.752 1.00 0.00 C ATOM 762 C GLY A 284 -2.778 -4.032 -4.501 1.00 0.00 C ATOM 763 O GLY A 284 -1.648 -4.504 -4.552 1.00 0.00 O ATOM 0 H GLY A 284 -2.386 -5.891 -2.824 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -4.637 -5.088 -4.461 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -4.370 -4.050 -3.074 1.00 0.00 H new ATOM 767 N HIS A 285 -3.112 -2.889 -5.082 1.00 0.00 N ATOM 768 CA HIS A 285 -2.123 -2.004 -5.692 1.00 0.00 C ATOM 769 C HIS A 285 -2.580 -0.554 -5.522 1.00 0.00 C ATOM 770 O HIS A 285 -3.757 -0.252 -5.722 1.00 0.00 O ATOM 771 CB HIS A 285 -1.907 -2.332 -7.176 1.00 0.00 C ATOM 772 CG HIS A 285 -3.142 -2.312 -8.025 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.594 -1.185 -8.671 1.00 0.00 N ATOM 774 CD2 HIS A 285 -4.000 -3.304 -8.364 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.671 -1.482 -9.368 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.940 -2.763 -9.204 1.00 0.00 N ATOM 0 H HIS A 285 -4.071 -2.547 -5.145 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.166 -2.151 -5.190 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.192 -1.620 -7.588 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.452 -3.320 -7.250 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -3.953 -4.331 -8.034 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -5.240 -0.792 -9.973 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.717 -3.267 -9.631 1.00 0.00 H new ATOM 785 N PHE A 286 -1.667 0.335 -5.144 1.00 0.00 N ATOM 786 CA PHE A 286 -2.033 1.715 -4.813 1.00 0.00 C ATOM 787 C PHE A 286 -0.856 2.678 -5.012 1.00 0.00 C ATOM 788 O PHE A 286 0.302 2.262 -5.013 1.00 0.00 O ATOM 789 CB PHE A 286 -2.532 1.786 -3.367 1.00 0.00 C ATOM 790 CG PHE A 286 -4.031 1.715 -3.232 1.00 0.00 C ATOM 791 CD1 PHE A 286 -4.808 2.842 -3.435 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.656 0.531 -2.888 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.181 2.791 -3.300 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.034 0.474 -2.747 1.00 0.00 C ATOM 795 CZ PHE A 286 -6.794 1.606 -2.955 1.00 0.00 C ATOM 0 H PHE A 286 -0.672 0.130 -5.058 1.00 0.00 H new ATOM 0 HA PHE A 286 -2.829 2.023 -5.491 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.087 0.969 -2.799 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.181 2.715 -2.917 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.334 3.775 -3.703 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.065 -0.359 -2.727 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -6.774 3.679 -3.465 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.512 -0.456 -2.475 1.00 0.00 H new ATOM 0 HZ PHE A 286 -7.868 1.564 -2.848 1.00 0.00 H new ATOM 805 N PRO A 287 -1.150 3.988 -5.177 1.00 0.00 N ATOM 806 CA PRO A 287 -0.146 5.008 -5.453 1.00 0.00 C ATOM 807 C PRO A 287 0.361 5.738 -4.201 1.00 0.00 C ATOM 808 O PRO A 287 -0.246 5.679 -3.121 1.00 0.00 O ATOM 809 CB PRO A 287 -0.909 5.972 -6.363 1.00 0.00 C ATOM 810 CG PRO A 287 -2.359 5.809 -6.016 1.00 0.00 C ATOM 811 CD PRO A 287 -2.490 4.585 -5.138 1.00 0.00 C ATOM 0 HA PRO A 287 0.758 4.580 -5.885 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.583 7.000 -6.203 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.731 5.741 -7.413 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.729 6.693 -5.497 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -2.958 5.696 -6.920 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -2.782 4.850 -4.122 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.246 3.898 -5.518 1.00 0.00 H new ATOM 819 N PHE A 288 1.484 6.429 -4.385 1.00 0.00 N ATOM 820 CA PHE A 288 2.210 7.114 -3.314 1.00 0.00 C ATOM 821 C PHE A 288 1.512 8.396 -2.876 1.00 0.00 C ATOM 822 O PHE A 288 1.779 8.908 -1.790 1.00 0.00 O ATOM 823 CB PHE A 288 3.619 7.458 -3.809 1.00 0.00 C ATOM 824 CG PHE A 288 4.641 7.632 -2.722 1.00 0.00 C ATOM 825 CD1 PHE A 288 4.780 8.836 -2.049 1.00 0.00 C ATOM 826 CD2 PHE A 288 5.471 6.581 -2.383 1.00 0.00 C ATOM 827 CE1 PHE A 288 5.729 8.980 -1.054 1.00 0.00 C ATOM 828 CE2 PHE A 288 6.421 6.718 -1.393 1.00 0.00 C ATOM 829 CZ PHE A 288 6.551 7.920 -0.727 1.00 0.00 C ATOM 0 H PHE A 288 1.924 6.531 -5.299 1.00 0.00 H new ATOM 0 HA PHE A 288 2.249 6.444 -2.455 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.955 6.670 -4.482 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.570 8.377 -4.393 1.00 0.00 H new ATOM 0 HD1 PHE A 288 4.141 9.669 -2.304 1.00 0.00 H new ATOM 0 HD2 PHE A 288 5.374 5.638 -2.901 1.00 0.00 H new ATOM 0 HE1 PHE A 288 5.827 9.921 -0.533 1.00 0.00 H new ATOM 0 HE2 PHE A 288 7.062 5.887 -1.139 1.00 0.00 H new ATOM 0 HZ PHE A 288 7.294 8.031 0.049 1.00 0.00 H new ATOM 839 N THR A 289 0.622 8.903 -3.724 1.00 0.00 N ATOM 840 CA THR A 289 -0.057 10.181 -3.487 1.00 0.00 C ATOM 841 C THR A 289 -0.640 10.299 -2.074 1.00 0.00 C ATOM 842 O THR A 289 -0.811 11.402 -1.556 1.00 0.00 O ATOM 843 CB THR A 289 -1.184 10.405 -4.521 1.00 0.00 C ATOM 844 OG1 THR A 289 -1.798 11.686 -4.324 1.00 0.00 O ATOM 845 CG2 THR A 289 -2.244 9.315 -4.423 1.00 0.00 C ATOM 0 H THR A 289 0.349 8.444 -4.593 1.00 0.00 H new ATOM 0 HA THR A 289 0.708 10.950 -3.595 1.00 0.00 H new ATOM 0 HB THR A 289 -0.734 10.368 -5.513 1.00 0.00 H new ATOM 0 HG1 THR A 289 -2.508 11.814 -4.987 1.00 0.00 H new ATOM 0 HG21 THR A 289 -3.024 9.498 -5.162 1.00 0.00 H new ATOM 0 HG22 THR A 289 -1.786 8.344 -4.612 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.681 9.322 -3.425 1.00 0.00 H new ATOM 853 N HIS A 290 -0.931 9.172 -1.446 1.00 0.00 N ATOM 854 CA HIS A 290 -1.529 9.180 -0.126 1.00 0.00 C ATOM 855 C HIS A 290 -0.899 8.133 0.790 1.00 0.00 C ATOM 856 O HIS A 290 -1.603 7.357 1.440 1.00 0.00 O ATOM 857 CB HIS A 290 -3.048 8.994 -0.235 1.00 0.00 C ATOM 858 CG HIS A 290 -3.506 7.853 -1.095 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.700 7.877 -1.777 1.00 0.00 N ATOM 860 CD2 HIS A 290 -2.942 6.656 -1.376 1.00 0.00 C ATOM 861 CE1 HIS A 290 -4.855 6.752 -2.438 1.00 0.00 C ATOM 862 NE2 HIS A 290 -3.800 5.988 -2.220 1.00 0.00 N ATOM 0 H HIS A 290 -0.762 8.242 -1.830 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.332 10.150 0.330 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.451 8.853 0.768 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.481 9.915 -0.625 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -5.365 8.651 -1.771 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -1.995 6.292 -1.007 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -5.703 6.495 -3.056 1.00 0.00 H new ATOM 871 N VAL A 291 0.434 8.104 0.822 1.00 0.00 N ATOM 872 CA VAL A 291 1.164 7.250 1.756 1.00 0.00 C ATOM 873 C VAL A 291 2.430 7.942 2.265 1.00 0.00 C ATOM 874 O VAL A 291 2.974 8.835 1.612 1.00 0.00 O ATOM 875 CB VAL A 291 1.570 5.885 1.141 1.00 0.00 C ATOM 876 CG1 VAL A 291 0.353 5.062 0.762 1.00 0.00 C ATOM 877 CG2 VAL A 291 2.486 6.067 -0.056 1.00 0.00 C ATOM 0 H VAL A 291 1.029 8.663 0.211 1.00 0.00 H new ATOM 0 HA VAL A 291 0.474 7.066 2.579 1.00 0.00 H new ATOM 0 HB VAL A 291 2.120 5.339 1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.675 4.112 0.334 1.00 0.00 H new ATOM 0 HG12 VAL A 291 -0.250 4.874 1.650 1.00 0.00 H new ATOM 0 HG13 VAL A 291 -0.241 5.607 0.029 1.00 0.00 H new ATOM 0 HG21 VAL A 291 2.751 5.091 -0.463 1.00 0.00 H new ATOM 0 HG22 VAL A 291 1.974 6.652 -0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 291 3.391 6.589 0.255 1.00 0.00 H new ATOM 887 N ARG A 292 2.872 7.524 3.442 1.00 0.00 N ATOM 888 CA ARG A 292 4.131 7.959 4.022 1.00 0.00 C ATOM 889 C ARG A 292 4.963 6.714 4.260 1.00 0.00 C ATOM 890 O ARG A 292 4.641 5.890 5.106 1.00 0.00 O ATOM 891 CB ARG A 292 3.912 8.719 5.334 1.00 0.00 C ATOM 892 CG ARG A 292 2.958 9.900 5.218 1.00 0.00 C ATOM 893 CD ARG A 292 3.311 10.807 4.047 1.00 0.00 C ATOM 894 NE ARG A 292 4.689 11.290 4.109 1.00 0.00 N ATOM 895 CZ ARG A 292 5.531 11.266 3.077 1.00 0.00 C ATOM 896 NH1 ARG A 292 5.168 10.700 1.928 1.00 0.00 N ATOM 897 NH2 ARG A 292 6.748 11.781 3.205 1.00 0.00 N ATOM 0 H ARG A 292 2.359 6.865 4.027 1.00 0.00 H new ATOM 0 HA ARG A 292 4.639 8.647 3.346 1.00 0.00 H new ATOM 0 HB2 ARG A 292 3.526 8.027 6.082 1.00 0.00 H new ATOM 0 HB3 ARG A 292 4.875 9.078 5.698 1.00 0.00 H new ATOM 0 HG2 ARG A 292 1.939 9.532 5.097 1.00 0.00 H new ATOM 0 HG3 ARG A 292 2.981 10.477 6.143 1.00 0.00 H new ATOM 0 HD2 ARG A 292 3.161 10.265 3.113 1.00 0.00 H new ATOM 0 HD3 ARG A 292 2.631 11.659 4.033 1.00 0.00 H new ATOM 0 HE ARG A 292 5.026 11.668 4.995 1.00 0.00 H new ATOM 0 HH11 ARG A 292 4.242 10.283 1.835 1.00 0.00 H new ATOM 0 HH12 ARG A 292 5.816 10.684 1.140 1.00 0.00 H new ATOM 0 HH21 ARG A 292 7.036 12.194 4.092 1.00 0.00 H new ATOM 0 HH22 ARG A 292 7.395 11.764 2.416 1.00 0.00 H new ATOM 911 N LEU A 293 6.010 6.562 3.501 1.00 0.00 N ATOM 912 CA LEU A 293 6.628 5.294 3.324 1.00 0.00 C ATOM 913 C LEU A 293 7.790 5.034 4.270 1.00 0.00 C ATOM 914 O LEU A 293 8.721 5.836 4.367 1.00 0.00 O ATOM 915 CB LEU A 293 7.109 5.288 1.907 1.00 0.00 C ATOM 916 CG LEU A 293 7.129 3.945 1.255 1.00 0.00 C ATOM 917 CD1 LEU A 293 5.759 3.627 0.680 1.00 0.00 C ATOM 918 CD2 LEU A 293 8.204 3.911 0.195 1.00 0.00 C ATOM 0 H LEU A 293 6.456 7.323 2.988 1.00 0.00 H new ATOM 0 HA LEU A 293 5.911 4.504 3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 293 6.473 5.951 1.320 1.00 0.00 H new ATOM 0 HB3 LEU A 293 8.116 5.704 1.879 1.00 0.00 H new ATOM 0 HG LEU A 293 7.362 3.178 1.994 1.00 0.00 H new ATOM 0 HD11 LEU A 293 5.782 2.646 0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 293 5.020 3.626 1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 293 5.491 4.381 -0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 293 8.216 2.930 -0.279 1.00 0.00 H new ATOM 0 HD22 LEU A 293 7.999 4.674 -0.556 1.00 0.00 H new ATOM 0 HD23 LEU A 293 9.174 4.105 0.654 1.00 0.00 H new ATOM 930 N LEU A 294 7.726 3.909 4.966 1.00 0.00 N ATOM 931 CA LEU A 294 8.891 3.365 5.631 1.00 0.00 C ATOM 932 C LEU A 294 9.661 2.572 4.578 1.00 0.00 C ATOM 933 O LEU A 294 9.116 1.657 3.952 1.00 0.00 O ATOM 934 CB LEU A 294 8.503 2.454 6.809 1.00 0.00 C ATOM 935 CG LEU A 294 7.609 3.055 7.904 1.00 0.00 C ATOM 936 CD1 LEU A 294 7.560 4.560 7.809 1.00 0.00 C ATOM 937 CD2 LEU A 294 6.207 2.469 7.833 1.00 0.00 C ATOM 0 H LEU A 294 6.876 3.357 5.083 1.00 0.00 H new ATOM 0 HA LEU A 294 9.495 4.169 6.051 1.00 0.00 H new ATOM 0 HB2 LEU A 294 7.997 1.578 6.404 1.00 0.00 H new ATOM 0 HB3 LEU A 294 9.421 2.103 7.279 1.00 0.00 H new ATOM 0 HG LEU A 294 8.045 2.796 8.869 1.00 0.00 H new ATOM 0 HD11 LEU A 294 6.919 4.954 8.598 1.00 0.00 H new ATOM 0 HD12 LEU A 294 8.566 4.965 7.923 1.00 0.00 H new ATOM 0 HD13 LEU A 294 7.160 4.850 6.838 1.00 0.00 H new ATOM 0 HD21 LEU A 294 5.589 2.907 8.617 1.00 0.00 H new ATOM 0 HD22 LEU A 294 5.769 2.690 6.860 1.00 0.00 H new ATOM 0 HD23 LEU A 294 6.257 1.389 7.972 1.00 0.00 H new