USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 576 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 91 THR OG1 : rot 180:sc= -1.68! USER MOD Set 1.2: A 132 GLN : amide:sc= -10.6! K(o=-12!,f=-0.6) USER MOD Single : A 88 ASN : amide:sc= -4.67! C(o=-4.7!,f=-4.1!) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.289 X(o=-0.29,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc=-0.00123 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0467) USER MOD Single : A 127 SER OG : rot 39:sc= 1.17 USER MOD Single : A 130 TYR OH : rot 94:sc= 0.197 USER MOD Single : A 133 TYR OH : rot -26:sc= 0.215 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.36 X(o=-0.36,f=-0.0048) USER MOD Single : A 143 CYS SG : rot -173:sc= -4.09! USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -107:sc= -3.08 (180deg=-8.25!) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -8.539 13.425 -4.148 1.00 0.00 N ATOM 175 CA ASN A 88 -7.877 13.603 -5.435 1.00 0.00 C ATOM 176 C ASN A 88 -6.648 12.706 -5.544 1.00 0.00 C ATOM 177 O ASN A 88 -5.902 12.514 -4.583 1.00 0.00 O ATOM 178 CB ASN A 88 -7.472 15.066 -5.626 1.00 0.00 C ATOM 179 CG ASN A 88 -6.505 15.253 -6.780 1.00 0.00 C ATOM 180 OD1 ASN A 88 -6.915 15.496 -7.915 1.00 0.00 O ATOM 181 ND2 ASN A 88 -5.214 15.139 -6.493 1.00 0.00 N ATOM 0 HA ASN A 88 -8.581 13.322 -6.219 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.364 15.667 -5.802 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.014 15.436 -4.709 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.516 15.254 -7.228 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.920 14.937 -5.537 1.00 0.00 H new ATOM 188 N PRO A 89 -6.430 12.142 -6.741 1.00 0.00 N ATOM 189 CA PRO A 89 -5.292 11.257 -7.004 1.00 0.00 C ATOM 190 C PRO A 89 -3.964 12.005 -7.005 1.00 0.00 C ATOM 191 O PRO A 89 -3.917 13.209 -7.259 1.00 0.00 O ATOM 192 CB PRO A 89 -5.592 10.698 -8.398 1.00 0.00 C ATOM 193 CG PRO A 89 -6.459 11.726 -9.039 1.00 0.00 C ATOM 194 CD PRO A 89 -7.278 12.327 -7.931 1.00 0.00 C ATOM 0 HA PRO A 89 -5.186 10.491 -6.236 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.676 10.542 -8.968 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -6.098 9.735 -8.338 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -5.859 12.487 -9.537 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -7.099 11.278 -9.799 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.490 13.381 -8.114 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.238 11.823 -7.822 1.00 0.00 H new ATOM 202 N THR A 90 -2.883 11.284 -6.721 1.00 0.00 N ATOM 203 CA THR A 90 -1.554 11.880 -6.688 1.00 0.00 C ATOM 204 C THR A 90 -0.472 10.808 -6.625 1.00 0.00 C ATOM 205 O THR A 90 -0.725 9.680 -6.199 1.00 0.00 O ATOM 206 CB THR A 90 -1.392 12.828 -5.484 1.00 0.00 C ATOM 207 OG1 THR A 90 -0.251 13.671 -5.675 1.00 0.00 O ATOM 208 CG2 THR A 90 -1.236 12.040 -4.193 1.00 0.00 C ATOM 0 H THR A 90 -2.903 10.286 -6.511 1.00 0.00 H new ATOM 0 HA THR A 90 -1.442 12.452 -7.609 1.00 0.00 H new ATOM 0 HB THR A 90 -2.289 13.443 -5.410 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.156 14.272 -4.907 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.123 12.730 -3.357 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.119 11.421 -4.036 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.354 11.403 -4.260 1.00 0.00 H new ATOM 216 N THR A 91 0.735 11.166 -7.051 1.00 0.00 N ATOM 217 CA THR A 91 1.856 10.234 -7.044 1.00 0.00 C ATOM 218 C THR A 91 2.131 9.716 -5.637 1.00 0.00 C ATOM 219 O THR A 91 2.599 8.591 -5.459 1.00 0.00 O ATOM 220 CB THR A 91 3.135 10.889 -7.597 1.00 0.00 C ATOM 221 OG1 THR A 91 3.448 12.066 -6.843 1.00 0.00 O ATOM 222 CG2 THR A 91 2.967 11.250 -9.065 1.00 0.00 C ATOM 0 H THR A 91 0.962 12.095 -7.405 1.00 0.00 H new ATOM 0 HA THR A 91 1.577 9.400 -7.688 1.00 0.00 H new ATOM 0 HB THR A 91 3.952 10.173 -7.507 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.264 12.476 -7.200 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.883 11.711 -9.433 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.758 10.348 -9.640 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.139 11.950 -9.175 1.00 0.00 H new ATOM 230 N ARG A 92 1.837 10.543 -4.639 1.00 0.00 N ATOM 231 CA ARG A 92 2.053 10.168 -3.247 1.00 0.00 C ATOM 232 C ARG A 92 0.883 9.345 -2.717 1.00 0.00 C ATOM 233 O ARG A 92 -0.277 9.736 -2.852 1.00 0.00 O ATOM 234 CB ARG A 92 2.243 11.417 -2.384 1.00 0.00 C ATOM 235 CG ARG A 92 2.879 11.133 -1.032 1.00 0.00 C ATOM 236 CD ARG A 92 3.068 12.408 -0.226 1.00 0.00 C ATOM 237 NE ARG A 92 1.940 13.323 -0.377 1.00 0.00 N ATOM 238 CZ ARG A 92 1.845 14.218 -1.354 1.00 0.00 C ATOM 239 NH1 ARG A 92 2.805 14.317 -2.262 1.00 0.00 N ATOM 240 NH2 ARG A 92 0.787 15.016 -1.423 1.00 0.00 N ATOM 0 H ARG A 92 1.449 11.477 -4.769 1.00 0.00 H new ATOM 0 HA ARG A 92 2.955 9.559 -3.197 1.00 0.00 H new ATOM 0 HB2 ARG A 92 2.864 12.131 -2.925 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.274 11.891 -2.228 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.253 10.438 -0.473 1.00 0.00 H new ATOM 0 HG3 ARG A 92 3.844 10.647 -1.178 1.00 0.00 H new ATOM 0 HD2 ARG A 92 3.192 12.156 0.827 1.00 0.00 H new ATOM 0 HD3 ARG A 92 3.984 12.906 -0.545 1.00 0.00 H new ATOM 0 HE ARG A 92 1.183 13.272 0.305 1.00 0.00 H new ATOM 0 HH11 ARG A 92 3.619 13.705 -2.212 1.00 0.00 H new ATOM 0 HH12 ARG A 92 2.729 15.005 -3.011 1.00 0.00 H new ATOM 0 HH21 ARG A 92 0.046 14.942 -0.726 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.715 15.703 -2.173 1.00 0.00 H new ATOM 254 N LEU A 93 1.195 8.203 -2.114 1.00 0.00 N ATOM 255 CA LEU A 93 0.169 7.323 -1.565 1.00 0.00 C ATOM 256 C LEU A 93 0.450 7.008 -0.099 1.00 0.00 C ATOM 257 O LEU A 93 1.593 6.756 0.284 1.00 0.00 O ATOM 258 CB LEU A 93 0.097 6.025 -2.371 1.00 0.00 C ATOM 259 CG LEU A 93 -0.056 6.184 -3.885 1.00 0.00 C ATOM 260 CD1 LEU A 93 0.176 4.854 -4.586 1.00 0.00 C ATOM 261 CD2 LEU A 93 -1.431 6.737 -4.228 1.00 0.00 C ATOM 0 H LEU A 93 2.150 7.865 -1.993 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.789 7.838 -1.631 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.001 5.449 -2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.742 5.437 -2.001 1.00 0.00 H new ATOM 0 HG LEU A 93 0.695 6.893 -4.235 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.063 4.985 -5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.183 4.498 -4.367 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.552 4.124 -4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.521 6.843 -5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.199 6.054 -3.865 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.560 7.711 -3.756 1.00 0.00 H new ATOM 273 N TRP A 94 -0.598 7.024 0.716 1.00 0.00 N ATOM 274 CA TRP A 94 -0.464 6.738 2.140 1.00 0.00 C ATOM 275 C TRP A 94 -0.672 5.253 2.419 1.00 0.00 C ATOM 276 O TRP A 94 -1.666 4.665 1.992 1.00 0.00 O ATOM 277 CB TRP A 94 -1.468 7.566 2.944 1.00 0.00 C ATOM 278 CG TRP A 94 -1.461 7.249 4.409 1.00 0.00 C ATOM 279 CD1 TRP A 94 -0.616 7.759 5.353 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.338 6.350 5.095 1.00 0.00 C ATOM 281 NE1 TRP A 94 -0.916 7.231 6.586 1.00 0.00 N ATOM 282 CE2 TRP A 94 -1.969 6.364 6.455 1.00 0.00 C ATOM 283 CE3 TRP A 94 -3.401 5.536 4.695 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -2.624 5.595 7.412 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -4.051 4.773 5.646 1.00 0.00 C ATOM 286 CH2 TRP A 94 -3.661 4.807 6.992 1.00 0.00 C ATOM 0 H TRP A 94 -1.550 7.232 0.415 1.00 0.00 H new ATOM 0 HA TRP A 94 0.547 7.008 2.446 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.247 8.625 2.808 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.469 7.396 2.547 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.172 8.472 5.159 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.433 7.449 7.457 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.709 5.504 3.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -2.325 5.619 8.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -4.873 4.140 5.347 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.189 4.199 7.712 1.00 0.00 H new ATOM 297 N VAL A 95 0.271 4.653 3.138 1.00 0.00 N ATOM 298 CA VAL A 95 0.189 3.237 3.475 1.00 0.00 C ATOM 299 C VAL A 95 0.349 3.019 4.976 1.00 0.00 C ATOM 300 O VAL A 95 1.399 3.309 5.547 1.00 0.00 O ATOM 301 CB VAL A 95 1.263 2.420 2.732 1.00 0.00 C ATOM 302 CG1 VAL A 95 1.101 0.936 3.021 1.00 0.00 C ATOM 303 CG2 VAL A 95 1.197 2.691 1.236 1.00 0.00 C ATOM 0 H VAL A 95 1.100 5.125 3.498 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.798 2.894 3.164 1.00 0.00 H new ATOM 0 HB VAL A 95 2.244 2.730 3.092 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.869 0.375 2.487 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.202 0.761 4.092 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.116 0.606 2.691 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.962 2.106 0.726 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.214 2.410 0.858 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.367 3.751 1.050 1.00 0.00 H new ATOM 313 N GLY A 96 -0.701 2.505 5.609 1.00 0.00 N ATOM 314 CA GLY A 96 -0.657 2.257 7.038 1.00 0.00 C ATOM 315 C GLY A 96 -0.897 0.800 7.381 1.00 0.00 C ATOM 316 O GLY A 96 -0.813 -0.071 6.516 1.00 0.00 O ATOM 0 H GLY A 96 -1.581 2.256 5.158 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.314 2.564 7.427 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.408 2.872 7.534 1.00 0.00 H new ATOM 320 N GLY A 97 -1.197 0.533 8.649 1.00 0.00 N ATOM 321 CA GLY A 97 -1.444 -0.830 9.082 1.00 0.00 C ATOM 322 C GLY A 97 -0.190 -1.680 9.062 1.00 0.00 C ATOM 323 O GLY A 97 -0.240 -2.867 8.737 1.00 0.00 O ATOM 0 H GLY A 97 -1.273 1.236 9.384 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.855 -0.818 10.091 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.196 -1.283 8.436 1.00 0.00 H new ATOM 327 N LEU A 98 0.940 -1.074 9.410 1.00 0.00 N ATOM 328 CA LEU A 98 2.214 -1.783 9.430 1.00 0.00 C ATOM 329 C LEU A 98 2.554 -2.253 10.841 1.00 0.00 C ATOM 330 O LEU A 98 2.149 -1.637 11.826 1.00 0.00 O ATOM 331 CB LEU A 98 3.330 -0.882 8.898 1.00 0.00 C ATOM 332 CG LEU A 98 3.196 -0.437 7.441 1.00 0.00 C ATOM 333 CD1 LEU A 98 4.302 0.543 7.078 1.00 0.00 C ATOM 334 CD2 LEU A 98 3.222 -1.641 6.511 1.00 0.00 C ATOM 0 H LEU A 98 1.000 -0.093 9.682 1.00 0.00 H new ATOM 0 HA LEU A 98 2.124 -2.659 8.787 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.382 0.008 9.525 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.279 -1.407 9.011 1.00 0.00 H new ATOM 0 HG LEU A 98 2.237 0.068 7.322 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.190 0.849 6.038 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.237 1.420 7.723 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.272 0.064 7.213 1.00 0.00 H new ATOM 0 HD21 LEU A 98 3.125 -1.305 5.478 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.165 -2.174 6.633 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.394 -2.307 6.755 1.00 0.00 H new ATOM 346 N GLY A 99 3.303 -3.348 10.930 1.00 0.00 N ATOM 347 CA GLY A 99 3.686 -3.881 12.225 1.00 0.00 C ATOM 348 C GLY A 99 5.180 -4.111 12.337 1.00 0.00 C ATOM 349 O GLY A 99 5.938 -3.880 11.395 1.00 0.00 O ATOM 0 H GLY A 99 3.651 -3.875 10.129 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.368 -3.192 13.007 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.163 -4.822 12.397 1.00 0.00 H new ATOM 353 N PRO A 100 5.624 -4.575 13.515 1.00 0.00 N ATOM 354 CA PRO A 100 7.041 -4.845 13.776 1.00 0.00 C ATOM 355 C PRO A 100 7.555 -6.051 12.996 1.00 0.00 C ATOM 356 O PRO A 100 8.744 -6.363 13.031 1.00 0.00 O ATOM 357 CB PRO A 100 7.078 -5.126 15.280 1.00 0.00 C ATOM 358 CG PRO A 100 5.706 -5.606 15.609 1.00 0.00 C ATOM 359 CD PRO A 100 4.777 -4.872 14.682 1.00 0.00 C ATOM 0 HA PRO A 100 7.677 -4.015 13.468 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.829 -5.877 15.524 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.329 -4.228 15.845 1.00 0.00 H new ATOM 0 HG2 PRO A 100 5.626 -6.684 15.469 1.00 0.00 H new ATOM 0 HG3 PRO A 100 5.460 -5.401 16.651 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.917 -5.483 14.409 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.389 -3.962 15.139 1.00 0.00 H new ATOM 367 N ASN A 101 6.650 -6.724 12.293 1.00 0.00 N ATOM 368 CA ASN A 101 7.012 -7.896 11.504 1.00 0.00 C ATOM 369 C ASN A 101 7.234 -7.520 10.042 1.00 0.00 C ATOM 370 O ASN A 101 8.236 -7.902 9.437 1.00 0.00 O ATOM 371 CB ASN A 101 5.921 -8.963 11.608 1.00 0.00 C ATOM 372 CG ASN A 101 5.905 -9.892 10.409 1.00 0.00 C ATOM 373 OD1 ASN A 101 6.600 -10.908 10.388 1.00 0.00 O ATOM 374 ND2 ASN A 101 5.109 -9.547 9.404 1.00 0.00 N ATOM 0 H ASN A 101 5.661 -6.478 12.254 1.00 0.00 H new ATOM 0 HA ASN A 101 7.943 -8.298 11.903 1.00 0.00 H new ATOM 0 HB2 ASN A 101 6.074 -9.548 12.515 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.949 -8.478 11.701 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.056 -10.133 8.571 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.551 -8.696 9.465 1.00 0.00 H new ATOM 381 N THR A 102 6.293 -6.769 9.480 1.00 0.00 N ATOM 382 CA THR A 102 6.385 -6.341 8.090 1.00 0.00 C ATOM 383 C THR A 102 7.736 -5.697 7.801 1.00 0.00 C ATOM 384 O THR A 102 8.266 -4.949 8.622 1.00 0.00 O ATOM 385 CB THR A 102 5.267 -5.344 7.733 1.00 0.00 C ATOM 386 OG1 THR A 102 3.995 -5.874 8.123 1.00 0.00 O ATOM 387 CG2 THR A 102 5.262 -5.046 6.242 1.00 0.00 C ATOM 0 H THR A 102 5.457 -6.444 9.967 1.00 0.00 H new ATOM 0 HA THR A 102 6.273 -7.235 7.477 1.00 0.00 H new ATOM 0 HB THR A 102 5.454 -4.415 8.272 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.290 -5.233 7.894 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.464 -4.340 6.015 1.00 0.00 H new ATOM 0 HG22 THR A 102 6.221 -4.615 5.954 1.00 0.00 H new ATOM 0 HG23 THR A 102 5.098 -5.970 5.687 1.00 0.00 H new ATOM 395 N SER A 103 8.289 -5.992 6.629 1.00 0.00 N ATOM 396 CA SER A 103 9.580 -5.444 6.232 1.00 0.00 C ATOM 397 C SER A 103 9.432 -4.521 5.027 1.00 0.00 C ATOM 398 O SER A 103 8.607 -4.761 4.144 1.00 0.00 O ATOM 399 CB SER A 103 10.560 -6.573 5.907 1.00 0.00 C ATOM 400 OG SER A 103 11.855 -6.064 5.641 1.00 0.00 O ATOM 0 H SER A 103 7.862 -6.608 5.937 1.00 0.00 H new ATOM 0 HA SER A 103 9.971 -4.862 7.067 1.00 0.00 H new ATOM 0 HB2 SER A 103 10.605 -7.271 6.743 1.00 0.00 H new ATOM 0 HB3 SER A 103 10.201 -7.133 5.043 1.00 0.00 H new ATOM 0 HG SER A 103 12.463 -6.806 5.438 1.00 0.00 H new ATOM 406 N LEU A 104 10.236 -3.464 4.997 1.00 0.00 N ATOM 407 CA LEU A 104 10.196 -2.503 3.900 1.00 0.00 C ATOM 408 C LEU A 104 10.397 -3.200 2.558 1.00 0.00 C ATOM 409 O LEU A 104 9.576 -3.071 1.651 1.00 0.00 O ATOM 410 CB LEU A 104 11.268 -1.430 4.096 1.00 0.00 C ATOM 411 CG LEU A 104 11.087 -0.144 3.289 1.00 0.00 C ATOM 412 CD1 LEU A 104 10.766 -0.466 1.838 1.00 0.00 C ATOM 413 CD2 LEU A 104 9.994 0.720 3.900 1.00 0.00 C ATOM 0 H LEU A 104 10.924 -3.251 5.720 1.00 0.00 H new ATOM 0 HA LEU A 104 9.214 -2.030 3.900 1.00 0.00 H new ATOM 0 HB2 LEU A 104 11.303 -1.169 5.154 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.236 -1.861 3.842 1.00 0.00 H new ATOM 0 HG LEU A 104 12.022 0.415 3.318 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.640 0.461 1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 104 11.582 -1.044 1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 104 9.845 -1.047 1.789 1.00 0.00 H new ATOM 0 HD21 LEU A 104 9.879 1.631 3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.054 0.169 3.903 1.00 0.00 H new ATOM 0 HD23 LEU A 104 10.265 0.980 4.923 1.00 0.00 H new ATOM 425 N ALA A 105 11.495 -3.940 2.440 1.00 0.00 N ATOM 426 CA ALA A 105 11.802 -4.661 1.211 1.00 0.00 C ATOM 427 C ALA A 105 10.557 -5.336 0.645 1.00 0.00 C ATOM 428 O ALA A 105 10.307 -5.290 -0.559 1.00 0.00 O ATOM 429 CB ALA A 105 12.895 -5.689 1.461 1.00 0.00 C ATOM 0 H ALA A 105 12.187 -4.056 3.181 1.00 0.00 H new ATOM 0 HA ALA A 105 12.159 -3.940 0.475 1.00 0.00 H new ATOM 0 HB1 ALA A 105 13.114 -6.220 0.535 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.795 -5.185 1.812 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.560 -6.400 2.216 1.00 0.00 H new ATOM 435 N ALA A 106 9.780 -5.964 1.522 1.00 0.00 N ATOM 436 CA ALA A 106 8.561 -6.648 1.109 1.00 0.00 C ATOM 437 C ALA A 106 7.664 -5.725 0.290 1.00 0.00 C ATOM 438 O ALA A 106 7.466 -5.938 -0.907 1.00 0.00 O ATOM 439 CB ALA A 106 7.811 -7.171 2.326 1.00 0.00 C ATOM 0 H ALA A 106 9.973 -6.013 2.522 1.00 0.00 H new ATOM 0 HA ALA A 106 8.843 -7.491 0.479 1.00 0.00 H new ATOM 0 HB1 ALA A 106 6.903 -7.680 2.003 1.00 0.00 H new ATOM 0 HB2 ALA A 106 8.445 -7.871 2.871 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.548 -6.337 2.977 1.00 0.00 H new ATOM 445 N LEU A 107 7.124 -4.701 0.941 1.00 0.00 N ATOM 446 CA LEU A 107 6.247 -3.746 0.273 1.00 0.00 C ATOM 447 C LEU A 107 6.913 -3.177 -0.976 1.00 0.00 C ATOM 448 O LEU A 107 6.409 -3.336 -2.087 1.00 0.00 O ATOM 449 CB LEU A 107 5.875 -2.610 1.228 1.00 0.00 C ATOM 450 CG LEU A 107 5.146 -3.021 2.508 1.00 0.00 C ATOM 451 CD1 LEU A 107 5.068 -1.852 3.477 1.00 0.00 C ATOM 452 CD2 LEU A 107 3.754 -3.543 2.184 1.00 0.00 C ATOM 0 H LEU A 107 7.278 -4.511 1.931 1.00 0.00 H new ATOM 0 HA LEU A 107 5.341 -4.271 -0.027 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.787 -2.083 1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.248 -1.899 0.689 1.00 0.00 H new ATOM 0 HG LEU A 107 5.711 -3.822 2.984 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.546 -2.164 4.382 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.075 -1.524 3.734 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.527 -1.029 3.011 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.250 -3.831 3.106 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.180 -2.763 1.685 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.834 -4.410 1.528 1.00 0.00 H new ATOM 464 N ALA A 108 8.050 -2.516 -0.785 1.00 0.00 N ATOM 465 CA ALA A 108 8.787 -1.927 -1.897 1.00 0.00 C ATOM 466 C ALA A 108 8.789 -2.856 -3.107 1.00 0.00 C ATOM 467 O ALA A 108 8.684 -2.405 -4.247 1.00 0.00 O ATOM 468 CB ALA A 108 10.213 -1.606 -1.473 1.00 0.00 C ATOM 0 H ALA A 108 8.481 -2.375 0.129 1.00 0.00 H new ATOM 0 HA ALA A 108 8.287 -1.001 -2.183 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.752 -1.167 -2.312 1.00 0.00 H new ATOM 0 HB2 ALA A 108 10.196 -0.899 -0.643 1.00 0.00 H new ATOM 0 HB3 ALA A 108 10.714 -2.522 -1.159 1.00 0.00 H new ATOM 474 N ARG A 109 8.911 -4.154 -2.850 1.00 0.00 N ATOM 475 CA ARG A 109 8.929 -5.145 -3.919 1.00 0.00 C ATOM 476 C ARG A 109 7.549 -5.284 -4.556 1.00 0.00 C ATOM 477 O ARG A 109 7.429 -5.448 -5.769 1.00 0.00 O ATOM 478 CB ARG A 109 9.391 -6.500 -3.379 1.00 0.00 C ATOM 479 CG ARG A 109 9.708 -7.513 -4.467 1.00 0.00 C ATOM 480 CD ARG A 109 11.122 -7.338 -4.998 1.00 0.00 C ATOM 481 NE ARG A 109 11.503 -8.415 -5.907 1.00 0.00 N ATOM 482 CZ ARG A 109 12.717 -8.539 -6.432 1.00 0.00 C ATOM 483 NH1 ARG A 109 13.662 -7.656 -6.140 1.00 0.00 N ATOM 484 NH2 ARG A 109 12.987 -9.547 -7.252 1.00 0.00 N ATOM 0 H ARG A 109 8.999 -4.544 -1.911 1.00 0.00 H new ATOM 0 HA ARG A 109 9.630 -4.806 -4.682 1.00 0.00 H new ATOM 0 HB2 ARG A 109 10.277 -6.353 -2.762 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.615 -6.907 -2.730 1.00 0.00 H new ATOM 0 HG2 ARG A 109 9.589 -8.522 -4.072 1.00 0.00 H new ATOM 0 HG3 ARG A 109 8.995 -7.405 -5.285 1.00 0.00 H new ATOM 0 HD2 ARG A 109 11.199 -6.382 -5.516 1.00 0.00 H new ATOM 0 HD3 ARG A 109 11.821 -7.305 -4.163 1.00 0.00 H new ATOM 0 HE ARG A 109 10.798 -9.110 -6.152 1.00 0.00 H new ATOM 0 HH11 ARG A 109 13.458 -6.879 -5.511 1.00 0.00 H new ATOM 0 HH12 ARG A 109 14.593 -7.753 -6.544 1.00 0.00 H new ATOM 0 HH21 ARG A 109 12.262 -10.227 -7.480 1.00 0.00 H new ATOM 0 HH22 ARG A 109 13.919 -9.641 -7.655 1.00 0.00 H new ATOM 498 N GLU A 110 6.511 -5.216 -3.728 1.00 0.00 N ATOM 499 CA GLU A 110 5.141 -5.335 -4.211 1.00 0.00 C ATOM 500 C GLU A 110 4.710 -4.068 -4.944 1.00 0.00 C ATOM 501 O GLU A 110 4.405 -4.100 -6.136 1.00 0.00 O ATOM 502 CB GLU A 110 4.188 -5.611 -3.046 1.00 0.00 C ATOM 503 CG GLU A 110 4.336 -7.004 -2.456 1.00 0.00 C ATOM 504 CD GLU A 110 3.725 -8.078 -3.336 1.00 0.00 C ATOM 505 OE1 GLU A 110 3.489 -7.803 -4.531 1.00 0.00 O ATOM 506 OE2 GLU A 110 3.484 -9.193 -2.829 1.00 0.00 O ATOM 0 H GLU A 110 6.593 -5.079 -2.721 1.00 0.00 H new ATOM 0 HA GLU A 110 5.101 -6.170 -4.910 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.362 -4.873 -2.263 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.162 -5.477 -3.388 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.394 -7.221 -2.306 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.863 -7.031 -1.474 1.00 0.00 H new ATOM 513 N PHE A 111 4.688 -2.952 -4.222 1.00 0.00 N ATOM 514 CA PHE A 111 4.294 -1.674 -4.803 1.00 0.00 C ATOM 515 C PHE A 111 5.095 -1.381 -6.068 1.00 0.00 C ATOM 516 O PHE A 111 4.573 -0.814 -7.028 1.00 0.00 O ATOM 517 CB PHE A 111 4.491 -0.546 -3.788 1.00 0.00 C ATOM 518 CG PHE A 111 3.313 -0.347 -2.877 1.00 0.00 C ATOM 519 CD1 PHE A 111 3.183 -1.095 -1.718 1.00 0.00 C ATOM 520 CD2 PHE A 111 2.338 0.590 -3.179 1.00 0.00 C ATOM 521 CE1 PHE A 111 2.100 -0.913 -0.878 1.00 0.00 C ATOM 522 CE2 PHE A 111 1.253 0.776 -2.343 1.00 0.00 C ATOM 523 CZ PHE A 111 1.134 0.024 -1.191 1.00 0.00 C ATOM 0 H PHE A 111 4.938 -2.907 -3.234 1.00 0.00 H new ATOM 0 HA PHE A 111 3.239 -1.734 -5.069 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.374 -0.760 -3.186 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.688 0.383 -4.323 1.00 0.00 H new ATOM 0 HD1 PHE A 111 3.936 -1.828 -1.468 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.427 1.182 -4.078 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.009 -1.503 0.022 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.499 1.509 -2.591 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.288 0.168 -0.536 1.00 0.00 H new ATOM 533 N ASP A 112 6.365 -1.771 -6.060 1.00 0.00 N ATOM 534 CA ASP A 112 7.239 -1.551 -7.206 1.00 0.00 C ATOM 535 C ASP A 112 6.674 -2.218 -8.457 1.00 0.00 C ATOM 536 O ASP A 112 6.694 -1.639 -9.543 1.00 0.00 O ATOM 537 CB ASP A 112 8.641 -2.089 -6.916 1.00 0.00 C ATOM 538 CG ASP A 112 9.497 -2.177 -8.164 1.00 0.00 C ATOM 539 OD1 ASP A 112 9.148 -2.964 -9.068 1.00 0.00 O ATOM 540 OD2 ASP A 112 10.517 -1.459 -8.236 1.00 0.00 O ATOM 0 H ASP A 112 6.812 -2.241 -5.273 1.00 0.00 H new ATOM 0 HA ASP A 112 7.300 -0.477 -7.384 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.131 -1.443 -6.188 1.00 0.00 H new ATOM 0 HB3 ASP A 112 8.561 -3.077 -6.463 1.00 0.00 H new ATOM 545 N ARG A 113 6.171 -3.437 -8.295 1.00 0.00 N ATOM 546 CA ARG A 113 5.602 -4.183 -9.411 1.00 0.00 C ATOM 547 C ARG A 113 4.826 -3.258 -10.344 1.00 0.00 C ATOM 548 O ARG A 113 4.819 -3.449 -11.560 1.00 0.00 O ATOM 549 CB ARG A 113 4.684 -5.293 -8.895 1.00 0.00 C ATOM 550 CG ARG A 113 5.403 -6.336 -8.055 1.00 0.00 C ATOM 551 CD ARG A 113 4.477 -7.482 -7.679 1.00 0.00 C ATOM 552 NE ARG A 113 3.938 -8.159 -8.856 1.00 0.00 N ATOM 553 CZ ARG A 113 2.857 -7.748 -9.510 1.00 0.00 C ATOM 554 NH1 ARG A 113 2.204 -6.668 -9.104 1.00 0.00 N ATOM 555 NH2 ARG A 113 2.429 -8.418 -10.572 1.00 0.00 N ATOM 0 H ARG A 113 6.146 -3.929 -7.402 1.00 0.00 H new ATOM 0 HA ARG A 113 6.422 -4.631 -9.972 1.00 0.00 H new ATOM 0 HB2 ARG A 113 3.887 -4.847 -8.301 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.211 -5.786 -9.744 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.258 -6.724 -8.608 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.793 -5.870 -7.150 1.00 0.00 H new ATOM 0 HD2 ARG A 113 5.020 -8.200 -7.065 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.656 -7.100 -7.072 1.00 0.00 H new ATOM 0 HE ARG A 113 4.418 -8.993 -9.194 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.531 -6.151 -8.288 1.00 0.00 H new ATOM 0 HH12 ARG A 113 1.374 -6.354 -9.608 1.00 0.00 H new ATOM 0 HH21 ARG A 113 2.930 -9.249 -10.887 1.00 0.00 H new ATOM 0 HH22 ARG A 113 1.599 -8.102 -11.074 1.00 0.00 H new ATOM 569 N PHE A 114 4.172 -2.256 -9.766 1.00 0.00 N ATOM 570 CA PHE A 114 3.391 -1.302 -10.545 1.00 0.00 C ATOM 571 C PHE A 114 4.300 -0.280 -11.222 1.00 0.00 C ATOM 572 O PHE A 114 4.351 -0.196 -12.448 1.00 0.00 O ATOM 573 CB PHE A 114 2.379 -0.586 -9.648 1.00 0.00 C ATOM 574 CG PHE A 114 1.372 -1.510 -9.024 1.00 0.00 C ATOM 575 CD1 PHE A 114 0.228 -1.876 -9.715 1.00 0.00 C ATOM 576 CD2 PHE A 114 1.570 -2.012 -7.748 1.00 0.00 C ATOM 577 CE1 PHE A 114 -0.700 -2.725 -9.143 1.00 0.00 C ATOM 578 CE2 PHE A 114 0.645 -2.862 -7.171 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.491 -3.220 -7.870 1.00 0.00 C ATOM 0 H PHE A 114 4.167 -2.083 -8.761 1.00 0.00 H new ATOM 0 HA PHE A 114 2.855 -1.854 -11.317 1.00 0.00 H new ATOM 0 HB2 PHE A 114 2.914 -0.059 -8.859 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.854 0.167 -10.235 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.060 -1.494 -10.711 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.457 -1.736 -7.198 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.589 -3.002 -9.691 1.00 0.00 H new ATOM 0 HE2 PHE A 114 0.810 -3.246 -6.175 1.00 0.00 H new ATOM 0 HZ PHE A 114 -1.214 -3.885 -7.423 1.00 0.00 H new ATOM 589 N GLY A 115 5.015 0.496 -10.413 1.00 0.00 N ATOM 590 CA GLY A 115 5.911 1.502 -10.952 1.00 0.00 C ATOM 591 C GLY A 115 7.204 1.607 -10.167 1.00 0.00 C ATOM 592 O GLY A 115 7.547 0.707 -9.400 1.00 0.00 O ATOM 0 H GLY A 115 4.990 0.446 -9.395 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.139 1.262 -11.991 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.409 2.470 -10.951 1.00 0.00 H new ATOM 596 N SER A 116 7.924 2.707 -10.361 1.00 0.00 N ATOM 597 CA SER A 116 9.190 2.923 -9.669 1.00 0.00 C ATOM 598 C SER A 116 9.000 3.833 -8.460 1.00 0.00 C ATOM 599 O SER A 116 8.420 4.914 -8.569 1.00 0.00 O ATOM 600 CB SER A 116 10.219 3.532 -10.624 1.00 0.00 C ATOM 601 OG SER A 116 11.365 3.980 -9.920 1.00 0.00 O ATOM 0 H SER A 116 7.653 3.462 -10.991 1.00 0.00 H new ATOM 0 HA SER A 116 9.555 1.957 -9.320 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.512 2.792 -11.368 1.00 0.00 H new ATOM 0 HB3 SER A 116 9.770 4.366 -11.163 1.00 0.00 H new ATOM 0 HG SER A 116 12.008 4.363 -10.552 1.00 0.00 H new ATOM 607 N ILE A 117 9.492 3.388 -7.309 1.00 0.00 N ATOM 608 CA ILE A 117 9.378 4.162 -6.079 1.00 0.00 C ATOM 609 C ILE A 117 10.575 5.089 -5.900 1.00 0.00 C ATOM 610 O ILE A 117 11.721 4.683 -6.092 1.00 0.00 O ATOM 611 CB ILE A 117 9.262 3.247 -4.846 1.00 0.00 C ATOM 612 CG1 ILE A 117 8.059 2.313 -4.989 1.00 0.00 C ATOM 613 CG2 ILE A 117 9.147 4.079 -3.578 1.00 0.00 C ATOM 614 CD1 ILE A 117 7.969 1.272 -3.894 1.00 0.00 C ATOM 0 H ILE A 117 9.974 2.495 -7.202 1.00 0.00 H new ATOM 0 HA ILE A 117 8.470 4.758 -6.165 1.00 0.00 H new ATOM 0 HB ILE A 117 10.164 2.639 -4.777 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.146 2.908 -4.990 1.00 0.00 H new ATOM 0 HG13 ILE A 117 8.113 1.810 -5.954 1.00 0.00 H new ATOM 0 HG21 ILE A 117 9.066 3.418 -2.715 1.00 0.00 H new ATOM 0 HG22 ILE A 117 10.032 4.706 -3.473 1.00 0.00 H new ATOM 0 HG23 ILE A 117 8.260 4.710 -3.636 1.00 0.00 H new ATOM 0 HD11 ILE A 117 7.093 0.645 -4.059 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.866 0.653 -3.906 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.884 1.768 -2.927 1.00 0.00 H new ATOM 626 N ARG A 118 10.301 6.336 -5.529 1.00 0.00 N ATOM 627 CA ARG A 118 11.356 7.320 -5.322 1.00 0.00 C ATOM 628 C ARG A 118 11.953 7.193 -3.924 1.00 0.00 C ATOM 629 O ARG A 118 13.147 6.938 -3.766 1.00 0.00 O ATOM 630 CB ARG A 118 10.811 8.734 -5.529 1.00 0.00 C ATOM 631 CG ARG A 118 11.884 9.811 -5.506 1.00 0.00 C ATOM 632 CD ARG A 118 11.506 10.993 -6.385 1.00 0.00 C ATOM 633 NE ARG A 118 12.577 11.983 -6.460 1.00 0.00 N ATOM 634 CZ ARG A 118 12.678 12.884 -7.431 1.00 0.00 C ATOM 635 NH1 ARG A 118 11.777 12.921 -8.402 1.00 0.00 N ATOM 636 NH2 ARG A 118 13.682 13.752 -7.430 1.00 0.00 N ATOM 0 H ARG A 118 9.358 6.688 -5.366 1.00 0.00 H new ATOM 0 HA ARG A 118 12.143 7.130 -6.052 1.00 0.00 H new ATOM 0 HB2 ARG A 118 10.287 8.776 -6.484 1.00 0.00 H new ATOM 0 HB3 ARG A 118 10.077 8.948 -4.753 1.00 0.00 H new ATOM 0 HG2 ARG A 118 12.037 10.152 -4.482 1.00 0.00 H new ATOM 0 HG3 ARG A 118 12.830 9.391 -5.847 1.00 0.00 H new ATOM 0 HD2 ARG A 118 11.269 10.638 -7.388 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.604 11.463 -5.992 1.00 0.00 H new ATOM 0 HE ARG A 118 13.286 11.983 -5.727 1.00 0.00 H new ATOM 0 HH11 ARG A 118 11.003 12.257 -8.405 1.00 0.00 H new ATOM 0 HH12 ARG A 118 11.857 13.614 -9.146 1.00 0.00 H new ATOM 0 HH21 ARG A 118 14.377 13.728 -6.683 1.00 0.00 H new ATOM 0 HH22 ARG A 118 13.759 14.444 -8.176 1.00 0.00 H new ATOM 650 N THR A 119 11.113 7.374 -2.909 1.00 0.00 N ATOM 651 CA THR A 119 11.556 7.281 -1.524 1.00 0.00 C ATOM 652 C THR A 119 10.403 6.902 -0.601 1.00 0.00 C ATOM 653 O THR A 119 9.236 6.998 -0.980 1.00 0.00 O ATOM 654 CB THR A 119 12.170 8.609 -1.040 1.00 0.00 C ATOM 655 OG1 THR A 119 12.909 8.396 0.168 1.00 0.00 O ATOM 656 CG2 THR A 119 11.087 9.650 -0.802 1.00 0.00 C ATOM 0 H THR A 119 10.122 7.586 -3.021 1.00 0.00 H new ATOM 0 HA THR A 119 12.318 6.502 -1.488 1.00 0.00 H new ATOM 0 HB THR A 119 12.842 8.977 -1.815 1.00 0.00 H new ATOM 0 HG1 THR A 119 13.297 9.244 0.468 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.544 10.579 -0.461 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.546 9.831 -1.731 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.394 9.287 -0.043 1.00 0.00 H new ATOM 664 N ILE A 120 10.738 6.471 0.610 1.00 0.00 N ATOM 665 CA ILE A 120 9.730 6.079 1.587 1.00 0.00 C ATOM 666 C ILE A 120 10.093 6.576 2.982 1.00 0.00 C ATOM 667 O ILE A 120 11.261 6.573 3.368 1.00 0.00 O ATOM 668 CB ILE A 120 9.552 4.549 1.629 1.00 0.00 C ATOM 669 CG1 ILE A 120 9.283 4.006 0.224 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.420 4.174 2.574 1.00 0.00 C ATOM 671 CD1 ILE A 120 9.706 2.565 0.043 1.00 0.00 C ATOM 0 H ILE A 120 11.700 6.384 0.938 1.00 0.00 H new ATOM 0 HA ILE A 120 8.792 6.538 1.274 1.00 0.00 H new ATOM 0 HB ILE A 120 10.473 4.100 2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 120 8.219 4.094 0.007 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.809 4.625 -0.503 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.306 3.090 2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 120 8.650 4.533 3.577 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.492 4.630 2.229 1.00 0.00 H new ATOM 0 HD11 ILE A 120 9.486 2.246 -0.976 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.776 2.474 0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 120 9.161 1.935 0.746 1.00 0.00 H new ATOM 683 N ASP A 121 9.083 7.001 3.733 1.00 0.00 N ATOM 684 CA ASP A 121 9.295 7.499 5.088 1.00 0.00 C ATOM 685 C ASP A 121 9.304 6.352 6.093 1.00 0.00 C ATOM 686 O ASP A 121 8.570 5.375 5.942 1.00 0.00 O ATOM 687 CB ASP A 121 8.209 8.510 5.458 1.00 0.00 C ATOM 688 CG ASP A 121 8.554 9.300 6.705 1.00 0.00 C ATOM 689 OD1 ASP A 121 9.742 9.311 7.090 1.00 0.00 O ATOM 690 OD2 ASP A 121 7.636 9.907 7.296 1.00 0.00 O ATOM 0 H ASP A 121 8.110 7.011 3.427 1.00 0.00 H new ATOM 0 HA ASP A 121 10.266 7.993 5.120 1.00 0.00 H new ATOM 0 HB2 ASP A 121 8.058 9.198 4.626 1.00 0.00 H new ATOM 0 HB3 ASP A 121 7.266 7.986 5.613 1.00 0.00 H new ATOM 695 N HIS A 122 10.140 6.477 7.119 1.00 0.00 N ATOM 696 CA HIS A 122 10.245 5.450 8.150 1.00 0.00 C ATOM 697 C HIS A 122 9.730 5.970 9.489 1.00 0.00 C ATOM 698 O HIS A 122 10.271 6.927 10.044 1.00 0.00 O ATOM 699 CB HIS A 122 11.695 4.987 8.292 1.00 0.00 C ATOM 700 CG HIS A 122 12.123 4.023 7.229 1.00 0.00 C ATOM 701 ND1 HIS A 122 12.835 2.873 7.497 1.00 0.00 N ATOM 702 CD2 HIS A 122 11.934 4.042 5.888 1.00 0.00 C ATOM 703 CE1 HIS A 122 13.067 2.228 6.368 1.00 0.00 C ATOM 704 NE2 HIS A 122 12.530 2.916 5.377 1.00 0.00 N ATOM 0 H HIS A 122 10.754 7.279 7.259 1.00 0.00 H new ATOM 0 HA HIS A 122 9.629 4.603 7.849 1.00 0.00 H new ATOM 0 HB2 HIS A 122 12.350 5.858 8.266 1.00 0.00 H new ATOM 0 HB3 HIS A 122 11.825 4.520 9.268 1.00 0.00 H new ATOM 0 HD2 HIS A 122 11.412 4.802 5.325 1.00 0.00 H new ATOM 0 HE1 HIS A 122 13.605 1.296 6.272 1.00 0.00 H new ATOM 0 HE2 HIS A 122 12.554 2.653 4.392 1.00 0.00 H new ATOM 713 N VAL A 123 8.682 5.334 10.002 1.00 0.00 N ATOM 714 CA VAL A 123 8.095 5.732 11.276 1.00 0.00 C ATOM 715 C VAL A 123 7.523 4.529 12.017 1.00 0.00 C ATOM 716 O VAL A 123 6.679 3.804 11.490 1.00 0.00 O ATOM 717 CB VAL A 123 6.980 6.777 11.078 1.00 0.00 C ATOM 718 CG1 VAL A 123 6.664 7.476 12.391 1.00 0.00 C ATOM 719 CG2 VAL A 123 7.378 7.785 10.010 1.00 0.00 C ATOM 0 H VAL A 123 8.222 4.541 9.555 1.00 0.00 H new ATOM 0 HA VAL A 123 8.896 6.174 11.869 1.00 0.00 H new ATOM 0 HB VAL A 123 6.080 6.263 10.742 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.874 8.210 12.231 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.333 6.741 13.124 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.558 7.979 12.760 1.00 0.00 H new ATOM 0 HG21 VAL A 123 6.579 8.515 9.883 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.292 8.296 10.314 1.00 0.00 H new ATOM 0 HG23 VAL A 123 7.549 7.267 9.066 1.00 0.00 H new ATOM 729 N LYS A 124 7.988 4.322 13.244 1.00 0.00 N ATOM 730 CA LYS A 124 7.523 3.207 14.061 1.00 0.00 C ATOM 731 C LYS A 124 6.301 3.607 14.882 1.00 0.00 C ATOM 732 O LYS A 124 5.282 2.917 14.873 1.00 0.00 O ATOM 733 CB LYS A 124 8.640 2.728 14.991 1.00 0.00 C ATOM 734 CG LYS A 124 8.356 1.386 15.642 1.00 0.00 C ATOM 735 CD LYS A 124 9.058 1.257 16.983 1.00 0.00 C ATOM 736 CE LYS A 124 8.694 -0.046 17.680 1.00 0.00 C ATOM 737 NZ LYS A 124 7.295 -0.030 18.191 1.00 0.00 N ATOM 0 H LYS A 124 8.687 4.912 13.695 1.00 0.00 H new ATOM 0 HA LYS A 124 7.241 2.393 13.393 1.00 0.00 H new ATOM 0 HB2 LYS A 124 9.568 2.658 14.424 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.798 3.474 15.770 1.00 0.00 H new ATOM 0 HG2 LYS A 124 7.281 1.268 15.780 1.00 0.00 H new ATOM 0 HG3 LYS A 124 8.683 0.583 14.981 1.00 0.00 H new ATOM 0 HD2 LYS A 124 10.137 1.303 16.836 1.00 0.00 H new ATOM 0 HD3 LYS A 124 8.787 2.099 17.619 1.00 0.00 H new ATOM 0 HE2 LYS A 124 8.817 -0.876 16.985 1.00 0.00 H new ATOM 0 HE3 LYS A 124 9.381 -0.219 18.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 7.129 -0.875 18.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 7.145 0.823 18.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 6.633 -0.027 17.389 1.00 0.00 H new ATOM 751 N GLY A 125 6.409 4.728 15.589 1.00 0.00 N ATOM 752 CA GLY A 125 5.305 5.200 16.403 1.00 0.00 C ATOM 753 C GLY A 125 3.962 5.016 15.724 1.00 0.00 C ATOM 754 O GLY A 125 3.123 4.246 16.191 1.00 0.00 O ATOM 0 H GLY A 125 7.241 5.317 15.612 1.00 0.00 H new ATOM 0 HA2 GLY A 125 5.304 4.666 17.353 1.00 0.00 H new ATOM 0 HA3 GLY A 125 5.451 6.256 16.631 1.00 0.00 H new ATOM 758 N ASP A 126 3.758 5.724 14.619 1.00 0.00 N ATOM 759 CA ASP A 126 2.508 5.635 13.874 1.00 0.00 C ATOM 760 C ASP A 126 2.505 4.413 12.960 1.00 0.00 C ATOM 761 O ASP A 126 1.447 3.929 12.558 1.00 0.00 O ATOM 762 CB ASP A 126 2.289 6.905 13.049 1.00 0.00 C ATOM 763 CG ASP A 126 1.614 8.003 13.845 1.00 0.00 C ATOM 764 OD1 ASP A 126 2.190 8.438 14.864 1.00 0.00 O ATOM 765 OD2 ASP A 126 0.508 8.429 13.449 1.00 0.00 O ATOM 0 H ASP A 126 4.442 6.366 14.219 1.00 0.00 H new ATOM 0 HA ASP A 126 1.694 5.532 14.591 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.249 7.265 12.680 1.00 0.00 H new ATOM 0 HB3 ASP A 126 1.681 6.667 12.176 1.00 0.00 H new ATOM 770 N SER A 127 3.696 3.920 12.637 1.00 0.00 N ATOM 771 CA SER A 127 3.831 2.757 11.767 1.00 0.00 C ATOM 772 C SER A 127 3.254 3.044 10.384 1.00 0.00 C ATOM 773 O SER A 127 2.473 2.256 9.849 1.00 0.00 O ATOM 774 CB SER A 127 3.128 1.547 12.385 1.00 0.00 C ATOM 775 OG SER A 127 3.903 0.987 13.431 1.00 0.00 O ATOM 0 H SER A 127 4.581 4.307 12.964 1.00 0.00 H new ATOM 0 HA SER A 127 4.893 2.535 11.660 1.00 0.00 H new ATOM 0 HB2 SER A 127 2.153 1.846 12.770 1.00 0.00 H new ATOM 0 HB3 SER A 127 2.950 0.794 11.617 1.00 0.00 H new ATOM 0 HG SER A 127 4.321 1.706 13.949 1.00 0.00 H new ATOM 781 N PHE A 128 3.644 4.177 9.810 1.00 0.00 N ATOM 782 CA PHE A 128 3.165 4.569 8.490 1.00 0.00 C ATOM 783 C PHE A 128 4.330 4.759 7.523 1.00 0.00 C ATOM 784 O PHE A 128 5.488 4.819 7.935 1.00 0.00 O ATOM 785 CB PHE A 128 2.349 5.860 8.583 1.00 0.00 C ATOM 786 CG PHE A 128 3.194 7.099 8.663 1.00 0.00 C ATOM 787 CD1 PHE A 128 3.838 7.589 7.539 1.00 0.00 C ATOM 788 CD2 PHE A 128 3.345 7.774 9.864 1.00 0.00 C ATOM 789 CE1 PHE A 128 4.616 8.729 7.609 1.00 0.00 C ATOM 790 CE2 PHE A 128 4.122 8.915 9.941 1.00 0.00 C ATOM 791 CZ PHE A 128 4.759 9.392 8.812 1.00 0.00 C ATOM 0 H PHE A 128 4.290 4.840 10.238 1.00 0.00 H new ATOM 0 HA PHE A 128 2.527 3.771 8.110 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.696 5.931 7.713 1.00 0.00 H new ATOM 0 HB3 PHE A 128 1.706 5.811 9.462 1.00 0.00 H new ATOM 0 HD1 PHE A 128 3.731 7.074 6.596 1.00 0.00 H new ATOM 0 HD2 PHE A 128 2.850 7.404 10.750 1.00 0.00 H new ATOM 0 HE1 PHE A 128 5.111 9.101 6.724 1.00 0.00 H new ATOM 0 HE2 PHE A 128 4.231 9.433 10.883 1.00 0.00 H new ATOM 0 HZ PHE A 128 5.368 10.282 8.870 1.00 0.00 H new ATOM 801 N ALA A 129 4.014 4.853 6.236 1.00 0.00 N ATOM 802 CA ALA A 129 5.033 5.038 5.210 1.00 0.00 C ATOM 803 C ALA A 129 4.428 5.606 3.931 1.00 0.00 C ATOM 804 O ALA A 129 3.428 5.097 3.426 1.00 0.00 O ATOM 805 CB ALA A 129 5.737 3.720 4.922 1.00 0.00 C ATOM 0 H ALA A 129 3.060 4.804 5.879 1.00 0.00 H new ATOM 0 HA ALA A 129 5.764 5.754 5.585 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.495 3.873 4.154 1.00 0.00 H new ATOM 0 HB2 ALA A 129 6.211 3.354 5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 129 5.009 2.988 4.573 1.00 0.00 H new ATOM 811 N TYR A 130 5.041 6.665 3.413 1.00 0.00 N ATOM 812 CA TYR A 130 4.560 7.306 2.194 1.00 0.00 C ATOM 813 C TYR A 130 5.409 6.899 0.994 1.00 0.00 C ATOM 814 O TYR A 130 6.627 7.080 0.992 1.00 0.00 O ATOM 815 CB TYR A 130 4.576 8.827 2.352 1.00 0.00 C ATOM 816 CG TYR A 130 3.289 9.391 2.909 1.00 0.00 C ATOM 817 CD1 TYR A 130 2.148 9.483 2.121 1.00 0.00 C ATOM 818 CD2 TYR A 130 3.213 9.832 4.225 1.00 0.00 C ATOM 819 CE1 TYR A 130 0.971 9.999 2.626 1.00 0.00 C ATOM 820 CE2 TYR A 130 2.039 10.348 4.739 1.00 0.00 C ATOM 821 CZ TYR A 130 0.921 10.430 3.935 1.00 0.00 C ATOM 822 OH TYR A 130 -0.251 10.943 4.443 1.00 0.00 O ATOM 0 H TYR A 130 5.871 7.098 3.818 1.00 0.00 H new ATOM 0 HA TYR A 130 3.536 6.977 2.020 1.00 0.00 H new ATOM 0 HB2 TYR A 130 5.400 9.107 3.009 1.00 0.00 H new ATOM 0 HB3 TYR A 130 4.773 9.283 1.382 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.182 9.145 1.096 1.00 0.00 H new ATOM 0 HD2 TYR A 130 4.087 9.770 4.857 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.094 10.065 1.999 1.00 0.00 H new ATOM 0 HE2 TYR A 130 1.997 10.685 5.764 1.00 0.00 H new ATOM 0 HH TYR A 130 -0.754 10.230 4.888 1.00 0.00 H new ATOM 832 N ILE A 131 4.757 6.349 -0.025 1.00 0.00 N ATOM 833 CA ILE A 131 5.451 5.918 -1.232 1.00 0.00 C ATOM 834 C ILE A 131 5.215 6.893 -2.380 1.00 0.00 C ATOM 835 O ILE A 131 4.074 7.158 -2.757 1.00 0.00 O ATOM 836 CB ILE A 131 5.000 4.511 -1.668 1.00 0.00 C ATOM 837 CG1 ILE A 131 5.346 3.483 -0.589 1.00 0.00 C ATOM 838 CG2 ILE A 131 5.647 4.135 -2.993 1.00 0.00 C ATOM 839 CD1 ILE A 131 4.781 2.107 -0.862 1.00 0.00 C ATOM 0 H ILE A 131 3.749 6.191 -0.039 1.00 0.00 H new ATOM 0 HA ILE A 131 6.514 5.893 -0.993 1.00 0.00 H new ATOM 0 HB ILE A 131 3.918 4.517 -1.803 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.430 3.411 -0.502 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.972 3.837 0.372 1.00 0.00 H new ATOM 0 HG21 ILE A 131 5.319 3.138 -3.288 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.355 4.855 -3.758 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.731 4.142 -2.883 1.00 0.00 H new ATOM 0 HD11 ILE A 131 5.066 1.430 -0.056 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.694 2.165 -0.920 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.175 1.733 -1.807 1.00 0.00 H new ATOM 851 N GLN A 132 6.302 7.424 -2.931 1.00 0.00 N ATOM 852 CA GLN A 132 6.213 8.370 -4.037 1.00 0.00 C ATOM 853 C GLN A 132 6.547 7.692 -5.361 1.00 0.00 C ATOM 854 O GLN A 132 7.662 7.208 -5.558 1.00 0.00 O ATOM 855 CB GLN A 132 7.157 9.551 -3.802 1.00 0.00 C ATOM 856 CG GLN A 132 6.915 10.720 -4.744 1.00 0.00 C ATOM 857 CD GLN A 132 5.603 11.428 -4.470 1.00 0.00 C ATOM 858 OE1 GLN A 132 5.578 12.501 -3.865 1.00 0.00 O ATOM 859 NE2 GLN A 132 4.503 10.831 -4.914 1.00 0.00 N ATOM 0 H GLN A 132 7.254 7.215 -2.630 1.00 0.00 H new ATOM 0 HA GLN A 132 5.188 8.738 -4.087 1.00 0.00 H new ATOM 0 HB2 GLN A 132 7.046 9.895 -2.774 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.186 9.211 -3.915 1.00 0.00 H new ATOM 0 HG2 GLN A 132 7.734 11.433 -4.651 1.00 0.00 H new ATOM 0 HG3 GLN A 132 6.921 10.360 -5.773 1.00 0.00 H new ATOM 0 HE21 GLN A 132 4.570 9.943 -5.411 1.00 0.00 H new ATOM 0 HE22 GLN A 132 3.591 11.261 -4.759 1.00 0.00 H new ATOM 868 N TYR A 133 5.575 7.661 -6.266 1.00 0.00 N ATOM 869 CA TYR A 133 5.765 7.040 -7.571 1.00 0.00 C ATOM 870 C TYR A 133 6.280 8.054 -8.588 1.00 0.00 C ATOM 871 O TYR A 133 5.971 9.242 -8.506 1.00 0.00 O ATOM 872 CB TYR A 133 4.453 6.428 -8.064 1.00 0.00 C ATOM 873 CG TYR A 133 4.197 5.035 -7.534 1.00 0.00 C ATOM 874 CD1 TYR A 133 4.927 3.948 -8.001 1.00 0.00 C ATOM 875 CD2 TYR A 133 3.226 4.805 -6.568 1.00 0.00 C ATOM 876 CE1 TYR A 133 4.696 2.674 -7.520 1.00 0.00 C ATOM 877 CE2 TYR A 133 2.990 3.535 -6.080 1.00 0.00 C ATOM 878 CZ TYR A 133 3.727 2.472 -6.560 1.00 0.00 C ATOM 879 OH TYR A 133 3.494 1.205 -6.078 1.00 0.00 O ATOM 0 H TYR A 133 4.647 8.059 -6.119 1.00 0.00 H new ATOM 0 HA TYR A 133 6.509 6.251 -7.464 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.627 7.076 -7.771 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.463 6.397 -9.154 1.00 0.00 H new ATOM 0 HD1 TYR A 133 5.687 4.102 -8.752 1.00 0.00 H new ATOM 0 HD2 TYR A 133 2.645 5.634 -6.192 1.00 0.00 H new ATOM 0 HE1 TYR A 133 5.272 1.840 -7.894 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.233 3.375 -5.327 1.00 0.00 H new ATOM 0 HH TYR A 133 3.754 0.545 -6.754 1.00 0.00 H new ATOM 889 N GLU A 134 7.067 7.575 -9.546 1.00 0.00 N ATOM 890 CA GLU A 134 7.626 8.439 -10.579 1.00 0.00 C ATOM 891 C GLU A 134 6.517 9.140 -11.360 1.00 0.00 C ATOM 892 O GLU A 134 6.655 10.299 -11.749 1.00 0.00 O ATOM 893 CB GLU A 134 8.504 7.629 -11.534 1.00 0.00 C ATOM 894 CG GLU A 134 9.927 7.436 -11.037 1.00 0.00 C ATOM 895 CD GLU A 134 10.812 8.633 -11.325 1.00 0.00 C ATOM 896 OE1 GLU A 134 11.007 8.953 -12.516 1.00 0.00 O ATOM 897 OE2 GLU A 134 11.311 9.248 -10.360 1.00 0.00 O ATOM 0 H GLU A 134 7.332 6.593 -9.628 1.00 0.00 H new ATOM 0 HA GLU A 134 8.238 9.197 -10.090 1.00 0.00 H new ATOM 0 HB2 GLU A 134 8.048 6.652 -11.693 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.531 8.129 -12.502 1.00 0.00 H new ATOM 0 HG2 GLU A 134 9.911 7.251 -9.963 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.355 6.551 -11.507 1.00 0.00 H new ATOM 904 N SER A 135 5.419 8.426 -11.586 1.00 0.00 N ATOM 905 CA SER A 135 4.288 8.976 -12.324 1.00 0.00 C ATOM 906 C SER A 135 3.000 8.851 -11.516 1.00 0.00 C ATOM 907 O SER A 135 2.896 8.018 -10.615 1.00 0.00 O ATOM 908 CB SER A 135 4.132 8.261 -13.667 1.00 0.00 C ATOM 909 OG SER A 135 3.476 9.088 -14.612 1.00 0.00 O ATOM 0 H SER A 135 5.289 7.465 -11.269 1.00 0.00 H new ATOM 0 HA SER A 135 4.483 10.033 -12.504 1.00 0.00 H new ATOM 0 HB2 SER A 135 5.113 7.977 -14.047 1.00 0.00 H new ATOM 0 HB3 SER A 135 3.565 7.341 -13.529 1.00 0.00 H new ATOM 0 HG SER A 135 3.390 8.609 -15.462 1.00 0.00 H new ATOM 915 N LEU A 136 2.020 9.686 -11.845 1.00 0.00 N ATOM 916 CA LEU A 136 0.737 9.670 -11.152 1.00 0.00 C ATOM 917 C LEU A 136 -0.108 8.480 -11.594 1.00 0.00 C ATOM 918 O LEU A 136 -0.752 7.824 -10.775 1.00 0.00 O ATOM 919 CB LEU A 136 -0.022 10.973 -11.412 1.00 0.00 C ATOM 920 CG LEU A 136 -1.142 11.306 -10.426 1.00 0.00 C ATOM 921 CD1 LEU A 136 -1.522 12.775 -10.527 1.00 0.00 C ATOM 922 CD2 LEU A 136 -2.354 10.421 -10.678 1.00 0.00 C ATOM 0 H LEU A 136 2.090 10.382 -12.587 1.00 0.00 H new ATOM 0 HA LEU A 136 0.932 9.576 -10.084 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.695 11.794 -11.408 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.449 10.928 -12.414 1.00 0.00 H new ATOM 0 HG LEU A 136 -0.781 11.114 -9.416 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.321 12.994 -9.818 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -0.653 13.392 -10.297 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -1.865 12.993 -11.538 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -3.142 10.672 -9.967 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.717 10.581 -11.693 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.073 9.375 -10.554 1.00 0.00 H new ATOM 934 N ASP A 137 -0.098 8.205 -12.894 1.00 0.00 N ATOM 935 CA ASP A 137 -0.860 7.091 -13.445 1.00 0.00 C ATOM 936 C ASP A 137 -0.543 5.795 -12.704 1.00 0.00 C ATOM 937 O ASP A 137 -1.446 5.081 -12.270 1.00 0.00 O ATOM 938 CB ASP A 137 -0.558 6.927 -14.936 1.00 0.00 C ATOM 939 CG ASP A 137 -1.414 5.857 -15.586 1.00 0.00 C ATOM 940 OD1 ASP A 137 -2.593 6.141 -15.883 1.00 0.00 O ATOM 941 OD2 ASP A 137 -0.905 4.736 -15.797 1.00 0.00 O ATOM 0 H ASP A 137 0.429 8.738 -13.585 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.920 7.311 -13.318 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -0.722 7.878 -15.444 1.00 0.00 H new ATOM 0 HB3 ASP A 137 0.494 6.674 -15.065 1.00 0.00 H new ATOM 946 N ALA A 138 0.745 5.499 -12.564 1.00 0.00 N ATOM 947 CA ALA A 138 1.181 4.291 -11.875 1.00 0.00 C ATOM 948 C ALA A 138 0.701 4.282 -10.428 1.00 0.00 C ATOM 949 O ALA A 138 0.312 3.240 -9.900 1.00 0.00 O ATOM 950 CB ALA A 138 2.696 4.169 -11.932 1.00 0.00 C ATOM 0 H ALA A 138 1.505 6.080 -12.919 1.00 0.00 H new ATOM 0 HA ALA A 138 0.740 3.433 -12.382 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.008 3.262 -11.414 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.018 4.121 -12.972 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.149 5.036 -11.451 1.00 0.00 H new ATOM 956 N ALA A 139 0.732 5.448 -9.791 1.00 0.00 N ATOM 957 CA ALA A 139 0.299 5.573 -8.405 1.00 0.00 C ATOM 958 C ALA A 139 -1.157 5.148 -8.244 1.00 0.00 C ATOM 959 O ALA A 139 -1.486 4.351 -7.366 1.00 0.00 O ATOM 960 CB ALA A 139 0.490 7.003 -7.920 1.00 0.00 C ATOM 0 H ALA A 139 1.053 6.320 -10.213 1.00 0.00 H new ATOM 0 HA ALA A 139 0.913 4.909 -7.797 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.163 7.082 -6.883 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.544 7.273 -7.989 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.099 7.679 -8.539 1.00 0.00 H new ATOM 966 N GLN A 140 -2.023 5.685 -9.097 1.00 0.00 N ATOM 967 CA GLN A 140 -3.444 5.361 -9.047 1.00 0.00 C ATOM 968 C GLN A 140 -3.663 3.855 -9.147 1.00 0.00 C ATOM 969 O GLN A 140 -4.409 3.273 -8.360 1.00 0.00 O ATOM 970 CB GLN A 140 -4.191 6.073 -10.176 1.00 0.00 C ATOM 971 CG GLN A 140 -4.522 7.524 -9.866 1.00 0.00 C ATOM 972 CD GLN A 140 -5.149 8.245 -11.043 1.00 0.00 C ATOM 973 OE1 GLN A 140 -6.342 8.550 -11.036 1.00 0.00 O ATOM 974 NE2 GLN A 140 -4.346 8.521 -12.064 1.00 0.00 N ATOM 0 H GLN A 140 -1.766 6.346 -9.830 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.835 5.704 -8.089 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.587 6.032 -11.082 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.116 5.535 -10.385 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -5.203 7.563 -9.016 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.612 8.045 -9.569 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -3.363 8.250 -12.028 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -4.712 9.004 -12.884 1.00 0.00 H new ATOM 983 N ALA A 141 -3.009 3.231 -10.121 1.00 0.00 N ATOM 984 CA ALA A 141 -3.131 1.792 -10.323 1.00 0.00 C ATOM 985 C ALA A 141 -2.969 1.037 -9.008 1.00 0.00 C ATOM 986 O ALA A 141 -3.899 0.382 -8.540 1.00 0.00 O ATOM 987 CB ALA A 141 -2.104 1.313 -11.339 1.00 0.00 C ATOM 0 H ALA A 141 -2.389 3.699 -10.782 1.00 0.00 H new ATOM 0 HA ALA A 141 -4.130 1.588 -10.708 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -2.206 0.237 -11.480 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.268 1.821 -12.289 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -1.101 1.538 -10.976 1.00 0.00 H new ATOM 993 N ALA A 142 -1.782 1.134 -8.418 1.00 0.00 N ATOM 994 CA ALA A 142 -1.500 0.461 -7.156 1.00 0.00 C ATOM 995 C ALA A 142 -2.433 0.949 -6.053 1.00 0.00 C ATOM 996 O ALA A 142 -2.880 0.166 -5.214 1.00 0.00 O ATOM 997 CB ALA A 142 -0.048 0.678 -6.756 1.00 0.00 C ATOM 0 H ALA A 142 -1.001 1.672 -8.793 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.672 -0.606 -7.295 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.149 0.170 -5.812 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.606 0.274 -7.529 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.142 1.745 -6.641 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.723 2.245 -6.060 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.602 2.837 -5.058 1.00 0.00 C ATOM 1005 C CYS A 143 -4.849 1.983 -4.857 1.00 0.00 C ATOM 1006 O CYS A 143 -5.297 1.776 -3.729 1.00 0.00 O ATOM 1007 CB CYS A 143 -4.001 4.254 -5.473 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.484 5.319 -4.094 1.00 0.00 S ATOM 0 H CYS A 143 -2.362 2.906 -6.748 1.00 0.00 H new ATOM 0 HA CYS A 143 -3.058 2.882 -4.114 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -3.166 4.716 -5.999 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.829 4.195 -6.179 1.00 0.00 H new ATOM 0 HG CYS A 143 -4.938 6.446 -4.555 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.408 1.491 -5.958 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.603 0.660 -5.902 1.00 0.00 C ATOM 1016 C ALA A 144 -6.242 -0.809 -5.703 1.00 0.00 C ATOM 1017 O ALA A 144 -6.722 -1.456 -4.772 1.00 0.00 O ATOM 1018 CB ALA A 144 -7.428 0.835 -7.169 1.00 0.00 C ATOM 0 H ALA A 144 -5.052 1.654 -6.900 1.00 0.00 H new ATOM 0 HA ALA A 144 -7.198 0.980 -5.047 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -8.318 0.208 -7.113 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.725 1.879 -7.268 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.832 0.543 -8.034 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.394 -1.329 -6.583 1.00 0.00 N ATOM 1025 CA LYS A 145 -4.967 -2.721 -6.505 1.00 0.00 C ATOM 1026 C LYS A 145 -4.516 -3.073 -5.091 1.00 0.00 C ATOM 1027 O LYS A 145 -5.078 -3.963 -4.454 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.830 -2.984 -7.494 1.00 0.00 C ATOM 1029 CG LYS A 145 -4.308 -3.412 -8.871 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.735 -2.219 -9.709 1.00 0.00 C ATOM 1031 CE LYS A 145 -5.206 -2.648 -11.090 1.00 0.00 C ATOM 1032 NZ LYS A 145 -4.065 -2.868 -12.021 1.00 0.00 N ATOM 0 H LYS A 145 -4.988 -0.807 -7.360 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.818 -3.351 -6.764 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.229 -2.080 -7.592 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -3.178 -3.758 -7.088 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -3.510 -3.950 -9.383 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -5.144 -4.103 -8.768 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -5.537 -1.684 -9.200 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.900 -1.525 -9.807 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -5.789 -3.565 -11.006 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -5.868 -1.886 -11.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -4.427 -3.159 -12.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -3.523 -1.986 -12.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -3.446 -3.613 -11.642 1.00 0.00 H new ATOM 1046 N MET A 146 -3.500 -2.367 -4.606 1.00 0.00 N ATOM 1047 CA MET A 146 -2.977 -2.603 -3.265 1.00 0.00 C ATOM 1048 C MET A 146 -4.094 -2.551 -2.228 1.00 0.00 C ATOM 1049 O MET A 146 -4.206 -3.434 -1.378 1.00 0.00 O ATOM 1050 CB MET A 146 -1.900 -1.571 -2.926 1.00 0.00 C ATOM 1051 CG MET A 146 -0.588 -1.798 -3.658 1.00 0.00 C ATOM 1052 SD MET A 146 0.059 -3.465 -3.425 1.00 0.00 S ATOM 1053 CE MET A 146 0.509 -3.414 -1.692 1.00 0.00 C ATOM 0 H MET A 146 -3.023 -1.627 -5.121 1.00 0.00 H new ATOM 0 HA MET A 146 -2.534 -3.599 -3.245 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.274 -0.576 -3.167 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.715 -1.590 -1.852 1.00 0.00 H new ATOM 0 HG2 MET A 146 -0.734 -1.615 -4.723 1.00 0.00 H new ATOM 0 HG3 MET A 146 0.148 -1.075 -3.308 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.594 -3.373 -1.599 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.071 -2.530 -1.228 1.00 0.00 H new ATOM 0 HE3 MET A 146 0.135 -4.308 -1.193 1.00 0.00 H new ATOM 1063 N ARG A 147 -4.917 -1.510 -2.304 1.00 0.00 N ATOM 1064 CA ARG A 147 -6.024 -1.342 -1.370 1.00 0.00 C ATOM 1065 C ARG A 147 -6.737 -2.669 -1.128 1.00 0.00 C ATOM 1066 O ARG A 147 -7.571 -3.092 -1.928 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.016 -0.307 -1.903 1.00 0.00 C ATOM 1068 CG ARG A 147 -7.928 0.270 -0.833 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.202 -0.547 -0.687 1.00 0.00 C ATOM 1070 NE ARG A 147 -9.966 -0.163 0.497 1.00 0.00 N ATOM 1071 CZ ARG A 147 -11.212 -0.561 0.728 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -11.832 -1.350 -0.139 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -11.842 -0.169 1.829 1.00 0.00 N ATOM 0 H ARG A 147 -4.838 -0.771 -3.002 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.617 -0.990 -0.422 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.462 0.506 -2.373 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.627 -0.768 -2.679 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -7.400 0.297 0.120 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -8.182 1.299 -1.086 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.820 -0.416 -1.575 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -8.949 -1.606 -0.628 1.00 0.00 H new ATOM 0 HE ARG A 147 -9.518 0.444 1.184 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.352 -1.653 -0.986 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -12.789 -1.654 0.042 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.369 0.438 2.498 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.799 -0.475 2.005 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.403 -3.322 -0.019 1.00 0.00 N ATOM 1088 CA GLY A 148 -7.020 -4.594 0.308 1.00 0.00 C ATOM 1089 C GLY A 148 -6.150 -5.775 -0.073 1.00 0.00 C ATOM 1090 O GLY A 148 -6.656 -6.852 -0.390 1.00 0.00 O ATOM 0 H GLY A 148 -5.716 -2.992 0.659 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -7.227 -4.629 1.378 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -7.978 -4.672 -0.205 1.00 0.00 H new ATOM 1094 N PHE A 149 -4.837 -5.575 -0.044 1.00 0.00 N ATOM 1095 CA PHE A 149 -3.894 -6.631 -0.391 1.00 0.00 C ATOM 1096 C PHE A 149 -3.715 -7.604 0.771 1.00 0.00 C ATOM 1097 O PHE A 149 -3.617 -7.211 1.933 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.542 -6.030 -0.780 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.533 -7.054 -1.214 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -1.504 -7.507 -2.523 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.612 -7.565 -0.312 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -0.577 -8.450 -2.925 1.00 0.00 C ATOM 1103 CE2 PHE A 149 0.317 -8.508 -0.708 1.00 0.00 C ATOM 1104 CZ PHE A 149 0.336 -8.950 -2.016 1.00 0.00 C ATOM 0 H PHE A 149 -4.401 -4.690 0.217 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.298 -7.179 -1.242 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.691 -5.313 -1.588 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.142 -5.475 0.069 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -2.214 -7.119 -3.238 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.621 -7.222 0.712 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.566 -8.796 -3.948 1.00 0.00 H new ATOM 0 HE2 PHE A 149 1.028 -8.899 0.005 1.00 0.00 H new ATOM 0 HZ PHE A 149 1.063 -9.685 -2.328 1.00 0.00 H new ATOM 1114 N PRO A 150 -3.672 -8.906 0.450 1.00 0.00 N ATOM 1115 CA PRO A 150 -3.505 -9.963 1.452 1.00 0.00 C ATOM 1116 C PRO A 150 -2.108 -9.967 2.063 1.00 0.00 C ATOM 1117 O PRO A 150 -1.169 -10.517 1.487 1.00 0.00 O ATOM 1118 CB PRO A 150 -3.744 -11.248 0.655 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.401 -10.892 -0.750 1.00 0.00 C ATOM 1120 CD PRO A 150 -3.783 -9.446 -0.915 1.00 0.00 C ATOM 0 HA PRO A 150 -4.183 -9.836 2.296 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.119 -12.063 1.021 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -4.779 -11.579 0.738 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.338 -11.039 -0.942 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -3.943 -11.522 -1.456 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -3.116 -8.931 -1.606 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.794 -9.340 -1.308 1.00 0.00 H new ATOM 1128 N LEU A 151 -1.978 -9.351 3.233 1.00 0.00 N ATOM 1129 CA LEU A 151 -0.695 -9.283 3.924 1.00 0.00 C ATOM 1130 C LEU A 151 -0.879 -9.431 5.431 1.00 0.00 C ATOM 1131 O LEU A 151 -1.663 -8.708 6.044 1.00 0.00 O ATOM 1132 CB LEU A 151 0.006 -7.960 3.611 1.00 0.00 C ATOM 1133 CG LEU A 151 1.535 -7.996 3.604 1.00 0.00 C ATOM 1134 CD1 LEU A 151 2.088 -6.977 2.619 1.00 0.00 C ATOM 1135 CD2 LEU A 151 2.081 -7.740 5.001 1.00 0.00 C ATOM 0 H LEU A 151 -2.745 -8.891 3.723 1.00 0.00 H new ATOM 0 HA LEU A 151 -0.076 -10.107 3.570 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.334 -7.614 2.635 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -0.317 -7.219 4.342 1.00 0.00 H new ATOM 0 HG LEU A 151 1.855 -8.989 3.287 1.00 0.00 H new ATOM 0 HD11 LEU A 151 3.177 -7.017 2.627 1.00 0.00 H new ATOM 0 HD12 LEU A 151 1.724 -7.205 1.617 1.00 0.00 H new ATOM 0 HD13 LEU A 151 1.759 -5.978 2.906 1.00 0.00 H new ATOM 0 HD21 LEU A 151 3.170 -7.769 4.977 1.00 0.00 H new ATOM 0 HD22 LEU A 151 1.752 -6.760 5.346 1.00 0.00 H new ATOM 0 HD23 LEU A 151 1.712 -8.507 5.682 1.00 0.00 H new ATOM 1147 N GLY A 152 -0.149 -10.372 6.022 1.00 0.00 N ATOM 1148 CA GLY A 152 -0.244 -10.596 7.452 1.00 0.00 C ATOM 1149 C GLY A 152 -1.241 -11.683 7.803 1.00 0.00 C ATOM 1150 O GLY A 152 -0.969 -12.868 7.617 1.00 0.00 O ATOM 0 H GLY A 152 0.507 -10.983 5.535 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.738 -10.868 7.840 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.535 -9.668 7.944 1.00 0.00 H new ATOM 1154 N GLY A 153 -2.400 -11.278 8.316 1.00 0.00 N ATOM 1155 CA GLY A 153 -3.422 -12.239 8.688 1.00 0.00 C ATOM 1156 C GLY A 153 -4.686 -12.088 7.865 1.00 0.00 C ATOM 1157 O GLY A 153 -4.744 -11.309 6.913 1.00 0.00 O ATOM 0 H GLY A 153 -2.649 -10.302 8.480 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -3.030 -13.248 8.564 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.663 -12.118 9.744 1.00 0.00 H new ATOM 1161 N PRO A 154 -5.729 -12.849 8.230 1.00 0.00 N ATOM 1162 CA PRO A 154 -7.017 -12.815 7.531 1.00 0.00 C ATOM 1163 C PRO A 154 -7.766 -11.506 7.758 1.00 0.00 C ATOM 1164 O PRO A 154 -8.462 -11.016 6.869 1.00 0.00 O ATOM 1165 CB PRO A 154 -7.786 -13.985 8.148 1.00 0.00 C ATOM 1166 CG PRO A 154 -7.182 -14.166 9.497 1.00 0.00 C ATOM 1167 CD PRO A 154 -5.731 -13.800 9.354 1.00 0.00 C ATOM 0 HA PRO A 154 -6.896 -12.889 6.450 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -8.851 -13.766 8.218 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -7.685 -14.887 7.545 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -7.674 -13.530 10.233 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -7.293 -15.195 9.839 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -5.339 -13.347 10.265 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -5.115 -14.674 9.142 1.00 0.00 H new ATOM 1175 N ASP A 155 -7.617 -10.945 8.953 1.00 0.00 N ATOM 1176 CA ASP A 155 -8.279 -9.692 9.297 1.00 0.00 C ATOM 1177 C ASP A 155 -7.366 -8.502 9.019 1.00 0.00 C ATOM 1178 O ASP A 155 -7.820 -7.453 8.561 1.00 0.00 O ATOM 1179 CB ASP A 155 -8.696 -9.698 10.769 1.00 0.00 C ATOM 1180 CG ASP A 155 -9.934 -10.537 11.016 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -11.050 -10.039 10.760 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -9.786 -11.693 11.465 1.00 0.00 O ATOM 0 H ASP A 155 -7.044 -11.338 9.700 1.00 0.00 H new ATOM 0 HA ASP A 155 -9.170 -9.597 8.676 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -7.875 -10.080 11.375 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -8.883 -8.675 11.095 1.00 0.00 H new ATOM 1187 N ARG A 156 -6.078 -8.672 9.300 1.00 0.00 N ATOM 1188 CA ARG A 156 -5.102 -7.611 9.082 1.00 0.00 C ATOM 1189 C ARG A 156 -4.886 -7.368 7.592 1.00 0.00 C ATOM 1190 O ARG A 156 -4.255 -8.173 6.907 1.00 0.00 O ATOM 1191 CB ARG A 156 -3.773 -7.967 9.750 1.00 0.00 C ATOM 1192 CG ARG A 156 -3.815 -7.897 11.268 1.00 0.00 C ATOM 1193 CD ARG A 156 -2.837 -8.876 11.898 1.00 0.00 C ATOM 1194 NE ARG A 156 -2.502 -8.508 13.271 1.00 0.00 N ATOM 1195 CZ ARG A 156 -1.775 -9.270 14.080 1.00 0.00 C ATOM 1196 NH1 ARG A 156 -1.309 -10.437 13.655 1.00 0.00 N ATOM 1197 NH2 ARG A 156 -1.513 -8.866 15.316 1.00 0.00 N ATOM 0 H ARG A 156 -5.686 -9.534 9.679 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.492 -6.696 9.528 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -3.483 -8.974 9.449 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -3.000 -7.291 9.385 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.578 -6.884 11.593 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -4.825 -8.115 11.616 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -3.268 -9.877 11.886 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -1.926 -8.914 11.300 1.00 0.00 H new ATOM 0 HE ARG A 156 -2.845 -7.616 13.628 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -1.509 -10.751 12.705 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -0.751 -11.021 14.278 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -1.870 -7.969 15.646 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -0.955 -9.452 15.937 1.00 0.00 H new ATOM 1211 N ARG A 157 -5.415 -6.254 7.096 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.282 -5.907 5.686 1.00 0.00 C ATOM 1213 C ARG A 157 -4.577 -4.564 5.522 1.00 0.00 C ATOM 1214 O ARG A 157 -4.525 -3.760 6.453 1.00 0.00 O ATOM 1215 CB ARG A 157 -6.658 -5.857 5.019 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.125 -7.202 4.486 1.00 0.00 C ATOM 1217 CD ARG A 157 -8.291 -7.045 3.522 1.00 0.00 C ATOM 1218 NE ARG A 157 -9.436 -6.393 4.151 1.00 0.00 N ATOM 1219 CZ ARG A 157 -10.606 -6.220 3.546 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -10.785 -6.649 2.304 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -11.602 -5.618 4.184 1.00 0.00 N ATOM 0 H ARG A 157 -5.940 -5.577 7.650 1.00 0.00 H new ATOM 0 HA ARG A 157 -4.680 -6.676 5.203 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -7.388 -5.487 5.739 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -6.629 -5.141 4.198 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -6.298 -7.701 3.981 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -7.423 -7.841 5.318 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -7.971 -6.462 2.658 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -8.590 -8.026 3.152 1.00 0.00 H new ATOM 0 HE ARG A 157 -9.332 -6.052 5.107 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -10.023 -7.114 1.810 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -11.685 -6.514 1.843 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -11.470 -5.288 5.140 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -12.500 -5.486 3.718 1.00 0.00 H new ATOM 1235 N LEU A 158 -4.035 -4.328 4.332 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.332 -3.083 4.045 1.00 0.00 C ATOM 1237 C LEU A 158 -4.317 -1.937 3.837 1.00 0.00 C ATOM 1238 O LEU A 158 -5.373 -2.115 3.231 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.451 -3.245 2.805 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.374 -4.327 2.884 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.513 -4.316 1.630 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.514 -4.134 4.124 1.00 0.00 C ATOM 0 H LEU A 158 -4.069 -4.983 3.551 1.00 0.00 H new ATOM 0 HA LEU A 158 -2.702 -2.845 4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -3.095 -3.463 1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.965 -2.291 2.602 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.866 -5.297 2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.248 -5.093 1.704 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -1.139 -4.503 0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -0.030 -3.344 1.528 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.247 -4.913 4.164 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -0.032 -3.157 4.084 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.140 -4.193 5.014 1.00 0.00 H new ATOM 1254 N ARG A 159 -3.962 -0.759 4.341 1.00 0.00 N ATOM 1255 CA ARG A 159 -4.814 0.416 4.210 1.00 0.00 C ATOM 1256 C ARG A 159 -4.169 1.456 3.298 1.00 0.00 C ATOM 1257 O ARG A 159 -3.194 2.107 3.673 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.090 1.029 5.584 1.00 0.00 C ATOM 1259 CG ARG A 159 -6.245 2.017 5.589 1.00 0.00 C ATOM 1260 CD ARG A 159 -7.587 1.308 5.501 1.00 0.00 C ATOM 1261 NE ARG A 159 -8.697 2.191 5.847 1.00 0.00 N ATOM 1262 CZ ARG A 159 -9.093 2.418 7.095 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -8.473 1.831 8.109 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -10.112 3.235 7.330 1.00 0.00 N ATOM 0 H ARG A 159 -3.090 -0.594 4.844 1.00 0.00 H new ATOM 0 HA ARG A 159 -5.758 0.101 3.764 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -5.304 0.229 6.293 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -4.190 1.534 5.935 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -6.208 2.616 6.499 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -6.140 2.705 4.750 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -7.729 0.926 4.490 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -7.587 0.447 6.170 1.00 0.00 H new ATOM 0 HE ARG A 159 -9.195 2.659 5.090 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -7.689 1.203 7.933 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -8.780 2.008 9.066 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -10.592 3.689 6.553 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -10.416 3.409 8.288 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.720 1.606 2.097 1.00 0.00 N ATOM 1279 CA VAL A 160 -4.199 2.566 1.132 1.00 0.00 C ATOM 1280 C VAL A 160 -5.199 3.690 0.881 1.00 0.00 C ATOM 1281 O VAL A 160 -6.372 3.441 0.603 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.860 1.887 -0.208 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -3.256 2.892 -1.178 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.917 0.714 0.014 1.00 0.00 C ATOM 0 H VAL A 160 -5.527 1.075 1.770 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.287 2.983 1.560 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.782 1.505 -0.646 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -3.023 2.394 -2.119 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.969 3.696 -1.360 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -2.343 3.306 -0.751 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.688 0.245 -0.943 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.995 1.070 0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.392 -0.015 0.671 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.726 4.928 0.980 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.578 6.091 0.762 1.00 0.00 C ATOM 1296 C ASP A 161 -4.800 7.214 0.084 1.00 0.00 C ATOM 1297 O ASP A 161 -3.684 7.543 0.487 1.00 0.00 O ATOM 1298 CB ASP A 161 -6.155 6.583 2.091 1.00 0.00 C ATOM 1299 CG ASP A 161 -6.547 8.047 2.044 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -7.363 8.416 1.173 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -6.039 8.824 2.880 1.00 0.00 O ATOM 0 H ASP A 161 -3.758 5.152 1.210 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.397 5.794 0.107 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -7.028 5.984 2.349 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -5.420 6.432 2.881 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.397 7.800 -0.949 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.759 8.885 -1.686 1.00 0.00 C ATOM 1308 C PHE A 162 -4.348 10.013 -0.744 1.00 0.00 C ATOM 1309 O PHE A 162 -5.149 10.487 0.061 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.704 9.423 -2.763 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.736 8.582 -4.007 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.596 8.418 -4.777 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.905 7.955 -4.405 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.623 7.645 -5.923 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.938 7.180 -5.549 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.795 7.025 -6.309 1.00 0.00 C ATOM 0 H PHE A 162 -6.321 7.542 -1.295 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.863 8.489 -2.164 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.711 9.488 -2.352 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.402 10.436 -3.027 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.676 8.899 -4.479 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.801 8.073 -3.814 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.728 7.526 -6.516 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.856 6.696 -5.848 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.818 6.420 -7.203 1.00 0.00 H new ATOM 1326 N ALA A 163 -3.094 10.438 -0.852 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.576 11.511 -0.012 1.00 0.00 C ATOM 1328 C ALA A 163 -3.124 12.865 -0.451 1.00 0.00 C ATOM 1329 O ALA A 163 -2.484 13.587 -1.215 1.00 0.00 O ATOM 1330 CB ALA A 163 -1.055 11.519 -0.045 1.00 0.00 C ATOM 0 H ALA A 163 -2.418 10.056 -1.513 1.00 0.00 H new ATOM 0 HA ALA A 163 -2.905 11.330 1.011 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -0.682 12.325 0.586 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -0.678 10.565 0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.714 11.673 -1.069 1.00 0.00 H new