USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=11 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 254 THR OG1 : rot -9:sc= 1.23 USER MOD Set 1.2: A 285 HIS : no HD1:sc= 0.502 K(o=1.7,f=-1.9!) USER MOD Single : A 239 TYR OH : rot 180:sc= 0 USER MOD Single : A 244 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 245 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 249 ASN : amide:sc= -0.113 K(o=-0.11,f=-2.2!) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ -157:sc= -0.958! (180deg=-1.72!) USER MOD Single : A 265 LYS NZ :NH3+ 178:sc= 0.079 (180deg=0.0457) USER MOD Single : A 267 THR OG1 : rot 180:sc= 0.0102 USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 270 ASN : amide:sc= -5.09! C(o=-5.1!,f=-11!) USER MOD Single : A 272 SER OG : rot 180:sc= 0 USER MOD Single : A 274 GLN : amide:sc= -1.36 X(o=-1.4,f=-1.4) USER MOD Single : A 279 CYS SG : rot 72:sc= 0.848 USER MOD Single : A 280 ASN : amide:sc= -1.78! K(o=-1.8!,f=-0.03) USER MOD Single : A 282 LYS NZ :NH3+ -177:sc= 0.741 (180deg=0.715) USER MOD Single : A 289 THR OG1 : rot 180:sc= 0 USER MOD Single : A 290 HIS : no HE2:sc= -4.5! C(o=-4.5!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 8 N PRO A 237 10.234 -5.591 0.371 1.00 0.00 N ATOM 9 CA PRO A 237 8.919 -5.002 0.517 1.00 0.00 C ATOM 10 C PRO A 237 8.949 -3.856 1.515 1.00 0.00 C ATOM 11 O PRO A 237 9.491 -3.997 2.615 1.00 0.00 O ATOM 12 CB PRO A 237 8.075 -6.169 1.063 1.00 0.00 C ATOM 13 CG PRO A 237 9.042 -7.267 1.403 1.00 0.00 C ATOM 14 CD PRO A 237 10.417 -6.664 1.339 1.00 0.00 C ATOM 0 HA PRO A 237 8.532 -4.583 -0.412 1.00 0.00 H new ATOM 0 HB2 PRO A 237 7.511 -5.862 1.943 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.351 -6.505 0.321 1.00 0.00 H new ATOM 0 HG2 PRO A 237 8.840 -7.667 2.397 1.00 0.00 H new ATOM 0 HG3 PRO A 237 8.949 -8.096 0.701 1.00 0.00 H new ATOM 0 HD2 PRO A 237 10.743 -6.287 2.309 1.00 0.00 H new ATOM 0 HD3 PRO A 237 11.164 -7.386 1.011 1.00 0.00 H new ATOM 22 N ILE A 238 8.377 -2.725 1.146 1.00 0.00 N ATOM 23 CA ILE A 238 8.358 -1.588 2.055 1.00 0.00 C ATOM 24 C ILE A 238 7.214 -1.740 3.037 1.00 0.00 C ATOM 25 O ILE A 238 6.249 -2.462 2.768 1.00 0.00 O ATOM 26 CB ILE A 238 8.201 -0.240 1.343 1.00 0.00 C ATOM 27 CG1 ILE A 238 6.740 0.073 1.056 1.00 0.00 C ATOM 28 CG2 ILE A 238 9.011 -0.216 0.060 1.00 0.00 C ATOM 29 CD1 ILE A 238 6.610 1.312 0.234 1.00 0.00 C ATOM 0 H ILE A 238 7.928 -2.567 0.244 1.00 0.00 H new ATOM 0 HA ILE A 238 9.324 -1.586 2.560 1.00 0.00 H new ATOM 0 HB ILE A 238 8.581 0.532 2.011 1.00 0.00 H new ATOM 0 HG12 ILE A 238 6.281 -0.765 0.532 1.00 0.00 H new ATOM 0 HG13 ILE A 238 6.200 0.197 1.995 1.00 0.00 H new ATOM 0 HG21 ILE A 238 8.886 0.749 -0.431 1.00 0.00 H new ATOM 0 HG22 ILE A 238 10.065 -0.372 0.292 1.00 0.00 H new ATOM 0 HG23 ILE A 238 8.665 -1.008 -0.604 1.00 0.00 H new ATOM 0 HD11 ILE A 238 5.556 1.513 0.043 1.00 0.00 H new ATOM 0 HD12 ILE A 238 7.048 2.153 0.771 1.00 0.00 H new ATOM 0 HD13 ILE A 238 7.131 1.176 -0.714 1.00 0.00 H new ATOM 41 N TYR A 239 7.303 -1.064 4.161 1.00 0.00 N ATOM 42 CA TYR A 239 6.164 -0.969 5.044 1.00 0.00 C ATOM 43 C TYR A 239 5.600 0.414 4.886 1.00 0.00 C ATOM 44 O TYR A 239 6.263 1.375 5.202 1.00 0.00 O ATOM 45 CB TYR A 239 6.568 -1.214 6.500 1.00 0.00 C ATOM 46 CG TYR A 239 6.772 -2.670 6.836 1.00 0.00 C ATOM 47 CD1 TYR A 239 5.717 -3.563 6.756 1.00 0.00 C ATOM 48 CD2 TYR A 239 8.010 -3.150 7.246 1.00 0.00 C ATOM 49 CE1 TYR A 239 5.882 -4.893 7.070 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.187 -4.485 7.561 1.00 0.00 C ATOM 51 CZ TYR A 239 7.120 -5.353 7.472 1.00 0.00 C ATOM 52 OH TYR A 239 7.292 -6.681 7.792 1.00 0.00 O ATOM 0 H TYR A 239 8.141 -0.578 4.482 1.00 0.00 H new ATOM 0 HA TYR A 239 5.425 -1.728 4.788 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.489 -0.670 6.709 1.00 0.00 H new ATOM 0 HB3 TYR A 239 5.800 -0.803 7.155 1.00 0.00 H new ATOM 0 HD1 TYR A 239 4.746 -3.209 6.441 1.00 0.00 H new ATOM 0 HD2 TYR A 239 8.846 -2.471 7.320 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.046 -5.574 7.002 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.156 -4.845 7.875 1.00 0.00 H new ATOM 0 HH TYR A 239 8.224 -6.836 8.054 1.00 0.00 H new ATOM 62 N ALA A 240 4.385 0.544 4.422 1.00 0.00 N ATOM 63 CA ALA A 240 3.893 1.864 4.109 1.00 0.00 C ATOM 64 C ALA A 240 2.774 2.262 5.036 1.00 0.00 C ATOM 65 O ALA A 240 1.707 1.652 5.050 1.00 0.00 O ATOM 66 CB ALA A 240 3.441 1.932 2.659 1.00 0.00 C ATOM 0 H ALA A 240 3.732 -0.222 4.255 1.00 0.00 H new ATOM 0 HA ALA A 240 4.710 2.572 4.251 1.00 0.00 H new ATOM 0 HB1 ALA A 240 3.073 2.934 2.439 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.282 1.703 2.005 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.644 1.208 2.492 1.00 0.00 H new ATOM 72 N ARG A 241 3.033 3.301 5.799 1.00 0.00 N ATOM 73 CA ARG A 241 2.039 3.874 6.667 1.00 0.00 C ATOM 74 C ARG A 241 1.057 4.660 5.814 1.00 0.00 C ATOM 75 O ARG A 241 1.340 5.771 5.364 1.00 0.00 O ATOM 76 CB ARG A 241 2.725 4.767 7.707 1.00 0.00 C ATOM 77 CG ARG A 241 1.751 5.551 8.574 1.00 0.00 C ATOM 78 CD ARG A 241 1.053 4.633 9.564 1.00 0.00 C ATOM 79 NE ARG A 241 1.990 4.116 10.560 1.00 0.00 N ATOM 80 CZ ARG A 241 1.720 3.145 11.428 1.00 0.00 C ATOM 81 NH1 ARG A 241 0.517 2.586 11.475 1.00 0.00 N ATOM 82 NH2 ARG A 241 2.662 2.741 12.265 1.00 0.00 N ATOM 0 H ARG A 241 3.939 3.769 5.832 1.00 0.00 H new ATOM 0 HA ARG A 241 1.494 3.098 7.205 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.352 4.148 8.348 1.00 0.00 H new ATOM 0 HB3 ARG A 241 3.386 5.466 7.194 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.285 6.335 9.111 1.00 0.00 H new ATOM 0 HG3 ARG A 241 1.011 6.044 7.944 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.251 5.176 10.064 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.591 3.802 9.030 1.00 0.00 H new ATOM 0 HE ARG A 241 2.921 4.531 10.592 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -0.216 2.900 10.840 1.00 0.00 H new ATOM 0 HH12 ARG A 241 0.326 1.842 12.147 1.00 0.00 H new ATOM 0 HH21 ARG A 241 3.585 3.174 12.241 1.00 0.00 H new ATOM 0 HH22 ARG A 241 2.465 1.997 12.934 1.00 0.00 H new ATOM 96 N VAL A 242 -0.093 4.070 5.564 1.00 0.00 N ATOM 97 CA VAL A 242 -1.057 4.688 4.681 1.00 0.00 C ATOM 98 C VAL A 242 -1.890 5.703 5.444 1.00 0.00 C ATOM 99 O VAL A 242 -2.489 5.388 6.470 1.00 0.00 O ATOM 100 CB VAL A 242 -1.957 3.653 3.970 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.674 2.766 4.967 1.00 0.00 C ATOM 102 CG2 VAL A 242 -2.958 4.356 3.072 1.00 0.00 C ATOM 0 H VAL A 242 -0.380 3.173 5.955 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.500 5.203 3.898 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.318 3.017 3.358 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.298 2.050 4.433 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.941 2.230 5.570 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.299 3.379 5.616 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.586 3.615 2.577 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.582 5.018 3.672 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.426 4.940 2.321 1.00 0.00 H new ATOM 112 N ILE A 243 -1.898 6.930 4.947 1.00 0.00 N ATOM 113 CA ILE A 243 -2.534 8.031 5.648 1.00 0.00 C ATOM 114 C ILE A 243 -3.889 8.382 5.053 1.00 0.00 C ATOM 115 O ILE A 243 -4.548 9.309 5.519 1.00 0.00 O ATOM 116 CB ILE A 243 -1.617 9.282 5.673 1.00 0.00 C ATOM 117 CG1 ILE A 243 -1.220 9.740 4.254 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.374 8.999 6.500 1.00 0.00 C ATOM 119 CD1 ILE A 243 -2.243 10.631 3.583 1.00 0.00 C ATOM 0 H ILE A 243 -1.469 7.187 4.058 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.699 7.698 6.673 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.182 10.094 6.130 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -0.270 10.272 4.308 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -1.057 8.860 3.632 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.264 9.883 6.512 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.665 8.748 7.520 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.172 8.163 6.062 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -1.888 10.909 2.590 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -3.189 10.096 3.494 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.390 11.531 4.181 1.00 0.00 H new ATOM 131 N GLN A 244 -4.312 7.641 4.032 1.00 0.00 N ATOM 132 CA GLN A 244 -5.557 7.952 3.348 1.00 0.00 C ATOM 133 C GLN A 244 -5.852 6.929 2.267 1.00 0.00 C ATOM 134 O GLN A 244 -5.278 6.980 1.179 1.00 0.00 O ATOM 135 CB GLN A 244 -5.483 9.343 2.728 1.00 0.00 C ATOM 136 CG GLN A 244 -6.797 9.820 2.139 1.00 0.00 C ATOM 137 CD GLN A 244 -6.734 11.255 1.668 1.00 0.00 C ATOM 138 OE1 GLN A 244 -5.982 12.066 2.211 1.00 0.00 O ATOM 139 NE2 GLN A 244 -7.525 11.576 0.662 1.00 0.00 N ATOM 0 H GLN A 244 -3.814 6.830 3.665 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.362 7.925 4.083 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -5.157 10.053 3.488 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -4.724 9.342 1.946 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -7.070 9.178 1.302 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -7.584 9.721 2.887 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -8.131 10.870 0.244 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -7.531 12.530 0.302 1.00 0.00 H new ATOM 148 N LYS A 245 -6.698 5.973 2.582 1.00 0.00 N ATOM 149 CA LYS A 245 -7.168 5.028 1.593 1.00 0.00 C ATOM 150 C LYS A 245 -8.611 4.630 1.890 1.00 0.00 C ATOM 151 O LYS A 245 -9.127 4.864 2.985 1.00 0.00 O ATOM 152 CB LYS A 245 -6.262 3.796 1.528 1.00 0.00 C ATOM 153 CG LYS A 245 -5.707 3.502 0.134 1.00 0.00 C ATOM 154 CD LYS A 245 -4.209 3.789 0.056 1.00 0.00 C ATOM 155 CE LYS A 245 -3.381 2.534 -0.218 1.00 0.00 C ATOM 156 NZ LYS A 245 -1.916 2.808 -0.169 1.00 0.00 N ATOM 0 H LYS A 245 -7.076 5.829 3.519 1.00 0.00 H new ATOM 0 HA LYS A 245 -7.134 5.510 0.616 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.429 3.934 2.217 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.822 2.928 1.875 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -5.892 2.458 -0.120 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -6.233 4.108 -0.604 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -4.024 4.520 -0.731 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -3.880 4.239 0.993 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.631 1.768 0.516 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -3.642 2.134 -1.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.392 1.930 -0.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -1.672 3.520 -0.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -1.661 3.165 0.774 1.00 0.00 H new ATOM 170 N ARG A 246 -9.246 4.058 0.887 1.00 0.00 N ATOM 171 CA ARG A 246 -10.627 3.597 0.962 1.00 0.00 C ATOM 172 C ARG A 246 -10.645 2.111 1.320 1.00 0.00 C ATOM 173 O ARG A 246 -9.599 1.535 1.600 1.00 0.00 O ATOM 174 CB ARG A 246 -11.323 3.836 -0.381 1.00 0.00 C ATOM 175 CG ARG A 246 -10.770 2.989 -1.513 1.00 0.00 C ATOM 176 CD ARG A 246 -11.428 3.331 -2.838 1.00 0.00 C ATOM 177 NE ARG A 246 -11.164 4.711 -3.234 1.00 0.00 N ATOM 178 CZ ARG A 246 -10.963 5.104 -4.489 1.00 0.00 C ATOM 179 NH1 ARG A 246 -11.029 4.228 -5.487 1.00 0.00 N ATOM 180 NH2 ARG A 246 -10.699 6.380 -4.743 1.00 0.00 N ATOM 0 H ARG A 246 -8.813 3.895 -0.022 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.161 4.152 1.733 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -12.387 3.629 -0.271 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -11.229 4.889 -0.647 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.694 3.142 -1.590 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.927 1.934 -1.289 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -11.062 2.655 -3.611 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -12.504 3.174 -2.761 1.00 0.00 H new ATOM 0 HE ARG A 246 -11.132 5.420 -2.501 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -11.235 3.248 -5.293 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -10.874 4.536 -6.447 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -10.651 7.053 -3.978 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -10.544 6.687 -5.703 1.00 0.00 H new ATOM 194 N VAL A 247 -11.820 1.485 1.321 1.00 0.00 N ATOM 195 CA VAL A 247 -11.924 0.063 1.654 1.00 0.00 C ATOM 196 C VAL A 247 -12.256 -0.785 0.417 1.00 0.00 C ATOM 197 O VAL A 247 -13.355 -1.327 0.290 1.00 0.00 O ATOM 198 CB VAL A 247 -12.961 -0.203 2.769 1.00 0.00 C ATOM 199 CG1 VAL A 247 -12.373 0.131 4.126 1.00 0.00 C ATOM 200 CG2 VAL A 247 -14.237 0.600 2.533 1.00 0.00 C ATOM 0 H VAL A 247 -12.708 1.934 1.097 1.00 0.00 H new ATOM 0 HA VAL A 247 -10.944 -0.234 2.028 1.00 0.00 H new ATOM 0 HB VAL A 247 -13.218 -1.262 2.747 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -13.115 -0.061 4.901 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -11.494 -0.488 4.304 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -12.087 1.183 4.150 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -14.949 0.394 3.332 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -14.001 1.664 2.523 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -14.674 0.316 1.575 1.00 0.00 H new ATOM 210 N PRO A 248 -11.297 -0.897 -0.513 1.00 0.00 N ATOM 211 CA PRO A 248 -11.414 -1.677 -1.724 1.00 0.00 C ATOM 212 C PRO A 248 -10.802 -3.065 -1.555 1.00 0.00 C ATOM 213 O PRO A 248 -9.623 -3.197 -1.232 1.00 0.00 O ATOM 214 CB PRO A 248 -10.605 -0.837 -2.713 1.00 0.00 C ATOM 215 CG PRO A 248 -9.614 -0.073 -1.883 1.00 0.00 C ATOM 216 CD PRO A 248 -9.981 -0.287 -0.449 1.00 0.00 C ATOM 0 HA PRO A 248 -12.444 -1.860 -2.031 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -10.099 -1.470 -3.442 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -11.251 -0.160 -3.272 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.600 -0.422 -2.077 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -9.640 0.988 -2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.264 -0.936 0.054 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -10.003 0.653 0.102 1.00 0.00 H new ATOM 224 N ASN A 249 -11.590 -4.095 -1.770 1.00 0.00 N ATOM 225 CA ASN A 249 -11.117 -5.455 -1.554 1.00 0.00 C ATOM 226 C ASN A 249 -10.266 -5.930 -2.728 1.00 0.00 C ATOM 227 O ASN A 249 -10.108 -5.222 -3.725 1.00 0.00 O ATOM 228 CB ASN A 249 -12.292 -6.415 -1.316 1.00 0.00 C ATOM 229 CG ASN A 249 -13.036 -6.133 -0.020 1.00 0.00 C ATOM 230 OD1 ASN A 249 -13.124 -4.992 0.435 1.00 0.00 O ATOM 231 ND2 ASN A 249 -13.576 -7.173 0.589 1.00 0.00 N ATOM 0 H ASN A 249 -12.555 -4.024 -2.092 1.00 0.00 H new ATOM 0 HA ASN A 249 -10.493 -5.452 -0.660 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -12.988 -6.342 -2.151 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -11.920 -7.439 -1.299 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -14.085 -7.044 1.464 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -13.484 -8.105 0.185 1.00 0.00 H new ATOM 238 N ALA A 250 -9.703 -7.127 -2.605 1.00 0.00 N ATOM 239 CA ALA A 250 -8.899 -7.723 -3.670 1.00 0.00 C ATOM 240 C ALA A 250 -9.744 -8.013 -4.910 1.00 0.00 C ATOM 241 O ALA A 250 -9.247 -8.510 -5.915 1.00 0.00 O ATOM 242 CB ALA A 250 -8.250 -8.999 -3.172 1.00 0.00 C ATOM 0 H ALA A 250 -9.789 -7.709 -1.772 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.126 -7.008 -3.952 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -7.652 -9.439 -3.970 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -7.608 -8.772 -2.321 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -9.022 -9.705 -2.866 1.00 0.00 H new ATOM 248 N TYR A 251 -11.023 -7.703 -4.828 1.00 0.00 N ATOM 249 CA TYR A 251 -11.925 -7.857 -5.943 1.00 0.00 C ATOM 250 C TYR A 251 -12.219 -6.499 -6.570 1.00 0.00 C ATOM 251 O TYR A 251 -13.082 -6.377 -7.437 1.00 0.00 O ATOM 252 CB TYR A 251 -13.209 -8.526 -5.483 1.00 0.00 C ATOM 253 CG TYR A 251 -12.997 -9.891 -4.871 1.00 0.00 C ATOM 254 CD1 TYR A 251 -12.482 -10.937 -5.626 1.00 0.00 C ATOM 255 CD2 TYR A 251 -13.313 -10.134 -3.541 1.00 0.00 C ATOM 256 CE1 TYR A 251 -12.288 -12.187 -5.071 1.00 0.00 C ATOM 257 CE2 TYR A 251 -13.121 -11.381 -2.980 1.00 0.00 C ATOM 258 CZ TYR A 251 -12.611 -12.404 -3.748 1.00 0.00 C ATOM 259 OH TYR A 251 -12.416 -13.647 -3.192 1.00 0.00 O ATOM 0 H TYR A 251 -11.463 -7.337 -3.984 1.00 0.00 H new ATOM 0 HA TYR A 251 -11.457 -8.489 -6.697 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -13.702 -7.883 -4.754 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -13.884 -8.620 -6.333 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -12.229 -10.770 -6.663 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -13.715 -9.335 -2.936 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -11.885 -12.990 -5.670 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -13.370 -11.553 -1.943 1.00 0.00 H new ATOM 0 HH TYR A 251 -12.693 -13.632 -2.252 1.00 0.00 H new ATOM 269 N ASP A 252 -11.487 -5.480 -6.124 1.00 0.00 N ATOM 270 CA ASP A 252 -11.624 -4.130 -6.678 1.00 0.00 C ATOM 271 C ASP A 252 -10.528 -3.910 -7.700 1.00 0.00 C ATOM 272 O ASP A 252 -9.776 -2.938 -7.626 1.00 0.00 O ATOM 273 CB ASP A 252 -11.512 -3.055 -5.583 1.00 0.00 C ATOM 274 CG ASP A 252 -12.210 -1.758 -5.958 1.00 0.00 C ATOM 275 OD1 ASP A 252 -11.625 -0.948 -6.709 1.00 0.00 O ATOM 276 OD2 ASP A 252 -13.350 -1.543 -5.493 1.00 0.00 O ATOM 0 H ASP A 252 -10.793 -5.561 -5.381 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.609 -4.045 -7.137 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -11.941 -3.439 -4.658 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -10.459 -2.852 -5.386 1.00 0.00 H new ATOM 281 N LYS A 253 -10.443 -4.828 -8.658 1.00 0.00 N ATOM 282 CA LYS A 253 -9.290 -4.910 -9.549 1.00 0.00 C ATOM 283 C LYS A 253 -8.051 -5.192 -8.706 1.00 0.00 C ATOM 284 O LYS A 253 -6.947 -4.783 -9.047 1.00 0.00 O ATOM 285 CB LYS A 253 -9.101 -3.626 -10.381 1.00 0.00 C ATOM 286 CG LYS A 253 -10.181 -3.386 -11.434 1.00 0.00 C ATOM 287 CD LYS A 253 -11.521 -2.980 -10.825 1.00 0.00 C ATOM 288 CE LYS A 253 -11.597 -1.488 -10.505 1.00 0.00 C ATOM 289 NZ LYS A 253 -10.545 -1.042 -9.549 1.00 0.00 N ATOM 0 H LYS A 253 -11.162 -5.529 -8.838 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.456 -5.716 -10.263 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -9.075 -2.771 -9.705 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -8.132 -3.670 -10.877 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -9.847 -2.607 -12.119 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -10.315 -4.293 -12.024 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -12.323 -3.240 -11.516 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -11.689 -3.552 -9.912 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -11.504 -0.919 -11.430 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -12.578 -1.261 -10.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -10.855 -0.170 -9.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -10.384 -1.785 -8.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -9.661 -0.859 -10.066 1.00 0.00 H new ATOM 303 N THR A 254 -8.296 -5.877 -7.583 1.00 0.00 N ATOM 304 CA THR A 254 -7.301 -6.210 -6.576 1.00 0.00 C ATOM 305 C THR A 254 -6.711 -4.952 -5.958 1.00 0.00 C ATOM 306 O THR A 254 -5.703 -4.405 -6.408 1.00 0.00 O ATOM 307 CB THR A 254 -6.192 -7.177 -7.063 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.281 -6.555 -7.980 1.00 0.00 O ATOM 309 CG2 THR A 254 -6.791 -8.406 -7.726 1.00 0.00 C ATOM 0 H THR A 254 -9.227 -6.223 -7.349 1.00 0.00 H new ATOM 0 HA THR A 254 -7.839 -6.764 -5.807 1.00 0.00 H new ATOM 0 HB THR A 254 -5.636 -7.468 -6.172 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.626 -5.675 -8.238 1.00 0.00 H new ATOM 0 HG21 THR A 254 -5.990 -9.067 -8.058 1.00 0.00 H new ATOM 0 HG22 THR A 254 -7.424 -8.933 -7.012 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.389 -8.101 -8.585 1.00 0.00 H new ATOM 317 N ALA A 255 -7.383 -4.473 -4.935 1.00 0.00 N ATOM 318 CA ALA A 255 -6.944 -3.283 -4.230 1.00 0.00 C ATOM 319 C ALA A 255 -6.752 -3.547 -2.735 1.00 0.00 C ATOM 320 O ALA A 255 -7.182 -4.575 -2.210 1.00 0.00 O ATOM 321 CB ALA A 255 -7.939 -2.169 -4.458 1.00 0.00 C ATOM 0 H ALA A 255 -8.239 -4.889 -4.569 1.00 0.00 H new ATOM 0 HA ALA A 255 -5.973 -2.986 -4.626 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.611 -1.274 -3.929 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -8.008 -1.955 -5.525 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -8.917 -2.473 -4.085 1.00 0.00 H new ATOM 327 N LEU A 256 -6.075 -2.613 -2.069 1.00 0.00 N ATOM 328 CA LEU A 256 -5.823 -2.695 -0.636 1.00 0.00 C ATOM 329 C LEU A 256 -6.948 -2.050 0.152 1.00 0.00 C ATOM 330 O LEU A 256 -7.138 -0.839 0.075 1.00 0.00 O ATOM 331 CB LEU A 256 -4.523 -1.978 -0.262 1.00 0.00 C ATOM 332 CG LEU A 256 -3.235 -2.751 -0.488 1.00 0.00 C ATOM 333 CD1 LEU A 256 -3.242 -4.039 0.319 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.056 -3.032 -1.955 1.00 0.00 C ATOM 0 H LEU A 256 -5.687 -1.779 -2.510 1.00 0.00 H new ATOM 0 HA LEU A 256 -5.750 -3.755 -0.391 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -4.469 -1.050 -0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -4.576 -1.703 0.791 1.00 0.00 H new ATOM 0 HG LEU A 256 -2.393 -2.148 -0.149 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -2.313 -4.582 0.146 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -3.333 -3.804 1.379 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -4.085 -4.657 0.011 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -2.130 -3.587 -2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -3.897 -3.623 -2.318 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -3.010 -2.091 -2.503 1.00 0.00 H new ATOM 346 N ALA A 257 -7.666 -2.850 0.922 1.00 0.00 N ATOM 347 CA ALA A 257 -8.732 -2.334 1.765 1.00 0.00 C ATOM 348 C ALA A 257 -8.173 -1.853 3.089 1.00 0.00 C ATOM 349 O ALA A 257 -8.129 -2.589 4.077 1.00 0.00 O ATOM 350 CB ALA A 257 -9.805 -3.382 1.963 1.00 0.00 C ATOM 0 H ALA A 257 -7.530 -3.859 0.981 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.192 -1.480 1.268 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.595 -2.979 2.596 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.223 -3.662 0.996 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.371 -4.261 2.439 1.00 0.00 H new ATOM 356 N LEU A 258 -7.756 -0.603 3.082 1.00 0.00 N ATOM 357 CA LEU A 258 -7.053 0.006 4.214 1.00 0.00 C ATOM 358 C LEU A 258 -7.309 1.510 4.235 1.00 0.00 C ATOM 359 O LEU A 258 -7.795 2.054 3.264 1.00 0.00 O ATOM 360 CB LEU A 258 -5.550 -0.312 4.127 1.00 0.00 C ATOM 361 CG LEU A 258 -5.000 -0.484 2.719 1.00 0.00 C ATOM 362 CD1 LEU A 258 -5.166 0.777 1.913 1.00 0.00 C ATOM 363 CD2 LEU A 258 -3.547 -0.870 2.762 1.00 0.00 C ATOM 0 H LEU A 258 -7.891 0.029 2.293 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.430 -0.410 5.148 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -4.997 0.488 4.619 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.356 -1.226 4.689 1.00 0.00 H new ATOM 0 HG LEU A 258 -5.568 -1.281 2.238 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.764 0.624 0.911 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -6.224 1.028 1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -4.630 1.592 2.399 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.172 -0.988 1.746 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -2.979 -0.091 3.270 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -3.436 -1.811 3.301 1.00 0.00 H new ATOM 375 N GLU A 259 -6.974 2.190 5.319 1.00 0.00 N ATOM 376 CA GLU A 259 -7.381 3.580 5.468 1.00 0.00 C ATOM 377 C GLU A 259 -6.295 4.423 6.126 1.00 0.00 C ATOM 378 O GLU A 259 -5.133 4.035 6.171 1.00 0.00 O ATOM 379 CB GLU A 259 -8.664 3.655 6.293 1.00 0.00 C ATOM 380 CG GLU A 259 -8.485 3.244 7.745 1.00 0.00 C ATOM 381 CD GLU A 259 -9.729 3.491 8.570 1.00 0.00 C ATOM 382 OE1 GLU A 259 -10.727 2.767 8.385 1.00 0.00 O ATOM 383 OE2 GLU A 259 -9.720 4.414 9.408 1.00 0.00 O ATOM 0 H GLU A 259 -6.432 1.813 6.096 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.555 3.984 4.471 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.048 4.675 6.259 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -9.418 3.015 5.834 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -8.225 2.186 7.791 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -7.650 3.797 8.176 1.00 0.00 H new ATOM 390 N VAL A 260 -6.692 5.583 6.639 1.00 0.00 N ATOM 391 CA VAL A 260 -5.769 6.485 7.313 1.00 0.00 C ATOM 392 C VAL A 260 -5.206 5.877 8.601 1.00 0.00 C ATOM 393 O VAL A 260 -5.943 5.517 9.517 1.00 0.00 O ATOM 394 CB VAL A 260 -6.437 7.846 7.630 1.00 0.00 C ATOM 395 CG1 VAL A 260 -7.777 7.648 8.326 1.00 0.00 C ATOM 396 CG2 VAL A 260 -5.513 8.712 8.477 1.00 0.00 C ATOM 0 H VAL A 260 -7.654 5.921 6.599 1.00 0.00 H new ATOM 0 HA VAL A 260 -4.942 6.648 6.622 1.00 0.00 H new ATOM 0 HB VAL A 260 -6.621 8.360 6.687 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -8.224 8.619 8.537 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -8.442 7.075 7.679 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -7.625 7.108 9.260 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -6.000 9.664 8.689 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -5.292 8.200 9.414 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -4.585 8.892 7.935 1.00 0.00 H new ATOM 406 N GLY A 261 -3.894 5.725 8.632 1.00 0.00 N ATOM 407 CA GLY A 261 -3.208 5.331 9.844 1.00 0.00 C ATOM 408 C GLY A 261 -2.740 3.898 9.786 1.00 0.00 C ATOM 409 O GLY A 261 -2.074 3.416 10.701 1.00 0.00 O ATOM 0 H GLY A 261 -3.283 5.869 7.828 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.352 5.986 10.006 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.874 5.461 10.697 1.00 0.00 H new ATOM 413 N GLU A 262 -3.065 3.223 8.697 1.00 0.00 N ATOM 414 CA GLU A 262 -2.826 1.793 8.598 1.00 0.00 C ATOM 415 C GLU A 262 -1.455 1.497 7.996 1.00 0.00 C ATOM 416 O GLU A 262 -0.682 2.412 7.708 1.00 0.00 O ATOM 417 CB GLU A 262 -3.934 1.135 7.783 1.00 0.00 C ATOM 418 CG GLU A 262 -5.306 1.329 8.397 1.00 0.00 C ATOM 419 CD GLU A 262 -6.180 0.101 8.257 1.00 0.00 C ATOM 420 OE1 GLU A 262 -6.876 -0.033 7.238 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.162 -0.750 9.174 1.00 0.00 O ATOM 0 H GLU A 262 -3.494 3.640 7.871 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.834 1.374 9.604 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -3.931 1.547 6.774 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.728 0.068 7.693 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -5.197 1.575 9.453 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.797 2.178 7.921 1.00 0.00 H new ATOM 428 N LEU A 263 -1.152 0.218 7.818 1.00 0.00 N ATOM 429 CA LEU A 263 0.151 -0.196 7.317 1.00 0.00 C ATOM 430 C LEU A 263 -0.009 -1.193 6.180 1.00 0.00 C ATOM 431 O LEU A 263 -0.585 -2.263 6.355 1.00 0.00 O ATOM 432 CB LEU A 263 0.981 -0.789 8.477 1.00 0.00 C ATOM 433 CG LEU A 263 2.426 -1.247 8.165 1.00 0.00 C ATOM 434 CD1 LEU A 263 2.460 -2.522 7.339 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.199 -0.138 7.474 1.00 0.00 C ATOM 0 H LEU A 263 -1.792 -0.552 8.014 1.00 0.00 H new ATOM 0 HA LEU A 263 0.681 0.669 6.919 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.029 -0.043 9.271 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.436 -1.645 8.876 1.00 0.00 H new ATOM 0 HG LEU A 263 2.907 -1.471 9.117 1.00 0.00 H new ATOM 0 HD11 LEU A 263 3.495 -2.803 7.146 1.00 0.00 H new ATOM 0 HD12 LEU A 263 1.962 -3.323 7.886 1.00 0.00 H new ATOM 0 HD13 LEU A 263 1.947 -2.356 6.392 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.213 -0.478 7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 263 2.702 0.125 6.540 1.00 0.00 H new ATOM 0 HD23 LEU A 263 3.238 0.737 8.123 1.00 0.00 H new ATOM 447 N VAL A 264 0.508 -0.834 5.017 1.00 0.00 N ATOM 448 CA VAL A 264 0.507 -1.723 3.871 1.00 0.00 C ATOM 449 C VAL A 264 1.934 -2.089 3.473 1.00 0.00 C ATOM 450 O VAL A 264 2.731 -1.232 3.102 1.00 0.00 O ATOM 451 CB VAL A 264 -0.244 -1.112 2.662 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.206 0.316 2.387 1.00 0.00 C ATOM 453 CG2 VAL A 264 -0.059 -1.976 1.423 1.00 0.00 C ATOM 0 H VAL A 264 0.937 0.075 4.843 1.00 0.00 H new ATOM 0 HA VAL A 264 -0.024 -2.627 4.167 1.00 0.00 H new ATOM 0 HB VAL A 264 -1.304 -1.084 2.914 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -0.342 0.712 1.532 1.00 0.00 H new ATOM 0 HG12 VAL A 264 0.009 0.935 3.263 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.274 0.325 2.169 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.594 -1.530 0.585 1.00 0.00 H new ATOM 0 HG22 VAL A 264 1.002 -2.043 1.182 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -0.452 -2.975 1.614 1.00 0.00 H new ATOM 463 N LYS A 265 2.252 -3.364 3.570 1.00 0.00 N ATOM 464 CA LYS A 265 3.565 -3.854 3.205 1.00 0.00 C ATOM 465 C LYS A 265 3.567 -4.226 1.726 1.00 0.00 C ATOM 466 O LYS A 265 3.089 -5.295 1.345 1.00 0.00 O ATOM 467 CB LYS A 265 3.931 -5.055 4.093 1.00 0.00 C ATOM 468 CG LYS A 265 5.318 -5.628 3.846 1.00 0.00 C ATOM 469 CD LYS A 265 5.284 -6.794 2.874 1.00 0.00 C ATOM 470 CE LYS A 265 5.041 -8.124 3.572 1.00 0.00 C ATOM 471 NZ LYS A 265 3.681 -8.226 4.174 1.00 0.00 N ATOM 0 H LYS A 265 1.612 -4.085 3.902 1.00 0.00 H new ATOM 0 HA LYS A 265 4.317 -3.081 3.363 1.00 0.00 H new ATOM 0 HB2 LYS A 265 3.858 -4.753 5.138 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.194 -5.843 3.937 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.969 -4.847 3.453 1.00 0.00 H new ATOM 0 HG3 LYS A 265 5.749 -5.956 4.792 1.00 0.00 H new ATOM 0 HD2 LYS A 265 4.500 -6.625 2.136 1.00 0.00 H new ATOM 0 HD3 LYS A 265 6.228 -6.839 2.331 1.00 0.00 H new ATOM 0 HE2 LYS A 265 5.177 -8.934 2.856 1.00 0.00 H new ATOM 0 HE3 LYS A 265 5.789 -8.260 4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 3.562 -9.165 4.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 3.568 -7.493 4.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 2.963 -8.091 3.434 1.00 0.00 H new ATOM 485 N VAL A 266 4.068 -3.334 0.882 1.00 0.00 N ATOM 486 CA VAL A 266 4.037 -3.575 -0.548 1.00 0.00 C ATOM 487 C VAL A 266 5.149 -4.526 -0.964 1.00 0.00 C ATOM 488 O VAL A 266 6.335 -4.288 -0.704 1.00 0.00 O ATOM 489 CB VAL A 266 4.082 -2.265 -1.370 1.00 0.00 C ATOM 490 CG1 VAL A 266 3.039 -1.295 -0.859 1.00 0.00 C ATOM 491 CG2 VAL A 266 5.453 -1.618 -1.366 1.00 0.00 C ATOM 0 H VAL A 266 4.494 -2.450 1.160 1.00 0.00 H new ATOM 0 HA VAL A 266 3.081 -4.049 -0.770 1.00 0.00 H new ATOM 0 HB VAL A 266 3.861 -2.527 -2.405 1.00 0.00 H new ATOM 0 HG11 VAL A 266 3.079 -0.376 -1.444 1.00 0.00 H new ATOM 0 HG12 VAL A 266 2.049 -1.742 -0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.236 -1.067 0.188 1.00 0.00 H new ATOM 0 HG21 VAL A 266 5.425 -0.703 -1.958 1.00 0.00 H new ATOM 0 HG22 VAL A 266 5.740 -1.379 -0.342 1.00 0.00 H new ATOM 0 HG23 VAL A 266 6.181 -2.306 -1.795 1.00 0.00 H new ATOM 501 N THR A 267 4.736 -5.618 -1.591 1.00 0.00 N ATOM 502 CA THR A 267 5.633 -6.692 -1.962 1.00 0.00 C ATOM 503 C THR A 267 6.277 -6.435 -3.311 1.00 0.00 C ATOM 504 O THR A 267 7.321 -7.008 -3.630 1.00 0.00 O ATOM 505 CB THR A 267 4.874 -8.031 -2.001 1.00 0.00 C ATOM 506 OG1 THR A 267 3.711 -7.904 -2.834 1.00 0.00 O ATOM 507 CG2 THR A 267 4.455 -8.450 -0.601 1.00 0.00 C ATOM 0 H THR A 267 3.764 -5.780 -1.856 1.00 0.00 H new ATOM 0 HA THR A 267 6.420 -6.740 -1.209 1.00 0.00 H new ATOM 0 HB THR A 267 5.536 -8.794 -2.410 1.00 0.00 H new ATOM 0 HG1 THR A 267 3.231 -8.758 -2.858 1.00 0.00 H new ATOM 0 HG21 THR A 267 3.920 -9.398 -0.650 1.00 0.00 H new ATOM 0 HG22 THR A 267 5.340 -8.564 0.025 1.00 0.00 H new ATOM 0 HG23 THR A 267 3.804 -7.688 -0.173 1.00 0.00 H new ATOM 515 N LYS A 268 5.675 -5.560 -4.098 1.00 0.00 N ATOM 516 CA LYS A 268 6.210 -5.277 -5.411 1.00 0.00 C ATOM 517 C LYS A 268 6.485 -3.799 -5.526 1.00 0.00 C ATOM 518 O LYS A 268 5.564 -2.997 -5.662 1.00 0.00 O ATOM 519 CB LYS A 268 5.240 -5.734 -6.498 1.00 0.00 C ATOM 520 CG LYS A 268 5.894 -5.970 -7.853 1.00 0.00 C ATOM 521 CD LYS A 268 6.806 -7.195 -7.835 1.00 0.00 C ATOM 522 CE LYS A 268 8.203 -6.869 -7.328 1.00 0.00 C ATOM 523 NZ LYS A 268 9.078 -8.071 -7.283 1.00 0.00 N ATOM 0 H LYS A 268 4.830 -5.043 -3.854 1.00 0.00 H new ATOM 0 HA LYS A 268 7.142 -5.826 -5.547 1.00 0.00 H new ATOM 0 HB2 LYS A 268 4.756 -6.655 -6.174 1.00 0.00 H new ATOM 0 HB3 LYS A 268 4.457 -4.984 -6.610 1.00 0.00 H new ATOM 0 HG2 LYS A 268 5.122 -6.102 -8.611 1.00 0.00 H new ATOM 0 HG3 LYS A 268 6.472 -5.090 -8.136 1.00 0.00 H new ATOM 0 HD2 LYS A 268 6.363 -7.965 -7.203 1.00 0.00 H new ATOM 0 HD3 LYS A 268 6.875 -7.609 -8.841 1.00 0.00 H new ATOM 0 HE2 LYS A 268 8.656 -6.116 -7.973 1.00 0.00 H new ATOM 0 HE3 LYS A 268 8.134 -6.434 -6.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 10.019 -7.802 -6.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 8.661 -8.780 -6.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 9.166 -8.472 -8.239 1.00 0.00 H new ATOM 537 N ILE A 269 7.757 -3.450 -5.479 1.00 0.00 N ATOM 538 CA ILE A 269 8.164 -2.059 -5.422 1.00 0.00 C ATOM 539 C ILE A 269 8.472 -1.470 -6.794 1.00 0.00 C ATOM 540 O ILE A 269 8.733 -2.191 -7.757 1.00 0.00 O ATOM 541 CB ILE A 269 9.351 -1.851 -4.451 1.00 0.00 C ATOM 542 CG1 ILE A 269 10.350 -3.010 -4.513 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.817 -1.723 -3.041 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.764 -3.377 -5.914 1.00 0.00 C ATOM 0 H ILE A 269 8.530 -4.115 -5.479 1.00 0.00 H new ATOM 0 HA ILE A 269 7.305 -1.512 -5.033 1.00 0.00 H new ATOM 0 HB ILE A 269 9.877 -0.944 -4.748 1.00 0.00 H new ATOM 0 HG12 ILE A 269 11.238 -2.744 -3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 269 9.910 -3.884 -4.033 1.00 0.00 H new ATOM 0 HG21 ILE A 269 9.647 -1.576 -2.350 1.00 0.00 H new ATOM 0 HG22 ILE A 269 8.142 -0.869 -2.984 1.00 0.00 H new ATOM 0 HG23 ILE A 269 8.277 -2.631 -2.772 1.00 0.00 H new ATOM 0 HD11 ILE A 269 11.472 -4.205 -5.879 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.886 -3.675 -6.487 1.00 0.00 H new ATOM 0 HD13 ILE A 269 11.234 -2.517 -6.391 1.00 0.00 H new ATOM 556 N ASN A 270 8.386 -0.152 -6.875 1.00 0.00 N ATOM 557 CA ASN A 270 8.631 0.563 -8.120 1.00 0.00 C ATOM 558 C ASN A 270 9.269 1.915 -7.820 1.00 0.00 C ATOM 559 O ASN A 270 9.485 2.254 -6.657 1.00 0.00 O ATOM 560 CB ASN A 270 7.326 0.715 -8.907 1.00 0.00 C ATOM 561 CG ASN A 270 6.446 1.840 -8.414 1.00 0.00 C ATOM 562 OD1 ASN A 270 6.433 2.931 -8.973 1.00 0.00 O ATOM 563 ND2 ASN A 270 5.718 1.589 -7.352 1.00 0.00 N ATOM 0 H ASN A 270 8.146 0.450 -6.087 1.00 0.00 H new ATOM 0 HA ASN A 270 9.324 -0.007 -8.739 1.00 0.00 H new ATOM 0 HB2 ASN A 270 7.563 0.885 -9.957 1.00 0.00 H new ATOM 0 HB3 ASN A 270 6.769 -0.220 -8.853 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.115 2.314 -6.964 1.00 0.00 H new ATOM 0 HD22 ASN A 270 5.755 0.669 -6.914 1.00 0.00 H new ATOM 570 N VAL A 271 9.559 2.690 -8.858 1.00 0.00 N ATOM 571 CA VAL A 271 10.288 3.945 -8.690 1.00 0.00 C ATOM 572 C VAL A 271 9.346 5.149 -8.533 1.00 0.00 C ATOM 573 O VAL A 271 9.751 6.200 -8.038 1.00 0.00 O ATOM 574 CB VAL A 271 11.255 4.179 -9.875 1.00 0.00 C ATOM 575 CG1 VAL A 271 10.495 4.436 -11.170 1.00 0.00 C ATOM 576 CG2 VAL A 271 12.220 5.317 -9.581 1.00 0.00 C ATOM 0 H VAL A 271 9.303 2.475 -9.822 1.00 0.00 H new ATOM 0 HA VAL A 271 10.864 3.855 -7.769 1.00 0.00 H new ATOM 0 HB VAL A 271 11.838 3.267 -10.005 1.00 0.00 H new ATOM 0 HG11 VAL A 271 11.204 4.596 -11.982 1.00 0.00 H new ATOM 0 HG12 VAL A 271 9.868 3.575 -11.401 1.00 0.00 H new ATOM 0 HG13 VAL A 271 9.869 5.321 -11.055 1.00 0.00 H new ATOM 0 HG21 VAL A 271 12.887 5.458 -10.432 1.00 0.00 H new ATOM 0 HG22 VAL A 271 11.658 6.234 -9.405 1.00 0.00 H new ATOM 0 HG23 VAL A 271 12.808 5.076 -8.695 1.00 0.00 H new ATOM 586 N SER A 272 8.094 4.995 -8.941 1.00 0.00 N ATOM 587 CA SER A 272 7.140 6.102 -8.915 1.00 0.00 C ATOM 588 C SER A 272 6.299 6.109 -7.636 1.00 0.00 C ATOM 589 O SER A 272 5.941 7.168 -7.122 1.00 0.00 O ATOM 590 CB SER A 272 6.222 6.020 -10.133 1.00 0.00 C ATOM 591 OG SER A 272 6.972 6.007 -11.336 1.00 0.00 O ATOM 0 H SER A 272 7.713 4.117 -9.294 1.00 0.00 H new ATOM 0 HA SER A 272 7.712 7.029 -8.938 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.611 5.120 -10.072 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.539 6.869 -10.136 1.00 0.00 H new ATOM 0 HG SER A 272 6.362 5.952 -12.101 1.00 0.00 H new ATOM 597 N GLY A 273 5.978 4.925 -7.132 1.00 0.00 N ATOM 598 CA GLY A 273 5.137 4.826 -5.958 1.00 0.00 C ATOM 599 C GLY A 273 3.816 4.153 -6.264 1.00 0.00 C ATOM 600 O GLY A 273 2.991 3.951 -5.381 1.00 0.00 O ATOM 0 H GLY A 273 6.286 4.032 -7.516 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.660 4.264 -5.184 1.00 0.00 H new ATOM 0 HA3 GLY A 273 4.952 5.823 -5.559 1.00 0.00 H new ATOM 604 N GLN A 274 3.611 3.821 -7.529 1.00 0.00 N ATOM 605 CA GLN A 274 2.431 3.074 -7.948 1.00 0.00 C ATOM 606 C GLN A 274 2.732 1.586 -7.881 1.00 0.00 C ATOM 607 O GLN A 274 2.991 0.942 -8.899 1.00 0.00 O ATOM 608 CB GLN A 274 2.007 3.462 -9.371 1.00 0.00 C ATOM 609 CG GLN A 274 1.391 4.852 -9.491 1.00 0.00 C ATOM 610 CD GLN A 274 2.380 5.975 -9.237 1.00 0.00 C ATOM 611 OE1 GLN A 274 3.038 6.456 -10.153 1.00 0.00 O ATOM 612 NE2 GLN A 274 2.498 6.393 -7.986 1.00 0.00 N ATOM 0 H GLN A 274 4.249 4.058 -8.289 1.00 0.00 H new ATOM 0 HA GLN A 274 1.607 3.315 -7.277 1.00 0.00 H new ATOM 0 HB2 GLN A 274 2.878 3.407 -10.024 1.00 0.00 H new ATOM 0 HB3 GLN A 274 1.289 2.728 -9.735 1.00 0.00 H new ATOM 0 HG2 GLN A 274 0.969 4.969 -10.489 1.00 0.00 H new ATOM 0 HG3 GLN A 274 0.566 4.938 -8.784 1.00 0.00 H new ATOM 0 HE21 GLN A 274 1.933 5.968 -7.251 1.00 0.00 H new ATOM 0 HE22 GLN A 274 3.154 7.140 -7.758 1.00 0.00 H new ATOM 621 N TRP A 275 2.726 1.047 -6.675 1.00 0.00 N ATOM 622 CA TRP A 275 3.173 -0.320 -6.458 1.00 0.00 C ATOM 623 C TRP A 275 2.049 -1.209 -5.986 1.00 0.00 C ATOM 624 O TRP A 275 0.941 -0.749 -5.694 1.00 0.00 O ATOM 625 CB TRP A 275 4.328 -0.388 -5.453 1.00 0.00 C ATOM 626 CG TRP A 275 4.398 0.738 -4.475 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.385 1.293 -3.749 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.584 1.433 -4.110 1.00 0.00 C ATOM 629 NE1 TRP A 275 3.878 2.313 -2.974 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.228 2.410 -3.176 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.919 1.323 -4.499 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.160 3.270 -2.617 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.845 2.174 -3.948 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.464 3.141 -3.014 1.00 0.00 C ATOM 0 H TRP A 275 2.418 1.532 -5.832 1.00 0.00 H new ATOM 0 HA TRP A 275 3.525 -0.681 -7.424 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.249 -1.323 -4.898 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.266 -0.424 -6.007 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.352 0.978 -3.779 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.328 2.903 -2.349 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.220 0.580 -5.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 5.868 4.016 -1.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.882 2.095 -4.240 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.212 3.799 -2.597 1.00 0.00 H new ATOM 645 N GLU A 276 2.353 -2.491 -5.909 1.00 0.00 N ATOM 646 CA GLU A 276 1.389 -3.466 -5.467 1.00 0.00 C ATOM 647 C GLU A 276 1.603 -3.743 -3.994 1.00 0.00 C ATOM 648 O GLU A 276 2.708 -4.102 -3.563 1.00 0.00 O ATOM 649 CB GLU A 276 1.513 -4.737 -6.304 1.00 0.00 C ATOM 650 CG GLU A 276 1.402 -4.460 -7.795 1.00 0.00 C ATOM 651 CD GLU A 276 1.512 -5.705 -8.644 1.00 0.00 C ATOM 652 OE1 GLU A 276 2.644 -6.076 -9.025 1.00 0.00 O ATOM 653 OE2 GLU A 276 0.461 -6.300 -8.961 1.00 0.00 O ATOM 0 H GLU A 276 3.266 -2.877 -6.149 1.00 0.00 H new ATOM 0 HA GLU A 276 0.378 -3.082 -5.601 1.00 0.00 H new ATOM 0 HB2 GLU A 276 2.471 -5.214 -6.096 1.00 0.00 H new ATOM 0 HB3 GLU A 276 0.735 -5.441 -6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.448 -3.974 -7.997 1.00 0.00 H new ATOM 0 HG3 GLU A 276 2.184 -3.759 -8.087 1.00 0.00 H new ATOM 660 N GLY A 277 0.531 -3.582 -3.242 1.00 0.00 N ATOM 661 CA GLY A 277 0.606 -3.596 -1.807 1.00 0.00 C ATOM 662 C GLY A 277 -0.057 -4.810 -1.206 1.00 0.00 C ATOM 663 O GLY A 277 -0.946 -5.408 -1.814 1.00 0.00 O ATOM 0 H GLY A 277 -0.408 -3.439 -3.613 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.652 -3.568 -1.501 1.00 0.00 H new ATOM 0 HA3 GLY A 277 0.134 -2.696 -1.413 1.00 0.00 H new ATOM 667 N GLU A 278 0.379 -5.176 -0.018 1.00 0.00 N ATOM 668 CA GLU A 278 -0.240 -6.246 0.733 1.00 0.00 C ATOM 669 C GLU A 278 -0.301 -5.832 2.200 1.00 0.00 C ATOM 670 O GLU A 278 0.721 -5.566 2.826 1.00 0.00 O ATOM 671 CB GLU A 278 0.552 -7.544 0.520 1.00 0.00 C ATOM 672 CG GLU A 278 -0.047 -8.787 1.161 1.00 0.00 C ATOM 673 CD GLU A 278 0.164 -8.858 2.659 1.00 0.00 C ATOM 674 OE1 GLU A 278 1.329 -8.790 3.105 1.00 0.00 O ATOM 675 OE2 GLU A 278 -0.829 -8.990 3.401 1.00 0.00 O ATOM 0 H GLU A 278 1.172 -4.740 0.453 1.00 0.00 H new ATOM 0 HA GLU A 278 -1.258 -6.433 0.391 1.00 0.00 H new ATOM 0 HB2 GLU A 278 0.648 -7.719 -0.552 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.559 -7.403 0.912 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -1.116 -8.814 0.951 1.00 0.00 H new ATOM 0 HG3 GLU A 278 0.391 -9.671 0.698 1.00 0.00 H new ATOM 682 N CYS A 279 -1.502 -5.760 2.737 1.00 0.00 N ATOM 683 CA CYS A 279 -1.706 -5.242 4.073 1.00 0.00 C ATOM 684 C CYS A 279 -2.439 -6.249 4.935 1.00 0.00 C ATOM 685 O CYS A 279 -3.654 -6.385 4.834 1.00 0.00 O ATOM 686 CB CYS A 279 -2.505 -3.939 4.001 1.00 0.00 C ATOM 687 SG CYS A 279 -3.110 -3.335 5.596 1.00 0.00 S ATOM 0 H CYS A 279 -2.356 -6.056 2.264 1.00 0.00 H new ATOM 0 HA CYS A 279 -0.733 -5.049 4.524 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -1.879 -3.169 3.550 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -3.357 -4.087 3.337 1.00 0.00 H new ATOM 0 HG CYS A 279 -2.114 -2.870 6.290 1.00 0.00 H new ATOM 693 N ASN A 280 -1.681 -6.965 5.758 1.00 0.00 N ATOM 694 CA ASN A 280 -2.249 -7.836 6.787 1.00 0.00 C ATOM 695 C ASN A 280 -3.296 -8.791 6.205 1.00 0.00 C ATOM 696 O ASN A 280 -4.324 -9.063 6.832 1.00 0.00 O ATOM 697 CB ASN A 280 -2.873 -6.996 7.917 1.00 0.00 C ATOM 698 CG ASN A 280 -1.856 -6.307 8.819 1.00 0.00 C ATOM 699 OD1 ASN A 280 -2.109 -6.115 10.010 1.00 0.00 O ATOM 700 ND2 ASN A 280 -0.720 -5.899 8.271 1.00 0.00 N ATOM 0 H ASN A 280 -0.661 -6.960 5.733 1.00 0.00 H new ATOM 0 HA ASN A 280 -1.435 -8.437 7.193 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -3.522 -6.239 7.476 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -3.505 -7.641 8.527 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -0.026 -5.411 8.838 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -0.539 -6.073 7.282 1.00 0.00 H new ATOM 707 N GLY A 281 -3.041 -9.288 4.999 1.00 0.00 N ATOM 708 CA GLY A 281 -3.966 -10.212 4.370 1.00 0.00 C ATOM 709 C GLY A 281 -4.605 -9.654 3.112 1.00 0.00 C ATOM 710 O GLY A 281 -5.015 -10.415 2.235 1.00 0.00 O ATOM 0 H GLY A 281 -2.212 -9.068 4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -3.438 -11.133 4.124 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -4.749 -10.474 5.082 1.00 0.00 H new ATOM 714 N LYS A 282 -4.709 -8.333 3.023 1.00 0.00 N ATOM 715 CA LYS A 282 -5.268 -7.685 1.838 1.00 0.00 C ATOM 716 C LYS A 282 -4.194 -7.575 0.759 1.00 0.00 C ATOM 717 O LYS A 282 -3.057 -7.240 1.061 1.00 0.00 O ATOM 718 CB LYS A 282 -5.804 -6.277 2.165 1.00 0.00 C ATOM 719 CG LYS A 282 -6.976 -6.233 3.145 1.00 0.00 C ATOM 720 CD LYS A 282 -6.551 -6.578 4.563 1.00 0.00 C ATOM 721 CE LYS A 282 -7.604 -6.192 5.591 1.00 0.00 C ATOM 722 NZ LYS A 282 -7.718 -4.717 5.755 1.00 0.00 N ATOM 0 H LYS A 282 -4.414 -7.688 3.756 1.00 0.00 H new ATOM 0 HA LYS A 282 -6.099 -8.295 1.483 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -4.988 -5.682 2.574 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -6.112 -5.799 1.235 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.421 -5.238 3.133 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -7.747 -6.931 2.818 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -6.355 -7.648 4.631 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -5.616 -6.067 4.794 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -8.570 -6.598 5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -7.355 -6.644 6.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -8.410 -4.503 6.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -6.792 -4.325 6.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -8.031 -4.291 4.859 1.00 0.00 H new ATOM 736 N ARG A 283 -4.534 -7.861 -0.491 1.00 0.00 N ATOM 737 CA ARG A 283 -3.558 -7.726 -1.573 1.00 0.00 C ATOM 738 C ARG A 283 -4.119 -6.883 -2.709 1.00 0.00 C ATOM 739 O ARG A 283 -5.294 -7.003 -3.057 1.00 0.00 O ATOM 740 CB ARG A 283 -3.122 -9.088 -2.124 1.00 0.00 C ATOM 741 CG ARG A 283 -2.606 -10.044 -1.065 1.00 0.00 C ATOM 742 CD ARG A 283 -3.701 -10.986 -0.608 1.00 0.00 C ATOM 743 NE ARG A 283 -3.972 -12.020 -1.607 1.00 0.00 N ATOM 744 CZ ARG A 283 -5.185 -12.354 -2.044 1.00 0.00 C ATOM 745 NH1 ARG A 283 -6.267 -11.736 -1.584 1.00 0.00 N ATOM 746 NH2 ARG A 283 -5.313 -13.310 -2.954 1.00 0.00 N ATOM 0 H ARG A 283 -5.458 -8.182 -0.781 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.686 -7.230 -1.147 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -3.967 -9.549 -2.635 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.343 -8.934 -2.871 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -1.770 -10.618 -1.464 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -2.227 -9.479 -0.213 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -3.410 -11.455 0.332 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -4.612 -10.419 -0.413 1.00 0.00 H new ATOM 0 HE ARG A 283 -3.174 -12.521 -1.997 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -6.175 -10.996 -0.888 1.00 0.00 H new ATOM 0 HH12 ARG A 283 -7.190 -12.001 -1.927 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -4.485 -13.785 -3.315 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -6.239 -13.571 -3.293 1.00 0.00 H new ATOM 760 N GLY A 284 -3.278 -6.029 -3.282 1.00 0.00 N ATOM 761 CA GLY A 284 -3.719 -5.201 -4.393 1.00 0.00 C ATOM 762 C GLY A 284 -2.648 -4.243 -4.884 1.00 0.00 C ATOM 763 O GLY A 284 -1.470 -4.569 -4.867 1.00 0.00 O ATOM 0 H GLY A 284 -2.307 -5.894 -3.001 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -4.028 -5.844 -5.217 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -4.596 -4.630 -4.087 1.00 0.00 H new ATOM 767 N HIS A 285 -3.064 -3.054 -5.323 1.00 0.00 N ATOM 768 CA HIS A 285 -2.128 -2.047 -5.850 1.00 0.00 C ATOM 769 C HIS A 285 -2.647 -0.626 -5.608 1.00 0.00 C ATOM 770 O HIS A 285 -3.840 -0.371 -5.753 1.00 0.00 O ATOM 771 CB HIS A 285 -1.848 -2.275 -7.346 1.00 0.00 C ATOM 772 CG HIS A 285 -3.070 -2.482 -8.193 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.783 -1.454 -8.772 1.00 0.00 N ATOM 774 CD2 HIS A 285 -3.696 -3.622 -8.564 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.793 -1.955 -9.458 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.763 -3.268 -9.349 1.00 0.00 N ATOM 0 H HIS A 285 -4.041 -2.760 -5.326 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.188 -2.160 -5.309 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.297 -1.418 -7.732 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.199 -3.145 -7.451 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -3.408 -4.627 -8.292 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -5.522 -1.385 -10.015 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.425 -3.915 -9.778 1.00 0.00 H new ATOM 785 N PHE A 286 -1.744 0.292 -5.248 1.00 0.00 N ATOM 786 CA PHE A 286 -2.116 1.680 -4.943 1.00 0.00 C ATOM 787 C PHE A 286 -0.916 2.623 -5.108 1.00 0.00 C ATOM 788 O PHE A 286 0.235 2.183 -5.080 1.00 0.00 O ATOM 789 CB PHE A 286 -2.684 1.782 -3.520 1.00 0.00 C ATOM 790 CG PHE A 286 -4.175 1.598 -3.455 1.00 0.00 C ATOM 791 CD1 PHE A 286 -5.034 2.578 -3.926 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.714 0.446 -2.923 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.404 2.406 -3.869 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.082 0.268 -2.863 1.00 0.00 C ATOM 795 CZ PHE A 286 -6.929 1.246 -3.336 1.00 0.00 C ATOM 0 H PHE A 286 -0.746 0.099 -5.160 1.00 0.00 H new ATOM 0 HA PHE A 286 -2.886 1.986 -5.651 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.205 1.031 -2.892 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.428 2.756 -3.104 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.628 3.488 -4.343 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.058 -0.326 -2.549 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -7.062 3.177 -4.241 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.489 -0.640 -2.444 1.00 0.00 H new ATOM 0 HZ PHE A 286 -7.999 1.106 -3.290 1.00 0.00 H new ATOM 805 N PRO A 287 -1.179 3.939 -5.285 1.00 0.00 N ATOM 806 CA PRO A 287 -0.148 4.928 -5.581 1.00 0.00 C ATOM 807 C PRO A 287 0.433 5.628 -4.346 1.00 0.00 C ATOM 808 O PRO A 287 -0.017 5.429 -3.210 1.00 0.00 O ATOM 809 CB PRO A 287 -0.901 5.930 -6.455 1.00 0.00 C ATOM 810 CG PRO A 287 -2.335 5.840 -6.037 1.00 0.00 C ATOM 811 CD PRO A 287 -2.505 4.569 -5.241 1.00 0.00 C ATOM 0 HA PRO A 287 0.724 4.467 -6.044 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.515 6.940 -6.313 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.786 5.690 -7.512 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.613 6.706 -5.437 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -2.988 5.834 -6.910 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -2.813 4.778 -4.217 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.268 3.924 -5.678 1.00 0.00 H new ATOM 819 N PHE A 288 1.420 6.482 -4.625 1.00 0.00 N ATOM 820 CA PHE A 288 2.297 7.089 -3.626 1.00 0.00 C ATOM 821 C PHE A 288 1.653 8.288 -2.927 1.00 0.00 C ATOM 822 O PHE A 288 1.892 8.527 -1.743 1.00 0.00 O ATOM 823 CB PHE A 288 3.557 7.553 -4.365 1.00 0.00 C ATOM 824 CG PHE A 288 4.761 7.810 -3.510 1.00 0.00 C ATOM 825 CD1 PHE A 288 4.957 9.033 -2.890 1.00 0.00 C ATOM 826 CD2 PHE A 288 5.717 6.826 -3.359 1.00 0.00 C ATOM 827 CE1 PHE A 288 6.088 9.265 -2.130 1.00 0.00 C ATOM 828 CE2 PHE A 288 6.852 7.049 -2.607 1.00 0.00 C ATOM 829 CZ PHE A 288 7.039 8.271 -1.990 1.00 0.00 C ATOM 0 H PHE A 288 1.636 6.777 -5.577 1.00 0.00 H new ATOM 0 HA PHE A 288 2.515 6.355 -2.850 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.817 6.799 -5.108 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.320 8.467 -4.909 1.00 0.00 H new ATOM 0 HD1 PHE A 288 4.219 9.813 -3.002 1.00 0.00 H new ATOM 0 HD2 PHE A 288 5.575 5.868 -3.836 1.00 0.00 H new ATOM 0 HE1 PHE A 288 6.229 10.220 -1.647 1.00 0.00 H new ATOM 0 HE2 PHE A 288 7.593 6.270 -2.501 1.00 0.00 H new ATOM 0 HZ PHE A 288 7.926 8.449 -1.400 1.00 0.00 H new ATOM 839 N THR A 289 0.832 9.028 -3.670 1.00 0.00 N ATOM 840 CA THR A 289 0.337 10.336 -3.242 1.00 0.00 C ATOM 841 C THR A 289 -0.380 10.309 -1.883 1.00 0.00 C ATOM 842 O THR A 289 -0.296 11.270 -1.123 1.00 0.00 O ATOM 843 CB THR A 289 -0.594 10.935 -4.318 1.00 0.00 C ATOM 844 OG1 THR A 289 -1.121 12.198 -3.886 1.00 0.00 O ATOM 845 CG2 THR A 289 -1.734 9.982 -4.640 1.00 0.00 C ATOM 0 H THR A 289 0.491 8.738 -4.586 1.00 0.00 H new ATOM 0 HA THR A 289 1.217 10.967 -3.115 1.00 0.00 H new ATOM 0 HB THR A 289 -0.004 11.090 -5.221 1.00 0.00 H new ATOM 0 HG1 THR A 289 -1.707 12.563 -4.581 1.00 0.00 H new ATOM 0 HG21 THR A 289 -2.376 10.426 -5.401 1.00 0.00 H new ATOM 0 HG22 THR A 289 -1.328 9.042 -5.012 1.00 0.00 H new ATOM 0 HG23 THR A 289 -2.317 9.794 -3.738 1.00 0.00 H new ATOM 853 N HIS A 290 -1.073 9.227 -1.567 1.00 0.00 N ATOM 854 CA HIS A 290 -1.784 9.150 -0.295 1.00 0.00 C ATOM 855 C HIS A 290 -1.194 8.059 0.591 1.00 0.00 C ATOM 856 O HIS A 290 -1.906 7.208 1.129 1.00 0.00 O ATOM 857 CB HIS A 290 -3.306 8.971 -0.500 1.00 0.00 C ATOM 858 CG HIS A 290 -3.722 7.813 -1.358 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.839 7.848 -2.160 1.00 0.00 N ATOM 860 CD2 HIS A 290 -3.189 6.581 -1.517 1.00 0.00 C ATOM 861 CE1 HIS A 290 -4.979 6.695 -2.775 1.00 0.00 C ATOM 862 NE2 HIS A 290 -3.987 5.902 -2.412 1.00 0.00 N ATOM 0 H HIS A 290 -1.160 8.402 -2.160 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.650 10.101 0.221 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.774 8.859 0.478 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.703 9.885 -0.941 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -5.464 8.648 -2.262 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -2.302 6.200 -1.033 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -5.772 6.439 -3.462 1.00 0.00 H new ATOM 871 N VAL A 291 0.124 8.086 0.724 1.00 0.00 N ATOM 872 CA VAL A 291 0.817 7.172 1.611 1.00 0.00 C ATOM 873 C VAL A 291 2.086 7.811 2.150 1.00 0.00 C ATOM 874 O VAL A 291 2.648 8.727 1.548 1.00 0.00 O ATOM 875 CB VAL A 291 1.148 5.830 0.904 1.00 0.00 C ATOM 876 CG1 VAL A 291 2.634 5.672 0.592 1.00 0.00 C ATOM 877 CG2 VAL A 291 0.642 4.653 1.722 1.00 0.00 C ATOM 0 H VAL A 291 0.734 8.734 0.226 1.00 0.00 H new ATOM 0 HA VAL A 291 0.150 6.954 2.445 1.00 0.00 H new ATOM 0 HB VAL A 291 0.629 5.846 -0.054 1.00 0.00 H new ATOM 0 HG11 VAL A 291 2.802 4.715 0.098 1.00 0.00 H new ATOM 0 HG12 VAL A 291 2.956 6.480 -0.065 1.00 0.00 H new ATOM 0 HG13 VAL A 291 3.206 5.708 1.519 1.00 0.00 H new ATOM 0 HG21 VAL A 291 0.884 3.722 1.209 1.00 0.00 H new ATOM 0 HG22 VAL A 291 1.117 4.661 2.703 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -0.439 4.731 1.842 1.00 0.00 H new ATOM 887 N ARG A 292 2.509 7.320 3.293 1.00 0.00 N ATOM 888 CA ARG A 292 3.757 7.734 3.914 1.00 0.00 C ATOM 889 C ARG A 292 4.513 6.479 4.288 1.00 0.00 C ATOM 890 O ARG A 292 4.154 5.782 5.226 1.00 0.00 O ATOM 891 CB ARG A 292 3.498 8.591 5.156 1.00 0.00 C ATOM 892 CG ARG A 292 2.735 9.874 4.867 1.00 0.00 C ATOM 893 CD ARG A 292 3.498 10.776 3.914 1.00 0.00 C ATOM 894 NE ARG A 292 4.766 11.229 4.480 1.00 0.00 N ATOM 895 CZ ARG A 292 5.645 11.984 3.823 1.00 0.00 C ATOM 896 NH1 ARG A 292 5.424 12.326 2.559 1.00 0.00 N ATOM 897 NH2 ARG A 292 6.753 12.386 4.433 1.00 0.00 N ATOM 0 H ARG A 292 1.997 6.617 3.825 1.00 0.00 H new ATOM 0 HA ARG A 292 4.336 8.343 3.220 1.00 0.00 H new ATOM 0 HB2 ARG A 292 2.938 8.002 5.882 1.00 0.00 H new ATOM 0 HB3 ARG A 292 4.453 8.843 5.618 1.00 0.00 H new ATOM 0 HG2 ARG A 292 1.763 9.631 4.439 1.00 0.00 H new ATOM 0 HG3 ARG A 292 2.548 10.405 5.800 1.00 0.00 H new ATOM 0 HD2 ARG A 292 3.688 10.241 2.983 1.00 0.00 H new ATOM 0 HD3 ARG A 292 2.884 11.641 3.665 1.00 0.00 H new ATOM 0 HE ARG A 292 4.992 10.951 5.435 1.00 0.00 H new ATOM 0 HH11 ARG A 292 4.577 12.010 2.086 1.00 0.00 H new ATOM 0 HH12 ARG A 292 6.101 12.904 2.061 1.00 0.00 H new ATOM 0 HH21 ARG A 292 6.929 12.117 5.401 1.00 0.00 H new ATOM 0 HH22 ARG A 292 7.429 12.964 3.934 1.00 0.00 H new ATOM 911 N LEU A 293 5.561 6.193 3.562 1.00 0.00 N ATOM 912 CA LEU A 293 6.125 4.880 3.577 1.00 0.00 C ATOM 913 C LEU A 293 7.375 4.775 4.423 1.00 0.00 C ATOM 914 O LEU A 293 8.260 5.634 4.387 1.00 0.00 O ATOM 915 CB LEU A 293 6.423 4.458 2.151 1.00 0.00 C ATOM 916 CG LEU A 293 7.098 5.517 1.278 1.00 0.00 C ATOM 917 CD1 LEU A 293 7.891 4.847 0.181 1.00 0.00 C ATOM 918 CD2 LEU A 293 6.073 6.466 0.687 1.00 0.00 C ATOM 0 H LEU A 293 6.039 6.857 2.953 1.00 0.00 H new ATOM 0 HA LEU A 293 5.393 4.214 4.034 1.00 0.00 H new ATOM 0 HB2 LEU A 293 7.061 3.574 2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 293 5.488 4.162 1.675 1.00 0.00 H new ATOM 0 HG LEU A 293 7.775 6.101 1.902 1.00 0.00 H new ATOM 0 HD11 LEU A 293 8.370 5.606 -0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 293 8.653 4.206 0.623 1.00 0.00 H new ATOM 0 HD13 LEU A 293 7.223 4.245 -0.435 1.00 0.00 H new ATOM 0 HD21 LEU A 293 6.578 7.209 0.071 1.00 0.00 H new ATOM 0 HD22 LEU A 293 5.368 5.904 0.074 1.00 0.00 H new ATOM 0 HD23 LEU A 293 5.535 6.967 1.491 1.00 0.00 H new ATOM 930 N LEU A 294 7.415 3.705 5.186 1.00 0.00 N ATOM 931 CA LEU A 294 8.587 3.303 5.917 1.00 0.00 C ATOM 932 C LEU A 294 9.461 2.498 4.967 1.00 0.00 C ATOM 933 O LEU A 294 8.966 1.715 4.144 1.00 0.00 O ATOM 934 CB LEU A 294 8.211 2.456 7.144 1.00 0.00 C ATOM 935 CG LEU A 294 7.471 3.165 8.294 1.00 0.00 C ATOM 936 CD1 LEU A 294 7.053 4.576 7.926 1.00 0.00 C ATOM 937 CD2 LEU A 294 6.261 2.351 8.728 1.00 0.00 C ATOM 0 H LEU A 294 6.618 3.082 5.315 1.00 0.00 H new ATOM 0 HA LEU A 294 9.119 4.181 6.284 1.00 0.00 H new ATOM 0 HB2 LEU A 294 7.590 1.627 6.804 1.00 0.00 H new ATOM 0 HB3 LEU A 294 9.126 2.023 7.548 1.00 0.00 H new ATOM 0 HG LEU A 294 8.170 3.242 9.127 1.00 0.00 H new ATOM 0 HD11 LEU A 294 6.535 5.034 8.769 1.00 0.00 H new ATOM 0 HD12 LEU A 294 7.937 5.165 7.680 1.00 0.00 H new ATOM 0 HD13 LEU A 294 6.386 4.545 7.064 1.00 0.00 H new ATOM 0 HD21 LEU A 294 5.749 2.865 9.541 1.00 0.00 H new ATOM 0 HD22 LEU A 294 5.579 2.235 7.886 1.00 0.00 H new ATOM 0 HD23 LEU A 294 6.587 1.368 9.069 1.00 0.00 H new