USER MOD reduce.3.24.130724 H: found=0, std=0, add=769, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 768 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 42 HIS :FLIP no HD1:sc= -0.785 F(o=-2.3!,f=-0.79) USER MOD Single : A 43 ASN : amide:sc= -0.0102 K(o=-0.01,f=-1.9!) USER MOD Single : A 47 SER OG : rot 180:sc= 0.00252 USER MOD Single : A 55 SER OG : rot 28:sc= 0.166 USER MOD Single : A 61 LYS NZ :NH3+ 154:sc= -1.58 (180deg=-2.2!) USER MOD Single : A 63 GLN :FLIP amide:sc= -4.92! C(o=-9.7!,f=-4.9!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot -178:sc= -2.6! USER MOD Single : A 85 LYS NZ :NH3+ -178:sc= -0.402 (180deg=-0.474) USER MOD Single : A 88 GLN : amide:sc= -0.0399 K(o=-0.04,f=-2!) USER MOD Single : A 92 TYR OH : rot 165:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= -0.473 USER MOD Single : A 99 CYS SG : rot 110:sc= -4.05! USER MOD Single : A 100 HIS : no HE2:sc= 0.592 K(o=0.59,f=-4.4!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= -0.0101 USER MOD Single : A 106 GLN : amide:sc= -3.94! C(o=-3.9!,f=-4.6!) USER MOD Single : A 107 GLN : amide:sc= -0.0609 K(o=-0.061,f=-1.1) USER MOD Single : A 109 GLN :FLIP amide:sc=-0.00235 F(o=-1.6!,f=-0.0024) USER MOD Single : A 112 THR OG1 : rot -160:sc=-0.00469 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN :FLIP amide:sc= -2.4! C(o=-4.9!,f=-2.4!) USER MOD Single : A 120 SER OG : rot 16:sc= -0.871 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot -47:sc= 0.593 USER MOD Single : A 133 THR OG1 : rot -75:sc= 0.79 USER MOD Single : A 137 GLN :FLIP amide:sc= -6.03! C(o=-12!,f=-6!) USER MOD ----------------------------------------------------------------- ATOM 265 N ALA A 39 18.070 6.375 -1.534 1.00 0.00 N ATOM 266 CA ALA A 39 17.766 5.733 -0.214 1.00 0.00 C ATOM 267 C ALA A 39 16.858 6.659 0.598 1.00 0.00 C ATOM 268 O ALA A 39 17.248 7.741 0.989 1.00 0.00 O ATOM 269 CB ALA A 39 19.074 5.504 0.546 1.00 0.00 C ATOM 0 HA ALA A 39 17.264 4.778 -0.373 1.00 0.00 H new ATOM 0 HB1 ALA A 39 18.859 5.037 1.507 1.00 0.00 H new ATOM 0 HB2 ALA A 39 19.724 4.852 -0.037 1.00 0.00 H new ATOM 0 HB3 ALA A 39 19.572 6.460 0.710 1.00 0.00 H new ATOM 275 N ALA A 40 15.644 6.246 0.845 1.00 0.00 N ATOM 276 CA ALA A 40 14.699 7.103 1.620 1.00 0.00 C ATOM 277 C ALA A 40 13.683 6.220 2.358 1.00 0.00 C ATOM 278 O ALA A 40 13.782 5.004 2.364 1.00 0.00 O ATOM 279 CB ALA A 40 13.976 8.051 0.651 1.00 0.00 C ATOM 0 H ALA A 40 15.264 5.349 0.543 1.00 0.00 H new ATOM 0 HA ALA A 40 15.249 7.689 2.357 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.283 8.682 1.208 1.00 0.00 H new ATOM 0 HB2 ALA A 40 14.708 8.678 0.142 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.424 7.467 -0.085 1.00 0.00 H new ATOM 285 N VAL A 41 12.714 6.829 2.988 1.00 0.00 N ATOM 286 CA VAL A 41 11.683 6.046 3.730 1.00 0.00 C ATOM 287 C VAL A 41 10.726 5.410 2.720 1.00 0.00 C ATOM 288 O VAL A 41 10.425 5.981 1.691 1.00 0.00 O ATOM 289 CB VAL A 41 10.901 6.984 4.657 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.796 6.211 5.383 1.00 0.00 C ATOM 291 CG2 VAL A 41 11.849 7.594 5.693 1.00 0.00 C ATOM 0 H VAL A 41 12.592 7.841 3.021 1.00 0.00 H new ATOM 0 HA VAL A 41 12.162 5.269 4.326 1.00 0.00 H new ATOM 0 HB VAL A 41 10.452 7.775 4.056 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.248 6.888 6.038 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.112 5.781 4.651 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.241 5.412 5.977 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.290 8.260 6.350 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.303 6.798 6.284 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.630 8.158 5.184 1.00 0.00 H new ATOM 301 N HIS A 42 10.258 4.226 2.999 1.00 0.00 N ATOM 302 CA HIS A 42 9.333 3.538 2.049 1.00 0.00 C ATOM 303 C HIS A 42 8.374 2.629 2.827 1.00 0.00 C ATOM 304 O HIS A 42 8.754 1.980 3.780 1.00 0.00 O ATOM 305 CB HIS A 42 10.166 2.669 1.092 1.00 0.00 C ATOM 306 CG HIS A 42 10.660 3.483 -0.073 1.00 0.00 C ATOM 307 ND1 HIS A 42 11.614 4.465 -0.173 1.00 0.00 N flip ATOM 308 CD2 HIS A 42 10.168 3.303 -1.355 1.00 0.00 C flip ATOM 309 CE1 HIS A 42 11.714 4.888 -1.494 1.00 0.00 C flip ATOM 310 NE2 HIS A 42 10.822 4.155 -2.164 1.00 0.00 N flip ATOM 0 H HIS A 42 10.476 3.701 3.846 1.00 0.00 H new ATOM 0 HA HIS A 42 8.762 4.282 1.493 1.00 0.00 H new ATOM 0 HB2 HIS A 42 11.013 2.240 1.627 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.562 1.837 0.730 1.00 0.00 H new ATOM 0 HD2 HIS A 42 9.399 2.605 -1.651 1.00 0.00 H new ATOM 0 HE1 HIS A 42 12.372 5.646 -1.892 1.00 0.00 H new ATOM 0 HE2 HIS A 42 10.657 4.232 -3.168 1.00 0.00 H new ATOM 318 N ASN A 43 7.143 2.555 2.403 1.00 0.00 N ATOM 319 CA ASN A 43 6.171 1.662 3.089 1.00 0.00 C ATOM 320 C ASN A 43 6.361 0.244 2.546 1.00 0.00 C ATOM 321 O ASN A 43 5.825 -0.111 1.515 1.00 0.00 O ATOM 322 CB ASN A 43 4.751 2.139 2.792 1.00 0.00 C ATOM 323 CG ASN A 43 4.500 3.461 3.515 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.302 3.886 4.322 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.415 4.134 3.259 1.00 0.00 N ATOM 0 H ASN A 43 6.769 3.076 1.610 1.00 0.00 H new ATOM 0 HA ASN A 43 6.333 1.677 4.167 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.616 2.267 1.718 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.028 1.391 3.117 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.239 5.018 3.736 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.741 3.777 2.581 1.00 0.00 H new ATOM 332 N VAL A 44 7.135 -0.566 3.220 1.00 0.00 N ATOM 333 CA VAL A 44 7.375 -1.958 2.726 1.00 0.00 C ATOM 334 C VAL A 44 6.270 -2.892 3.275 1.00 0.00 C ATOM 335 O VAL A 44 6.076 -2.962 4.473 1.00 0.00 O ATOM 336 CB VAL A 44 8.770 -2.425 3.196 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.744 -2.836 4.669 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.228 -3.618 2.353 1.00 0.00 C ATOM 0 H VAL A 44 7.611 -0.326 4.090 1.00 0.00 H new ATOM 0 HA VAL A 44 7.343 -1.985 1.637 1.00 0.00 H new ATOM 0 HB VAL A 44 9.463 -1.593 3.075 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.739 -3.160 4.974 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.437 -1.986 5.279 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.038 -3.655 4.806 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.213 -3.944 2.688 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.517 -4.437 2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.281 -3.324 1.305 1.00 0.00 H new ATOM 348 N PRO A 45 5.535 -3.602 2.429 1.00 0.00 N ATOM 349 CA PRO A 45 4.445 -4.515 2.902 1.00 0.00 C ATOM 350 C PRO A 45 4.874 -5.425 4.057 1.00 0.00 C ATOM 351 O PRO A 45 5.968 -5.950 4.080 1.00 0.00 O ATOM 352 CB PRO A 45 4.109 -5.356 1.664 1.00 0.00 C ATOM 353 CG PRO A 45 4.450 -4.483 0.502 1.00 0.00 C ATOM 354 CD PRO A 45 5.637 -3.620 0.947 1.00 0.00 C ATOM 0 HA PRO A 45 3.603 -3.946 3.296 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.686 -6.281 1.646 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.056 -5.637 1.651 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.710 -5.082 -0.371 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.601 -3.861 0.220 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.585 -4.045 0.618 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.577 -2.614 0.531 1.00 0.00 H new ATOM 362 N LEU A 46 4.004 -5.622 5.010 1.00 0.00 N ATOM 363 CA LEU A 46 4.345 -6.508 6.154 1.00 0.00 C ATOM 364 C LEU A 46 4.485 -7.945 5.656 1.00 0.00 C ATOM 365 O LEU A 46 5.214 -8.745 6.209 1.00 0.00 O ATOM 366 CB LEU A 46 3.215 -6.475 7.183 1.00 0.00 C ATOM 367 CG LEU A 46 3.045 -5.057 7.781 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.578 -4.835 8.133 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.886 -4.890 9.056 1.00 0.00 C ATOM 0 H LEU A 46 3.073 -5.207 5.044 1.00 0.00 H new ATOM 0 HA LEU A 46 5.277 -6.164 6.603 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.283 -6.789 6.714 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.425 -7.187 7.981 1.00 0.00 H new ATOM 0 HG LEU A 46 3.380 -4.331 7.040 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.452 -3.838 8.555 1.00 0.00 H new ATOM 0 HD12 LEU A 46 0.970 -4.928 7.233 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.262 -5.580 8.863 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.747 -3.885 9.454 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.569 -5.622 9.799 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.939 -5.045 8.820 1.00 0.00 H new ATOM 381 N SER A 47 3.753 -8.277 4.637 1.00 0.00 N ATOM 382 CA SER A 47 3.778 -9.668 4.099 1.00 0.00 C ATOM 383 C SER A 47 5.164 -10.055 3.561 1.00 0.00 C ATOM 384 O SER A 47 5.504 -11.221 3.530 1.00 0.00 O ATOM 385 CB SER A 47 2.753 -9.775 2.970 1.00 0.00 C ATOM 386 OG SER A 47 2.909 -8.677 2.083 1.00 0.00 O ATOM 0 H SER A 47 3.129 -7.639 4.144 1.00 0.00 H new ATOM 0 HA SER A 47 3.538 -10.351 4.914 1.00 0.00 H new ATOM 0 HB2 SER A 47 2.886 -10.713 2.431 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.743 -9.784 3.381 1.00 0.00 H new ATOM 0 HG SER A 47 2.253 -8.746 1.358 1.00 0.00 H new ATOM 392 N VAL A 48 5.960 -9.110 3.113 1.00 0.00 N ATOM 393 CA VAL A 48 7.309 -9.462 2.550 1.00 0.00 C ATOM 394 C VAL A 48 8.432 -9.141 3.547 1.00 0.00 C ATOM 395 O VAL A 48 9.563 -8.924 3.161 1.00 0.00 O ATOM 396 CB VAL A 48 7.538 -8.689 1.243 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.321 -8.852 0.329 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.767 -7.201 1.526 1.00 0.00 C ATOM 0 H VAL A 48 5.737 -8.115 3.112 1.00 0.00 H new ATOM 0 HA VAL A 48 7.328 -10.534 2.355 1.00 0.00 H new ATOM 0 HB VAL A 48 8.425 -9.092 0.754 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.486 -8.303 -0.598 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.174 -9.908 0.103 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.435 -8.461 0.830 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.927 -6.672 0.586 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.894 -6.788 2.030 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.644 -7.082 2.163 1.00 0.00 H new ATOM 408 N LEU A 49 8.149 -9.135 4.826 1.00 0.00 N ATOM 409 CA LEU A 49 9.224 -8.855 5.823 1.00 0.00 C ATOM 410 C LEU A 49 9.874 -10.175 6.231 1.00 0.00 C ATOM 411 O LEU A 49 9.206 -11.169 6.440 1.00 0.00 O ATOM 412 CB LEU A 49 8.629 -8.202 7.076 1.00 0.00 C ATOM 413 CG LEU A 49 8.174 -6.763 6.793 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.550 -6.198 8.074 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.367 -5.883 6.372 1.00 0.00 C ATOM 0 H LEU A 49 7.225 -9.311 5.220 1.00 0.00 H new ATOM 0 HA LEU A 49 9.957 -8.183 5.376 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.782 -8.791 7.428 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.370 -8.201 7.875 1.00 0.00 H new ATOM 0 HG LEU A 49 7.450 -6.766 5.978 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.219 -5.175 7.897 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.696 -6.811 8.364 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.291 -6.206 8.874 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.020 -4.868 6.177 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.107 -5.866 7.172 1.00 0.00 H new ATOM 0 HD23 LEU A 49 9.820 -6.292 5.468 1.00 0.00 H new ATOM 427 N ILE A 50 11.174 -10.187 6.350 1.00 0.00 N ATOM 428 CA ILE A 50 11.901 -11.433 6.752 1.00 0.00 C ATOM 429 C ILE A 50 12.449 -11.266 8.167 1.00 0.00 C ATOM 430 O ILE A 50 13.330 -10.464 8.410 1.00 0.00 O ATOM 431 CB ILE A 50 13.060 -11.671 5.790 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.519 -11.727 4.362 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.746 -12.996 6.130 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.682 -11.804 3.374 1.00 0.00 C ATOM 0 H ILE A 50 11.773 -9.378 6.184 1.00 0.00 H new ATOM 0 HA ILE A 50 11.217 -12.281 6.722 1.00 0.00 H new ATOM 0 HB ILE A 50 13.783 -10.860 5.878 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.870 -12.594 4.243 1.00 0.00 H new ATOM 0 HG13 ILE A 50 11.913 -10.844 4.157 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.574 -13.164 5.441 1.00 0.00 H new ATOM 0 HG22 ILE A 50 14.125 -12.958 7.151 1.00 0.00 H new ATOM 0 HG23 ILE A 50 13.028 -13.811 6.040 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.293 -11.844 2.357 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.314 -10.923 3.487 1.00 0.00 H new ATOM 0 HD13 ILE A 50 14.270 -12.700 3.573 1.00 0.00 H new ATOM 446 N ARG A 51 11.934 -12.022 9.103 1.00 0.00 N ATOM 447 CA ARG A 51 12.418 -11.923 10.517 1.00 0.00 C ATOM 448 C ARG A 51 12.636 -13.332 11.092 1.00 0.00 C ATOM 449 O ARG A 51 11.709 -13.949 11.578 1.00 0.00 O ATOM 450 CB ARG A 51 11.354 -11.208 11.355 1.00 0.00 C ATOM 451 CG ARG A 51 11.005 -9.863 10.706 1.00 0.00 C ATOM 452 CD ARG A 51 10.318 -8.951 11.728 1.00 0.00 C ATOM 453 NE ARG A 51 11.337 -8.411 12.684 1.00 0.00 N ATOM 454 CZ ARG A 51 11.500 -8.935 13.878 1.00 0.00 C ATOM 455 NH1 ARG A 51 10.787 -9.960 14.265 1.00 0.00 N ATOM 456 NH2 ARG A 51 12.389 -8.427 14.687 1.00 0.00 N ATOM 0 H ARG A 51 11.195 -12.708 8.949 1.00 0.00 H new ATOM 0 HA ARG A 51 13.357 -11.370 10.541 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.461 -11.828 11.433 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.721 -11.049 12.369 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.910 -9.385 10.330 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.350 -10.022 9.850 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.813 -8.131 11.217 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.554 -9.507 12.271 1.00 0.00 H new ATOM 0 HE ARG A 51 11.916 -7.620 12.402 1.00 0.00 H new ATOM 0 HH11 ARG A 51 10.092 -10.364 13.637 1.00 0.00 H new ATOM 0 HH12 ARG A 51 10.925 -10.355 15.195 1.00 0.00 H new ATOM 0 HH21 ARG A 51 12.951 -7.629 14.391 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.522 -8.828 15.616 1.00 0.00 H new ATOM 470 N PRO A 52 13.850 -13.834 11.068 1.00 0.00 N ATOM 471 CA PRO A 52 14.181 -15.172 11.621 1.00 0.00 C ATOM 472 C PRO A 52 14.718 -15.074 13.053 1.00 0.00 C ATOM 473 O PRO A 52 15.505 -15.892 13.487 1.00 0.00 O ATOM 474 CB PRO A 52 15.281 -15.635 10.675 1.00 0.00 C ATOM 475 CG PRO A 52 16.055 -14.382 10.376 1.00 0.00 C ATOM 476 CD PRO A 52 15.056 -13.208 10.494 1.00 0.00 C ATOM 0 HA PRO A 52 13.322 -15.840 11.681 1.00 0.00 H new ATOM 0 HB2 PRO A 52 15.913 -16.393 11.138 1.00 0.00 H new ATOM 0 HB3 PRO A 52 14.868 -16.075 9.767 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.881 -14.260 11.077 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.488 -14.423 9.377 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.442 -12.417 11.137 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.850 -12.758 9.523 1.00 0.00 H new ATOM 484 N LEU A 53 14.318 -14.062 13.781 1.00 0.00 N ATOM 485 CA LEU A 53 14.823 -13.882 15.177 1.00 0.00 C ATOM 486 C LEU A 53 13.674 -13.380 16.078 1.00 0.00 C ATOM 487 O LEU A 53 13.433 -12.192 16.155 1.00 0.00 O ATOM 488 CB LEU A 53 15.956 -12.837 15.135 1.00 0.00 C ATOM 489 CG LEU A 53 16.928 -13.022 16.312 1.00 0.00 C ATOM 490 CD1 LEU A 53 18.205 -12.223 16.033 1.00 0.00 C ATOM 491 CD2 LEU A 53 16.288 -12.515 17.609 1.00 0.00 C ATOM 0 H LEU A 53 13.660 -13.349 13.467 1.00 0.00 H new ATOM 0 HA LEU A 53 15.194 -14.825 15.580 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.500 -12.924 14.194 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.530 -11.834 15.166 1.00 0.00 H new ATOM 0 HG LEU A 53 17.163 -14.081 16.422 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.901 -12.348 16.863 1.00 0.00 H new ATOM 0 HD12 LEU A 53 18.667 -12.584 15.114 1.00 0.00 H new ATOM 0 HD13 LEU A 53 17.957 -11.167 15.923 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.985 -12.651 18.436 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.048 -11.457 17.507 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.375 -13.076 17.808 1.00 0.00 H new ATOM 503 N PRO A 54 12.959 -14.260 16.753 1.00 0.00 N ATOM 504 CA PRO A 54 11.830 -13.841 17.635 1.00 0.00 C ATOM 505 C PRO A 54 12.330 -13.225 18.949 1.00 0.00 C ATOM 506 O PRO A 54 13.483 -13.360 19.308 1.00 0.00 O ATOM 507 CB PRO A 54 11.055 -15.143 17.880 1.00 0.00 C ATOM 508 CG PRO A 54 12.073 -16.233 17.752 1.00 0.00 C ATOM 509 CD PRO A 54 13.135 -15.731 16.760 1.00 0.00 C ATOM 0 HA PRO A 54 11.214 -13.064 17.182 1.00 0.00 H new ATOM 0 HB2 PRO A 54 10.595 -15.148 18.868 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.252 -15.266 17.153 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.523 -16.458 18.719 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.612 -17.153 17.393 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.140 -16.010 17.077 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.985 -16.155 15.767 1.00 0.00 H new ATOM 517 N SER A 55 11.475 -12.536 19.662 1.00 0.00 N ATOM 518 CA SER A 55 11.908 -11.898 20.943 1.00 0.00 C ATOM 519 C SER A 55 10.732 -11.844 21.921 1.00 0.00 C ATOM 520 O SER A 55 9.594 -12.073 21.561 1.00 0.00 O ATOM 521 CB SER A 55 12.392 -10.471 20.649 1.00 0.00 C ATOM 522 OG SER A 55 13.783 -10.493 20.363 1.00 0.00 O ATOM 0 H SER A 55 10.497 -12.388 19.413 1.00 0.00 H new ATOM 0 HA SER A 55 12.714 -12.482 21.387 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.843 -10.056 19.804 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.196 -9.825 21.505 1.00 0.00 H new ATOM 0 HG SER A 55 14.024 -11.362 19.979 1.00 0.00 H new ATOM 528 N VAL A 56 11.006 -11.520 23.156 1.00 0.00 N ATOM 529 CA VAL A 56 9.917 -11.421 24.168 1.00 0.00 C ATOM 530 C VAL A 56 9.348 -10.004 24.126 1.00 0.00 C ATOM 531 O VAL A 56 9.990 -9.053 24.525 1.00 0.00 O ATOM 532 CB VAL A 56 10.484 -11.705 25.560 1.00 0.00 C ATOM 533 CG1 VAL A 56 9.402 -11.456 26.612 1.00 0.00 C ATOM 534 CG2 VAL A 56 10.944 -13.162 25.637 1.00 0.00 C ATOM 0 H VAL A 56 11.942 -11.319 23.508 1.00 0.00 H new ATOM 0 HA VAL A 56 9.134 -12.147 23.950 1.00 0.00 H new ATOM 0 HB VAL A 56 11.332 -11.046 25.747 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.806 -11.658 27.604 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.074 -10.418 26.558 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.554 -12.114 26.424 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.348 -13.364 26.629 1.00 0.00 H new ATOM 0 HG22 VAL A 56 10.097 -13.821 25.449 1.00 0.00 H new ATOM 0 HG23 VAL A 56 11.716 -13.340 24.888 1.00 0.00 H new ATOM 544 N LEU A 57 8.153 -9.854 23.627 1.00 0.00 N ATOM 545 CA LEU A 57 7.538 -8.501 23.532 1.00 0.00 C ATOM 546 C LEU A 57 6.786 -8.159 24.811 1.00 0.00 C ATOM 547 O LEU A 57 6.200 -9.003 25.460 1.00 0.00 O ATOM 548 CB LEU A 57 6.554 -8.466 22.373 1.00 0.00 C ATOM 549 CG LEU A 57 7.287 -8.761 21.057 1.00 0.00 C ATOM 550 CD1 LEU A 57 6.249 -8.944 19.944 1.00 0.00 C ATOM 551 CD2 LEU A 57 8.237 -7.601 20.703 1.00 0.00 C ATOM 0 H LEU A 57 7.572 -10.616 23.278 1.00 0.00 H new ATOM 0 HA LEU A 57 8.337 -7.776 23.377 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.765 -9.201 22.532 1.00 0.00 H new ATOM 0 HB3 LEU A 57 6.074 -7.489 22.321 1.00 0.00 H new ATOM 0 HG LEU A 57 7.879 -9.670 21.165 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.758 -9.154 19.003 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.590 -9.776 20.194 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.660 -8.032 19.842 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.750 -7.824 19.768 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.663 -6.681 20.592 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.971 -7.476 21.499 1.00 0.00 H new ATOM 563 N ASP A 58 6.789 -6.907 25.154 1.00 0.00 N ATOM 564 CA ASP A 58 6.072 -6.434 26.367 1.00 0.00 C ATOM 565 C ASP A 58 4.680 -5.933 25.927 1.00 0.00 C ATOM 566 O ASP A 58 4.578 -5.172 24.989 1.00 0.00 O ATOM 567 CB ASP A 58 6.885 -5.284 26.971 1.00 0.00 C ATOM 568 CG ASP A 58 6.034 -4.491 27.968 1.00 0.00 C ATOM 569 OD1 ASP A 58 5.050 -3.911 27.546 1.00 0.00 O ATOM 570 OD2 ASP A 58 6.384 -4.479 29.136 1.00 0.00 O ATOM 0 H ASP A 58 7.269 -6.173 24.633 1.00 0.00 H new ATOM 0 HA ASP A 58 5.956 -7.226 27.107 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.769 -5.679 27.472 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.237 -4.624 26.178 1.00 0.00 H new ATOM 575 N PRO A 59 3.611 -6.355 26.568 1.00 0.00 N ATOM 576 CA PRO A 59 2.234 -5.923 26.174 1.00 0.00 C ATOM 577 C PRO A 59 1.908 -4.488 26.613 1.00 0.00 C ATOM 578 O PRO A 59 0.997 -3.867 26.101 1.00 0.00 O ATOM 579 CB PRO A 59 1.332 -6.932 26.895 1.00 0.00 C ATOM 580 CG PRO A 59 2.097 -7.302 28.124 1.00 0.00 C ATOM 581 CD PRO A 59 3.577 -7.276 27.724 1.00 0.00 C ATOM 0 HA PRO A 59 2.107 -5.910 25.092 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.366 -6.494 27.145 1.00 0.00 H new ATOM 0 HB3 PRO A 59 1.134 -7.804 26.272 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.899 -6.599 28.933 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.807 -8.290 28.482 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.206 -6.919 28.539 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.937 -8.269 27.455 1.00 0.00 H new ATOM 589 N ALA A 60 2.634 -3.960 27.557 1.00 0.00 N ATOM 590 CA ALA A 60 2.352 -2.572 28.028 1.00 0.00 C ATOM 591 C ALA A 60 3.023 -1.555 27.100 1.00 0.00 C ATOM 592 O ALA A 60 2.449 -0.540 26.759 1.00 0.00 O ATOM 593 CB ALA A 60 2.897 -2.398 29.447 1.00 0.00 C ATOM 0 H ALA A 60 3.411 -4.428 28.024 1.00 0.00 H new ATOM 0 HA ALA A 60 1.275 -2.405 28.021 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.692 -1.385 29.794 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.414 -3.114 30.112 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.973 -2.571 29.447 1.00 0.00 H new ATOM 599 N LYS A 61 4.238 -1.810 26.699 1.00 0.00 N ATOM 600 CA LYS A 61 4.948 -0.854 25.809 1.00 0.00 C ATOM 601 C LYS A 61 4.316 -0.887 24.406 1.00 0.00 C ATOM 602 O LYS A 61 4.286 0.109 23.711 1.00 0.00 O ATOM 603 CB LYS A 61 6.449 -1.238 25.752 1.00 0.00 C ATOM 604 CG LYS A 61 7.329 0.004 25.938 1.00 0.00 C ATOM 605 CD LYS A 61 8.804 -0.408 26.031 1.00 0.00 C ATOM 606 CE LYS A 61 9.224 -1.166 24.765 1.00 0.00 C ATOM 607 NZ LYS A 61 8.545 -0.577 23.576 1.00 0.00 N ATOM 0 H LYS A 61 4.770 -2.643 26.951 1.00 0.00 H new ATOM 0 HA LYS A 61 4.859 0.160 26.198 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.673 -1.969 26.529 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.674 -1.710 24.796 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.186 0.690 25.103 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.034 0.537 26.842 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.429 0.476 26.158 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.959 -1.036 26.908 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.306 -1.114 24.641 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.964 -2.221 24.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 9.116 -0.756 22.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.607 -1.012 23.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.437 0.449 23.711 1.00 0.00 H new ATOM 621 N VAL A 62 3.809 -2.016 23.987 1.00 0.00 N ATOM 622 CA VAL A 62 3.183 -2.088 22.634 1.00 0.00 C ATOM 623 C VAL A 62 1.863 -1.314 22.653 1.00 0.00 C ATOM 624 O VAL A 62 1.614 -0.471 21.814 1.00 0.00 O ATOM 625 CB VAL A 62 2.916 -3.553 22.263 1.00 0.00 C ATOM 626 CG1 VAL A 62 2.061 -3.616 20.992 1.00 0.00 C ATOM 627 CG2 VAL A 62 4.246 -4.268 22.014 1.00 0.00 C ATOM 0 H VAL A 62 3.801 -2.886 24.519 1.00 0.00 H new ATOM 0 HA VAL A 62 3.856 -1.651 21.896 1.00 0.00 H new ATOM 0 HB VAL A 62 2.386 -4.040 23.082 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.873 -4.658 20.731 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.112 -3.109 21.166 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.589 -3.127 20.174 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.056 -5.308 21.751 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.775 -3.778 21.197 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.855 -4.228 22.917 1.00 0.00 H new ATOM 637 N GLN A 63 1.015 -1.594 23.605 1.00 0.00 N ATOM 638 CA GLN A 63 -0.290 -0.873 23.678 1.00 0.00 C ATOM 639 C GLN A 63 -0.019 0.638 23.580 1.00 0.00 C ATOM 640 O GLN A 63 -0.713 1.359 22.891 1.00 0.00 O ATOM 641 CB GLN A 63 -1.011 -1.271 25.006 1.00 0.00 C ATOM 642 CG GLN A 63 -1.335 -0.062 25.902 1.00 0.00 C ATOM 643 CD GLN A 63 -2.371 0.829 25.211 1.00 0.00 C ATOM 644 OE1 GLN A 63 -2.023 2.017 24.802 1.00 0.00 O flip ATOM 645 NE2 GLN A 63 -3.509 0.439 25.043 1.00 0.00 N flip ATOM 0 H GLN A 63 1.168 -2.290 24.335 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.949 -1.146 22.854 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -1.935 -1.797 24.767 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.382 -1.968 25.560 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -1.718 -0.402 26.864 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.428 0.507 26.103 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -3.782 -0.490 25.363 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -4.192 1.041 24.582 1.00 0.00 H new ATOM 654 N SER A 64 0.993 1.113 24.255 1.00 0.00 N ATOM 655 CA SER A 64 1.314 2.567 24.195 1.00 0.00 C ATOM 656 C SER A 64 1.629 2.959 22.750 1.00 0.00 C ATOM 657 O SER A 64 1.149 3.955 22.247 1.00 0.00 O ATOM 658 CB SER A 64 2.528 2.859 25.079 1.00 0.00 C ATOM 659 OG SER A 64 2.929 4.210 24.903 1.00 0.00 O ATOM 0 H SER A 64 1.611 0.556 24.845 1.00 0.00 H new ATOM 0 HA SER A 64 0.460 3.143 24.551 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.282 2.675 26.125 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.348 2.189 24.822 1.00 0.00 H new ATOM 0 HG SER A 64 3.706 4.397 25.470 1.00 0.00 H new ATOM 665 N LEU A 65 2.429 2.178 22.074 1.00 0.00 N ATOM 666 CA LEU A 65 2.770 2.497 20.666 1.00 0.00 C ATOM 667 C LEU A 65 1.494 2.430 19.824 1.00 0.00 C ATOM 668 O LEU A 65 1.238 3.278 18.993 1.00 0.00 O ATOM 669 CB LEU A 65 3.790 1.464 20.169 1.00 0.00 C ATOM 670 CG LEU A 65 5.213 1.865 20.621 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.095 0.617 20.717 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.832 2.840 19.612 1.00 0.00 C ATOM 0 H LEU A 65 2.860 1.330 22.442 1.00 0.00 H new ATOM 0 HA LEU A 65 3.198 3.496 20.586 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.540 0.477 20.559 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.751 1.396 19.082 1.00 0.00 H new ATOM 0 HG LEU A 65 5.148 2.347 21.596 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.097 0.903 21.036 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.668 -0.076 21.442 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.149 0.134 19.742 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.834 3.116 19.940 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.889 2.363 18.633 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.213 3.735 19.544 1.00 0.00 H new ATOM 684 N VAL A 66 0.686 1.433 20.048 1.00 0.00 N ATOM 685 CA VAL A 66 -0.580 1.306 19.284 1.00 0.00 C ATOM 686 C VAL A 66 -1.380 2.604 19.449 1.00 0.00 C ATOM 687 O VAL A 66 -2.077 3.036 18.552 1.00 0.00 O ATOM 688 CB VAL A 66 -1.364 0.110 19.849 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.834 0.179 19.432 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.748 -1.189 19.324 1.00 0.00 C ATOM 0 H VAL A 66 0.852 0.696 20.733 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.389 1.141 18.224 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.310 0.139 20.937 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.369 -0.677 19.843 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.277 1.100 19.811 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.905 0.163 18.344 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.300 -2.040 19.722 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.797 -1.201 18.235 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.293 -1.252 19.641 1.00 0.00 H new ATOM 700 N ASP A 67 -1.275 3.229 20.588 1.00 0.00 N ATOM 701 CA ASP A 67 -2.013 4.501 20.818 1.00 0.00 C ATOM 702 C ASP A 67 -1.302 5.643 20.081 1.00 0.00 C ATOM 703 O ASP A 67 -1.929 6.565 19.600 1.00 0.00 O ATOM 704 CB ASP A 67 -2.044 4.795 22.326 1.00 0.00 C ATOM 705 CG ASP A 67 -3.205 4.039 22.981 1.00 0.00 C ATOM 706 OD1 ASP A 67 -3.245 2.827 22.851 1.00 0.00 O ATOM 707 OD2 ASP A 67 -4.033 4.686 23.600 1.00 0.00 O ATOM 0 H ASP A 67 -0.707 2.911 21.373 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.032 4.413 20.442 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.100 4.497 22.783 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.155 5.866 22.494 1.00 0.00 H new ATOM 712 N THR A 68 0.000 5.593 19.992 1.00 0.00 N ATOM 713 CA THR A 68 0.739 6.677 19.290 1.00 0.00 C ATOM 714 C THR A 68 0.403 6.632 17.800 1.00 0.00 C ATOM 715 O THR A 68 0.035 7.625 17.203 1.00 0.00 O ATOM 716 CB THR A 68 2.244 6.471 19.482 1.00 0.00 C ATOM 717 OG1 THR A 68 2.507 6.156 20.842 1.00 0.00 O ATOM 718 CG2 THR A 68 2.988 7.749 19.100 1.00 0.00 C ATOM 0 H THR A 68 0.582 4.848 20.375 1.00 0.00 H new ATOM 0 HA THR A 68 0.450 7.645 19.700 1.00 0.00 H new ATOM 0 HB THR A 68 2.583 5.653 18.847 1.00 0.00 H new ATOM 0 HG1 THR A 68 3.470 6.022 20.966 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.059 7.601 19.237 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.786 7.990 18.056 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.651 8.569 19.734 1.00 0.00 H new ATOM 726 N ILE A 69 0.523 5.483 17.198 1.00 0.00 N ATOM 727 CA ILE A 69 0.209 5.362 15.749 1.00 0.00 C ATOM 728 C ILE A 69 -1.241 5.801 15.507 1.00 0.00 C ATOM 729 O ILE A 69 -1.544 6.475 14.542 1.00 0.00 O ATOM 730 CB ILE A 69 0.399 3.902 15.312 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.825 3.451 15.674 1.00 0.00 C ATOM 732 CG2 ILE A 69 0.189 3.783 13.795 1.00 0.00 C ATOM 733 CD1 ILE A 69 2.128 2.083 15.054 1.00 0.00 C ATOM 0 H ILE A 69 0.826 4.620 17.649 1.00 0.00 H new ATOM 0 HA ILE A 69 0.876 5.999 15.168 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.328 3.269 15.822 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.547 4.186 15.318 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.932 3.398 16.757 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.325 2.746 13.489 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -0.820 4.107 13.541 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.913 4.412 13.277 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.140 1.779 15.320 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.418 1.347 15.431 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.042 2.148 13.969 1.00 0.00 H new ATOM 745 N ARG A 70 -2.139 5.416 16.373 1.00 0.00 N ATOM 746 CA ARG A 70 -3.574 5.798 16.193 1.00 0.00 C ATOM 747 C ARG A 70 -3.794 7.265 16.612 1.00 0.00 C ATOM 748 O ARG A 70 -4.643 7.946 16.072 1.00 0.00 O ATOM 749 CB ARG A 70 -4.460 4.865 17.057 1.00 0.00 C ATOM 750 CG ARG A 70 -5.022 3.713 16.212 1.00 0.00 C ATOM 751 CD ARG A 70 -6.018 2.909 17.051 1.00 0.00 C ATOM 752 NE ARG A 70 -7.083 3.817 17.561 1.00 0.00 N ATOM 753 CZ ARG A 70 -7.949 3.381 18.435 1.00 0.00 C ATOM 754 NH1 ARG A 70 -7.881 2.150 18.863 1.00 0.00 N ATOM 755 NH2 ARG A 70 -8.882 4.177 18.882 1.00 0.00 N ATOM 0 H ARG A 70 -1.943 4.852 17.200 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.845 5.694 15.142 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.875 4.464 17.884 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.280 5.436 17.494 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.513 4.106 15.322 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.212 3.068 15.871 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.460 2.115 16.449 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -5.504 2.429 17.884 1.00 0.00 H new ATOM 0 HE ARG A 70 -7.136 4.779 17.227 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -7.151 1.529 18.515 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -8.558 1.809 19.546 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -8.934 5.139 18.548 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -9.559 3.837 19.565 1.00 0.00 H new ATOM 769 N GLU A 71 -3.058 7.750 17.577 1.00 0.00 N ATOM 770 CA GLU A 71 -3.253 9.159 18.031 1.00 0.00 C ATOM 771 C GLU A 71 -2.421 10.111 17.171 1.00 0.00 C ATOM 772 O GLU A 71 -2.817 11.230 16.909 1.00 0.00 O ATOM 773 CB GLU A 71 -2.809 9.278 19.491 1.00 0.00 C ATOM 774 CG GLU A 71 -3.222 10.642 20.044 1.00 0.00 C ATOM 775 CD GLU A 71 -4.744 10.696 20.191 1.00 0.00 C ATOM 776 OE1 GLU A 71 -5.269 9.938 20.990 1.00 0.00 O ATOM 777 OE2 GLU A 71 -5.358 11.493 19.501 1.00 0.00 O ATOM 0 H GLU A 71 -2.331 7.232 18.070 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.306 9.425 17.936 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.259 8.482 20.084 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.728 9.157 19.564 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.747 10.813 21.010 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.882 11.434 19.377 1.00 0.00 H new ATOM 784 N ASP A 72 -1.267 9.686 16.739 1.00 0.00 N ATOM 785 CA ASP A 72 -0.405 10.577 15.906 1.00 0.00 C ATOM 786 C ASP A 72 0.523 9.727 15.026 1.00 0.00 C ATOM 787 O ASP A 72 1.642 9.446 15.408 1.00 0.00 O ATOM 788 CB ASP A 72 0.444 11.454 16.832 1.00 0.00 C ATOM 789 CG ASP A 72 1.038 12.617 16.034 1.00 0.00 C ATOM 790 OD1 ASP A 72 1.639 12.358 15.005 1.00 0.00 O ATOM 791 OD2 ASP A 72 0.882 13.747 16.467 1.00 0.00 O ATOM 0 H ASP A 72 -0.881 8.760 16.926 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.033 11.201 15.270 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.167 11.835 17.650 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.242 10.862 17.280 1.00 0.00 H new ATOM 796 N PRO A 73 0.076 9.300 13.863 1.00 0.00 N ATOM 797 CA PRO A 73 0.917 8.453 12.959 1.00 0.00 C ATOM 798 C PRO A 73 2.201 9.163 12.482 1.00 0.00 C ATOM 799 O PRO A 73 3.146 8.523 12.064 1.00 0.00 O ATOM 800 CB PRO A 73 -0.016 8.119 11.776 1.00 0.00 C ATOM 801 CG PRO A 73 -1.095 9.157 11.814 1.00 0.00 C ATOM 802 CD PRO A 73 -1.261 9.557 13.279 1.00 0.00 C ATOM 0 HA PRO A 73 1.283 7.566 13.476 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.524 8.148 10.830 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.432 7.116 11.875 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.825 10.020 11.205 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -2.028 8.762 11.412 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.548 10.604 13.379 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.034 8.966 13.771 1.00 0.00 H new ATOM 810 N ASP A 74 2.247 10.470 12.532 1.00 0.00 N ATOM 811 CA ASP A 74 3.471 11.195 12.070 1.00 0.00 C ATOM 812 C ASP A 74 4.501 11.294 13.208 1.00 0.00 C ATOM 813 O ASP A 74 5.688 11.388 12.967 1.00 0.00 O ATOM 814 CB ASP A 74 3.084 12.604 11.612 1.00 0.00 C ATOM 815 CG ASP A 74 2.365 12.523 10.263 1.00 0.00 C ATOM 816 OD1 ASP A 74 1.818 11.473 9.968 1.00 0.00 O ATOM 817 OD2 ASP A 74 2.375 13.511 9.548 1.00 0.00 O ATOM 0 H ASP A 74 1.492 11.066 12.872 1.00 0.00 H new ATOM 0 HA ASP A 74 3.915 10.643 11.242 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.437 13.074 12.353 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.974 13.227 11.525 1.00 0.00 H new ATOM 822 N SER A 75 4.066 11.277 14.441 1.00 0.00 N ATOM 823 CA SER A 75 5.032 11.376 15.574 1.00 0.00 C ATOM 824 C SER A 75 5.714 10.021 15.789 1.00 0.00 C ATOM 825 O SER A 75 6.296 9.772 16.827 1.00 0.00 O ATOM 826 CB SER A 75 4.279 11.770 16.847 1.00 0.00 C ATOM 827 OG SER A 75 3.571 12.980 16.622 1.00 0.00 O ATOM 0 H SER A 75 3.086 11.199 14.712 1.00 0.00 H new ATOM 0 HA SER A 75 5.786 12.129 15.343 1.00 0.00 H new ATOM 0 HB2 SER A 75 3.586 10.978 17.132 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.979 11.894 17.673 1.00 0.00 H new ATOM 0 HG SER A 75 3.113 13.249 17.446 1.00 0.00 H new ATOM 833 N VAL A 76 5.641 9.142 14.816 1.00 0.00 N ATOM 834 CA VAL A 76 6.276 7.789 14.942 1.00 0.00 C ATOM 835 C VAL A 76 7.332 7.636 13.824 1.00 0.00 C ATOM 836 O VAL A 76 6.984 7.612 12.660 1.00 0.00 O ATOM 837 CB VAL A 76 5.177 6.723 14.773 1.00 0.00 C ATOM 838 CG1 VAL A 76 5.612 5.396 15.412 1.00 0.00 C ATOM 839 CG2 VAL A 76 3.896 7.216 15.450 1.00 0.00 C ATOM 0 H VAL A 76 5.163 9.306 13.930 1.00 0.00 H new ATOM 0 HA VAL A 76 6.756 7.671 15.913 1.00 0.00 H new ATOM 0 HB VAL A 76 5.002 6.558 13.710 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.824 4.654 15.283 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.524 5.043 14.932 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.797 5.548 16.475 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.112 6.467 15.335 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.086 7.383 16.510 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.576 8.150 14.987 1.00 0.00 H new ATOM 849 N PRO A 77 8.610 7.557 14.147 1.00 0.00 N ATOM 850 CA PRO A 77 9.676 7.435 13.107 1.00 0.00 C ATOM 851 C PRO A 77 9.776 6.021 12.508 1.00 0.00 C ATOM 852 O PRO A 77 9.289 5.064 13.078 1.00 0.00 O ATOM 853 CB PRO A 77 10.963 7.809 13.858 1.00 0.00 C ATOM 854 CG PRO A 77 10.699 7.469 15.295 1.00 0.00 C ATOM 855 CD PRO A 77 9.180 7.575 15.510 1.00 0.00 C ATOM 0 HA PRO A 77 9.472 8.075 12.249 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.818 7.253 13.473 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.193 8.868 13.741 1.00 0.00 H new ATOM 0 HG2 PRO A 77 11.052 6.464 15.525 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.231 8.152 15.957 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.805 6.744 16.108 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.917 8.492 16.038 1.00 0.00 H new ATOM 863 N PRO A 78 10.412 5.895 11.363 1.00 0.00 N ATOM 864 CA PRO A 78 10.588 4.581 10.673 1.00 0.00 C ATOM 865 C PRO A 78 11.693 3.738 11.313 1.00 0.00 C ATOM 866 O PRO A 78 12.421 4.195 12.172 1.00 0.00 O ATOM 867 CB PRO A 78 10.975 4.980 9.246 1.00 0.00 C ATOM 868 CG PRO A 78 11.691 6.284 9.402 1.00 0.00 C ATOM 869 CD PRO A 78 11.036 6.994 10.594 1.00 0.00 C ATOM 0 HA PRO A 78 9.691 3.965 10.727 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.615 4.229 8.784 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.095 5.084 8.611 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.754 6.125 9.580 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.606 6.885 8.497 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.771 7.533 11.192 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.295 7.724 10.267 1.00 0.00 H new ATOM 877 N ILE A 79 11.821 2.509 10.887 1.00 0.00 N ATOM 878 CA ILE A 79 12.877 1.606 11.445 1.00 0.00 C ATOM 879 C ILE A 79 13.945 1.361 10.379 1.00 0.00 C ATOM 880 O ILE A 79 13.760 1.670 9.220 1.00 0.00 O ATOM 881 CB ILE A 79 12.238 0.272 11.841 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.273 -0.172 10.735 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.470 0.437 13.161 1.00 0.00 C ATOM 884 CD1 ILE A 79 10.950 -1.655 10.909 1.00 0.00 C ATOM 0 H ILE A 79 11.234 2.086 10.169 1.00 0.00 H new ATOM 0 HA ILE A 79 13.334 2.068 12.320 1.00 0.00 H new ATOM 0 HB ILE A 79 13.016 -0.481 11.973 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.358 0.418 10.777 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.720 0.002 9.756 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.017 -0.514 13.440 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.158 0.755 13.945 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.690 1.188 13.037 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.264 -1.973 10.124 1.00 0.00 H new ATOM 0 HD12 ILE A 79 11.869 -2.237 10.845 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.486 -1.815 11.882 1.00 0.00 H new ATOM 896 N ASP A 80 15.064 0.801 10.760 1.00 0.00 N ATOM 897 CA ASP A 80 16.144 0.531 9.765 1.00 0.00 C ATOM 898 C ASP A 80 15.960 -0.878 9.199 1.00 0.00 C ATOM 899 O ASP A 80 15.705 -1.819 9.924 1.00 0.00 O ATOM 900 CB ASP A 80 17.510 0.633 10.451 1.00 0.00 C ATOM 901 CG ASP A 80 18.608 0.775 9.393 1.00 0.00 C ATOM 902 OD1 ASP A 80 18.970 -0.231 8.806 1.00 0.00 O ATOM 903 OD2 ASP A 80 19.066 1.887 9.189 1.00 0.00 O ATOM 0 H ASP A 80 15.276 0.519 11.717 1.00 0.00 H new ATOM 0 HA ASP A 80 16.092 1.262 8.958 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.527 1.490 11.124 1.00 0.00 H new ATOM 0 HB3 ASP A 80 17.690 -0.254 11.059 1.00 0.00 H new ATOM 908 N VAL A 81 16.080 -1.028 7.907 1.00 0.00 N ATOM 909 CA VAL A 81 15.905 -2.373 7.274 1.00 0.00 C ATOM 910 C VAL A 81 16.981 -2.574 6.198 1.00 0.00 C ATOM 911 O VAL A 81 17.300 -1.677 5.442 1.00 0.00 O ATOM 912 CB VAL A 81 14.492 -2.445 6.664 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.406 -3.546 5.602 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.480 -2.744 7.776 1.00 0.00 C ATOM 0 H VAL A 81 16.293 -0.272 7.256 1.00 0.00 H new ATOM 0 HA VAL A 81 16.014 -3.165 8.015 1.00 0.00 H new ATOM 0 HB VAL A 81 14.270 -1.488 6.191 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.398 -3.574 5.188 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.120 -3.339 4.805 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.639 -4.509 6.057 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.478 -2.796 7.351 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.726 -3.697 8.245 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.516 -1.952 8.524 1.00 0.00 H new ATOM 924 N LEU A 82 17.547 -3.752 6.136 1.00 0.00 N ATOM 925 CA LEU A 82 18.609 -4.031 5.126 1.00 0.00 C ATOM 926 C LEU A 82 17.971 -4.474 3.806 1.00 0.00 C ATOM 927 O LEU A 82 16.986 -5.185 3.785 1.00 0.00 O ATOM 928 CB LEU A 82 19.523 -5.148 5.645 1.00 0.00 C ATOM 929 CG LEU A 82 20.124 -4.753 7.012 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.490 -6.013 7.800 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.388 -3.910 6.809 1.00 0.00 C ATOM 0 H LEU A 82 17.317 -4.537 6.746 1.00 0.00 H new ATOM 0 HA LEU A 82 19.190 -3.124 4.958 1.00 0.00 H new ATOM 0 HB2 LEU A 82 18.958 -6.075 5.742 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.323 -5.336 4.929 1.00 0.00 H new ATOM 0 HG LEU A 82 19.384 -4.173 7.563 1.00 0.00 H new ATOM 0 HD11 LEU A 82 20.914 -5.729 8.763 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.595 -6.615 7.960 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.222 -6.593 7.239 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.803 -3.637 7.779 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.124 -4.487 6.249 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.137 -3.006 6.255 1.00 0.00 H new ATOM 943 N TRP A 83 18.534 -4.047 2.705 1.00 0.00 N ATOM 944 CA TRP A 83 17.995 -4.409 1.359 1.00 0.00 C ATOM 945 C TRP A 83 19.065 -5.210 0.610 1.00 0.00 C ATOM 946 O TRP A 83 20.115 -4.691 0.284 1.00 0.00 O ATOM 947 CB TRP A 83 17.709 -3.100 0.630 1.00 0.00 C ATOM 948 CG TRP A 83 17.214 -3.309 -0.768 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.745 -4.462 -1.316 1.00 0.00 C ATOM 950 CD2 TRP A 83 17.136 -2.305 -1.809 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.389 -4.210 -2.636 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.619 -2.892 -2.982 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.472 -0.944 -1.835 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.441 -2.149 -4.149 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.298 -0.191 -3.006 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.784 -0.794 -4.161 1.00 0.00 C ATOM 0 H TRP A 83 19.361 -3.451 2.682 1.00 0.00 H new ATOM 0 HA TRP A 83 17.088 -5.010 1.428 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.968 -2.531 1.192 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.618 -2.499 0.602 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.663 -5.413 -0.811 1.00 0.00 H new ATOM 0 HE1 TRP A 83 16.006 -4.911 -3.270 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.867 -0.472 -0.948 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 16.041 -2.617 -5.036 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.561 0.856 -3.017 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.653 -0.212 -5.061 1.00 0.00 H new ATOM 967 N ILE A 84 18.820 -6.474 0.353 1.00 0.00 N ATOM 968 CA ILE A 84 19.838 -7.319 -0.355 1.00 0.00 C ATOM 969 C ILE A 84 19.175 -8.092 -1.496 1.00 0.00 C ATOM 970 O ILE A 84 18.036 -8.505 -1.401 1.00 0.00 O ATOM 971 CB ILE A 84 20.446 -8.309 0.643 1.00 0.00 C ATOM 972 CG1 ILE A 84 20.908 -7.552 1.888 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.649 -9.010 0.009 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.603 -8.522 2.844 1.00 0.00 C ATOM 0 H ILE A 84 17.958 -6.958 0.603 1.00 0.00 H new ATOM 0 HA ILE A 84 20.617 -6.677 -0.766 1.00 0.00 H new ATOM 0 HB ILE A 84 19.695 -9.051 0.916 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.590 -6.750 1.607 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.055 -7.087 2.381 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.078 -9.713 0.723 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.328 -9.548 -0.883 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.399 -8.268 -0.265 1.00 0.00 H new ATOM 0 HD11 ILE A 84 21.933 -7.984 3.732 1.00 0.00 H new ATOM 0 HD12 ILE A 84 20.906 -9.309 3.134 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.466 -8.966 2.348 1.00 0.00 H new ATOM 986 N LYS A 85 19.890 -8.285 -2.578 1.00 0.00 N ATOM 987 CA LYS A 85 19.332 -9.028 -3.751 1.00 0.00 C ATOM 988 C LYS A 85 20.003 -10.397 -3.856 1.00 0.00 C ATOM 989 O LYS A 85 21.093 -10.611 -3.362 1.00 0.00 O ATOM 990 CB LYS A 85 19.595 -8.218 -5.031 1.00 0.00 C ATOM 991 CG LYS A 85 18.476 -7.200 -5.226 1.00 0.00 C ATOM 992 CD LYS A 85 18.771 -6.319 -6.449 1.00 0.00 C ATOM 993 CE LYS A 85 17.477 -5.683 -6.972 1.00 0.00 C ATOM 994 NZ LYS A 85 17.030 -4.622 -6.032 1.00 0.00 N ATOM 0 H LYS A 85 20.848 -7.955 -2.699 1.00 0.00 H new ATOM 0 HA LYS A 85 18.259 -9.167 -3.623 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.556 -7.709 -4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 85 19.649 -8.885 -5.892 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.525 -7.715 -5.360 1.00 0.00 H new ATOM 0 HG3 LYS A 85 18.380 -6.579 -4.335 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.484 -5.540 -6.181 1.00 0.00 H new ATOM 0 HD3 LYS A 85 19.233 -6.918 -7.234 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.642 -5.260 -7.963 1.00 0.00 H new ATOM 0 HE3 LYS A 85 16.702 -6.442 -7.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 16.135 -4.214 -6.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 16.889 -5.032 -5.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 17.753 -3.876 -5.981 1.00 0.00 H new ATOM 1008 N GLY A 86 19.344 -11.328 -4.492 1.00 0.00 N ATOM 1009 CA GLY A 86 19.912 -12.701 -4.635 1.00 0.00 C ATOM 1010 C GLY A 86 20.552 -12.871 -6.012 1.00 0.00 C ATOM 1011 O GLY A 86 20.778 -11.919 -6.733 1.00 0.00 O ATOM 0 H GLY A 86 18.429 -11.195 -4.922 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.655 -12.877 -3.857 1.00 0.00 H new ATOM 0 HA3 GLY A 86 19.125 -13.443 -4.498 1.00 0.00 H new ATOM 1015 N ALA A 87 20.856 -14.087 -6.370 1.00 0.00 N ATOM 1016 CA ALA A 87 21.498 -14.357 -7.687 1.00 0.00 C ATOM 1017 C ALA A 87 20.515 -14.090 -8.837 1.00 0.00 C ATOM 1018 O ALA A 87 20.890 -14.143 -9.992 1.00 0.00 O ATOM 1019 CB ALA A 87 21.951 -15.823 -7.727 1.00 0.00 C ATOM 0 H ALA A 87 20.685 -14.915 -5.800 1.00 0.00 H new ATOM 0 HA ALA A 87 22.355 -13.694 -7.808 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.423 -16.032 -8.687 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.666 -16.005 -6.924 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.087 -16.475 -7.598 1.00 0.00 H new ATOM 1025 N GLN A 88 19.261 -13.820 -8.542 1.00 0.00 N ATOM 1026 CA GLN A 88 18.259 -13.568 -9.635 1.00 0.00 C ATOM 1027 C GLN A 88 17.473 -12.276 -9.363 1.00 0.00 C ATOM 1028 O GLN A 88 16.289 -12.194 -9.624 1.00 0.00 O ATOM 1029 CB GLN A 88 17.297 -14.756 -9.709 1.00 0.00 C ATOM 1030 CG GLN A 88 18.107 -16.056 -9.700 1.00 0.00 C ATOM 1031 CD GLN A 88 17.219 -17.222 -10.141 1.00 0.00 C ATOM 1032 OE1 GLN A 88 16.097 -17.020 -10.562 1.00 0.00 O ATOM 1033 NE2 GLN A 88 17.678 -18.443 -10.063 1.00 0.00 N ATOM 0 H GLN A 88 18.888 -13.763 -7.594 1.00 0.00 H new ATOM 0 HA GLN A 88 18.784 -13.454 -10.583 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.608 -14.736 -8.864 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.693 -14.695 -10.614 1.00 0.00 H new ATOM 0 HG2 GLN A 88 18.964 -15.966 -10.368 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.500 -16.244 -8.701 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.620 -18.612 -9.710 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.095 -19.227 -10.356 1.00 0.00 H new ATOM 1042 N GLY A 89 18.131 -11.258 -8.875 1.00 0.00 N ATOM 1043 CA GLY A 89 17.441 -9.957 -8.623 1.00 0.00 C ATOM 1044 C GLY A 89 16.398 -10.077 -7.503 1.00 0.00 C ATOM 1045 O GLY A 89 15.892 -9.086 -7.016 1.00 0.00 O ATOM 0 H GLY A 89 19.123 -11.271 -8.638 1.00 0.00 H new ATOM 0 HA2 GLY A 89 18.178 -9.200 -8.355 1.00 0.00 H new ATOM 0 HA3 GLY A 89 16.955 -9.619 -9.538 1.00 0.00 H new ATOM 1049 N GLY A 90 16.066 -11.267 -7.089 1.00 0.00 N ATOM 1050 CA GLY A 90 15.057 -11.424 -6.011 1.00 0.00 C ATOM 1051 C GLY A 90 15.411 -10.509 -4.843 1.00 0.00 C ATOM 1052 O GLY A 90 16.368 -10.727 -4.130 1.00 0.00 O ATOM 0 H GLY A 90 16.452 -12.138 -7.453 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.064 -11.180 -6.390 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.025 -12.461 -5.677 1.00 0.00 H new ATOM 1056 N ASP A 91 14.641 -9.485 -4.645 1.00 0.00 N ATOM 1057 CA ASP A 91 14.916 -8.553 -3.522 1.00 0.00 C ATOM 1058 C ASP A 91 14.412 -9.186 -2.225 1.00 0.00 C ATOM 1059 O ASP A 91 13.319 -9.714 -2.163 1.00 0.00 O ATOM 1060 CB ASP A 91 14.193 -7.219 -3.769 1.00 0.00 C ATOM 1061 CG ASP A 91 15.045 -6.330 -4.677 1.00 0.00 C ATOM 1062 OD1 ASP A 91 16.140 -5.983 -4.268 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.588 -6.011 -5.762 1.00 0.00 O ATOM 0 H ASP A 91 13.828 -9.250 -5.214 1.00 0.00 H new ATOM 0 HA ASP A 91 15.987 -8.364 -3.448 1.00 0.00 H new ATOM 0 HB2 ASP A 91 13.222 -7.401 -4.229 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.007 -6.714 -2.821 1.00 0.00 H new ATOM 1068 N TYR A 92 15.209 -9.135 -1.193 1.00 0.00 N ATOM 1069 CA TYR A 92 14.809 -9.727 0.121 1.00 0.00 C ATOM 1070 C TYR A 92 15.012 -8.669 1.209 1.00 0.00 C ATOM 1071 O TYR A 92 16.080 -8.104 1.341 1.00 0.00 O ATOM 1072 CB TYR A 92 15.686 -10.952 0.399 1.00 0.00 C ATOM 1073 CG TYR A 92 15.470 -11.982 -0.694 1.00 0.00 C ATOM 1074 CD1 TYR A 92 14.418 -12.903 -0.595 1.00 0.00 C ATOM 1075 CD2 TYR A 92 16.321 -12.017 -1.808 1.00 0.00 C ATOM 1076 CE1 TYR A 92 14.218 -13.853 -1.604 1.00 0.00 C ATOM 1077 CE2 TYR A 92 16.119 -12.967 -2.816 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.068 -13.885 -2.714 1.00 0.00 C ATOM 1079 OH TYR A 92 14.871 -14.821 -3.708 1.00 0.00 O ATOM 0 H TYR A 92 16.133 -8.703 -1.202 1.00 0.00 H new ATOM 0 HA TYR A 92 13.764 -10.036 0.106 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.736 -10.661 0.438 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.437 -11.379 1.371 1.00 0.00 H new ATOM 0 HD1 TYR A 92 13.760 -12.880 0.261 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.133 -11.310 -1.888 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.407 -14.562 -1.525 1.00 0.00 H new ATOM 0 HE2 TYR A 92 16.775 -12.991 -3.673 1.00 0.00 H new ATOM 0 HH TYR A 92 15.380 -14.564 -4.505 1.00 0.00 H new ATOM 1089 N PHE A 93 13.987 -8.373 1.973 1.00 0.00 N ATOM 1090 CA PHE A 93 14.102 -7.328 3.032 1.00 0.00 C ATOM 1091 C PHE A 93 14.294 -7.981 4.404 1.00 0.00 C ATOM 1092 O PHE A 93 13.479 -8.759 4.858 1.00 0.00 O ATOM 1093 CB PHE A 93 12.824 -6.478 3.027 1.00 0.00 C ATOM 1094 CG PHE A 93 12.619 -5.875 1.650 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.382 -4.769 1.242 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.676 -6.430 0.773 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.199 -4.225 -0.034 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.499 -5.886 -0.504 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.260 -4.785 -0.908 1.00 0.00 C ATOM 0 H PHE A 93 13.071 -8.816 1.905 1.00 0.00 H new ATOM 0 HA PHE A 93 14.967 -6.696 2.830 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.965 -7.093 3.297 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.898 -5.688 3.774 1.00 0.00 H new ATOM 0 HD1 PHE A 93 14.110 -4.338 1.913 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.085 -7.279 1.084 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.783 -3.372 -0.345 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.774 -6.317 -1.178 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.123 -4.367 -1.894 1.00 0.00 H new ATOM 1109 N TYR A 94 15.381 -7.659 5.059 1.00 0.00 N ATOM 1110 CA TYR A 94 15.680 -8.233 6.406 1.00 0.00 C ATOM 1111 C TYR A 94 15.518 -7.142 7.466 1.00 0.00 C ATOM 1112 O TYR A 94 15.967 -6.027 7.295 1.00 0.00 O ATOM 1113 CB TYR A 94 17.137 -8.741 6.416 1.00 0.00 C ATOM 1114 CG TYR A 94 17.175 -10.205 6.059 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.192 -10.598 4.718 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.186 -11.165 7.074 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.223 -11.956 4.390 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.216 -12.524 6.746 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.234 -12.920 5.404 1.00 0.00 C ATOM 1120 OH TYR A 94 17.264 -14.261 5.080 1.00 0.00 O ATOM 0 H TYR A 94 16.087 -7.010 4.710 1.00 0.00 H new ATOM 0 HA TYR A 94 14.997 -9.055 6.622 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.735 -8.169 5.706 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.578 -8.587 7.401 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.181 -9.853 3.936 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.171 -10.858 8.109 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.238 -12.261 3.354 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.225 -13.268 7.529 1.00 0.00 H new ATOM 0 HH TYR A 94 17.269 -14.796 5.901 1.00 0.00 H new ATOM 1130 N SER A 95 14.895 -7.470 8.568 1.00 0.00 N ATOM 1131 CA SER A 95 14.706 -6.475 9.669 1.00 0.00 C ATOM 1132 C SER A 95 15.260 -7.057 10.972 1.00 0.00 C ATOM 1133 O SER A 95 14.936 -8.162 11.359 1.00 0.00 O ATOM 1134 CB SER A 95 13.209 -6.160 9.828 1.00 0.00 C ATOM 1135 OG SER A 95 13.050 -4.798 10.195 1.00 0.00 O ATOM 0 H SER A 95 14.505 -8.394 8.755 1.00 0.00 H new ATOM 0 HA SER A 95 15.238 -5.554 9.429 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.683 -6.360 8.895 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.769 -6.806 10.587 1.00 0.00 H new ATOM 0 HG SER A 95 12.096 -4.595 10.295 1.00 0.00 H new ATOM 1141 N PHE A 96 16.072 -6.302 11.659 1.00 0.00 N ATOM 1142 CA PHE A 96 16.640 -6.761 12.954 1.00 0.00 C ATOM 1143 C PHE A 96 16.424 -5.634 13.960 1.00 0.00 C ATOM 1144 O PHE A 96 17.242 -4.748 14.111 1.00 0.00 O ATOM 1145 CB PHE A 96 18.132 -7.004 12.802 1.00 0.00 C ATOM 1146 CG PHE A 96 18.362 -8.285 12.035 1.00 0.00 C ATOM 1147 CD1 PHE A 96 18.068 -9.515 12.628 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.881 -8.243 10.739 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.296 -10.704 11.926 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.108 -9.427 10.035 1.00 0.00 C ATOM 1151 CZ PHE A 96 18.818 -10.660 10.629 1.00 0.00 C ATOM 0 H PHE A 96 16.370 -5.370 11.371 1.00 0.00 H new ATOM 0 HA PHE A 96 16.162 -7.685 13.279 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.595 -6.167 12.279 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.602 -7.067 13.783 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.664 -9.548 13.629 1.00 0.00 H new ATOM 0 HD2 PHE A 96 19.107 -7.292 10.280 1.00 0.00 H new ATOM 0 HE1 PHE A 96 18.069 -11.655 12.385 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.507 -9.391 9.032 1.00 0.00 H new ATOM 0 HZ PHE A 96 18.997 -11.577 10.087 1.00 0.00 H new ATOM 1161 N GLY A 97 15.316 -5.659 14.629 1.00 0.00 N ATOM 1162 CA GLY A 97 14.985 -4.597 15.625 1.00 0.00 C ATOM 1163 C GLY A 97 13.519 -4.211 15.430 1.00 0.00 C ATOM 1164 O GLY A 97 12.738 -4.976 14.899 1.00 0.00 O ATOM 0 H GLY A 97 14.605 -6.384 14.531 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.152 -4.960 16.639 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.630 -3.729 15.486 1.00 0.00 H new ATOM 1168 N GLY A 98 13.134 -3.031 15.836 1.00 0.00 N ATOM 1169 CA GLY A 98 11.713 -2.611 15.652 1.00 0.00 C ATOM 1170 C GLY A 98 10.769 -3.738 16.094 1.00 0.00 C ATOM 1171 O GLY A 98 9.594 -3.732 15.784 1.00 0.00 O ATOM 0 H GLY A 98 13.738 -2.342 16.285 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.514 -1.710 16.233 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.531 -2.363 14.606 1.00 0.00 H new ATOM 1175 N CYS A 99 11.276 -4.712 16.800 1.00 0.00 N ATOM 1176 CA CYS A 99 10.412 -5.845 17.244 1.00 0.00 C ATOM 1177 C CYS A 99 9.148 -5.307 17.924 1.00 0.00 C ATOM 1178 O CYS A 99 8.057 -5.789 17.691 1.00 0.00 O ATOM 1179 CB CYS A 99 11.193 -6.736 18.221 1.00 0.00 C ATOM 1180 SG CYS A 99 10.468 -8.394 18.237 1.00 0.00 S ATOM 0 H CYS A 99 12.252 -4.773 17.089 1.00 0.00 H new ATOM 0 HA CYS A 99 10.120 -6.434 16.375 1.00 0.00 H new ATOM 0 HB2 CYS A 99 12.240 -6.788 17.924 1.00 0.00 H new ATOM 0 HB3 CYS A 99 11.167 -6.306 19.222 1.00 0.00 H new ATOM 0 HG CYS A 99 11.284 -9.230 17.668 1.00 0.00 H new ATOM 1186 N HIS A 100 9.281 -4.317 18.763 1.00 0.00 N ATOM 1187 CA HIS A 100 8.083 -3.763 19.451 1.00 0.00 C ATOM 1188 C HIS A 100 7.287 -2.889 18.473 1.00 0.00 C ATOM 1189 O HIS A 100 6.107 -3.095 18.272 1.00 0.00 O ATOM 1190 CB HIS A 100 8.537 -2.938 20.667 1.00 0.00 C ATOM 1191 CG HIS A 100 8.769 -3.853 21.848 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.869 -4.695 21.925 1.00 0.00 N ATOM 1193 CD2 HIS A 100 8.046 -4.078 22.998 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.778 -5.381 23.081 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.686 -5.042 23.772 1.00 0.00 N ATOM 0 H HIS A 100 10.166 -3.869 19.001 1.00 0.00 H new ATOM 0 HA HIS A 100 7.440 -4.574 19.793 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.453 -2.396 20.429 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.781 -2.193 20.915 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.612 -4.779 21.232 1.00 0.00 H new ATOM 0 HD2 HIS A 100 7.123 -3.582 23.260 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.499 -6.115 23.409 1.00 0.00 H new ATOM 1203 N ARG A 101 7.914 -1.925 17.856 1.00 0.00 N ATOM 1204 CA ARG A 101 7.169 -1.067 16.892 1.00 0.00 C ATOM 1205 C ARG A 101 6.480 -1.964 15.865 1.00 0.00 C ATOM 1206 O ARG A 101 5.432 -1.644 15.343 1.00 0.00 O ATOM 1207 CB ARG A 101 8.137 -0.105 16.200 1.00 0.00 C ATOM 1208 CG ARG A 101 8.935 0.630 17.278 1.00 0.00 C ATOM 1209 CD ARG A 101 9.762 1.774 16.667 1.00 0.00 C ATOM 1210 NE ARG A 101 11.090 1.250 16.236 1.00 0.00 N ATOM 1211 CZ ARG A 101 12.107 2.062 16.115 1.00 0.00 C ATOM 1212 NH1 ARG A 101 11.956 3.337 16.352 1.00 0.00 N ATOM 1213 NH2 ARG A 101 13.273 1.600 15.754 1.00 0.00 N ATOM 0 H ARG A 101 8.901 -1.696 17.976 1.00 0.00 H new ATOM 0 HA ARG A 101 6.418 -0.478 17.418 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.808 -0.652 15.538 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.589 0.606 15.582 1.00 0.00 H new ATOM 0 HG2 ARG A 101 8.255 1.030 18.030 1.00 0.00 H new ATOM 0 HG3 ARG A 101 9.597 -0.071 17.787 1.00 0.00 H new ATOM 0 HD2 ARG A 101 9.235 2.204 15.815 1.00 0.00 H new ATOM 0 HD3 ARG A 101 9.893 2.573 17.397 1.00 0.00 H new ATOM 0 HE ARG A 101 11.205 0.257 16.035 1.00 0.00 H new ATOM 0 HH11 ARG A 101 11.044 3.699 16.632 1.00 0.00 H new ATOM 0 HH12 ARG A 101 12.750 3.971 16.258 1.00 0.00 H new ATOM 0 HH21 ARG A 101 13.391 0.604 15.566 1.00 0.00 H new ATOM 0 HH22 ARG A 101 14.066 2.234 15.660 1.00 0.00 H new ATOM 1227 N TYR A 102 7.060 -3.098 15.590 1.00 0.00 N ATOM 1228 CA TYR A 102 6.442 -4.041 14.612 1.00 0.00 C ATOM 1229 C TYR A 102 5.136 -4.579 15.207 1.00 0.00 C ATOM 1230 O TYR A 102 4.133 -4.688 14.532 1.00 0.00 O ATOM 1231 CB TYR A 102 7.421 -5.197 14.338 1.00 0.00 C ATOM 1232 CG TYR A 102 6.709 -6.356 13.674 1.00 0.00 C ATOM 1233 CD1 TYR A 102 6.068 -7.312 14.467 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.693 -6.480 12.277 1.00 0.00 C ATOM 1235 CE1 TYR A 102 5.411 -8.393 13.871 1.00 0.00 C ATOM 1236 CE2 TYR A 102 6.034 -7.563 11.681 1.00 0.00 C ATOM 1237 CZ TYR A 102 5.394 -8.519 12.478 1.00 0.00 C ATOM 1238 OH TYR A 102 4.746 -9.586 11.890 1.00 0.00 O ATOM 0 H TYR A 102 7.938 -3.415 16.001 1.00 0.00 H new ATOM 0 HA TYR A 102 6.227 -3.531 13.673 1.00 0.00 H new ATOM 0 HB2 TYR A 102 8.233 -4.849 13.700 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.871 -5.528 15.274 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.080 -7.216 15.543 1.00 0.00 H new ATOM 0 HD2 TYR A 102 7.187 -5.742 11.662 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.917 -9.130 14.486 1.00 0.00 H new ATOM 0 HE2 TYR A 102 6.020 -7.660 10.605 1.00 0.00 H new ATOM 0 HH TYR A 102 4.829 -9.522 10.916 1.00 0.00 H new ATOM 1248 N ALA A 103 5.144 -4.913 16.469 1.00 0.00 N ATOM 1249 CA ALA A 103 3.906 -5.440 17.114 1.00 0.00 C ATOM 1250 C ALA A 103 2.786 -4.406 17.001 1.00 0.00 C ATOM 1251 O ALA A 103 1.655 -4.734 16.709 1.00 0.00 O ATOM 1252 CB ALA A 103 4.183 -5.725 18.591 1.00 0.00 C ATOM 0 H ALA A 103 5.956 -4.844 17.083 1.00 0.00 H new ATOM 0 HA ALA A 103 3.603 -6.359 16.613 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.279 -6.110 19.063 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.980 -6.464 18.676 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.488 -4.804 19.088 1.00 0.00 H new ATOM 1258 N ALA A 104 3.088 -3.159 17.237 1.00 0.00 N ATOM 1259 CA ALA A 104 2.033 -2.113 17.148 1.00 0.00 C ATOM 1260 C ALA A 104 1.451 -2.098 15.733 1.00 0.00 C ATOM 1261 O ALA A 104 0.252 -2.044 15.545 1.00 0.00 O ATOM 1262 CB ALA A 104 2.637 -0.744 17.473 1.00 0.00 C ATOM 0 H ALA A 104 4.017 -2.821 17.487 1.00 0.00 H new ATOM 0 HA ALA A 104 1.241 -2.333 17.863 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.863 0.020 17.407 1.00 0.00 H new ATOM 0 HB2 ALA A 104 3.048 -0.758 18.482 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.431 -0.518 16.761 1.00 0.00 H new ATOM 1268 N TYR A 105 2.290 -2.150 14.736 1.00 0.00 N ATOM 1269 CA TYR A 105 1.789 -2.145 13.338 1.00 0.00 C ATOM 1270 C TYR A 105 1.064 -3.470 13.064 1.00 0.00 C ATOM 1271 O TYR A 105 0.015 -3.500 12.451 1.00 0.00 O ATOM 1272 CB TYR A 105 2.991 -1.985 12.386 1.00 0.00 C ATOM 1273 CG TYR A 105 3.215 -0.524 12.059 1.00 0.00 C ATOM 1274 CD1 TYR A 105 2.549 0.058 10.975 1.00 0.00 C ATOM 1275 CD2 TYR A 105 4.089 0.244 12.838 1.00 0.00 C ATOM 1276 CE1 TYR A 105 2.754 1.408 10.670 1.00 0.00 C ATOM 1277 CE2 TYR A 105 4.296 1.595 12.532 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.627 2.177 11.448 1.00 0.00 C ATOM 1279 OH TYR A 105 3.830 3.508 11.147 1.00 0.00 O ATOM 0 H TYR A 105 3.304 -2.196 14.832 1.00 0.00 H new ATOM 0 HA TYR A 105 1.093 -1.321 13.181 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.886 -2.402 12.847 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.814 -2.546 11.469 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.876 -0.535 10.373 1.00 0.00 H new ATOM 0 HD2 TYR A 105 4.603 -0.205 13.675 1.00 0.00 H new ATOM 0 HE1 TYR A 105 2.238 1.857 9.834 1.00 0.00 H new ATOM 0 HE2 TYR A 105 4.971 2.188 13.132 1.00 0.00 H new ATOM 0 HH TYR A 105 4.464 3.895 11.786 1.00 0.00 H new ATOM 1289 N GLN A 106 1.617 -4.563 13.513 1.00 0.00 N ATOM 1290 CA GLN A 106 0.971 -5.880 13.282 1.00 0.00 C ATOM 1291 C GLN A 106 -0.403 -5.900 13.959 1.00 0.00 C ATOM 1292 O GLN A 106 -1.384 -6.326 13.384 1.00 0.00 O ATOM 1293 CB GLN A 106 1.859 -6.976 13.881 1.00 0.00 C ATOM 1294 CG GLN A 106 1.341 -8.361 13.470 1.00 0.00 C ATOM 1295 CD GLN A 106 0.147 -8.757 14.348 1.00 0.00 C ATOM 1296 OE1 GLN A 106 -0.989 -8.579 13.956 1.00 0.00 O ATOM 1297 NE2 GLN A 106 0.348 -9.296 15.525 1.00 0.00 N ATOM 0 H GLN A 106 2.494 -4.598 14.033 1.00 0.00 H new ATOM 0 HA GLN A 106 0.844 -6.052 12.213 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.887 -6.848 13.541 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.870 -6.892 14.968 1.00 0.00 H new ATOM 0 HG2 GLN A 106 1.044 -8.351 12.421 1.00 0.00 H new ATOM 0 HG3 GLN A 106 2.136 -9.100 13.569 1.00 0.00 H new ATOM 0 HE21 GLN A 106 1.299 -9.448 15.860 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -0.447 -9.563 16.106 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.476 -5.444 15.180 1.00 0.00 N ATOM 1307 CA GLN A 107 -1.778 -5.439 15.904 1.00 0.00 C ATOM 1308 C GLN A 107 -2.792 -4.567 15.158 1.00 0.00 C ATOM 1309 O GLN A 107 -3.941 -4.931 15.006 1.00 0.00 O ATOM 1310 CB GLN A 107 -1.569 -4.886 17.319 1.00 0.00 C ATOM 1311 CG GLN A 107 -2.904 -4.890 18.084 1.00 0.00 C ATOM 1312 CD GLN A 107 -2.644 -4.928 19.594 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -1.610 -4.490 20.057 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -3.550 -5.439 20.385 1.00 0.00 N ATOM 0 H GLN A 107 0.314 -5.073 15.709 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.161 -6.458 15.959 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -0.833 -5.490 17.850 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -1.172 -3.872 17.268 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.481 -4.001 17.829 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -3.500 -5.753 17.788 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.418 -5.807 19.996 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.389 -5.470 21.392 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.383 -3.418 14.694 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.334 -2.530 13.966 1.00 0.00 C ATOM 1325 C LEU A 108 -3.676 -3.144 12.606 1.00 0.00 C ATOM 1326 O LEU A 108 -4.357 -2.547 11.797 1.00 0.00 O ATOM 1327 CB LEU A 108 -2.695 -1.153 13.770 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.563 -0.450 15.134 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -1.737 0.834 14.975 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -3.959 -0.107 15.700 1.00 0.00 C ATOM 0 H LEU A 108 -1.434 -3.056 14.787 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.250 -2.423 14.547 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.714 -1.258 13.306 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.303 -0.550 13.096 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.059 -1.122 15.829 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.645 1.330 15.941 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.745 0.584 14.600 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.234 1.501 14.271 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.849 0.389 16.664 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.479 0.555 15.008 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.535 -1.023 15.827 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.217 -4.340 12.357 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.521 -5.009 11.059 1.00 0.00 C ATOM 1344 C GLN A 109 -3.324 -4.028 9.896 1.00 0.00 C ATOM 1345 O GLN A 109 -4.058 -4.046 8.928 1.00 0.00 O ATOM 1346 CB GLN A 109 -4.972 -5.507 11.077 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.165 -6.599 10.018 1.00 0.00 C ATOM 1348 CD GLN A 109 -6.575 -7.177 10.137 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -7.311 -6.860 11.166 1.00 0.00 O flip ATOM 1350 NE2 GLN A 109 -7.012 -7.925 9.285 1.00 0.00 N flip ATOM 0 H GLN A 109 -2.642 -4.885 12.999 1.00 0.00 H new ATOM 0 HA GLN A 109 -2.844 -5.852 10.922 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.219 -5.898 12.064 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.652 -4.677 10.884 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -5.012 -6.185 9.021 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -4.424 -7.387 10.153 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -6.436 -8.173 8.480 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -7.954 -8.305 9.375 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.334 -3.182 9.973 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.095 -2.222 8.862 1.00 0.00 C ATOM 1361 C ARG A 110 -1.582 -2.998 7.652 1.00 0.00 C ATOM 1362 O ARG A 110 -1.138 -4.121 7.769 1.00 0.00 O ATOM 1363 CB ARG A 110 -1.057 -1.179 9.296 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.674 -0.210 10.324 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.493 0.879 9.615 1.00 0.00 C ATOM 1366 NE ARG A 110 -2.848 1.946 10.594 1.00 0.00 N ATOM 1367 CZ ARG A 110 -1.984 2.880 10.887 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -0.805 2.877 10.328 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -2.300 3.815 11.740 1.00 0.00 N ATOM 0 H ARG A 110 -1.683 -3.115 10.755 1.00 0.00 H new ATOM 0 HA ARG A 110 -3.021 -1.707 8.605 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.190 -1.677 9.730 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.704 -0.623 8.427 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.312 -0.761 11.014 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.884 0.250 10.918 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -1.919 1.302 8.791 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -3.397 0.448 9.186 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.767 1.946 11.036 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -0.558 2.145 9.662 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -0.130 3.607 10.557 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.221 3.816 12.177 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -1.626 4.545 11.970 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.665 -2.420 6.490 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.204 -3.135 5.265 1.00 0.00 C ATOM 1385 C GLU A 111 0.324 -3.055 5.130 1.00 0.00 C ATOM 1386 O GLU A 111 0.961 -4.012 4.732 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.860 -2.505 4.033 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.329 -2.926 3.966 1.00 0.00 C ATOM 1389 CD GLU A 111 -4.072 -2.387 5.190 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -3.888 -1.222 5.504 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -4.812 -3.148 5.792 1.00 0.00 O ATOM 0 H GLU A 111 -2.032 -1.482 6.332 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.490 -4.184 5.344 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.784 -1.419 4.083 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.339 -2.820 3.129 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.786 -2.544 3.053 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.405 -4.013 3.931 1.00 0.00 H new ATOM 1398 N THR A 112 0.919 -1.922 5.432 1.00 0.00 N ATOM 1399 CA THR A 112 2.409 -1.789 5.289 1.00 0.00 C ATOM 1400 C THR A 112 3.010 -1.117 6.520 1.00 0.00 C ATOM 1401 O THR A 112 2.310 -0.713 7.427 1.00 0.00 O ATOM 1402 CB THR A 112 2.712 -0.916 4.070 1.00 0.00 C ATOM 1403 OG1 THR A 112 1.984 0.299 4.179 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.305 -1.636 2.773 1.00 0.00 C ATOM 0 H THR A 112 0.440 -1.087 5.770 1.00 0.00 H new ATOM 0 HA THR A 112 2.840 -2.784 5.176 1.00 0.00 H new ATOM 0 HB THR A 112 3.783 -0.715 4.037 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.910 0.717 3.296 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.529 -0.999 1.918 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.861 -2.569 2.685 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.237 -1.851 2.796 1.00 0.00 H new ATOM 1412 N ILE A 113 4.318 -0.987 6.546 1.00 0.00 N ATOM 1413 CA ILE A 113 4.996 -0.325 7.711 1.00 0.00 C ATOM 1414 C ILE A 113 6.124 0.597 7.203 1.00 0.00 C ATOM 1415 O ILE A 113 6.833 0.229 6.287 1.00 0.00 O ATOM 1416 CB ILE A 113 5.615 -1.390 8.625 1.00 0.00 C ATOM 1417 CG1 ILE A 113 6.093 -0.718 9.916 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.812 -2.053 7.930 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.531 -1.785 10.924 1.00 0.00 C ATOM 0 H ILE A 113 4.946 -1.311 5.810 1.00 0.00 H new ATOM 0 HA ILE A 113 4.257 0.257 8.262 1.00 0.00 H new ATOM 0 HB ILE A 113 4.868 -2.151 8.849 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.923 -0.045 9.701 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.292 -0.111 10.339 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.243 -2.807 8.588 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.480 -2.525 7.006 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.564 -1.298 7.702 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.870 -1.302 11.841 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.689 -2.440 11.149 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.346 -2.373 10.501 1.00 0.00 H new ATOM 1431 N PRO A 114 6.341 1.767 7.789 1.00 0.00 N ATOM 1432 CA PRO A 114 7.454 2.654 7.343 1.00 0.00 C ATOM 1433 C PRO A 114 8.813 2.041 7.702 1.00 0.00 C ATOM 1434 O PRO A 114 9.030 1.600 8.813 1.00 0.00 O ATOM 1435 CB PRO A 114 7.232 3.982 8.104 1.00 0.00 C ATOM 1436 CG PRO A 114 5.866 3.878 8.715 1.00 0.00 C ATOM 1437 CD PRO A 114 5.592 2.387 8.905 1.00 0.00 C ATOM 0 HA PRO A 114 7.458 2.797 6.262 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.994 4.126 8.870 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.295 4.835 7.429 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.826 4.405 9.668 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.115 4.332 8.068 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.944 2.032 9.874 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.527 2.162 8.851 1.00 0.00 H new ATOM 1445 N ALA A 115 9.723 2.006 6.774 1.00 0.00 N ATOM 1446 CA ALA A 115 11.062 1.418 7.063 1.00 0.00 C ATOM 1447 C ALA A 115 12.109 2.049 6.147 1.00 0.00 C ATOM 1448 O ALA A 115 11.916 2.166 4.953 1.00 0.00 O ATOM 1449 CB ALA A 115 11.020 -0.091 6.818 1.00 0.00 C ATOM 0 H ALA A 115 9.600 2.359 5.825 1.00 0.00 H new ATOM 0 HA ALA A 115 11.324 1.613 8.103 1.00 0.00 H new ATOM 0 HB1 ALA A 115 11.999 -0.521 7.029 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.275 -0.545 7.472 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.756 -0.284 5.778 1.00 0.00 H new ATOM 1455 N LYS A 116 13.217 2.455 6.698 1.00 0.00 N ATOM 1456 CA LYS A 116 14.279 3.077 5.865 1.00 0.00 C ATOM 1457 C LYS A 116 15.036 1.980 5.114 1.00 0.00 C ATOM 1458 O LYS A 116 15.600 1.084 5.710 1.00 0.00 O ATOM 1459 CB LYS A 116 15.252 3.850 6.771 1.00 0.00 C ATOM 1460 CG LYS A 116 15.920 4.969 5.975 1.00 0.00 C ATOM 1461 CD LYS A 116 16.866 5.754 6.886 1.00 0.00 C ATOM 1462 CE LYS A 116 17.625 6.794 6.059 1.00 0.00 C ATOM 1463 NZ LYS A 116 18.673 7.432 6.904 1.00 0.00 N ATOM 0 H LYS A 116 13.433 2.382 7.692 1.00 0.00 H new ATOM 0 HA LYS A 116 13.830 3.765 5.149 1.00 0.00 H new ATOM 0 HB2 LYS A 116 14.716 4.267 7.624 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.008 3.173 7.170 1.00 0.00 H new ATOM 0 HG2 LYS A 116 16.473 4.550 5.134 1.00 0.00 H new ATOM 0 HG3 LYS A 116 15.164 5.635 5.559 1.00 0.00 H new ATOM 0 HD2 LYS A 116 16.301 6.246 7.678 1.00 0.00 H new ATOM 0 HD3 LYS A 116 17.568 5.075 7.370 1.00 0.00 H new ATOM 0 HE2 LYS A 116 18.082 6.320 5.190 1.00 0.00 H new ATOM 0 HE3 LYS A 116 16.935 7.550 5.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 19.189 8.139 6.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 18.226 7.897 7.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 19.337 6.706 7.241 1.00 0.00 H new ATOM 1477 N LEU A 117 15.061 2.045 3.812 1.00 0.00 N ATOM 1478 CA LEU A 117 15.796 0.999 3.036 1.00 0.00 C ATOM 1479 C LEU A 117 17.273 1.384 2.946 1.00 0.00 C ATOM 1480 O LEU A 117 17.616 2.516 2.666 1.00 0.00 O ATOM 1481 CB LEU A 117 15.227 0.878 1.617 1.00 0.00 C ATOM 1482 CG LEU A 117 13.710 0.624 1.655 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.209 0.345 0.230 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.393 -0.584 2.546 1.00 0.00 C ATOM 0 H LEU A 117 14.610 2.769 3.253 1.00 0.00 H new ATOM 0 HA LEU A 117 15.683 0.042 3.546 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.433 1.791 1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.723 0.063 1.090 1.00 0.00 H new ATOM 0 HG LEU A 117 13.213 1.505 2.062 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.134 0.164 0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.420 1.206 -0.405 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.717 -0.533 -0.169 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.316 -0.751 2.563 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.891 -1.469 2.150 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.746 -0.392 3.559 1.00 0.00 H new ATOM 1496 N VAL A 118 18.148 0.441 3.181 1.00 0.00 N ATOM 1497 CA VAL A 118 19.617 0.719 3.113 1.00 0.00 C ATOM 1498 C VAL A 118 20.295 -0.408 2.335 1.00 0.00 C ATOM 1499 O VAL A 118 20.290 -1.550 2.752 1.00 0.00 O ATOM 1500 CB VAL A 118 20.188 0.775 4.533 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.681 1.112 4.478 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.453 1.852 5.335 1.00 0.00 C ATOM 0 H VAL A 118 17.906 -0.521 3.420 1.00 0.00 H new ATOM 0 HA VAL A 118 19.794 1.672 2.615 1.00 0.00 H new ATOM 0 HB VAL A 118 20.055 -0.195 5.013 1.00 0.00 H new ATOM 0 HG11 VAL A 118 22.083 1.151 5.491 1.00 0.00 H new ATOM 0 HG12 VAL A 118 22.206 0.345 3.908 1.00 0.00 H new ATOM 0 HG13 VAL A 118 21.818 2.080 3.996 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.858 1.893 6.346 1.00 0.00 H new ATOM 0 HG22 VAL A 118 19.586 2.820 4.851 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.391 1.611 5.379 1.00 0.00 H new ATOM 1512 N GLN A 119 20.873 -0.105 1.205 1.00 0.00 N ATOM 1513 CA GLN A 119 21.538 -1.176 0.413 1.00 0.00 C ATOM 1514 C GLN A 119 22.536 -1.914 1.308 1.00 0.00 C ATOM 1515 O GLN A 119 23.237 -1.311 2.098 1.00 0.00 O ATOM 1516 CB GLN A 119 22.286 -0.571 -0.780 1.00 0.00 C ATOM 1517 CG GLN A 119 21.287 0.054 -1.764 1.00 0.00 C ATOM 1518 CD GLN A 119 20.552 1.231 -1.107 1.00 0.00 C ATOM 1519 OE1 GLN A 119 21.232 2.182 -0.527 1.00 0.00 O flip ATOM 1520 NE2 GLN A 119 19.341 1.293 -1.133 1.00 0.00 N flip ATOM 0 H GLN A 119 20.913 0.830 0.799 1.00 0.00 H new ATOM 0 HA GLN A 119 20.780 -1.867 0.043 1.00 0.00 H new ATOM 0 HB2 GLN A 119 22.989 0.186 -0.433 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.870 -1.342 -1.283 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.812 0.397 -2.656 1.00 0.00 H new ATOM 0 HG3 GLN A 119 20.567 -0.698 -2.087 1.00 0.00 H new ATOM 0 HE21 GLN A 119 18.802 0.554 -1.584 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.862 2.084 -0.704 1.00 0.00 H new ATOM 1529 N SER A 120 22.608 -3.214 1.194 1.00 0.00 N ATOM 1530 CA SER A 120 23.562 -3.997 2.039 1.00 0.00 C ATOM 1531 C SER A 120 24.147 -5.142 1.210 1.00 0.00 C ATOM 1532 O SER A 120 23.841 -5.295 0.044 1.00 0.00 O ATOM 1533 CB SER A 120 22.815 -4.561 3.252 1.00 0.00 C ATOM 1534 OG SER A 120 22.680 -3.545 4.235 1.00 0.00 O ATOM 0 H SER A 120 22.046 -3.771 0.550 1.00 0.00 H new ATOM 0 HA SER A 120 24.371 -3.352 2.382 1.00 0.00 H new ATOM 0 HB2 SER A 120 21.832 -4.925 2.951 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.358 -5.412 3.664 1.00 0.00 H new ATOM 0 HG SER A 120 22.863 -2.672 3.830 1.00 0.00 H new ATOM 1540 N THR A 121 24.993 -5.944 1.807 1.00 0.00 N ATOM 1541 CA THR A 121 25.620 -7.088 1.074 1.00 0.00 C ATOM 1542 C THR A 121 25.449 -8.370 1.892 1.00 0.00 C ATOM 1543 O THR A 121 25.195 -8.335 3.082 1.00 0.00 O ATOM 1544 CB THR A 121 27.112 -6.802 0.884 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.650 -6.284 2.093 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.301 -5.779 -0.238 1.00 0.00 C ATOM 0 H THR A 121 25.279 -5.854 2.782 1.00 0.00 H new ATOM 0 HA THR A 121 25.141 -7.211 0.103 1.00 0.00 H new ATOM 0 HB THR A 121 27.628 -7.726 0.620 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.606 -6.102 1.974 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.364 -5.577 -0.371 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.888 -6.176 -1.165 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.786 -4.854 0.022 1.00 0.00 H new ATOM 1554 N LEU A 122 25.579 -9.506 1.265 1.00 0.00 N ATOM 1555 CA LEU A 122 25.414 -10.785 2.016 1.00 0.00 C ATOM 1556 C LEU A 122 26.371 -10.806 3.218 1.00 0.00 C ATOM 1557 O LEU A 122 26.049 -11.335 4.263 1.00 0.00 O ATOM 1558 CB LEU A 122 25.705 -11.978 1.090 1.00 0.00 C ATOM 1559 CG LEU A 122 25.323 -13.299 1.783 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.795 -13.396 1.966 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.805 -14.472 0.922 1.00 0.00 C ATOM 0 H LEU A 122 25.791 -9.606 0.272 1.00 0.00 H new ATOM 0 HA LEU A 122 24.388 -10.860 2.375 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.144 -11.871 0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.762 -11.991 0.824 1.00 0.00 H new ATOM 0 HG LEU A 122 25.794 -13.332 2.765 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.546 -14.337 2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.448 -12.564 2.579 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.309 -13.356 0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.539 -15.412 1.406 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.332 -14.422 -0.059 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.887 -14.418 0.806 1.00 0.00 H new ATOM 1573 N SER A 123 27.541 -10.231 3.087 1.00 0.00 N ATOM 1574 CA SER A 123 28.499 -10.221 4.231 1.00 0.00 C ATOM 1575 C SER A 123 27.824 -9.595 5.454 1.00 0.00 C ATOM 1576 O SER A 123 27.903 -10.110 6.550 1.00 0.00 O ATOM 1577 CB SER A 123 29.735 -9.402 3.855 1.00 0.00 C ATOM 1578 OG SER A 123 30.451 -10.071 2.827 1.00 0.00 O ATOM 0 H SER A 123 27.872 -9.770 2.239 1.00 0.00 H new ATOM 0 HA SER A 123 28.799 -11.243 4.464 1.00 0.00 H new ATOM 0 HB2 SER A 123 29.438 -8.409 3.519 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.373 -9.265 4.728 1.00 0.00 H new ATOM 0 HG SER A 123 31.242 -9.546 2.584 1.00 0.00 H new ATOM 1584 N ASP A 124 27.150 -8.491 5.276 1.00 0.00 N ATOM 1585 CA ASP A 124 26.465 -7.845 6.423 1.00 0.00 C ATOM 1586 C ASP A 124 25.527 -8.872 7.069 1.00 0.00 C ATOM 1587 O ASP A 124 25.492 -9.042 8.277 1.00 0.00 O ATOM 1588 CB ASP A 124 25.663 -6.645 5.895 1.00 0.00 C ATOM 1589 CG ASP A 124 26.561 -5.405 5.823 1.00 0.00 C ATOM 1590 OD1 ASP A 124 27.021 -4.970 6.866 1.00 0.00 O ATOM 1591 OD2 ASP A 124 26.772 -4.914 4.727 1.00 0.00 O ATOM 0 H ASP A 124 27.046 -8.011 4.382 1.00 0.00 H new ATOM 0 HA ASP A 124 27.183 -7.498 7.166 1.00 0.00 H new ATOM 0 HB2 ASP A 124 25.262 -6.872 4.907 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.812 -6.450 6.548 1.00 0.00 H new ATOM 1596 N LEU A 125 24.769 -9.568 6.270 1.00 0.00 N ATOM 1597 CA LEU A 125 23.843 -10.582 6.837 1.00 0.00 C ATOM 1598 C LEU A 125 24.662 -11.632 7.601 1.00 0.00 C ATOM 1599 O LEU A 125 24.262 -12.102 8.645 1.00 0.00 O ATOM 1600 CB LEU A 125 23.044 -11.236 5.692 1.00 0.00 C ATOM 1601 CG LEU A 125 21.656 -11.692 6.186 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.701 -10.493 6.315 1.00 0.00 C ATOM 1603 CD2 LEU A 125 21.069 -12.684 5.182 1.00 0.00 C ATOM 0 H LEU A 125 24.751 -9.479 5.254 1.00 0.00 H new ATOM 0 HA LEU A 125 23.140 -10.114 7.526 1.00 0.00 H new ATOM 0 HB2 LEU A 125 22.929 -10.528 4.872 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.595 -12.091 5.300 1.00 0.00 H new ATOM 0 HG LEU A 125 21.771 -12.159 7.164 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.728 -10.839 6.665 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.110 -9.777 7.028 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.587 -10.012 5.343 1.00 0.00 H new ATOM 0 HD21 LEU A 125 20.087 -13.011 5.525 1.00 0.00 H new ATOM 0 HD22 LEU A 125 20.972 -12.202 4.209 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.729 -13.547 5.095 1.00 0.00 H new ATOM 1615 N ARG A 126 25.813 -11.989 7.096 1.00 0.00 N ATOM 1616 CA ARG A 126 26.668 -12.994 7.801 1.00 0.00 C ATOM 1617 C ARG A 126 26.977 -12.492 9.211 1.00 0.00 C ATOM 1618 O ARG A 126 27.062 -13.262 10.147 1.00 0.00 O ATOM 1619 CB ARG A 126 27.979 -13.171 7.018 1.00 0.00 C ATOM 1620 CG ARG A 126 28.773 -14.377 7.552 1.00 0.00 C ATOM 1621 CD ARG A 126 28.318 -15.665 6.853 1.00 0.00 C ATOM 1622 NE ARG A 126 28.972 -15.762 5.518 1.00 0.00 N ATOM 1623 CZ ARG A 126 30.231 -16.095 5.430 1.00 0.00 C ATOM 1624 NH1 ARG A 126 30.917 -16.344 6.512 1.00 0.00 N ATOM 1625 NH2 ARG A 126 30.804 -16.179 4.261 1.00 0.00 N ATOM 0 H ARG A 126 26.200 -11.628 6.224 1.00 0.00 H new ATOM 0 HA ARG A 126 26.146 -13.949 7.864 1.00 0.00 H new ATOM 0 HB2 ARG A 126 27.760 -13.313 5.960 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.582 -12.267 7.100 1.00 0.00 H new ATOM 0 HG2 ARG A 126 29.839 -14.222 7.386 1.00 0.00 H new ATOM 0 HG3 ARG A 126 28.628 -14.469 8.628 1.00 0.00 H new ATOM 0 HD2 ARG A 126 28.577 -16.532 7.461 1.00 0.00 H new ATOM 0 HD3 ARG A 126 27.234 -15.667 6.740 1.00 0.00 H new ATOM 0 HE ARG A 126 28.436 -15.568 4.672 1.00 0.00 H new ATOM 0 HH11 ARG A 126 30.469 -16.278 7.426 1.00 0.00 H new ATOM 0 HH12 ARG A 126 31.901 -16.604 6.443 1.00 0.00 H new ATOM 0 HH21 ARG A 126 30.268 -15.984 3.415 1.00 0.00 H new ATOM 0 HH22 ARG A 126 31.788 -16.439 4.193 1.00 0.00 H new ATOM 1639 N VAL A 127 27.131 -11.208 9.378 1.00 0.00 N ATOM 1640 CA VAL A 127 27.416 -10.674 10.735 1.00 0.00 C ATOM 1641 C VAL A 127 26.254 -11.048 11.655 1.00 0.00 C ATOM 1642 O VAL A 127 26.434 -11.303 12.829 1.00 0.00 O ATOM 1643 CB VAL A 127 27.555 -9.151 10.678 1.00 0.00 C ATOM 1644 CG1 VAL A 127 27.829 -8.616 12.084 1.00 0.00 C ATOM 1645 CG2 VAL A 127 28.722 -8.779 9.763 1.00 0.00 C ATOM 0 H VAL A 127 27.072 -10.510 8.637 1.00 0.00 H new ATOM 0 HA VAL A 127 28.347 -11.097 11.112 1.00 0.00 H new ATOM 0 HB VAL A 127 26.634 -8.716 10.290 1.00 0.00 H new ATOM 0 HG11 VAL A 127 27.929 -7.531 12.047 1.00 0.00 H new ATOM 0 HG12 VAL A 127 27.002 -8.882 12.742 1.00 0.00 H new ATOM 0 HG13 VAL A 127 28.752 -9.052 12.466 1.00 0.00 H new ATOM 0 HG21 VAL A 127 28.821 -7.694 9.722 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.643 -9.213 10.153 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.535 -9.164 8.761 1.00 0.00 H new ATOM 1655 N TYR A 128 25.053 -11.078 11.127 1.00 0.00 N ATOM 1656 CA TYR A 128 23.869 -11.433 11.978 1.00 0.00 C ATOM 1657 C TYR A 128 23.606 -12.943 11.951 1.00 0.00 C ATOM 1658 O TYR A 128 23.394 -13.562 12.976 1.00 0.00 O ATOM 1659 CB TYR A 128 22.617 -10.732 11.446 1.00 0.00 C ATOM 1660 CG TYR A 128 22.742 -9.236 11.596 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.476 -8.629 12.829 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.108 -8.456 10.496 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.577 -7.239 12.959 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.210 -7.067 10.625 1.00 0.00 C ATOM 1665 CZ TYR A 128 22.944 -6.458 11.857 1.00 0.00 C ATOM 1666 OH TYR A 128 23.043 -5.087 11.985 1.00 0.00 O ATOM 0 H TYR A 128 24.841 -10.874 10.150 1.00 0.00 H new ATOM 0 HA TYR A 128 24.088 -11.115 12.997 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.469 -10.987 10.396 1.00 0.00 H new ATOM 0 HB3 TYR A 128 21.739 -11.085 11.986 1.00 0.00 H new ATOM 0 HD1 TYR A 128 22.193 -9.232 13.679 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.312 -8.926 9.545 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.372 -6.769 13.910 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.494 -6.465 9.775 1.00 0.00 H new ATOM 0 HH TYR A 128 23.309 -4.697 11.126 1.00 0.00 H new ATOM 1676 N LEU A 129 23.578 -13.531 10.781 1.00 0.00 N ATOM 1677 CA LEU A 129 23.284 -14.991 10.655 1.00 0.00 C ATOM 1678 C LEU A 129 24.501 -15.733 10.117 1.00 0.00 C ATOM 1679 O LEU A 129 24.381 -16.580 9.259 1.00 0.00 O ATOM 1680 CB LEU A 129 22.152 -15.170 9.650 1.00 0.00 C ATOM 1681 CG LEU A 129 20.875 -14.460 10.120 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.755 -14.747 9.110 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.460 -14.957 11.516 1.00 0.00 C ATOM 0 H LEU A 129 23.749 -13.054 9.896 1.00 0.00 H new ATOM 0 HA LEU A 129 23.017 -15.384 11.636 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.456 -14.773 8.681 1.00 0.00 H new ATOM 0 HB3 LEU A 129 21.950 -16.232 9.511 1.00 0.00 H new ATOM 0 HG LEU A 129 21.059 -13.388 10.183 1.00 0.00 H new ATOM 0 HD11 LEU A 129 18.840 -14.249 9.430 1.00 0.00 H new ATOM 0 HD12 LEU A 129 20.046 -14.374 8.128 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.582 -15.822 9.054 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.553 -14.441 11.831 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.273 -16.030 11.479 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.260 -14.752 12.228 1.00 0.00 H new ATOM 1695 N GLY A 130 25.663 -15.423 10.595 1.00 0.00 N ATOM 1696 CA GLY A 130 26.881 -16.116 10.094 1.00 0.00 C ATOM 1697 C GLY A 130 26.834 -17.610 10.454 1.00 0.00 C ATOM 1698 O GLY A 130 27.838 -18.198 10.803 1.00 0.00 O ATOM 0 H GLY A 130 25.828 -14.718 11.313 1.00 0.00 H new ATOM 0 HA2 GLY A 130 26.955 -15.998 9.013 1.00 0.00 H new ATOM 0 HA3 GLY A 130 27.771 -15.659 10.527 1.00 0.00 H new ATOM 1702 N ALA A 131 25.684 -18.238 10.365 1.00 0.00 N ATOM 1703 CA ALA A 131 25.598 -19.692 10.695 1.00 0.00 C ATOM 1704 C ALA A 131 24.443 -20.329 9.911 1.00 0.00 C ATOM 1705 O ALA A 131 24.642 -21.254 9.148 1.00 0.00 O ATOM 1706 CB ALA A 131 25.368 -19.863 12.202 1.00 0.00 C ATOM 0 H ALA A 131 24.806 -17.805 10.079 1.00 0.00 H new ATOM 0 HA ALA A 131 26.530 -20.185 10.419 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.305 -20.924 12.442 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.197 -19.415 12.750 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.438 -19.371 12.486 1.00 0.00 H new ATOM 1712 N SER A 132 23.239 -19.843 10.086 1.00 0.00 N ATOM 1713 CA SER A 132 22.073 -20.420 9.345 1.00 0.00 C ATOM 1714 C SER A 132 21.757 -19.539 8.135 1.00 0.00 C ATOM 1715 O SER A 132 20.612 -19.349 7.774 1.00 0.00 O ATOM 1716 CB SER A 132 20.856 -20.462 10.272 1.00 0.00 C ATOM 1717 OG SER A 132 19.787 -21.132 9.620 1.00 0.00 O ATOM 0 H SER A 132 23.012 -19.070 10.711 1.00 0.00 H new ATOM 0 HA SER A 132 22.314 -21.429 9.010 1.00 0.00 H new ATOM 0 HB2 SER A 132 21.109 -20.976 11.199 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.555 -19.449 10.540 1.00 0.00 H new ATOM 0 HG SER A 132 19.688 -20.782 8.710 1.00 0.00 H new ATOM 1723 N THR A 133 22.764 -18.990 7.513 1.00 0.00 N ATOM 1724 CA THR A 133 22.525 -18.108 6.335 1.00 0.00 C ATOM 1725 C THR A 133 22.113 -18.965 5.110 1.00 0.00 C ATOM 1726 O THR A 133 22.882 -19.793 4.663 1.00 0.00 O ATOM 1727 CB THR A 133 23.836 -17.347 6.012 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.715 -17.442 7.121 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.547 -15.869 5.721 1.00 0.00 C ATOM 0 H THR A 133 23.743 -19.114 7.770 1.00 0.00 H new ATOM 0 HA THR A 133 21.725 -17.402 6.560 1.00 0.00 H new ATOM 0 HB THR A 133 24.293 -17.794 5.129 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.407 -16.845 7.835 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.481 -15.353 5.497 1.00 0.00 H new ATOM 0 HG22 THR A 133 22.875 -15.791 4.866 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.080 -15.411 6.593 1.00 0.00 H new ATOM 1737 N PRO A 134 20.936 -18.766 4.546 1.00 0.00 N ATOM 1738 CA PRO A 134 20.496 -19.535 3.348 1.00 0.00 C ATOM 1739 C PRO A 134 21.113 -18.973 2.061 1.00 0.00 C ATOM 1740 O PRO A 134 21.939 -18.082 2.097 1.00 0.00 O ATOM 1741 CB PRO A 134 18.974 -19.359 3.352 1.00 0.00 C ATOM 1742 CG PRO A 134 18.751 -18.017 3.975 1.00 0.00 C ATOM 1743 CD PRO A 134 19.898 -17.807 4.975 1.00 0.00 C ATOM 0 HA PRO A 134 20.806 -20.579 3.382 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.568 -19.399 2.341 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.485 -20.148 3.924 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.748 -17.233 3.218 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.785 -17.978 4.478 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.267 -16.782 4.947 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.575 -18.002 5.998 1.00 0.00 H new ATOM 1751 N ASP A 135 20.715 -19.489 0.928 1.00 0.00 N ATOM 1752 CA ASP A 135 21.262 -19.002 -0.375 1.00 0.00 C ATOM 1753 C ASP A 135 20.191 -18.174 -1.083 1.00 0.00 C ATOM 1754 O ASP A 135 19.115 -18.651 -1.383 1.00 0.00 O ATOM 1755 CB ASP A 135 21.634 -20.204 -1.245 1.00 0.00 C ATOM 1756 CG ASP A 135 22.505 -19.739 -2.414 1.00 0.00 C ATOM 1757 OD1 ASP A 135 22.593 -18.540 -2.622 1.00 0.00 O ATOM 1758 OD2 ASP A 135 23.070 -20.591 -3.081 1.00 0.00 O ATOM 0 H ASP A 135 20.026 -20.237 0.848 1.00 0.00 H new ATOM 0 HA ASP A 135 22.147 -18.390 -0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.170 -20.944 -0.651 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.732 -20.688 -1.620 1.00 0.00 H new ATOM 1763 N LEU A 136 20.478 -16.933 -1.340 1.00 0.00 N ATOM 1764 CA LEU A 136 19.481 -16.056 -2.017 1.00 0.00 C ATOM 1765 C LEU A 136 19.490 -16.306 -3.528 1.00 0.00 C ATOM 1766 O LEU A 136 20.530 -16.437 -4.143 1.00 0.00 O ATOM 1767 CB LEU A 136 19.829 -14.591 -1.748 1.00 0.00 C ATOM 1768 CG LEU A 136 19.786 -14.300 -0.244 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.191 -12.840 -0.014 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.368 -14.536 0.303 1.00 0.00 C ATOM 0 H LEU A 136 21.364 -16.483 -1.110 1.00 0.00 H new ATOM 0 HA LEU A 136 18.489 -16.283 -1.625 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.821 -14.368 -2.140 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.127 -13.942 -2.271 1.00 0.00 H new ATOM 0 HG LEU A 136 20.474 -14.966 0.276 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.165 -12.619 1.053 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.200 -12.678 -0.393 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.497 -12.183 -0.538 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.351 -14.326 1.372 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.667 -13.876 -0.208 1.00 0.00 H new ATOM 0 HD23 LEU A 136 18.080 -15.573 0.133 1.00 0.00 H new ATOM 1782 N GLN A 137 18.325 -16.363 -4.124 1.00 0.00 N ATOM 1783 CA GLN A 137 18.215 -16.597 -5.598 1.00 0.00 C ATOM 1784 C GLN A 137 17.303 -15.531 -6.214 1.00 0.00 C ATOM 1785 O GLN A 137 17.603 -14.360 -6.057 1.00 0.00 O ATOM 1786 CB GLN A 137 17.615 -17.986 -5.845 1.00 0.00 C ATOM 1787 CG GLN A 137 18.232 -18.994 -4.873 1.00 0.00 C ATOM 1788 CD GLN A 137 19.756 -18.982 -5.023 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.512 -18.846 -3.965 1.00 0.00 O flip ATOM 1790 NE2 GLN A 137 20.268 -19.099 -6.119 1.00 0.00 N flip ATOM 1791 OXT GLN A 137 16.320 -15.906 -6.832 1.00 0.00 O ATOM 0 H GLN A 137 17.431 -16.256 -3.644 1.00 0.00 H new ATOM 0 HA GLN A 137 19.203 -16.539 -6.054 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.533 -17.954 -5.713 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.802 -18.296 -6.873 1.00 0.00 H new ATOM 0 HG2 GLN A 137 17.955 -18.744 -3.849 1.00 0.00 H new ATOM 0 HG3 GLN A 137 17.844 -19.993 -5.073 1.00 0.00 H new ATOM 0 HE21 GLN A 137 19.682 -19.205 -6.947 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.284 -19.091 -6.211 1.00 0.00 H new