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 Single : A 88 ASN : amide:sc= -0.454 X(o=-0.45,f=-0.026) USER MOD Single : A 90 THR OG1 : rot -140:sc= -0.167 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.00127 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.149 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= -0.165 USER MOD Single : A 122 HIS : no HD1:sc=-0.00146 X(o=-0.0015,f=-0.24) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 75:sc= 0.936 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -1.19 K(o=-1.2,f=-2.2) USER MOD Single : A 133 TYR OH : rot -16:sc= 0.548 USER MOD Single : A 135 SER OG : rot 180:sc= -0.121 USER MOD Single : A 140 GLN : amide:sc= -3.71! C(o=-3.7!,f=-9.4!) USER MOD Single : A 143 CYS SG : rot -165:sc= 0.911 USER MOD Single : A 145 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00393) USER MOD Single : A 146 MET CE :methyl -119:sc= -4.31! (180deg=-10.3!) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -9.285 12.512 -4.531 1.00 0.00 N ATOM 175 CA ASN A 88 -8.651 12.547 -5.844 1.00 0.00 C ATOM 176 C ASN A 88 -7.350 11.751 -5.842 1.00 0.00 C ATOM 177 O ASN A 88 -6.712 11.560 -4.806 1.00 0.00 O ATOM 178 CB ASN A 88 -8.377 13.993 -6.263 1.00 0.00 C ATOM 179 CG ASN A 88 -9.641 14.726 -6.671 1.00 0.00 C ATOM 180 OD1 ASN A 88 -9.907 15.834 -6.206 1.00 0.00 O ATOM 181 ND2 ASN A 88 -10.426 14.108 -7.546 1.00 0.00 N ATOM 0 HA ASN A 88 -9.334 12.091 -6.561 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -7.903 14.524 -5.438 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.672 14.000 -7.094 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.289 14.552 -7.859 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.165 13.190 -7.905 1.00 0.00 H new ATOM 188 N PRO A 89 -6.944 11.276 -7.029 1.00 0.00 N ATOM 189 CA PRO A 89 -5.715 10.494 -7.191 1.00 0.00 C ATOM 190 C PRO A 89 -4.461 11.338 -6.991 1.00 0.00 C ATOM 191 O PRO A 89 -4.491 12.560 -7.140 1.00 0.00 O ATOM 192 CB PRO A 89 -5.799 9.996 -8.636 1.00 0.00 C ATOM 193 CG PRO A 89 -6.663 10.991 -9.330 1.00 0.00 C ATOM 194 CD PRO A 89 -7.655 11.465 -8.305 1.00 0.00 C ATOM 0 HA PRO A 89 -5.641 9.694 -6.454 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.811 9.942 -9.094 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -6.229 8.996 -8.686 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -6.071 11.822 -9.713 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -7.169 10.540 -10.184 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.928 12.509 -8.462 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.578 10.886 -8.341 1.00 0.00 H new ATOM 202 N THR A 90 -3.357 10.679 -6.651 1.00 0.00 N ATOM 203 CA THR A 90 -2.093 11.369 -6.430 1.00 0.00 C ATOM 204 C THR A 90 -0.909 10.445 -6.695 1.00 0.00 C ATOM 205 O THR A 90 -1.083 9.255 -6.961 1.00 0.00 O ATOM 206 CB THR A 90 -1.993 11.912 -4.992 1.00 0.00 C ATOM 207 OG1 THR A 90 -2.723 11.066 -4.097 1.00 0.00 O ATOM 208 CG2 THR A 90 -2.535 13.331 -4.911 1.00 0.00 C ATOM 0 H THR A 90 -3.314 9.668 -6.523 1.00 0.00 H new ATOM 0 HA THR A 90 -2.063 12.205 -7.129 1.00 0.00 H new ATOM 0 HB THR A 90 -0.942 11.924 -4.704 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.196 11.617 -3.439 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.454 13.693 -3.886 1.00 0.00 H new ATOM 0 HG22 THR A 90 -1.959 13.979 -5.572 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.581 13.339 -5.217 1.00 0.00 H new ATOM 216 N THR A 91 0.297 11.000 -6.621 1.00 0.00 N ATOM 217 CA THR A 91 1.510 10.226 -6.853 1.00 0.00 C ATOM 218 C THR A 91 2.121 9.754 -5.539 1.00 0.00 C ATOM 219 O THR A 91 3.077 8.978 -5.531 1.00 0.00 O ATOM 220 CB THR A 91 2.559 11.045 -7.629 1.00 0.00 C ATOM 221 OG1 THR A 91 2.744 12.321 -7.005 1.00 0.00 O ATOM 222 CG2 THR A 91 2.131 11.240 -9.076 1.00 0.00 C ATOM 0 H THR A 91 0.459 11.983 -6.402 1.00 0.00 H new ATOM 0 HA THR A 91 1.223 9.360 -7.449 1.00 0.00 H new ATOM 0 HB THR A 91 3.500 10.495 -7.616 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.413 12.835 -7.503 1.00 0.00 H new ATOM 0 HG21 THR A 91 2.887 11.821 -9.604 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.019 10.268 -9.557 1.00 0.00 H new ATOM 0 HG23 THR A 91 1.179 11.771 -9.106 1.00 0.00 H new ATOM 230 N ARG A 92 1.564 10.227 -4.429 1.00 0.00 N ATOM 231 CA ARG A 92 2.055 9.853 -3.108 1.00 0.00 C ATOM 232 C ARG A 92 0.991 9.085 -2.330 1.00 0.00 C ATOM 233 O ARG A 92 0.103 9.680 -1.718 1.00 0.00 O ATOM 234 CB ARG A 92 2.475 11.099 -2.326 1.00 0.00 C ATOM 235 CG ARG A 92 2.826 10.816 -0.874 1.00 0.00 C ATOM 236 CD ARG A 92 2.692 12.064 -0.015 1.00 0.00 C ATOM 237 NE ARG A 92 3.913 12.866 -0.021 1.00 0.00 N ATOM 238 CZ ARG A 92 4.206 13.764 0.913 1.00 0.00 C ATOM 239 NH1 ARG A 92 3.372 13.973 1.922 1.00 0.00 N ATOM 240 NH2 ARG A 92 5.337 14.455 0.838 1.00 0.00 N ATOM 0 H ARG A 92 0.772 10.870 -4.418 1.00 0.00 H new ATOM 0 HA ARG A 92 2.922 9.205 -3.239 1.00 0.00 H new ATOM 0 HB2 ARG A 92 3.335 11.553 -2.817 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.666 11.829 -2.360 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.173 10.034 -0.486 1.00 0.00 H new ATOM 0 HG3 ARG A 92 3.847 10.438 -0.812 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.860 12.667 -0.379 1.00 0.00 H new ATOM 0 HD3 ARG A 92 2.453 11.776 1.009 1.00 0.00 H new ATOM 0 HE ARG A 92 4.576 12.729 -0.784 1.00 0.00 H new ATOM 0 HH11 ARG A 92 2.502 13.444 1.983 1.00 0.00 H new ATOM 0 HH12 ARG A 92 3.600 14.663 2.638 1.00 0.00 H new ATOM 0 HH21 ARG A 92 5.981 14.296 0.063 1.00 0.00 H new ATOM 0 HH22 ARG A 92 5.562 15.145 1.555 1.00 0.00 H new ATOM 254 N LEU A 93 1.087 7.760 -2.358 1.00 0.00 N ATOM 255 CA LEU A 93 0.132 6.910 -1.655 1.00 0.00 C ATOM 256 C LEU A 93 0.527 6.742 -0.191 1.00 0.00 C ATOM 257 O LEU A 93 1.709 6.638 0.135 1.00 0.00 O ATOM 258 CB LEU A 93 0.045 5.540 -2.331 1.00 0.00 C ATOM 259 CG LEU A 93 0.040 5.546 -3.860 1.00 0.00 C ATOM 260 CD1 LEU A 93 -0.003 4.125 -4.399 1.00 0.00 C ATOM 261 CD2 LEU A 93 -1.137 6.354 -4.387 1.00 0.00 C ATOM 0 H LEU A 93 1.815 7.252 -2.859 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.845 7.392 -1.696 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.887 4.936 -1.993 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.862 5.044 -1.986 1.00 0.00 H new ATOM 0 HG LEU A 93 0.961 6.016 -4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.006 4.149 -5.489 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.872 3.577 -4.051 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.906 3.629 -4.045 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.124 6.347 -5.477 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.069 5.913 -4.032 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.062 7.381 -4.030 1.00 0.00 H new ATOM 273 N TRP A 94 -0.471 6.716 0.685 1.00 0.00 N ATOM 274 CA TRP A 94 -0.228 6.558 2.115 1.00 0.00 C ATOM 275 C TRP A 94 -0.569 5.145 2.573 1.00 0.00 C ATOM 276 O TRP A 94 -1.709 4.697 2.441 1.00 0.00 O ATOM 277 CB TRP A 94 -1.048 7.577 2.908 1.00 0.00 C ATOM 278 CG TRP A 94 -1.193 7.224 4.357 1.00 0.00 C ATOM 279 CD1 TRP A 94 -0.373 7.608 5.380 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.219 6.416 4.944 1.00 0.00 C ATOM 281 NE1 TRP A 94 -0.827 7.086 6.567 1.00 0.00 N ATOM 282 CE2 TRP A 94 -1.958 6.353 6.327 1.00 0.00 C ATOM 283 CE3 TRP A 94 -3.333 5.742 4.437 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -2.771 5.641 7.205 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -4.138 5.036 5.310 1.00 0.00 C ATOM 286 CH2 TRP A 94 -3.855 4.990 6.681 1.00 0.00 C ATOM 0 H TRP A 94 -1.455 6.802 0.431 1.00 0.00 H new ATOM 0 HA TRP A 94 0.832 6.733 2.299 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.576 8.556 2.825 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.039 7.662 2.461 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.503 8.230 5.272 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.392 7.223 7.479 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.561 5.772 3.382 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -2.554 5.604 8.262 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -5.001 4.510 4.929 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.505 4.430 7.337 1.00 0.00 H new ATOM 297 N VAL A 95 0.424 4.446 3.112 1.00 0.00 N ATOM 298 CA VAL A 95 0.228 3.083 3.591 1.00 0.00 C ATOM 299 C VAL A 95 0.256 3.026 5.114 1.00 0.00 C ATOM 300 O VAL A 95 1.262 3.356 5.740 1.00 0.00 O ATOM 301 CB VAL A 95 1.303 2.131 3.034 1.00 0.00 C ATOM 302 CG1 VAL A 95 1.081 0.716 3.544 1.00 0.00 C ATOM 303 CG2 VAL A 95 1.306 2.164 1.513 1.00 0.00 C ATOM 0 H VAL A 95 1.373 4.801 3.228 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.751 2.762 3.236 1.00 0.00 H new ATOM 0 HB VAL A 95 2.278 2.468 3.385 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.850 0.059 3.139 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.134 0.709 4.633 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.099 0.364 3.226 1.00 0.00 H new ATOM 0 HG21 VAL A 95 2.071 1.486 1.136 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.330 1.853 1.140 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.519 3.177 1.171 1.00 0.00 H new ATOM 313 N GLY A 96 -0.858 2.604 5.706 1.00 0.00 N ATOM 314 CA GLY A 96 -0.940 2.512 7.152 1.00 0.00 C ATOM 315 C GLY A 96 -1.284 1.113 7.625 1.00 0.00 C ATOM 316 O GLY A 96 -1.502 0.213 6.815 1.00 0.00 O ATOM 0 H GLY A 96 -1.704 2.324 5.210 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.012 2.815 7.587 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.694 3.211 7.515 1.00 0.00 H new ATOM 320 N GLY A 97 -1.330 0.929 8.941 1.00 0.00 N ATOM 321 CA GLY A 97 -1.647 -0.373 9.497 1.00 0.00 C ATOM 322 C GLY A 97 -0.467 -1.324 9.459 1.00 0.00 C ATOM 323 O GLY A 97 -0.596 -2.469 9.023 1.00 0.00 O ATOM 0 H GLY A 97 -1.153 1.658 9.632 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.979 -0.253 10.528 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.478 -0.808 8.943 1.00 0.00 H new ATOM 327 N LEU A 98 0.687 -0.849 9.914 1.00 0.00 N ATOM 328 CA LEU A 98 1.897 -1.665 9.928 1.00 0.00 C ATOM 329 C LEU A 98 2.213 -2.145 11.341 1.00 0.00 C ATOM 330 O LEU A 98 1.813 -1.523 12.323 1.00 0.00 O ATOM 331 CB LEU A 98 3.079 -0.869 9.372 1.00 0.00 C ATOM 332 CG LEU A 98 2.865 -0.217 8.005 1.00 0.00 C ATOM 333 CD1 LEU A 98 4.068 0.632 7.624 1.00 0.00 C ATOM 334 CD2 LEU A 98 2.600 -1.276 6.944 1.00 0.00 C ATOM 0 H LEU A 98 0.811 0.096 10.278 1.00 0.00 H new ATOM 0 HA LEU A 98 1.725 -2.537 9.297 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.335 -0.089 10.089 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.940 -1.534 9.304 1.00 0.00 H new ATOM 0 HG LEU A 98 1.992 0.433 8.067 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.897 1.088 6.649 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.212 1.414 8.370 1.00 0.00 H new ATOM 0 HD13 LEU A 98 4.958 0.004 7.580 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.450 -0.794 5.978 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.453 -1.952 6.884 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.707 -1.842 7.210 1.00 0.00 H new ATOM 346 N GLY A 99 2.936 -3.257 11.435 1.00 0.00 N ATOM 347 CA GLY A 99 3.296 -3.801 12.731 1.00 0.00 C ATOM 348 C GLY A 99 4.747 -4.233 12.796 1.00 0.00 C ATOM 349 O GLY A 99 5.560 -3.885 11.940 1.00 0.00 O ATOM 0 H GLY A 99 3.279 -3.791 10.636 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.108 -3.052 13.501 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.656 -4.655 12.954 1.00 0.00 H new ATOM 353 N PRO A 100 5.091 -5.010 13.834 1.00 0.00 N ATOM 354 CA PRO A 100 6.456 -5.506 14.033 1.00 0.00 C ATOM 355 C PRO A 100 6.851 -6.551 12.994 1.00 0.00 C ATOM 356 O PRO A 100 8.034 -6.779 12.748 1.00 0.00 O ATOM 357 CB PRO A 100 6.406 -6.133 15.429 1.00 0.00 C ATOM 358 CG PRO A 100 4.977 -6.503 15.627 1.00 0.00 C ATOM 359 CD PRO A 100 4.175 -5.464 14.893 1.00 0.00 C ATOM 0 HA PRO A 100 7.196 -4.712 13.933 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.054 -7.007 15.494 1.00 0.00 H new ATOM 0 HB3 PRO A 100 6.742 -5.430 16.191 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.774 -7.500 15.236 1.00 0.00 H new ATOM 0 HG3 PRO A 100 4.721 -6.517 16.686 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.258 -5.883 14.479 1.00 0.00 H new ATOM 0 HD3 PRO A 100 3.882 -4.645 15.550 1.00 0.00 H new ATOM 367 N ASN A 101 5.851 -7.182 12.388 1.00 0.00 N ATOM 368 CA ASN A 101 6.094 -8.203 11.375 1.00 0.00 C ATOM 369 C ASN A 101 6.237 -7.574 9.992 1.00 0.00 C ATOM 370 O ASN A 101 7.140 -7.922 9.230 1.00 0.00 O ATOM 371 CB ASN A 101 4.956 -9.225 11.368 1.00 0.00 C ATOM 372 CG ASN A 101 4.906 -10.026 10.081 1.00 0.00 C ATOM 373 OD1 ASN A 101 4.093 -9.753 9.198 1.00 0.00 O ATOM 374 ND2 ASN A 101 5.778 -11.021 9.970 1.00 0.00 N ATOM 0 H ASN A 101 4.865 -7.005 12.580 1.00 0.00 H new ATOM 0 HA ASN A 101 7.027 -8.710 11.622 1.00 0.00 H new ATOM 0 HB2 ASN A 101 5.077 -9.905 12.211 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.007 -8.708 11.508 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.792 -11.595 9.127 1.00 0.00 H new ATOM 0 HD22 ASN A 101 6.434 -11.211 10.728 1.00 0.00 H new ATOM 381 N THR A 102 5.340 -6.646 9.674 1.00 0.00 N ATOM 382 CA THR A 102 5.365 -5.969 8.384 1.00 0.00 C ATOM 383 C THR A 102 6.717 -5.310 8.135 1.00 0.00 C ATOM 384 O THR A 102 7.057 -4.311 8.768 1.00 0.00 O ATOM 385 CB THR A 102 4.261 -4.899 8.289 1.00 0.00 C ATOM 386 OG1 THR A 102 3.110 -5.317 9.032 1.00 0.00 O ATOM 387 CG2 THR A 102 3.873 -4.649 6.840 1.00 0.00 C ATOM 0 H THR A 102 4.587 -6.346 10.293 1.00 0.00 H new ATOM 0 HA THR A 102 5.189 -6.731 7.624 1.00 0.00 H new ATOM 0 HB THR A 102 4.647 -3.971 8.710 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.413 -4.631 8.969 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.092 -3.890 6.798 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.745 -4.304 6.284 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.504 -5.574 6.397 1.00 0.00 H new ATOM 395 N SER A 103 7.484 -5.877 7.209 1.00 0.00 N ATOM 396 CA SER A 103 8.802 -5.346 6.879 1.00 0.00 C ATOM 397 C SER A 103 8.730 -4.436 5.655 1.00 0.00 C ATOM 398 O SER A 103 8.228 -4.832 4.602 1.00 0.00 O ATOM 399 CB SER A 103 9.786 -6.489 6.621 1.00 0.00 C ATOM 400 OG SER A 103 10.300 -7.003 7.838 1.00 0.00 O ATOM 0 H SER A 103 7.216 -6.703 6.674 1.00 0.00 H new ATOM 0 HA SER A 103 9.153 -4.759 7.728 1.00 0.00 H new ATOM 0 HB2 SER A 103 9.287 -7.285 6.068 1.00 0.00 H new ATOM 0 HB3 SER A 103 10.606 -6.133 5.997 1.00 0.00 H new ATOM 0 HG SER A 103 10.925 -7.733 7.647 1.00 0.00 H new ATOM 406 N LEU A 104 9.234 -3.216 5.803 1.00 0.00 N ATOM 407 CA LEU A 104 9.228 -2.249 4.711 1.00 0.00 C ATOM 408 C LEU A 104 9.608 -2.914 3.392 1.00 0.00 C ATOM 409 O LEU A 104 8.913 -2.764 2.387 1.00 0.00 O ATOM 410 CB LEU A 104 10.193 -1.102 5.014 1.00 0.00 C ATOM 411 CG LEU A 104 10.159 0.079 4.044 1.00 0.00 C ATOM 412 CD1 LEU A 104 8.830 0.812 4.141 1.00 0.00 C ATOM 413 CD2 LEU A 104 11.316 1.029 4.318 1.00 0.00 C ATOM 0 H LEU A 104 9.652 -2.873 6.668 1.00 0.00 H new ATOM 0 HA LEU A 104 8.218 -1.850 4.617 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.979 -0.729 6.016 1.00 0.00 H new ATOM 0 HB3 LEU A 104 11.207 -1.502 5.032 1.00 0.00 H new ATOM 0 HG LEU A 104 10.265 -0.306 3.030 1.00 0.00 H new ATOM 0 HD11 LEU A 104 8.825 1.649 3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.018 0.128 3.893 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.693 1.185 5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.275 1.863 3.618 1.00 0.00 H new ATOM 0 HD22 LEU A 104 11.243 1.407 5.338 1.00 0.00 H new ATOM 0 HD23 LEU A 104 12.260 0.498 4.195 1.00 0.00 H new ATOM 425 N ALA A 105 10.714 -3.650 3.404 1.00 0.00 N ATOM 426 CA ALA A 105 11.184 -4.342 2.210 1.00 0.00 C ATOM 427 C ALA A 105 10.034 -5.038 1.490 1.00 0.00 C ATOM 428 O ALA A 105 9.923 -4.969 0.267 1.00 0.00 O ATOM 429 CB ALA A 105 12.267 -5.346 2.574 1.00 0.00 C ATOM 0 H ALA A 105 11.301 -3.783 4.227 1.00 0.00 H new ATOM 0 HA ALA A 105 11.606 -3.600 1.532 1.00 0.00 H new ATOM 0 HB1 ALA A 105 12.609 -5.855 1.673 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.105 -4.825 3.036 1.00 0.00 H new ATOM 0 HB3 ALA A 105 11.864 -6.078 3.274 1.00 0.00 H new ATOM 435 N ALA A 106 9.181 -5.708 2.258 1.00 0.00 N ATOM 436 CA ALA A 106 8.039 -6.416 1.693 1.00 0.00 C ATOM 437 C ALA A 106 7.215 -5.500 0.795 1.00 0.00 C ATOM 438 O ALA A 106 7.199 -5.662 -0.426 1.00 0.00 O ATOM 439 CB ALA A 106 7.171 -6.989 2.804 1.00 0.00 C ATOM 0 H ALA A 106 9.259 -5.775 3.273 1.00 0.00 H new ATOM 0 HA ALA A 106 8.417 -7.236 1.082 1.00 0.00 H new ATOM 0 HB1 ALA A 106 6.322 -7.515 2.368 1.00 0.00 H new ATOM 0 HB2 ALA A 106 7.759 -7.684 3.404 1.00 0.00 H new ATOM 0 HB3 ALA A 106 6.809 -6.179 3.438 1.00 0.00 H new ATOM 445 N LEU A 107 6.531 -4.539 1.405 1.00 0.00 N ATOM 446 CA LEU A 107 5.704 -3.597 0.660 1.00 0.00 C ATOM 447 C LEU A 107 6.490 -2.970 -0.487 1.00 0.00 C ATOM 448 O LEU A 107 6.135 -3.126 -1.654 1.00 0.00 O ATOM 449 CB LEU A 107 5.178 -2.503 1.591 1.00 0.00 C ATOM 450 CG LEU A 107 4.360 -2.979 2.792 1.00 0.00 C ATOM 451 CD1 LEU A 107 4.296 -1.896 3.857 1.00 0.00 C ATOM 452 CD2 LEU A 107 2.960 -3.385 2.356 1.00 0.00 C ATOM 0 H LEU A 107 6.533 -4.392 2.414 1.00 0.00 H new ATOM 0 HA LEU A 107 4.861 -4.145 0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.028 -1.929 1.960 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.562 -1.820 1.005 1.00 0.00 H new ATOM 0 HG LEU A 107 4.853 -3.852 3.220 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.710 -2.253 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.305 -1.654 4.190 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.827 -1.004 3.441 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.392 -3.721 3.223 1.00 0.00 H new ATOM 0 HD22 LEU A 107 2.458 -2.530 1.902 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.026 -4.195 1.629 1.00 0.00 H new ATOM 464 N ALA A 108 7.562 -2.263 -0.145 1.00 0.00 N ATOM 465 CA ALA A 108 8.402 -1.616 -1.146 1.00 0.00 C ATOM 466 C ALA A 108 8.561 -2.497 -2.381 1.00 0.00 C ATOM 467 O ALA A 108 8.319 -2.057 -3.504 1.00 0.00 O ATOM 468 CB ALA A 108 9.763 -1.280 -0.556 1.00 0.00 C ATOM 0 H ALA A 108 7.869 -2.124 0.818 1.00 0.00 H new ATOM 0 HA ALA A 108 7.913 -0.691 -1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.379 -0.798 -1.315 1.00 0.00 H new ATOM 0 HB2 ALA A 108 9.636 -0.606 0.291 1.00 0.00 H new ATOM 0 HB3 ALA A 108 10.250 -2.196 -0.221 1.00 0.00 H new ATOM 474 N ARG A 109 8.971 -3.743 -2.164 1.00 0.00 N ATOM 475 CA ARG A 109 9.165 -4.685 -3.260 1.00 0.00 C ATOM 476 C ARG A 109 7.878 -4.859 -4.061 1.00 0.00 C ATOM 477 O ARG A 109 7.914 -5.050 -5.276 1.00 0.00 O ATOM 478 CB ARG A 109 9.629 -6.039 -2.720 1.00 0.00 C ATOM 479 CG ARG A 109 10.283 -6.921 -3.771 1.00 0.00 C ATOM 480 CD ARG A 109 11.741 -6.546 -3.984 1.00 0.00 C ATOM 481 NE ARG A 109 12.264 -7.073 -5.242 1.00 0.00 N ATOM 482 CZ ARG A 109 13.560 -7.154 -5.523 1.00 0.00 C ATOM 483 NH1 ARG A 109 14.460 -6.746 -4.640 1.00 0.00 N ATOM 484 NH2 ARG A 109 13.957 -7.646 -6.690 1.00 0.00 N ATOM 0 H ARG A 109 9.175 -4.123 -1.240 1.00 0.00 H new ATOM 0 HA ARG A 109 9.933 -4.282 -3.921 1.00 0.00 H new ATOM 0 HB2 ARG A 109 10.335 -5.874 -1.906 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.773 -6.565 -2.298 1.00 0.00 H new ATOM 0 HG2 ARG A 109 10.216 -7.965 -3.465 1.00 0.00 H new ATOM 0 HG3 ARG A 109 9.741 -6.830 -4.712 1.00 0.00 H new ATOM 0 HD2 ARG A 109 11.841 -5.461 -3.976 1.00 0.00 H new ATOM 0 HD3 ARG A 109 12.338 -6.927 -3.155 1.00 0.00 H new ATOM 0 HE ARG A 109 11.598 -7.397 -5.943 1.00 0.00 H new ATOM 0 HH11 ARG A 109 14.158 -6.369 -3.742 1.00 0.00 H new ATOM 0 HH12 ARG A 109 15.454 -6.809 -4.859 1.00 0.00 H new ATOM 0 HH21 ARG A 109 13.267 -7.962 -7.371 1.00 0.00 H new ATOM 0 HH22 ARG A 109 14.952 -7.708 -6.905 1.00 0.00 H new ATOM 498 N GLU A 110 6.743 -4.792 -3.371 1.00 0.00 N ATOM 499 CA GLU A 110 5.446 -4.944 -4.019 1.00 0.00 C ATOM 500 C GLU A 110 5.074 -3.683 -4.794 1.00 0.00 C ATOM 501 O GLU A 110 4.847 -3.728 -6.003 1.00 0.00 O ATOM 502 CB GLU A 110 4.366 -5.255 -2.981 1.00 0.00 C ATOM 503 CG GLU A 110 4.565 -6.586 -2.276 1.00 0.00 C ATOM 504 CD GLU A 110 4.313 -7.772 -3.187 1.00 0.00 C ATOM 505 OE1 GLU A 110 3.315 -7.745 -3.936 1.00 0.00 O ATOM 506 OE2 GLU A 110 5.117 -8.728 -3.151 1.00 0.00 O ATOM 0 H GLU A 110 6.696 -4.634 -2.364 1.00 0.00 H new ATOM 0 HA GLU A 110 5.515 -5.775 -4.722 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.349 -4.458 -2.237 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.392 -5.255 -3.471 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.583 -6.639 -1.889 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.895 -6.642 -1.418 1.00 0.00 H new ATOM 513 N PHE A 111 5.013 -2.559 -4.088 1.00 0.00 N ATOM 514 CA PHE A 111 4.667 -1.285 -4.708 1.00 0.00 C ATOM 515 C PHE A 111 5.556 -1.009 -5.918 1.00 0.00 C ATOM 516 O PHE A 111 5.083 -0.548 -6.956 1.00 0.00 O ATOM 517 CB PHE A 111 4.800 -0.147 -3.694 1.00 0.00 C ATOM 518 CG PHE A 111 3.639 -0.050 -2.746 1.00 0.00 C ATOM 519 CD1 PHE A 111 3.460 -0.996 -1.750 1.00 0.00 C ATOM 520 CD2 PHE A 111 2.727 0.987 -2.851 1.00 0.00 C ATOM 521 CE1 PHE A 111 2.392 -0.910 -0.877 1.00 0.00 C ATOM 522 CE2 PHE A 111 1.657 1.079 -1.980 1.00 0.00 C ATOM 523 CZ PHE A 111 1.490 0.130 -0.991 1.00 0.00 C ATOM 0 H PHE A 111 5.199 -2.504 -3.087 1.00 0.00 H new ATOM 0 HA PHE A 111 3.632 -1.343 -5.045 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.716 -0.287 -3.121 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.901 0.797 -4.230 1.00 0.00 H new ATOM 0 HD1 PHE A 111 4.163 -1.810 -1.655 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.853 1.733 -3.622 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.263 -1.655 -0.106 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.953 1.892 -2.073 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.656 0.201 -0.308 1.00 0.00 H new ATOM 533 N ASP A 112 6.845 -1.295 -5.774 1.00 0.00 N ATOM 534 CA ASP A 112 7.801 -1.080 -6.854 1.00 0.00 C ATOM 535 C ASP A 112 7.299 -1.697 -8.155 1.00 0.00 C ATOM 536 O ASP A 112 7.260 -1.036 -9.193 1.00 0.00 O ATOM 537 CB ASP A 112 9.162 -1.672 -6.485 1.00 0.00 C ATOM 538 CG ASP A 112 10.280 -1.145 -7.363 1.00 0.00 C ATOM 539 OD1 ASP A 112 10.065 -1.021 -8.586 1.00 0.00 O ATOM 540 OD2 ASP A 112 11.370 -0.857 -6.826 1.00 0.00 O ATOM 0 H ASP A 112 7.252 -1.676 -4.920 1.00 0.00 H new ATOM 0 HA ASP A 112 7.910 -0.005 -7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.384 -1.443 -5.443 1.00 0.00 H new ATOM 0 HB3 ASP A 112 9.118 -2.758 -6.570 1.00 0.00 H new ATOM 545 N ARG A 113 6.917 -2.969 -8.092 1.00 0.00 N ATOM 546 CA ARG A 113 6.420 -3.676 -9.266 1.00 0.00 C ATOM 547 C ARG A 113 5.588 -2.749 -10.148 1.00 0.00 C ATOM 548 O ARG A 113 5.978 -2.427 -11.270 1.00 0.00 O ATOM 549 CB ARG A 113 5.582 -4.884 -8.843 1.00 0.00 C ATOM 550 CG ARG A 113 6.354 -5.905 -8.025 1.00 0.00 C ATOM 551 CD ARG A 113 5.431 -6.957 -7.431 1.00 0.00 C ATOM 552 NE ARG A 113 4.881 -7.844 -8.453 1.00 0.00 N ATOM 553 CZ ARG A 113 5.557 -8.854 -8.990 1.00 0.00 C ATOM 554 NH1 ARG A 113 6.800 -9.104 -8.603 1.00 0.00 N ATOM 555 NH2 ARG A 113 4.988 -9.616 -9.915 1.00 0.00 N ATOM 0 H ARG A 113 6.942 -3.530 -7.241 1.00 0.00 H new ATOM 0 HA ARG A 113 7.279 -4.022 -9.841 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.727 -4.537 -8.262 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.185 -5.370 -9.734 1.00 0.00 H new ATOM 0 HG2 ARG A 113 7.100 -6.389 -8.655 1.00 0.00 H new ATOM 0 HG3 ARG A 113 6.893 -5.399 -7.224 1.00 0.00 H new ATOM 0 HD2 ARG A 113 5.979 -7.547 -6.696 1.00 0.00 H new ATOM 0 HD3 ARG A 113 4.615 -6.466 -6.901 1.00 0.00 H new ATOM 0 HE ARG A 113 3.926 -7.679 -8.772 1.00 0.00 H new ATOM 0 HH11 ARG A 113 7.240 -8.520 -7.891 1.00 0.00 H new ATOM 0 HH12 ARG A 113 7.317 -9.880 -9.017 1.00 0.00 H new ATOM 0 HH21 ARG A 113 4.031 -9.427 -10.214 1.00 0.00 H new ATOM 0 HH22 ARG A 113 5.507 -10.391 -10.327 1.00 0.00 H new ATOM 569 N PHE A 114 4.439 -2.324 -9.632 1.00 0.00 N ATOM 570 CA PHE A 114 3.551 -1.436 -10.372 1.00 0.00 C ATOM 571 C PHE A 114 4.347 -0.366 -11.114 1.00 0.00 C ATOM 572 O PHE A 114 4.234 -0.225 -12.331 1.00 0.00 O ATOM 573 CB PHE A 114 2.548 -0.776 -9.424 1.00 0.00 C ATOM 574 CG PHE A 114 1.614 -1.751 -8.766 1.00 0.00 C ATOM 575 CD1 PHE A 114 0.551 -2.295 -9.470 1.00 0.00 C ATOM 576 CD2 PHE A 114 1.799 -2.125 -7.445 1.00 0.00 C ATOM 577 CE1 PHE A 114 -0.310 -3.191 -8.867 1.00 0.00 C ATOM 578 CE2 PHE A 114 0.941 -3.021 -6.837 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.115 -3.556 -7.549 1.00 0.00 C ATOM 0 H PHE A 114 4.102 -2.581 -8.704 1.00 0.00 H new ATOM 0 HA PHE A 114 3.008 -2.034 -11.104 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.093 -0.231 -8.653 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.963 -0.043 -9.980 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.394 -2.015 -10.501 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.624 -1.711 -6.884 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.136 -3.606 -9.426 1.00 0.00 H new ATOM 0 HE2 PHE A 114 1.096 -3.303 -5.806 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.786 -4.258 -7.077 1.00 0.00 H new ATOM 589 N GLY A 115 5.152 0.387 -10.370 1.00 0.00 N ATOM 590 CA GLY A 115 5.954 1.435 -10.972 1.00 0.00 C ATOM 591 C GLY A 115 7.161 1.799 -10.130 1.00 0.00 C ATOM 592 O GLY A 115 7.221 1.471 -8.945 1.00 0.00 O ATOM 0 H GLY A 115 5.263 0.289 -9.361 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.287 1.112 -11.958 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.337 2.321 -11.119 1.00 0.00 H new ATOM 596 N SER A 116 8.126 2.476 -10.743 1.00 0.00 N ATOM 597 CA SER A 116 9.341 2.879 -10.044 1.00 0.00 C ATOM 598 C SER A 116 9.017 3.840 -8.904 1.00 0.00 C ATOM 599 O SER A 116 8.487 4.929 -9.127 1.00 0.00 O ATOM 600 CB SER A 116 10.321 3.536 -11.017 1.00 0.00 C ATOM 601 OG SER A 116 10.635 2.665 -12.090 1.00 0.00 O ATOM 0 H SER A 116 8.090 2.757 -11.723 1.00 0.00 H new ATOM 0 HA SER A 116 9.803 1.985 -9.624 1.00 0.00 H new ATOM 0 HB2 SER A 116 9.889 4.457 -11.407 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.234 3.811 -10.489 1.00 0.00 H new ATOM 0 HG SER A 116 11.262 3.109 -12.699 1.00 0.00 H new ATOM 607 N ILE A 117 9.339 3.428 -7.682 1.00 0.00 N ATOM 608 CA ILE A 117 9.084 4.252 -6.507 1.00 0.00 C ATOM 609 C ILE A 117 10.150 5.332 -6.351 1.00 0.00 C ATOM 610 O ILE A 117 11.347 5.047 -6.388 1.00 0.00 O ATOM 611 CB ILE A 117 9.039 3.403 -5.223 1.00 0.00 C ATOM 612 CG1 ILE A 117 7.960 2.324 -5.338 1.00 0.00 C ATOM 613 CG2 ILE A 117 8.784 4.287 -4.012 1.00 0.00 C ATOM 614 CD1 ILE A 117 8.114 1.205 -4.331 1.00 0.00 C ATOM 0 H ILE A 117 9.777 2.529 -7.480 1.00 0.00 H new ATOM 0 HA ILE A 117 8.112 4.722 -6.657 1.00 0.00 H new ATOM 0 HB ILE A 117 10.004 2.914 -5.094 1.00 0.00 H new ATOM 0 HG12 ILE A 117 6.981 2.786 -5.209 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.984 1.903 -6.343 1.00 0.00 H new ATOM 0 HG21 ILE A 117 8.755 3.672 -3.112 1.00 0.00 H new ATOM 0 HG22 ILE A 117 9.584 5.022 -3.923 1.00 0.00 H new ATOM 0 HG23 ILE A 117 7.830 4.801 -4.131 1.00 0.00 H new ATOM 0 HD11 ILE A 117 7.315 0.477 -4.471 1.00 0.00 H new ATOM 0 HD12 ILE A 117 9.078 0.717 -4.473 1.00 0.00 H new ATOM 0 HD13 ILE A 117 8.060 1.614 -3.322 1.00 0.00 H new ATOM 626 N ARG A 118 9.706 6.572 -6.174 1.00 0.00 N ATOM 627 CA ARG A 118 10.621 7.695 -6.011 1.00 0.00 C ATOM 628 C ARG A 118 11.344 7.617 -4.670 1.00 0.00 C ATOM 629 O ARG A 118 12.574 7.624 -4.613 1.00 0.00 O ATOM 630 CB ARG A 118 9.862 9.019 -6.118 1.00 0.00 C ATOM 631 CG ARG A 118 10.755 10.244 -6.003 1.00 0.00 C ATOM 632 CD ARG A 118 10.070 11.486 -6.552 1.00 0.00 C ATOM 633 NE ARG A 118 10.307 11.653 -7.983 1.00 0.00 N ATOM 634 CZ ARG A 118 9.750 12.614 -8.713 1.00 0.00 C ATOM 635 NH1 ARG A 118 8.929 13.488 -8.148 1.00 0.00 N ATOM 636 NH2 ARG A 118 10.014 12.701 -10.010 1.00 0.00 N ATOM 0 H ARG A 118 8.718 6.824 -6.140 1.00 0.00 H new ATOM 0 HA ARG A 118 11.363 7.645 -6.808 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.337 9.051 -7.073 1.00 0.00 H new ATOM 0 HB3 ARG A 118 9.104 9.058 -5.336 1.00 0.00 H new ATOM 0 HG2 ARG A 118 11.020 10.405 -4.958 1.00 0.00 H new ATOM 0 HG3 ARG A 118 11.685 10.070 -6.545 1.00 0.00 H new ATOM 0 HD2 ARG A 118 8.998 11.420 -6.367 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.432 12.365 -6.019 1.00 0.00 H new ATOM 0 HE ARG A 118 10.934 10.996 -8.448 1.00 0.00 H new ATOM 0 HH11 ARG A 118 8.724 13.424 -7.151 1.00 0.00 H new ATOM 0 HH12 ARG A 118 8.503 14.225 -8.710 1.00 0.00 H new ATOM 0 HH21 ARG A 118 10.645 12.030 -10.448 1.00 0.00 H new ATOM 0 HH22 ARG A 118 9.586 13.439 -10.569 1.00 0.00 H new ATOM 650 N THR A 119 10.572 7.544 -3.590 1.00 0.00 N ATOM 651 CA THR A 119 11.137 7.467 -2.249 1.00 0.00 C ATOM 652 C THR A 119 10.092 7.012 -1.237 1.00 0.00 C ATOM 653 O THR A 119 8.890 7.098 -1.491 1.00 0.00 O ATOM 654 CB THR A 119 11.712 8.824 -1.803 1.00 0.00 C ATOM 655 OG1 THR A 119 12.233 8.722 -0.473 1.00 0.00 O ATOM 656 CG2 THR A 119 10.644 9.907 -1.853 1.00 0.00 C ATOM 0 H THR A 119 9.552 7.537 -3.619 1.00 0.00 H new ATOM 0 HA THR A 119 11.943 6.735 -2.287 1.00 0.00 H new ATOM 0 HB THR A 119 12.515 9.096 -2.488 1.00 0.00 H new ATOM 0 HG1 THR A 119 12.598 9.589 -0.197 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.073 10.857 -1.534 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.270 10.002 -2.872 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.822 9.639 -1.189 1.00 0.00 H new ATOM 664 N ILE A 120 10.557 6.531 -0.089 1.00 0.00 N ATOM 665 CA ILE A 120 9.661 6.065 0.962 1.00 0.00 C ATOM 666 C ILE A 120 10.113 6.563 2.330 1.00 0.00 C ATOM 667 O ILE A 120 11.307 6.734 2.576 1.00 0.00 O ATOM 668 CB ILE A 120 9.577 4.527 0.989 1.00 0.00 C ATOM 669 CG1 ILE A 120 9.066 3.999 -0.353 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.674 4.067 2.124 1.00 0.00 C ATOM 671 CD1 ILE A 120 9.149 2.494 -0.480 1.00 0.00 C ATOM 0 H ILE A 120 11.549 6.454 0.137 1.00 0.00 H new ATOM 0 HA ILE A 120 8.674 6.470 0.739 1.00 0.00 H new ATOM 0 HB ILE A 120 10.576 4.125 1.159 1.00 0.00 H new ATOM 0 HG12 ILE A 120 8.030 4.310 -0.486 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.642 4.456 -1.158 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.624 2.978 2.131 1.00 0.00 H new ATOM 0 HG22 ILE A 120 9.077 4.418 3.074 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.673 4.475 1.981 1.00 0.00 H new ATOM 0 HD11 ILE A 120 8.770 2.190 -1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.187 2.177 -0.379 1.00 0.00 H new ATOM 0 HD13 ILE A 120 8.550 2.029 0.303 1.00 0.00 H new ATOM 683 N ASP A 121 9.152 6.791 3.218 1.00 0.00 N ATOM 684 CA ASP A 121 9.451 7.267 4.564 1.00 0.00 C ATOM 685 C ASP A 121 9.753 6.099 5.498 1.00 0.00 C ATOM 686 O ASP A 121 9.089 5.063 5.449 1.00 0.00 O ATOM 687 CB ASP A 121 8.280 8.084 5.111 1.00 0.00 C ATOM 688 CG ASP A 121 8.393 9.557 4.771 1.00 0.00 C ATOM 689 OD1 ASP A 121 9.518 10.014 4.478 1.00 0.00 O ATOM 690 OD2 ASP A 121 7.356 10.253 4.797 1.00 0.00 O ATOM 0 H ASP A 121 8.159 6.654 3.030 1.00 0.00 H new ATOM 0 HA ASP A 121 10.334 7.904 4.510 1.00 0.00 H new ATOM 0 HB2 ASP A 121 7.347 7.691 4.707 1.00 0.00 H new ATOM 0 HB3 ASP A 121 8.233 7.967 6.194 1.00 0.00 H new ATOM 695 N HIS A 122 10.760 6.273 6.348 1.00 0.00 N ATOM 696 CA HIS A 122 11.151 5.234 7.294 1.00 0.00 C ATOM 697 C HIS A 122 10.810 5.644 8.724 1.00 0.00 C ATOM 698 O HIS A 122 11.352 6.618 9.247 1.00 0.00 O ATOM 699 CB HIS A 122 12.647 4.944 7.176 1.00 0.00 C ATOM 700 CG HIS A 122 13.036 3.586 7.673 1.00 0.00 C ATOM 701 ND1 HIS A 122 13.220 2.504 6.839 1.00 0.00 N ATOM 702 CD2 HIS A 122 13.276 3.137 8.928 1.00 0.00 C ATOM 703 CE1 HIS A 122 13.556 1.448 7.559 1.00 0.00 C ATOM 704 NE2 HIS A 122 13.597 1.806 8.830 1.00 0.00 N ATOM 0 H HIS A 122 11.320 7.124 6.401 1.00 0.00 H new ATOM 0 HA HIS A 122 10.594 4.329 7.052 1.00 0.00 H new ATOM 0 HB2 HIS A 122 12.946 5.039 6.132 1.00 0.00 H new ATOM 0 HB3 HIS A 122 13.200 5.699 7.735 1.00 0.00 H new ATOM 0 HD2 HIS A 122 13.224 3.718 9.837 1.00 0.00 H new ATOM 0 HE1 HIS A 122 13.762 0.460 7.174 1.00 0.00 H new ATOM 0 HE2 HIS A 122 13.829 1.193 9.611 1.00 0.00 H new ATOM 713 N VAL A 123 9.909 4.895 9.350 1.00 0.00 N ATOM 714 CA VAL A 123 9.496 5.180 10.719 1.00 0.00 C ATOM 715 C VAL A 123 8.629 4.057 11.277 1.00 0.00 C ATOM 716 O VAL A 123 7.622 3.678 10.678 1.00 0.00 O ATOM 717 CB VAL A 123 8.718 6.506 10.806 1.00 0.00 C ATOM 718 CG1 VAL A 123 7.452 6.438 9.967 1.00 0.00 C ATOM 719 CG2 VAL A 123 8.391 6.838 12.254 1.00 0.00 C ATOM 0 H VAL A 123 9.451 4.086 8.931 1.00 0.00 H new ATOM 0 HA VAL A 123 10.406 5.262 11.313 1.00 0.00 H new ATOM 0 HB VAL A 123 9.346 7.303 10.408 1.00 0.00 H new ATOM 0 HG11 VAL A 123 6.915 7.384 10.041 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.715 6.250 8.926 1.00 0.00 H new ATOM 0 HG13 VAL A 123 6.817 5.631 10.332 1.00 0.00 H new ATOM 0 HG21 VAL A 123 7.841 7.778 12.296 1.00 0.00 H new ATOM 0 HG22 VAL A 123 7.782 6.042 12.681 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.316 6.932 12.823 1.00 0.00 H new ATOM 729 N LYS A 124 9.026 3.528 12.430 1.00 0.00 N ATOM 730 CA LYS A 124 8.285 2.448 13.072 1.00 0.00 C ATOM 731 C LYS A 124 7.232 3.004 14.025 1.00 0.00 C ATOM 732 O LYS A 124 6.050 2.678 13.918 1.00 0.00 O ATOM 733 CB LYS A 124 9.242 1.527 13.832 1.00 0.00 C ATOM 734 CG LYS A 124 8.613 0.209 14.250 1.00 0.00 C ATOM 735 CD LYS A 124 9.306 -0.378 15.469 1.00 0.00 C ATOM 736 CE LYS A 124 9.166 -1.891 15.515 1.00 0.00 C ATOM 737 NZ LYS A 124 9.953 -2.488 16.630 1.00 0.00 N ATOM 0 H LYS A 124 9.857 3.830 12.939 1.00 0.00 H new ATOM 0 HA LYS A 124 7.780 1.874 12.295 1.00 0.00 H new ATOM 0 HB2 LYS A 124 10.111 1.323 13.206 1.00 0.00 H new ATOM 0 HB3 LYS A 124 9.604 2.045 14.720 1.00 0.00 H new ATOM 0 HG2 LYS A 124 7.556 0.363 14.470 1.00 0.00 H new ATOM 0 HG3 LYS A 124 8.667 -0.499 13.423 1.00 0.00 H new ATOM 0 HD2 LYS A 124 10.362 -0.110 15.453 1.00 0.00 H new ATOM 0 HD3 LYS A 124 8.881 0.055 16.374 1.00 0.00 H new ATOM 0 HE2 LYS A 124 8.115 -2.155 15.631 1.00 0.00 H new ATOM 0 HE3 LYS A 124 9.499 -2.315 14.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 9.831 -3.521 16.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.960 -2.258 16.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 9.619 -2.103 17.536 1.00 0.00 H new ATOM 751 N GLY A 125 7.669 3.845 14.957 1.00 0.00 N ATOM 752 CA GLY A 125 6.751 4.433 15.915 1.00 0.00 C ATOM 753 C GLY A 125 5.505 4.991 15.256 1.00 0.00 C ATOM 754 O GLY A 125 4.392 4.547 15.541 1.00 0.00 O ATOM 0 H GLY A 125 8.642 4.130 15.066 1.00 0.00 H new ATOM 0 HA2 GLY A 125 6.464 3.679 16.648 1.00 0.00 H new ATOM 0 HA3 GLY A 125 7.259 5.230 16.459 1.00 0.00 H new ATOM 758 N ASP A 126 5.690 5.968 14.375 1.00 0.00 N ATOM 759 CA ASP A 126 4.572 6.588 13.675 1.00 0.00 C ATOM 760 C ASP A 126 3.569 5.536 13.212 1.00 0.00 C ATOM 761 O ASP A 126 2.359 5.755 13.256 1.00 0.00 O ATOM 762 CB ASP A 126 5.077 7.392 12.475 1.00 0.00 C ATOM 763 CG ASP A 126 5.530 8.786 12.862 1.00 0.00 C ATOM 764 OD1 ASP A 126 5.971 8.967 14.015 1.00 0.00 O ATOM 765 OD2 ASP A 126 5.442 9.696 12.011 1.00 0.00 O ATOM 0 H ASP A 126 6.604 6.348 14.129 1.00 0.00 H new ATOM 0 HA ASP A 126 4.070 7.262 14.369 1.00 0.00 H new ATOM 0 HB2 ASP A 126 5.906 6.860 12.008 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.284 7.464 11.730 1.00 0.00 H new ATOM 770 N SER A 127 4.082 4.392 12.767 1.00 0.00 N ATOM 771 CA SER A 127 3.232 3.307 12.292 1.00 0.00 C ATOM 772 C SER A 127 2.574 3.674 10.965 1.00 0.00 C ATOM 773 O SER A 127 1.460 3.242 10.671 1.00 0.00 O ATOM 774 CB SER A 127 2.159 2.978 13.332 1.00 0.00 C ATOM 775 OG SER A 127 2.717 2.899 14.632 1.00 0.00 O ATOM 0 H SER A 127 5.082 4.194 12.726 1.00 0.00 H new ATOM 0 HA SER A 127 3.859 2.429 12.137 1.00 0.00 H new ATOM 0 HB2 SER A 127 1.382 3.742 13.312 1.00 0.00 H new ATOM 0 HB3 SER A 127 1.681 2.031 13.080 1.00 0.00 H new ATOM 0 HG SER A 127 2.918 3.801 14.957 1.00 0.00 H new ATOM 781 N PHE A 128 3.273 4.475 10.167 1.00 0.00 N ATOM 782 CA PHE A 128 2.757 4.903 8.872 1.00 0.00 C ATOM 783 C PHE A 128 3.883 5.426 7.984 1.00 0.00 C ATOM 784 O PHE A 128 4.834 6.040 8.467 1.00 0.00 O ATOM 785 CB PHE A 128 1.692 5.985 9.054 1.00 0.00 C ATOM 786 CG PHE A 128 2.241 7.286 9.568 1.00 0.00 C ATOM 787 CD1 PHE A 128 3.079 8.058 8.781 1.00 0.00 C ATOM 788 CD2 PHE A 128 1.918 7.736 10.838 1.00 0.00 C ATOM 789 CE1 PHE A 128 3.586 9.256 9.250 1.00 0.00 C ATOM 790 CE2 PHE A 128 2.421 8.932 11.313 1.00 0.00 C ATOM 791 CZ PHE A 128 3.257 9.693 10.518 1.00 0.00 C ATOM 0 H PHE A 128 4.198 4.840 10.394 1.00 0.00 H new ATOM 0 HA PHE A 128 2.306 4.038 8.386 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.197 6.161 8.099 1.00 0.00 H new ATOM 0 HB3 PHE A 128 0.931 5.622 9.745 1.00 0.00 H new ATOM 0 HD1 PHE A 128 3.340 7.720 7.789 1.00 0.00 H new ATOM 0 HD2 PHE A 128 1.266 7.145 11.464 1.00 0.00 H new ATOM 0 HE1 PHE A 128 4.238 9.849 8.626 1.00 0.00 H new ATOM 0 HE2 PHE A 128 2.161 9.272 12.305 1.00 0.00 H new ATOM 0 HZ PHE A 128 3.652 10.628 10.888 1.00 0.00 H new ATOM 801 N ALA A 129 3.768 5.177 6.684 1.00 0.00 N ATOM 802 CA ALA A 129 4.774 5.623 5.729 1.00 0.00 C ATOM 803 C ALA A 129 4.124 6.229 4.489 1.00 0.00 C ATOM 804 O ALA A 129 2.906 6.165 4.321 1.00 0.00 O ATOM 805 CB ALA A 129 5.682 4.466 5.339 1.00 0.00 C ATOM 0 H ALA A 129 2.988 4.669 6.268 1.00 0.00 H new ATOM 0 HA ALA A 129 5.375 6.397 6.207 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.429 4.814 4.625 1.00 0.00 H new ATOM 0 HB2 ALA A 129 6.182 4.080 6.228 1.00 0.00 H new ATOM 0 HB3 ALA A 129 5.087 3.674 4.885 1.00 0.00 H new ATOM 811 N TYR A 130 4.943 6.816 3.624 1.00 0.00 N ATOM 812 CA TYR A 130 4.447 7.436 2.402 1.00 0.00 C ATOM 813 C TYR A 130 5.282 7.012 1.198 1.00 0.00 C ATOM 814 O TYR A 130 6.492 7.237 1.157 1.00 0.00 O ATOM 815 CB TYR A 130 4.462 8.960 2.535 1.00 0.00 C ATOM 816 CG TYR A 130 3.377 9.500 3.439 1.00 0.00 C ATOM 817 CD1 TYR A 130 3.542 9.519 4.819 1.00 0.00 C ATOM 818 CD2 TYR A 130 2.187 9.989 2.915 1.00 0.00 C ATOM 819 CE1 TYR A 130 2.553 10.011 5.649 1.00 0.00 C ATOM 820 CE2 TYR A 130 1.194 10.484 3.737 1.00 0.00 C ATOM 821 CZ TYR A 130 1.381 10.492 5.104 1.00 0.00 C ATOM 822 OH TYR A 130 0.393 10.983 5.926 1.00 0.00 O ATOM 0 H TYR A 130 5.954 6.875 3.747 1.00 0.00 H new ATOM 0 HA TYR A 130 3.421 7.101 2.246 1.00 0.00 H new ATOM 0 HB2 TYR A 130 5.433 9.273 2.919 1.00 0.00 H new ATOM 0 HB3 TYR A 130 4.353 9.404 1.545 1.00 0.00 H new ATOM 0 HD1 TYR A 130 4.458 9.143 5.250 1.00 0.00 H new ATOM 0 HD2 TYR A 130 2.036 9.982 1.846 1.00 0.00 H new ATOM 0 HE1 TYR A 130 2.697 10.019 6.719 1.00 0.00 H new ATOM 0 HE2 TYR A 130 0.276 10.863 3.312 1.00 0.00 H new ATOM 0 HH TYR A 130 -0.366 11.283 5.383 1.00 0.00 H new ATOM 832 N ILE A 131 4.627 6.396 0.219 1.00 0.00 N ATOM 833 CA ILE A 131 5.308 5.941 -0.987 1.00 0.00 C ATOM 834 C ILE A 131 4.975 6.836 -2.176 1.00 0.00 C ATOM 835 O ILE A 131 3.826 7.234 -2.363 1.00 0.00 O ATOM 836 CB ILE A 131 4.932 4.488 -1.331 1.00 0.00 C ATOM 837 CG1 ILE A 131 5.193 3.574 -0.132 1.00 0.00 C ATOM 838 CG2 ILE A 131 5.714 4.012 -2.546 1.00 0.00 C ATOM 839 CD1 ILE A 131 4.609 2.187 -0.291 1.00 0.00 C ATOM 0 H ILE A 131 3.626 6.201 0.238 1.00 0.00 H new ATOM 0 HA ILE A 131 6.378 5.992 -0.785 1.00 0.00 H new ATOM 0 HB ILE A 131 3.869 4.450 -1.569 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.269 3.491 0.024 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.776 4.035 0.763 1.00 0.00 H new ATOM 0 HG21 ILE A 131 5.437 2.983 -2.777 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.484 4.650 -3.399 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.782 4.061 -2.334 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.832 1.594 0.596 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.529 2.259 -0.416 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.045 1.707 -1.167 1.00 0.00 H new ATOM 851 N GLN A 132 5.989 7.146 -2.978 1.00 0.00 N ATOM 852 CA GLN A 132 5.803 7.992 -4.151 1.00 0.00 C ATOM 853 C GLN A 132 6.168 7.241 -5.428 1.00 0.00 C ATOM 854 O GLN A 132 7.048 6.380 -5.423 1.00 0.00 O ATOM 855 CB GLN A 132 6.651 9.260 -4.031 1.00 0.00 C ATOM 856 CG GLN A 132 6.579 10.158 -5.255 1.00 0.00 C ATOM 857 CD GLN A 132 6.926 11.600 -4.942 1.00 0.00 C ATOM 858 OE1 GLN A 132 7.402 11.913 -3.851 1.00 0.00 O ATOM 859 NE2 GLN A 132 6.687 12.488 -5.900 1.00 0.00 N ATOM 0 H GLN A 132 6.947 6.824 -2.837 1.00 0.00 H new ATOM 0 HA GLN A 132 4.750 8.271 -4.203 1.00 0.00 H new ATOM 0 HB2 GLN A 132 6.325 9.824 -3.157 1.00 0.00 H new ATOM 0 HB3 GLN A 132 7.690 8.978 -3.858 1.00 0.00 H new ATOM 0 HG2 GLN A 132 7.261 9.782 -6.018 1.00 0.00 H new ATOM 0 HG3 GLN A 132 5.574 10.113 -5.675 1.00 0.00 H new ATOM 0 HE21 GLN A 132 6.291 12.184 -6.790 1.00 0.00 H new ATOM 0 HE22 GLN A 132 6.899 13.474 -5.746 1.00 0.00 H new ATOM 868 N TYR A 133 5.486 7.573 -6.518 1.00 0.00 N ATOM 869 CA TYR A 133 5.737 6.928 -7.802 1.00 0.00 C ATOM 870 C TYR A 133 6.249 7.935 -8.827 1.00 0.00 C ATOM 871 O TYR A 133 5.924 9.120 -8.763 1.00 0.00 O ATOM 872 CB TYR A 133 4.461 6.261 -8.319 1.00 0.00 C ATOM 873 CG TYR A 133 4.184 4.914 -7.690 1.00 0.00 C ATOM 874 CD1 TYR A 133 4.759 3.756 -8.201 1.00 0.00 C ATOM 875 CD2 TYR A 133 3.348 4.798 -6.587 1.00 0.00 C ATOM 876 CE1 TYR A 133 4.509 2.523 -7.630 1.00 0.00 C ATOM 877 CE2 TYR A 133 3.093 3.569 -6.009 1.00 0.00 C ATOM 878 CZ TYR A 133 3.676 2.435 -6.535 1.00 0.00 C ATOM 879 OH TYR A 133 3.424 1.209 -5.963 1.00 0.00 O ATOM 0 H TYR A 133 4.755 8.284 -6.539 1.00 0.00 H new ATOM 0 HA TYR A 133 6.503 6.167 -7.654 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.614 6.921 -8.131 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.537 6.139 -9.400 1.00 0.00 H new ATOM 0 HD1 TYR A 133 5.412 3.821 -9.059 1.00 0.00 H new ATOM 0 HD2 TYR A 133 2.889 5.684 -6.174 1.00 0.00 H new ATOM 0 HE1 TYR A 133 4.964 1.633 -8.039 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.441 3.497 -5.151 1.00 0.00 H new ATOM 0 HH TYR A 133 3.689 0.498 -6.583 1.00 0.00 H new ATOM 889 N GLU A 134 7.051 7.453 -9.771 1.00 0.00 N ATOM 890 CA GLU A 134 7.608 8.311 -10.810 1.00 0.00 C ATOM 891 C GLU A 134 6.523 8.761 -11.784 1.00 0.00 C ATOM 892 O GLU A 134 6.675 9.767 -12.477 1.00 0.00 O ATOM 893 CB GLU A 134 8.717 7.577 -11.568 1.00 0.00 C ATOM 894 CG GLU A 134 10.067 7.629 -10.873 1.00 0.00 C ATOM 895 CD GLU A 134 11.227 7.535 -11.844 1.00 0.00 C ATOM 896 OE1 GLU A 134 11.294 8.367 -12.773 1.00 0.00 O ATOM 897 OE2 GLU A 134 12.069 6.628 -11.675 1.00 0.00 O ATOM 0 H GLU A 134 7.329 6.474 -9.838 1.00 0.00 H new ATOM 0 HA GLU A 134 8.029 9.194 -10.329 1.00 0.00 H new ATOM 0 HB2 GLU A 134 8.426 6.535 -11.701 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.813 8.011 -12.563 1.00 0.00 H new ATOM 0 HG2 GLU A 134 10.145 8.558 -10.308 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.133 6.812 -10.154 1.00 0.00 H new ATOM 904 N SER A 135 5.429 8.009 -11.830 1.00 0.00 N ATOM 905 CA SER A 135 4.320 8.327 -12.722 1.00 0.00 C ATOM 906 C SER A 135 2.992 8.295 -11.971 1.00 0.00 C ATOM 907 O SER A 135 2.734 7.386 -11.181 1.00 0.00 O ATOM 908 CB SER A 135 4.280 7.342 -13.892 1.00 0.00 C ATOM 909 OG SER A 135 4.711 6.054 -13.490 1.00 0.00 O ATOM 0 H SER A 135 5.286 7.175 -11.260 1.00 0.00 H new ATOM 0 HA SER A 135 4.475 9.334 -13.109 1.00 0.00 H new ATOM 0 HB2 SER A 135 3.266 7.283 -14.287 1.00 0.00 H new ATOM 0 HB3 SER A 135 4.915 7.706 -14.699 1.00 0.00 H new ATOM 0 HG SER A 135 4.674 5.443 -14.255 1.00 0.00 H new ATOM 915 N LEU A 136 2.154 9.295 -12.222 1.00 0.00 N ATOM 916 CA LEU A 136 0.852 9.383 -11.570 1.00 0.00 C ATOM 917 C LEU A 136 0.027 8.127 -11.828 1.00 0.00 C ATOM 918 O LEU A 136 -0.469 7.494 -10.895 1.00 0.00 O ATOM 919 CB LEU A 136 0.094 10.616 -12.066 1.00 0.00 C ATOM 920 CG LEU A 136 -1.082 11.073 -11.202 1.00 0.00 C ATOM 921 CD1 LEU A 136 -1.819 12.223 -11.870 1.00 0.00 C ATOM 922 CD2 LEU A 136 -2.030 9.913 -10.935 1.00 0.00 C ATOM 0 H LEU A 136 2.353 10.056 -12.872 1.00 0.00 H new ATOM 0 HA LEU A 136 1.016 9.472 -10.496 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.800 11.442 -12.150 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.277 10.410 -13.070 1.00 0.00 H new ATOM 0 HG LEU A 136 -0.692 11.424 -10.247 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.653 12.535 -11.241 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -1.136 13.061 -12.009 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -2.197 11.898 -12.839 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -2.861 10.257 -10.319 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.414 9.531 -11.881 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -1.496 9.119 -10.413 1.00 0.00 H new ATOM 934 N ASP A 137 -0.114 7.769 -13.100 1.00 0.00 N ATOM 935 CA ASP A 137 -0.877 6.586 -13.481 1.00 0.00 C ATOM 936 C ASP A 137 -0.415 5.365 -12.692 1.00 0.00 C ATOM 937 O ASP A 137 -1.228 4.542 -12.271 1.00 0.00 O ATOM 938 CB ASP A 137 -0.734 6.323 -14.981 1.00 0.00 C ATOM 939 CG ASP A 137 -0.939 7.576 -15.811 1.00 0.00 C ATOM 940 OD1 ASP A 137 -2.106 7.903 -16.113 1.00 0.00 O ATOM 941 OD2 ASP A 137 0.067 8.229 -16.156 1.00 0.00 O ATOM 0 H ASP A 137 0.290 8.281 -13.884 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.926 6.770 -13.250 1.00 0.00 H new ATOM 0 HB2 ASP A 137 0.257 5.915 -15.183 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -1.458 5.567 -15.285 1.00 0.00 H new ATOM 946 N ALA A 138 0.895 5.253 -12.497 1.00 0.00 N ATOM 947 CA ALA A 138 1.464 4.133 -11.758 1.00 0.00 C ATOM 948 C ALA A 138 0.982 4.128 -10.312 1.00 0.00 C ATOM 949 O ALA A 138 0.695 3.073 -9.747 1.00 0.00 O ATOM 950 CB ALA A 138 2.984 4.184 -11.811 1.00 0.00 C ATOM 0 H ALA A 138 1.582 5.924 -12.841 1.00 0.00 H new ATOM 0 HA ALA A 138 1.126 3.210 -12.228 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.396 3.342 -11.255 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.314 4.130 -12.848 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.332 5.117 -11.367 1.00 0.00 H new ATOM 956 N ALA A 139 0.897 5.314 -9.717 1.00 0.00 N ATOM 957 CA ALA A 139 0.449 5.446 -8.336 1.00 0.00 C ATOM 958 C ALA A 139 -1.014 5.041 -8.193 1.00 0.00 C ATOM 959 O ALA A 139 -1.375 4.297 -7.282 1.00 0.00 O ATOM 960 CB ALA A 139 0.655 6.872 -7.849 1.00 0.00 C ATOM 0 H ALA A 139 1.133 6.197 -10.170 1.00 0.00 H new ATOM 0 HA ALA A 139 1.046 4.774 -7.720 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.316 6.956 -6.816 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.713 7.126 -7.906 1.00 0.00 H new ATOM 0 HB3 ALA A 139 0.083 7.557 -8.475 1.00 0.00 H new ATOM 966 N GLN A 140 -1.851 5.538 -9.098 1.00 0.00 N ATOM 967 CA GLN A 140 -3.276 5.229 -9.070 1.00 0.00 C ATOM 968 C GLN A 140 -3.508 3.723 -9.138 1.00 0.00 C ATOM 969 O GLN A 140 -4.444 3.201 -8.534 1.00 0.00 O ATOM 970 CB GLN A 140 -3.992 5.920 -10.231 1.00 0.00 C ATOM 971 CG GLN A 140 -4.065 7.432 -10.088 1.00 0.00 C ATOM 972 CD GLN A 140 -4.884 8.083 -11.185 1.00 0.00 C ATOM 973 OE1 GLN A 140 -5.955 8.636 -10.931 1.00 0.00 O ATOM 974 NE2 GLN A 140 -4.384 8.022 -12.413 1.00 0.00 N ATOM 0 H GLN A 140 -1.568 6.156 -9.859 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.684 5.599 -8.129 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.478 5.676 -11.161 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.003 5.522 -10.312 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -4.499 7.681 -9.120 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.056 7.843 -10.100 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -3.493 7.554 -12.578 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -4.891 8.443 -13.191 1.00 0.00 H new ATOM 983 N ALA A 141 -2.649 3.030 -9.879 1.00 0.00 N ATOM 984 CA ALA A 141 -2.759 1.584 -10.024 1.00 0.00 C ATOM 985 C ALA A 141 -2.619 0.884 -8.677 1.00 0.00 C ATOM 986 O ALA A 141 -3.525 0.177 -8.237 1.00 0.00 O ATOM 987 CB ALA A 141 -1.710 1.070 -11.000 1.00 0.00 C ATOM 0 H ALA A 141 -1.870 3.447 -10.388 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.749 1.358 -10.419 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.804 -0.011 -11.099 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.859 1.537 -11.973 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.715 1.315 -10.628 1.00 0.00 H new ATOM 993 N ALA A 142 -1.478 1.085 -8.027 1.00 0.00 N ATOM 994 CA ALA A 142 -1.220 0.474 -6.729 1.00 0.00 C ATOM 995 C ALA A 142 -2.250 0.921 -5.697 1.00 0.00 C ATOM 996 O ALA A 142 -2.798 0.103 -4.958 1.00 0.00 O ATOM 997 CB ALA A 142 0.186 0.814 -6.255 1.00 0.00 C ATOM 0 H ALA A 142 -0.717 1.666 -8.378 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.302 -0.607 -6.842 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.365 0.351 -5.284 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.913 0.439 -6.975 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.288 1.895 -6.165 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.508 2.224 -5.652 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.472 2.780 -4.709 1.00 0.00 C ATOM 1005 C CYS A 143 -4.760 1.963 -4.703 1.00 0.00 C ATOM 1006 O CYS A 143 -5.446 1.875 -3.685 1.00 0.00 O ATOM 1007 CB CYS A 143 -3.780 4.236 -5.062 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.721 5.119 -3.796 1.00 0.00 S ATOM 0 H CYS A 143 -2.063 2.914 -6.257 1.00 0.00 H new ATOM 0 HA CYS A 143 -3.033 2.740 -3.712 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -2.842 4.763 -5.236 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.338 4.262 -5.998 1.00 0.00 H new ATOM 0 HG CYS A 143 -5.198 6.219 -4.298 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.083 1.367 -5.846 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.288 0.557 -5.972 1.00 0.00 C ATOM 1016 C ALA A 144 -6.021 -0.890 -5.572 1.00 0.00 C ATOM 1017 O ALA A 144 -6.562 -1.381 -4.581 1.00 0.00 O ATOM 1018 CB ALA A 144 -6.822 0.623 -7.396 1.00 0.00 C ATOM 0 H ALA A 144 -4.526 1.430 -6.698 1.00 0.00 H new ATOM 0 HA ALA A 144 -7.040 0.961 -5.294 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -7.722 0.013 -7.476 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.060 1.656 -7.648 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.067 0.246 -8.086 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.184 -1.569 -6.348 1.00 0.00 N ATOM 1025 CA LYS A 145 -4.844 -2.960 -6.075 1.00 0.00 C ATOM 1026 C LYS A 145 -4.453 -3.148 -4.612 1.00 0.00 C ATOM 1027 O LYS A 145 -5.087 -3.910 -3.883 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.698 -3.415 -6.982 1.00 0.00 C ATOM 1029 CG LYS A 145 -4.165 -4.001 -8.303 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.482 -2.913 -9.315 1.00 0.00 C ATOM 1031 CE LYS A 145 -4.740 -3.495 -10.697 1.00 0.00 C ATOM 1032 NZ LYS A 145 -5.986 -4.310 -10.732 1.00 0.00 N ATOM 0 H LYS A 145 -4.728 -1.178 -7.172 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.725 -3.569 -6.279 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.044 -2.566 -7.181 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -3.102 -4.159 -6.454 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -3.393 -4.658 -8.704 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -5.051 -4.614 -8.137 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -5.357 -2.352 -8.986 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.652 -2.208 -9.365 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -4.815 -2.686 -11.424 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -3.893 -4.113 -10.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -6.144 -4.661 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -5.892 -5.116 -10.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -6.793 -3.723 -10.440 1.00 0.00 H new ATOM 1046 N MET A 146 -3.406 -2.446 -4.190 1.00 0.00 N ATOM 1047 CA MET A 146 -2.933 -2.534 -2.813 1.00 0.00 C ATOM 1048 C MET A 146 -4.099 -2.457 -1.832 1.00 0.00 C ATOM 1049 O MET A 146 -4.195 -3.261 -0.904 1.00 0.00 O ATOM 1050 CB MET A 146 -1.933 -1.414 -2.522 1.00 0.00 C ATOM 1051 CG MET A 146 -0.682 -1.477 -3.385 1.00 0.00 C ATOM 1052 SD MET A 146 0.087 -3.108 -3.374 1.00 0.00 S ATOM 1053 CE MET A 146 0.675 -3.194 -1.685 1.00 0.00 C ATOM 0 H MET A 146 -2.870 -1.811 -4.781 1.00 0.00 H new ATOM 0 HA MET A 146 -2.437 -3.496 -2.687 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.422 -0.452 -2.675 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.643 -1.460 -1.472 1.00 0.00 H new ATOM 0 HG2 MET A 146 -0.938 -1.207 -4.410 1.00 0.00 H new ATOM 0 HG3 MET A 146 0.037 -0.738 -3.031 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.760 -3.299 -1.682 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.398 -2.282 -1.156 1.00 0.00 H new ATOM 0 HE3 MET A 146 0.226 -4.053 -1.187 1.00 0.00 H new ATOM 1063 N ARG A 147 -4.982 -1.487 -2.044 1.00 0.00 N ATOM 1064 CA ARG A 147 -6.140 -1.305 -1.177 1.00 0.00 C ATOM 1065 C ARG A 147 -6.705 -2.652 -0.734 1.00 0.00 C ATOM 1066 O ARG A 147 -7.137 -3.456 -1.559 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.222 -0.499 -1.897 1.00 0.00 C ATOM 1068 CG ARG A 147 -8.081 0.338 -0.964 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.133 1.124 -1.730 1.00 0.00 C ATOM 1070 NE ARG A 147 -10.139 0.252 -2.331 1.00 0.00 N ATOM 1071 CZ ARG A 147 -9.990 -0.337 -3.512 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -8.882 -0.148 -4.215 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -10.951 -1.116 -3.992 1.00 0.00 N ATOM 0 H ARG A 147 -4.918 -0.815 -2.809 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.816 -0.757 -0.292 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.749 0.157 -2.627 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.864 -1.183 -2.452 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -8.568 -0.311 -0.236 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -7.448 1.026 -0.404 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.620 1.829 -1.056 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -8.649 1.711 -2.511 1.00 0.00 H new ATOM 0 HE ARG A 147 -11.003 0.086 -1.815 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -8.142 0.451 -3.849 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -8.770 -0.601 -5.122 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.805 -1.263 -3.454 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -10.836 -1.568 -4.899 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.696 -2.891 0.574 1.00 0.00 N ATOM 1088 CA GLY A 148 -7.209 -4.141 1.103 1.00 0.00 C ATOM 1089 C GLY A 148 -6.358 -5.331 0.705 1.00 0.00 C ATOM 1090 O GLY A 148 -6.878 -6.352 0.255 1.00 0.00 O ATOM 0 H GLY A 148 -6.343 -2.241 1.276 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -7.257 -4.080 2.190 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -8.228 -4.292 0.747 1.00 0.00 H new ATOM 1094 N PHE A 149 -5.046 -5.200 0.871 1.00 0.00 N ATOM 1095 CA PHE A 149 -4.121 -6.273 0.524 1.00 0.00 C ATOM 1096 C PHE A 149 -4.129 -7.364 1.590 1.00 0.00 C ATOM 1097 O PHE A 149 -4.197 -7.095 2.790 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.705 -5.719 0.356 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.877 -6.481 -0.640 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -2.034 -6.265 -1.999 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.943 -7.411 -0.216 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -1.274 -6.966 -2.917 1.00 0.00 C ATOM 1103 CE2 PHE A 149 -0.180 -8.114 -1.129 1.00 0.00 C ATOM 1104 CZ PHE A 149 -0.345 -7.890 -2.482 1.00 0.00 C ATOM 0 H PHE A 149 -4.599 -4.362 1.243 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.448 -6.710 -0.420 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.766 -4.676 0.044 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.201 -5.733 1.322 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -2.757 -5.542 -2.345 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.809 -7.589 0.841 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -1.407 -6.791 -3.974 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.544 -8.838 -0.785 1.00 0.00 H new ATOM 0 HZ PHE A 149 0.251 -8.436 -3.198 1.00 0.00 H new ATOM 1114 N PRO A 150 -4.058 -8.627 1.144 1.00 0.00 N ATOM 1115 CA PRO A 150 -4.056 -9.785 2.042 1.00 0.00 C ATOM 1116 C PRO A 150 -2.764 -9.893 2.845 1.00 0.00 C ATOM 1117 O PRO A 150 -2.555 -10.861 3.579 1.00 0.00 O ATOM 1118 CB PRO A 150 -4.193 -10.975 1.088 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.643 -10.487 -0.207 1.00 0.00 C ATOM 1120 CD PRO A 150 -3.975 -9.022 -0.273 1.00 0.00 C ATOM 0 HA PRO A 150 -4.850 -9.724 2.786 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.639 -11.840 1.452 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -5.234 -11.283 0.985 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.566 -10.646 -0.258 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -4.084 -11.025 -1.046 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -3.206 -8.459 -0.803 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.916 -8.846 -0.795 1.00 0.00 H new ATOM 1128 N LEU A 151 -1.899 -8.895 2.703 1.00 0.00 N ATOM 1129 CA LEU A 151 -0.626 -8.878 3.416 1.00 0.00 C ATOM 1130 C LEU A 151 -0.768 -9.506 4.798 1.00 0.00 C ATOM 1131 O LEU A 151 -1.831 -9.441 5.415 1.00 0.00 O ATOM 1132 CB LEU A 151 -0.112 -7.443 3.545 1.00 0.00 C ATOM 1133 CG LEU A 151 1.407 -7.278 3.611 1.00 0.00 C ATOM 1134 CD1 LEU A 151 2.003 -7.270 2.212 1.00 0.00 C ATOM 1135 CD2 LEU A 151 1.773 -6.003 4.356 1.00 0.00 C ATOM 0 H LEU A 151 -2.056 -8.087 2.101 1.00 0.00 H new ATOM 0 HA LEU A 151 0.092 -9.465 2.843 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.483 -6.868 2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -0.545 -7.003 4.443 1.00 0.00 H new ATOM 0 HG LEU A 151 1.823 -8.125 4.156 1.00 0.00 H new ATOM 0 HD11 LEU A 151 3.085 -7.152 2.278 1.00 0.00 H new ATOM 0 HD12 LEU A 151 1.771 -8.210 1.712 1.00 0.00 H new ATOM 0 HD13 LEU A 151 1.582 -6.442 1.642 1.00 0.00 H new ATOM 0 HD21 LEU A 151 2.858 -5.902 4.393 1.00 0.00 H new ATOM 0 HD22 LEU A 151 1.346 -5.144 3.838 1.00 0.00 H new ATOM 0 HD23 LEU A 151 1.378 -6.048 5.371 1.00 0.00 H new ATOM 1147 N GLY A 152 0.312 -10.114 5.280 1.00 0.00 N ATOM 1148 CA GLY A 152 0.288 -10.743 6.587 1.00 0.00 C ATOM 1149 C GLY A 152 -0.641 -11.940 6.637 1.00 0.00 C ATOM 1150 O GLY A 152 -0.226 -13.068 6.373 1.00 0.00 O ATOM 0 H GLY A 152 1.203 -10.182 4.788 1.00 0.00 H new ATOM 0 HA2 GLY A 152 1.297 -11.058 6.854 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.025 -10.012 7.333 1.00 0.00 H new ATOM 1154 N GLY A 153 -1.902 -11.695 6.979 1.00 0.00 N ATOM 1155 CA GLY A 153 -2.872 -12.772 7.058 1.00 0.00 C ATOM 1156 C GLY A 153 -4.170 -12.436 6.351 1.00 0.00 C ATOM 1157 O GLY A 153 -4.337 -11.350 5.796 1.00 0.00 O ATOM 0 H GLY A 153 -2.269 -10.770 7.203 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.446 -13.674 6.619 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.079 -12.994 8.105 1.00 0.00 H new ATOM 1161 N PRO A 154 -5.119 -13.384 6.365 1.00 0.00 N ATOM 1162 CA PRO A 154 -6.425 -13.207 5.724 1.00 0.00 C ATOM 1163 C PRO A 154 -7.295 -12.189 6.453 1.00 0.00 C ATOM 1164 O PRO A 154 -8.327 -11.758 5.938 1.00 0.00 O ATOM 1165 CB PRO A 154 -7.052 -14.601 5.805 1.00 0.00 C ATOM 1166 CG PRO A 154 -6.390 -15.247 6.973 1.00 0.00 C ATOM 1167 CD PRO A 154 -4.989 -14.703 7.008 1.00 0.00 C ATOM 0 HA PRO A 154 -6.331 -12.825 4.707 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -8.131 -14.542 5.944 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -6.879 -15.167 4.889 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -6.920 -15.019 7.898 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -6.385 -16.332 6.868 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -4.617 -14.617 8.029 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -4.294 -15.347 6.468 1.00 0.00 H new ATOM 1175 N ASP A 155 -6.872 -11.807 7.652 1.00 0.00 N ATOM 1176 CA ASP A 155 -7.612 -10.837 8.452 1.00 0.00 C ATOM 1177 C ASP A 155 -7.017 -9.441 8.300 1.00 0.00 C ATOM 1178 O ASP A 155 -7.736 -8.472 8.054 1.00 0.00 O ATOM 1179 CB ASP A 155 -7.609 -11.250 9.924 1.00 0.00 C ATOM 1180 CG ASP A 155 -8.704 -10.566 10.719 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -9.858 -10.547 10.243 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -8.407 -10.050 11.817 1.00 0.00 O ATOM 0 H ASP A 155 -6.020 -12.154 8.092 1.00 0.00 H new ATOM 0 HA ASP A 155 -8.641 -10.815 8.092 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -7.733 -12.331 9.996 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -6.641 -11.010 10.364 1.00 0.00 H new ATOM 1187 N ARG A 156 -5.700 -9.345 8.450 1.00 0.00 N ATOM 1188 CA ARG A 156 -5.008 -8.067 8.333 1.00 0.00 C ATOM 1189 C ARG A 156 -5.031 -7.567 6.891 1.00 0.00 C ATOM 1190 O ARG A 156 -4.526 -8.231 5.986 1.00 0.00 O ATOM 1191 CB ARG A 156 -3.562 -8.199 8.815 1.00 0.00 C ATOM 1192 CG ARG A 156 -3.419 -8.159 10.328 1.00 0.00 C ATOM 1193 CD ARG A 156 -1.977 -8.380 10.756 1.00 0.00 C ATOM 1194 NE ARG A 156 -1.874 -8.737 12.169 1.00 0.00 N ATOM 1195 CZ ARG A 156 -2.041 -9.972 12.629 1.00 0.00 C ATOM 1196 NH1 ARG A 156 -2.316 -10.963 11.792 1.00 0.00 N ATOM 1197 NH2 ARG A 156 -1.932 -10.218 13.928 1.00 0.00 N ATOM 0 H ARG A 156 -5.091 -10.137 8.653 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.528 -7.342 8.960 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -3.148 -9.137 8.444 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -2.968 -7.395 8.381 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.768 -7.196 10.702 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -4.054 -8.924 10.775 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -1.536 -9.171 10.149 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -1.400 -7.474 10.568 1.00 0.00 H new ATOM 0 HE ARG A 156 -1.662 -7.998 12.839 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -2.400 -10.778 10.792 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -2.444 -11.910 12.148 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -1.720 -9.458 14.575 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -2.060 -11.167 14.280 1.00 0.00 H new ATOM 1211 N ARG A 157 -5.621 -6.394 6.687 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.712 -5.806 5.356 1.00 0.00 C ATOM 1213 C ARG A 157 -5.084 -4.415 5.332 1.00 0.00 C ATOM 1214 O ARG A 157 -5.345 -3.590 6.209 1.00 0.00 O ATOM 1215 CB ARG A 157 -7.173 -5.726 4.909 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.862 -7.079 4.836 1.00 0.00 C ATOM 1217 CD ARG A 157 -7.666 -7.732 3.476 1.00 0.00 C ATOM 1218 NE ARG A 157 -8.731 -8.681 3.166 1.00 0.00 N ATOM 1219 CZ ARG A 157 -9.998 -8.328 2.978 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -10.355 -7.055 3.068 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -10.910 -9.250 2.699 1.00 0.00 N ATOM 0 H ARG A 157 -6.043 -5.832 7.426 1.00 0.00 H new ATOM 0 HA ARG A 157 -5.163 -6.446 4.665 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -7.721 -5.085 5.600 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -7.219 -5.251 3.929 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -7.467 -7.732 5.614 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -8.927 -6.957 5.032 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -7.631 -6.962 2.706 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -6.705 -8.246 3.456 1.00 0.00 H new ATOM 0 HE ARG A 157 -8.489 -9.669 3.090 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -9.656 -6.343 3.282 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -11.328 -6.787 2.923 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -10.639 -10.231 2.629 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -11.882 -8.978 2.555 1.00 0.00 H new ATOM 1235 N LEU A 158 -4.257 -4.163 4.324 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.592 -2.872 4.185 1.00 0.00 C ATOM 1237 C LEU A 158 -4.600 -1.769 3.878 1.00 0.00 C ATOM 1238 O LEU A 158 -5.631 -2.015 3.251 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.536 -2.936 3.080 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.459 -4.008 3.242 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.589 -4.084 1.997 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.608 -3.728 4.473 1.00 0.00 C ATOM 0 H LEU A 158 -4.031 -4.835 3.591 1.00 0.00 H new ATOM 0 HA LEU A 158 -3.105 -2.639 5.132 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -3.043 -3.100 2.129 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -2.046 -1.964 3.016 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.951 -4.972 3.376 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.172 -4.853 2.131 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -1.208 -4.333 1.135 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -0.106 -3.121 1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.154 -4.501 4.572 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -0.126 -2.756 4.369 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.241 -3.726 5.360 1.00 0.00 H new ATOM 1254 N ARG A 159 -4.295 -0.554 4.321 1.00 0.00 N ATOM 1255 CA ARG A 159 -5.174 0.586 4.093 1.00 0.00 C ATOM 1256 C ARG A 159 -4.442 1.695 3.343 1.00 0.00 C ATOM 1257 O ARG A 159 -3.622 2.411 3.918 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.707 1.121 5.423 1.00 0.00 C ATOM 1259 CG ARG A 159 -6.912 0.357 5.948 1.00 0.00 C ATOM 1260 CD ARG A 159 -6.535 -1.054 6.372 1.00 0.00 C ATOM 1261 NE ARG A 159 -7.382 -1.543 7.457 1.00 0.00 N ATOM 1262 CZ ARG A 159 -7.188 -1.240 8.735 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -6.182 -0.451 9.088 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -8.002 -1.724 9.665 1.00 0.00 N ATOM 0 H ARG A 159 -3.445 -0.334 4.840 1.00 0.00 H new ATOM 0 HA ARG A 159 -6.012 0.250 3.483 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -4.911 1.082 6.166 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -5.977 2.170 5.301 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -7.341 0.891 6.796 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -7.681 0.313 5.177 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -6.618 -1.724 5.517 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -5.493 -1.071 6.690 1.00 0.00 H new ATOM 0 HE ARG A 159 -8.166 -2.151 7.220 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -5.555 -0.075 8.377 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -6.036 -0.220 10.071 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -8.778 -2.330 9.398 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -7.851 -1.490 10.646 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.743 1.830 2.055 1.00 0.00 N ATOM 1279 CA VAL A 160 -4.114 2.852 1.227 1.00 0.00 C ATOM 1280 C VAL A 160 -5.115 3.933 0.834 1.00 0.00 C ATOM 1281 O VAL A 160 -6.241 3.636 0.435 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.506 2.243 -0.051 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -2.575 3.238 -0.726 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.774 0.949 0.273 1.00 0.00 C ATOM 0 H VAL A 160 -5.418 1.245 1.563 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.318 3.297 1.824 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.315 2.012 -0.744 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.155 2.790 -1.627 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.133 4.135 -0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -1.768 3.503 -0.043 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.351 0.532 -0.641 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.973 1.152 0.984 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.473 0.235 0.708 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.696 5.189 0.950 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.555 6.316 0.605 1.00 0.00 C ATOM 1296 C ASP A 161 -4.767 7.394 -0.132 1.00 0.00 C ATOM 1297 O ASP A 161 -3.566 7.556 0.083 1.00 0.00 O ATOM 1298 CB ASP A 161 -6.191 6.904 1.866 1.00 0.00 C ATOM 1299 CG ASP A 161 -7.460 6.177 2.267 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -8.350 6.019 1.406 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -7.563 5.768 3.443 1.00 0.00 O ATOM 0 H ASP A 161 -3.767 5.452 1.280 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.343 5.952 -0.055 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -5.475 6.858 2.686 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -6.416 7.957 1.699 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.451 8.129 -1.003 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.815 9.191 -1.774 1.00 0.00 C ATOM 1308 C PHE A 162 -4.521 10.401 -0.893 1.00 0.00 C ATOM 1309 O PHE A 162 -5.392 10.881 -0.168 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.708 9.603 -2.946 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.663 8.644 -4.100 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.505 8.488 -4.845 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.780 7.897 -4.441 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.462 7.606 -5.908 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.742 7.013 -5.503 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.581 6.867 -6.237 1.00 0.00 C ATOM 0 H PHE A 162 -6.446 8.009 -1.192 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.871 8.809 -2.162 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.737 9.689 -2.596 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.405 10.591 -3.293 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.626 9.062 -4.592 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.690 8.007 -3.870 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.553 7.495 -6.481 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.619 6.437 -5.759 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.549 6.176 -7.067 1.00 0.00 H new ATOM 1326 N ALA A 163 -3.286 10.888 -0.960 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.876 12.043 -0.171 1.00 0.00 C ATOM 1328 C ALA A 163 -2.685 13.272 -1.054 1.00 0.00 C ATOM 1329 O ALA A 163 -1.661 13.416 -1.722 1.00 0.00 O ATOM 1330 CB ALA A 163 -1.596 11.734 0.591 1.00 0.00 C ATOM 0 H ALA A 163 -2.552 10.500 -1.553 1.00 0.00 H new ATOM 0 HA ALA A 163 -3.668 12.262 0.545 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -1.301 12.605 1.176 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -1.765 10.889 1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.803 11.486 -0.115 1.00 0.00 H new