USER MOD reduce.3.24.130724 H: found=0, std=0, add=583, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 584 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 179 LYS NZ :NH3+ 152:sc= -0.644 (180deg=-1.48) USER MOD Set 1.2: A 189 TYR OH : rot 180:sc= 0.0985 USER MOD Set 2.1: A 165 LYS NZ :NH3+ 168:sc= 0.0512 (180deg=0.0579) USER MOD Set 2.2: A 168 MET CE :methyl 166:sc= -5.06 (180deg=-5.11!) USER MOD Set 2.3: A 169 THR OG1 : rot 180:sc= -1.06 USER MOD Single : A 121 ASN : amide:sc= -1.96 K(o=-2,f=-0.79) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 32:sc= 0.111 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 138 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0345) USER MOD Single : A 140 HIS : no HE2:sc= -0.917 K(o=-0.92,f=-2!) USER MOD Single : A 141 MET CE :methyl 131:sc= -1.84 (180deg=-7!) USER MOD Single : A 148 CYS SG : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot -123:sc= 1.25 USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 LYS NZ :NH3+ -178:sc= -1.46! (180deg=-1.51!) USER MOD Single : A 177 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 178 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 182 SER OG : rot -75:sc= -0.257 USER MOD Single : A 183 HIS : no HD1:sc= -1.56 K(o=-1.6,f=-2.5) USER MOD Single : A 187 THR OG1 : rot 180:sc= 0.0471 USER MOD Single : A 193 LYS NZ :NH3+ -150:sc= -0.0432 (180deg=-0.319) USER MOD ----------------------------------------------------------------- ATOM 240 N ASN A 121 0.653 -1.436 -7.301 1.00 0.00 N ATOM 241 CA ASN A 121 0.636 -0.030 -6.912 1.00 0.00 C ATOM 242 C ASN A 121 0.279 0.120 -5.437 1.00 0.00 C ATOM 243 O ASN A 121 -0.687 -0.475 -4.958 1.00 0.00 O ATOM 244 CB ASN A 121 -0.361 0.747 -7.773 1.00 0.00 C ATOM 245 CG ASN A 121 -1.707 0.056 -7.865 1.00 0.00 C ATOM 246 OD1 ASN A 121 -1.843 -0.980 -8.516 1.00 0.00 O ATOM 247 ND2 ASN A 121 -2.712 0.628 -7.212 1.00 0.00 N ATOM 0 HA ASN A 121 1.634 0.378 -7.069 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.496 1.745 -7.356 1.00 0.00 H new ATOM 0 HB3 ASN A 121 0.049 0.873 -8.775 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -3.641 0.209 -7.238 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -2.554 1.487 -6.685 1.00 0.00 H new ATOM 254 N ARG A 122 1.066 0.915 -4.721 1.00 0.00 N ATOM 255 CA ARG A 122 0.833 1.140 -3.299 1.00 0.00 C ATOM 256 C ARG A 122 0.865 2.629 -2.968 1.00 0.00 C ATOM 257 O ARG A 122 1.764 3.352 -3.397 1.00 0.00 O ATOM 258 CB ARG A 122 1.881 0.399 -2.468 1.00 0.00 C ATOM 259 CG ARG A 122 1.461 0.163 -1.027 1.00 0.00 C ATOM 260 CD ARG A 122 2.639 -0.266 -0.167 1.00 0.00 C ATOM 261 NE ARG A 122 2.915 -1.697 -0.294 1.00 0.00 N ATOM 262 CZ ARG A 122 4.098 -2.205 -0.642 1.00 0.00 C ATOM 263 NH1 ARG A 122 5.129 -1.409 -0.900 1.00 0.00 N ATOM 264 NH2 ARG A 122 4.249 -3.519 -0.732 1.00 0.00 N ATOM 0 H ARG A 122 1.870 1.414 -5.101 1.00 0.00 H new ATOM 0 HA ARG A 122 -0.157 0.755 -3.054 1.00 0.00 H new ATOM 0 HB2 ARG A 122 2.092 -0.562 -2.938 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.810 0.969 -2.478 1.00 0.00 H new ATOM 0 HG2 ARG A 122 1.025 1.075 -0.620 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.686 -0.603 -0.993 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.524 0.301 -0.455 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.433 -0.027 0.876 1.00 0.00 H new ATOM 0 HE ARG A 122 2.153 -2.348 -0.104 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.021 -0.397 -0.833 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.029 -1.810 -1.165 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.462 -4.137 -0.535 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.152 -3.912 -0.998 1.00 0.00 H new ATOM 278 N VAL A 123 -0.122 3.079 -2.200 1.00 0.00 N ATOM 279 CA VAL A 123 -0.207 4.481 -1.807 1.00 0.00 C ATOM 280 C VAL A 123 0.230 4.672 -0.361 1.00 0.00 C ATOM 281 O VAL A 123 0.332 3.711 0.401 1.00 0.00 O ATOM 282 CB VAL A 123 -1.635 5.032 -1.974 1.00 0.00 C ATOM 283 CG1 VAL A 123 -1.930 5.321 -3.437 1.00 0.00 C ATOM 284 CG2 VAL A 123 -2.654 4.063 -1.395 1.00 0.00 C ATOM 0 H VAL A 123 -0.874 2.493 -1.837 1.00 0.00 H new ATOM 0 HA VAL A 123 0.464 5.032 -2.466 1.00 0.00 H new ATOM 0 HB VAL A 123 -1.709 5.970 -1.423 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -2.944 5.709 -3.534 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -1.221 6.059 -3.812 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -1.837 4.402 -4.015 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -3.657 4.470 -1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -2.582 3.107 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -2.454 3.916 -0.334 1.00 0.00 H new ATOM 294 N VAL A 124 0.486 5.921 0.012 1.00 0.00 N ATOM 295 CA VAL A 124 0.912 6.242 1.369 1.00 0.00 C ATOM 296 C VAL A 124 -0.094 7.159 2.057 1.00 0.00 C ATOM 297 O VAL A 124 -0.720 8.004 1.415 1.00 0.00 O ATOM 298 CB VAL A 124 2.300 6.914 1.380 1.00 0.00 C ATOM 299 CG1 VAL A 124 2.268 8.225 0.609 1.00 0.00 C ATOM 300 CG2 VAL A 124 2.777 7.137 2.808 1.00 0.00 C ATOM 0 H VAL A 124 0.406 6.728 -0.607 1.00 0.00 H new ATOM 0 HA VAL A 124 0.972 5.300 1.914 1.00 0.00 H new ATOM 0 HB VAL A 124 3.007 6.248 0.886 1.00 0.00 H new ATOM 0 HG11 VAL A 124 3.257 8.683 0.629 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.978 8.033 -0.424 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.546 8.900 1.069 1.00 0.00 H new ATOM 0 HG21 VAL A 124 3.758 7.612 2.794 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.070 7.780 3.332 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.845 6.179 3.323 1.00 0.00 H new ATOM 310 N VAL A 125 -0.245 6.987 3.366 1.00 0.00 N ATOM 311 CA VAL A 125 -1.174 7.798 4.142 1.00 0.00 C ATOM 312 C VAL A 125 -0.435 8.640 5.176 1.00 0.00 C ATOM 313 O VAL A 125 0.569 8.206 5.741 1.00 0.00 O ATOM 314 CB VAL A 125 -2.220 6.926 4.861 1.00 0.00 C ATOM 315 CG1 VAL A 125 -3.307 7.793 5.477 1.00 0.00 C ATOM 316 CG2 VAL A 125 -2.819 5.907 3.901 1.00 0.00 C ATOM 0 H VAL A 125 0.265 6.292 3.912 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.684 8.455 3.437 1.00 0.00 H new ATOM 0 HB VAL A 125 -1.722 6.384 5.665 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -4.037 7.159 5.980 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -2.861 8.477 6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -3.803 8.366 4.693 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -3.556 5.300 4.428 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -3.302 6.427 3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -2.029 5.263 3.514 1.00 0.00 H new ATOM 326 N SER A 126 -0.938 9.845 5.420 1.00 0.00 N ATOM 327 CA SER A 126 -0.325 10.748 6.387 1.00 0.00 C ATOM 328 C SER A 126 -1.388 11.441 7.234 1.00 0.00 C ATOM 329 O SER A 126 -2.307 12.068 6.705 1.00 0.00 O ATOM 330 CB SER A 126 0.534 11.791 5.670 1.00 0.00 C ATOM 331 OG SER A 126 0.826 12.885 6.521 1.00 0.00 O ATOM 0 H SER A 126 -1.769 10.219 4.961 1.00 0.00 H new ATOM 0 HA SER A 126 0.310 10.157 7.047 1.00 0.00 H new ATOM 0 HB2 SER A 126 1.463 11.331 5.332 1.00 0.00 H new ATOM 0 HB3 SER A 126 0.013 12.147 4.781 1.00 0.00 H new ATOM 0 HG SER A 126 1.377 13.536 6.039 1.00 0.00 H new ATOM 337 N GLY A 127 -1.257 11.324 8.551 1.00 0.00 N ATOM 338 CA GLY A 127 -2.212 11.943 9.450 1.00 0.00 C ATOM 339 C GLY A 127 -3.171 10.939 10.058 1.00 0.00 C ATOM 340 O GLY A 127 -4.363 11.211 10.193 1.00 0.00 O ATOM 0 H GLY A 127 -0.506 10.811 9.012 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.675 12.457 10.247 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.779 12.700 8.908 1.00 0.00 H new ATOM 344 N LEU A 128 -2.648 9.773 10.424 1.00 0.00 N ATOM 345 CA LEU A 128 -3.465 8.722 11.020 1.00 0.00 C ATOM 346 C LEU A 128 -3.866 9.086 12.448 1.00 0.00 C ATOM 347 O LEU A 128 -3.168 9.842 13.124 1.00 0.00 O ATOM 348 CB LEU A 128 -2.708 7.393 11.013 1.00 0.00 C ATOM 349 CG LEU A 128 -2.856 6.570 9.732 1.00 0.00 C ATOM 350 CD1 LEU A 128 -4.285 6.074 9.579 1.00 0.00 C ATOM 351 CD2 LEU A 128 -2.441 7.393 8.522 1.00 0.00 C ATOM 0 H LEU A 128 -1.662 9.532 10.318 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.371 8.619 10.423 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.649 7.595 11.177 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -3.052 6.792 11.855 1.00 0.00 H new ATOM 0 HG LEU A 128 -2.199 5.703 9.800 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -4.371 5.491 8.662 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -4.547 5.449 10.433 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -4.963 6.926 9.532 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -2.552 6.793 7.619 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -3.073 8.278 8.450 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -1.400 7.698 8.629 1.00 0.00 H new ATOM 363 N PRO A 129 -5.000 8.548 12.927 1.00 0.00 N ATOM 364 CA PRO A 129 -5.492 8.819 14.281 1.00 0.00 C ATOM 365 C PRO A 129 -4.637 8.147 15.353 1.00 0.00 C ATOM 366 O PRO A 129 -3.780 7.318 15.046 1.00 0.00 O ATOM 367 CB PRO A 129 -6.901 8.223 14.272 1.00 0.00 C ATOM 368 CG PRO A 129 -6.852 7.152 13.239 1.00 0.00 C ATOM 369 CD PRO A 129 -5.892 7.635 12.186 1.00 0.00 C ATOM 0 HA PRO A 129 -5.465 9.882 14.519 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -7.166 7.819 15.249 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -7.648 8.977 14.025 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -6.516 6.209 13.670 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -7.840 6.974 12.814 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -5.339 6.810 11.738 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -6.410 8.149 11.376 1.00 0.00 H new ATOM 377 N PRO A 130 -4.860 8.498 16.631 1.00 0.00 N ATOM 378 CA PRO A 130 -4.106 7.925 17.750 1.00 0.00 C ATOM 379 C PRO A 130 -4.457 6.461 17.996 1.00 0.00 C ATOM 380 O PRO A 130 -3.640 5.694 18.505 1.00 0.00 O ATOM 381 CB PRO A 130 -4.531 8.784 18.943 1.00 0.00 C ATOM 382 CG PRO A 130 -5.880 9.298 18.577 1.00 0.00 C ATOM 383 CD PRO A 130 -5.864 9.480 17.085 1.00 0.00 C ATOM 0 HA PRO A 130 -3.032 7.933 17.563 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -4.566 8.197 19.861 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -3.829 9.600 19.113 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -6.659 8.597 18.876 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -6.089 10.241 19.083 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -6.843 9.286 16.646 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -5.586 10.497 16.807 1.00 0.00 H new ATOM 391 N SER A 131 -5.677 6.081 17.631 1.00 0.00 N ATOM 392 CA SER A 131 -6.136 4.709 17.813 1.00 0.00 C ATOM 393 C SER A 131 -7.018 4.270 16.649 1.00 0.00 C ATOM 394 O SER A 131 -7.990 4.943 16.305 1.00 0.00 O ATOM 395 CB SER A 131 -6.904 4.576 19.130 1.00 0.00 C ATOM 396 OG SER A 131 -7.977 5.499 19.192 1.00 0.00 O ATOM 0 H SER A 131 -6.365 6.704 17.208 1.00 0.00 H new ATOM 0 HA SER A 131 -5.260 4.061 17.845 1.00 0.00 H new ATOM 0 HB2 SER A 131 -7.288 3.561 19.229 1.00 0.00 H new ATOM 0 HB3 SER A 131 -6.227 4.744 19.968 1.00 0.00 H new ATOM 0 HG SER A 131 -8.333 5.648 18.291 1.00 0.00 H new ATOM 402 N GLY A 132 -6.672 3.138 16.045 1.00 0.00 N ATOM 403 CA GLY A 132 -7.443 2.629 14.926 1.00 0.00 C ATOM 404 C GLY A 132 -6.773 1.449 14.248 1.00 0.00 C ATOM 405 O GLY A 132 -5.578 1.216 14.432 1.00 0.00 O ATOM 0 H GLY A 132 -5.872 2.564 16.310 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -8.431 2.330 15.276 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -7.591 3.427 14.198 1.00 0.00 H new ATOM 409 N SER A 133 -7.544 0.703 13.463 1.00 0.00 N ATOM 410 CA SER A 133 -7.018 -0.460 12.757 1.00 0.00 C ATOM 411 C SER A 133 -6.990 -0.217 11.252 1.00 0.00 C ATOM 412 O SER A 133 -7.774 0.573 10.725 1.00 0.00 O ATOM 413 CB SER A 133 -7.860 -1.698 13.069 1.00 0.00 C ATOM 414 OG SER A 133 -7.051 -2.860 13.144 1.00 0.00 O ATOM 0 H SER A 133 -8.535 0.883 13.300 1.00 0.00 H new ATOM 0 HA SER A 133 -5.997 -0.628 13.099 1.00 0.00 H new ATOM 0 HB2 SER A 133 -8.386 -1.556 14.013 1.00 0.00 H new ATOM 0 HB3 SER A 133 -8.619 -1.829 12.298 1.00 0.00 H new ATOM 0 HG SER A 133 -7.613 -3.637 13.346 1.00 0.00 H new ATOM 420 N TRP A 134 -6.081 -0.901 10.564 1.00 0.00 N ATOM 421 CA TRP A 134 -5.950 -0.760 9.119 1.00 0.00 C ATOM 422 C TRP A 134 -7.094 -1.461 8.394 1.00 0.00 C ATOM 423 O TRP A 134 -7.500 -1.048 7.308 1.00 0.00 O ATOM 424 CB TRP A 134 -4.610 -1.330 8.651 1.00 0.00 C ATOM 425 CG TRP A 134 -4.462 -2.797 8.920 1.00 0.00 C ATOM 426 CD1 TRP A 134 -3.727 -3.378 9.913 1.00 0.00 C ATOM 427 CD2 TRP A 134 -5.063 -3.870 8.185 1.00 0.00 C ATOM 428 NE1 TRP A 134 -3.834 -4.746 9.841 1.00 0.00 N ATOM 429 CE2 TRP A 134 -4.648 -5.072 8.789 1.00 0.00 C ATOM 430 CE3 TRP A 134 -5.912 -3.931 7.076 1.00 0.00 C ATOM 431 CZ2 TRP A 134 -5.054 -6.320 8.320 1.00 0.00 C ATOM 432 CZ3 TRP A 134 -6.313 -5.170 6.612 1.00 0.00 C ATOM 433 CH2 TRP A 134 -5.885 -6.349 7.233 1.00 0.00 C ATOM 0 H TRP A 134 -5.424 -1.558 10.985 1.00 0.00 H new ATOM 0 HA TRP A 134 -5.991 0.302 8.879 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -4.501 -1.151 7.581 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -3.802 -0.793 9.148 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -3.146 -2.841 10.648 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -3.381 -5.410 10.469 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -6.248 -3.027 6.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -4.725 -7.231 8.797 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -6.968 -5.229 5.755 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -6.217 -7.301 6.846 1.00 0.00 H new ATOM 444 N GLN A 135 -7.611 -2.524 9.002 1.00 0.00 N ATOM 445 CA GLN A 135 -8.708 -3.284 8.412 1.00 0.00 C ATOM 446 C GLN A 135 -9.926 -2.395 8.187 1.00 0.00 C ATOM 447 O GLN A 135 -10.573 -2.465 7.142 1.00 0.00 O ATOM 448 CB GLN A 135 -9.080 -4.464 9.311 1.00 0.00 C ATOM 449 CG GLN A 135 -8.258 -5.713 9.041 1.00 0.00 C ATOM 450 CD GLN A 135 -8.680 -6.890 9.899 1.00 0.00 C ATOM 451 OE1 GLN A 135 -9.597 -6.782 10.713 1.00 0.00 O ATOM 452 NE2 GLN A 135 -8.009 -8.022 9.720 1.00 0.00 N ATOM 0 H GLN A 135 -7.288 -2.879 9.902 1.00 0.00 H new ATOM 0 HA GLN A 135 -8.376 -3.664 7.446 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -8.951 -4.172 10.353 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -10.136 -4.697 9.174 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -8.351 -5.984 7.989 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -7.205 -5.496 9.222 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -7.256 -8.065 9.033 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -8.247 -8.848 10.269 1.00 0.00 H new ATOM 461 N ASP A 136 -10.234 -1.556 9.170 1.00 0.00 N ATOM 462 CA ASP A 136 -11.373 -0.652 9.072 1.00 0.00 C ATOM 463 C ASP A 136 -11.047 0.541 8.176 1.00 0.00 C ATOM 464 O ASP A 136 -11.947 1.197 7.650 1.00 0.00 O ATOM 465 CB ASP A 136 -11.786 -0.164 10.461 1.00 0.00 C ATOM 466 CG ASP A 136 -10.672 0.582 11.168 1.00 0.00 C ATOM 467 OD1 ASP A 136 -10.585 1.817 11.000 1.00 0.00 O ATOM 468 OD2 ASP A 136 -9.887 -0.067 11.890 1.00 0.00 O ATOM 0 H ASP A 136 -9.711 -1.483 10.043 1.00 0.00 H new ATOM 0 HA ASP A 136 -12.203 -1.201 8.627 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -12.655 0.488 10.370 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -12.089 -1.017 11.067 1.00 0.00 H new ATOM 473 N LEU A 137 -9.757 0.817 8.006 1.00 0.00 N ATOM 474 CA LEU A 137 -9.316 1.931 7.174 1.00 0.00 C ATOM 475 C LEU A 137 -9.579 1.647 5.699 1.00 0.00 C ATOM 476 O LEU A 137 -10.107 2.494 4.979 1.00 0.00 O ATOM 477 CB LEU A 137 -7.826 2.203 7.399 1.00 0.00 C ATOM 478 CG LEU A 137 -7.210 3.252 6.473 1.00 0.00 C ATOM 479 CD1 LEU A 137 -7.696 4.644 6.845 1.00 0.00 C ATOM 480 CD2 LEU A 137 -5.691 3.183 6.528 1.00 0.00 C ATOM 0 H LEU A 137 -8.999 0.284 8.433 1.00 0.00 H new ATOM 0 HA LEU A 137 -9.886 2.815 7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -7.683 2.523 8.431 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -7.280 1.268 7.277 1.00 0.00 H new ATOM 0 HG LEU A 137 -7.528 3.040 5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -7.247 5.377 6.175 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -8.781 4.687 6.755 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -7.408 4.867 7.872 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -5.268 3.936 5.863 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -5.355 3.370 7.548 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -5.360 2.194 6.212 1.00 0.00 H new ATOM 492 N LYS A 138 -9.207 0.451 5.253 1.00 0.00 N ATOM 493 CA LYS A 138 -9.404 0.062 3.859 1.00 0.00 C ATOM 494 C LYS A 138 -10.870 0.189 3.458 1.00 0.00 C ATOM 495 O LYS A 138 -11.188 0.640 2.358 1.00 0.00 O ATOM 496 CB LYS A 138 -8.918 -1.363 3.617 1.00 0.00 C ATOM 497 CG LYS A 138 -9.284 -2.303 4.734 1.00 0.00 C ATOM 498 CD LYS A 138 -9.044 -3.755 4.354 1.00 0.00 C ATOM 499 CE LYS A 138 -10.116 -4.271 3.407 1.00 0.00 C ATOM 500 NZ LYS A 138 -9.552 -4.651 2.082 1.00 0.00 N ATOM 0 H LYS A 138 -8.769 -0.264 5.834 1.00 0.00 H new ATOM 0 HA LYS A 138 -8.815 0.740 3.241 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -9.342 -1.733 2.684 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.835 -1.356 3.494 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -8.699 -2.058 5.621 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -10.333 -2.165 4.996 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -8.065 -3.852 3.884 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -9.027 -4.369 5.254 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -10.609 -5.135 3.853 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -10.879 -3.505 3.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -10.327 -4.884 1.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -9.003 -3.856 1.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -8.932 -5.479 2.193 1.00 0.00 H new ATOM 514 N ASP A 139 -11.759 -0.211 4.362 1.00 0.00 N ATOM 515 CA ASP A 139 -13.194 -0.144 4.111 1.00 0.00 C ATOM 516 C ASP A 139 -13.667 1.300 3.990 1.00 0.00 C ATOM 517 O ASP A 139 -14.669 1.584 3.334 1.00 0.00 O ATOM 518 CB ASP A 139 -13.962 -0.852 5.229 1.00 0.00 C ATOM 519 CG ASP A 139 -13.650 -2.334 5.297 1.00 0.00 C ATOM 520 OD1 ASP A 139 -12.571 -2.736 4.812 1.00 0.00 O ATOM 521 OD2 ASP A 139 -14.484 -3.092 5.835 1.00 0.00 O ATOM 0 H ASP A 139 -11.510 -0.586 5.277 1.00 0.00 H new ATOM 0 HA ASP A 139 -13.391 -0.648 3.165 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -13.717 -0.388 6.184 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -15.032 -0.716 5.073 1.00 0.00 H new ATOM 526 N HIS A 140 -12.943 2.205 4.634 1.00 0.00 N ATOM 527 CA HIS A 140 -13.288 3.622 4.608 1.00 0.00 C ATOM 528 C HIS A 140 -12.736 4.304 3.360 1.00 0.00 C ATOM 529 O HIS A 140 -13.334 5.247 2.842 1.00 0.00 O ATOM 530 CB HIS A 140 -12.753 4.318 5.862 1.00 0.00 C ATOM 531 CG HIS A 140 -13.722 5.285 6.469 1.00 0.00 C ATOM 532 ND1 HIS A 140 -13.650 6.648 6.272 1.00 0.00 N ATOM 533 CD2 HIS A 140 -14.792 5.080 7.274 1.00 0.00 C ATOM 534 CE1 HIS A 140 -14.631 7.239 6.930 1.00 0.00 C ATOM 535 NE2 HIS A 140 -15.339 6.310 7.545 1.00 0.00 N ATOM 0 H HIS A 140 -12.112 1.984 5.182 1.00 0.00 H new ATOM 0 HA HIS A 140 -14.375 3.702 4.586 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -12.493 3.563 6.604 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -11.834 4.847 5.610 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -12.948 7.125 5.706 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -15.148 4.127 7.635 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -14.821 8.302 6.960 1.00 0.00 H new ATOM 544 N MET A 141 -11.592 3.825 2.883 1.00 0.00 N ATOM 545 CA MET A 141 -10.963 4.398 1.697 1.00 0.00 C ATOM 546 C MET A 141 -11.384 3.660 0.424 1.00 0.00 C ATOM 547 O MET A 141 -10.990 4.039 -0.679 1.00 0.00 O ATOM 548 CB MET A 141 -9.437 4.377 1.846 1.00 0.00 C ATOM 549 CG MET A 141 -8.808 3.016 1.583 1.00 0.00 C ATOM 550 SD MET A 141 -7.979 2.930 -0.017 1.00 0.00 S ATOM 551 CE MET A 141 -6.897 4.354 0.082 1.00 0.00 C ATOM 0 H MET A 141 -11.082 3.044 3.297 1.00 0.00 H new ATOM 0 HA MET A 141 -11.299 5.431 1.606 1.00 0.00 H new ATOM 0 HB2 MET A 141 -9.005 5.104 1.159 1.00 0.00 H new ATOM 0 HB3 MET A 141 -9.176 4.698 2.855 1.00 0.00 H new ATOM 0 HG2 MET A 141 -8.090 2.794 2.372 1.00 0.00 H new ATOM 0 HG3 MET A 141 -9.580 2.248 1.629 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.886 4.063 -0.203 1.00 0.00 H new ATOM 0 HE2 MET A 141 -7.255 5.131 -0.594 1.00 0.00 H new ATOM 0 HE3 MET A 141 -6.891 4.736 1.103 1.00 0.00 H new ATOM 561 N ARG A 142 -12.183 2.607 0.580 1.00 0.00 N ATOM 562 CA ARG A 142 -12.650 1.825 -0.562 1.00 0.00 C ATOM 563 C ARG A 142 -13.507 2.668 -1.504 1.00 0.00 C ATOM 564 O ARG A 142 -13.749 2.279 -2.647 1.00 0.00 O ATOM 565 CB ARG A 142 -13.450 0.614 -0.082 1.00 0.00 C ATOM 566 CG ARG A 142 -12.581 -0.556 0.349 1.00 0.00 C ATOM 567 CD ARG A 142 -12.774 -1.763 -0.557 1.00 0.00 C ATOM 568 NE ARG A 142 -14.187 -2.044 -0.803 1.00 0.00 N ATOM 569 CZ ARG A 142 -14.997 -2.607 0.090 1.00 0.00 C ATOM 570 NH1 ARG A 142 -14.539 -2.953 1.287 1.00 0.00 N ATOM 571 NH2 ARG A 142 -16.269 -2.825 -0.214 1.00 0.00 N ATOM 0 H ARG A 142 -12.520 2.276 1.484 1.00 0.00 H new ATOM 0 HA ARG A 142 -11.772 1.486 -1.112 1.00 0.00 H new ATOM 0 HB2 ARG A 142 -14.082 0.914 0.754 1.00 0.00 H new ATOM 0 HB3 ARG A 142 -14.114 0.287 -0.882 1.00 0.00 H new ATOM 0 HG2 ARG A 142 -11.533 -0.255 0.337 1.00 0.00 H new ATOM 0 HG3 ARG A 142 -12.822 -0.830 1.376 1.00 0.00 H new ATOM 0 HD2 ARG A 142 -12.269 -1.588 -1.507 1.00 0.00 H new ATOM 0 HD3 ARG A 142 -12.305 -2.636 -0.103 1.00 0.00 H new ATOM 0 HE ARG A 142 -14.575 -1.794 -1.713 1.00 0.00 H new ATOM 0 HH11 ARG A 142 -13.561 -2.788 1.526 1.00 0.00 H new ATOM 0 HH12 ARG A 142 -15.165 -3.384 1.967 1.00 0.00 H new ATOM 0 HH21 ARG A 142 -16.626 -2.561 -1.132 1.00 0.00 H new ATOM 0 HH22 ARG A 142 -16.890 -3.257 0.470 1.00 0.00 H new ATOM 585 N GLU A 143 -13.969 3.821 -1.023 1.00 0.00 N ATOM 586 CA GLU A 143 -14.802 4.709 -1.830 1.00 0.00 C ATOM 587 C GLU A 143 -14.173 4.959 -3.197 1.00 0.00 C ATOM 588 O GLU A 143 -14.876 5.147 -4.190 1.00 0.00 O ATOM 589 CB GLU A 143 -15.010 6.038 -1.105 1.00 0.00 C ATOM 590 CG GLU A 143 -16.421 6.590 -1.239 1.00 0.00 C ATOM 591 CD GLU A 143 -17.047 6.926 0.101 1.00 0.00 C ATOM 592 OE1 GLU A 143 -16.686 7.972 0.680 1.00 0.00 O ATOM 593 OE2 GLU A 143 -17.899 6.143 0.570 1.00 0.00 O ATOM 0 H GLU A 143 -13.781 4.161 -0.080 1.00 0.00 H new ATOM 0 HA GLU A 143 -15.767 4.224 -1.979 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -14.779 5.906 -0.048 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -14.304 6.770 -1.496 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -16.399 7.485 -1.860 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -17.045 5.860 -1.754 1.00 0.00 H new ATOM 600 N ALA A 144 -12.845 4.952 -3.241 1.00 0.00 N ATOM 601 CA ALA A 144 -12.122 5.170 -4.487 1.00 0.00 C ATOM 602 C ALA A 144 -12.328 3.998 -5.435 1.00 0.00 C ATOM 603 O ALA A 144 -12.333 4.161 -6.655 1.00 0.00 O ATOM 604 CB ALA A 144 -10.640 5.368 -4.208 1.00 0.00 C ATOM 0 H ALA A 144 -12.248 4.798 -2.428 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.513 6.071 -4.961 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -10.111 5.530 -5.147 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -10.504 6.235 -3.561 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.241 4.481 -3.715 1.00 0.00 H new ATOM 610 N GLY A 145 -12.498 2.815 -4.859 1.00 0.00 N ATOM 611 CA GLY A 145 -12.703 1.621 -5.658 1.00 0.00 C ATOM 612 C GLY A 145 -12.537 0.348 -4.852 1.00 0.00 C ATOM 613 O GLY A 145 -13.458 -0.078 -4.155 1.00 0.00 O ATOM 0 H GLY A 145 -12.498 2.660 -3.851 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -13.703 1.645 -6.092 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -11.996 1.617 -6.488 1.00 0.00 H new ATOM 617 N ASP A 146 -11.360 -0.261 -4.948 1.00 0.00 N ATOM 618 CA ASP A 146 -11.076 -1.494 -4.223 1.00 0.00 C ATOM 619 C ASP A 146 -9.736 -1.407 -3.504 1.00 0.00 C ATOM 620 O ASP A 146 -8.863 -0.628 -3.884 1.00 0.00 O ATOM 621 CB ASP A 146 -11.078 -2.687 -5.181 1.00 0.00 C ATOM 622 CG ASP A 146 -12.435 -3.358 -5.266 1.00 0.00 C ATOM 623 OD1 ASP A 146 -13.126 -3.432 -4.228 1.00 0.00 O ATOM 624 OD2 ASP A 146 -12.807 -3.809 -6.369 1.00 0.00 O ATOM 0 H ASP A 146 -10.587 0.079 -5.521 1.00 0.00 H new ATOM 0 HA ASP A 146 -11.859 -1.635 -3.477 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -10.778 -2.352 -6.174 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -10.336 -3.415 -4.852 1.00 0.00 H new ATOM 629 N VAL A 147 -9.586 -2.212 -2.459 1.00 0.00 N ATOM 630 CA VAL A 147 -8.359 -2.230 -1.676 1.00 0.00 C ATOM 631 C VAL A 147 -7.805 -3.647 -1.559 1.00 0.00 C ATOM 632 O VAL A 147 -8.557 -4.621 -1.562 1.00 0.00 O ATOM 633 CB VAL A 147 -8.599 -1.657 -0.266 1.00 0.00 C ATOM 634 CG1 VAL A 147 -7.321 -1.691 0.561 1.00 0.00 C ATOM 635 CG2 VAL A 147 -9.145 -0.240 -0.356 1.00 0.00 C ATOM 0 H VAL A 147 -10.302 -2.862 -2.134 1.00 0.00 H new ATOM 0 HA VAL A 147 -7.631 -1.607 -2.196 1.00 0.00 H new ATOM 0 HB VAL A 147 -9.339 -2.282 0.235 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -7.518 -1.281 1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.977 -2.721 0.656 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.553 -1.096 0.068 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -9.309 0.151 0.648 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -8.429 0.393 -0.879 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -10.089 -0.248 -0.901 1.00 0.00 H new ATOM 645 N CYS A 148 -6.484 -3.753 -1.459 1.00 0.00 N ATOM 646 CA CYS A 148 -5.828 -5.051 -1.343 1.00 0.00 C ATOM 647 C CYS A 148 -5.091 -5.171 -0.013 1.00 0.00 C ATOM 648 O CYS A 148 -5.283 -6.134 0.729 1.00 0.00 O ATOM 649 CB CYS A 148 -4.850 -5.256 -2.501 1.00 0.00 C ATOM 650 SG CYS A 148 -4.031 -6.868 -2.497 1.00 0.00 S ATOM 0 H CYS A 148 -5.847 -2.956 -1.456 1.00 0.00 H new ATOM 0 HA CYS A 148 -6.596 -5.823 -1.383 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -5.387 -5.135 -3.442 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -4.091 -4.474 -2.465 1.00 0.00 H new ATOM 0 HG CYS A 148 -3.225 -6.948 -3.514 1.00 0.00 H new ATOM 656 N TYR A 149 -4.247 -4.188 0.281 1.00 0.00 N ATOM 657 CA TYR A 149 -3.480 -4.185 1.522 1.00 0.00 C ATOM 658 C TYR A 149 -3.636 -2.858 2.256 1.00 0.00 C ATOM 659 O TYR A 149 -3.825 -1.811 1.636 1.00 0.00 O ATOM 660 CB TYR A 149 -2.002 -4.450 1.232 1.00 0.00 C ATOM 661 CG TYR A 149 -1.211 -4.873 2.450 1.00 0.00 C ATOM 662 CD1 TYR A 149 -1.388 -6.130 3.014 1.00 0.00 C ATOM 663 CD2 TYR A 149 -0.288 -4.015 3.034 1.00 0.00 C ATOM 664 CE1 TYR A 149 -0.667 -6.519 4.127 1.00 0.00 C ATOM 665 CE2 TYR A 149 0.437 -4.397 4.147 1.00 0.00 C ATOM 666 CZ TYR A 149 0.244 -5.650 4.689 1.00 0.00 C ATOM 667 OH TYR A 149 0.963 -6.034 5.797 1.00 0.00 O ATOM 0 H TYR A 149 -4.077 -3.383 -0.322 1.00 0.00 H new ATOM 0 HA TYR A 149 -3.867 -4.979 2.161 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -1.923 -5.226 0.471 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -1.555 -3.548 0.814 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -2.100 -6.814 2.576 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -0.134 -3.033 2.611 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -0.817 -7.499 4.555 1.00 0.00 H new ATOM 0 HE2 TYR A 149 1.151 -3.718 4.590 1.00 0.00 H new ATOM 0 HH TYR A 149 0.813 -5.393 6.523 1.00 0.00 H new ATOM 677 N ALA A 150 -3.554 -2.908 3.582 1.00 0.00 N ATOM 678 CA ALA A 150 -3.684 -1.711 4.403 1.00 0.00 C ATOM 679 C ALA A 150 -2.989 -1.892 5.748 1.00 0.00 C ATOM 680 O ALA A 150 -3.139 -2.924 6.402 1.00 0.00 O ATOM 681 CB ALA A 150 -5.152 -1.367 4.606 1.00 0.00 C ATOM 0 H ALA A 150 -3.398 -3.766 4.111 1.00 0.00 H new ATOM 0 HA ALA A 150 -3.199 -0.886 3.881 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -5.234 -0.471 5.221 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -5.621 -1.187 3.638 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -5.654 -2.196 5.104 1.00 0.00 H new ATOM 687 N ASP A 151 -2.228 -0.882 6.156 1.00 0.00 N ATOM 688 CA ASP A 151 -1.510 -0.929 7.425 1.00 0.00 C ATOM 689 C ASP A 151 -1.366 0.467 8.021 1.00 0.00 C ATOM 690 O ASP A 151 -1.022 1.419 7.321 1.00 0.00 O ATOM 691 CB ASP A 151 -0.129 -1.559 7.230 1.00 0.00 C ATOM 692 CG ASP A 151 -0.133 -3.053 7.489 1.00 0.00 C ATOM 693 OD1 ASP A 151 -0.902 -3.501 8.364 1.00 0.00 O ATOM 694 OD2 ASP A 151 0.633 -3.774 6.815 1.00 0.00 O ATOM 0 H ASP A 151 -2.092 -0.021 5.627 1.00 0.00 H new ATOM 0 HA ASP A 151 -2.087 -1.542 8.118 1.00 0.00 H new ATOM 0 HB2 ASP A 151 0.213 -1.370 6.212 1.00 0.00 H new ATOM 0 HB3 ASP A 151 0.584 -1.079 7.900 1.00 0.00 H new ATOM 699 N VAL A 152 -1.634 0.582 9.318 1.00 0.00 N ATOM 700 CA VAL A 152 -1.536 1.862 10.008 1.00 0.00 C ATOM 701 C VAL A 152 -0.675 1.747 11.262 1.00 0.00 C ATOM 702 O VAL A 152 -1.002 1.002 12.186 1.00 0.00 O ATOM 703 CB VAL A 152 -2.927 2.395 10.402 1.00 0.00 C ATOM 704 CG1 VAL A 152 -3.749 2.709 9.162 1.00 0.00 C ATOM 705 CG2 VAL A 152 -3.650 1.394 11.290 1.00 0.00 C ATOM 0 H VAL A 152 -1.921 -0.196 9.912 1.00 0.00 H new ATOM 0 HA VAL A 152 -1.070 2.561 9.313 1.00 0.00 H new ATOM 0 HB VAL A 152 -2.796 3.318 10.966 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -4.728 3.084 9.460 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -3.236 3.465 8.567 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.873 1.803 8.569 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -4.630 1.787 11.558 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -3.771 0.453 10.754 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -3.067 1.223 12.195 1.00 0.00 H new ATOM 715 N TYR A 153 0.427 2.489 11.286 1.00 0.00 N ATOM 716 CA TYR A 153 1.337 2.471 12.426 1.00 0.00 C ATOM 717 C TYR A 153 1.161 3.721 13.282 1.00 0.00 C ATOM 718 O TYR A 153 1.136 4.839 12.768 1.00 0.00 O ATOM 719 CB TYR A 153 2.786 2.367 11.947 1.00 0.00 C ATOM 720 CG TYR A 153 3.066 1.129 11.125 1.00 0.00 C ATOM 721 CD1 TYR A 153 2.536 0.984 9.849 1.00 0.00 C ATOM 722 CD2 TYR A 153 3.861 0.105 11.625 1.00 0.00 C ATOM 723 CE1 TYR A 153 2.790 -0.146 9.095 1.00 0.00 C ATOM 724 CE2 TYR A 153 4.120 -1.027 10.877 1.00 0.00 C ATOM 725 CZ TYR A 153 3.582 -1.148 9.614 1.00 0.00 C ATOM 726 OH TYR A 153 3.837 -2.275 8.866 1.00 0.00 O ATOM 0 H TYR A 153 0.712 3.110 10.529 1.00 0.00 H new ATOM 0 HA TYR A 153 1.099 1.599 13.035 1.00 0.00 H new ATOM 0 HB2 TYR A 153 3.028 3.249 11.354 1.00 0.00 H new ATOM 0 HB3 TYR A 153 3.447 2.375 12.813 1.00 0.00 H new ATOM 0 HD1 TYR A 153 1.915 1.767 9.440 1.00 0.00 H new ATOM 0 HD2 TYR A 153 4.283 0.196 12.615 1.00 0.00 H new ATOM 0 HE1 TYR A 153 2.370 -0.244 8.105 1.00 0.00 H new ATOM 0 HE2 TYR A 153 4.741 -1.813 11.280 1.00 0.00 H new ATOM 0 HH TYR A 153 4.412 -2.883 9.376 1.00 0.00 H new ATOM 736 N ARG A 154 1.040 3.524 14.591 1.00 0.00 N ATOM 737 CA ARG A 154 0.867 4.636 15.518 1.00 0.00 C ATOM 738 C ARG A 154 2.077 5.564 15.487 1.00 0.00 C ATOM 739 O ARG A 154 3.081 5.315 16.153 1.00 0.00 O ATOM 740 CB ARG A 154 0.647 4.113 16.939 1.00 0.00 C ATOM 741 CG ARG A 154 -0.806 3.798 17.253 1.00 0.00 C ATOM 742 CD ARG A 154 -1.022 3.583 18.743 1.00 0.00 C ATOM 743 NE ARG A 154 -0.648 2.233 19.161 1.00 0.00 N ATOM 744 CZ ARG A 154 0.583 1.880 19.530 1.00 0.00 C ATOM 745 NH1 ARG A 154 1.566 2.773 19.539 1.00 0.00 N ATOM 746 NH2 ARG A 154 0.831 0.630 19.893 1.00 0.00 N ATOM 0 H ARG A 154 1.059 2.605 15.033 1.00 0.00 H new ATOM 0 HA ARG A 154 -0.011 5.203 15.207 1.00 0.00 H new ATOM 0 HB2 ARG A 154 1.244 3.213 17.082 1.00 0.00 H new ATOM 0 HB3 ARG A 154 1.011 4.854 17.650 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -1.439 4.615 16.907 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -1.112 2.905 16.708 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -0.436 4.311 19.303 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -2.069 3.761 18.987 1.00 0.00 H new ATOM 0 HE ARG A 154 -1.374 1.517 19.171 1.00 0.00 H new ATOM 0 HH11 ARG A 154 1.382 3.737 19.262 1.00 0.00 H new ATOM 0 HH12 ARG A 154 2.505 2.495 19.823 1.00 0.00 H new ATOM 0 HH21 ARG A 154 0.080 -0.061 19.890 1.00 0.00 H new ATOM 0 HH22 ARG A 154 1.773 0.358 20.176 1.00 0.00 H new ATOM 760 N ASP A 155 1.972 6.636 14.708 1.00 0.00 N ATOM 761 CA ASP A 155 3.057 7.604 14.588 1.00 0.00 C ATOM 762 C ASP A 155 2.604 8.833 13.807 1.00 0.00 C ATOM 763 O ASP A 155 2.924 9.965 14.171 1.00 0.00 O ATOM 764 CB ASP A 155 4.265 6.966 13.901 1.00 0.00 C ATOM 765 CG ASP A 155 5.581 7.456 14.472 1.00 0.00 C ATOM 766 OD1 ASP A 155 5.623 7.773 15.680 1.00 0.00 O ATOM 767 OD2 ASP A 155 6.570 7.523 13.713 1.00 0.00 O ATOM 0 H ASP A 155 1.147 6.856 14.150 1.00 0.00 H new ATOM 0 HA ASP A 155 3.343 7.918 15.592 1.00 0.00 H new ATOM 0 HB2 ASP A 155 4.208 5.882 14.005 1.00 0.00 H new ATOM 0 HB3 ASP A 155 4.231 7.186 12.834 1.00 0.00 H new ATOM 772 N GLY A 156 1.855 8.602 12.734 1.00 0.00 N ATOM 773 CA GLY A 156 1.368 9.700 11.918 1.00 0.00 C ATOM 774 C GLY A 156 1.479 9.420 10.432 1.00 0.00 C ATOM 775 O GLY A 156 1.791 10.316 9.648 1.00 0.00 O ATOM 0 H GLY A 156 1.576 7.674 12.414 1.00 0.00 H new ATOM 0 HA2 GLY A 156 0.326 9.899 12.169 1.00 0.00 H new ATOM 0 HA3 GLY A 156 1.931 10.602 12.156 1.00 0.00 H new ATOM 779 N THR A 157 1.222 8.174 10.042 1.00 0.00 N ATOM 780 CA THR A 157 1.294 7.780 8.639 1.00 0.00 C ATOM 781 C THR A 157 0.633 6.423 8.423 1.00 0.00 C ATOM 782 O THR A 157 0.254 5.746 9.379 1.00 0.00 O ATOM 783 CB THR A 157 2.749 7.729 8.172 1.00 0.00 C ATOM 784 OG1 THR A 157 3.588 7.228 9.197 1.00 0.00 O ATOM 785 CG2 THR A 157 3.292 9.078 7.752 1.00 0.00 C ATOM 0 H THR A 157 0.962 7.420 10.678 1.00 0.00 H new ATOM 0 HA THR A 157 0.759 8.526 8.052 1.00 0.00 H new ATOM 0 HB THR A 157 2.750 7.070 7.304 1.00 0.00 H new ATOM 0 HG1 THR A 157 4.514 7.202 8.878 1.00 0.00 H new ATOM 0 HG21 THR A 157 4.328 8.970 7.432 1.00 0.00 H new ATOM 0 HG22 THR A 157 2.697 9.469 6.927 1.00 0.00 H new ATOM 0 HG23 THR A 157 3.242 9.768 8.594 1.00 0.00 H new ATOM 793 N GLY A 158 0.497 6.031 7.161 1.00 0.00 N ATOM 794 CA GLY A 158 -0.118 4.756 6.843 1.00 0.00 C ATOM 795 C GLY A 158 0.250 4.263 5.458 1.00 0.00 C ATOM 796 O GLY A 158 0.895 4.975 4.689 1.00 0.00 O ATOM 0 H GLY A 158 0.802 6.573 6.353 1.00 0.00 H new ATOM 0 HA2 GLY A 158 0.187 4.015 7.582 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -1.201 4.851 6.915 1.00 0.00 H new ATOM 800 N VAL A 159 -0.161 3.040 5.139 1.00 0.00 N ATOM 801 CA VAL A 159 0.128 2.451 3.838 1.00 0.00 C ATOM 802 C VAL A 159 -1.055 1.636 3.329 1.00 0.00 C ATOM 803 O VAL A 159 -1.646 0.851 4.072 1.00 0.00 O ATOM 804 CB VAL A 159 1.374 1.547 3.894 1.00 0.00 C ATOM 805 CG1 VAL A 159 2.640 2.386 3.975 1.00 0.00 C ATOM 806 CG2 VAL A 159 1.284 0.587 5.071 1.00 0.00 C ATOM 0 H VAL A 159 -0.696 2.438 5.765 1.00 0.00 H new ATOM 0 HA VAL A 159 0.319 3.277 3.153 1.00 0.00 H new ATOM 0 HB VAL A 159 1.415 0.959 2.977 1.00 0.00 H new ATOM 0 HG11 VAL A 159 3.509 1.730 4.014 1.00 0.00 H new ATOM 0 HG12 VAL A 159 2.708 3.027 3.096 1.00 0.00 H new ATOM 0 HG13 VAL A 159 2.611 3.003 4.873 1.00 0.00 H new ATOM 0 HG21 VAL A 159 2.173 -0.044 5.095 1.00 0.00 H new ATOM 0 HG22 VAL A 159 1.217 1.155 5.999 1.00 0.00 H new ATOM 0 HG23 VAL A 159 0.398 -0.039 4.963 1.00 0.00 H new ATOM 816 N VAL A 160 -1.398 1.828 2.060 1.00 0.00 N ATOM 817 CA VAL A 160 -2.513 1.110 1.453 1.00 0.00 C ATOM 818 C VAL A 160 -2.184 0.692 0.024 1.00 0.00 C ATOM 819 O VAL A 160 -1.786 1.516 -0.799 1.00 0.00 O ATOM 820 CB VAL A 160 -3.795 1.965 1.442 1.00 0.00 C ATOM 821 CG1 VAL A 160 -5.000 1.117 1.067 1.00 0.00 C ATOM 822 CG2 VAL A 160 -4.004 2.634 2.793 1.00 0.00 C ATOM 0 H VAL A 160 -0.920 2.474 1.432 1.00 0.00 H new ATOM 0 HA VAL A 160 -2.684 0.221 2.060 1.00 0.00 H new ATOM 0 HB VAL A 160 -3.681 2.746 0.690 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -5.896 1.738 1.065 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -4.851 0.692 0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -5.119 0.312 1.793 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -4.914 3.233 2.765 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -4.095 1.871 3.566 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.153 3.277 3.016 1.00 0.00 H new ATOM 832 N GLU A 161 -2.355 -0.594 -0.264 1.00 0.00 N ATOM 833 CA GLU A 161 -2.077 -1.122 -1.595 1.00 0.00 C ATOM 834 C GLU A 161 -3.359 -1.241 -2.411 1.00 0.00 C ATOM 835 O GLU A 161 -4.198 -2.104 -2.149 1.00 0.00 O ATOM 836 CB GLU A 161 -1.393 -2.487 -1.493 1.00 0.00 C ATOM 837 CG GLU A 161 -0.562 -2.843 -2.715 1.00 0.00 C ATOM 838 CD GLU A 161 -1.400 -3.408 -3.845 1.00 0.00 C ATOM 839 OE1 GLU A 161 -2.157 -4.371 -3.599 1.00 0.00 O ATOM 840 OE2 GLU A 161 -1.299 -2.889 -4.976 1.00 0.00 O ATOM 0 H GLU A 161 -2.684 -1.289 0.406 1.00 0.00 H new ATOM 0 HA GLU A 161 -1.408 -0.427 -2.103 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -0.752 -2.498 -0.612 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -2.152 -3.255 -1.344 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -0.038 -1.954 -3.065 1.00 0.00 H new ATOM 0 HG3 GLU A 161 0.199 -3.571 -2.433 1.00 0.00 H new ATOM 847 N PHE A 162 -3.505 -0.367 -3.402 1.00 0.00 N ATOM 848 CA PHE A 162 -4.685 -0.370 -4.259 1.00 0.00 C ATOM 849 C PHE A 162 -4.618 -1.506 -5.276 1.00 0.00 C ATOM 850 O PHE A 162 -3.538 -1.996 -5.604 1.00 0.00 O ATOM 851 CB PHE A 162 -4.816 0.972 -4.984 1.00 0.00 C ATOM 852 CG PHE A 162 -5.876 1.867 -4.406 1.00 0.00 C ATOM 853 CD1 PHE A 162 -7.208 1.690 -4.741 1.00 0.00 C ATOM 854 CD2 PHE A 162 -5.538 2.886 -3.529 1.00 0.00 C ATOM 855 CE1 PHE A 162 -8.185 2.513 -4.212 1.00 0.00 C ATOM 856 CE2 PHE A 162 -6.510 3.711 -2.997 1.00 0.00 C ATOM 857 CZ PHE A 162 -7.835 3.525 -3.339 1.00 0.00 C ATOM 0 H PHE A 162 -2.820 0.353 -3.631 1.00 0.00 H new ATOM 0 HA PHE A 162 -5.561 -0.523 -3.629 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -3.857 1.489 -4.950 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.041 0.788 -6.034 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -7.487 0.900 -5.423 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -4.503 3.037 -3.259 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -9.220 2.365 -4.481 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -6.234 4.501 -2.314 1.00 0.00 H new ATOM 0 HZ PHE A 162 -8.596 4.169 -2.925 1.00 0.00 H new ATOM 867 N VAL A 163 -5.780 -1.917 -5.773 1.00 0.00 N ATOM 868 CA VAL A 163 -5.854 -2.991 -6.756 1.00 0.00 C ATOM 869 C VAL A 163 -5.601 -2.461 -8.163 1.00 0.00 C ATOM 870 O VAL A 163 -4.590 -2.782 -8.786 1.00 0.00 O ATOM 871 CB VAL A 163 -7.225 -3.693 -6.721 1.00 0.00 C ATOM 872 CG1 VAL A 163 -7.253 -4.866 -7.691 1.00 0.00 C ATOM 873 CG2 VAL A 163 -7.554 -4.152 -5.308 1.00 0.00 C ATOM 0 H VAL A 163 -6.683 -1.522 -5.511 1.00 0.00 H new ATOM 0 HA VAL A 163 -5.080 -3.714 -6.496 1.00 0.00 H new ATOM 0 HB VAL A 163 -7.986 -2.977 -7.033 1.00 0.00 H new ATOM 0 HG11 VAL A 163 -8.230 -5.348 -7.651 1.00 0.00 H new ATOM 0 HG12 VAL A 163 -7.067 -4.506 -8.703 1.00 0.00 H new ATOM 0 HG13 VAL A 163 -6.482 -5.585 -7.415 1.00 0.00 H new ATOM 0 HG21 VAL A 163 -8.526 -4.646 -5.303 1.00 0.00 H new ATOM 0 HG22 VAL A 163 -6.791 -4.850 -4.965 1.00 0.00 H new ATOM 0 HG23 VAL A 163 -7.582 -3.289 -4.642 1.00 0.00 H new ATOM 883 N ARG A 164 -6.528 -1.646 -8.657 1.00 0.00 N ATOM 884 CA ARG A 164 -6.407 -1.071 -9.991 1.00 0.00 C ATOM 885 C ARG A 164 -5.713 0.287 -9.935 1.00 0.00 C ATOM 886 O ARG A 164 -5.891 1.048 -8.984 1.00 0.00 O ATOM 887 CB ARG A 164 -7.787 -0.925 -10.634 1.00 0.00 C ATOM 888 CG ARG A 164 -7.746 -0.847 -12.152 1.00 0.00 C ATOM 889 CD ARG A 164 -9.052 -1.320 -12.771 1.00 0.00 C ATOM 890 NE ARG A 164 -8.834 -2.344 -13.791 1.00 0.00 N ATOM 891 CZ ARG A 164 -8.592 -3.623 -13.517 1.00 0.00 C ATOM 892 NH1 ARG A 164 -8.536 -4.040 -12.258 1.00 0.00 N ATOM 893 NH2 ARG A 164 -8.407 -4.489 -14.504 1.00 0.00 N ATOM 0 H ARG A 164 -7.371 -1.369 -8.153 1.00 0.00 H new ATOM 0 HA ARG A 164 -5.802 -1.745 -10.597 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -8.408 -1.771 -10.339 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -8.267 -0.027 -10.245 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -7.548 0.180 -12.459 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -6.923 -1.456 -12.526 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -9.700 -1.718 -11.990 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -9.572 -0.471 -13.215 1.00 0.00 H new ATOM 0 HE ARG A 164 -8.870 -2.061 -14.770 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -8.679 -3.379 -11.495 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -8.350 -5.022 -12.054 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -8.450 -4.174 -15.473 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -8.221 -5.470 -14.294 1.00 0.00 H new ATOM 907 N LYS A 165 -4.921 0.585 -10.960 1.00 0.00 N ATOM 908 CA LYS A 165 -4.201 1.852 -11.026 1.00 0.00 C ATOM 909 C LYS A 165 -5.172 3.026 -11.085 1.00 0.00 C ATOM 910 O LYS A 165 -4.953 4.058 -10.451 1.00 0.00 O ATOM 911 CB LYS A 165 -3.277 1.876 -12.245 1.00 0.00 C ATOM 912 CG LYS A 165 -2.431 3.136 -12.340 1.00 0.00 C ATOM 913 CD LYS A 165 -1.088 2.959 -11.650 1.00 0.00 C ATOM 914 CE LYS A 165 -0.398 4.294 -11.425 1.00 0.00 C ATOM 915 NZ LYS A 165 0.690 4.193 -10.414 1.00 0.00 N ATOM 0 H LYS A 165 -4.762 -0.033 -11.756 1.00 0.00 H new ATOM 0 HA LYS A 165 -3.599 1.947 -10.122 1.00 0.00 H new ATOM 0 HB2 LYS A 165 -2.619 1.008 -12.209 1.00 0.00 H new ATOM 0 HB3 LYS A 165 -3.879 1.783 -13.149 1.00 0.00 H new ATOM 0 HG2 LYS A 165 -2.272 3.391 -13.388 1.00 0.00 H new ATOM 0 HG3 LYS A 165 -2.967 3.970 -11.887 1.00 0.00 H new ATOM 0 HD2 LYS A 165 -1.233 2.457 -10.693 1.00 0.00 H new ATOM 0 HD3 LYS A 165 -0.449 2.315 -12.254 1.00 0.00 H new ATOM 0 HE2 LYS A 165 0.015 4.653 -12.368 1.00 0.00 H new ATOM 0 HE3 LYS A 165 -1.131 5.031 -11.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 1.265 5.060 -10.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 0.275 4.075 -9.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 1.292 3.373 -10.632 1.00 0.00 H new ATOM 929 N GLU A 166 -6.245 2.862 -11.852 1.00 0.00 N ATOM 930 CA GLU A 166 -7.251 3.908 -11.995 1.00 0.00 C ATOM 931 C GLU A 166 -7.868 4.259 -10.645 1.00 0.00 C ATOM 932 O GLU A 166 -8.071 5.432 -10.329 1.00 0.00 O ATOM 933 CB GLU A 166 -8.344 3.464 -12.969 1.00 0.00 C ATOM 934 CG GLU A 166 -8.080 3.877 -14.408 1.00 0.00 C ATOM 935 CD GLU A 166 -8.448 5.323 -14.676 1.00 0.00 C ATOM 936 OE1 GLU A 166 -8.551 6.100 -13.704 1.00 0.00 O ATOM 937 OE2 GLU A 166 -8.633 5.679 -15.859 1.00 0.00 O ATOM 0 H GLU A 166 -6.440 2.014 -12.384 1.00 0.00 H new ATOM 0 HA GLU A 166 -6.760 4.797 -12.391 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -8.442 2.379 -12.923 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -9.297 3.884 -12.648 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -7.025 3.726 -14.638 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -8.648 3.231 -15.078 1.00 0.00 H new ATOM 944 N ASP A 167 -8.161 3.235 -9.851 1.00 0.00 N ATOM 945 CA ASP A 167 -8.753 3.435 -8.534 1.00 0.00 C ATOM 946 C ASP A 167 -7.742 4.063 -7.582 1.00 0.00 C ATOM 947 O ASP A 167 -8.106 4.826 -6.687 1.00 0.00 O ATOM 948 CB ASP A 167 -9.250 2.104 -7.966 1.00 0.00 C ATOM 949 CG ASP A 167 -10.215 1.400 -8.902 1.00 0.00 C ATOM 950 OD1 ASP A 167 -9.977 1.424 -10.128 1.00 0.00 O ATOM 951 OD2 ASP A 167 -11.207 0.826 -8.408 1.00 0.00 O ATOM 0 H ASP A 167 -7.998 2.258 -10.097 1.00 0.00 H new ATOM 0 HA ASP A 167 -9.601 4.112 -8.639 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -8.397 1.454 -7.772 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -9.740 2.281 -7.009 1.00 0.00 H new ATOM 956 N MET A 168 -6.470 3.738 -7.785 1.00 0.00 N ATOM 957 CA MET A 168 -5.402 4.272 -6.949 1.00 0.00 C ATOM 958 C MET A 168 -5.249 5.775 -7.165 1.00 0.00 C ATOM 959 O MET A 168 -5.444 6.569 -6.244 1.00 0.00 O ATOM 960 CB MET A 168 -4.083 3.559 -7.257 1.00 0.00 C ATOM 961 CG MET A 168 -2.898 4.099 -6.470 1.00 0.00 C ATOM 962 SD MET A 168 -1.406 4.243 -7.471 1.00 0.00 S ATOM 963 CE MET A 168 -1.962 5.372 -8.744 1.00 0.00 C ATOM 0 H MET A 168 -6.154 3.107 -8.521 1.00 0.00 H new ATOM 0 HA MET A 168 -5.663 4.098 -5.905 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.196 2.496 -7.043 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.872 3.649 -8.323 1.00 0.00 H new ATOM 0 HG2 MET A 168 -3.153 5.077 -6.063 1.00 0.00 H new ATOM 0 HG3 MET A 168 -2.700 3.442 -5.623 1.00 0.00 H new ATOM 0 HE1 MET A 168 -1.101 5.755 -9.292 1.00 0.00 H new ATOM 0 HE2 MET A 168 -2.626 4.847 -9.431 1.00 0.00 H new ATOM 0 HE3 MET A 168 -2.498 6.203 -8.285 1.00 0.00 H new ATOM 973 N THR A 169 -4.900 6.158 -8.390 1.00 0.00 N ATOM 974 CA THR A 169 -4.722 7.564 -8.731 1.00 0.00 C ATOM 975 C THR A 169 -5.956 8.378 -8.351 1.00 0.00 C ATOM 976 O THR A 169 -5.852 9.548 -7.985 1.00 0.00 O ATOM 977 CB THR A 169 -4.437 7.713 -10.224 1.00 0.00 C ATOM 978 OG1 THR A 169 -3.245 7.035 -10.578 1.00 0.00 O ATOM 979 CG2 THR A 169 -4.294 9.154 -10.663 1.00 0.00 C ATOM 0 H THR A 169 -4.735 5.513 -9.163 1.00 0.00 H new ATOM 0 HA THR A 169 -3.872 7.945 -8.166 1.00 0.00 H new ATOM 0 HB THR A 169 -5.301 7.280 -10.728 1.00 0.00 H new ATOM 0 HG1 THR A 169 -3.081 7.141 -11.538 1.00 0.00 H new ATOM 0 HG21 THR A 169 -4.093 9.190 -11.734 1.00 0.00 H new ATOM 0 HG22 THR A 169 -5.217 9.693 -10.449 1.00 0.00 H new ATOM 0 HG23 THR A 169 -3.469 9.619 -10.123 1.00 0.00 H new ATOM 987 N TYR A 170 -7.122 7.752 -8.441 1.00 0.00 N ATOM 988 CA TYR A 170 -8.371 8.422 -8.102 1.00 0.00 C ATOM 989 C TYR A 170 -8.380 8.821 -6.631 1.00 0.00 C ATOM 990 O TYR A 170 -8.732 9.948 -6.283 1.00 0.00 O ATOM 991 CB TYR A 170 -9.559 7.508 -8.400 1.00 0.00 C ATOM 992 CG TYR A 170 -10.900 8.137 -8.092 1.00 0.00 C ATOM 993 CD1 TYR A 170 -11.480 9.046 -8.968 1.00 0.00 C ATOM 994 CD2 TYR A 170 -11.585 7.821 -6.926 1.00 0.00 C ATOM 995 CE1 TYR A 170 -12.705 9.623 -8.690 1.00 0.00 C ATOM 996 CE2 TYR A 170 -12.811 8.394 -6.641 1.00 0.00 C ATOM 997 CZ TYR A 170 -13.366 9.294 -7.526 1.00 0.00 C ATOM 998 OH TYR A 170 -14.585 9.866 -7.246 1.00 0.00 O ATOM 0 H TYR A 170 -7.229 6.784 -8.745 1.00 0.00 H new ATOM 0 HA TYR A 170 -8.454 9.323 -8.710 1.00 0.00 H new ATOM 0 HB2 TYR A 170 -9.533 7.224 -9.452 1.00 0.00 H new ATOM 0 HB3 TYR A 170 -9.456 6.591 -7.820 1.00 0.00 H new ATOM 0 HD1 TYR A 170 -10.965 9.306 -9.881 1.00 0.00 H new ATOM 0 HD2 TYR A 170 -11.153 7.116 -6.231 1.00 0.00 H new ATOM 0 HE1 TYR A 170 -13.142 10.328 -9.381 1.00 0.00 H new ATOM 0 HE2 TYR A 170 -13.331 8.138 -5.730 1.00 0.00 H new ATOM 0 HH TYR A 170 -14.916 9.527 -6.388 1.00 0.00 H new ATOM 1008 N ALA A 171 -7.996 7.883 -5.773 1.00 0.00 N ATOM 1009 CA ALA A 171 -7.961 8.121 -4.341 1.00 0.00 C ATOM 1010 C ALA A 171 -7.032 9.280 -3.987 1.00 0.00 C ATOM 1011 O ALA A 171 -7.399 10.171 -3.222 1.00 0.00 O ATOM 1012 CB ALA A 171 -7.534 6.858 -3.608 1.00 0.00 C ATOM 0 H ALA A 171 -7.703 6.946 -6.050 1.00 0.00 H new ATOM 0 HA ALA A 171 -8.967 8.394 -4.024 1.00 0.00 H new ATOM 0 HB1 ALA A 171 -7.512 7.050 -2.535 1.00 0.00 H new ATOM 0 HB2 ALA A 171 -8.243 6.058 -3.819 1.00 0.00 H new ATOM 0 HB3 ALA A 171 -6.541 6.561 -3.944 1.00 0.00 H new ATOM 1018 N VAL A 172 -5.828 9.271 -4.549 1.00 0.00 N ATOM 1019 CA VAL A 172 -4.865 10.327 -4.284 1.00 0.00 C ATOM 1020 C VAL A 172 -5.383 11.669 -4.784 1.00 0.00 C ATOM 1021 O VAL A 172 -4.953 12.726 -4.324 1.00 0.00 O ATOM 1022 CB VAL A 172 -3.510 10.027 -4.944 1.00 0.00 C ATOM 1023 CG1 VAL A 172 -2.825 8.858 -4.255 1.00 0.00 C ATOM 1024 CG2 VAL A 172 -3.685 9.755 -6.428 1.00 0.00 C ATOM 0 H VAL A 172 -5.499 8.547 -5.188 1.00 0.00 H new ATOM 0 HA VAL A 172 -4.726 10.374 -3.204 1.00 0.00 H new ATOM 0 HB VAL A 172 -2.873 10.905 -4.834 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -1.867 8.662 -4.737 1.00 0.00 H new ATOM 0 HG12 VAL A 172 -2.660 9.101 -3.205 1.00 0.00 H new ATOM 0 HG13 VAL A 172 -3.456 7.972 -4.328 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -2.714 9.545 -6.876 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -4.342 8.896 -6.565 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -4.125 10.629 -6.909 1.00 0.00 H new ATOM 1034 N ARG A 173 -6.307 11.613 -5.735 1.00 0.00 N ATOM 1035 CA ARG A 173 -6.892 12.808 -6.312 1.00 0.00 C ATOM 1036 C ARG A 173 -8.067 13.305 -5.480 1.00 0.00 C ATOM 1037 O ARG A 173 -7.986 14.338 -4.815 1.00 0.00 O ATOM 1038 CB ARG A 173 -7.367 12.515 -7.733 1.00 0.00 C ATOM 1039 CG ARG A 173 -6.247 12.510 -8.754 1.00 0.00 C ATOM 1040 CD ARG A 173 -6.779 12.364 -10.170 1.00 0.00 C ATOM 1041 NE ARG A 173 -6.805 13.641 -10.880 1.00 0.00 N ATOM 1042 CZ ARG A 173 -5.734 14.200 -11.439 1.00 0.00 C ATOM 1043 NH1 ARG A 173 -4.553 13.599 -11.376 1.00 0.00 N ATOM 1044 NH2 ARG A 173 -5.845 15.364 -12.065 1.00 0.00 N ATOM 0 H ARG A 173 -6.668 10.742 -6.123 1.00 0.00 H new ATOM 0 HA ARG A 173 -6.127 13.585 -6.327 1.00 0.00 H new ATOM 0 HB2 ARG A 173 -7.867 11.546 -7.748 1.00 0.00 H new ATOM 0 HB3 ARG A 173 -8.108 13.261 -8.021 1.00 0.00 H new ATOM 0 HG2 ARG A 173 -5.676 13.435 -8.673 1.00 0.00 H new ATOM 0 HG3 ARG A 173 -5.560 11.692 -8.537 1.00 0.00 H new ATOM 0 HD2 ARG A 173 -6.158 11.656 -10.719 1.00 0.00 H new ATOM 0 HD3 ARG A 173 -7.785 11.947 -10.138 1.00 0.00 H new ATOM 0 HE ARG A 173 -7.696 14.133 -10.951 1.00 0.00 H new ATOM 0 HH11 ARG A 173 -4.462 12.703 -10.897 1.00 0.00 H new ATOM 0 HH12 ARG A 173 -3.736 14.033 -11.806 1.00 0.00 H new ATOM 0 HH21 ARG A 173 -6.751 15.830 -12.118 1.00 0.00 H new ATOM 0 HH22 ARG A 173 -5.025 15.793 -12.494 1.00 0.00 H new ATOM 1058 N LYS A 174 -9.167 12.566 -5.546 1.00 0.00 N ATOM 1059 CA LYS A 174 -10.382 12.926 -4.824 1.00 0.00 C ATOM 1060 C LYS A 174 -10.301 12.552 -3.339 1.00 0.00 C ATOM 1061 O LYS A 174 -10.806 13.282 -2.486 1.00 0.00 O ATOM 1062 CB LYS A 174 -11.600 12.279 -5.510 1.00 0.00 C ATOM 1063 CG LYS A 174 -12.347 11.249 -4.672 1.00 0.00 C ATOM 1064 CD LYS A 174 -13.398 11.909 -3.794 1.00 0.00 C ATOM 1065 CE LYS A 174 -13.620 11.133 -2.506 1.00 0.00 C ATOM 1066 NZ LYS A 174 -13.317 11.957 -1.303 1.00 0.00 N ATOM 0 H LYS A 174 -9.243 11.710 -6.095 1.00 0.00 H new ATOM 0 HA LYS A 174 -10.495 14.010 -4.857 1.00 0.00 H new ATOM 0 HB2 LYS A 174 -12.297 13.067 -5.794 1.00 0.00 H new ATOM 0 HB3 LYS A 174 -11.266 11.801 -6.431 1.00 0.00 H new ATOM 0 HG2 LYS A 174 -12.823 10.520 -5.328 1.00 0.00 H new ATOM 0 HG3 LYS A 174 -11.640 10.703 -4.048 1.00 0.00 H new ATOM 0 HD2 LYS A 174 -13.088 12.927 -3.557 1.00 0.00 H new ATOM 0 HD3 LYS A 174 -14.337 11.981 -4.342 1.00 0.00 H new ATOM 0 HE2 LYS A 174 -14.654 10.792 -2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 174 -12.990 10.243 -2.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 -13.448 11.382 -0.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 -12.333 12.290 -1.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 -13.958 12.775 -1.272 1.00 0.00 H new ATOM 1080 N LEU A 175 -9.670 11.419 -3.030 1.00 0.00 N ATOM 1081 CA LEU A 175 -9.542 10.980 -1.639 1.00 0.00 C ATOM 1082 C LEU A 175 -8.261 11.518 -1.006 1.00 0.00 C ATOM 1083 O LEU A 175 -7.515 10.776 -0.369 1.00 0.00 O ATOM 1084 CB LEU A 175 -9.560 9.451 -1.539 1.00 0.00 C ATOM 1085 CG LEU A 175 -10.916 8.791 -1.784 1.00 0.00 C ATOM 1086 CD1 LEU A 175 -10.755 7.286 -1.921 1.00 0.00 C ATOM 1087 CD2 LEU A 175 -11.882 9.123 -0.656 1.00 0.00 C ATOM 0 H LEU A 175 -9.244 10.794 -3.715 1.00 0.00 H new ATOM 0 HA LEU A 175 -10.398 11.380 -1.095 1.00 0.00 H new ATOM 0 HB2 LEU A 175 -8.845 9.049 -2.257 1.00 0.00 H new ATOM 0 HB3 LEU A 175 -9.210 9.165 -0.547 1.00 0.00 H new ATOM 0 HG LEU A 175 -11.327 9.181 -2.715 1.00 0.00 H new ATOM 0 HD11 LEU A 175 -11.730 6.830 -2.095 1.00 0.00 H new ATOM 0 HD12 LEU A 175 -10.096 7.066 -2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 175 -10.324 6.881 -1.005 1.00 0.00 H new ATOM 0 HD21 LEU A 175 -12.843 8.645 -0.847 1.00 0.00 H new ATOM 0 HD22 LEU A 175 -11.477 8.760 0.289 1.00 0.00 H new ATOM 0 HD23 LEU A 175 -12.019 10.203 -0.600 1.00 0.00 H new ATOM 1099 N ASP A 176 -8.012 12.810 -1.181 1.00 0.00 N ATOM 1100 CA ASP A 176 -6.822 13.440 -0.620 1.00 0.00 C ATOM 1101 C ASP A 176 -7.195 14.362 0.536 1.00 0.00 C ATOM 1102 O ASP A 176 -8.055 15.232 0.397 1.00 0.00 O ATOM 1103 CB ASP A 176 -6.077 14.226 -1.700 1.00 0.00 C ATOM 1104 CG ASP A 176 -4.812 14.878 -1.175 1.00 0.00 C ATOM 1105 OD1 ASP A 176 -4.160 14.282 -0.292 1.00 0.00 O ATOM 1106 OD2 ASP A 176 -4.475 15.984 -1.646 1.00 0.00 O ATOM 0 H ASP A 176 -8.617 13.442 -1.706 1.00 0.00 H new ATOM 0 HA ASP A 176 -6.167 12.656 -0.240 1.00 0.00 H new ATOM 0 HB2 ASP A 176 -5.823 13.557 -2.522 1.00 0.00 H new ATOM 0 HB3 ASP A 176 -6.736 14.993 -2.106 1.00 0.00 H new ATOM 1111 N ASN A 177 -6.545 14.163 1.677 1.00 0.00 N ATOM 1112 CA ASN A 177 -6.811 14.975 2.859 1.00 0.00 C ATOM 1113 C ASN A 177 -8.257 14.805 3.314 1.00 0.00 C ATOM 1114 O ASN A 177 -8.861 15.731 3.857 1.00 0.00 O ATOM 1115 CB ASN A 177 -6.523 16.449 2.569 1.00 0.00 C ATOM 1116 CG ASN A 177 -5.888 17.157 3.749 1.00 0.00 C ATOM 1117 OD1 ASN A 177 -4.677 17.076 3.959 1.00 0.00 O ATOM 1118 ND2 ASN A 177 -6.704 17.857 4.528 1.00 0.00 N ATOM 0 H ASN A 177 -5.831 13.447 1.809 1.00 0.00 H new ATOM 0 HA ASN A 177 -6.152 14.638 3.660 1.00 0.00 H new ATOM 0 HB2 ASN A 177 -5.862 16.524 1.705 1.00 0.00 H new ATOM 0 HB3 ASN A 177 -7.453 16.953 2.304 1.00 0.00 H new ATOM 0 HD21 ASN A 177 -6.334 18.355 5.338 1.00 0.00 H new ATOM 0 HD22 ASN A 177 -7.701 17.897 4.317 1.00 0.00 H new ATOM 1125 N THR A 178 -8.806 13.616 3.088 1.00 0.00 N ATOM 1126 CA THR A 178 -10.182 13.321 3.473 1.00 0.00 C ATOM 1127 C THR A 178 -10.288 13.084 4.976 1.00 0.00 C ATOM 1128 O THR A 178 -9.328 13.297 5.718 1.00 0.00 O ATOM 1129 CB THR A 178 -10.699 12.097 2.710 1.00 0.00 C ATOM 1130 OG1 THR A 178 -9.628 11.388 2.109 1.00 0.00 O ATOM 1131 CG2 THR A 178 -11.689 12.447 1.620 1.00 0.00 C ATOM 0 H THR A 178 -8.319 12.840 2.640 1.00 0.00 H new ATOM 0 HA THR A 178 -10.797 14.184 3.217 1.00 0.00 H new ATOM 0 HB THR A 178 -11.206 11.485 3.456 1.00 0.00 H new ATOM 0 HG1 THR A 178 -9.980 10.610 1.628 1.00 0.00 H new ATOM 0 HG21 THR A 178 -12.016 11.536 1.119 1.00 0.00 H new ATOM 0 HG22 THR A 178 -12.551 12.949 2.059 1.00 0.00 H new ATOM 0 HG23 THR A 178 -11.214 13.109 0.896 1.00 0.00 H new ATOM 1139 N LYS A 179 -11.461 12.644 5.418 1.00 0.00 N ATOM 1140 CA LYS A 179 -11.695 12.379 6.833 1.00 0.00 C ATOM 1141 C LYS A 179 -11.858 10.884 7.090 1.00 0.00 C ATOM 1142 O LYS A 179 -12.781 10.252 6.575 1.00 0.00 O ATOM 1143 CB LYS A 179 -12.938 13.130 7.315 1.00 0.00 C ATOM 1144 CG LYS A 179 -13.244 12.919 8.789 1.00 0.00 C ATOM 1145 CD LYS A 179 -14.508 13.654 9.209 1.00 0.00 C ATOM 1146 CE LYS A 179 -14.189 14.861 10.076 1.00 0.00 C ATOM 1147 NZ LYS A 179 -13.141 15.724 9.465 1.00 0.00 N ATOM 0 H LYS A 179 -12.265 12.463 4.817 1.00 0.00 H new ATOM 0 HA LYS A 179 -10.827 12.731 7.390 1.00 0.00 H new ATOM 0 HB2 LYS A 179 -12.803 14.196 7.130 1.00 0.00 H new ATOM 0 HB3 LYS A 179 -13.797 12.810 6.725 1.00 0.00 H new ATOM 0 HG2 LYS A 179 -13.359 11.854 8.989 1.00 0.00 H new ATOM 0 HG3 LYS A 179 -12.403 13.267 9.389 1.00 0.00 H new ATOM 0 HD2 LYS A 179 -15.054 13.976 8.322 1.00 0.00 H new ATOM 0 HD3 LYS A 179 -15.161 12.974 9.756 1.00 0.00 H new ATOM 0 HE2 LYS A 179 -15.096 15.446 10.231 1.00 0.00 H new ATOM 0 HE3 LYS A 179 -13.855 14.525 11.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 179 -13.272 16.706 9.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 179 -12.201 15.389 9.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 179 -13.217 15.681 8.429 1.00 0.00 H new ATOM 1161 N PHE A 180 -10.957 10.327 7.892 1.00 0.00 N ATOM 1162 CA PHE A 180 -11.000 8.907 8.222 1.00 0.00 C ATOM 1163 C PHE A 180 -11.686 8.688 9.568 1.00 0.00 C ATOM 1164 O PHE A 180 -11.415 9.397 10.537 1.00 0.00 O ATOM 1165 CB PHE A 180 -9.579 8.329 8.246 1.00 0.00 C ATOM 1166 CG PHE A 180 -9.477 6.977 8.898 1.00 0.00 C ATOM 1167 CD1 PHE A 180 -10.304 5.936 8.504 1.00 0.00 C ATOM 1168 CD2 PHE A 180 -8.554 6.751 9.906 1.00 0.00 C ATOM 1169 CE1 PHE A 180 -10.210 4.694 9.104 1.00 0.00 C ATOM 1170 CE2 PHE A 180 -8.456 5.512 10.509 1.00 0.00 C ATOM 1171 CZ PHE A 180 -9.284 4.483 10.108 1.00 0.00 C ATOM 0 H PHE A 180 -10.188 10.837 8.326 1.00 0.00 H new ATOM 0 HA PHE A 180 -11.578 8.390 7.456 1.00 0.00 H new ATOM 0 HB2 PHE A 180 -9.211 8.256 7.223 1.00 0.00 H new ATOM 0 HB3 PHE A 180 -8.924 9.024 8.771 1.00 0.00 H new ATOM 0 HD1 PHE A 180 -11.029 6.097 7.720 1.00 0.00 H new ATOM 0 HD2 PHE A 180 -7.904 7.552 10.224 1.00 0.00 H new ATOM 0 HE1 PHE A 180 -10.859 3.890 8.789 1.00 0.00 H new ATOM 0 HE2 PHE A 180 -7.732 5.349 11.294 1.00 0.00 H new ATOM 0 HZ PHE A 180 -9.208 3.514 10.578 1.00 0.00 H new ATOM 1181 N ARG A 181 -12.577 7.703 9.619 1.00 0.00 N ATOM 1182 CA ARG A 181 -13.303 7.391 10.844 1.00 0.00 C ATOM 1183 C ARG A 181 -13.069 5.943 11.264 1.00 0.00 C ATOM 1184 O ARG A 181 -13.428 5.012 10.544 1.00 0.00 O ATOM 1185 CB ARG A 181 -14.800 7.641 10.653 1.00 0.00 C ATOM 1186 CG ARG A 181 -15.626 7.380 11.902 1.00 0.00 C ATOM 1187 CD ARG A 181 -17.094 7.703 11.677 1.00 0.00 C ATOM 1188 NE ARG A 181 -17.913 7.373 12.841 1.00 0.00 N ATOM 1189 CZ ARG A 181 -19.239 7.270 12.809 1.00 0.00 C ATOM 1190 NH1 ARG A 181 -19.900 7.469 11.675 1.00 0.00 N ATOM 1191 NH2 ARG A 181 -19.908 6.967 13.914 1.00 0.00 N ATOM 0 H ARG A 181 -12.813 7.107 8.826 1.00 0.00 H new ATOM 0 HA ARG A 181 -12.929 8.044 11.632 1.00 0.00 H new ATOM 0 HB2 ARG A 181 -14.950 8.674 10.338 1.00 0.00 H new ATOM 0 HB3 ARG A 181 -15.166 7.005 9.847 1.00 0.00 H new ATOM 0 HG2 ARG A 181 -15.523 6.335 12.196 1.00 0.00 H new ATOM 0 HG3 ARG A 181 -15.242 7.982 12.726 1.00 0.00 H new ATOM 0 HD2 ARG A 181 -17.201 8.763 11.448 1.00 0.00 H new ATOM 0 HD3 ARG A 181 -17.458 7.151 10.810 1.00 0.00 H new ATOM 0 HE ARG A 181 -17.440 7.212 13.730 1.00 0.00 H new ATOM 0 HH11 ARG A 181 -19.391 7.702 10.822 1.00 0.00 H new ATOM 0 HH12 ARG A 181 -20.917 7.389 11.656 1.00 0.00 H new ATOM 0 HH21 ARG A 181 -19.406 6.813 14.788 1.00 0.00 H new ATOM 0 HH22 ARG A 181 -20.925 6.888 13.889 1.00 0.00 H new ATOM 1205 N SER A 182 -12.466 5.763 12.434 1.00 0.00 N ATOM 1206 CA SER A 182 -12.186 4.429 12.952 1.00 0.00 C ATOM 1207 C SER A 182 -13.431 3.821 13.587 1.00 0.00 C ATOM 1208 O SER A 182 -14.279 4.535 14.121 1.00 0.00 O ATOM 1209 CB SER A 182 -11.052 4.485 13.977 1.00 0.00 C ATOM 1210 OG SER A 182 -11.372 5.361 15.044 1.00 0.00 O ATOM 0 H SER A 182 -12.162 6.524 13.041 1.00 0.00 H new ATOM 0 HA SER A 182 -11.881 3.798 12.117 1.00 0.00 H new ATOM 0 HB2 SER A 182 -10.861 3.486 14.368 1.00 0.00 H new ATOM 0 HB3 SER A 182 -10.135 4.818 13.491 1.00 0.00 H new ATOM 0 HG SER A 182 -11.291 6.289 14.741 1.00 0.00 H new ATOM 1216 N HIS A 183 -13.533 2.497 13.527 1.00 0.00 N ATOM 1217 CA HIS A 183 -14.674 1.791 14.099 1.00 0.00 C ATOM 1218 C HIS A 183 -14.861 2.154 15.571 1.00 0.00 C ATOM 1219 O HIS A 183 -15.960 2.037 16.114 1.00 0.00 O ATOM 1220 CB HIS A 183 -14.494 0.278 13.949 1.00 0.00 C ATOM 1221 CG HIS A 183 -13.409 -0.293 14.811 1.00 0.00 C ATOM 1222 ND1 HIS A 183 -12.222 0.363 15.064 1.00 0.00 N ATOM 1223 CD2 HIS A 183 -13.337 -1.467 15.482 1.00 0.00 C ATOM 1224 CE1 HIS A 183 -11.468 -0.383 15.851 1.00 0.00 C ATOM 1225 NE2 HIS A 183 -12.121 -1.498 16.120 1.00 0.00 N ATOM 0 H HIS A 183 -12.839 1.891 13.088 1.00 0.00 H new ATOM 0 HA HIS A 183 -15.567 2.097 13.555 1.00 0.00 H new ATOM 0 HB2 HIS A 183 -15.435 -0.216 14.192 1.00 0.00 H new ATOM 0 HB3 HIS A 183 -14.274 0.050 12.906 1.00 0.00 H new ATOM 0 HD2 HIS A 183 -14.095 -2.236 15.510 1.00 0.00 H new ATOM 0 HE1 HIS A 183 -10.484 -0.124 16.213 1.00 0.00 H new ATOM 0 HE2 HIS A 183 -11.778 -2.259 16.706 1.00 0.00 H new ATOM 1234 N GLU A 184 -13.782 2.597 16.210 1.00 0.00 N ATOM 1235 CA GLU A 184 -13.830 2.978 17.617 1.00 0.00 C ATOM 1236 C GLU A 184 -14.551 4.311 17.798 1.00 0.00 C ATOM 1237 O GLU A 184 -15.067 4.606 18.877 1.00 0.00 O ATOM 1238 CB GLU A 184 -12.414 3.071 18.189 1.00 0.00 C ATOM 1239 CG GLU A 184 -11.872 1.743 18.692 1.00 0.00 C ATOM 1240 CD GLU A 184 -12.576 1.263 19.946 1.00 0.00 C ATOM 1241 OE1 GLU A 184 -12.292 1.810 21.032 1.00 0.00 O ATOM 1242 OE2 GLU A 184 -13.411 0.341 19.841 1.00 0.00 O ATOM 0 H GLU A 184 -12.865 2.701 15.776 1.00 0.00 H new ATOM 0 HA GLU A 184 -14.385 2.210 18.156 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -11.746 3.459 17.420 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -12.409 3.790 19.008 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -11.979 0.992 17.910 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -10.806 1.843 18.894 1.00 0.00 H new ATOM 1249 N GLY A 185 -14.584 5.113 16.738 1.00 0.00 N ATOM 1250 CA GLY A 185 -15.244 6.404 16.806 1.00 0.00 C ATOM 1251 C GLY A 185 -14.260 7.554 16.884 1.00 0.00 C ATOM 1252 O GLY A 185 -14.561 8.600 17.460 1.00 0.00 O ATOM 0 H GLY A 185 -14.166 4.892 15.834 1.00 0.00 H new ATOM 0 HA2 GLY A 185 -15.878 6.531 15.929 1.00 0.00 H new ATOM 0 HA3 GLY A 185 -15.898 6.429 17.678 1.00 0.00 H new ATOM 1256 N GLU A 186 -13.080 7.360 16.304 1.00 0.00 N ATOM 1257 CA GLU A 186 -12.047 8.388 16.309 1.00 0.00 C ATOM 1258 C GLU A 186 -11.800 8.918 14.900 1.00 0.00 C ATOM 1259 O GLU A 186 -11.263 8.212 14.046 1.00 0.00 O ATOM 1260 CB GLU A 186 -10.746 7.831 16.890 1.00 0.00 C ATOM 1261 CG GLU A 186 -10.682 7.891 18.407 1.00 0.00 C ATOM 1262 CD GLU A 186 -9.677 8.910 18.910 1.00 0.00 C ATOM 1263 OE1 GLU A 186 -9.333 9.833 18.141 1.00 0.00 O ATOM 1264 OE2 GLU A 186 -9.234 8.785 20.071 1.00 0.00 O ATOM 0 H GLU A 186 -12.816 6.499 15.824 1.00 0.00 H new ATOM 0 HA GLU A 186 -12.393 9.212 16.933 1.00 0.00 H new ATOM 0 HB2 GLU A 186 -10.629 6.795 16.571 1.00 0.00 H new ATOM 0 HB3 GLU A 186 -9.905 8.389 16.477 1.00 0.00 H new ATOM 0 HG2 GLU A 186 -11.669 8.136 18.799 1.00 0.00 H new ATOM 0 HG3 GLU A 186 -10.420 6.907 18.795 1.00 0.00 H new ATOM 1271 N THR A 187 -12.197 10.164 14.663 1.00 0.00 N ATOM 1272 CA THR A 187 -12.019 10.785 13.356 1.00 0.00 C ATOM 1273 C THR A 187 -10.653 11.456 13.251 1.00 0.00 C ATOM 1274 O THR A 187 -10.062 11.847 14.257 1.00 0.00 O ATOM 1275 CB THR A 187 -13.124 11.809 13.096 1.00 0.00 C ATOM 1276 OG1 THR A 187 -13.718 12.228 14.312 1.00 0.00 O ATOM 1277 CG2 THR A 187 -14.225 11.282 12.203 1.00 0.00 C ATOM 0 H THR A 187 -12.643 10.763 15.358 1.00 0.00 H new ATOM 0 HA THR A 187 -12.077 10.000 12.601 1.00 0.00 H new ATOM 0 HB THR A 187 -12.635 12.642 12.591 1.00 0.00 H new ATOM 0 HG1 THR A 187 -14.421 12.884 14.124 1.00 0.00 H new ATOM 0 HG21 THR A 187 -14.978 12.057 12.058 1.00 0.00 H new ATOM 0 HG22 THR A 187 -13.806 10.998 11.238 1.00 0.00 H new ATOM 0 HG23 THR A 187 -14.686 10.411 12.669 1.00 0.00 H new ATOM 1285 N ALA A 188 -10.159 11.583 12.024 1.00 0.00 N ATOM 1286 CA ALA A 188 -8.864 12.206 11.781 1.00 0.00 C ATOM 1287 C ALA A 188 -8.642 12.449 10.293 1.00 0.00 C ATOM 1288 O ALA A 188 -9.163 11.718 9.450 1.00 0.00 O ATOM 1289 CB ALA A 188 -7.749 11.339 12.347 1.00 0.00 C ATOM 0 H ALA A 188 -10.637 11.262 11.182 1.00 0.00 H new ATOM 0 HA ALA A 188 -8.852 13.172 12.286 1.00 0.00 H new ATOM 0 HB1 ALA A 188 -6.787 11.815 12.159 1.00 0.00 H new ATOM 0 HB2 ALA A 188 -7.891 11.219 13.421 1.00 0.00 H new ATOM 0 HB3 ALA A 188 -7.770 10.361 11.867 1.00 0.00 H new ATOM 1295 N TYR A 189 -7.866 13.480 9.975 1.00 0.00 N ATOM 1296 CA TYR A 189 -7.575 13.817 8.587 1.00 0.00 C ATOM 1297 C TYR A 189 -6.358 13.045 8.086 1.00 0.00 C ATOM 1298 O TYR A 189 -5.311 13.031 8.732 1.00 0.00 O ATOM 1299 CB TYR A 189 -7.335 15.321 8.444 1.00 0.00 C ATOM 1300 CG TYR A 189 -8.577 16.156 8.663 1.00 0.00 C ATOM 1301 CD1 TYR A 189 -9.208 16.187 9.901 1.00 0.00 C ATOM 1302 CD2 TYR A 189 -9.118 16.914 7.632 1.00 0.00 C ATOM 1303 CE1 TYR A 189 -10.342 16.949 10.104 1.00 0.00 C ATOM 1304 CE2 TYR A 189 -10.252 17.679 7.828 1.00 0.00 C ATOM 1305 CZ TYR A 189 -10.860 17.693 9.065 1.00 0.00 C ATOM 1306 OH TYR A 189 -11.989 18.454 9.264 1.00 0.00 O ATOM 0 H TYR A 189 -7.428 14.096 10.660 1.00 0.00 H new ATOM 0 HA TYR A 189 -8.437 13.536 7.982 1.00 0.00 H new ATOM 0 HB2 TYR A 189 -6.571 15.628 9.158 1.00 0.00 H new ATOM 0 HB3 TYR A 189 -6.941 15.525 7.448 1.00 0.00 H new ATOM 0 HD1 TYR A 189 -8.805 15.606 10.717 1.00 0.00 H new ATOM 0 HD2 TYR A 189 -8.644 16.905 6.661 1.00 0.00 H new ATOM 0 HE1 TYR A 189 -10.821 16.962 11.072 1.00 0.00 H new ATOM 0 HE2 TYR A 189 -10.660 18.263 7.016 1.00 0.00 H new ATOM 0 HH TYR A 189 -12.222 18.917 8.432 1.00 0.00 H new ATOM 1316 N ILE A 190 -6.504 12.402 6.932 1.00 0.00 N ATOM 1317 CA ILE A 190 -5.417 11.625 6.347 1.00 0.00 C ATOM 1318 C ILE A 190 -5.110 12.085 4.926 1.00 0.00 C ATOM 1319 O ILE A 190 -6.013 12.441 4.169 1.00 0.00 O ATOM 1320 CB ILE A 190 -5.751 10.121 6.324 1.00 0.00 C ATOM 1321 CG1 ILE A 190 -7.106 9.887 5.653 1.00 0.00 C ATOM 1322 CG2 ILE A 190 -5.746 9.555 7.735 1.00 0.00 C ATOM 1323 CD1 ILE A 190 -7.167 8.610 4.845 1.00 0.00 C ATOM 0 H ILE A 190 -7.364 12.404 6.384 1.00 0.00 H new ATOM 0 HA ILE A 190 -4.541 11.788 6.975 1.00 0.00 H new ATOM 0 HB ILE A 190 -4.987 9.603 5.745 1.00 0.00 H new ATOM 0 HG12 ILE A 190 -7.882 9.861 6.418 1.00 0.00 H new ATOM 0 HG13 ILE A 190 -7.330 10.731 5.001 1.00 0.00 H new ATOM 0 HG21 ILE A 190 -5.984 8.492 7.701 1.00 0.00 H new ATOM 0 HG22 ILE A 190 -4.760 9.692 8.179 1.00 0.00 H new ATOM 0 HG23 ILE A 190 -6.491 10.074 8.338 1.00 0.00 H new ATOM 0 HD11 ILE A 190 -8.156 8.509 4.398 1.00 0.00 H new ATOM 0 HD12 ILE A 190 -6.414 8.642 4.057 1.00 0.00 H new ATOM 0 HD13 ILE A 190 -6.975 7.758 5.497 1.00 0.00 H new ATOM 1335 N ARG A 191 -3.829 12.073 4.569 1.00 0.00 N ATOM 1336 CA ARG A 191 -3.402 12.485 3.237 1.00 0.00 C ATOM 1337 C ARG A 191 -2.913 11.286 2.430 1.00 0.00 C ATOM 1338 O ARG A 191 -1.991 10.583 2.841 1.00 0.00 O ATOM 1339 CB ARG A 191 -2.295 13.537 3.334 1.00 0.00 C ATOM 1340 CG ARG A 191 -1.764 13.987 1.982 1.00 0.00 C ATOM 1341 CD ARG A 191 -1.441 15.472 1.974 1.00 0.00 C ATOM 1342 NE ARG A 191 -0.327 15.785 1.083 1.00 0.00 N ATOM 1343 CZ ARG A 191 -0.385 15.679 -0.243 1.00 0.00 C ATOM 1344 NH1 ARG A 191 -1.503 15.276 -0.835 1.00 0.00 N ATOM 1345 NH2 ARG A 191 0.676 15.978 -0.980 1.00 0.00 N ATOM 0 H ARG A 191 -3.069 11.782 5.184 1.00 0.00 H new ATOM 0 HA ARG A 191 -4.260 12.920 2.725 1.00 0.00 H new ATOM 0 HB2 ARG A 191 -2.676 14.405 3.873 1.00 0.00 H new ATOM 0 HB3 ARG A 191 -1.471 13.133 3.922 1.00 0.00 H new ATOM 0 HG2 ARG A 191 -0.868 13.418 1.735 1.00 0.00 H new ATOM 0 HG3 ARG A 191 -2.502 13.770 1.210 1.00 0.00 H new ATOM 0 HD2 ARG A 191 -2.322 16.033 1.663 1.00 0.00 H new ATOM 0 HD3 ARG A 191 -1.198 15.796 2.986 1.00 0.00 H new ATOM 0 HE ARG A 191 0.547 16.104 1.501 1.00 0.00 H new ATOM 0 HH11 ARG A 191 -2.323 15.046 -0.274 1.00 0.00 H new ATOM 0 HH12 ARG A 191 -1.542 15.197 -1.851 1.00 0.00 H new ATOM 0 HH21 ARG A 191 1.537 16.289 -0.531 1.00 0.00 H new ATOM 0 HH22 ARG A 191 0.631 15.897 -1.996 1.00 0.00 H new ATOM 1359 N VAL A 192 -3.540 11.060 1.280 1.00 0.00 N ATOM 1360 CA VAL A 192 -3.171 9.946 0.415 1.00 0.00 C ATOM 1361 C VAL A 192 -2.170 10.384 -0.649 1.00 0.00 C ATOM 1362 O VAL A 192 -2.159 11.543 -1.064 1.00 0.00 O ATOM 1363 CB VAL A 192 -4.407 9.339 -0.279 1.00 0.00 C ATOM 1364 CG1 VAL A 192 -4.072 7.981 -0.875 1.00 0.00 C ATOM 1365 CG2 VAL A 192 -5.570 9.230 0.697 1.00 0.00 C ATOM 0 H VAL A 192 -4.306 11.633 0.926 1.00 0.00 H new ATOM 0 HA VAL A 192 -2.713 9.190 1.052 1.00 0.00 H new ATOM 0 HB VAL A 192 -4.706 10.002 -1.091 1.00 0.00 H new ATOM 0 HG11 VAL A 192 -4.957 7.568 -1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 192 -3.274 8.093 -1.609 1.00 0.00 H new ATOM 0 HG13 VAL A 192 -3.745 7.307 -0.083 1.00 0.00 H new ATOM 0 HG21 VAL A 192 -6.433 8.800 0.188 1.00 0.00 H new ATOM 0 HG22 VAL A 192 -5.285 8.591 1.533 1.00 0.00 H new ATOM 0 HG23 VAL A 192 -5.826 10.222 1.070 1.00 0.00 H new ATOM 1375 N LYS A 193 -1.330 9.451 -1.086 1.00 0.00 N ATOM 1376 CA LYS A 193 -0.325 9.742 -2.102 1.00 0.00 C ATOM 1377 C LYS A 193 0.098 8.470 -2.830 1.00 0.00 C ATOM 1378 O LYS A 193 -0.239 7.363 -2.412 1.00 0.00 O ATOM 1379 CB LYS A 193 0.895 10.410 -1.464 1.00 0.00 C ATOM 1380 CG LYS A 193 0.868 11.928 -1.540 1.00 0.00 C ATOM 1381 CD LYS A 193 1.752 12.447 -2.663 1.00 0.00 C ATOM 1382 CE LYS A 193 3.211 12.079 -2.441 1.00 0.00 C ATOM 1383 NZ LYS A 193 3.696 11.097 -3.450 1.00 0.00 N ATOM 0 H LYS A 193 -1.325 8.487 -0.752 1.00 0.00 H new ATOM 0 HA LYS A 193 -0.765 10.424 -2.829 1.00 0.00 H new ATOM 0 HB2 LYS A 193 0.959 10.108 -0.419 1.00 0.00 H new ATOM 0 HB3 LYS A 193 1.797 10.046 -1.956 1.00 0.00 H new ATOM 0 HG2 LYS A 193 -0.156 12.267 -1.696 1.00 0.00 H new ATOM 0 HG3 LYS A 193 1.201 12.347 -0.590 1.00 0.00 H new ATOM 0 HD2 LYS A 193 1.413 12.036 -3.614 1.00 0.00 H new ATOM 0 HD3 LYS A 193 1.656 13.531 -2.732 1.00 0.00 H new ATOM 0 HE2 LYS A 193 3.824 12.979 -2.487 1.00 0.00 H new ATOM 0 HE3 LYS A 193 3.332 11.662 -1.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 4.438 10.503 -3.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 2.905 10.496 -3.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 4.084 11.605 -4.270 1.00 0.00 H new ATOM 1397 N VAL A 194 0.839 8.637 -3.920 1.00 0.00 N ATOM 1398 CA VAL A 194 1.309 7.502 -4.706 1.00 0.00 C ATOM 1399 C VAL A 194 2.681 7.038 -4.231 1.00 0.00 C ATOM 1400 O VAL A 194 3.652 7.793 -4.272 1.00 0.00 O ATOM 1401 CB VAL A 194 1.388 7.849 -6.205 1.00 0.00 C ATOM 1402 CG1 VAL A 194 1.650 6.599 -7.031 1.00 0.00 C ATOM 1403 CG2 VAL A 194 0.112 8.542 -6.661 1.00 0.00 C ATOM 0 H VAL A 194 1.127 9.547 -4.279 1.00 0.00 H new ATOM 0 HA VAL A 194 0.586 6.699 -4.565 1.00 0.00 H new ATOM 0 HB VAL A 194 2.221 8.536 -6.356 1.00 0.00 H new ATOM 0 HG11 VAL A 194 1.702 6.865 -8.087 1.00 0.00 H new ATOM 0 HG12 VAL A 194 2.594 6.150 -6.723 1.00 0.00 H new ATOM 0 HG13 VAL A 194 0.841 5.885 -6.876 1.00 0.00 H new ATOM 0 HG21 VAL A 194 0.186 8.779 -7.722 1.00 0.00 H new ATOM 0 HG22 VAL A 194 -0.740 7.882 -6.495 1.00 0.00 H new ATOM 0 HG23 VAL A 194 -0.026 9.462 -6.092 1.00 0.00 H new ATOM 1413 N ASP A 195 2.752 5.791 -3.778 1.00 0.00 N ATOM 1414 CA ASP A 195 4.004 5.223 -3.292 1.00 0.00 C ATOM 1415 C ASP A 195 4.588 4.240 -4.303 1.00 0.00 C ATOM 1416 O ASP A 195 3.950 3.250 -4.662 1.00 0.00 O ATOM 1417 CB ASP A 195 3.780 4.524 -1.948 1.00 0.00 C ATOM 1418 CG ASP A 195 4.695 5.053 -0.862 1.00 0.00 C ATOM 1419 OD1 ASP A 195 4.840 6.289 -0.758 1.00 0.00 O ATOM 1420 OD2 ASP A 195 5.266 4.232 -0.114 1.00 0.00 O ATOM 0 H ASP A 195 1.957 5.154 -3.737 1.00 0.00 H new ATOM 0 HA ASP A 195 4.716 6.037 -3.157 1.00 0.00 H new ATOM 0 HB2 ASP A 195 2.742 4.656 -1.641 1.00 0.00 H new ATOM 0 HB3 ASP A 195 3.943 3.453 -2.067 1.00 0.00 H new