USER MOD reduce.3.24.130724 H: found=0, std=0, add=816, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 820 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 Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 29 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0231) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 127:sc= 0.0815 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 151:sc= 1.86 (180deg=0.859) USER MOD Single : A 70 ASN : amide:sc= -1.72! X(o=-1.7!,f=-1.7) USER MOD Single : A 71 GLN : amide:sc= 1.03 K(o=1,f=-4.8!) USER MOD Single : A 73 MET CE :methyl -113:sc= -0.094 (180deg=-0.316) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc=-0.00188 X(o=-0.0019,f=0) USER MOD Single : A 82 GLN : amide:sc= 0.367 K(o=0.37,f=-0.3) USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 129 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.285) USER MOD Single : B 157 LYS NZ :NH3+ 172:sc= 1.07 (180deg=0.987) USER MOD Single : B 160 TYR OH : rot 150:sc= 0 USER MOD Single : B 162 SER OG : rot 180:sc= 0 USER MOD Single : B 165 SER OG : rot 180:sc= 0 USER MOD Single : B 168 SER OG : rot 180:sc= 0 USER MOD Single : B 169 LYS NZ :NH3+ 154:sc= 2.17 (180deg=1.21) USER MOD Single : B 170 ASN : amide:sc= -2.09! K(o=-2.1!,f=-0.5) USER MOD Single : B 171 GLN : amide:sc= 0.779 K(o=0.78,f=-4.1!) USER MOD Single : B 173 MET CE :methyl 174:sc= 0 (180deg=-0.0132) USER MOD Single : B 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 181 GLN : amide:sc=-0.000409 X(o=-0.00041,f=0) USER MOD Single : B 182 GLN : amide:sc= 0.13 X(o=0.13,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 132 N GLU A 11 -7.496 -7.858 7.568 1.00 0.00 N ATOM 133 CA GLU A 11 -7.902 -6.965 6.467 1.00 0.00 C ATOM 134 C GLU A 11 -7.300 -7.363 5.105 1.00 0.00 C ATOM 135 O GLU A 11 -7.913 -7.082 4.076 1.00 0.00 O ATOM 136 CB GLU A 11 -7.634 -5.481 6.804 1.00 0.00 C ATOM 137 CG GLU A 11 -6.198 -5.119 7.215 1.00 0.00 C ATOM 138 CD GLU A 11 -5.973 -5.326 8.726 1.00 0.00 C ATOM 139 OE1 GLU A 11 -6.190 -4.370 9.511 1.00 0.00 O ATOM 140 OE2 GLU A 11 -5.601 -6.452 9.135 1.00 0.00 O1- ATOM 0 HA GLU A 11 -8.980 -7.089 6.363 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -7.902 -4.880 5.935 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -8.304 -5.188 7.612 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.493 -5.732 6.654 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -5.995 -4.080 6.955 1.00 0.00 H new ATOM 147 N LEU A 12 -6.181 -8.096 5.066 1.00 0.00 N ATOM 148 CA LEU A 12 -5.622 -8.657 3.827 1.00 0.00 C ATOM 149 C LEU A 12 -6.605 -9.631 3.141 1.00 0.00 C ATOM 150 O LEU A 12 -6.702 -9.645 1.911 1.00 0.00 O ATOM 151 CB LEU A 12 -4.286 -9.379 4.118 1.00 0.00 C ATOM 152 CG LEU A 12 -3.038 -8.520 4.407 1.00 0.00 C ATOM 153 CD1 LEU A 12 -2.672 -7.618 3.228 1.00 0.00 C ATOM 154 CD2 LEU A 12 -3.152 -7.663 5.667 1.00 0.00 C ATOM 0 H LEU A 12 -5.634 -8.319 5.897 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.445 -7.825 3.145 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.443 -10.036 4.974 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.060 -10.017 3.264 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.246 -9.250 4.572 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.787 -7.033 3.479 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.465 -8.231 2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.503 -6.946 3.012 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.235 -7.089 5.801 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.996 -6.981 5.568 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.306 -8.307 6.533 1.00 0.00 H new ATOM 166 N SER A 13 -7.355 -10.414 3.926 1.00 0.00 N ATOM 167 CA SER A 13 -8.421 -11.297 3.429 1.00 0.00 C ATOM 168 C SER A 13 -9.684 -10.517 3.025 1.00 0.00 C ATOM 169 O SER A 13 -10.275 -10.788 1.978 1.00 0.00 O ATOM 170 CB SER A 13 -8.742 -12.349 4.502 1.00 0.00 C ATOM 171 OG SER A 13 -9.715 -13.282 4.051 1.00 0.00 O ATOM 0 H SER A 13 -7.238 -10.454 4.938 1.00 0.00 H new ATOM 0 HA SER A 13 -8.065 -11.791 2.525 1.00 0.00 H new ATOM 0 HB2 SER A 13 -7.830 -12.879 4.776 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.104 -11.852 5.402 1.00 0.00 H new ATOM 0 HG SER A 13 -9.893 -13.937 4.758 1.00 0.00 H new ATOM 177 N GLU A 14 -10.070 -9.496 3.803 1.00 0.00 N ATOM 178 CA GLU A 14 -11.246 -8.654 3.534 1.00 0.00 C ATOM 179 C GLU A 14 -11.127 -7.867 2.217 1.00 0.00 C ATOM 180 O GLU A 14 -12.073 -7.836 1.428 1.00 0.00 O ATOM 181 CB GLU A 14 -11.464 -7.703 4.726 1.00 0.00 C ATOM 182 CG GLU A 14 -12.693 -6.791 4.613 1.00 0.00 C ATOM 183 CD GLU A 14 -14.044 -7.536 4.521 1.00 0.00 C ATOM 184 OE1 GLU A 14 -15.016 -6.962 3.973 1.00 0.00 O ATOM 185 OE2 GLU A 14 -14.168 -8.684 5.015 1.00 0.00 O1- ATOM 0 H GLU A 14 -9.567 -9.227 4.649 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.110 -9.308 3.415 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.555 -8.299 5.634 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.577 -7.080 4.841 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -12.717 -6.128 5.478 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.581 -6.160 3.731 1.00 0.00 H new ATOM 192 N ILE A 15 -9.961 -7.259 1.959 1.00 0.00 N ATOM 193 CA ILE A 15 -9.667 -6.465 0.749 1.00 0.00 C ATOM 194 C ILE A 15 -9.635 -7.317 -0.540 1.00 0.00 C ATOM 195 O ILE A 15 -9.970 -6.821 -1.617 1.00 0.00 O ATOM 196 CB ILE A 15 -8.363 -5.659 0.983 1.00 0.00 C ATOM 197 CG1 ILE A 15 -8.519 -4.566 2.066 1.00 0.00 C ATOM 198 CG2 ILE A 15 -7.826 -5.006 -0.301 1.00 0.00 C ATOM 199 CD1 ILE A 15 -9.681 -3.585 1.881 1.00 0.00 C ATOM 0 H ILE A 15 -9.171 -7.305 2.602 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.484 -5.763 0.581 1.00 0.00 H new ATOM 0 HB ILE A 15 -7.644 -6.401 1.330 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -8.637 -5.057 3.032 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -7.592 -3.994 2.110 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -6.913 -4.456 -0.075 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.611 -5.778 -1.040 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.573 -4.320 -0.700 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -9.686 -2.868 2.702 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -9.562 -3.054 0.936 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -10.623 -4.134 1.873 1.00 0.00 H new ATOM 211 N GLU A 16 -9.305 -8.607 -0.456 1.00 0.00 N ATOM 212 CA GLU A 16 -9.470 -9.562 -1.573 1.00 0.00 C ATOM 213 C GLU A 16 -10.933 -10.004 -1.794 1.00 0.00 C ATOM 214 O GLU A 16 -11.298 -10.365 -2.918 1.00 0.00 O ATOM 215 CB GLU A 16 -8.581 -10.798 -1.360 1.00 0.00 C ATOM 216 CG GLU A 16 -7.103 -10.514 -1.646 1.00 0.00 C ATOM 217 CD GLU A 16 -6.270 -11.811 -1.694 1.00 0.00 C ATOM 218 OE1 GLU A 16 -6.364 -12.650 -0.764 1.00 0.00 O ATOM 219 OE2 GLU A 16 -5.503 -12.012 -2.672 1.00 0.00 O1- ATOM 0 H GLU A 16 -8.914 -9.028 0.387 1.00 0.00 H new ATOM 0 HA GLU A 16 -9.161 -9.029 -2.473 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.689 -11.146 -0.333 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -8.925 -11.605 -2.008 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -7.011 -9.988 -2.596 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.704 -9.854 -0.876 1.00 0.00 H new ATOM 226 N GLY A 17 -11.772 -10.001 -0.750 1.00 0.00 N ATOM 227 CA GLY A 17 -13.168 -10.468 -0.801 1.00 0.00 C ATOM 228 C GLY A 17 -14.172 -9.453 -1.361 1.00 0.00 C ATOM 229 O GLY A 17 -15.128 -9.838 -2.044 1.00 0.00 O ATOM 0 H GLY A 17 -11.496 -9.668 0.174 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -13.211 -11.372 -1.409 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -13.479 -10.746 0.206 1.00 0.00 H new ATOM 233 N LEU A 18 -13.961 -8.160 -1.091 1.00 0.00 N ATOM 234 CA LEU A 18 -14.781 -7.034 -1.575 1.00 0.00 C ATOM 235 C LEU A 18 -14.551 -6.703 -3.071 1.00 0.00 C ATOM 236 O LEU A 18 -13.734 -7.338 -3.750 1.00 0.00 O ATOM 237 CB LEU A 18 -14.563 -5.846 -0.617 1.00 0.00 C ATOM 238 CG LEU A 18 -13.148 -5.244 -0.513 1.00 0.00 C ATOM 239 CD1 LEU A 18 -12.678 -4.501 -1.759 1.00 0.00 C ATOM 240 CD2 LEU A 18 -13.132 -4.244 0.647 1.00 0.00 C ATOM 0 H LEU A 18 -13.184 -7.853 -0.506 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.836 -7.309 -1.555 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -15.243 -5.048 -0.916 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -14.864 -6.164 0.381 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.473 -6.088 -0.370 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -11.673 -4.112 -1.594 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.667 -5.185 -2.608 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -13.357 -3.674 -1.967 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -12.138 -3.807 0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -13.860 -3.455 0.457 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -13.387 -4.758 1.574 1.00 0.00 H new ATOM 252 N GLN A 19 -15.271 -5.699 -3.587 1.00 0.00 N ATOM 253 CA GLN A 19 -15.171 -5.224 -4.980 1.00 0.00 C ATOM 254 C GLN A 19 -14.948 -3.699 -5.086 1.00 0.00 C ATOM 255 O GLN A 19 -14.976 -2.979 -4.091 1.00 0.00 O ATOM 256 CB GLN A 19 -16.385 -5.719 -5.788 1.00 0.00 C ATOM 257 CG GLN A 19 -17.743 -5.146 -5.364 1.00 0.00 C ATOM 258 CD GLN A 19 -18.650 -6.239 -4.805 1.00 0.00 C ATOM 259 OE1 GLN A 19 -19.400 -6.900 -5.518 1.00 0.00 O ATOM 260 NE2 GLN A 19 -18.597 -6.484 -3.513 1.00 0.00 N ATOM 0 H GLN A 19 -15.956 -5.180 -3.038 1.00 0.00 H new ATOM 0 HA GLN A 19 -14.274 -5.657 -5.422 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -16.222 -5.479 -6.839 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -16.430 -6.805 -5.713 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -17.595 -4.371 -4.611 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -18.224 -4.672 -6.219 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -17.976 -5.938 -2.916 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -19.177 -7.220 -3.109 1.00 0.00 H new ATOM 269 N ASP A 20 -14.719 -3.186 -6.300 1.00 0.00 N ATOM 270 CA ASP A 20 -14.337 -1.786 -6.566 1.00 0.00 C ATOM 271 C ASP A 20 -15.332 -0.734 -6.041 1.00 0.00 C ATOM 272 O ASP A 20 -14.931 0.362 -5.644 1.00 0.00 O ATOM 273 CB ASP A 20 -14.117 -1.586 -8.078 1.00 0.00 C ATOM 274 CG ASP A 20 -13.154 -2.615 -8.684 1.00 0.00 C ATOM 275 OD1 ASP A 20 -13.591 -3.753 -8.985 1.00 0.00 O ATOM 276 OD2 ASP A 20 -11.958 -2.290 -8.869 1.00 0.00 O1- ATOM 0 H ASP A 20 -14.795 -3.744 -7.150 1.00 0.00 H new ATOM 0 HA ASP A 20 -13.415 -1.621 -6.009 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -15.077 -1.649 -8.591 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.727 -0.584 -8.253 1.00 0.00 H new ATOM 281 N ASP A 21 -16.620 -1.076 -5.961 1.00 0.00 N ATOM 282 CA ASP A 21 -17.656 -0.226 -5.356 1.00 0.00 C ATOM 283 C ASP A 21 -17.465 -0.048 -3.835 1.00 0.00 C ATOM 284 O ASP A 21 -17.771 1.014 -3.289 1.00 0.00 O ATOM 285 CB ASP A 21 -19.051 -0.808 -5.646 1.00 0.00 C ATOM 286 CG ASP A 21 -19.426 -0.875 -7.140 1.00 0.00 C ATOM 287 OD1 ASP A 21 -18.875 -0.111 -7.969 1.00 0.00 O ATOM 288 OD2 ASP A 21 -20.321 -1.686 -7.491 1.00 0.00 O1- ATOM 0 H ASP A 21 -16.980 -1.961 -6.318 1.00 0.00 H new ATOM 0 HA ASP A 21 -17.564 0.761 -5.809 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -19.104 -1.813 -5.227 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -19.796 -0.206 -5.126 1.00 0.00 H new ATOM 293 N ASP A 22 -16.912 -1.055 -3.151 1.00 0.00 N ATOM 294 CA ASP A 22 -16.558 -1.000 -1.725 1.00 0.00 C ATOM 295 C ASP A 22 -15.241 -0.234 -1.485 1.00 0.00 C ATOM 296 O ASP A 22 -15.107 0.479 -0.488 1.00 0.00 O ATOM 297 CB ASP A 22 -16.452 -2.422 -1.150 1.00 0.00 C ATOM 298 CG ASP A 22 -17.643 -3.327 -1.517 1.00 0.00 C ATOM 299 OD1 ASP A 22 -17.406 -4.460 -1.998 1.00 0.00 O ATOM 300 OD2 ASP A 22 -18.814 -2.920 -1.305 1.00 0.00 O1- ATOM 0 H ASP A 22 -16.692 -1.953 -3.582 1.00 0.00 H new ATOM 0 HA ASP A 22 -17.352 -0.458 -1.212 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -15.532 -2.883 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -16.374 -2.361 -0.065 1.00 0.00 H new ATOM 305 N LEU A 23 -14.280 -0.336 -2.416 1.00 0.00 N ATOM 306 CA LEU A 23 -13.057 0.476 -2.402 1.00 0.00 C ATOM 307 C LEU A 23 -13.403 1.967 -2.529 1.00 0.00 C ATOM 308 O LEU A 23 -12.973 2.761 -1.694 1.00 0.00 O ATOM 309 CB LEU A 23 -12.085 0.035 -3.516 1.00 0.00 C ATOM 310 CG LEU A 23 -11.531 -1.394 -3.368 1.00 0.00 C ATOM 311 CD1 LEU A 23 -10.705 -1.786 -4.587 1.00 0.00 C ATOM 312 CD2 LEU A 23 -10.613 -1.512 -2.147 1.00 0.00 C ATOM 0 H LEU A 23 -14.331 -0.986 -3.201 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.555 0.321 -1.447 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -12.596 0.113 -4.475 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.248 0.732 -3.544 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.394 -2.050 -3.258 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.325 -2.799 -4.458 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.330 -1.743 -5.479 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.868 -1.096 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.238 -2.533 -2.071 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.774 -0.825 -2.255 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.173 -1.263 -1.246 1.00 0.00 H new ATOM 324 N ALA A 24 -14.241 2.343 -3.499 1.00 0.00 N ATOM 325 CA ALA A 24 -14.723 3.713 -3.661 1.00 0.00 C ATOM 326 C ALA A 24 -15.489 4.234 -2.426 1.00 0.00 C ATOM 327 O ALA A 24 -15.387 5.419 -2.101 1.00 0.00 O ATOM 328 CB ALA A 24 -15.588 3.770 -4.925 1.00 0.00 C ATOM 0 H ALA A 24 -14.606 1.697 -4.199 1.00 0.00 H new ATOM 0 HA ALA A 24 -13.863 4.375 -3.762 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -15.959 4.785 -5.066 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -14.990 3.479 -5.789 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -16.431 3.087 -4.820 1.00 0.00 H new ATOM 334 N ALA A 25 -16.197 3.362 -1.702 1.00 0.00 N ATOM 335 CA ALA A 25 -16.935 3.714 -0.484 1.00 0.00 C ATOM 336 C ALA A 25 -16.042 4.081 0.724 1.00 0.00 C ATOM 337 O ALA A 25 -16.543 4.715 1.657 1.00 0.00 O ATOM 338 CB ALA A 25 -17.891 2.566 -0.135 1.00 0.00 C ATOM 0 H ALA A 25 -16.275 2.376 -1.949 1.00 0.00 H new ATOM 0 HA ALA A 25 -17.491 4.626 -0.701 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -18.445 2.816 0.769 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -18.589 2.411 -0.958 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -17.318 1.654 0.031 1.00 0.00 H new ATOM 344 N LEU A 26 -14.742 3.730 0.726 1.00 0.00 N ATOM 345 CA LEU A 26 -13.804 4.043 1.826 1.00 0.00 C ATOM 346 C LEU A 26 -12.580 4.888 1.406 1.00 0.00 C ATOM 347 O LEU A 26 -12.055 5.642 2.227 1.00 0.00 O ATOM 348 CB LEU A 26 -13.455 2.749 2.593 1.00 0.00 C ATOM 349 CG LEU A 26 -12.387 1.841 1.952 1.00 0.00 C ATOM 350 CD1 LEU A 26 -11.004 2.114 2.552 1.00 0.00 C ATOM 351 CD2 LEU A 26 -12.693 0.359 2.209 1.00 0.00 C ATOM 0 H LEU A 26 -14.308 3.217 -0.041 1.00 0.00 H new ATOM 0 HA LEU A 26 -14.315 4.713 2.517 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.115 3.024 3.591 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -14.369 2.168 2.716 1.00 0.00 H new ATOM 0 HG LEU A 26 -12.398 2.058 0.884 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.268 1.461 2.083 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -10.730 3.154 2.376 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -11.028 1.922 3.625 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -11.923 -0.257 1.745 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -12.710 0.172 3.283 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -13.664 0.109 1.782 1.00 0.00 H new ATOM 363 N LEU A 27 -12.154 4.834 0.135 1.00 0.00 N ATOM 364 CA LEU A 27 -11.194 5.778 -0.458 1.00 0.00 C ATOM 365 C LEU A 27 -11.841 7.154 -0.710 1.00 0.00 C ATOM 366 O LEU A 27 -11.192 8.191 -0.554 1.00 0.00 O ATOM 367 CB LEU A 27 -10.641 5.210 -1.781 1.00 0.00 C ATOM 368 CG LEU A 27 -9.402 4.303 -1.640 1.00 0.00 C ATOM 369 CD1 LEU A 27 -9.576 3.135 -0.667 1.00 0.00 C ATOM 370 CD2 LEU A 27 -9.038 3.712 -3.004 1.00 0.00 C ATOM 0 H LEU A 27 -12.472 4.121 -0.521 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.376 5.912 0.250 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.432 4.644 -2.273 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.389 6.043 -2.438 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.620 4.949 -1.241 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.656 2.551 -0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.800 3.520 0.328 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.396 2.500 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.162 3.072 -2.901 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.875 3.124 -3.381 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.817 4.519 -3.703 1.00 0.00 H new ATOM 382 N GLY A 28 -13.124 7.173 -1.085 1.00 0.00 N ATOM 383 CA GLY A 28 -13.912 8.390 -1.289 1.00 0.00 C ATOM 384 C GLY A 28 -13.334 9.299 -2.377 1.00 0.00 C ATOM 385 O GLY A 28 -13.032 8.845 -3.485 1.00 0.00 O ATOM 0 H GLY A 28 -13.656 6.320 -1.259 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -14.932 8.115 -1.556 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -13.966 8.943 -0.351 1.00 0.00 H new ATOM 389 N LYS A 29 -13.156 10.589 -2.056 1.00 0.00 N ATOM 390 CA LYS A 29 -12.603 11.619 -2.958 1.00 0.00 C ATOM 391 C LYS A 29 -11.175 11.308 -3.443 1.00 0.00 C ATOM 392 O LYS A 29 -10.781 11.748 -4.524 1.00 0.00 O ATOM 393 CB LYS A 29 -12.684 12.973 -2.217 1.00 0.00 C ATOM 394 CG LYS A 29 -12.326 14.215 -3.052 1.00 0.00 C ATOM 395 CD LYS A 29 -13.253 14.425 -4.266 1.00 0.00 C ATOM 396 CE LYS A 29 -12.930 15.719 -5.034 1.00 0.00 C ATOM 397 NZ LYS A 29 -13.281 16.938 -4.258 1.00 0.00 N1+ ATOM 0 H LYS A 29 -13.399 10.958 -1.137 1.00 0.00 H new ATOM 0 HA LYS A 29 -13.194 11.647 -3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -13.697 13.096 -1.833 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -12.019 12.934 -1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -12.370 15.098 -2.414 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -11.297 14.125 -3.401 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -13.163 13.573 -4.940 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -14.289 14.455 -3.928 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -11.868 15.739 -5.277 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -13.473 15.723 -5.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -13.141 17.780 -4.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -14.276 16.885 -3.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -12.671 17.002 -3.418 1.00 0.00 H new ATOM 411 N GLU A 30 -10.412 10.519 -2.683 1.00 0.00 N ATOM 412 CA GLU A 30 -9.036 10.102 -3.007 1.00 0.00 C ATOM 413 C GLU A 30 -8.946 8.836 -3.900 1.00 0.00 C ATOM 414 O GLU A 30 -7.845 8.387 -4.220 1.00 0.00 O ATOM 415 CB GLU A 30 -8.231 9.908 -1.710 1.00 0.00 C ATOM 416 CG GLU A 30 -8.271 11.097 -0.726 1.00 0.00 C ATOM 417 CD GLU A 30 -7.999 12.467 -1.385 1.00 0.00 C ATOM 418 OE1 GLU A 30 -8.733 13.443 -1.088 1.00 0.00 O ATOM 419 OE2 GLU A 30 -7.039 12.591 -2.183 1.00 0.00 O1- ATOM 0 H GLU A 30 -10.741 10.138 -1.796 1.00 0.00 H new ATOM 0 HA GLU A 30 -8.605 10.907 -3.602 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -8.605 9.021 -1.198 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -7.192 9.710 -1.973 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -9.249 11.124 -0.245 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.534 10.930 0.059 1.00 0.00 H new ATOM 426 N PHE A 31 -10.082 8.252 -4.312 1.00 0.00 N ATOM 427 CA PHE A 31 -10.117 7.102 -5.224 1.00 0.00 C ATOM 428 C PHE A 31 -9.470 7.436 -6.586 1.00 0.00 C ATOM 429 O PHE A 31 -9.617 8.549 -7.103 1.00 0.00 O ATOM 430 CB PHE A 31 -11.566 6.615 -5.381 1.00 0.00 C ATOM 431 CG PHE A 31 -11.751 5.373 -6.236 1.00 0.00 C ATOM 432 CD1 PHE A 31 -11.813 4.099 -5.646 1.00 0.00 C ATOM 433 CD2 PHE A 31 -11.866 5.497 -7.632 1.00 0.00 C ATOM 434 CE1 PHE A 31 -11.997 2.959 -6.449 1.00 0.00 C ATOM 435 CE2 PHE A 31 -12.026 4.356 -8.434 1.00 0.00 C ATOM 436 CZ PHE A 31 -12.097 3.083 -7.846 1.00 0.00 C ATOM 0 H PHE A 31 -11.007 8.568 -4.019 1.00 0.00 H new ATOM 0 HA PHE A 31 -9.525 6.294 -4.794 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -11.973 6.416 -4.390 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -12.157 7.423 -5.812 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -11.719 3.995 -4.575 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -11.831 6.475 -8.089 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -12.062 1.983 -5.990 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -12.095 4.458 -9.507 1.00 0.00 H new ATOM 0 HZ PHE A 31 -12.227 2.206 -8.462 1.00 0.00 H new ATOM 446 N ILE A 32 -8.742 6.472 -7.168 1.00 0.00 N ATOM 447 CA ILE A 32 -7.914 6.682 -8.366 1.00 0.00 C ATOM 448 C ILE A 32 -8.757 7.112 -9.585 1.00 0.00 C ATOM 449 O ILE A 32 -9.837 6.571 -9.840 1.00 0.00 O ATOM 450 CB ILE A 32 -7.039 5.427 -8.644 1.00 0.00 C ATOM 451 CG1 ILE A 32 -5.644 5.792 -9.199 1.00 0.00 C ATOM 452 CG2 ILE A 32 -7.696 4.448 -9.632 1.00 0.00 C ATOM 453 CD1 ILE A 32 -4.713 6.382 -8.130 1.00 0.00 C ATOM 0 H ILE A 32 -8.711 5.515 -6.817 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.237 7.514 -8.174 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.936 4.946 -7.671 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.183 4.901 -9.624 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.758 6.510 -10.011 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -7.039 3.592 -9.787 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.648 4.106 -9.226 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -7.867 4.951 -10.584 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.748 6.619 -8.578 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -5.157 7.290 -7.722 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.572 5.656 -7.329 1.00 0.00 H new ATOM 722 N TRP A 56 7.000 -13.702 7.926 1.00 0.00 N ATOM 723 CA TRP A 56 5.916 -12.712 7.891 1.00 0.00 C ATOM 724 C TRP A 56 6.143 -11.609 6.846 1.00 0.00 C ATOM 725 O TRP A 56 5.187 -11.162 6.207 1.00 0.00 O ATOM 726 CB TRP A 56 5.720 -12.110 9.300 1.00 0.00 C ATOM 727 CG TRP A 56 6.906 -11.398 9.894 1.00 0.00 C ATOM 728 CD1 TRP A 56 7.786 -11.949 10.759 1.00 0.00 C ATOM 729 CD2 TRP A 56 7.418 -10.048 9.617 1.00 0.00 C ATOM 730 NE1 TRP A 56 8.817 -11.066 10.998 1.00 0.00 N ATOM 731 CE2 TRP A 56 8.690 -9.920 10.248 1.00 0.00 C ATOM 732 CE3 TRP A 56 6.962 -8.942 8.863 1.00 0.00 C ATOM 733 CZ2 TRP A 56 9.517 -8.804 10.051 1.00 0.00 C ATOM 734 CZ3 TRP A 56 7.768 -7.797 8.687 1.00 0.00 C ATOM 735 CH2 TRP A 56 9.054 -7.740 9.251 1.00 0.00 C ATOM 0 HA TRP A 56 5.008 -13.231 7.585 1.00 0.00 H new ATOM 0 HB2 TRP A 56 4.886 -11.409 9.259 1.00 0.00 H new ATOM 0 HB3 TRP A 56 5.429 -12.913 9.977 1.00 0.00 H new ATOM 0 HD1 TRP A 56 7.695 -12.932 11.197 1.00 0.00 H new ATOM 0 HE1 TRP A 56 9.581 -11.241 11.651 1.00 0.00 H new ATOM 0 HE3 TRP A 56 5.980 -8.974 8.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 10.495 -8.761 10.506 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 7.395 -6.960 8.116 1.00 0.00 H new ATOM 0 HH2 TRP A 56 9.686 -6.883 9.072 1.00 0.00 H new ATOM 746 N LYS A 57 7.398 -11.196 6.631 1.00 0.00 N ATOM 747 CA LYS A 57 7.777 -10.148 5.667 1.00 0.00 C ATOM 748 C LYS A 57 7.568 -10.571 4.211 1.00 0.00 C ATOM 749 O LYS A 57 7.027 -9.797 3.426 1.00 0.00 O ATOM 750 CB LYS A 57 9.201 -9.657 5.954 1.00 0.00 C ATOM 751 CG LYS A 57 10.327 -10.703 5.885 1.00 0.00 C ATOM 752 CD LYS A 57 11.596 -10.127 6.526 1.00 0.00 C ATOM 753 CE LYS A 57 12.751 -11.121 6.389 1.00 0.00 C ATOM 754 NZ LYS A 57 13.921 -10.710 7.212 1.00 0.00 N1+ ATOM 0 H LYS A 57 8.197 -11.587 7.131 1.00 0.00 H new ATOM 0 HA LYS A 57 7.101 -9.304 5.806 1.00 0.00 H new ATOM 0 HB2 LYS A 57 9.434 -8.861 5.247 1.00 0.00 H new ATOM 0 HB3 LYS A 57 9.212 -9.212 6.949 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.025 -11.613 6.403 1.00 0.00 H new ATOM 0 HG3 LYS A 57 10.522 -10.976 4.848 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.859 -9.184 6.047 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.415 -9.910 7.579 1.00 0.00 H new ATOM 0 HE2 LYS A 57 12.418 -12.112 6.696 1.00 0.00 H new ATOM 0 HE3 LYS A 57 13.048 -11.194 5.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 14.687 -11.404 7.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 14.252 -9.774 6.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 13.642 -10.664 8.213 1.00 0.00 H new ATOM 768 N ASP A 58 7.906 -11.812 3.876 1.00 0.00 N ATOM 769 CA ASP A 58 7.621 -12.402 2.561 1.00 0.00 C ATOM 770 C ASP A 58 6.113 -12.646 2.358 1.00 0.00 C ATOM 771 O ASP A 58 5.564 -12.323 1.302 1.00 0.00 O ATOM 772 CB ASP A 58 8.399 -13.717 2.405 1.00 0.00 C ATOM 773 CG ASP A 58 9.931 -13.579 2.400 1.00 0.00 C ATOM 774 OD1 ASP A 58 10.472 -12.472 2.154 1.00 0.00 O ATOM 775 OD2 ASP A 58 10.613 -14.608 2.628 1.00 0.00 O1- ATOM 0 H ASP A 58 8.390 -12.447 4.511 1.00 0.00 H new ATOM 0 HA ASP A 58 7.942 -11.694 1.797 1.00 0.00 H new ATOM 0 HB2 ASP A 58 8.114 -14.387 3.216 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.091 -14.194 1.475 1.00 0.00 H new ATOM 780 N ASP A 59 5.430 -13.172 3.384 1.00 0.00 N ATOM 781 CA ASP A 59 3.996 -13.482 3.356 1.00 0.00 C ATOM 782 C ASP A 59 3.122 -12.221 3.170 1.00 0.00 C ATOM 783 O ASP A 59 2.160 -12.228 2.395 1.00 0.00 O ATOM 784 CB ASP A 59 3.651 -14.201 4.675 1.00 0.00 C ATOM 785 CG ASP A 59 2.238 -14.801 4.701 1.00 0.00 C ATOM 786 OD1 ASP A 59 1.781 -15.353 3.671 1.00 0.00 O ATOM 787 OD2 ASP A 59 1.582 -14.752 5.770 1.00 0.00 O1- ATOM 0 H ASP A 59 5.870 -13.398 4.276 1.00 0.00 H new ATOM 0 HA ASP A 59 3.782 -14.120 2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 59 4.377 -14.996 4.845 1.00 0.00 H new ATOM 0 HB3 ASP A 59 3.752 -13.496 5.500 1.00 0.00 H new ATOM 792 N TYR A 60 3.492 -11.115 3.825 1.00 0.00 N ATOM 793 CA TYR A 60 2.854 -9.807 3.673 1.00 0.00 C ATOM 794 C TYR A 60 3.188 -9.149 2.326 1.00 0.00 C ATOM 795 O TYR A 60 2.285 -8.817 1.549 1.00 0.00 O ATOM 796 CB TYR A 60 3.267 -8.930 4.866 1.00 0.00 C ATOM 797 CG TYR A 60 2.655 -7.539 4.893 1.00 0.00 C ATOM 798 CD1 TYR A 60 3.465 -6.399 4.711 1.00 0.00 C ATOM 799 CD2 TYR A 60 1.275 -7.381 5.141 1.00 0.00 C ATOM 800 CE1 TYR A 60 2.900 -5.109 4.799 1.00 0.00 C ATOM 801 CE2 TYR A 60 0.706 -6.095 5.217 1.00 0.00 C ATOM 802 CZ TYR A 60 1.523 -4.956 5.063 1.00 0.00 C ATOM 803 OH TYR A 60 0.981 -3.712 5.173 1.00 0.00 O ATOM 0 H TYR A 60 4.264 -11.107 4.492 1.00 0.00 H new ATOM 0 HA TYR A 60 1.771 -9.930 3.670 1.00 0.00 H new ATOM 0 HB2 TYR A 60 2.995 -9.446 5.787 1.00 0.00 H new ATOM 0 HB3 TYR A 60 4.353 -8.831 4.865 1.00 0.00 H new ATOM 0 HD1 TYR A 60 4.519 -6.513 4.504 1.00 0.00 H new ATOM 0 HD2 TYR A 60 0.651 -8.252 5.273 1.00 0.00 H new ATOM 0 HE1 TYR A 60 3.523 -4.237 4.664 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -0.354 -5.981 5.393 1.00 0.00 H new ATOM 0 HH TYR A 60 0.021 -3.788 5.355 1.00 0.00 H new ATOM 813 N LEU A 61 4.482 -8.999 2.002 1.00 0.00 N ATOM 814 CA LEU A 61 4.931 -8.262 0.815 1.00 0.00 C ATOM 815 C LEU A 61 4.486 -8.914 -0.511 1.00 0.00 C ATOM 816 O LEU A 61 4.180 -8.201 -1.466 1.00 0.00 O ATOM 817 CB LEU A 61 6.455 -8.096 0.897 1.00 0.00 C ATOM 818 CG LEU A 61 7.089 -7.202 -0.184 1.00 0.00 C ATOM 819 CD1 LEU A 61 6.622 -5.750 -0.089 1.00 0.00 C ATOM 820 CD2 LEU A 61 8.609 -7.214 -0.008 1.00 0.00 C ATOM 0 H LEU A 61 5.245 -9.386 2.557 1.00 0.00 H new ATOM 0 HA LEU A 61 4.453 -7.282 0.811 1.00 0.00 H new ATOM 0 HB2 LEU A 61 6.705 -7.685 1.875 1.00 0.00 H new ATOM 0 HB3 LEU A 61 6.913 -9.083 0.840 1.00 0.00 H new ATOM 0 HG LEU A 61 6.785 -7.600 -1.152 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.099 -5.162 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.540 -5.707 -0.210 1.00 0.00 H new ATOM 0 HD13 LEU A 61 6.894 -5.343 0.885 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.068 -6.583 -0.769 1.00 0.00 H new ATOM 0 HD22 LEU A 61 8.864 -6.833 0.981 1.00 0.00 H new ATOM 0 HD23 LEU A 61 8.979 -8.234 -0.110 1.00 0.00 H new ATOM 832 N SER A 62 4.360 -10.248 -0.556 1.00 0.00 N ATOM 833 CA SER A 62 3.807 -10.978 -1.706 1.00 0.00 C ATOM 834 C SER A 62 2.379 -10.533 -2.051 1.00 0.00 C ATOM 835 O SER A 62 2.091 -10.226 -3.213 1.00 0.00 O ATOM 836 CB SER A 62 3.847 -12.487 -1.422 1.00 0.00 C ATOM 837 OG SER A 62 3.243 -13.224 -2.471 1.00 0.00 O ATOM 0 H SER A 62 4.642 -10.857 0.212 1.00 0.00 H new ATOM 0 HA SER A 62 4.425 -10.749 -2.574 1.00 0.00 H new ATOM 0 HB2 SER A 62 4.881 -12.809 -1.297 1.00 0.00 H new ATOM 0 HB3 SER A 62 3.333 -12.697 -0.484 1.00 0.00 H new ATOM 0 HG SER A 62 3.284 -14.181 -2.264 1.00 0.00 H new ATOM 843 N ARG A 63 1.492 -10.395 -1.050 1.00 0.00 N ATOM 844 CA ARG A 63 0.123 -9.881 -1.256 1.00 0.00 C ATOM 845 C ARG A 63 0.131 -8.432 -1.742 1.00 0.00 C ATOM 846 O ARG A 63 -0.578 -8.115 -2.690 1.00 0.00 O ATOM 847 CB ARG A 63 -0.710 -10.014 0.030 1.00 0.00 C ATOM 848 CG ARG A 63 -1.034 -11.480 0.349 1.00 0.00 C ATOM 849 CD ARG A 63 -1.855 -11.574 1.642 1.00 0.00 C ATOM 850 NE ARG A 63 -2.261 -12.963 1.949 1.00 0.00 N ATOM 851 CZ ARG A 63 -1.502 -13.925 2.448 1.00 0.00 C ATOM 852 NH1 ARG A 63 -0.235 -13.756 2.687 1.00 0.00 N1+ ATOM 853 NH2 ARG A 63 -2.007 -15.095 2.715 1.00 0.00 N ATOM 0 H ARG A 63 1.700 -10.634 -0.081 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.339 -10.489 -2.034 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.164 -9.572 0.864 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.638 -9.452 -0.078 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -1.590 -11.925 -0.476 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.110 -12.049 0.454 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.269 -11.177 2.471 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.744 -10.949 1.552 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.232 -13.206 1.755 1.00 0.00 H new ATOM 0 HH11 ARG A 63 0.206 -12.858 2.489 1.00 0.00 H new ATOM 0 HH12 ARG A 63 0.318 -14.522 3.072 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.995 -15.276 2.540 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.414 -15.831 3.100 1.00 0.00 H new ATOM 867 N LEU A 64 0.972 -7.572 -1.168 1.00 0.00 N ATOM 868 CA LEU A 64 1.065 -6.174 -1.598 1.00 0.00 C ATOM 869 C LEU A 64 1.612 -6.027 -3.036 1.00 0.00 C ATOM 870 O LEU A 64 1.251 -5.073 -3.726 1.00 0.00 O ATOM 871 CB LEU A 64 1.882 -5.371 -0.571 1.00 0.00 C ATOM 872 CG LEU A 64 1.058 -4.905 0.644 1.00 0.00 C ATOM 873 CD1 LEU A 64 0.702 -5.994 1.654 1.00 0.00 C ATOM 874 CD2 LEU A 64 1.827 -3.823 1.392 1.00 0.00 C ATOM 0 H LEU A 64 1.600 -7.818 -0.403 1.00 0.00 H new ATOM 0 HA LEU A 64 0.057 -5.761 -1.635 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.714 -5.983 -0.222 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.313 -4.499 -1.063 1.00 0.00 H new ATOM 0 HG LEU A 64 0.119 -4.549 0.221 1.00 0.00 H new ATOM 0 HD11 LEU A 64 0.122 -5.559 2.468 1.00 0.00 H new ATOM 0 HD12 LEU A 64 0.113 -6.768 1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.616 -6.433 2.053 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.245 -3.492 2.252 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.782 -4.224 1.732 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.005 -2.978 0.727 1.00 0.00 H new ATOM 886 N SER A 65 2.404 -6.985 -3.536 1.00 0.00 N ATOM 887 CA SER A 65 2.785 -7.060 -4.957 1.00 0.00 C ATOM 888 C SER A 65 1.638 -7.549 -5.868 1.00 0.00 C ATOM 889 O SER A 65 1.476 -7.051 -6.986 1.00 0.00 O ATOM 890 CB SER A 65 4.026 -7.943 -5.121 1.00 0.00 C ATOM 891 OG SER A 65 4.514 -7.855 -6.445 1.00 0.00 O ATOM 0 H SER A 65 2.801 -7.733 -2.967 1.00 0.00 H new ATOM 0 HA SER A 65 3.016 -6.045 -5.280 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.799 -7.631 -4.419 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.779 -8.978 -4.884 1.00 0.00 H new ATOM 0 HG SER A 65 5.464 -7.616 -6.428 1.00 0.00 H new ATOM 897 N ARG A 66 0.795 -8.474 -5.392 1.00 0.00 N ATOM 898 CA ARG A 66 -0.372 -9.018 -6.120 1.00 0.00 C ATOM 899 C ARG A 66 -1.557 -8.054 -6.235 1.00 0.00 C ATOM 900 O ARG A 66 -2.221 -8.035 -7.271 1.00 0.00 O ATOM 901 CB ARG A 66 -0.842 -10.314 -5.443 1.00 0.00 C ATOM 902 CG ARG A 66 0.121 -11.490 -5.680 1.00 0.00 C ATOM 903 CD ARG A 66 -0.289 -12.757 -4.914 1.00 0.00 C ATOM 904 NE ARG A 66 -1.606 -13.279 -5.349 1.00 0.00 N ATOM 905 CZ ARG A 66 -2.783 -13.089 -4.777 1.00 0.00 C ATOM 906 NH1 ARG A 66 -2.946 -12.394 -3.690 1.00 0.00 N1+ ATOM 907 NH2 ARG A 66 -3.862 -13.608 -5.292 1.00 0.00 N ATOM 0 H ARG A 66 0.904 -8.880 -4.463 1.00 0.00 H new ATOM 0 HA ARG A 66 -0.027 -9.200 -7.138 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.944 -10.143 -4.371 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -1.831 -10.578 -5.819 1.00 0.00 H new ATOM 0 HG2 ARG A 66 0.161 -11.712 -6.746 1.00 0.00 H new ATOM 0 HG3 ARG A 66 1.126 -11.197 -5.378 1.00 0.00 H new ATOM 0 HD2 ARG A 66 0.469 -13.527 -5.058 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -0.322 -12.538 -3.847 1.00 0.00 H new ATOM 0 HE ARG A 66 -1.604 -13.854 -6.191 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -2.141 -11.963 -3.235 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -3.878 -12.280 -3.292 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -3.803 -14.166 -6.144 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -4.765 -13.456 -4.843 1.00 0.00 H new ATOM 921 N LEU A 67 -1.848 -7.278 -5.189 1.00 0.00 N ATOM 922 CA LEU A 67 -3.033 -6.403 -5.087 1.00 0.00 C ATOM 923 C LEU A 67 -2.968 -5.156 -5.998 1.00 0.00 C ATOM 924 O LEU A 67 -1.899 -4.694 -6.398 1.00 0.00 O ATOM 925 CB LEU A 67 -3.245 -6.035 -3.600 1.00 0.00 C ATOM 926 CG LEU A 67 -4.236 -6.950 -2.840 1.00 0.00 C ATOM 927 CD1 LEU A 67 -3.911 -8.443 -2.880 1.00 0.00 C ATOM 928 CD2 LEU A 67 -4.287 -6.537 -1.372 1.00 0.00 C ATOM 0 H LEU A 67 -1.253 -7.235 -4.362 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.897 -6.955 -5.457 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.281 -6.065 -3.092 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.604 -5.007 -3.542 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.187 -6.816 -3.356 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.665 -8.995 -2.319 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.905 -8.787 -3.914 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.931 -8.614 -2.436 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.985 -7.181 -0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.294 -6.633 -0.932 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.619 -5.501 -1.297 1.00 0.00 H new ATOM 940 N SER A 68 -4.144 -4.601 -6.307 1.00 0.00 N ATOM 941 CA SER A 68 -4.332 -3.309 -7.000 1.00 0.00 C ATOM 942 C SER A 68 -3.844 -2.112 -6.171 1.00 0.00 C ATOM 943 O SER A 68 -3.807 -2.186 -4.940 1.00 0.00 O ATOM 944 CB SER A 68 -5.829 -3.155 -7.314 1.00 0.00 C ATOM 945 OG SER A 68 -6.147 -1.889 -7.857 1.00 0.00 O ATOM 0 H SER A 68 -5.029 -5.052 -6.075 1.00 0.00 H new ATOM 0 HA SER A 68 -3.733 -3.315 -7.911 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.130 -3.933 -8.016 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.405 -3.309 -6.401 1.00 0.00 H new ATOM 0 HG SER A 68 -7.109 -1.844 -8.040 1.00 0.00 H new ATOM 951 N LYS A 69 -3.537 -0.969 -6.804 1.00 0.00 N ATOM 952 CA LYS A 69 -3.253 0.303 -6.100 1.00 0.00 C ATOM 953 C LYS A 69 -4.425 0.781 -5.224 1.00 0.00 C ATOM 954 O LYS A 69 -4.205 1.271 -4.114 1.00 0.00 O ATOM 955 CB LYS A 69 -2.795 1.363 -7.116 1.00 0.00 C ATOM 956 CG LYS A 69 -2.532 2.719 -6.434 1.00 0.00 C ATOM 957 CD LYS A 69 -1.620 3.638 -7.253 1.00 0.00 C ATOM 958 CE LYS A 69 -1.538 5.005 -6.562 1.00 0.00 C ATOM 959 NZ LYS A 69 -0.531 5.892 -7.193 1.00 0.00 N1+ ATOM 0 H LYS A 69 -3.477 -0.895 -7.820 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.439 0.128 -5.396 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.887 1.023 -7.615 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.556 1.483 -7.887 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.483 3.222 -6.261 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.080 2.546 -5.457 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -0.626 3.200 -7.341 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -2.009 3.750 -8.265 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.515 5.486 -6.595 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -1.288 4.864 -5.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -0.816 6.884 -7.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 0.395 5.739 -6.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.465 5.675 -8.208 1.00 0.00 H new ATOM 973 N ASN A 70 -5.670 0.581 -5.663 1.00 0.00 N ATOM 974 CA ASN A 70 -6.866 0.872 -4.862 1.00 0.00 C ATOM 975 C ASN A 70 -6.971 -0.036 -3.619 1.00 0.00 C ATOM 976 O ASN A 70 -7.291 0.427 -2.523 1.00 0.00 O ATOM 977 CB ASN A 70 -8.115 0.753 -5.756 1.00 0.00 C ATOM 978 CG ASN A 70 -8.086 1.696 -6.947 1.00 0.00 C ATOM 979 OD1 ASN A 70 -7.384 1.492 -7.923 1.00 0.00 O ATOM 980 ND2 ASN A 70 -8.858 2.753 -6.914 1.00 0.00 N ATOM 0 H ASN A 70 -5.880 0.210 -6.590 1.00 0.00 H new ATOM 0 HA ASN A 70 -6.790 1.892 -4.484 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -8.202 -0.273 -6.114 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -9.003 0.959 -5.159 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -8.870 3.401 -7.702 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -9.447 2.929 -6.100 1.00 0.00 H new ATOM 987 N GLN A 71 -6.638 -1.322 -3.771 1.00 0.00 N ATOM 988 CA GLN A 71 -6.555 -2.283 -2.664 1.00 0.00 C ATOM 989 C GLN A 71 -5.395 -1.976 -1.700 1.00 0.00 C ATOM 990 O GLN A 71 -5.569 -2.098 -0.488 1.00 0.00 O ATOM 991 CB GLN A 71 -6.425 -3.703 -3.236 1.00 0.00 C ATOM 992 CG GLN A 71 -7.716 -4.206 -3.899 1.00 0.00 C ATOM 993 CD GLN A 71 -7.523 -5.603 -4.486 1.00 0.00 C ATOM 994 OE1 GLN A 71 -6.678 -5.829 -5.343 1.00 0.00 O ATOM 995 NE2 GLN A 71 -8.279 -6.593 -4.058 1.00 0.00 N ATOM 0 H GLN A 71 -6.415 -1.731 -4.678 1.00 0.00 H new ATOM 0 HA GLN A 71 -7.471 -2.201 -2.078 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -5.617 -3.721 -3.967 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -6.145 -4.387 -2.435 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -8.522 -4.224 -3.166 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -8.017 -3.515 -4.687 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -8.988 -6.422 -3.345 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -8.156 -7.531 -4.440 1.00 0.00 H new ATOM 1004 N LEU A 72 -4.246 -1.520 -2.209 1.00 0.00 N ATOM 1005 CA LEU A 72 -3.113 -1.039 -1.405 1.00 0.00 C ATOM 1006 C LEU A 72 -3.491 0.171 -0.540 1.00 0.00 C ATOM 1007 O LEU A 72 -3.183 0.185 0.653 1.00 0.00 O ATOM 1008 CB LEU A 72 -1.922 -0.699 -2.326 1.00 0.00 C ATOM 1009 CG LEU A 72 -1.128 -1.945 -2.761 1.00 0.00 C ATOM 1010 CD1 LEU A 72 -0.325 -1.673 -4.028 1.00 0.00 C ATOM 1011 CD2 LEU A 72 -0.137 -2.344 -1.669 1.00 0.00 C ATOM 0 H LEU A 72 -4.072 -1.473 -3.213 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.825 -1.840 -0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.290 -0.181 -3.212 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.254 -0.010 -1.809 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.851 -2.740 -2.943 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.225 -2.571 -4.310 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.002 -1.394 -4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.377 -0.860 -3.846 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.419 -3.226 -1.987 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.557 -1.523 -1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.679 -2.568 -0.750 1.00 0.00 H new ATOM 1023 N MET A 73 -4.205 1.151 -1.099 1.00 0.00 N ATOM 1024 CA MET A 73 -4.780 2.259 -0.323 1.00 0.00 C ATOM 1025 C MET A 73 -5.755 1.764 0.755 1.00 0.00 C ATOM 1026 O MET A 73 -5.690 2.217 1.897 1.00 0.00 O ATOM 1027 CB MET A 73 -5.484 3.260 -1.256 1.00 0.00 C ATOM 1028 CG MET A 73 -4.503 4.254 -1.877 1.00 0.00 C ATOM 1029 SD MET A 73 -5.281 5.619 -2.791 1.00 0.00 S ATOM 1030 CE MET A 73 -5.692 4.812 -4.358 1.00 0.00 C ATOM 0 H MET A 73 -4.402 1.201 -2.099 1.00 0.00 H new ATOM 0 HA MET A 73 -3.956 2.759 0.185 1.00 0.00 H new ATOM 0 HB2 MET A 73 -5.999 2.716 -2.048 1.00 0.00 H new ATOM 0 HB3 MET A 73 -6.245 3.804 -0.696 1.00 0.00 H new ATOM 0 HG2 MET A 73 -3.881 4.673 -1.086 1.00 0.00 H new ATOM 0 HG3 MET A 73 -3.839 3.715 -2.552 1.00 0.00 H new ATOM 0 HE1 MET A 73 -5.088 5.241 -5.158 1.00 0.00 H new ATOM 0 HE2 MET A 73 -5.488 3.744 -4.282 1.00 0.00 H new ATOM 0 HE3 MET A 73 -6.748 4.965 -4.580 1.00 0.00 H new ATOM 1040 N ALA A 74 -6.629 0.807 0.430 1.00 0.00 N ATOM 1041 CA ALA A 74 -7.651 0.318 1.350 1.00 0.00 C ATOM 1042 C ALA A 74 -7.094 -0.522 2.519 1.00 0.00 C ATOM 1043 O ALA A 74 -7.471 -0.267 3.664 1.00 0.00 O ATOM 1044 CB ALA A 74 -8.696 -0.449 0.544 1.00 0.00 C ATOM 0 H ALA A 74 -6.645 0.351 -0.482 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.107 1.180 1.836 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.470 -0.823 1.214 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.146 0.215 -0.194 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.220 -1.287 0.036 1.00 0.00 H new ATOM 1050 N LEU A 75 -6.183 -1.476 2.271 1.00 0.00 N ATOM 1051 CA LEU A 75 -5.568 -2.280 3.337 1.00 0.00 C ATOM 1052 C LEU A 75 -4.744 -1.404 4.293 1.00 0.00 C ATOM 1053 O LEU A 75 -4.798 -1.590 5.510 1.00 0.00 O ATOM 1054 CB LEU A 75 -4.770 -3.472 2.746 1.00 0.00 C ATOM 1055 CG LEU A 75 -3.372 -3.163 2.158 1.00 0.00 C ATOM 1056 CD1 LEU A 75 -2.246 -3.316 3.189 1.00 0.00 C ATOM 1057 CD2 LEU A 75 -3.053 -4.129 1.017 1.00 0.00 C ATOM 0 H LEU A 75 -5.855 -1.710 1.334 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.361 -2.717 3.944 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.649 -4.220 3.530 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.374 -3.927 1.961 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.416 -2.128 1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.289 -3.087 2.720 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.417 -2.630 4.019 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.231 -4.340 3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.067 -3.901 0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.063 -5.152 1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.801 -4.024 0.231 1.00 0.00 H new ATOM 1069 N ALA A 76 -4.047 -0.402 3.748 1.00 0.00 N ATOM 1070 CA ALA A 76 -3.273 0.573 4.502 1.00 0.00 C ATOM 1071 C ALA A 76 -4.166 1.458 5.393 1.00 0.00 C ATOM 1072 O ALA A 76 -3.873 1.645 6.574 1.00 0.00 O ATOM 1073 CB ALA A 76 -2.457 1.392 3.503 1.00 0.00 C ATOM 0 H ALA A 76 -4.009 -0.248 2.740 1.00 0.00 H new ATOM 0 HA ALA A 76 -2.602 0.061 5.192 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.864 2.134 4.039 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.793 0.730 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.130 1.897 2.810 1.00 0.00 H new ATOM 1079 N LEU A 77 -5.288 1.967 4.867 1.00 0.00 N ATOM 1080 CA LEU A 77 -6.236 2.778 5.642 1.00 0.00 C ATOM 1081 C LEU A 77 -6.880 1.958 6.776 1.00 0.00 C ATOM 1082 O LEU A 77 -6.913 2.416 7.920 1.00 0.00 O ATOM 1083 CB LEU A 77 -7.256 3.401 4.663 1.00 0.00 C ATOM 1084 CG LEU A 77 -8.076 4.622 5.135 1.00 0.00 C ATOM 1085 CD1 LEU A 77 -9.112 4.312 6.215 1.00 0.00 C ATOM 1086 CD2 LEU A 77 -7.199 5.778 5.622 1.00 0.00 C ATOM 0 H LEU A 77 -5.563 1.829 3.895 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.719 3.592 6.150 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.716 3.692 3.762 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.960 2.620 4.375 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.610 4.920 4.233 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.640 5.226 6.486 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.825 3.580 5.836 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -8.611 3.909 7.095 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.832 6.606 5.940 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.590 5.444 6.462 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.550 6.109 4.811 1.00 0.00 H new ATOM 1098 N LYS A 78 -7.296 0.714 6.504 1.00 0.00 N ATOM 1099 CA LYS A 78 -7.846 -0.209 7.513 1.00 0.00 C ATOM 1100 C LYS A 78 -6.859 -0.498 8.653 1.00 0.00 C ATOM 1101 O LYS A 78 -7.222 -0.300 9.815 1.00 0.00 O ATOM 1102 CB LYS A 78 -8.318 -1.520 6.855 1.00 0.00 C ATOM 1103 CG LYS A 78 -9.667 -1.353 6.122 1.00 0.00 C ATOM 1104 CD LYS A 78 -10.151 -2.703 5.563 1.00 0.00 C ATOM 1105 CE LYS A 78 -11.469 -2.585 4.786 1.00 0.00 C ATOM 1106 NZ LYS A 78 -12.627 -2.294 5.673 1.00 0.00 N1+ ATOM 0 H LYS A 78 -7.261 0.313 5.567 1.00 0.00 H new ATOM 0 HA LYS A 78 -8.705 0.291 7.960 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.562 -1.862 6.148 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.414 -2.293 7.617 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -10.412 -0.949 6.808 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.559 -0.635 5.309 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -9.384 -3.116 4.908 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -10.281 -3.406 6.385 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.378 -1.795 4.041 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -11.653 -3.514 4.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -13.493 -2.224 5.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.732 -3.060 6.369 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.466 -1.395 6.170 1.00 0.00 H new ATOM 1120 N LEU A 79 -5.614 -0.887 8.351 1.00 0.00 N ATOM 1121 CA LEU A 79 -4.610 -1.178 9.394 1.00 0.00 C ATOM 1122 C LEU A 79 -4.172 0.080 10.178 1.00 0.00 C ATOM 1123 O LEU A 79 -3.790 -0.038 11.348 1.00 0.00 O ATOM 1124 CB LEU A 79 -3.436 -2.011 8.835 1.00 0.00 C ATOM 1125 CG LEU A 79 -2.454 -1.312 7.876 1.00 0.00 C ATOM 1126 CD1 LEU A 79 -1.357 -0.512 8.584 1.00 0.00 C ATOM 1127 CD2 LEU A 79 -1.751 -2.352 7.005 1.00 0.00 C ATOM 0 H LEU A 79 -5.274 -1.009 7.397 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.095 -1.806 10.141 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.864 -2.394 9.680 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.854 -2.874 8.316 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.063 -0.620 7.294 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.707 -0.050 7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.812 0.263 9.200 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.770 -1.179 9.215 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.058 -1.852 6.329 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.201 -3.047 7.640 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.492 -2.901 6.424 1.00 0.00 H new ATOM 1139 N LYS A 80 -4.252 1.276 9.571 1.00 0.00 N ATOM 1140 CA LYS A 80 -3.965 2.567 10.221 1.00 0.00 C ATOM 1141 C LYS A 80 -5.102 3.037 11.142 1.00 0.00 C ATOM 1142 O LYS A 80 -4.835 3.607 12.199 1.00 0.00 O ATOM 1143 CB LYS A 80 -3.638 3.606 9.130 1.00 0.00 C ATOM 1144 CG LYS A 80 -3.207 4.988 9.651 1.00 0.00 C ATOM 1145 CD LYS A 80 -1.919 4.949 10.480 1.00 0.00 C ATOM 1146 CE LYS A 80 -1.505 6.364 10.898 1.00 0.00 C ATOM 1147 NZ LYS A 80 -0.263 6.343 11.712 1.00 0.00 N1+ ATOM 0 H LYS A 80 -4.524 1.375 8.593 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.103 2.443 10.877 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.843 3.209 8.499 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.515 3.732 8.496 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -3.066 5.660 8.804 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -4.010 5.406 10.259 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.068 4.331 11.366 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.120 4.487 9.900 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.351 6.977 10.010 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.309 6.827 11.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.007 7.315 11.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.420 5.777 12.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 0.509 5.923 11.156 1.00 0.00 H new ATOM 1161 N GLN A 81 -6.358 2.764 10.783 1.00 0.00 N ATOM 1162 CA GLN A 81 -7.537 3.126 11.578 1.00 0.00 C ATOM 1163 C GLN A 81 -7.706 2.255 12.838 1.00 0.00 C ATOM 1164 O GLN A 81 -8.132 2.758 13.879 1.00 0.00 O ATOM 1165 CB GLN A 81 -8.774 3.066 10.667 1.00 0.00 C ATOM 1166 CG GLN A 81 -10.066 3.525 11.363 1.00 0.00 C ATOM 1167 CD GLN A 81 -11.201 3.837 10.382 1.00 0.00 C ATOM 1168 OE1 GLN A 81 -11.885 4.847 10.491 1.00 0.00 O ATOM 1169 NE2 GLN A 81 -11.442 3.017 9.380 1.00 0.00 N ATOM 0 H GLN A 81 -6.590 2.277 9.917 1.00 0.00 H new ATOM 0 HA GLN A 81 -7.405 4.140 11.955 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.601 3.690 9.790 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -8.905 2.044 10.311 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -10.395 2.749 12.054 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -9.855 4.413 11.959 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -10.885 2.170 9.269 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.186 3.229 8.715 1.00 0.00 H new ATOM 1178 N GLN A 82 -7.356 0.964 12.778 1.00 0.00 N ATOM 1179 CA GLN A 82 -7.458 0.051 13.925 1.00 0.00 C ATOM 1180 C GLN A 82 -6.302 0.203 14.935 1.00 0.00 C ATOM 1181 O GLN A 82 -6.539 0.124 16.142 1.00 0.00 O ATOM 1182 CB GLN A 82 -7.642 -1.394 13.428 1.00 0.00 C ATOM 1183 CG GLN A 82 -6.472 -1.986 12.623 1.00 0.00 C ATOM 1184 CD GLN A 82 -5.384 -2.651 13.468 1.00 0.00 C ATOM 1185 OE1 GLN A 82 -5.641 -3.395 14.407 1.00 0.00 O ATOM 1186 NE2 GLN A 82 -4.124 -2.422 13.157 1.00 0.00 N ATOM 0 H GLN A 82 -6.994 0.522 11.933 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.345 0.329 14.494 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -7.823 -2.034 14.292 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.539 -1.433 12.809 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -6.867 -2.720 11.921 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.018 -1.191 12.031 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -3.895 -1.805 12.378 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -3.378 -2.862 13.695 1.00 0.00 H new ATOM 1403 N GLU B 111 7.874 6.886 8.088 1.00 0.00 N ATOM 1404 CA GLU B 111 8.231 6.116 6.891 1.00 0.00 C ATOM 1405 C GLU B 111 7.944 6.873 5.583 1.00 0.00 C ATOM 1406 O GLU B 111 8.686 6.723 4.614 1.00 0.00 O ATOM 1407 CB GLU B 111 7.474 4.775 6.878 1.00 0.00 C ATOM 1408 CG GLU B 111 7.840 3.806 8.014 1.00 0.00 C ATOM 1409 CD GLU B 111 7.405 4.247 9.426 1.00 0.00 C ATOM 1410 OE1 GLU B 111 6.402 4.984 9.576 1.00 0.00 O ATOM 1411 OE2 GLU B 111 8.080 3.852 10.406 1.00 0.00 O1- ATOM 0 HA GLU B 111 9.306 5.946 6.941 1.00 0.00 H new ATOM 0 HB2 GLU B 111 6.404 4.979 6.927 1.00 0.00 H new ATOM 0 HB3 GLU B 111 7.661 4.280 5.925 1.00 0.00 H new ATOM 0 HG2 GLU B 111 7.391 2.836 7.800 1.00 0.00 H new ATOM 0 HG3 GLU B 111 8.921 3.664 8.013 1.00 0.00 H new ATOM 1418 N LEU B 112 6.916 7.730 5.563 1.00 0.00 N ATOM 1419 CA LEU B 112 6.551 8.549 4.403 1.00 0.00 C ATOM 1420 C LEU B 112 7.703 9.495 4.022 1.00 0.00 C ATOM 1421 O LEU B 112 8.111 9.526 2.860 1.00 0.00 O ATOM 1422 CB LEU B 112 5.262 9.352 4.696 1.00 0.00 C ATOM 1423 CG LEU B 112 3.929 8.579 4.742 1.00 0.00 C ATOM 1424 CD1 LEU B 112 3.637 7.852 3.427 1.00 0.00 C ATOM 1425 CD2 LEU B 112 3.832 7.563 5.884 1.00 0.00 C ATOM 0 H LEU B 112 6.305 7.876 6.367 1.00 0.00 H new ATOM 0 HA LEU B 112 6.362 7.886 3.559 1.00 0.00 H new ATOM 0 HB2 LEU B 112 5.391 9.855 5.655 1.00 0.00 H new ATOM 0 HB3 LEU B 112 5.172 10.130 3.938 1.00 0.00 H new ATOM 0 HG LEU B 112 3.184 9.356 4.917 1.00 0.00 H new ATOM 0 HD11 LEU B 112 2.688 7.322 3.507 1.00 0.00 H new ATOM 0 HD12 LEU B 112 3.580 8.577 2.615 1.00 0.00 H new ATOM 0 HD13 LEU B 112 4.435 7.139 3.221 1.00 0.00 H new ATOM 0 HD21 LEU B 112 2.864 7.063 5.845 1.00 0.00 H new ATOM 0 HD22 LEU B 112 4.627 6.824 5.782 1.00 0.00 H new ATOM 0 HD23 LEU B 112 3.936 8.078 6.839 1.00 0.00 H new ATOM 1437 N SER B 113 8.282 10.204 4.997 1.00 0.00 N ATOM 1438 CA SER B 113 9.413 11.118 4.769 1.00 0.00 C ATOM 1439 C SER B 113 10.672 10.408 4.246 1.00 0.00 C ATOM 1440 O SER B 113 11.429 10.995 3.472 1.00 0.00 O ATOM 1441 CB SER B 113 9.760 11.859 6.069 1.00 0.00 C ATOM 1442 OG SER B 113 8.637 12.603 6.527 1.00 0.00 O ATOM 0 H SER B 113 7.980 10.162 5.971 1.00 0.00 H new ATOM 0 HA SER B 113 9.091 11.818 3.998 1.00 0.00 H new ATOM 0 HB2 SER B 113 10.067 11.144 6.832 1.00 0.00 H new ATOM 0 HB3 SER B 113 10.604 12.528 5.900 1.00 0.00 H new ATOM 0 HG SER B 113 8.870 13.069 7.357 1.00 0.00 H new ATOM 1448 N GLU B 114 10.882 9.140 4.623 1.00 0.00 N ATOM 1449 CA GLU B 114 11.990 8.311 4.126 1.00 0.00 C ATOM 1450 C GLU B 114 11.744 7.829 2.686 1.00 0.00 C ATOM 1451 O GLU B 114 12.576 8.066 1.803 1.00 0.00 O ATOM 1452 CB GLU B 114 12.224 7.137 5.099 1.00 0.00 C ATOM 1453 CG GLU B 114 13.397 6.217 4.715 1.00 0.00 C ATOM 1454 CD GLU B 114 14.770 6.923 4.666 1.00 0.00 C ATOM 1455 OE1 GLU B 114 14.987 7.928 5.382 1.00 0.00 O ATOM 1456 OE2 GLU B 114 15.668 6.440 3.935 1.00 0.00 O1- ATOM 0 H GLU B 114 10.281 8.655 5.289 1.00 0.00 H new ATOM 0 HA GLU B 114 12.895 8.917 4.087 1.00 0.00 H new ATOM 0 HB2 GLU B 114 12.404 7.538 6.096 1.00 0.00 H new ATOM 0 HB3 GLU B 114 11.313 6.540 5.155 1.00 0.00 H new ATOM 0 HG2 GLU B 114 13.449 5.396 5.431 1.00 0.00 H new ATOM 0 HG3 GLU B 114 13.193 5.776 3.739 1.00 0.00 H new ATOM 1463 N ILE B 115 10.597 7.187 2.427 1.00 0.00 N ATOM 1464 CA ILE B 115 10.219 6.587 1.134 1.00 0.00 C ATOM 1465 C ILE B 115 10.027 7.632 0.017 1.00 0.00 C ATOM 1466 O ILE B 115 10.319 7.344 -1.146 1.00 0.00 O ATOM 1467 CB ILE B 115 8.966 5.705 1.342 1.00 0.00 C ATOM 1468 CG1 ILE B 115 9.251 4.473 2.234 1.00 0.00 C ATOM 1469 CG2 ILE B 115 8.350 5.229 0.015 1.00 0.00 C ATOM 1470 CD1 ILE B 115 10.413 3.578 1.809 1.00 0.00 C ATOM 0 H ILE B 115 9.876 7.065 3.139 1.00 0.00 H new ATOM 0 HA ILE B 115 11.042 5.963 0.786 1.00 0.00 H new ATOM 0 HB ILE B 115 8.249 6.351 1.849 1.00 0.00 H new ATOM 0 HG12 ILE B 115 9.443 4.823 3.248 1.00 0.00 H new ATOM 0 HG13 ILE B 115 8.348 3.864 2.273 1.00 0.00 H new ATOM 0 HG21 ILE B 115 7.474 4.614 0.220 1.00 0.00 H new ATOM 0 HG22 ILE B 115 8.055 6.093 -0.580 1.00 0.00 H new ATOM 0 HG23 ILE B 115 9.084 4.642 -0.537 1.00 0.00 H new ATOM 0 HD11 ILE B 115 10.511 2.751 2.512 1.00 0.00 H new ATOM 0 HD12 ILE B 115 10.223 3.185 0.810 1.00 0.00 H new ATOM 0 HD13 ILE B 115 11.335 4.159 1.801 1.00 0.00 H new ATOM 1482 N GLU B 116 9.594 8.850 0.342 1.00 0.00 N ATOM 1483 CA GLU B 116 9.551 9.972 -0.608 1.00 0.00 C ATOM 1484 C GLU B 116 10.938 10.590 -0.888 1.00 0.00 C ATOM 1485 O GLU B 116 11.129 11.223 -1.931 1.00 0.00 O ATOM 1486 CB GLU B 116 8.605 11.060 -0.084 1.00 0.00 C ATOM 1487 CG GLU B 116 7.140 10.605 -0.060 1.00 0.00 C ATOM 1488 CD GLU B 116 6.204 11.722 0.443 1.00 0.00 C ATOM 1489 OE1 GLU B 116 5.280 11.443 1.241 1.00 0.00 O ATOM 1490 OE2 GLU B 116 6.341 12.880 -0.008 1.00 0.00 O1- ATOM 0 H GLU B 116 9.261 9.092 1.275 1.00 0.00 H new ATOM 0 HA GLU B 116 9.187 9.566 -1.552 1.00 0.00 H new ATOM 0 HB2 GLU B 116 8.909 11.347 0.923 1.00 0.00 H new ATOM 0 HB3 GLU B 116 8.696 11.948 -0.710 1.00 0.00 H new ATOM 0 HG2 GLU B 116 6.837 10.300 -1.062 1.00 0.00 H new ATOM 0 HG3 GLU B 116 7.041 9.730 0.583 1.00 0.00 H new ATOM 1497 N GLY B 117 11.911 10.425 0.021 1.00 0.00 N ATOM 1498 CA GLY B 117 13.272 10.958 -0.100 1.00 0.00 C ATOM 1499 C GLY B 117 14.224 10.084 -0.935 1.00 0.00 C ATOM 1500 O GLY B 117 15.052 10.614 -1.678 1.00 0.00 O ATOM 0 H GLY B 117 11.766 9.902 0.884 1.00 0.00 H new ATOM 0 HA2 GLY B 117 13.222 11.950 -0.548 1.00 0.00 H new ATOM 0 HA3 GLY B 117 13.692 11.080 0.899 1.00 0.00 H new ATOM 1504 N LEU B 118 14.095 8.758 -0.831 1.00 0.00 N ATOM 1505 CA LEU B 118 14.888 7.773 -1.585 1.00 0.00 C ATOM 1506 C LEU B 118 14.372 7.550 -3.028 1.00 0.00 C ATOM 1507 O LEU B 118 13.422 8.199 -3.480 1.00 0.00 O ATOM 1508 CB LEU B 118 15.030 6.488 -0.743 1.00 0.00 C ATOM 1509 CG LEU B 118 13.739 5.716 -0.394 1.00 0.00 C ATOM 1510 CD1 LEU B 118 13.118 4.980 -1.576 1.00 0.00 C ATOM 1511 CD2 LEU B 118 14.059 4.682 0.686 1.00 0.00 C ATOM 0 H LEU B 118 13.418 8.324 -0.203 1.00 0.00 H new ATOM 0 HA LEU B 118 15.891 8.169 -1.747 1.00 0.00 H new ATOM 0 HB2 LEU B 118 15.694 5.808 -1.277 1.00 0.00 H new ATOM 0 HB3 LEU B 118 15.527 6.751 0.191 1.00 0.00 H new ATOM 0 HG LEU B 118 13.017 6.462 -0.060 1.00 0.00 H new ATOM 0 HD11 LEU B 118 12.216 4.463 -1.249 1.00 0.00 H new ATOM 0 HD12 LEU B 118 12.863 5.696 -2.357 1.00 0.00 H new ATOM 0 HD13 LEU B 118 13.831 4.254 -1.968 1.00 0.00 H new ATOM 0 HD21 LEU B 118 13.154 4.130 0.941 1.00 0.00 H new ATOM 0 HD22 LEU B 118 14.814 3.989 0.314 1.00 0.00 H new ATOM 0 HD23 LEU B 118 14.437 5.188 1.574 1.00 0.00 H new ATOM 1523 N GLN B 119 15.021 6.638 -3.763 1.00 0.00 N ATOM 1524 CA GLN B 119 14.763 6.329 -5.177 1.00 0.00 C ATOM 1525 C GLN B 119 14.692 4.813 -5.451 1.00 0.00 C ATOM 1526 O GLN B 119 14.906 3.986 -4.563 1.00 0.00 O ATOM 1527 CB GLN B 119 15.814 7.046 -6.042 1.00 0.00 C ATOM 1528 CG GLN B 119 17.238 6.458 -5.919 1.00 0.00 C ATOM 1529 CD GLN B 119 18.310 7.549 -5.863 1.00 0.00 C ATOM 1530 OE1 GLN B 119 19.104 7.735 -6.784 1.00 0.00 O ATOM 1531 NE2 GLN B 119 18.362 8.329 -4.797 1.00 0.00 N ATOM 0 H GLN B 119 15.773 6.070 -3.372 1.00 0.00 H new ATOM 0 HA GLN B 119 13.775 6.702 -5.447 1.00 0.00 H new ATOM 0 HB2 GLN B 119 15.502 7.001 -7.086 1.00 0.00 H new ATOM 0 HB3 GLN B 119 15.842 8.099 -5.763 1.00 0.00 H new ATOM 0 HG2 GLN B 119 17.300 5.844 -5.021 1.00 0.00 H new ATOM 0 HG3 GLN B 119 17.433 5.802 -6.767 1.00 0.00 H new ATOM 0 HE21 GLN B 119 17.709 8.184 -4.027 1.00 0.00 H new ATOM 0 HE22 GLN B 119 19.055 9.075 -4.745 1.00 0.00 H new ATOM 1540 N ASP B 120 14.417 4.447 -6.703 1.00 0.00 N ATOM 1541 CA ASP B 120 14.207 3.070 -7.171 1.00 0.00 C ATOM 1542 C ASP B 120 15.372 2.109 -6.867 1.00 0.00 C ATOM 1543 O ASP B 120 15.137 0.919 -6.670 1.00 0.00 O ATOM 1544 CB ASP B 120 13.928 3.065 -8.682 1.00 0.00 C ATOM 1545 CG ASP B 120 15.095 3.607 -9.522 1.00 0.00 C ATOM 1546 OD1 ASP B 120 15.683 2.834 -10.317 1.00 0.00 O ATOM 1547 OD2 ASP B 120 15.403 4.819 -9.414 1.00 0.00 O1- ATOM 0 H ASP B 120 14.330 5.130 -7.455 1.00 0.00 H new ATOM 0 HA ASP B 120 13.348 2.699 -6.611 1.00 0.00 H new ATOM 0 HB2 ASP B 120 13.705 2.046 -8.999 1.00 0.00 H new ATOM 0 HB3 ASP B 120 13.039 3.663 -8.881 1.00 0.00 H new ATOM 1552 N ASP B 121 16.607 2.610 -6.776 1.00 0.00 N ATOM 1553 CA ASP B 121 17.787 1.825 -6.405 1.00 0.00 C ATOM 1554 C ASP B 121 17.679 1.236 -4.979 1.00 0.00 C ATOM 1555 O ASP B 121 18.049 0.083 -4.744 1.00 0.00 O ATOM 1556 CB ASP B 121 19.021 2.739 -6.521 1.00 0.00 C ATOM 1557 CG ASP B 121 20.366 2.011 -6.321 1.00 0.00 C ATOM 1558 OD1 ASP B 121 20.495 0.818 -6.686 1.00 0.00 O ATOM 1559 OD2 ASP B 121 21.331 2.656 -5.843 1.00 0.00 O1- ATOM 0 H ASP B 121 16.818 3.590 -6.962 1.00 0.00 H new ATOM 0 HA ASP B 121 17.871 0.973 -7.080 1.00 0.00 H new ATOM 0 HB2 ASP B 121 19.019 3.211 -7.503 1.00 0.00 H new ATOM 0 HB3 ASP B 121 18.939 3.537 -5.783 1.00 0.00 H new ATOM 1564 N ASP B 122 17.118 2.000 -4.037 1.00 0.00 N ATOM 1565 CA ASP B 122 16.847 1.550 -2.665 1.00 0.00 C ATOM 1566 C ASP B 122 15.539 0.749 -2.550 1.00 0.00 C ATOM 1567 O ASP B 122 15.483 -0.221 -1.791 1.00 0.00 O ATOM 1568 CB ASP B 122 16.842 2.763 -1.724 1.00 0.00 C ATOM 1569 CG ASP B 122 18.201 3.482 -1.645 1.00 0.00 C ATOM 1570 OD1 ASP B 122 18.224 4.733 -1.587 1.00 0.00 O ATOM 1571 OD2 ASP B 122 19.255 2.803 -1.596 1.00 0.00 O1- ATOM 0 H ASP B 122 16.834 2.965 -4.207 1.00 0.00 H new ATOM 0 HA ASP B 122 17.643 0.865 -2.372 1.00 0.00 H new ATOM 0 HB2 ASP B 122 16.084 3.471 -2.060 1.00 0.00 H new ATOM 0 HB3 ASP B 122 16.553 2.437 -0.725 1.00 0.00 H new ATOM 1576 N LEU B 123 14.509 1.097 -3.341 1.00 0.00 N ATOM 1577 CA LEU B 123 13.256 0.332 -3.400 1.00 0.00 C ATOM 1578 C LEU B 123 13.504 -1.106 -3.877 1.00 0.00 C ATOM 1579 O LEU B 123 13.057 -2.052 -3.230 1.00 0.00 O ATOM 1580 CB LEU B 123 12.213 1.024 -4.304 1.00 0.00 C ATOM 1581 CG LEU B 123 11.733 2.399 -3.805 1.00 0.00 C ATOM 1582 CD1 LEU B 123 10.848 3.077 -4.854 1.00 0.00 C ATOM 1583 CD2 LEU B 123 10.897 2.284 -2.528 1.00 0.00 C ATOM 0 H LEU B 123 14.523 1.912 -3.954 1.00 0.00 H new ATOM 0 HA LEU B 123 12.855 0.294 -2.387 1.00 0.00 H new ATOM 0 HB2 LEU B 123 12.639 1.144 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU B 123 11.348 0.368 -4.404 1.00 0.00 H new ATOM 0 HG LEU B 123 12.634 2.981 -3.611 1.00 0.00 H new ATOM 0 HD11 LEU B 123 10.520 4.047 -4.481 1.00 0.00 H new ATOM 0 HD12 LEU B 123 11.415 3.215 -5.774 1.00 0.00 H new ATOM 0 HD13 LEU B 123 9.978 2.452 -5.055 1.00 0.00 H new ATOM 0 HD21 LEU B 123 10.579 3.277 -2.211 1.00 0.00 H new ATOM 0 HD22 LEU B 123 10.020 1.667 -2.722 1.00 0.00 H new ATOM 0 HD23 LEU B 123 11.496 1.826 -1.741 1.00 0.00 H new ATOM 1595 N ALA B 124 14.260 -1.301 -4.962 1.00 0.00 N ATOM 1596 CA ALA B 124 14.598 -2.632 -5.470 1.00 0.00 C ATOM 1597 C ALA B 124 15.450 -3.454 -4.484 1.00 0.00 C ATOM 1598 O ALA B 124 15.277 -4.666 -4.394 1.00 0.00 O ATOM 1599 CB ALA B 124 15.306 -2.481 -6.821 1.00 0.00 C ATOM 0 H ALA B 124 14.655 -0.539 -5.513 1.00 0.00 H new ATOM 0 HA ALA B 124 13.671 -3.192 -5.595 1.00 0.00 H new ATOM 0 HB1 ALA B 124 15.563 -3.467 -7.209 1.00 0.00 H new ATOM 0 HB2 ALA B 124 14.644 -1.975 -7.524 1.00 0.00 H new ATOM 0 HB3 ALA B 124 16.215 -1.894 -6.692 1.00 0.00 H new ATOM 1605 N ALA B 125 16.335 -2.805 -3.719 1.00 0.00 N ATOM 1606 CA ALA B 125 17.146 -3.465 -2.699 1.00 0.00 C ATOM 1607 C ALA B 125 16.307 -4.031 -1.533 1.00 0.00 C ATOM 1608 O ALA B 125 16.618 -5.122 -1.040 1.00 0.00 O ATOM 1609 CB ALA B 125 18.206 -2.471 -2.197 1.00 0.00 C ATOM 0 H ALA B 125 16.507 -1.802 -3.793 1.00 0.00 H new ATOM 0 HA ALA B 125 17.630 -4.330 -3.152 1.00 0.00 H new ATOM 0 HB1 ALA B 125 18.821 -2.949 -1.434 1.00 0.00 H new ATOM 0 HB2 ALA B 125 18.837 -2.161 -3.030 1.00 0.00 H new ATOM 0 HB3 ALA B 125 17.713 -1.597 -1.771 1.00 0.00 H new ATOM 1615 N LEU B 126 15.249 -3.326 -1.102 1.00 0.00 N ATOM 1616 CA LEU B 126 14.400 -3.739 0.027 1.00 0.00 C ATOM 1617 C LEU B 126 13.175 -4.587 -0.390 1.00 0.00 C ATOM 1618 O LEU B 126 12.751 -5.451 0.378 1.00 0.00 O ATOM 1619 CB LEU B 126 14.091 -2.517 0.920 1.00 0.00 C ATOM 1620 CG LEU B 126 12.891 -1.635 0.510 1.00 0.00 C ATOM 1621 CD1 LEU B 126 11.627 -2.049 1.262 1.00 0.00 C ATOM 1622 CD2 LEU B 126 13.149 -0.171 0.859 1.00 0.00 C ATOM 0 H LEU B 126 14.957 -2.447 -1.530 1.00 0.00 H new ATOM 0 HA LEU B 126 14.958 -4.443 0.644 1.00 0.00 H new ATOM 0 HB2 LEU B 126 13.918 -2.874 1.935 1.00 0.00 H new ATOM 0 HB3 LEU B 126 14.980 -1.887 0.951 1.00 0.00 H new ATOM 0 HG LEU B 126 12.762 -1.762 -0.565 1.00 0.00 H new ATOM 0 HD11 LEU B 126 10.797 -1.413 0.956 1.00 0.00 H new ATOM 0 HD12 LEU B 126 11.392 -3.088 1.033 1.00 0.00 H new ATOM 0 HD13 LEU B 126 11.790 -1.941 2.334 1.00 0.00 H new ATOM 0 HD21 LEU B 126 12.290 0.431 0.561 1.00 0.00 H new ATOM 0 HD22 LEU B 126 13.304 -0.075 1.934 1.00 0.00 H new ATOM 0 HD23 LEU B 126 14.037 0.178 0.332 1.00 0.00 H new ATOM 1634 N LEU B 127 12.630 -4.404 -1.602 1.00 0.00 N ATOM 1635 CA LEU B 127 11.582 -5.270 -2.181 1.00 0.00 C ATOM 1636 C LEU B 127 12.142 -6.611 -2.685 1.00 0.00 C ATOM 1637 O LEU B 127 11.479 -7.643 -2.548 1.00 0.00 O ATOM 1638 CB LEU B 127 10.846 -4.542 -3.328 1.00 0.00 C ATOM 1639 CG LEU B 127 9.621 -3.715 -2.899 1.00 0.00 C ATOM 1640 CD1 LEU B 127 9.889 -2.667 -1.818 1.00 0.00 C ATOM 1641 CD2 LEU B 127 9.033 -2.993 -4.108 1.00 0.00 C ATOM 0 H LEU B 127 12.906 -3.640 -2.219 1.00 0.00 H new ATOM 0 HA LEU B 127 10.877 -5.489 -1.380 1.00 0.00 H new ATOM 0 HB2 LEU B 127 11.553 -3.881 -3.830 1.00 0.00 H new ATOM 0 HB3 LEU B 127 10.526 -5.283 -4.061 1.00 0.00 H new ATOM 0 HG LEU B 127 8.933 -4.444 -2.471 1.00 0.00 H new ATOM 0 HD11 LEU B 127 8.964 -2.139 -1.586 1.00 0.00 H new ATOM 0 HD12 LEU B 127 10.261 -3.158 -0.919 1.00 0.00 H new ATOM 0 HD13 LEU B 127 10.633 -1.956 -2.177 1.00 0.00 H new ATOM 0 HD21 LEU B 127 8.166 -2.410 -3.797 1.00 0.00 H new ATOM 0 HD22 LEU B 127 9.784 -2.328 -4.535 1.00 0.00 H new ATOM 0 HD23 LEU B 127 8.728 -3.725 -4.856 1.00 0.00 H new ATOM 1653 N GLY B 128 13.344 -6.613 -3.267 1.00 0.00 N ATOM 1654 CA GLY B 128 14.005 -7.817 -3.784 1.00 0.00 C ATOM 1655 C GLY B 128 13.198 -8.512 -4.888 1.00 0.00 C ATOM 1656 O GLY B 128 12.762 -7.875 -5.848 1.00 0.00 O ATOM 0 H GLY B 128 13.895 -5.765 -3.395 1.00 0.00 H new ATOM 0 HA2 GLY B 128 14.987 -7.548 -4.173 1.00 0.00 H new ATOM 0 HA3 GLY B 128 14.168 -8.517 -2.964 1.00 0.00 H new ATOM 1660 N LYS B 129 12.962 -9.820 -4.742 1.00 0.00 N ATOM 1661 CA LYS B 129 12.165 -10.641 -5.683 1.00 0.00 C ATOM 1662 C LYS B 129 10.698 -10.212 -5.818 1.00 0.00 C ATOM 1663 O LYS B 129 10.069 -10.548 -6.820 1.00 0.00 O ATOM 1664 CB LYS B 129 12.240 -12.125 -5.277 1.00 0.00 C ATOM 1665 CG LYS B 129 13.603 -12.786 -5.533 1.00 0.00 C ATOM 1666 CD LYS B 129 14.073 -12.846 -6.999 1.00 0.00 C ATOM 1667 CE LYS B 129 13.169 -13.660 -7.939 1.00 0.00 C ATOM 1668 NZ LYS B 129 12.071 -12.860 -8.546 1.00 0.00 N1+ ATOM 0 H LYS B 129 13.323 -10.356 -3.953 1.00 0.00 H new ATOM 0 HA LYS B 129 12.612 -10.484 -6.665 1.00 0.00 H new ATOM 0 HB2 LYS B 129 12.002 -12.211 -4.217 1.00 0.00 H new ATOM 0 HB3 LYS B 129 11.474 -12.677 -5.822 1.00 0.00 H new ATOM 0 HG2 LYS B 129 14.356 -12.250 -4.955 1.00 0.00 H new ATOM 0 HG3 LYS B 129 13.567 -13.804 -5.144 1.00 0.00 H new ATOM 0 HD2 LYS B 129 14.148 -11.828 -7.383 1.00 0.00 H new ATOM 0 HD3 LYS B 129 15.076 -13.271 -7.026 1.00 0.00 H new ATOM 0 HE2 LYS B 129 13.778 -14.089 -8.735 1.00 0.00 H new ATOM 0 HE3 LYS B 129 12.737 -14.493 -7.384 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 11.869 -13.217 -9.502 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 11.217 -12.940 -7.958 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 12.359 -11.862 -8.603 1.00 0.00 H new ATOM 1682 N GLU B 130 10.156 -9.456 -4.857 1.00 0.00 N ATOM 1683 CA GLU B 130 8.791 -8.901 -4.911 1.00 0.00 C ATOM 1684 C GLU B 130 8.689 -7.577 -5.704 1.00 0.00 C ATOM 1685 O GLU B 130 7.584 -7.075 -5.906 1.00 0.00 O ATOM 1686 CB GLU B 130 8.224 -8.720 -3.490 1.00 0.00 C ATOM 1687 CG GLU B 130 8.326 -9.953 -2.576 1.00 0.00 C ATOM 1688 CD GLU B 130 7.898 -11.272 -3.248 1.00 0.00 C ATOM 1689 OE1 GLU B 130 6.840 -11.306 -3.924 1.00 0.00 O ATOM 1690 OE2 GLU B 130 8.609 -12.294 -3.083 1.00 0.00 O1- ATOM 0 H GLU B 130 10.658 -9.206 -4.005 1.00 0.00 H new ATOM 0 HA GLU B 130 8.191 -9.630 -5.456 1.00 0.00 H new ATOM 0 HB2 GLU B 130 8.746 -7.891 -3.012 1.00 0.00 H new ATOM 0 HB3 GLU B 130 7.175 -8.434 -3.569 1.00 0.00 H new ATOM 0 HG2 GLU B 130 9.355 -10.051 -2.230 1.00 0.00 H new ATOM 0 HG3 GLU B 130 7.707 -9.790 -1.694 1.00 0.00 H new ATOM 1697 N PHE B 131 9.811 -7.018 -6.188 1.00 0.00 N ATOM 1698 CA PHE B 131 9.827 -5.820 -7.042 1.00 0.00 C ATOM 1699 C PHE B 131 9.005 -6.020 -8.326 1.00 0.00 C ATOM 1700 O PHE B 131 8.963 -7.126 -8.872 1.00 0.00 O ATOM 1701 CB PHE B 131 11.282 -5.413 -7.340 1.00 0.00 C ATOM 1702 CG PHE B 131 11.423 -4.115 -8.111 1.00 0.00 C ATOM 1703 CD1 PHE B 131 11.416 -4.120 -9.517 1.00 0.00 C ATOM 1704 CD2 PHE B 131 11.560 -2.899 -7.416 1.00 0.00 C ATOM 1705 CE1 PHE B 131 11.550 -2.917 -10.229 1.00 0.00 C ATOM 1706 CE2 PHE B 131 11.722 -1.697 -8.127 1.00 0.00 C ATOM 1707 CZ PHE B 131 11.713 -1.699 -9.533 1.00 0.00 C ATOM 0 H PHE B 131 10.741 -7.389 -5.995 1.00 0.00 H new ATOM 0 HA PHE B 131 9.347 -5.003 -6.503 1.00 0.00 H new ATOM 0 HB2 PHE B 131 11.822 -5.322 -6.397 1.00 0.00 H new ATOM 0 HB3 PHE B 131 11.761 -6.212 -7.906 1.00 0.00 H new ATOM 0 HD1 PHE B 131 11.307 -5.052 -10.051 1.00 0.00 H new ATOM 0 HD2 PHE B 131 11.541 -2.889 -6.336 1.00 0.00 H new ATOM 0 HE1 PHE B 131 11.528 -2.923 -11.309 1.00 0.00 H new ATOM 0 HE2 PHE B 131 11.854 -0.769 -7.591 1.00 0.00 H new ATOM 0 HZ PHE B 131 11.830 -0.774 -10.078 1.00 0.00 H new ATOM 1717 N ILE B 132 8.322 -4.966 -8.787 1.00 0.00 N ATOM 1718 CA ILE B 132 7.287 -5.036 -9.834 1.00 0.00 C ATOM 1719 C ILE B 132 7.817 -5.527 -11.197 1.00 0.00 C ATOM 1720 O ILE B 132 8.961 -5.266 -11.577 1.00 0.00 O ATOM 1721 CB ILE B 132 6.565 -3.668 -9.932 1.00 0.00 C ATOM 1722 CG1 ILE B 132 5.141 -3.755 -10.525 1.00 0.00 C ATOM 1723 CG2 ILE B 132 7.371 -2.648 -10.758 1.00 0.00 C ATOM 1724 CD1 ILE B 132 4.152 -4.523 -9.639 1.00 0.00 C ATOM 0 H ILE B 132 8.474 -4.020 -8.438 1.00 0.00 H new ATOM 0 HA ILE B 132 6.565 -5.798 -9.540 1.00 0.00 H new ATOM 0 HB ILE B 132 6.484 -3.334 -8.898 1.00 0.00 H new ATOM 0 HG12 ILE B 132 4.762 -2.746 -10.688 1.00 0.00 H new ATOM 0 HG13 ILE B 132 5.192 -4.238 -11.501 1.00 0.00 H new ATOM 0 HG21 ILE B 132 6.828 -1.704 -10.801 1.00 0.00 H new ATOM 0 HG22 ILE B 132 8.342 -2.487 -10.290 1.00 0.00 H new ATOM 0 HG23 ILE B 132 7.514 -3.030 -11.769 1.00 0.00 H new ATOM 0 HD11 ILE B 132 3.174 -4.543 -10.119 1.00 0.00 H new ATOM 0 HD12 ILE B 132 4.508 -5.543 -9.497 1.00 0.00 H new ATOM 0 HD13 ILE B 132 4.071 -4.029 -8.671 1.00 0.00 H new ATOM 1993 N TRP B 156 -4.659 12.734 10.420 1.00 0.00 N ATOM 1994 CA TRP B 156 -3.946 11.463 10.228 1.00 0.00 C ATOM 1995 C TRP B 156 -4.395 10.693 8.977 1.00 0.00 C ATOM 1996 O TRP B 156 -3.551 10.209 8.224 1.00 0.00 O ATOM 1997 CB TRP B 156 -4.072 10.592 11.497 1.00 0.00 C ATOM 1998 CG TRP B 156 -5.444 10.076 11.843 1.00 0.00 C ATOM 1999 CD1 TRP B 156 -6.316 10.676 12.687 1.00 0.00 C ATOM 2000 CD2 TRP B 156 -6.134 8.880 11.347 1.00 0.00 C ATOM 2001 NE1 TRP B 156 -7.499 9.963 12.719 1.00 0.00 N ATOM 2002 CE2 TRP B 156 -7.455 8.866 11.890 1.00 0.00 C ATOM 2003 CE3 TRP B 156 -5.788 7.816 10.479 1.00 0.00 C ATOM 2004 CZ2 TRP B 156 -8.395 7.878 11.557 1.00 0.00 C ATOM 2005 CZ3 TRP B 156 -6.716 6.808 10.151 1.00 0.00 C ATOM 2006 CH2 TRP B 156 -8.019 6.844 10.683 1.00 0.00 C ATOM 0 HA TRP B 156 -2.897 11.708 10.060 1.00 0.00 H new ATOM 0 HB2 TRP B 156 -3.407 9.736 11.387 1.00 0.00 H new ATOM 0 HB3 TRP B 156 -3.706 11.173 12.343 1.00 0.00 H new ATOM 0 HD1 TRP B 156 -6.117 11.576 13.250 1.00 0.00 H new ATOM 0 HE1 TRP B 156 -8.306 10.219 13.288 1.00 0.00 H new ATOM 0 HE3 TRP B 156 -4.793 7.776 10.060 1.00 0.00 H new ATOM 0 HZ2 TRP B 156 -9.394 7.912 11.967 1.00 0.00 H new ATOM 0 HZ3 TRP B 156 -6.427 6.005 9.489 1.00 0.00 H new ATOM 0 HH2 TRP B 156 -8.731 6.076 10.419 1.00 0.00 H new ATOM 2017 N LYS B 157 -5.708 10.603 8.723 1.00 0.00 N ATOM 2018 CA LYS B 157 -6.265 9.869 7.569 1.00 0.00 C ATOM 2019 C LYS B 157 -6.038 10.614 6.245 1.00 0.00 C ATOM 2020 O LYS B 157 -5.724 9.989 5.234 1.00 0.00 O ATOM 2021 CB LYS B 157 -7.750 9.531 7.819 1.00 0.00 C ATOM 2022 CG LYS B 157 -8.680 10.757 7.805 1.00 0.00 C ATOM 2023 CD LYS B 157 -10.137 10.399 8.105 1.00 0.00 C ATOM 2024 CE LYS B 157 -11.033 11.649 8.046 1.00 0.00 C ATOM 2025 NZ LYS B 157 -11.134 12.211 6.674 1.00 0.00 N1+ ATOM 0 H LYS B 157 -6.419 11.037 9.312 1.00 0.00 H new ATOM 0 HA LYS B 157 -5.725 8.927 7.468 1.00 0.00 H new ATOM 0 HB2 LYS B 157 -8.085 8.825 7.059 1.00 0.00 H new ATOM 0 HB3 LYS B 157 -7.841 9.029 8.782 1.00 0.00 H new ATOM 0 HG2 LYS B 157 -8.330 11.481 8.540 1.00 0.00 H new ATOM 0 HG3 LYS B 157 -8.623 11.240 6.829 1.00 0.00 H new ATOM 0 HD2 LYS B 157 -10.490 9.660 7.386 1.00 0.00 H new ATOM 0 HD3 LYS B 157 -10.208 9.942 9.092 1.00 0.00 H new ATOM 0 HE2 LYS B 157 -12.030 11.395 8.406 1.00 0.00 H new ATOM 0 HE3 LYS B 157 -10.636 12.409 8.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 157 -11.850 12.965 6.659 1.00 0.00 H new ATOM 0 HZ2 LYS B 157 -10.213 12.603 6.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 157 -11.409 11.459 6.010 1.00 0.00 H new ATOM 2039 N ASP B 158 -6.161 11.943 6.252 1.00 0.00 N ATOM 2040 CA ASP B 158 -6.043 12.788 5.055 1.00 0.00 C ATOM 2041 C ASP B 158 -4.585 12.880 4.577 1.00 0.00 C ATOM 2042 O ASP B 158 -4.312 12.655 3.401 1.00 0.00 O ATOM 2043 CB ASP B 158 -6.615 14.194 5.307 1.00 0.00 C ATOM 2044 CG ASP B 158 -8.142 14.268 5.503 1.00 0.00 C ATOM 2045 OD1 ASP B 158 -8.866 13.253 5.355 1.00 0.00 O ATOM 2046 OD2 ASP B 158 -8.637 15.381 5.799 1.00 0.00 O1- ATOM 0 H ASP B 158 -6.349 12.474 7.102 1.00 0.00 H new ATOM 0 HA ASP B 158 -6.630 12.317 4.267 1.00 0.00 H new ATOM 0 HB2 ASP B 158 -6.133 14.609 6.192 1.00 0.00 H new ATOM 0 HB3 ASP B 158 -6.343 14.833 4.467 1.00 0.00 H new ATOM 2051 N ASP B 159 -3.635 13.146 5.483 1.00 0.00 N ATOM 2052 CA ASP B 159 -2.198 13.231 5.171 1.00 0.00 C ATOM 2053 C ASP B 159 -1.648 11.894 4.632 1.00 0.00 C ATOM 2054 O ASP B 159 -0.821 11.874 3.717 1.00 0.00 O ATOM 2055 CB ASP B 159 -1.448 13.628 6.448 1.00 0.00 C ATOM 2056 CG ASP B 159 0.039 13.966 6.233 1.00 0.00 C ATOM 2057 OD1 ASP B 159 0.452 14.342 5.109 1.00 0.00 O ATOM 2058 OD2 ASP B 159 0.814 13.892 7.214 1.00 0.00 O1- ATOM 0 H ASP B 159 -3.844 13.311 6.468 1.00 0.00 H new ATOM 0 HA ASP B 159 -2.052 13.978 4.391 1.00 0.00 H new ATOM 0 HB2 ASP B 159 -1.944 14.491 6.893 1.00 0.00 H new ATOM 0 HB3 ASP B 159 -1.522 12.812 7.167 1.00 0.00 H new ATOM 2063 N TYR B 160 -2.140 10.777 5.170 1.00 0.00 N ATOM 2064 CA TYR B 160 -1.731 9.431 4.776 1.00 0.00 C ATOM 2065 C TYR B 160 -2.303 9.052 3.398 1.00 0.00 C ATOM 2066 O TYR B 160 -1.544 8.795 2.462 1.00 0.00 O ATOM 2067 CB TYR B 160 -2.152 8.459 5.887 1.00 0.00 C ATOM 2068 CG TYR B 160 -1.632 7.044 5.759 1.00 0.00 C ATOM 2069 CD1 TYR B 160 -0.251 6.792 5.899 1.00 0.00 C ATOM 2070 CD2 TYR B 160 -2.531 5.974 5.584 1.00 0.00 C ATOM 2071 CE1 TYR B 160 0.233 5.470 5.875 1.00 0.00 C ATOM 2072 CE2 TYR B 160 -2.049 4.653 5.575 1.00 0.00 C ATOM 2073 CZ TYR B 160 -0.666 4.401 5.720 1.00 0.00 C ATOM 2074 OH TYR B 160 -0.207 3.122 5.747 1.00 0.00 O ATOM 0 H TYR B 160 -2.847 10.784 5.905 1.00 0.00 H new ATOM 0 HA TYR B 160 -0.648 9.382 4.661 1.00 0.00 H new ATOM 0 HB2 TYR B 160 -1.818 8.863 6.843 1.00 0.00 H new ATOM 0 HB3 TYR B 160 -3.241 8.424 5.919 1.00 0.00 H new ATOM 0 HD1 TYR B 160 0.437 7.615 6.025 1.00 0.00 H new ATOM 0 HD2 TYR B 160 -3.586 6.167 5.457 1.00 0.00 H new ATOM 0 HE1 TYR B 160 1.291 5.278 5.975 1.00 0.00 H new ATOM 0 HE2 TYR B 160 -2.737 3.829 5.457 1.00 0.00 H new ATOM 0 HH TYR B 160 -0.904 2.532 6.101 1.00 0.00 H new ATOM 2084 N LEU B 161 -3.631 9.085 3.230 1.00 0.00 N ATOM 2085 CA LEU B 161 -4.288 8.653 1.989 1.00 0.00 C ATOM 2086 C LEU B 161 -3.942 9.552 0.778 1.00 0.00 C ATOM 2087 O LEU B 161 -3.798 9.049 -0.335 1.00 0.00 O ATOM 2088 CB LEU B 161 -5.807 8.558 2.251 1.00 0.00 C ATOM 2089 CG LEU B 161 -6.627 7.919 1.112 1.00 0.00 C ATOM 2090 CD1 LEU B 161 -6.205 6.477 0.812 1.00 0.00 C ATOM 2091 CD2 LEU B 161 -8.103 7.909 1.500 1.00 0.00 C ATOM 0 H LEU B 161 -4.279 9.411 3.948 1.00 0.00 H new ATOM 0 HA LEU B 161 -3.910 7.670 1.709 1.00 0.00 H new ATOM 0 HB2 LEU B 161 -5.968 7.981 3.162 1.00 0.00 H new ATOM 0 HB3 LEU B 161 -6.192 9.561 2.437 1.00 0.00 H new ATOM 0 HG LEU B 161 -6.448 8.517 0.218 1.00 0.00 H new ATOM 0 HD11 LEU B 161 -6.817 6.080 0.002 1.00 0.00 H new ATOM 0 HD12 LEU B 161 -5.156 6.459 0.517 1.00 0.00 H new ATOM 0 HD13 LEU B 161 -6.342 5.865 1.704 1.00 0.00 H new ATOM 0 HD21 LEU B 161 -8.687 7.458 0.698 1.00 0.00 H new ATOM 0 HD22 LEU B 161 -8.235 7.330 2.414 1.00 0.00 H new ATOM 0 HD23 LEU B 161 -8.443 8.931 1.666 1.00 0.00 H new ATOM 2103 N SER B 162 -3.717 10.851 1.006 1.00 0.00 N ATOM 2104 CA SER B 162 -3.262 11.818 -0.012 1.00 0.00 C ATOM 2105 C SER B 162 -1.845 11.526 -0.553 1.00 0.00 C ATOM 2106 O SER B 162 -1.520 11.885 -1.693 1.00 0.00 O ATOM 2107 CB SER B 162 -3.331 13.227 0.595 1.00 0.00 C ATOM 2108 OG SER B 162 -3.015 14.242 -0.342 1.00 0.00 O ATOM 0 H SER B 162 -3.848 11.274 1.925 1.00 0.00 H new ATOM 0 HA SER B 162 -3.924 11.732 -0.874 1.00 0.00 H new ATOM 0 HB2 SER B 162 -4.333 13.400 0.988 1.00 0.00 H new ATOM 0 HB3 SER B 162 -2.643 13.289 1.438 1.00 0.00 H new ATOM 0 HG SER B 162 -3.075 15.118 0.092 1.00 0.00 H new ATOM 2114 N ARG B 163 -0.999 10.827 0.220 1.00 0.00 N ATOM 2115 CA ARG B 163 0.305 10.308 -0.233 1.00 0.00 C ATOM 2116 C ARG B 163 0.149 8.971 -0.948 1.00 0.00 C ATOM 2117 O ARG B 163 0.667 8.815 -2.050 1.00 0.00 O ATOM 2118 CB ARG B 163 1.270 10.178 0.961 1.00 0.00 C ATOM 2119 CG ARG B 163 1.645 11.563 1.500 1.00 0.00 C ATOM 2120 CD ARG B 163 2.316 11.474 2.869 1.00 0.00 C ATOM 2121 NE ARG B 163 2.333 12.798 3.507 1.00 0.00 N ATOM 2122 CZ ARG B 163 3.142 13.805 3.259 1.00 0.00 C ATOM 2123 NH1 ARG B 163 4.197 13.720 2.500 1.00 0.00 N1+ ATOM 2124 NH2 ARG B 163 2.833 14.954 3.779 1.00 0.00 N ATOM 0 H ARG B 163 -1.204 10.602 1.194 1.00 0.00 H new ATOM 0 HA ARG B 163 0.724 11.017 -0.946 1.00 0.00 H new ATOM 0 HB2 ARG B 163 0.804 9.588 1.750 1.00 0.00 H new ATOM 0 HB3 ARG B 163 2.170 9.645 0.653 1.00 0.00 H new ATOM 0 HG2 ARG B 163 2.316 12.057 0.797 1.00 0.00 H new ATOM 0 HG3 ARG B 163 0.749 12.180 1.573 1.00 0.00 H new ATOM 0 HD2 ARG B 163 1.781 10.764 3.500 1.00 0.00 H new ATOM 0 HD3 ARG B 163 3.334 11.100 2.761 1.00 0.00 H new ATOM 0 HE ARG B 163 1.632 12.955 4.231 1.00 0.00 H new ATOM 0 HH11 ARG B 163 4.437 12.833 2.057 1.00 0.00 H new ATOM 0 HH12 ARG B 163 4.784 14.541 2.348 1.00 0.00 H new ATOM 0 HH21 ARG B 163 1.994 15.046 4.351 1.00 0.00 H new ATOM 0 HH22 ARG B 163 3.430 15.765 3.615 1.00 0.00 H new ATOM 2138 N LEU B 164 -0.595 8.020 -0.380 1.00 0.00 N ATOM 2139 CA LEU B 164 -0.769 6.691 -0.980 1.00 0.00 C ATOM 2140 C LEU B 164 -1.512 6.722 -2.336 1.00 0.00 C ATOM 2141 O LEU B 164 -1.338 5.805 -3.142 1.00 0.00 O ATOM 2142 CB LEU B 164 -1.437 5.738 0.032 1.00 0.00 C ATOM 2143 CG LEU B 164 -0.474 5.113 1.064 1.00 0.00 C ATOM 2144 CD1 LEU B 164 0.022 6.054 2.159 1.00 0.00 C ATOM 2145 CD2 LEU B 164 -1.172 3.938 1.747 1.00 0.00 C ATOM 0 H LEU B 164 -1.091 8.145 0.502 1.00 0.00 H new ATOM 0 HA LEU B 164 0.224 6.307 -1.215 1.00 0.00 H new ATOM 0 HB2 LEU B 164 -2.215 6.284 0.566 1.00 0.00 H new ATOM 0 HB3 LEU B 164 -1.930 4.936 -0.517 1.00 0.00 H new ATOM 0 HG LEU B 164 0.404 4.820 0.488 1.00 0.00 H new ATOM 0 HD11 LEU B 164 0.691 5.513 2.828 1.00 0.00 H new ATOM 0 HD12 LEU B 164 0.558 6.888 1.707 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.828 6.434 2.725 1.00 0.00 H new ATOM 0 HD21 LEU B 164 -0.499 3.490 2.478 1.00 0.00 H new ATOM 0 HD22 LEU B 164 -2.071 4.292 2.251 1.00 0.00 H new ATOM 0 HD23 LEU B 164 -1.444 3.192 1.000 1.00 0.00 H new ATOM 2157 N SER B 165 -2.269 7.781 -2.652 1.00 0.00 N ATOM 2158 CA SER B 165 -2.802 8.017 -4.006 1.00 0.00 C ATOM 2159 C SER B 165 -1.749 8.533 -5.010 1.00 0.00 C ATOM 2160 O SER B 165 -1.848 8.238 -6.203 1.00 0.00 O ATOM 2161 CB SER B 165 -3.994 8.979 -3.938 1.00 0.00 C ATOM 2162 OG SER B 165 -3.598 10.278 -3.521 1.00 0.00 O ATOM 0 H SER B 165 -2.531 8.500 -1.978 1.00 0.00 H new ATOM 0 HA SER B 165 -3.124 7.047 -4.384 1.00 0.00 H new ATOM 0 HB2 SER B 165 -4.469 9.040 -4.917 1.00 0.00 H new ATOM 0 HB3 SER B 165 -4.740 8.586 -3.247 1.00 0.00 H new ATOM 0 HG SER B 165 -4.382 10.865 -3.490 1.00 0.00 H new ATOM 2168 N ARG B 166 -0.706 9.254 -4.558 1.00 0.00 N ATOM 2169 CA ARG B 166 0.366 9.837 -5.398 1.00 0.00 C ATOM 2170 C ARG B 166 1.578 8.921 -5.605 1.00 0.00 C ATOM 2171 O ARG B 166 2.111 8.871 -6.716 1.00 0.00 O ATOM 2172 CB ARG B 166 0.830 11.153 -4.758 1.00 0.00 C ATOM 2173 CG ARG B 166 -0.207 12.270 -4.906 1.00 0.00 C ATOM 2174 CD ARG B 166 0.249 13.531 -4.158 1.00 0.00 C ATOM 2175 NE ARG B 166 -0.589 14.701 -4.478 1.00 0.00 N ATOM 2176 CZ ARG B 166 -1.803 14.948 -4.027 1.00 0.00 C ATOM 2177 NH1 ARG B 166 -2.428 14.128 -3.238 1.00 0.00 N1+ ATOM 2178 NH2 ARG B 166 -2.422 16.040 -4.372 1.00 0.00 N ATOM 0 H ARG B 166 -0.579 9.455 -3.566 1.00 0.00 H new ATOM 0 HA ARG B 166 -0.064 9.993 -6.387 1.00 0.00 H new ATOM 0 HB2 ARG B 166 1.034 10.988 -3.700 1.00 0.00 H new ATOM 0 HB3 ARG B 166 1.767 11.467 -5.218 1.00 0.00 H new ATOM 0 HG2 ARG B 166 -0.354 12.500 -5.961 1.00 0.00 H new ATOM 0 HG3 ARG B 166 -1.168 11.936 -4.515 1.00 0.00 H new ATOM 0 HD2 ARG B 166 0.217 13.346 -3.084 1.00 0.00 H new ATOM 0 HD3 ARG B 166 1.286 13.748 -4.414 1.00 0.00 H new ATOM 0 HE ARG B 166 -0.188 15.390 -5.114 1.00 0.00 H new ATOM 0 HH11 ARG B 166 -1.980 13.259 -2.947 1.00 0.00 H new ATOM 0 HH12 ARG B 166 -3.367 14.353 -2.909 1.00 0.00 H new ATOM 0 HH21 ARG B 166 -1.968 16.709 -4.994 1.00 0.00 H new ATOM 0 HH22 ARG B 166 -3.361 16.227 -4.021 1.00 0.00 H new ATOM 2192 N LEU B 167 2.018 8.223 -4.560 1.00 0.00 N ATOM 2193 CA LEU B 167 3.214 7.364 -4.557 1.00 0.00 C ATOM 2194 C LEU B 167 3.097 6.183 -5.540 1.00 0.00 C ATOM 2195 O LEU B 167 2.002 5.714 -5.871 1.00 0.00 O ATOM 2196 CB LEU B 167 3.480 6.884 -3.110 1.00 0.00 C ATOM 2197 CG LEU B 167 4.446 7.776 -2.304 1.00 0.00 C ATOM 2198 CD1 LEU B 167 4.022 9.243 -2.194 1.00 0.00 C ATOM 2199 CD2 LEU B 167 4.592 7.208 -0.894 1.00 0.00 C ATOM 0 H LEU B 167 1.540 8.236 -3.659 1.00 0.00 H new ATOM 0 HA LEU B 167 4.064 7.949 -4.907 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.530 6.829 -2.579 1.00 0.00 H new ATOM 0 HB3 LEU B 167 3.885 5.873 -3.146 1.00 0.00 H new ATOM 0 HG LEU B 167 5.387 7.767 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU B 167 4.761 9.793 -1.611 1.00 0.00 H new ATOM 0 HD12 LEU B 167 3.951 9.677 -3.191 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.052 9.305 -1.702 1.00 0.00 H new ATOM 0 HD21 LEU B 167 5.274 7.834 -0.318 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.617 7.190 -0.406 1.00 0.00 H new ATOM 0 HD23 LEU B 167 4.989 6.194 -0.949 1.00 0.00 H new ATOM 2211 N SER B 168 4.243 5.704 -6.030 1.00 0.00 N ATOM 2212 CA SER B 168 4.332 4.563 -6.958 1.00 0.00 C ATOM 2213 C SER B 168 4.106 3.242 -6.216 1.00 0.00 C ATOM 2214 O SER B 168 4.429 3.147 -5.032 1.00 0.00 O ATOM 2215 CB SER B 168 5.708 4.528 -7.634 1.00 0.00 C ATOM 2216 OG SER B 168 5.958 5.735 -8.346 1.00 0.00 O ATOM 0 H SER B 168 5.152 6.101 -5.792 1.00 0.00 H new ATOM 0 HA SER B 168 3.557 4.687 -7.715 1.00 0.00 H new ATOM 0 HB2 SER B 168 6.483 4.378 -6.882 1.00 0.00 H new ATOM 0 HB3 SER B 168 5.760 3.681 -8.318 1.00 0.00 H new ATOM 0 HG SER B 168 6.842 5.689 -8.767 1.00 0.00 H new ATOM 2222 N LYS B 169 3.623 2.180 -6.882 1.00 0.00 N ATOM 2223 CA LYS B 169 3.346 0.875 -6.235 1.00 0.00 C ATOM 2224 C LYS B 169 4.563 0.279 -5.503 1.00 0.00 C ATOM 2225 O LYS B 169 4.412 -0.358 -4.460 1.00 0.00 O ATOM 2226 CB LYS B 169 2.742 -0.077 -7.280 1.00 0.00 C ATOM 2227 CG LYS B 169 2.460 -1.471 -6.697 1.00 0.00 C ATOM 2228 CD LYS B 169 1.536 -2.298 -7.591 1.00 0.00 C ATOM 2229 CE LYS B 169 1.492 -3.736 -7.070 1.00 0.00 C ATOM 2230 NZ LYS B 169 0.527 -4.557 -7.837 1.00 0.00 N1+ ATOM 0 H LYS B 169 3.412 2.196 -7.880 1.00 0.00 H new ATOM 0 HA LYS B 169 2.619 1.032 -5.438 1.00 0.00 H new ATOM 0 HB2 LYS B 169 1.815 0.349 -7.665 1.00 0.00 H new ATOM 0 HB3 LYS B 169 3.425 -0.169 -8.124 1.00 0.00 H new ATOM 0 HG2 LYS B 169 3.402 -2.003 -6.561 1.00 0.00 H new ATOM 0 HG3 LYS B 169 2.008 -1.365 -5.711 1.00 0.00 H new ATOM 0 HD2 LYS B 169 0.534 -1.869 -7.596 1.00 0.00 H new ATOM 0 HD3 LYS B 169 1.895 -2.282 -8.620 1.00 0.00 H new ATOM 0 HE2 LYS B 169 2.485 -4.180 -7.138 1.00 0.00 H new ATOM 0 HE3 LYS B 169 1.215 -3.735 -6.016 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 0.809 -5.557 -7.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -0.423 -4.447 -7.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 0.517 -4.245 -8.829 1.00 0.00 H new ATOM 2244 N ASN B 170 5.781 0.537 -5.986 1.00 0.00 N ATOM 2245 CA ASN B 170 7.037 0.175 -5.321 1.00 0.00 C ATOM 2246 C ASN B 170 7.214 0.906 -3.971 1.00 0.00 C ATOM 2247 O ASN B 170 7.604 0.291 -2.976 1.00 0.00 O ATOM 2248 CB ASN B 170 8.202 0.491 -6.270 1.00 0.00 C ATOM 2249 CG ASN B 170 8.047 -0.134 -7.649 1.00 0.00 C ATOM 2250 OD1 ASN B 170 7.426 0.424 -8.543 1.00 0.00 O ATOM 2251 ND2 ASN B 170 8.591 -1.306 -7.872 1.00 0.00 N ATOM 0 H ASN B 170 5.926 1.016 -6.875 1.00 0.00 H new ATOM 0 HA ASN B 170 7.018 -0.891 -5.093 1.00 0.00 H new ATOM 0 HB2 ASN B 170 8.290 1.572 -6.377 1.00 0.00 H new ATOM 0 HB3 ASN B 170 9.131 0.139 -5.822 1.00 0.00 H new ATOM 0 HD21 ASN B 170 8.495 -1.747 -8.787 1.00 0.00 H new ATOM 0 HD22 ASN B 170 9.110 -1.777 -7.131 1.00 0.00 H new ATOM 2258 N GLN B 171 6.875 2.199 -3.917 1.00 0.00 N ATOM 2259 CA GLN B 171 6.830 2.999 -2.688 1.00 0.00 C ATOM 2260 C GLN B 171 5.705 2.542 -1.743 1.00 0.00 C ATOM 2261 O GLN B 171 5.935 2.440 -0.535 1.00 0.00 O ATOM 2262 CB GLN B 171 6.681 4.486 -3.030 1.00 0.00 C ATOM 2263 CG GLN B 171 7.910 5.090 -3.727 1.00 0.00 C ATOM 2264 CD GLN B 171 7.650 6.537 -4.112 1.00 0.00 C ATOM 2265 OE1 GLN B 171 6.783 6.827 -4.928 1.00 0.00 O ATOM 2266 NE2 GLN B 171 8.365 7.495 -3.555 1.00 0.00 N ATOM 0 H GLN B 171 6.618 2.731 -4.748 1.00 0.00 H new ATOM 0 HA GLN B 171 7.772 2.848 -2.161 1.00 0.00 H new ATOM 0 HB2 GLN B 171 5.810 4.616 -3.673 1.00 0.00 H new ATOM 0 HB3 GLN B 171 6.486 5.042 -2.113 1.00 0.00 H new ATOM 0 HG2 GLN B 171 8.774 5.034 -3.065 1.00 0.00 H new ATOM 0 HG3 GLN B 171 8.152 4.509 -4.617 1.00 0.00 H new ATOM 0 HE21 GLN B 171 9.088 7.262 -2.875 1.00 0.00 H new ATOM 0 HE22 GLN B 171 8.194 8.469 -3.804 1.00 0.00 H new ATOM 2275 N LEU B 172 4.512 2.223 -2.271 1.00 0.00 N ATOM 2276 CA LEU B 172 3.390 1.684 -1.481 1.00 0.00 C ATOM 2277 C LEU B 172 3.758 0.366 -0.789 1.00 0.00 C ATOM 2278 O LEU B 172 3.459 0.186 0.392 1.00 0.00 O ATOM 2279 CB LEU B 172 2.133 1.497 -2.352 1.00 0.00 C ATOM 2280 CG LEU B 172 1.615 2.752 -3.078 1.00 0.00 C ATOM 2281 CD1 LEU B 172 0.332 2.436 -3.838 1.00 0.00 C ATOM 2282 CD2 LEU B 172 1.329 3.912 -2.132 1.00 0.00 C ATOM 0 H LEU B 172 4.297 2.332 -3.262 1.00 0.00 H new ATOM 0 HA LEU B 172 3.169 2.418 -0.706 1.00 0.00 H new ATOM 0 HB2 LEU B 172 2.345 0.732 -3.099 1.00 0.00 H new ATOM 0 HB3 LEU B 172 1.333 1.112 -1.720 1.00 0.00 H new ATOM 0 HG LEU B 172 2.411 3.052 -3.760 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -0.021 3.334 -4.345 1.00 0.00 H new ATOM 0 HD12 LEU B 172 0.528 1.656 -4.574 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -0.430 2.092 -3.139 1.00 0.00 H new ATOM 0 HD21 LEU B 172 0.967 4.767 -2.703 1.00 0.00 H new ATOM 0 HD22 LEU B 172 0.571 3.613 -1.408 1.00 0.00 H new ATOM 0 HD23 LEU B 172 2.244 4.188 -1.607 1.00 0.00 H new ATOM 2294 N MET B 173 4.459 -0.533 -1.487 1.00 0.00 N ATOM 2295 CA MET B 173 5.046 -1.740 -0.896 1.00 0.00 C ATOM 2296 C MET B 173 6.091 -1.403 0.190 1.00 0.00 C ATOM 2297 O MET B 173 6.046 -1.966 1.282 1.00 0.00 O ATOM 2298 CB MET B 173 5.688 -2.596 -2.004 1.00 0.00 C ATOM 2299 CG MET B 173 4.710 -3.628 -2.562 1.00 0.00 C ATOM 2300 SD MET B 173 5.472 -4.879 -3.637 1.00 0.00 S ATOM 2301 CE MET B 173 5.580 -3.973 -5.202 1.00 0.00 C ATOM 0 H MET B 173 4.637 -0.443 -2.487 1.00 0.00 H new ATOM 0 HA MET B 173 4.246 -2.300 -0.412 1.00 0.00 H new ATOM 0 HB2 MET B 173 6.032 -1.948 -2.810 1.00 0.00 H new ATOM 0 HB3 MET B 173 6.566 -3.105 -1.607 1.00 0.00 H new ATOM 0 HG2 MET B 173 4.219 -4.132 -1.730 1.00 0.00 H new ATOM 0 HG3 MET B 173 3.933 -3.108 -3.123 1.00 0.00 H new ATOM 0 HE1 MET B 173 6.124 -4.572 -5.932 1.00 0.00 H new ATOM 0 HE2 MET B 173 4.576 -3.770 -5.575 1.00 0.00 H new ATOM 0 HE3 MET B 173 6.105 -3.031 -5.042 1.00 0.00 H new ATOM 2311 N ALA B 174 7.004 -0.465 -0.080 1.00 0.00 N ATOM 2312 CA ALA B 174 8.100 -0.131 0.830 1.00 0.00 C ATOM 2313 C ALA B 174 7.651 0.543 2.139 1.00 0.00 C ATOM 2314 O ALA B 174 8.090 0.128 3.214 1.00 0.00 O ATOM 2315 CB ALA B 174 9.109 0.730 0.070 1.00 0.00 C ATOM 0 H ALA B 174 7.002 0.085 -0.939 1.00 0.00 H new ATOM 0 HA ALA B 174 8.560 -1.064 1.155 1.00 0.00 H new ATOM 0 HB1 ALA B 174 9.936 0.991 0.731 1.00 0.00 H new ATOM 0 HB2 ALA B 174 9.490 0.173 -0.786 1.00 0.00 H new ATOM 0 HB3 ALA B 174 8.621 1.641 -0.278 1.00 0.00 H new ATOM 2321 N LEU B 175 6.755 1.538 2.081 1.00 0.00 N ATOM 2322 CA LEU B 175 6.248 2.225 3.278 1.00 0.00 C ATOM 2323 C LEU B 175 5.461 1.266 4.178 1.00 0.00 C ATOM 2324 O LEU B 175 5.618 1.287 5.404 1.00 0.00 O ATOM 2325 CB LEU B 175 5.459 3.499 2.891 1.00 0.00 C ATOM 2326 CG LEU B 175 4.051 3.305 2.286 1.00 0.00 C ATOM 2327 CD1 LEU B 175 2.953 3.349 3.354 1.00 0.00 C ATOM 2328 CD2 LEU B 175 3.727 4.413 1.281 1.00 0.00 C ATOM 0 H LEU B 175 6.362 1.888 1.207 1.00 0.00 H new ATOM 0 HA LEU B 175 7.096 2.562 3.874 1.00 0.00 H new ATOM 0 HB2 LEU B 175 5.360 4.118 3.783 1.00 0.00 H new ATOM 0 HB3 LEU B 175 6.058 4.063 2.176 1.00 0.00 H new ATOM 0 HG LEU B 175 4.070 2.327 1.805 1.00 0.00 H new ATOM 0 HD11 LEU B 175 1.981 3.208 2.882 1.00 0.00 H new ATOM 0 HD12 LEU B 175 3.121 2.555 4.082 1.00 0.00 H new ATOM 0 HD13 LEU B 175 2.975 4.315 3.859 1.00 0.00 H new ATOM 0 HD21 LEU B 175 2.730 4.252 0.871 1.00 0.00 H new ATOM 0 HD22 LEU B 175 3.761 5.380 1.782 1.00 0.00 H new ATOM 0 HD23 LEU B 175 4.459 4.397 0.473 1.00 0.00 H new ATOM 2340 N ALA B 176 4.678 0.372 3.566 1.00 0.00 N ATOM 2341 CA ALA B 176 3.900 -0.645 4.260 1.00 0.00 C ATOM 2342 C ALA B 176 4.793 -1.703 4.930 1.00 0.00 C ATOM 2343 O ALA B 176 4.561 -2.072 6.083 1.00 0.00 O ATOM 2344 CB ALA B 176 2.940 -1.274 3.254 1.00 0.00 C ATOM 0 H ALA B 176 4.569 0.339 2.552 1.00 0.00 H new ATOM 0 HA ALA B 176 3.338 -0.180 5.070 1.00 0.00 H new ATOM 0 HB1 ALA B 176 2.344 -2.041 3.750 1.00 0.00 H new ATOM 0 HB2 ALA B 176 2.280 -0.506 2.851 1.00 0.00 H new ATOM 0 HB3 ALA B 176 3.509 -1.726 2.441 1.00 0.00 H new ATOM 2350 N LEU B 177 5.859 -2.154 4.260 1.00 0.00 N ATOM 2351 CA LEU B 177 6.836 -3.095 4.822 1.00 0.00 C ATOM 2352 C LEU B 177 7.560 -2.490 6.039 1.00 0.00 C ATOM 2353 O LEU B 177 7.643 -3.133 7.089 1.00 0.00 O ATOM 2354 CB LEU B 177 7.792 -3.530 3.689 1.00 0.00 C ATOM 2355 CG LEU B 177 8.741 -4.718 3.951 1.00 0.00 C ATOM 2356 CD1 LEU B 177 9.910 -4.401 4.890 1.00 0.00 C ATOM 2357 CD2 LEU B 177 8.008 -5.953 4.473 1.00 0.00 C ATOM 0 H LEU B 177 6.071 -1.874 3.302 1.00 0.00 H new ATOM 0 HA LEU B 177 6.336 -3.984 5.207 1.00 0.00 H new ATOM 0 HB2 LEU B 177 7.185 -3.775 2.817 1.00 0.00 H new ATOM 0 HB3 LEU B 177 8.403 -2.669 3.420 1.00 0.00 H new ATOM 0 HG LEU B 177 9.158 -4.930 2.966 1.00 0.00 H new ATOM 0 HD11 LEU B 177 10.525 -5.291 5.018 1.00 0.00 H new ATOM 0 HD12 LEU B 177 10.514 -3.601 4.462 1.00 0.00 H new ATOM 0 HD13 LEU B 177 9.523 -4.085 5.859 1.00 0.00 H new ATOM 0 HD21 LEU B 177 8.724 -6.758 4.640 1.00 0.00 H new ATOM 0 HD22 LEU B 177 7.509 -5.711 5.411 1.00 0.00 H new ATOM 0 HD23 LEU B 177 7.267 -6.273 3.741 1.00 0.00 H new ATOM 2369 N LYS B 178 8.012 -1.233 5.943 1.00 0.00 N ATOM 2370 CA LYS B 178 8.669 -0.522 7.056 1.00 0.00 C ATOM 2371 C LYS B 178 7.749 -0.343 8.271 1.00 0.00 C ATOM 2372 O LYS B 178 8.155 -0.696 9.379 1.00 0.00 O ATOM 2373 CB LYS B 178 9.228 0.826 6.576 1.00 0.00 C ATOM 2374 CG LYS B 178 10.479 0.667 5.698 1.00 0.00 C ATOM 2375 CD LYS B 178 11.032 2.045 5.287 1.00 0.00 C ATOM 2376 CE LYS B 178 12.266 1.944 4.382 1.00 0.00 C ATOM 2377 NZ LYS B 178 13.456 1.403 5.097 1.00 0.00 N1+ ATOM 0 H LYS B 178 7.934 -0.677 5.092 1.00 0.00 H new ATOM 0 HA LYS B 178 9.498 -1.145 7.391 1.00 0.00 H new ATOM 0 HB2 LYS B 178 8.459 1.355 6.014 1.00 0.00 H new ATOM 0 HB3 LYS B 178 9.471 1.443 7.441 1.00 0.00 H new ATOM 0 HG2 LYS B 178 11.243 0.110 6.241 1.00 0.00 H new ATOM 0 HG3 LYS B 178 10.234 0.087 4.808 1.00 0.00 H new ATOM 0 HD2 LYS B 178 10.253 2.605 4.770 1.00 0.00 H new ATOM 0 HD3 LYS B 178 11.289 2.610 6.183 1.00 0.00 H new ATOM 0 HE2 LYS B 178 12.036 1.304 3.530 1.00 0.00 H new ATOM 0 HE3 LYS B 178 12.503 2.931 3.985 1.00 0.00 H new ATOM 0 HZ1 LYS B 178 14.262 1.355 4.442 1.00 0.00 H new ATOM 0 HZ2 LYS B 178 13.695 2.026 5.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 178 13.243 0.450 5.454 1.00 0.00 H new ATOM 2391 N LEU B 179 6.508 0.130 8.086 1.00 0.00 N ATOM 2392 CA LEU B 179 5.561 0.304 9.202 1.00 0.00 C ATOM 2393 C LEU B 179 5.091 -1.034 9.808 1.00 0.00 C ATOM 2394 O LEU B 179 4.782 -1.081 11.002 1.00 0.00 O ATOM 2395 CB LEU B 179 4.414 1.261 8.819 1.00 0.00 C ATOM 2396 CG LEU B 179 3.384 0.752 7.801 1.00 0.00 C ATOM 2397 CD1 LEU B 179 2.258 -0.078 8.417 1.00 0.00 C ATOM 2398 CD2 LEU B 179 2.719 1.929 7.077 1.00 0.00 C ATOM 0 H LEU B 179 6.135 0.399 7.176 1.00 0.00 H new ATOM 0 HA LEU B 179 6.100 0.789 10.016 1.00 0.00 H new ATOM 0 HB2 LEU B 179 3.882 1.532 9.731 1.00 0.00 H new ATOM 0 HB3 LEU B 179 4.856 2.176 8.424 1.00 0.00 H new ATOM 0 HG LEU B 179 3.954 0.117 7.123 1.00 0.00 H new ATOM 0 HD11 LEU B 179 1.572 -0.400 7.633 1.00 0.00 H new ATOM 0 HD12 LEU B 179 2.680 -0.953 8.912 1.00 0.00 H new ATOM 0 HD13 LEU B 179 1.718 0.526 9.146 1.00 0.00 H new ATOM 0 HD21 LEU B 179 1.992 1.550 6.359 1.00 0.00 H new ATOM 0 HD22 LEU B 179 2.214 2.565 7.804 1.00 0.00 H new ATOM 0 HD23 LEU B 179 3.478 2.509 6.553 1.00 0.00 H new ATOM 2410 N LYS B 180 5.077 -2.126 9.029 1.00 0.00 N ATOM 2411 CA LYS B 180 4.824 -3.502 9.504 1.00 0.00 C ATOM 2412 C LYS B 180 5.997 -4.052 10.327 1.00 0.00 C ATOM 2413 O LYS B 180 5.775 -4.691 11.356 1.00 0.00 O ATOM 2414 CB LYS B 180 4.506 -4.395 8.285 1.00 0.00 C ATOM 2415 CG LYS B 180 4.243 -5.875 8.598 1.00 0.00 C ATOM 2416 CD LYS B 180 3.035 -6.101 9.524 1.00 0.00 C ATOM 2417 CE LYS B 180 2.811 -7.611 9.698 1.00 0.00 C ATOM 2418 NZ LYS B 180 1.643 -7.890 10.578 1.00 0.00 N1+ ATOM 0 H LYS B 180 5.245 -2.079 8.024 1.00 0.00 H new ATOM 0 HA LYS B 180 3.968 -3.496 10.178 1.00 0.00 H new ATOM 0 HB2 LYS B 180 3.631 -3.988 7.778 1.00 0.00 H new ATOM 0 HB3 LYS B 180 5.339 -4.333 7.584 1.00 0.00 H new ATOM 0 HG2 LYS B 180 4.080 -6.412 7.664 1.00 0.00 H new ATOM 0 HG3 LYS B 180 5.131 -6.304 9.062 1.00 0.00 H new ATOM 0 HD2 LYS B 180 3.211 -5.633 10.493 1.00 0.00 H new ATOM 0 HD3 LYS B 180 2.145 -5.635 9.101 1.00 0.00 H new ATOM 0 HE2 LYS B 180 2.652 -8.071 8.723 1.00 0.00 H new ATOM 0 HE3 LYS B 180 3.705 -8.066 10.123 1.00 0.00 H new ATOM 0 HZ1 LYS B 180 1.519 -8.918 10.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 180 1.807 -7.471 11.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 180 0.786 -7.476 10.159 1.00 0.00 H new ATOM 2432 N GLN B 181 7.234 -3.777 9.920 1.00 0.00 N ATOM 2433 CA GLN B 181 8.436 -4.263 10.594 1.00 0.00 C ATOM 2434 C GLN B 181 8.629 -3.628 11.985 1.00 0.00 C ATOM 2435 O GLN B 181 9.010 -4.311 12.939 1.00 0.00 O ATOM 2436 CB GLN B 181 9.643 -4.005 9.671 1.00 0.00 C ATOM 2437 CG GLN B 181 10.979 -4.476 10.272 1.00 0.00 C ATOM 2438 CD GLN B 181 12.102 -4.617 9.237 1.00 0.00 C ATOM 2439 OE1 GLN B 181 12.889 -5.555 9.260 1.00 0.00 O ATOM 2440 NE2 GLN B 181 12.218 -3.724 8.275 1.00 0.00 N ATOM 0 H GLN B 181 7.433 -3.202 9.101 1.00 0.00 H new ATOM 0 HA GLN B 181 8.335 -5.332 10.779 1.00 0.00 H new ATOM 0 HB2 GLN B 181 9.480 -4.514 8.721 1.00 0.00 H new ATOM 0 HB3 GLN B 181 9.705 -2.938 9.455 1.00 0.00 H new ATOM 0 HG2 GLN B 181 11.291 -3.769 11.041 1.00 0.00 H new ATOM 0 HG3 GLN B 181 10.828 -5.436 10.765 1.00 0.00 H new ATOM 0 HE21 GLN B 181 11.575 -2.933 8.233 1.00 0.00 H new ATOM 0 HE22 GLN B 181 12.951 -3.824 7.572 1.00 0.00 H new ATOM 2449 N GLN B 182 8.329 -2.332 12.122 1.00 0.00 N ATOM 2450 CA GLN B 182 8.487 -1.589 13.380 1.00 0.00 C ATOM 2451 C GLN B 182 7.322 -1.788 14.376 1.00 0.00 C ATOM 2452 O GLN B 182 7.525 -1.607 15.576 1.00 0.00 O ATOM 2453 CB GLN B 182 8.755 -0.105 13.057 1.00 0.00 C ATOM 2454 CG GLN B 182 7.581 0.645 12.402 1.00 0.00 C ATOM 2455 CD GLN B 182 6.567 1.204 13.406 1.00 0.00 C ATOM 2456 OE1 GLN B 182 6.900 1.902 14.359 1.00 0.00 O ATOM 2457 NE2 GLN B 182 5.295 0.914 13.238 1.00 0.00 N ATOM 0 H GLN B 182 7.966 -1.763 11.357 1.00 0.00 H new ATOM 0 HA GLN B 182 9.348 -2.000 13.907 1.00 0.00 H new ATOM 0 HB2 GLN B 182 9.024 0.409 13.980 1.00 0.00 H new ATOM 0 HB3 GLN B 182 9.619 -0.044 12.395 1.00 0.00 H new ATOM 0 HG2 GLN B 182 7.975 1.466 11.803 1.00 0.00 H new ATOM 0 HG3 GLN B 182 7.067 -0.030 11.718 1.00 0.00 H new ATOM 0 HE21 GLN B 182 5.004 0.335 12.450 1.00 0.00 H new ATOM 0 HE22 GLN B 182 4.600 1.268 13.895 1.00 0.00 H new