USER MOD reduce.3.24.130724 H: found=0, std=0, add=769, rem=0, adj=20 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 Set 1.1: A 102 TYR OH : rot 24:sc= 0.819 USER MOD Set 1.2: A 106 GLN : amide:sc= 0.691 K(o=1.5,f=0.62) USER MOD Single : A 42 HIS : no HD1:sc= -1.63 K(o=-1.6,f=-0.36) USER MOD Single : A 43 ASN : amide:sc= -0.701! C(o=-0.7!,f=-7.9!) USER MOD Single : A 47 SER OG : rot 180:sc=-0.00502 USER MOD Single : A 55 SER OG : rot 26:sc= 0.128 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.483 K(o=-0.48,f=-3.5!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 76:sc= 0.752 USER MOD Single : A 75 SER OG : rot -46:sc= 0.581 USER MOD Single : A 85 LYS NZ :NH3+ 171:sc= -0.231 (180deg=-0.842) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= -0.448 USER MOD Single : A 99 CYS SG : rot 180:sc= -0.453 USER MOD Single : A 100 HIS : no HE2:sc= -0.882 K(o=-0.88,f=-5!) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.458 K(o=-0.46,f=-2) USER MOD Single : A 109 GLN : amide:sc= -3.4! C(o=-3.4!,f=-3.8!) USER MOD Single : A 112 THR OG1 : rot -160:sc= -0.0385 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -1.06! C(o=-1.1!,f=-4.9!) USER MOD Single : A 120 SER OG : rot 11:sc= -0.986 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 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot -68:sc= 0.78 USER MOD Single : A 137 GLN : amide:sc= -12.8! C(o=-13!,f=-6.4!) USER MOD ----------------------------------------------------------------- ATOM 265 N ALA A 39 17.979 6.452 -1.473 1.00 0.00 N ATOM 266 CA ALA A 39 17.629 5.828 -0.157 1.00 0.00 C ATOM 267 C ALA A 39 16.685 6.761 0.604 1.00 0.00 C ATOM 268 O ALA A 39 17.017 7.892 0.898 1.00 0.00 O ATOM 269 CB ALA A 39 18.907 5.623 0.658 1.00 0.00 C ATOM 0 HA ALA A 39 17.142 4.867 -0.320 1.00 0.00 H new ATOM 0 HB1 ALA A 39 18.658 5.169 1.617 1.00 0.00 H new ATOM 0 HB2 ALA A 39 19.586 4.968 0.112 1.00 0.00 H new ATOM 0 HB3 ALA A 39 19.389 6.586 0.827 1.00 0.00 H new ATOM 275 N ALA A 40 15.504 6.300 0.914 1.00 0.00 N ATOM 276 CA ALA A 40 14.531 7.163 1.644 1.00 0.00 C ATOM 277 C ALA A 40 13.525 6.288 2.405 1.00 0.00 C ATOM 278 O ALA A 40 13.643 5.075 2.451 1.00 0.00 O ATOM 279 CB ALA A 40 13.799 8.056 0.631 1.00 0.00 C ATOM 0 H ALA A 40 15.170 5.362 0.693 1.00 0.00 H new ATOM 0 HA ALA A 40 15.059 7.788 2.364 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.085 8.691 1.155 1.00 0.00 H new ATOM 0 HB2 ALA A 40 14.523 8.680 0.106 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.269 7.432 -0.088 1.00 0.00 H new ATOM 285 N VAL A 41 12.543 6.903 3.007 1.00 0.00 N ATOM 286 CA VAL A 41 11.519 6.129 3.769 1.00 0.00 C ATOM 287 C VAL A 41 10.551 5.480 2.779 1.00 0.00 C ATOM 288 O VAL A 41 10.205 6.055 1.766 1.00 0.00 O ATOM 289 CB VAL A 41 10.740 7.073 4.692 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.715 6.274 5.504 1.00 0.00 C ATOM 291 CG2 VAL A 41 11.706 7.785 5.648 1.00 0.00 C ATOM 0 H VAL A 41 12.405 7.914 3.004 1.00 0.00 H new ATOM 0 HA VAL A 41 12.010 5.363 4.369 1.00 0.00 H new ATOM 0 HB VAL A 41 10.223 7.816 4.084 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.164 6.949 6.159 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.020 5.778 4.826 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.231 5.526 6.106 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.145 8.454 6.301 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.231 7.045 6.252 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.429 8.362 5.072 1.00 0.00 H new ATOM 301 N HIS A 42 10.120 4.281 3.056 1.00 0.00 N ATOM 302 CA HIS A 42 9.181 3.581 2.125 1.00 0.00 C ATOM 303 C HIS A 42 8.200 2.720 2.928 1.00 0.00 C ATOM 304 O HIS A 42 8.429 2.401 4.078 1.00 0.00 O ATOM 305 CB HIS A 42 9.996 2.666 1.198 1.00 0.00 C ATOM 306 CG HIS A 42 10.531 3.442 0.025 1.00 0.00 C ATOM 307 ND1 HIS A 42 10.080 3.225 -1.267 1.00 0.00 N ATOM 308 CD2 HIS A 42 11.488 4.420 -0.073 1.00 0.00 C ATOM 309 CE1 HIS A 42 10.761 4.053 -2.079 1.00 0.00 C ATOM 310 NE2 HIS A 42 11.633 4.805 -1.402 1.00 0.00 N ATOM 0 H HIS A 42 10.377 3.751 3.889 1.00 0.00 H new ATOM 0 HA HIS A 42 8.627 4.319 1.544 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.821 2.220 1.753 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.370 1.847 0.844 1.00 0.00 H new ATOM 0 HD2 HIS A 42 12.045 4.829 0.757 1.00 0.00 H new ATOM 0 HE1 HIS A 42 10.620 4.104 -3.149 1.00 0.00 H new ATOM 0 HE2 HIS A 42 12.268 5.509 -1.778 1.00 0.00 H new ATOM 318 N ASN A 43 7.120 2.319 2.307 1.00 0.00 N ATOM 319 CA ASN A 43 6.119 1.447 2.992 1.00 0.00 C ATOM 320 C ASN A 43 6.312 0.017 2.483 1.00 0.00 C ATOM 321 O ASN A 43 5.787 -0.363 1.455 1.00 0.00 O ATOM 322 CB ASN A 43 4.711 1.929 2.656 1.00 0.00 C ATOM 323 CG ASN A 43 4.623 2.214 1.160 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.530 1.898 0.415 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.566 2.803 0.685 1.00 0.00 N ATOM 0 H ASN A 43 6.887 2.561 1.344 1.00 0.00 H new ATOM 0 HA ASN A 43 6.254 1.484 4.073 1.00 0.00 H new ATOM 0 HB2 ASN A 43 3.978 1.173 2.938 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.476 2.829 3.224 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.497 3.000 -0.313 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.805 3.068 1.311 1.00 0.00 H new ATOM 332 N VAL A 44 7.083 -0.772 3.182 1.00 0.00 N ATOM 333 CA VAL A 44 7.340 -2.175 2.729 1.00 0.00 C ATOM 334 C VAL A 44 6.229 -3.106 3.272 1.00 0.00 C ATOM 335 O VAL A 44 5.986 -3.128 4.462 1.00 0.00 O ATOM 336 CB VAL A 44 8.725 -2.617 3.249 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.656 -2.995 4.731 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.220 -3.826 2.451 1.00 0.00 C ATOM 0 H VAL A 44 7.548 -0.507 4.050 1.00 0.00 H new ATOM 0 HA VAL A 44 7.332 -2.230 1.640 1.00 0.00 H new ATOM 0 HB VAL A 44 9.414 -1.781 3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.644 -3.303 5.074 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.322 -2.134 5.311 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.953 -3.817 4.864 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.198 -4.132 2.823 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.515 -4.649 2.563 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.301 -3.558 1.397 1.00 0.00 H new ATOM 348 N PRO A 45 5.545 -3.870 2.430 1.00 0.00 N ATOM 349 CA PRO A 45 4.456 -4.785 2.902 1.00 0.00 C ATOM 350 C PRO A 45 4.858 -5.640 4.106 1.00 0.00 C ATOM 351 O PRO A 45 5.955 -6.152 4.185 1.00 0.00 O ATOM 352 CB PRO A 45 4.183 -5.684 1.688 1.00 0.00 C ATOM 353 CG PRO A 45 4.546 -4.851 0.506 1.00 0.00 C ATOM 354 CD PRO A 45 5.707 -3.955 0.955 1.00 0.00 C ATOM 0 HA PRO A 45 3.591 -4.216 3.242 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.780 -6.595 1.728 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.138 -5.990 1.650 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.841 -5.477 -0.336 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.697 -4.252 0.176 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.671 -4.385 0.683 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.654 -2.970 0.490 1.00 0.00 H new ATOM 362 N LEU A 46 3.962 -5.812 5.038 1.00 0.00 N ATOM 363 CA LEU A 46 4.278 -6.651 6.222 1.00 0.00 C ATOM 364 C LEU A 46 4.430 -8.106 5.775 1.00 0.00 C ATOM 365 O LEU A 46 5.133 -8.889 6.382 1.00 0.00 O ATOM 366 CB LEU A 46 3.123 -6.584 7.221 1.00 0.00 C ATOM 367 CG LEU A 46 2.930 -5.143 7.753 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.450 -4.908 8.035 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.720 -4.924 9.052 1.00 0.00 C ATOM 0 H LEU A 46 3.026 -5.407 5.029 1.00 0.00 H new ATOM 0 HA LEU A 46 5.197 -6.289 6.683 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.204 -6.925 6.743 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.319 -7.259 8.054 1.00 0.00 H new ATOM 0 HG LEU A 46 3.294 -4.446 6.998 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.308 -3.895 8.410 1.00 0.00 H new ATOM 0 HD12 LEU A 46 0.879 -5.038 7.116 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.104 -5.623 8.781 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.567 -3.904 9.404 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.374 -5.625 9.811 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.781 -5.087 8.864 1.00 0.00 H new ATOM 381 N SER A 47 3.735 -8.476 4.735 1.00 0.00 N ATOM 382 CA SER A 47 3.783 -9.890 4.255 1.00 0.00 C ATOM 383 C SER A 47 5.170 -10.271 3.709 1.00 0.00 C ATOM 384 O SER A 47 5.474 -11.442 3.596 1.00 0.00 O ATOM 385 CB SER A 47 2.733 -10.084 3.152 1.00 0.00 C ATOM 386 OG SER A 47 3.152 -11.119 2.275 1.00 0.00 O ATOM 0 H SER A 47 3.132 -7.858 4.193 1.00 0.00 H new ATOM 0 HA SER A 47 3.573 -10.538 5.106 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.769 -10.335 3.594 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.597 -9.156 2.597 1.00 0.00 H new ATOM 0 HG SER A 47 2.481 -11.244 1.572 1.00 0.00 H new ATOM 392 N VAL A 48 6.012 -9.320 3.356 1.00 0.00 N ATOM 393 CA VAL A 48 7.365 -9.676 2.803 1.00 0.00 C ATOM 394 C VAL A 48 8.476 -9.302 3.793 1.00 0.00 C ATOM 395 O VAL A 48 9.614 -9.114 3.409 1.00 0.00 O ATOM 396 CB VAL A 48 7.586 -8.945 1.471 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.364 -9.140 0.571 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.809 -7.448 1.703 1.00 0.00 C ATOM 0 H VAL A 48 5.822 -8.320 3.426 1.00 0.00 H new ATOM 0 HA VAL A 48 7.400 -10.753 2.639 1.00 0.00 H new ATOM 0 HB VAL A 48 8.472 -9.361 0.992 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.522 -8.621 -0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.218 -10.203 0.381 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.480 -8.735 1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.963 -6.950 0.746 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.935 -7.022 2.197 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.687 -7.304 2.332 1.00 0.00 H new ATOM 408 N LEU A 49 8.175 -9.211 5.065 1.00 0.00 N ATOM 409 CA LEU A 49 9.238 -8.871 6.058 1.00 0.00 C ATOM 410 C LEU A 49 9.884 -10.163 6.557 1.00 0.00 C ATOM 411 O LEU A 49 9.222 -11.045 7.068 1.00 0.00 O ATOM 412 CB LEU A 49 8.625 -8.139 7.259 1.00 0.00 C ATOM 413 CG LEU A 49 8.206 -6.708 6.887 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.558 -6.061 8.117 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.429 -5.877 6.450 1.00 0.00 C ATOM 0 H LEU A 49 7.244 -9.357 5.456 1.00 0.00 H new ATOM 0 HA LEU A 49 9.979 -8.230 5.580 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.758 -8.692 7.620 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.346 -8.108 8.076 1.00 0.00 H new ATOM 0 HG LEU A 49 7.503 -6.741 6.055 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.253 -5.043 7.874 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.684 -6.641 8.415 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.276 -6.039 8.937 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.109 -4.868 6.191 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.149 -5.831 7.267 1.00 0.00 H new ATOM 0 HD23 LEU A 49 9.895 -6.344 5.582 1.00 0.00 H new ATOM 427 N ILE A 50 11.174 -10.280 6.415 1.00 0.00 N ATOM 428 CA ILE A 50 11.880 -11.509 6.879 1.00 0.00 C ATOM 429 C ILE A 50 12.410 -11.297 8.295 1.00 0.00 C ATOM 430 O ILE A 50 13.261 -10.461 8.533 1.00 0.00 O ATOM 431 CB ILE A 50 13.048 -11.784 5.944 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.555 -11.701 4.501 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.620 -13.173 6.222 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.671 -12.130 3.549 1.00 0.00 C ATOM 0 H ILE A 50 11.775 -9.572 5.994 1.00 0.00 H new ATOM 0 HA ILE A 50 11.189 -12.352 6.877 1.00 0.00 H new ATOM 0 HB ILE A 50 13.833 -11.045 6.106 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.683 -12.342 4.367 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.240 -10.683 4.272 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.456 -13.364 5.549 1.00 0.00 H new ATOM 0 HG22 ILE A 50 13.966 -13.224 7.254 1.00 0.00 H new ATOM 0 HG23 ILE A 50 12.846 -13.924 6.061 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.315 -12.069 2.520 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.530 -11.471 3.675 1.00 0.00 H new ATOM 0 HD13 ILE A 50 13.965 -13.156 3.771 1.00 0.00 H new ATOM 446 N ARG A 51 11.916 -12.058 9.233 1.00 0.00 N ATOM 447 CA ARG A 51 12.386 -11.929 10.649 1.00 0.00 C ATOM 448 C ARG A 51 12.626 -13.328 11.240 1.00 0.00 C ATOM 449 O ARG A 51 11.708 -13.957 11.728 1.00 0.00 O ATOM 450 CB ARG A 51 11.301 -11.224 11.470 1.00 0.00 C ATOM 451 CG ARG A 51 10.910 -9.908 10.787 1.00 0.00 C ATOM 452 CD ARG A 51 10.194 -8.994 11.786 1.00 0.00 C ATOM 453 NE ARG A 51 11.194 -8.396 12.727 1.00 0.00 N ATOM 454 CZ ARG A 51 11.374 -8.884 13.933 1.00 0.00 C ATOM 455 NH1 ARG A 51 10.696 -9.922 14.347 1.00 0.00 N ATOM 456 NH2 ARG A 51 12.246 -8.327 14.728 1.00 0.00 N ATOM 0 H ARG A 51 11.201 -12.770 9.082 1.00 0.00 H new ATOM 0 HA ARG A 51 13.312 -11.355 10.676 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.427 -11.869 11.566 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.665 -11.028 12.479 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.799 -9.411 10.399 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.261 -10.109 9.935 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.662 -8.205 11.255 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.449 -9.561 12.344 1.00 0.00 H new ATOM 0 HE ARG A 51 11.746 -7.593 12.425 1.00 0.00 H new ATOM 0 HH11 ARG A 51 10.015 -10.365 13.730 1.00 0.00 H new ATOM 0 HH12 ARG A 51 10.848 -10.289 15.287 1.00 0.00 H new ATOM 0 HH21 ARG A 51 12.782 -7.519 14.411 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.392 -8.700 15.666 1.00 0.00 H new ATOM 470 N PRO A 52 13.848 -13.811 11.223 1.00 0.00 N ATOM 471 CA PRO A 52 14.198 -15.139 11.788 1.00 0.00 C ATOM 472 C PRO A 52 14.718 -15.029 13.225 1.00 0.00 C ATOM 473 O PRO A 52 15.500 -15.843 13.674 1.00 0.00 O ATOM 474 CB PRO A 52 15.315 -15.587 10.855 1.00 0.00 C ATOM 475 CG PRO A 52 16.069 -14.322 10.558 1.00 0.00 C ATOM 476 CD PRO A 52 15.045 -13.168 10.647 1.00 0.00 C ATOM 0 HA PRO A 52 13.349 -15.820 11.844 1.00 0.00 H new ATOM 0 HB2 PRO A 52 15.955 -16.332 11.328 1.00 0.00 H new ATOM 0 HB3 PRO A 52 14.919 -16.038 9.946 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.880 -14.177 11.272 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.521 -14.364 9.567 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.408 -12.357 11.279 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.837 -12.739 9.667 1.00 0.00 H new ATOM 484 N LEU A 53 14.310 -14.011 13.939 1.00 0.00 N ATOM 485 CA LEU A 53 14.799 -13.822 15.340 1.00 0.00 C ATOM 486 C LEU A 53 13.643 -13.302 16.220 1.00 0.00 C ATOM 487 O LEU A 53 13.399 -12.113 16.267 1.00 0.00 O ATOM 488 CB LEU A 53 15.940 -12.786 15.303 1.00 0.00 C ATOM 489 CG LEU A 53 16.896 -12.966 16.496 1.00 0.00 C ATOM 490 CD1 LEU A 53 18.191 -12.199 16.218 1.00 0.00 C ATOM 491 CD2 LEU A 53 16.251 -12.422 17.775 1.00 0.00 C ATOM 0 H LEU A 53 13.657 -13.299 13.611 1.00 0.00 H new ATOM 0 HA LEU A 53 15.157 -14.763 15.756 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.495 -12.886 14.371 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.521 -11.780 15.318 1.00 0.00 H new ATOM 0 HG LEU A 53 17.110 -14.027 16.629 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.874 -12.321 17.059 1.00 0.00 H new ATOM 0 HD12 LEU A 53 18.657 -12.588 15.312 1.00 0.00 H new ATOM 0 HD13 LEU A 53 17.966 -11.141 16.085 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.936 -12.554 18.613 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.032 -11.362 17.649 1.00 0.00 H new ATOM 0 HD23 LEU A 53 15.326 -12.962 17.974 1.00 0.00 H new ATOM 503 N PRO A 54 12.924 -14.167 16.911 1.00 0.00 N ATOM 504 CA PRO A 54 11.790 -13.726 17.775 1.00 0.00 C ATOM 505 C PRO A 54 12.285 -13.070 19.071 1.00 0.00 C ATOM 506 O PRO A 54 13.449 -13.155 19.412 1.00 0.00 O ATOM 507 CB PRO A 54 11.017 -15.021 18.056 1.00 0.00 C ATOM 508 CG PRO A 54 12.037 -16.113 17.960 1.00 0.00 C ATOM 509 CD PRO A 54 13.101 -15.637 16.957 1.00 0.00 C ATOM 0 HA PRO A 54 11.173 -12.966 17.296 1.00 0.00 H new ATOM 0 HB2 PRO A 54 10.556 -14.998 19.043 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.215 -15.166 17.332 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.485 -16.311 18.934 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.578 -17.043 17.625 1.00 0.00 H new ATOM 0 HD2 PRO A 54 14.105 -15.907 17.283 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.953 -16.087 15.975 1.00 0.00 H new ATOM 517 N SER A 55 11.418 -12.404 19.788 1.00 0.00 N ATOM 518 CA SER A 55 11.850 -11.730 21.051 1.00 0.00 C ATOM 519 C SER A 55 10.706 -11.739 22.067 1.00 0.00 C ATOM 520 O SER A 55 9.570 -12.024 21.745 1.00 0.00 O ATOM 521 CB SER A 55 12.231 -10.277 20.733 1.00 0.00 C ATOM 522 OG SER A 55 13.606 -10.215 20.384 1.00 0.00 O ATOM 0 H SER A 55 10.431 -12.297 19.555 1.00 0.00 H new ATOM 0 HA SER A 55 12.704 -12.261 21.471 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.619 -9.900 19.913 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.035 -9.641 21.596 1.00 0.00 H new ATOM 0 HG SER A 55 13.892 -11.082 20.027 1.00 0.00 H new ATOM 528 N VAL A 56 11.007 -11.404 23.293 1.00 0.00 N ATOM 529 CA VAL A 56 9.948 -11.360 24.344 1.00 0.00 C ATOM 530 C VAL A 56 9.272 -9.985 24.289 1.00 0.00 C ATOM 531 O VAL A 56 9.864 -8.969 24.591 1.00 0.00 O ATOM 532 CB VAL A 56 10.568 -11.626 25.735 1.00 0.00 C ATOM 533 CG1 VAL A 56 11.262 -10.371 26.292 1.00 0.00 C ATOM 534 CG2 VAL A 56 9.467 -12.064 26.707 1.00 0.00 C ATOM 0 H VAL A 56 11.944 -11.158 23.613 1.00 0.00 H new ATOM 0 HA VAL A 56 9.202 -12.135 24.166 1.00 0.00 H new ATOM 0 HB VAL A 56 11.316 -12.412 25.627 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.686 -10.594 27.271 1.00 0.00 H new ATOM 0 HG12 VAL A 56 12.057 -10.063 25.613 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.534 -9.565 26.387 1.00 0.00 H new ATOM 0 HG21 VAL A 56 9.902 -12.252 27.689 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.718 -11.276 26.787 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.997 -12.976 26.338 1.00 0.00 H new ATOM 544 N LEU A 57 8.039 -9.944 23.869 1.00 0.00 N ATOM 545 CA LEU A 57 7.323 -8.641 23.757 1.00 0.00 C ATOM 546 C LEU A 57 6.562 -8.336 25.041 1.00 0.00 C ATOM 547 O LEU A 57 6.059 -9.213 25.714 1.00 0.00 O ATOM 548 CB LEU A 57 6.330 -8.700 22.606 1.00 0.00 C ATOM 549 CG LEU A 57 7.069 -9.013 21.298 1.00 0.00 C ATOM 550 CD1 LEU A 57 6.038 -9.269 20.194 1.00 0.00 C ATOM 551 CD2 LEU A 57 7.972 -7.831 20.907 1.00 0.00 C ATOM 0 H LEU A 57 7.492 -10.761 23.597 1.00 0.00 H new ATOM 0 HA LEU A 57 8.061 -7.859 23.580 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.578 -9.464 22.801 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.804 -7.750 22.519 1.00 0.00 H new ATOM 0 HG LEU A 57 7.692 -9.897 21.432 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.553 -9.492 19.260 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.409 -10.114 20.473 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.417 -8.383 20.063 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.492 -8.062 19.978 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.363 -6.938 20.769 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.702 -7.654 21.697 1.00 0.00 H new ATOM 563 N ASP A 58 6.472 -7.081 25.365 1.00 0.00 N ATOM 564 CA ASP A 58 5.741 -6.646 26.588 1.00 0.00 C ATOM 565 C ASP A 58 4.372 -6.078 26.154 1.00 0.00 C ATOM 566 O ASP A 58 4.293 -5.359 25.178 1.00 0.00 O ATOM 567 CB ASP A 58 6.574 -5.561 27.279 1.00 0.00 C ATOM 568 CG ASP A 58 5.728 -4.830 28.326 1.00 0.00 C ATOM 569 OD1 ASP A 58 5.078 -3.863 27.963 1.00 0.00 O ATOM 570 OD2 ASP A 58 5.745 -5.250 29.471 1.00 0.00 O ATOM 0 H ASP A 58 6.882 -6.320 24.824 1.00 0.00 H new ATOM 0 HA ASP A 58 5.585 -7.476 27.277 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.446 -6.010 27.755 1.00 0.00 H new ATOM 0 HB3 ASP A 58 6.944 -4.851 26.540 1.00 0.00 H new ATOM 575 N PRO A 59 3.297 -6.396 26.847 1.00 0.00 N ATOM 576 CA PRO A 59 1.937 -5.897 26.473 1.00 0.00 C ATOM 577 C PRO A 59 1.723 -4.424 26.850 1.00 0.00 C ATOM 578 O PRO A 59 0.805 -3.783 26.380 1.00 0.00 O ATOM 579 CB PRO A 59 0.998 -6.808 27.273 1.00 0.00 C ATOM 580 CG PRO A 59 1.777 -7.157 28.500 1.00 0.00 C ATOM 581 CD PRO A 59 3.241 -7.254 28.051 1.00 0.00 C ATOM 0 HA PRO A 59 1.770 -5.931 25.396 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.068 -6.298 27.524 1.00 0.00 H new ATOM 0 HB3 PRO A 59 0.730 -7.699 26.706 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.654 -6.396 29.271 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.435 -8.100 28.925 1.00 0.00 H new ATOM 0 HD2 PRO A 59 3.922 -6.901 28.826 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.523 -8.282 27.823 1.00 0.00 H new ATOM 589 N ALA A 60 2.556 -3.885 27.697 1.00 0.00 N ATOM 590 CA ALA A 60 2.394 -2.462 28.106 1.00 0.00 C ATOM 591 C ALA A 60 3.095 -1.548 27.095 1.00 0.00 C ATOM 592 O ALA A 60 2.609 -0.482 26.769 1.00 0.00 O ATOM 593 CB ALA A 60 3.013 -2.270 29.492 1.00 0.00 C ATOM 0 H ALA A 60 3.344 -4.371 28.125 1.00 0.00 H new ATOM 0 HA ALA A 60 1.335 -2.207 28.137 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.899 -1.231 29.800 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.509 -2.918 30.209 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.072 -2.524 29.456 1.00 0.00 H new ATOM 599 N LYS A 61 4.235 -1.950 26.601 1.00 0.00 N ATOM 600 CA LYS A 61 4.964 -1.099 25.624 1.00 0.00 C ATOM 601 C LYS A 61 4.260 -1.166 24.259 1.00 0.00 C ATOM 602 O LYS A 61 4.259 -0.211 23.508 1.00 0.00 O ATOM 603 CB LYS A 61 6.427 -1.595 25.518 1.00 0.00 C ATOM 604 CG LYS A 61 7.401 -0.416 25.612 1.00 0.00 C ATOM 605 CD LYS A 61 8.830 -0.901 25.339 1.00 0.00 C ATOM 606 CE LYS A 61 9.270 -1.886 26.429 1.00 0.00 C ATOM 607 NZ LYS A 61 10.758 -1.938 26.477 1.00 0.00 N ATOM 0 H LYS A 61 4.691 -2.832 26.834 1.00 0.00 H new ATOM 0 HA LYS A 61 4.968 -0.061 25.956 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.634 -2.310 26.315 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.572 -2.120 24.574 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.125 0.354 24.892 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.344 0.037 26.602 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.879 -1.382 24.362 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.511 -0.051 25.310 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.875 -1.576 27.396 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.867 -2.878 26.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.058 -2.606 27.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.124 -2.253 25.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.132 -0.992 26.693 1.00 0.00 H new ATOM 621 N VAL A 62 3.658 -2.279 23.933 1.00 0.00 N ATOM 622 CA VAL A 62 2.958 -2.383 22.620 1.00 0.00 C ATOM 623 C VAL A 62 1.706 -1.505 22.656 1.00 0.00 C ATOM 624 O VAL A 62 1.335 -0.894 21.673 1.00 0.00 O ATOM 625 CB VAL A 62 2.562 -3.841 22.356 1.00 0.00 C ATOM 626 CG1 VAL A 62 1.670 -3.912 21.113 1.00 0.00 C ATOM 627 CG2 VAL A 62 3.821 -4.683 22.127 1.00 0.00 C ATOM 0 H VAL A 62 3.621 -3.116 24.515 1.00 0.00 H new ATOM 0 HA VAL A 62 3.621 -2.048 21.822 1.00 0.00 H new ATOM 0 HB VAL A 62 2.018 -4.228 23.218 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.389 -4.948 20.926 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.772 -3.316 21.275 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.214 -3.522 20.252 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.537 -5.719 21.940 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.367 -4.295 21.267 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.456 -4.635 23.011 1.00 0.00 H new ATOM 637 N GLN A 63 1.054 -1.434 23.784 1.00 0.00 N ATOM 638 CA GLN A 63 -0.169 -0.591 23.886 1.00 0.00 C ATOM 639 C GLN A 63 0.214 0.876 23.685 1.00 0.00 C ATOM 640 O GLN A 63 -0.476 1.623 23.021 1.00 0.00 O ATOM 641 CB GLN A 63 -0.796 -0.772 25.270 1.00 0.00 C ATOM 642 CG GLN A 63 -1.453 -2.155 25.361 1.00 0.00 C ATOM 643 CD GLN A 63 -2.794 -2.137 24.624 1.00 0.00 C ATOM 644 OE1 GLN A 63 -3.086 -1.212 23.892 1.00 0.00 O ATOM 645 NE2 GLN A 63 -3.628 -3.127 24.788 1.00 0.00 N ATOM 0 H GLN A 63 1.316 -1.924 24.639 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.887 -0.889 23.122 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.033 -0.669 26.042 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.538 0.006 25.449 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.798 -2.909 24.926 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.604 -2.429 26.405 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -3.383 -3.904 25.402 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -4.525 -3.124 24.302 1.00 0.00 H new ATOM 654 N SER A 64 1.315 1.292 24.250 1.00 0.00 N ATOM 655 CA SER A 64 1.747 2.708 24.088 1.00 0.00 C ATOM 656 C SER A 64 1.993 2.995 22.606 1.00 0.00 C ATOM 657 O SER A 64 1.691 4.063 22.111 1.00 0.00 O ATOM 658 CB SER A 64 3.038 2.942 24.875 1.00 0.00 C ATOM 659 OG SER A 64 3.298 4.336 24.954 1.00 0.00 O ATOM 0 H SER A 64 1.933 0.712 24.817 1.00 0.00 H new ATOM 0 HA SER A 64 0.969 3.372 24.464 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.948 2.521 25.876 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.870 2.433 24.389 1.00 0.00 H new ATOM 0 HG SER A 64 4.124 4.487 25.459 1.00 0.00 H new ATOM 665 N LEU A 65 2.535 2.046 21.892 1.00 0.00 N ATOM 666 CA LEU A 65 2.797 2.256 20.446 1.00 0.00 C ATOM 667 C LEU A 65 1.467 2.171 19.689 1.00 0.00 C ATOM 668 O LEU A 65 1.144 3.020 18.883 1.00 0.00 O ATOM 669 CB LEU A 65 3.766 1.162 19.963 1.00 0.00 C ATOM 670 CG LEU A 65 5.229 1.629 20.141 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.149 0.410 20.270 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.663 2.468 18.932 1.00 0.00 C ATOM 0 H LEU A 65 2.808 1.132 22.253 1.00 0.00 H new ATOM 0 HA LEU A 65 3.244 3.234 20.267 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.599 0.243 20.525 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.574 0.933 18.915 1.00 0.00 H new ATOM 0 HG LEU A 65 5.299 2.236 21.044 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.179 0.743 20.395 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.851 -0.181 21.136 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.072 -0.201 19.370 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.695 2.793 19.066 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.586 1.867 18.026 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.016 3.341 18.844 1.00 0.00 H new ATOM 684 N VAL A 66 0.687 1.161 19.959 1.00 0.00 N ATOM 685 CA VAL A 66 -0.625 1.029 19.276 1.00 0.00 C ATOM 686 C VAL A 66 -1.425 2.314 19.518 1.00 0.00 C ATOM 687 O VAL A 66 -2.194 2.749 18.684 1.00 0.00 O ATOM 688 CB VAL A 66 -1.362 -0.184 19.868 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.856 -0.124 19.540 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.768 -1.470 19.290 1.00 0.00 C ATOM 0 H VAL A 66 0.905 0.420 20.626 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.499 0.881 18.203 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.242 -0.170 20.951 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.358 -0.992 19.968 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.284 0.786 19.959 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.991 -0.124 18.458 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.289 -2.331 19.708 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.882 -1.468 18.206 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.291 -1.528 19.543 1.00 0.00 H new ATOM 700 N ASP A 67 -1.237 2.923 20.656 1.00 0.00 N ATOM 701 CA ASP A 67 -1.968 4.179 20.968 1.00 0.00 C ATOM 702 C ASP A 67 -1.334 5.348 20.204 1.00 0.00 C ATOM 703 O ASP A 67 -2.011 6.265 19.786 1.00 0.00 O ATOM 704 CB ASP A 67 -1.877 4.439 22.476 1.00 0.00 C ATOM 705 CG ASP A 67 -2.919 3.593 23.214 1.00 0.00 C ATOM 706 OD1 ASP A 67 -4.087 3.703 22.878 1.00 0.00 O ATOM 707 OD2 ASP A 67 -2.531 2.851 24.100 1.00 0.00 O ATOM 0 H ASP A 67 -0.603 2.600 21.387 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.012 4.085 20.670 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.877 4.196 22.836 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.042 5.497 22.682 1.00 0.00 H new ATOM 712 N THR A 68 -0.040 5.329 20.025 1.00 0.00 N ATOM 713 CA THR A 68 0.626 6.443 19.297 1.00 0.00 C ATOM 714 C THR A 68 0.194 6.421 17.830 1.00 0.00 C ATOM 715 O THR A 68 -0.234 7.416 17.281 1.00 0.00 O ATOM 716 CB THR A 68 2.146 6.274 19.389 1.00 0.00 C ATOM 717 OG1 THR A 68 2.501 5.915 20.717 1.00 0.00 O ATOM 718 CG2 THR A 68 2.829 7.589 19.014 1.00 0.00 C ATOM 0 H THR A 68 0.582 4.590 20.352 1.00 0.00 H new ATOM 0 HA THR A 68 0.340 7.395 19.744 1.00 0.00 H new ATOM 0 HB THR A 68 2.468 5.491 18.703 1.00 0.00 H new ATOM 0 HG1 THR A 68 2.289 4.970 20.868 1.00 0.00 H new ATOM 0 HG21 THR A 68 3.910 7.469 19.079 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.555 7.864 17.995 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.509 8.374 19.700 1.00 0.00 H new ATOM 726 N ILE A 69 0.303 5.288 17.195 1.00 0.00 N ATOM 727 CA ILE A 69 -0.101 5.189 15.765 1.00 0.00 C ATOM 728 C ILE A 69 -1.573 5.598 15.628 1.00 0.00 C ATOM 729 O ILE A 69 -1.955 6.276 14.696 1.00 0.00 O ATOM 730 CB ILE A 69 0.094 3.744 15.282 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.551 3.319 15.543 1.00 0.00 C ATOM 732 CG2 ILE A 69 -0.210 3.652 13.779 1.00 0.00 C ATOM 733 CD1 ILE A 69 1.857 1.993 14.838 1.00 0.00 C ATOM 0 H ILE A 69 0.656 4.424 17.606 1.00 0.00 H new ATOM 0 HA ILE A 69 0.513 5.853 15.157 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.584 3.083 15.822 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.231 4.093 15.187 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.719 3.215 16.615 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.070 2.625 13.442 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.241 3.957 13.597 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.465 4.309 13.230 1.00 0.00 H new ATOM 0 HD11 ILE A 69 2.891 1.707 15.033 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.189 1.218 15.215 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.709 2.109 13.764 1.00 0.00 H new ATOM 745 N ARG A 70 -2.401 5.181 16.547 1.00 0.00 N ATOM 746 CA ARG A 70 -3.852 5.534 16.470 1.00 0.00 C ATOM 747 C ARG A 70 -4.067 6.994 16.910 1.00 0.00 C ATOM 748 O ARG A 70 -4.949 7.670 16.418 1.00 0.00 O ATOM 749 CB ARG A 70 -4.656 4.581 17.392 1.00 0.00 C ATOM 750 CG ARG A 70 -5.261 3.427 16.582 1.00 0.00 C ATOM 751 CD ARG A 70 -6.169 2.593 17.489 1.00 0.00 C ATOM 752 NE ARG A 70 -7.204 3.475 18.100 1.00 0.00 N ATOM 753 CZ ARG A 70 -8.232 3.860 17.395 1.00 0.00 C ATOM 754 NH1 ARG A 70 -8.354 3.474 16.154 1.00 0.00 N ATOM 755 NH2 ARG A 70 -9.138 4.632 17.930 1.00 0.00 N ATOM 0 H ARG A 70 -2.137 4.610 17.350 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.197 5.426 15.442 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -4.004 4.184 18.170 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.449 5.135 17.893 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.831 3.819 15.739 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.469 2.803 16.169 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -6.646 1.799 16.914 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -5.579 2.112 18.269 1.00 0.00 H new ATOM 0 HE ARG A 70 -7.108 3.778 19.069 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -7.646 2.871 15.735 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -9.158 3.775 15.603 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -9.042 4.934 18.899 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -9.942 4.933 17.379 1.00 0.00 H new ATOM 769 N GLU A 71 -3.289 7.482 17.840 1.00 0.00 N ATOM 770 CA GLU A 71 -3.476 8.887 18.312 1.00 0.00 C ATOM 771 C GLU A 71 -2.685 9.851 17.427 1.00 0.00 C ATOM 772 O GLU A 71 -3.103 10.964 17.178 1.00 0.00 O ATOM 773 CB GLU A 71 -2.977 9.005 19.753 1.00 0.00 C ATOM 774 CG GLU A 71 -3.359 10.376 20.312 1.00 0.00 C ATOM 775 CD GLU A 71 -2.866 10.494 21.756 1.00 0.00 C ATOM 776 OE1 GLU A 71 -1.687 10.744 21.939 1.00 0.00 O ATOM 777 OE2 GLU A 71 -3.677 10.332 22.653 1.00 0.00 O ATOM 0 H GLU A 71 -2.533 6.969 18.293 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.535 9.142 18.260 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.412 8.216 20.366 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.895 8.875 19.787 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.920 11.165 19.701 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -4.440 10.508 20.274 1.00 0.00 H new ATOM 784 N ASP A 72 -1.539 9.441 16.961 1.00 0.00 N ATOM 785 CA ASP A 72 -0.715 10.343 16.104 1.00 0.00 C ATOM 786 C ASP A 72 0.248 9.504 15.245 1.00 0.00 C ATOM 787 O ASP A 72 1.297 9.109 15.715 1.00 0.00 O ATOM 788 CB ASP A 72 0.104 11.269 17.009 1.00 0.00 C ATOM 789 CG ASP A 72 0.648 12.440 16.188 1.00 0.00 C ATOM 790 OD1 ASP A 72 0.719 12.307 14.977 1.00 0.00 O ATOM 791 OD2 ASP A 72 0.984 13.451 16.784 1.00 0.00 O ATOM 0 H ASP A 72 -1.136 8.521 17.136 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.366 10.927 15.454 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.517 11.641 17.824 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.927 10.716 17.462 1.00 0.00 H new ATOM 796 N PRO A 73 -0.085 9.215 14.002 1.00 0.00 N ATOM 797 CA PRO A 73 0.804 8.396 13.125 1.00 0.00 C ATOM 798 C PRO A 73 2.022 9.183 12.603 1.00 0.00 C ATOM 799 O PRO A 73 2.873 8.639 11.927 1.00 0.00 O ATOM 800 CB PRO A 73 -0.119 7.974 11.973 1.00 0.00 C ATOM 801 CG PRO A 73 -1.138 9.066 11.874 1.00 0.00 C ATOM 802 CD PRO A 73 -1.326 9.617 13.295 1.00 0.00 C ATOM 0 HA PRO A 73 1.240 7.554 13.663 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.436 7.867 11.041 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.590 7.012 12.176 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.802 9.850 11.195 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -2.079 8.684 11.478 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.450 10.700 13.290 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.211 9.197 13.772 1.00 0.00 H new ATOM 810 N ASP A 74 2.110 10.456 12.901 1.00 0.00 N ATOM 811 CA ASP A 74 3.271 11.267 12.409 1.00 0.00 C ATOM 812 C ASP A 74 4.421 11.260 13.433 1.00 0.00 C ATOM 813 O ASP A 74 5.573 11.391 13.072 1.00 0.00 O ATOM 814 CB ASP A 74 2.813 12.710 12.169 1.00 0.00 C ATOM 815 CG ASP A 74 1.956 12.770 10.902 1.00 0.00 C ATOM 816 OD1 ASP A 74 2.328 12.135 9.929 1.00 0.00 O ATOM 817 OD2 ASP A 74 0.943 13.450 10.927 1.00 0.00 O ATOM 0 H ASP A 74 1.430 10.969 13.462 1.00 0.00 H new ATOM 0 HA ASP A 74 3.633 10.827 11.480 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.241 13.068 13.025 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.678 13.365 12.067 1.00 0.00 H new ATOM 822 N SER A 75 4.130 11.116 14.702 1.00 0.00 N ATOM 823 CA SER A 75 5.223 11.111 15.723 1.00 0.00 C ATOM 824 C SER A 75 5.816 9.702 15.833 1.00 0.00 C ATOM 825 O SER A 75 6.401 9.348 16.838 1.00 0.00 O ATOM 826 CB SER A 75 4.655 11.525 17.085 1.00 0.00 C ATOM 827 OG SER A 75 5.723 11.729 17.998 1.00 0.00 O ATOM 0 H SER A 75 3.187 11.002 15.074 1.00 0.00 H new ATOM 0 HA SER A 75 6.000 11.813 15.421 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.068 12.438 16.985 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.983 10.754 17.461 1.00 0.00 H new ATOM 0 HG SER A 75 6.361 10.989 17.926 1.00 0.00 H new ATOM 833 N VAL A 76 5.667 8.894 14.806 1.00 0.00 N ATOM 834 CA VAL A 76 6.214 7.498 14.835 1.00 0.00 C ATOM 835 C VAL A 76 7.260 7.356 13.706 1.00 0.00 C ATOM 836 O VAL A 76 6.898 7.264 12.550 1.00 0.00 O ATOM 837 CB VAL A 76 5.051 6.517 14.594 1.00 0.00 C ATOM 838 CG1 VAL A 76 5.400 5.125 15.141 1.00 0.00 C ATOM 839 CG2 VAL A 76 3.799 7.041 15.305 1.00 0.00 C ATOM 0 H VAL A 76 5.186 9.145 13.943 1.00 0.00 H new ATOM 0 HA VAL A 76 6.683 7.284 15.795 1.00 0.00 H new ATOM 0 HB VAL A 76 4.870 6.437 13.522 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.567 4.445 14.962 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.290 4.749 14.637 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.590 5.192 16.212 1.00 0.00 H new ATOM 0 HG21 VAL A 76 2.971 6.352 15.139 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.995 7.122 16.374 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.539 8.022 14.908 1.00 0.00 H new ATOM 849 N PRO A 77 8.544 7.360 14.014 1.00 0.00 N ATOM 850 CA PRO A 77 9.602 7.255 12.964 1.00 0.00 C ATOM 851 C PRO A 77 9.748 5.832 12.396 1.00 0.00 C ATOM 852 O PRO A 77 9.299 4.871 12.988 1.00 0.00 O ATOM 853 CB PRO A 77 10.887 7.702 13.683 1.00 0.00 C ATOM 854 CG PRO A 77 10.646 7.456 15.146 1.00 0.00 C ATOM 855 CD PRO A 77 9.124 7.464 15.368 1.00 0.00 C ATOM 0 HA PRO A 77 9.361 7.867 12.095 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.750 7.138 13.329 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.095 8.755 13.493 1.00 0.00 H new ATOM 0 HG2 PRO A 77 11.073 6.501 15.450 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.126 8.227 15.749 1.00 0.00 H new ATOM 0 HD2 PRO A 77 8.812 6.630 15.997 1.00 0.00 H new ATOM 0 HD3 PRO A 77 8.802 8.378 15.867 1.00 0.00 H new ATOM 863 N PRO A 78 10.378 5.709 11.249 1.00 0.00 N ATOM 864 CA PRO A 78 10.596 4.390 10.579 1.00 0.00 C ATOM 865 C PRO A 78 11.686 3.566 11.268 1.00 0.00 C ATOM 866 O PRO A 78 12.385 4.046 12.138 1.00 0.00 O ATOM 867 CB PRO A 78 11.038 4.778 9.161 1.00 0.00 C ATOM 868 CG PRO A 78 11.704 6.105 9.327 1.00 0.00 C ATOM 869 CD PRO A 78 10.956 6.817 10.459 1.00 0.00 C ATOM 0 HA PRO A 78 9.702 3.766 10.606 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.722 4.040 8.743 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.187 4.843 8.484 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.759 5.984 9.573 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.656 6.683 8.404 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.628 7.429 11.060 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.182 7.480 10.072 1.00 0.00 H new ATOM 877 N ILE A 79 11.839 2.332 10.866 1.00 0.00 N ATOM 878 CA ILE A 79 12.889 1.453 11.466 1.00 0.00 C ATOM 879 C ILE A 79 13.978 1.204 10.423 1.00 0.00 C ATOM 880 O ILE A 79 13.780 1.413 9.242 1.00 0.00 O ATOM 881 CB ILE A 79 12.265 0.112 11.871 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.318 -0.377 10.756 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.484 0.284 13.179 1.00 0.00 C ATOM 884 CD1 ILE A 79 11.169 -1.896 10.837 1.00 0.00 C ATOM 0 H ILE A 79 11.276 1.890 10.140 1.00 0.00 H new ATOM 0 HA ILE A 79 13.315 1.935 12.346 1.00 0.00 H new ATOM 0 HB ILE A 79 13.054 -0.625 12.018 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.343 0.100 10.858 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.711 -0.092 9.780 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.041 -0.670 13.466 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.160 0.621 13.965 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.695 1.023 13.037 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.499 -2.238 10.048 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.145 -2.364 10.713 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.756 -2.170 11.808 1.00 0.00 H new ATOM 896 N ASP A 80 15.123 0.751 10.847 1.00 0.00 N ATOM 897 CA ASP A 80 16.220 0.477 9.888 1.00 0.00 C ATOM 898 C ASP A 80 16.025 -0.927 9.311 1.00 0.00 C ATOM 899 O ASP A 80 15.855 -1.885 10.039 1.00 0.00 O ATOM 900 CB ASP A 80 17.550 0.554 10.637 1.00 0.00 C ATOM 901 CG ASP A 80 17.389 -0.075 12.023 1.00 0.00 C ATOM 902 OD1 ASP A 80 16.677 0.497 12.832 1.00 0.00 O ATOM 903 OD2 ASP A 80 17.982 -1.116 12.252 1.00 0.00 O ATOM 0 H ASP A 80 15.345 0.558 11.824 1.00 0.00 H new ATOM 0 HA ASP A 80 16.217 1.205 9.077 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.326 0.033 10.077 1.00 0.00 H new ATOM 0 HB3 ASP A 80 17.868 1.592 10.731 1.00 0.00 H new ATOM 908 N VAL A 81 16.037 -1.055 8.009 1.00 0.00 N ATOM 909 CA VAL A 81 15.842 -2.394 7.368 1.00 0.00 C ATOM 910 C VAL A 81 16.915 -2.594 6.291 1.00 0.00 C ATOM 911 O VAL A 81 17.238 -1.695 5.539 1.00 0.00 O ATOM 912 CB VAL A 81 14.425 -2.444 6.760 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.339 -3.493 5.646 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.416 -2.798 7.860 1.00 0.00 C ATOM 0 H VAL A 81 16.175 -0.284 7.356 1.00 0.00 H new ATOM 0 HA VAL A 81 15.939 -3.195 8.100 1.00 0.00 H new ATOM 0 HB VAL A 81 14.198 -1.466 6.334 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.329 -3.506 5.236 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.048 -3.244 4.856 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.578 -4.476 6.052 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.413 -2.835 7.435 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.666 -3.770 8.284 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.451 -2.041 8.643 1.00 0.00 H new ATOM 924 N LEU A 82 17.479 -3.771 6.232 1.00 0.00 N ATOM 925 CA LEU A 82 18.547 -4.052 5.232 1.00 0.00 C ATOM 926 C LEU A 82 17.923 -4.492 3.905 1.00 0.00 C ATOM 927 O LEU A 82 17.043 -5.328 3.864 1.00 0.00 O ATOM 928 CB LEU A 82 19.449 -5.171 5.765 1.00 0.00 C ATOM 929 CG LEU A 82 20.032 -4.772 7.140 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.372 -6.030 7.944 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.305 -3.941 6.950 1.00 0.00 C ATOM 0 H LEU A 82 17.243 -4.556 6.840 1.00 0.00 H new ATOM 0 HA LEU A 82 19.132 -3.147 5.066 1.00 0.00 H new ATOM 0 HB2 LEU A 82 18.879 -6.096 5.857 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.258 -5.364 5.060 1.00 0.00 H new ATOM 0 HG LEU A 82 19.289 -4.182 7.677 1.00 0.00 H new ATOM 0 HD11 LEU A 82 20.783 -5.743 8.912 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.469 -6.621 8.094 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.107 -6.622 7.399 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.708 -3.665 7.924 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.044 -4.527 6.404 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.070 -3.039 6.386 1.00 0.00 H new ATOM 943 N TRP A 83 18.383 -3.925 2.821 1.00 0.00 N ATOM 944 CA TRP A 83 17.849 -4.276 1.471 1.00 0.00 C ATOM 945 C TRP A 83 18.932 -5.043 0.708 1.00 0.00 C ATOM 946 O TRP A 83 19.925 -4.474 0.297 1.00 0.00 O ATOM 947 CB TRP A 83 17.530 -2.964 0.759 1.00 0.00 C ATOM 948 CG TRP A 83 17.046 -3.170 -0.644 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.603 -4.331 -1.200 1.00 0.00 C ATOM 950 CD2 TRP A 83 16.950 -2.161 -1.681 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.245 -4.079 -2.518 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.446 -2.755 -2.857 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.257 -0.792 -1.703 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.253 -2.012 -4.022 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.067 -0.041 -2.873 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.566 -0.651 -4.030 1.00 0.00 C ATOM 0 H TRP A 83 19.120 -3.220 2.814 1.00 0.00 H new ATOM 0 HA TRP A 83 16.955 -4.896 1.535 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.771 -2.423 1.325 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.422 -2.338 0.743 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.541 -5.287 -0.701 1.00 0.00 H new ATOM 0 HE1 TRP A 83 15.879 -4.785 -3.157 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.642 -0.314 -0.814 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 15.864 -2.486 -4.911 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.308 1.012 -2.881 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.422 -0.069 -4.928 1.00 0.00 H new ATOM 967 N ILE A 84 18.762 -6.333 0.533 1.00 0.00 N ATOM 968 CA ILE A 84 19.796 -7.152 -0.185 1.00 0.00 C ATOM 969 C ILE A 84 19.145 -7.907 -1.345 1.00 0.00 C ATOM 970 O ILE A 84 18.004 -8.318 -1.273 1.00 0.00 O ATOM 971 CB ILE A 84 20.415 -8.152 0.799 1.00 0.00 C ATOM 972 CG1 ILE A 84 20.914 -7.401 2.036 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.600 -8.862 0.140 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.575 -8.388 2.998 1.00 0.00 C ATOM 0 H ILE A 84 17.949 -6.857 0.857 1.00 0.00 H new ATOM 0 HA ILE A 84 20.572 -6.496 -0.580 1.00 0.00 H new ATOM 0 HB ILE A 84 19.662 -8.886 1.085 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.626 -6.629 1.744 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.083 -6.897 2.529 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.036 -9.571 0.843 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.257 -9.395 -0.747 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.352 -8.126 -0.146 1.00 0.00 H new ATOM 0 HD11 ILE A 84 21.931 -7.854 3.879 1.00 0.00 H new ATOM 0 HD12 ILE A 84 20.849 -9.143 3.300 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.417 -8.871 2.502 1.00 0.00 H new ATOM 986 N LYS A 85 19.874 -8.086 -2.420 1.00 0.00 N ATOM 987 CA LYS A 85 19.331 -8.808 -3.615 1.00 0.00 C ATOM 988 C LYS A 85 20.002 -10.176 -3.735 1.00 0.00 C ATOM 989 O LYS A 85 21.080 -10.403 -3.223 1.00 0.00 O ATOM 990 CB LYS A 85 19.612 -7.973 -4.876 1.00 0.00 C ATOM 991 CG LYS A 85 18.488 -6.962 -5.082 1.00 0.00 C ATOM 992 CD LYS A 85 18.815 -6.045 -6.268 1.00 0.00 C ATOM 993 CE LYS A 85 17.539 -5.380 -6.795 1.00 0.00 C ATOM 994 NZ LYS A 85 17.094 -4.338 -5.835 1.00 0.00 N ATOM 0 H LYS A 85 20.835 -7.758 -2.522 1.00 0.00 H new ATOM 0 HA LYS A 85 18.256 -8.950 -3.505 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.566 -7.456 -4.777 1.00 0.00 H new ATOM 0 HB3 LYS A 85 19.692 -8.625 -5.746 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.548 -7.483 -5.264 1.00 0.00 H new ATOM 0 HG3 LYS A 85 18.353 -6.367 -4.179 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.530 -5.282 -5.960 1.00 0.00 H new ATOM 0 HD3 LYS A 85 19.287 -6.622 -7.063 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.725 -4.934 -7.772 1.00 0.00 H new ATOM 0 HE3 LYS A 85 16.755 -6.126 -6.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 16.322 -3.784 -6.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 16.757 -4.792 -4.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 17.891 -3.708 -5.612 1.00 0.00 H new ATOM 1008 N GLY A 86 19.354 -11.094 -4.403 1.00 0.00 N ATOM 1009 CA GLY A 86 19.924 -12.465 -4.560 1.00 0.00 C ATOM 1010 C GLY A 86 20.605 -12.610 -5.921 1.00 0.00 C ATOM 1011 O GLY A 86 20.801 -11.653 -6.644 1.00 0.00 O ATOM 0 H GLY A 86 18.448 -10.952 -4.850 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.643 -12.659 -3.764 1.00 0.00 H new ATOM 0 HA3 GLY A 86 19.132 -13.208 -4.462 1.00 0.00 H new ATOM 1015 N ALA A 87 20.976 -13.814 -6.259 1.00 0.00 N ATOM 1016 CA ALA A 87 21.660 -14.069 -7.557 1.00 0.00 C ATOM 1017 C ALA A 87 20.701 -13.838 -8.733 1.00 0.00 C ATOM 1018 O ALA A 87 21.102 -13.912 -9.878 1.00 0.00 O ATOM 1019 CB ALA A 87 22.149 -15.522 -7.584 1.00 0.00 C ATOM 0 H ALA A 87 20.832 -14.643 -5.682 1.00 0.00 H new ATOM 0 HA ALA A 87 22.500 -13.382 -7.653 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.652 -15.719 -8.531 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.846 -15.687 -6.762 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.298 -16.194 -7.478 1.00 0.00 H new ATOM 1025 N GLN A 88 19.439 -13.581 -8.469 1.00 0.00 N ATOM 1026 CA GLN A 88 18.456 -13.370 -9.587 1.00 0.00 C ATOM 1027 C GLN A 88 17.670 -12.070 -9.376 1.00 0.00 C ATOM 1028 O GLN A 88 16.536 -11.947 -9.793 1.00 0.00 O ATOM 1029 CB GLN A 88 17.492 -14.558 -9.628 1.00 0.00 C ATOM 1030 CG GLN A 88 18.292 -15.861 -9.507 1.00 0.00 C ATOM 1031 CD GLN A 88 17.432 -17.043 -9.957 1.00 0.00 C ATOM 1032 OE1 GLN A 88 16.241 -16.904 -10.154 1.00 0.00 O ATOM 1033 NE2 GLN A 88 17.991 -18.211 -10.128 1.00 0.00 N ATOM 0 H GLN A 88 19.047 -13.508 -7.530 1.00 0.00 H new ATOM 0 HA GLN A 88 18.996 -13.294 -10.531 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.770 -14.484 -8.815 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.926 -14.550 -10.559 1.00 0.00 H new ATOM 0 HG2 GLN A 88 19.193 -15.803 -10.117 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.614 -16.006 -8.476 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.991 -18.327 -9.963 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.428 -19.007 -10.427 1.00 0.00 H new ATOM 1042 N GLY A 89 18.271 -11.091 -8.756 1.00 0.00 N ATOM 1043 CA GLY A 89 17.567 -9.789 -8.549 1.00 0.00 C ATOM 1044 C GLY A 89 16.494 -9.913 -7.461 1.00 0.00 C ATOM 1045 O GLY A 89 15.980 -8.925 -6.976 1.00 0.00 O ATOM 0 H GLY A 89 19.219 -11.135 -8.383 1.00 0.00 H new ATOM 0 HA2 GLY A 89 18.288 -9.022 -8.268 1.00 0.00 H new ATOM 0 HA3 GLY A 89 17.107 -9.467 -9.483 1.00 0.00 H new ATOM 1049 N GLY A 90 16.144 -11.108 -7.075 1.00 0.00 N ATOM 1050 CA GLY A 90 15.104 -11.277 -6.027 1.00 0.00 C ATOM 1051 C GLY A 90 15.419 -10.367 -4.844 1.00 0.00 C ATOM 1052 O GLY A 90 16.361 -10.580 -4.109 1.00 0.00 O ATOM 0 H GLY A 90 16.535 -11.976 -7.442 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.121 -11.036 -6.433 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.068 -12.316 -5.700 1.00 0.00 H new ATOM 1056 N ASP A 91 14.633 -9.352 -4.659 1.00 0.00 N ATOM 1057 CA ASP A 91 14.871 -8.422 -3.526 1.00 0.00 C ATOM 1058 C ASP A 91 14.361 -9.070 -2.238 1.00 0.00 C ATOM 1059 O ASP A 91 13.278 -9.619 -2.192 1.00 0.00 O ATOM 1060 CB ASP A 91 14.126 -7.103 -3.776 1.00 0.00 C ATOM 1061 CG ASP A 91 14.956 -6.209 -4.698 1.00 0.00 C ATOM 1062 OD1 ASP A 91 16.083 -5.915 -4.339 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.451 -5.834 -5.743 1.00 0.00 O ATOM 0 H ASP A 91 13.831 -9.123 -5.246 1.00 0.00 H new ATOM 0 HA ASP A 91 15.937 -8.214 -3.435 1.00 0.00 H new ATOM 0 HB2 ASP A 91 13.154 -7.303 -4.226 1.00 0.00 H new ATOM 0 HB3 ASP A 91 13.941 -6.594 -2.830 1.00 0.00 H new ATOM 1068 N TYR A 92 15.143 -9.006 -1.195 1.00 0.00 N ATOM 1069 CA TYR A 92 14.738 -9.608 0.113 1.00 0.00 C ATOM 1070 C TYR A 92 14.924 -8.553 1.206 1.00 0.00 C ATOM 1071 O TYR A 92 15.951 -7.908 1.280 1.00 0.00 O ATOM 1072 CB TYR A 92 15.622 -10.826 0.390 1.00 0.00 C ATOM 1073 CG TYR A 92 15.419 -11.850 -0.709 1.00 0.00 C ATOM 1074 CD1 TYR A 92 14.358 -12.763 -0.630 1.00 0.00 C ATOM 1075 CD2 TYR A 92 16.287 -11.887 -1.809 1.00 0.00 C ATOM 1076 CE1 TYR A 92 14.167 -13.707 -1.646 1.00 0.00 C ATOM 1077 CE2 TYR A 92 16.094 -12.831 -2.823 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.035 -13.741 -2.742 1.00 0.00 C ATOM 1079 OH TYR A 92 14.847 -14.672 -3.743 1.00 0.00 O ATOM 0 H TYR A 92 16.059 -8.556 -1.191 1.00 0.00 H new ATOM 0 HA TYR A 92 13.696 -9.926 0.091 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.669 -10.527 0.436 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.371 -11.260 1.358 1.00 0.00 H new ATOM 0 HD1 TYR A 92 13.687 -12.738 0.216 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.106 -11.186 -1.874 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.349 -14.409 -1.583 1.00 0.00 H new ATOM 0 HE2 TYR A 92 16.764 -12.857 -3.670 1.00 0.00 H new ATOM 0 HH TYR A 92 15.537 -14.558 -4.430 1.00 0.00 H new ATOM 1089 N PHE A 93 13.930 -8.351 2.040 1.00 0.00 N ATOM 1090 CA PHE A 93 14.030 -7.316 3.110 1.00 0.00 C ATOM 1091 C PHE A 93 14.236 -7.983 4.470 1.00 0.00 C ATOM 1092 O PHE A 93 13.422 -8.758 4.928 1.00 0.00 O ATOM 1093 CB PHE A 93 12.735 -6.496 3.115 1.00 0.00 C ATOM 1094 CG PHE A 93 12.514 -5.895 1.741 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.240 -4.764 1.341 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.592 -6.478 0.860 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.046 -4.223 0.064 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.397 -5.933 -0.414 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.125 -4.807 -0.812 1.00 0.00 C ATOM 0 H PHE A 93 13.049 -8.865 2.022 1.00 0.00 H new ATOM 0 HA PHE A 93 14.882 -6.664 2.917 1.00 0.00 H new ATOM 0 HB2 PHE A 93 11.891 -7.130 3.387 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.794 -5.706 3.864 1.00 0.00 H new ATOM 0 HD1 PHE A 93 13.949 -4.310 2.018 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.031 -7.349 1.165 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.608 -3.354 -0.245 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.684 -6.382 -1.090 1.00 0.00 H new ATOM 0 HZ PHE A 93 11.976 -4.388 -1.796 1.00 0.00 H new ATOM 1109 N TYR A 94 15.331 -7.675 5.115 1.00 0.00 N ATOM 1110 CA TYR A 94 15.636 -8.267 6.452 1.00 0.00 C ATOM 1111 C TYR A 94 15.453 -7.190 7.523 1.00 0.00 C ATOM 1112 O TYR A 94 15.787 -6.041 7.320 1.00 0.00 O ATOM 1113 CB TYR A 94 17.103 -8.749 6.455 1.00 0.00 C ATOM 1114 CG TYR A 94 17.168 -10.221 6.139 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.228 -10.649 4.810 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.165 -11.153 7.179 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.286 -12.014 4.519 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.222 -12.520 6.888 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.282 -12.951 5.558 1.00 0.00 C ATOM 1120 OH TYR A 94 17.339 -14.300 5.272 1.00 0.00 O ATOM 0 H TYR A 94 16.038 -7.028 4.766 1.00 0.00 H new ATOM 0 HA TYR A 94 14.970 -9.105 6.657 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.680 -8.186 5.721 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.554 -8.558 7.429 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.230 -9.925 4.009 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.119 -10.819 8.205 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.334 -12.346 3.492 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.220 -13.243 7.690 1.00 0.00 H new ATOM 0 HH TYR A 94 17.329 -14.812 6.107 1.00 0.00 H new ATOM 1130 N SER A 95 14.940 -7.561 8.667 1.00 0.00 N ATOM 1131 CA SER A 95 14.743 -6.570 9.772 1.00 0.00 C ATOM 1132 C SER A 95 15.307 -7.143 11.076 1.00 0.00 C ATOM 1133 O SER A 95 15.086 -8.290 11.413 1.00 0.00 O ATOM 1134 CB SER A 95 13.242 -6.271 9.932 1.00 0.00 C ATOM 1135 OG SER A 95 13.066 -4.899 10.250 1.00 0.00 O ATOM 0 H SER A 95 14.647 -8.513 8.887 1.00 0.00 H new ATOM 0 HA SER A 95 15.266 -5.644 9.533 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.712 -6.513 9.011 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.817 -6.895 10.718 1.00 0.00 H new ATOM 0 HG SER A 95 12.110 -4.706 10.351 1.00 0.00 H new ATOM 1141 N PHE A 96 16.012 -6.337 11.819 1.00 0.00 N ATOM 1142 CA PHE A 96 16.578 -6.789 13.118 1.00 0.00 C ATOM 1143 C PHE A 96 16.376 -5.658 14.126 1.00 0.00 C ATOM 1144 O PHE A 96 17.199 -4.774 14.258 1.00 0.00 O ATOM 1145 CB PHE A 96 18.070 -7.040 12.970 1.00 0.00 C ATOM 1146 CG PHE A 96 18.302 -8.311 12.187 1.00 0.00 C ATOM 1147 CD1 PHE A 96 18.064 -9.551 12.783 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.773 -8.248 10.875 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.301 -10.731 12.067 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.008 -9.422 10.156 1.00 0.00 C ATOM 1151 CZ PHE A 96 18.775 -10.665 10.752 1.00 0.00 C ATOM 0 H PHE A 96 16.223 -5.369 11.576 1.00 0.00 H new ATOM 0 HA PHE A 96 16.088 -7.707 13.443 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.541 -6.198 12.462 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.534 -7.118 13.953 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.697 -9.600 13.797 1.00 0.00 H new ATOM 0 HD2 PHE A 96 18.956 -7.289 10.414 1.00 0.00 H new ATOM 0 HE1 PHE A 96 18.118 -11.690 12.529 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.370 -9.370 9.140 1.00 0.00 H new ATOM 0 HZ PHE A 96 18.961 -11.573 10.198 1.00 0.00 H new ATOM 1161 N GLY A 97 15.283 -5.680 14.826 1.00 0.00 N ATOM 1162 CA GLY A 97 14.983 -4.613 15.832 1.00 0.00 C ATOM 1163 C GLY A 97 13.543 -4.139 15.625 1.00 0.00 C ATOM 1164 O GLY A 97 12.761 -4.787 14.959 1.00 0.00 O ATOM 0 H GLY A 97 14.567 -6.402 14.747 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.113 -4.999 16.843 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.676 -3.779 15.718 1.00 0.00 H new ATOM 1168 N GLY A 98 13.186 -3.011 16.179 1.00 0.00 N ATOM 1169 CA GLY A 98 11.795 -2.500 15.999 1.00 0.00 C ATOM 1170 C GLY A 98 10.785 -3.634 16.224 1.00 0.00 C ATOM 1171 O GLY A 98 9.632 -3.530 15.855 1.00 0.00 O ATOM 0 H GLY A 98 13.795 -2.422 16.747 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.604 -1.687 16.700 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.676 -2.090 14.996 1.00 0.00 H new ATOM 1175 N CYS A 99 11.208 -4.719 16.819 1.00 0.00 N ATOM 1176 CA CYS A 99 10.273 -5.855 17.053 1.00 0.00 C ATOM 1177 C CYS A 99 8.986 -5.345 17.706 1.00 0.00 C ATOM 1178 O CYS A 99 7.896 -5.619 17.245 1.00 0.00 O ATOM 1179 CB CYS A 99 10.945 -6.878 17.973 1.00 0.00 C ATOM 1180 SG CYS A 99 12.665 -7.111 17.460 1.00 0.00 S ATOM 0 H CYS A 99 12.161 -4.866 17.152 1.00 0.00 H new ATOM 0 HA CYS A 99 10.026 -6.323 16.100 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.906 -6.535 19.007 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.410 -7.827 17.932 1.00 0.00 H new ATOM 0 HG CYS A 99 13.237 -7.978 18.242 1.00 0.00 H new ATOM 1186 N HIS A 100 9.099 -4.609 18.776 1.00 0.00 N ATOM 1187 CA HIS A 100 7.876 -4.090 19.452 1.00 0.00 C ATOM 1188 C HIS A 100 7.083 -3.215 18.477 1.00 0.00 C ATOM 1189 O HIS A 100 5.868 -3.217 18.481 1.00 0.00 O ATOM 1190 CB HIS A 100 8.283 -3.275 20.691 1.00 0.00 C ATOM 1191 CG HIS A 100 8.552 -4.203 21.849 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.724 -4.937 21.958 1.00 0.00 N ATOM 1193 CD2 HIS A 100 7.803 -4.529 22.953 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.645 -5.661 23.092 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.494 -5.449 23.736 1.00 0.00 N ATOM 0 H HIS A 100 9.983 -4.344 19.211 1.00 0.00 H new ATOM 0 HA HIS A 100 7.248 -4.924 19.767 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.173 -2.684 20.473 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.491 -2.573 20.952 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.503 -4.930 21.300 1.00 0.00 H new ATOM 0 HD2 HIS A 100 6.825 -4.131 23.180 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.418 -6.331 23.438 1.00 0.00 H new ATOM 1203 N ARG A 101 7.750 -2.471 17.639 1.00 0.00 N ATOM 1204 CA ARG A 101 7.012 -1.611 16.670 1.00 0.00 C ATOM 1205 C ARG A 101 6.294 -2.498 15.644 1.00 0.00 C ATOM 1206 O ARG A 101 5.256 -2.139 15.125 1.00 0.00 O ATOM 1207 CB ARG A 101 7.985 -0.651 15.971 1.00 0.00 C ATOM 1208 CG ARG A 101 8.399 0.446 16.958 1.00 0.00 C ATOM 1209 CD ARG A 101 9.284 1.482 16.256 1.00 0.00 C ATOM 1210 NE ARG A 101 10.687 0.977 16.195 1.00 0.00 N ATOM 1211 CZ ARG A 101 11.682 1.816 16.080 1.00 0.00 C ATOM 1212 NH1 ARG A 101 11.451 3.099 16.000 1.00 0.00 N ATOM 1213 NH2 ARG A 101 12.908 1.372 16.041 1.00 0.00 N ATOM 0 H ARG A 101 8.767 -2.421 17.582 1.00 0.00 H new ATOM 0 HA ARG A 101 6.270 -1.016 17.202 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.863 -1.194 15.621 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.513 -0.209 15.093 1.00 0.00 H new ATOM 0 HG2 ARG A 101 7.513 0.931 17.367 1.00 0.00 H new ATOM 0 HG3 ARG A 101 8.937 0.006 17.797 1.00 0.00 H new ATOM 0 HD2 ARG A 101 8.911 1.673 15.250 1.00 0.00 H new ATOM 0 HD3 ARG A 101 9.250 2.429 16.794 1.00 0.00 H new ATOM 0 HE ARG A 101 10.870 -0.025 16.243 1.00 0.00 H new ATOM 0 HH11 ARG A 101 10.493 3.447 16.027 1.00 0.00 H new ATOM 0 HH12 ARG A 101 12.229 3.753 15.910 1.00 0.00 H new ATOM 0 HH21 ARG A 101 13.090 0.370 16.100 1.00 0.00 H new ATOM 0 HH22 ARG A 101 13.685 2.027 15.951 1.00 0.00 H new ATOM 1227 N TYR A 102 6.825 -3.658 15.356 1.00 0.00 N ATOM 1228 CA TYR A 102 6.157 -4.562 14.377 1.00 0.00 C ATOM 1229 C TYR A 102 4.842 -5.067 14.987 1.00 0.00 C ATOM 1230 O TYR A 102 3.822 -5.121 14.331 1.00 0.00 O ATOM 1231 CB TYR A 102 7.091 -5.743 14.064 1.00 0.00 C ATOM 1232 CG TYR A 102 6.335 -6.846 13.360 1.00 0.00 C ATOM 1233 CD1 TYR A 102 5.655 -7.802 14.117 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.317 -6.918 11.961 1.00 0.00 C ATOM 1235 CE1 TYR A 102 4.957 -8.833 13.483 1.00 0.00 C ATOM 1236 CE2 TYR A 102 5.617 -7.951 11.324 1.00 0.00 C ATOM 1237 CZ TYR A 102 4.937 -8.909 12.086 1.00 0.00 C ATOM 1238 OH TYR A 102 4.248 -9.927 11.460 1.00 0.00 O ATOM 0 H TYR A 102 7.692 -4.017 15.757 1.00 0.00 H new ATOM 0 HA TYR A 102 5.941 -4.028 13.451 1.00 0.00 H new ATOM 0 HB2 TYR A 102 7.917 -5.405 13.439 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.526 -6.125 14.988 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.669 -7.744 15.195 1.00 0.00 H new ATOM 0 HD2 TYR A 102 6.842 -6.178 11.375 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.433 -9.571 14.071 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.602 -8.008 10.246 1.00 0.00 H new ATOM 0 HH TYR A 102 3.544 -10.260 12.055 1.00 0.00 H new ATOM 1248 N ALA A 103 4.863 -5.434 16.240 1.00 0.00 N ATOM 1249 CA ALA A 103 3.619 -5.930 16.899 1.00 0.00 C ATOM 1250 C ALA A 103 2.530 -4.860 16.817 1.00 0.00 C ATOM 1251 O ALA A 103 1.397 -5.142 16.482 1.00 0.00 O ATOM 1252 CB ALA A 103 3.909 -6.238 18.370 1.00 0.00 C ATOM 0 H ALA A 103 5.689 -5.412 16.837 1.00 0.00 H new ATOM 0 HA ALA A 103 3.281 -6.834 16.392 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.001 -6.600 18.852 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.684 -7.002 18.436 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.249 -5.332 18.871 1.00 0.00 H new ATOM 1258 N ALA A 104 2.858 -3.637 17.129 1.00 0.00 N ATOM 1259 CA ALA A 104 1.831 -2.561 17.074 1.00 0.00 C ATOM 1260 C ALA A 104 1.232 -2.498 15.667 1.00 0.00 C ATOM 1261 O ALA A 104 0.030 -2.433 15.497 1.00 0.00 O ATOM 1262 CB ALA A 104 2.477 -1.217 17.423 1.00 0.00 C ATOM 0 H ALA A 104 3.789 -3.337 17.418 1.00 0.00 H new ATOM 0 HA ALA A 104 1.040 -2.776 17.793 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.724 -0.430 17.382 1.00 0.00 H new ATOM 0 HB2 ALA A 104 2.898 -1.265 18.427 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.270 -0.998 16.708 1.00 0.00 H new ATOM 1268 N TYR A 105 2.056 -2.519 14.657 1.00 0.00 N ATOM 1269 CA TYR A 105 1.535 -2.465 13.268 1.00 0.00 C ATOM 1270 C TYR A 105 0.787 -3.770 12.960 1.00 0.00 C ATOM 1271 O TYR A 105 -0.231 -3.771 12.296 1.00 0.00 O ATOM 1272 CB TYR A 105 2.724 -2.291 12.303 1.00 0.00 C ATOM 1273 CG TYR A 105 2.959 -0.824 12.013 1.00 0.00 C ATOM 1274 CD1 TYR A 105 2.284 -0.204 10.955 1.00 0.00 C ATOM 1275 CD2 TYR A 105 3.851 -0.087 12.801 1.00 0.00 C ATOM 1276 CE1 TYR A 105 2.500 1.152 10.684 1.00 0.00 C ATOM 1277 CE2 TYR A 105 4.068 1.270 12.530 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.392 1.889 11.472 1.00 0.00 C ATOM 1279 OH TYR A 105 3.606 3.226 11.206 1.00 0.00 O ATOM 0 H TYR A 105 3.072 -2.571 14.737 1.00 0.00 H new ATOM 0 HA TYR A 105 0.847 -1.628 13.150 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.621 -2.730 12.739 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.527 -2.825 11.373 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.596 -0.773 10.347 1.00 0.00 H new ATOM 0 HD2 TYR A 105 4.372 -0.565 13.618 1.00 0.00 H new ATOM 0 HE1 TYR A 105 1.979 1.630 9.867 1.00 0.00 H new ATOM 0 HE2 TYR A 105 4.757 1.839 13.137 1.00 0.00 H new ATOM 0 HH TYR A 105 4.253 3.588 11.847 1.00 0.00 H new ATOM 1289 N GLN A 106 1.285 -4.879 13.435 1.00 0.00 N ATOM 1290 CA GLN A 106 0.610 -6.173 13.170 1.00 0.00 C ATOM 1291 C GLN A 106 -0.731 -6.212 13.908 1.00 0.00 C ATOM 1292 O GLN A 106 -1.687 -6.804 13.447 1.00 0.00 O ATOM 1293 CB GLN A 106 1.500 -7.312 13.671 1.00 0.00 C ATOM 1294 CG GLN A 106 0.967 -8.645 13.139 1.00 0.00 C ATOM 1295 CD GLN A 106 1.521 -9.808 13.979 1.00 0.00 C ATOM 1296 OE1 GLN A 106 2.363 -10.550 13.514 1.00 0.00 O ATOM 1297 NE2 GLN A 106 1.090 -10.010 15.203 1.00 0.00 N ATOM 0 H GLN A 106 2.134 -4.941 13.997 1.00 0.00 H new ATOM 0 HA GLN A 106 0.436 -6.284 12.100 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.527 -7.159 13.338 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.516 -7.323 14.761 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.123 -8.649 13.172 1.00 0.00 H new ATOM 0 HG3 GLN A 106 1.255 -8.770 12.095 1.00 0.00 H new ATOM 0 HE21 GLN A 106 0.383 -9.393 15.603 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.462 -10.784 15.753 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.804 -5.594 15.054 1.00 0.00 N ATOM 1307 CA GLN A 107 -2.077 -5.601 15.829 1.00 0.00 C ATOM 1308 C GLN A 107 -3.109 -4.695 15.150 1.00 0.00 C ATOM 1309 O GLN A 107 -4.284 -5.004 15.107 1.00 0.00 O ATOM 1310 CB GLN A 107 -1.805 -5.096 17.251 1.00 0.00 C ATOM 1311 CG GLN A 107 -3.116 -5.065 18.051 1.00 0.00 C ATOM 1312 CD GLN A 107 -2.814 -5.119 19.553 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -1.814 -4.597 20.003 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -3.644 -5.737 20.349 1.00 0.00 N ATOM 0 H GLN A 107 -0.035 -5.083 15.488 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.470 -6.617 15.868 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.082 -5.745 17.745 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -1.366 -4.099 17.215 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.674 -4.159 17.816 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -3.745 -5.909 17.767 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.484 -6.175 19.970 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.453 -5.782 21.350 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.685 -3.578 14.626 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.649 -2.655 13.959 1.00 0.00 C ATOM 1325 C LEU A 108 -4.018 -3.199 12.575 1.00 0.00 C ATOM 1326 O LEU A 108 -4.676 -2.540 11.794 1.00 0.00 O ATOM 1327 CB LEU A 108 -3.008 -1.271 13.815 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.826 -0.634 15.204 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -2.030 0.672 15.066 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -4.200 -0.346 15.847 1.00 0.00 C ATOM 0 H LEU A 108 -1.715 -3.264 14.630 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.553 -2.578 14.563 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.043 -1.357 13.315 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.634 -0.633 13.191 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.281 -1.327 15.845 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.900 1.125 16.049 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.053 0.458 14.633 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.571 1.361 14.418 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -4.055 0.104 16.829 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.762 0.340 15.213 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.754 -1.278 15.954 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.610 -4.400 12.272 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.944 -5.000 10.947 1.00 0.00 C ATOM 1344 C GLN A 109 -3.707 -3.977 9.827 1.00 0.00 C ATOM 1345 O GLN A 109 -4.611 -3.624 9.095 1.00 0.00 O ATOM 1346 CB GLN A 109 -5.417 -5.443 10.951 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.631 -6.576 9.939 1.00 0.00 C ATOM 1348 CD GLN A 109 -5.323 -6.072 8.528 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -4.221 -6.232 8.041 1.00 0.00 O ATOM 1350 NE2 GLN A 109 -6.256 -5.465 7.847 1.00 0.00 N ATOM 0 H GLN A 109 -3.057 -4.996 12.888 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.303 -5.863 10.769 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.701 -5.778 11.949 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -6.059 -4.598 10.703 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -4.987 -7.421 10.183 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -6.659 -6.934 9.991 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -7.181 -5.331 8.256 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -6.061 -5.125 6.906 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.497 -3.508 9.679 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.195 -2.524 8.600 1.00 0.00 C ATOM 1361 C ARG A 110 -1.710 -3.284 7.370 1.00 0.00 C ATOM 1362 O ARG A 110 -1.316 -4.428 7.456 1.00 0.00 O ATOM 1363 CB ARG A 110 -1.096 -1.572 9.075 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.590 -0.781 10.294 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.669 0.232 9.879 1.00 0.00 C ATOM 1366 NE ARG A 110 -2.725 1.330 10.885 1.00 0.00 N ATOM 1367 CZ ARG A 110 -3.775 2.102 10.950 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -4.776 1.912 10.135 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -3.824 3.064 11.831 1.00 0.00 N ATOM 0 H ARG A 110 -1.701 -3.766 10.262 1.00 0.00 H new ATOM 0 HA ARG A 110 -3.089 -1.950 8.356 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.200 -2.136 9.334 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.822 -0.888 8.272 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -1.994 -1.466 11.040 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.754 -0.260 10.760 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -2.443 0.638 8.893 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -3.639 -0.261 9.807 1.00 0.00 H new ATOM 0 HE ARG A 110 -1.943 1.478 11.523 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -4.738 1.160 9.447 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -5.597 2.515 10.186 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.042 3.212 12.468 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -4.645 3.668 11.882 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.744 -2.665 6.226 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.285 -3.362 4.989 1.00 0.00 C ATOM 1385 C GLU A 111 0.245 -3.279 4.881 1.00 0.00 C ATOM 1386 O GLU A 111 0.899 -4.246 4.534 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.928 -2.706 3.760 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.388 -3.154 3.647 1.00 0.00 C ATOM 1389 CD GLU A 111 -4.169 -2.663 4.867 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -3.952 -1.531 5.269 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -4.971 -3.426 5.379 1.00 0.00 O ATOM 0 H GLU A 111 -2.069 -1.708 6.091 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.582 -4.410 5.036 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.875 -1.621 3.844 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.381 -2.983 2.859 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.832 -2.757 2.734 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.442 -4.241 3.581 1.00 0.00 H new ATOM 1398 N THR A 112 0.827 -2.134 5.163 1.00 0.00 N ATOM 1399 CA THR A 112 2.317 -1.992 5.062 1.00 0.00 C ATOM 1400 C THR A 112 2.855 -1.249 6.281 1.00 0.00 C ATOM 1401 O THR A 112 2.107 -0.810 7.133 1.00 0.00 O ATOM 1402 CB THR A 112 2.658 -1.178 3.810 1.00 0.00 C ATOM 1403 OG1 THR A 112 1.924 0.038 3.835 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.296 -1.962 2.538 1.00 0.00 C ATOM 0 H THR A 112 0.333 -1.292 5.459 1.00 0.00 H new ATOM 0 HA THR A 112 2.766 -2.984 5.009 1.00 0.00 H new ATOM 0 HB THR A 112 3.729 -0.974 3.802 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.878 0.411 2.930 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.546 -1.366 1.660 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.857 -2.896 2.514 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.228 -2.180 2.536 1.00 0.00 H new ATOM 1412 N ILE A 113 4.156 -1.095 6.360 1.00 0.00 N ATOM 1413 CA ILE A 113 4.766 -0.361 7.522 1.00 0.00 C ATOM 1414 C ILE A 113 5.898 0.558 7.022 1.00 0.00 C ATOM 1415 O ILE A 113 6.661 0.159 6.165 1.00 0.00 O ATOM 1416 CB ILE A 113 5.361 -1.362 8.519 1.00 0.00 C ATOM 1417 CG1 ILE A 113 5.763 -0.611 9.792 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.605 -2.033 7.917 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.191 -1.608 10.872 1.00 0.00 C ATOM 0 H ILE A 113 4.823 -1.444 5.672 1.00 0.00 H new ATOM 0 HA ILE A 113 3.989 0.230 8.006 1.00 0.00 H new ATOM 0 HB ILE A 113 4.620 -2.128 8.748 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.580 0.077 9.576 1.00 0.00 H new ATOM 0 HG13 ILE A 113 4.927 -0.011 10.150 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.019 -2.742 8.634 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.328 -2.560 7.004 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.352 -1.274 7.685 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.476 -1.067 11.774 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.362 -2.279 11.097 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.041 -2.189 10.514 1.00 0.00 H new ATOM 1431 N PRO A 114 6.059 1.762 7.554 1.00 0.00 N ATOM 1432 CA PRO A 114 7.176 2.648 7.114 1.00 0.00 C ATOM 1433 C PRO A 114 8.527 2.077 7.562 1.00 0.00 C ATOM 1434 O PRO A 114 8.705 1.710 8.707 1.00 0.00 O ATOM 1435 CB PRO A 114 6.897 4.006 7.801 1.00 0.00 C ATOM 1436 CG PRO A 114 5.501 3.908 8.341 1.00 0.00 C ATOM 1437 CD PRO A 114 5.241 2.424 8.595 1.00 0.00 C ATOM 0 HA PRO A 114 7.227 2.741 6.029 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.614 4.195 8.600 1.00 0.00 H new ATOM 0 HB3 PRO A 114 6.986 4.829 7.092 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.399 4.483 9.261 1.00 0.00 H new ATOM 0 HG3 PRO A 114 4.780 4.313 7.630 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.546 2.126 9.598 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.184 2.176 8.496 1.00 0.00 H new ATOM 1445 N ALA A 115 9.474 1.994 6.674 1.00 0.00 N ATOM 1446 CA ALA A 115 10.807 1.440 7.052 1.00 0.00 C ATOM 1447 C ALA A 115 11.900 2.076 6.193 1.00 0.00 C ATOM 1448 O ALA A 115 11.814 2.114 4.980 1.00 0.00 O ATOM 1449 CB ALA A 115 10.810 -0.075 6.835 1.00 0.00 C ATOM 0 H ALA A 115 9.386 2.285 5.701 1.00 0.00 H new ATOM 0 HA ALA A 115 11.000 1.662 8.101 1.00 0.00 H new ATOM 0 HB1 ALA A 115 11.784 -0.480 7.111 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.038 -0.533 7.453 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.611 -0.293 5.786 1.00 0.00 H new ATOM 1455 N LYS A 116 12.930 2.570 6.821 1.00 0.00 N ATOM 1456 CA LYS A 116 14.047 3.198 6.065 1.00 0.00 C ATOM 1457 C LYS A 116 14.829 2.106 5.324 1.00 0.00 C ATOM 1458 O LYS A 116 15.421 1.238 5.935 1.00 0.00 O ATOM 1459 CB LYS A 116 14.977 3.917 7.062 1.00 0.00 C ATOM 1460 CG LYS A 116 14.478 5.347 7.303 1.00 0.00 C ATOM 1461 CD LYS A 116 15.151 5.924 8.552 1.00 0.00 C ATOM 1462 CE LYS A 116 16.658 6.050 8.314 1.00 0.00 C ATOM 1463 NZ LYS A 116 17.249 6.951 9.343 1.00 0.00 N ATOM 0 H LYS A 116 13.046 2.565 7.834 1.00 0.00 H new ATOM 0 HA LYS A 116 13.657 3.915 5.343 1.00 0.00 H new ATOM 0 HB2 LYS A 116 15.007 3.370 8.004 1.00 0.00 H new ATOM 0 HB3 LYS A 116 15.995 3.938 6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 116 14.700 5.971 6.437 1.00 0.00 H new ATOM 0 HG3 LYS A 116 13.395 5.349 7.428 1.00 0.00 H new ATOM 0 HD2 LYS A 116 14.727 6.900 8.787 1.00 0.00 H new ATOM 0 HD3 LYS A 116 14.961 5.279 9.410 1.00 0.00 H new ATOM 0 HE2 LYS A 116 17.128 5.068 8.362 1.00 0.00 H new ATOM 0 HE3 LYS A 116 16.848 6.446 7.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 18.273 7.037 9.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 16.808 7.890 9.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 17.079 6.555 10.290 1.00 0.00 H new ATOM 1477 N LEU A 117 14.847 2.140 4.016 1.00 0.00 N ATOM 1478 CA LEU A 117 15.607 1.096 3.261 1.00 0.00 C ATOM 1479 C LEU A 117 17.080 1.500 3.177 1.00 0.00 C ATOM 1480 O LEU A 117 17.409 2.644 2.932 1.00 0.00 O ATOM 1481 CB LEU A 117 15.055 0.948 1.837 1.00 0.00 C ATOM 1482 CG LEU A 117 13.547 0.646 1.858 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.075 0.347 0.428 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.257 -0.570 2.749 1.00 0.00 C ATOM 0 H LEU A 117 14.374 2.838 3.442 1.00 0.00 H new ATOM 0 HA LEU A 117 15.503 0.146 3.786 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.238 1.864 1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.583 0.146 1.320 1.00 0.00 H new ATOM 0 HG LEU A 117 13.017 1.511 2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.006 0.132 0.435 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.267 1.212 -0.207 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.616 -0.516 0.039 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.186 -0.771 2.753 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.788 -1.440 2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.592 -0.364 3.766 1.00 0.00 H new ATOM 1496 N VAL A 118 17.969 0.560 3.375 1.00 0.00 N ATOM 1497 CA VAL A 118 19.433 0.861 3.306 1.00 0.00 C ATOM 1498 C VAL A 118 20.137 -0.264 2.546 1.00 0.00 C ATOM 1499 O VAL A 118 20.220 -1.383 3.013 1.00 0.00 O ATOM 1500 CB VAL A 118 20.001 0.950 4.726 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.488 1.311 4.666 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.247 2.025 5.510 1.00 0.00 C ATOM 0 H VAL A 118 17.742 -0.412 3.583 1.00 0.00 H new ATOM 0 HA VAL A 118 19.592 1.809 2.792 1.00 0.00 H new ATOM 0 HB VAL A 118 19.884 -0.013 5.222 1.00 0.00 H new ATOM 0 HG11 VAL A 118 21.888 1.373 5.678 1.00 0.00 H new ATOM 0 HG12 VAL A 118 22.026 0.544 4.109 1.00 0.00 H new ATOM 0 HG13 VAL A 118 21.609 2.273 4.168 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.651 2.089 6.520 1.00 0.00 H new ATOM 0 HG22 VAL A 118 19.363 2.987 5.012 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.189 1.766 5.558 1.00 0.00 H new ATOM 1512 N GLN A 119 20.642 0.019 1.375 1.00 0.00 N ATOM 1513 CA GLN A 119 21.335 -1.041 0.589 1.00 0.00 C ATOM 1514 C GLN A 119 22.343 -1.763 1.485 1.00 0.00 C ATOM 1515 O GLN A 119 23.034 -1.152 2.276 1.00 0.00 O ATOM 1516 CB GLN A 119 22.077 -0.410 -0.595 1.00 0.00 C ATOM 1517 CG GLN A 119 21.065 0.148 -1.597 1.00 0.00 C ATOM 1518 CD GLN A 119 20.411 1.401 -1.008 1.00 0.00 C ATOM 1519 OE1 GLN A 119 21.074 2.212 -0.392 1.00 0.00 O ATOM 1520 NE2 GLN A 119 19.131 1.597 -1.170 1.00 0.00 N ATOM 0 H GLN A 119 20.605 0.936 0.930 1.00 0.00 H new ATOM 0 HA GLN A 119 20.596 -1.751 0.217 1.00 0.00 H new ATOM 0 HB2 GLN A 119 22.733 0.387 -0.243 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.710 -1.154 -1.078 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.561 0.390 -2.537 1.00 0.00 H new ATOM 0 HG3 GLN A 119 20.306 -0.602 -1.821 1.00 0.00 H new ATOM 0 HE21 GLN A 119 18.572 0.918 -1.687 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.689 2.429 -0.780 1.00 0.00 H new ATOM 1529 N SER A 120 22.431 -3.062 1.369 1.00 0.00 N ATOM 1530 CA SER A 120 23.393 -3.836 2.212 1.00 0.00 C ATOM 1531 C SER A 120 24.006 -4.965 1.379 1.00 0.00 C ATOM 1532 O SER A 120 23.715 -5.113 0.208 1.00 0.00 O ATOM 1533 CB SER A 120 22.647 -4.424 3.413 1.00 0.00 C ATOM 1534 OG SER A 120 22.486 -3.422 4.405 1.00 0.00 O ATOM 0 H SER A 120 21.876 -3.624 0.724 1.00 0.00 H new ATOM 0 HA SER A 120 24.188 -3.179 2.564 1.00 0.00 H new ATOM 0 HB2 SER A 120 21.673 -4.802 3.101 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.201 -5.269 3.821 1.00 0.00 H new ATOM 0 HG SER A 120 22.737 -2.551 4.033 1.00 0.00 H new ATOM 1540 N THR A 121 24.860 -5.759 1.978 1.00 0.00 N ATOM 1541 CA THR A 121 25.514 -6.886 1.243 1.00 0.00 C ATOM 1542 C THR A 121 25.350 -8.182 2.042 1.00 0.00 C ATOM 1543 O THR A 121 25.081 -8.169 3.231 1.00 0.00 O ATOM 1544 CB THR A 121 27.005 -6.575 1.079 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.517 -6.067 2.303 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.195 -5.536 -0.027 1.00 0.00 C ATOM 0 H THR A 121 25.135 -5.673 2.957 1.00 0.00 H new ATOM 0 HA THR A 121 25.050 -7.005 0.264 1.00 0.00 H new ATOM 0 HB THR A 121 27.539 -7.487 0.811 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.471 -5.869 2.201 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.257 -5.317 -0.142 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.802 -5.927 -0.965 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.662 -4.622 0.237 1.00 0.00 H new ATOM 1554 N LEU A 122 25.505 -9.306 1.397 1.00 0.00 N ATOM 1555 CA LEU A 122 25.349 -10.599 2.124 1.00 0.00 C ATOM 1556 C LEU A 122 26.298 -10.629 3.331 1.00 0.00 C ATOM 1557 O LEU A 122 25.970 -11.167 4.369 1.00 0.00 O ATOM 1558 CB LEU A 122 25.657 -11.774 1.183 1.00 0.00 C ATOM 1559 CG LEU A 122 25.257 -13.107 1.844 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.723 -13.219 1.957 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.787 -14.266 0.994 1.00 0.00 C ATOM 0 H LEU A 122 25.731 -9.386 0.406 1.00 0.00 H new ATOM 0 HA LEU A 122 24.321 -10.691 2.474 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.116 -11.649 0.245 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.719 -11.785 0.940 1.00 0.00 H new ATOM 0 HG LEU A 122 25.685 -13.147 2.846 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.461 -14.167 2.426 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.342 -12.397 2.563 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.280 -13.172 0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.508 -15.213 1.456 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.358 -14.209 -0.006 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.873 -14.201 0.927 1.00 0.00 H new ATOM 1573 N SER A 123 27.467 -10.051 3.213 1.00 0.00 N ATOM 1574 CA SER A 123 28.413 -10.050 4.365 1.00 0.00 C ATOM 1575 C SER A 123 27.703 -9.477 5.593 1.00 0.00 C ATOM 1576 O SER A 123 27.785 -10.019 6.677 1.00 0.00 O ATOM 1577 CB SER A 123 29.629 -9.186 4.027 1.00 0.00 C ATOM 1578 OG SER A 123 30.549 -9.220 5.108 1.00 0.00 O ATOM 0 H SER A 123 27.804 -9.582 2.372 1.00 0.00 H new ATOM 0 HA SER A 123 28.742 -11.068 4.572 1.00 0.00 H new ATOM 0 HB2 SER A 123 30.106 -9.551 3.118 1.00 0.00 H new ATOM 0 HB3 SER A 123 29.317 -8.160 3.833 1.00 0.00 H new ATOM 0 HG SER A 123 31.329 -8.668 4.891 1.00 0.00 H new ATOM 1584 N ASP A 124 26.997 -8.390 5.431 1.00 0.00 N ATOM 1585 CA ASP A 124 26.275 -7.797 6.591 1.00 0.00 C ATOM 1586 C ASP A 124 25.365 -8.869 7.201 1.00 0.00 C ATOM 1587 O ASP A 124 25.255 -9.003 8.409 1.00 0.00 O ATOM 1588 CB ASP A 124 25.426 -6.610 6.120 1.00 0.00 C ATOM 1589 CG ASP A 124 24.896 -5.849 7.337 1.00 0.00 C ATOM 1590 OD1 ASP A 124 25.706 -5.300 8.066 1.00 0.00 O ATOM 1591 OD2 ASP A 124 23.690 -5.829 7.519 1.00 0.00 O ATOM 0 H ASP A 124 26.890 -7.890 4.549 1.00 0.00 H new ATOM 0 HA ASP A 124 26.991 -7.447 7.335 1.00 0.00 H new ATOM 0 HB2 ASP A 124 26.024 -5.947 5.495 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.596 -6.963 5.508 1.00 0.00 H new ATOM 1596 N LEU A 125 24.710 -9.643 6.373 1.00 0.00 N ATOM 1597 CA LEU A 125 23.812 -10.698 6.915 1.00 0.00 C ATOM 1598 C LEU A 125 24.654 -11.735 7.674 1.00 0.00 C ATOM 1599 O LEU A 125 24.210 -12.308 8.644 1.00 0.00 O ATOM 1600 CB LEU A 125 23.014 -11.359 5.761 1.00 0.00 C ATOM 1601 CG LEU A 125 21.556 -11.621 6.188 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.803 -10.289 6.408 1.00 0.00 C ATOM 1603 CD2 LEU A 125 20.859 -12.439 5.099 1.00 0.00 C ATOM 0 H LEU A 125 24.759 -9.589 5.356 1.00 0.00 H new ATOM 0 HA LEU A 125 23.095 -10.257 7.607 1.00 0.00 H new ATOM 0 HB2 LEU A 125 23.031 -10.713 4.884 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.489 -12.297 5.475 1.00 0.00 H new ATOM 0 HG LEU A 125 21.553 -12.173 7.128 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.776 -10.497 6.709 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.301 -9.714 7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.801 -9.715 5.481 1.00 0.00 H new ATOM 0 HD21 LEU A 125 19.827 -12.630 5.392 1.00 0.00 H new ATOM 0 HD22 LEU A 125 20.874 -11.884 4.161 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.380 -13.387 4.967 1.00 0.00 H new ATOM 1615 N ARG A 126 25.871 -11.970 7.254 1.00 0.00 N ATOM 1616 CA ARG A 126 26.729 -12.955 7.976 1.00 0.00 C ATOM 1617 C ARG A 126 26.997 -12.443 9.393 1.00 0.00 C ATOM 1618 O ARG A 126 27.078 -13.208 10.333 1.00 0.00 O ATOM 1619 CB ARG A 126 28.056 -13.109 7.224 1.00 0.00 C ATOM 1620 CG ARG A 126 28.852 -14.290 7.796 1.00 0.00 C ATOM 1621 CD ARG A 126 30.328 -14.152 7.413 1.00 0.00 C ATOM 1622 NE ARG A 126 31.020 -15.454 7.628 1.00 0.00 N ATOM 1623 CZ ARG A 126 32.172 -15.683 7.058 1.00 0.00 C ATOM 1624 NH1 ARG A 126 32.718 -14.771 6.301 1.00 0.00 N ATOM 1625 NH2 ARG A 126 32.778 -16.823 7.247 1.00 0.00 N ATOM 0 H ARG A 126 26.305 -11.524 6.446 1.00 0.00 H new ATOM 0 HA ARG A 126 26.226 -13.921 8.028 1.00 0.00 H new ATOM 0 HB2 ARG A 126 27.865 -13.269 6.163 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.639 -12.192 7.308 1.00 0.00 H new ATOM 0 HG2 ARG A 126 28.749 -14.319 8.881 1.00 0.00 H new ATOM 0 HG3 ARG A 126 28.453 -15.229 7.413 1.00 0.00 H new ATOM 0 HD2 ARG A 126 30.417 -13.848 6.370 1.00 0.00 H new ATOM 0 HD3 ARG A 126 30.799 -13.374 8.013 1.00 0.00 H new ATOM 0 HE ARG A 126 30.594 -16.166 8.221 1.00 0.00 H new ATOM 0 HH11 ARG A 126 32.245 -13.879 6.155 1.00 0.00 H new ATOM 0 HH12 ARG A 126 33.618 -14.950 5.856 1.00 0.00 H new ATOM 0 HH21 ARG A 126 32.352 -17.535 7.840 1.00 0.00 H new ATOM 0 HH22 ARG A 126 33.678 -17.002 6.802 1.00 0.00 H new ATOM 1639 N VAL A 127 27.124 -11.154 9.559 1.00 0.00 N ATOM 1640 CA VAL A 127 27.372 -10.604 10.917 1.00 0.00 C ATOM 1641 C VAL A 127 26.201 -10.991 11.822 1.00 0.00 C ATOM 1642 O VAL A 127 26.370 -11.245 12.998 1.00 0.00 O ATOM 1643 CB VAL A 127 27.482 -9.080 10.845 1.00 0.00 C ATOM 1644 CG1 VAL A 127 27.732 -8.523 12.246 1.00 0.00 C ATOM 1645 CG2 VAL A 127 28.650 -8.698 9.936 1.00 0.00 C ATOM 0 H VAL A 127 27.066 -10.461 8.813 1.00 0.00 H new ATOM 0 HA VAL A 127 28.302 -11.008 11.316 1.00 0.00 H new ATOM 0 HB VAL A 127 26.556 -8.667 10.446 1.00 0.00 H new ATOM 0 HG11 VAL A 127 27.811 -7.437 12.197 1.00 0.00 H new ATOM 0 HG12 VAL A 127 26.904 -8.798 12.900 1.00 0.00 H new ATOM 0 HG13 VAL A 127 28.660 -8.937 12.642 1.00 0.00 H new ATOM 0 HG21 VAL A 127 28.730 -7.612 9.883 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.575 -9.111 10.339 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.479 -9.098 8.937 1.00 0.00 H new ATOM 1655 N TYR A 128 25.006 -11.033 11.282 1.00 0.00 N ATOM 1656 CA TYR A 128 23.818 -11.401 12.120 1.00 0.00 C ATOM 1657 C TYR A 128 23.583 -12.915 12.090 1.00 0.00 C ATOM 1658 O TYR A 128 23.355 -13.537 13.109 1.00 0.00 O ATOM 1659 CB TYR A 128 22.561 -10.720 11.571 1.00 0.00 C ATOM 1660 CG TYR A 128 22.684 -9.220 11.673 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.434 -8.576 12.891 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.034 -8.471 10.545 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.535 -7.183 12.979 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.136 -7.079 10.633 1.00 0.00 C ATOM 1665 CZ TYR A 128 22.886 -6.434 11.850 1.00 0.00 C ATOM 1666 OH TYR A 128 22.986 -5.060 11.936 1.00 0.00 O ATOM 0 H TYR A 128 24.802 -10.830 10.304 1.00 0.00 H new ATOM 0 HA TYR A 128 24.016 -11.076 13.141 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.409 -11.008 10.531 1.00 0.00 H new ATOM 0 HB3 TYR A 128 21.686 -11.057 12.126 1.00 0.00 H new ATOM 0 HD1 TYR A 128 22.163 -9.154 13.762 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.226 -8.968 9.605 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.342 -6.686 13.918 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.408 -6.501 9.762 1.00 0.00 H new ATOM 0 HH TYR A 128 23.240 -4.695 11.063 1.00 0.00 H new ATOM 1676 N LEU A 129 23.601 -13.503 10.920 1.00 0.00 N ATOM 1677 CA LEU A 129 23.342 -14.966 10.783 1.00 0.00 C ATOM 1678 C LEU A 129 24.568 -15.664 10.199 1.00 0.00 C ATOM 1679 O LEU A 129 24.456 -16.461 9.294 1.00 0.00 O ATOM 1680 CB LEU A 129 22.187 -15.158 9.807 1.00 0.00 C ATOM 1681 CG LEU A 129 20.920 -14.444 10.300 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.766 -14.776 9.343 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.562 -14.897 11.725 1.00 0.00 C ATOM 0 H LEU A 129 23.788 -13.021 10.040 1.00 0.00 H new ATOM 0 HA LEU A 129 23.112 -15.384 11.763 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.467 -14.772 8.827 1.00 0.00 H new ATOM 0 HB3 LEU A 129 21.984 -16.222 9.684 1.00 0.00 H new ATOM 0 HG LEU A 129 21.096 -13.368 10.319 1.00 0.00 H new ATOM 0 HD11 LEU A 129 18.858 -14.276 9.680 1.00 0.00 H new ATOM 0 HD12 LEU A 129 20.017 -14.435 8.339 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.603 -15.854 9.330 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.662 -14.380 12.056 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.385 -15.973 11.731 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.385 -14.660 12.400 1.00 0.00 H new ATOM 1695 N GLY A 130 25.730 -15.369 10.696 1.00 0.00 N ATOM 1696 CA GLY A 130 26.959 -16.018 10.157 1.00 0.00 C ATOM 1697 C GLY A 130 26.927 -17.532 10.424 1.00 0.00 C ATOM 1698 O GLY A 130 27.938 -18.131 10.731 1.00 0.00 O ATOM 0 H GLY A 130 25.887 -14.705 11.454 1.00 0.00 H new ATOM 0 HA2 GLY A 130 27.036 -15.833 9.086 1.00 0.00 H new ATOM 0 HA3 GLY A 130 27.843 -15.579 10.620 1.00 0.00 H new ATOM 1702 N ALA A 131 25.783 -18.161 10.304 1.00 0.00 N ATOM 1703 CA ALA A 131 25.710 -19.632 10.546 1.00 0.00 C ATOM 1704 C ALA A 131 24.514 -20.217 9.785 1.00 0.00 C ATOM 1705 O ALA A 131 24.658 -21.136 9.003 1.00 0.00 O ATOM 1706 CB ALA A 131 25.554 -19.898 12.047 1.00 0.00 C ATOM 0 H ALA A 131 24.900 -17.719 10.049 1.00 0.00 H new ATOM 0 HA ALA A 131 26.626 -20.106 10.193 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.501 -20.972 12.223 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.410 -19.485 12.581 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.640 -19.426 12.407 1.00 0.00 H new ATOM 1712 N SER A 132 23.334 -19.692 10.005 1.00 0.00 N ATOM 1713 CA SER A 132 22.125 -20.217 9.293 1.00 0.00 C ATOM 1714 C SER A 132 21.789 -19.297 8.117 1.00 0.00 C ATOM 1715 O SER A 132 20.637 -19.075 7.801 1.00 0.00 O ATOM 1716 CB SER A 132 20.943 -20.249 10.263 1.00 0.00 C ATOM 1717 OG SER A 132 21.162 -21.251 11.245 1.00 0.00 O ATOM 0 H SER A 132 23.154 -18.921 10.648 1.00 0.00 H new ATOM 0 HA SER A 132 22.325 -21.223 8.924 1.00 0.00 H new ATOM 0 HB2 SER A 132 20.825 -19.276 10.741 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.020 -20.452 9.721 1.00 0.00 H new ATOM 0 HG SER A 132 20.405 -21.270 11.867 1.00 0.00 H new ATOM 1723 N THR A 133 22.785 -18.754 7.472 1.00 0.00 N ATOM 1724 CA THR A 133 22.522 -17.840 6.323 1.00 0.00 C ATOM 1725 C THR A 133 22.106 -18.673 5.083 1.00 0.00 C ATOM 1726 O THR A 133 22.897 -19.447 4.582 1.00 0.00 O ATOM 1727 CB THR A 133 23.821 -17.055 6.005 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.723 -17.190 7.091 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.517 -15.568 5.782 1.00 0.00 C ATOM 0 H THR A 133 23.770 -18.903 7.691 1.00 0.00 H new ATOM 0 HA THR A 133 21.719 -17.147 6.575 1.00 0.00 H new ATOM 0 HB THR A 133 24.262 -17.461 5.095 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.369 -16.715 7.871 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.443 -15.037 5.560 1.00 0.00 H new ATOM 0 HG22 THR A 133 22.827 -15.459 4.945 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.065 -15.150 6.682 1.00 0.00 H new ATOM 1737 N PRO A 134 20.901 -18.518 4.568 1.00 0.00 N ATOM 1738 CA PRO A 134 20.461 -19.279 3.362 1.00 0.00 C ATOM 1739 C PRO A 134 21.091 -18.726 2.079 1.00 0.00 C ATOM 1740 O PRO A 134 21.876 -17.799 2.107 1.00 0.00 O ATOM 1741 CB PRO A 134 18.934 -19.108 3.347 1.00 0.00 C ATOM 1742 CG PRO A 134 18.669 -17.830 4.085 1.00 0.00 C ATOM 1743 CD PRO A 134 19.836 -17.626 5.064 1.00 0.00 C ATOM 0 HA PRO A 134 20.767 -20.324 3.403 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.554 -19.058 2.326 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.440 -19.951 3.830 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.596 -16.992 3.392 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.721 -17.883 4.621 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.164 -16.587 5.078 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.547 -17.883 6.083 1.00 0.00 H new ATOM 1751 N ASP A 135 20.743 -19.294 0.956 1.00 0.00 N ATOM 1752 CA ASP A 135 21.300 -18.825 -0.349 1.00 0.00 C ATOM 1753 C ASP A 135 20.233 -18.008 -1.074 1.00 0.00 C ATOM 1754 O ASP A 135 19.165 -18.495 -1.389 1.00 0.00 O ATOM 1755 CB ASP A 135 21.681 -20.037 -1.201 1.00 0.00 C ATOM 1756 CG ASP A 135 22.556 -19.584 -2.373 1.00 0.00 C ATOM 1757 OD1 ASP A 135 23.332 -18.661 -2.185 1.00 0.00 O ATOM 1758 OD2 ASP A 135 22.435 -20.168 -3.437 1.00 0.00 O ATOM 0 H ASP A 135 20.088 -20.073 0.885 1.00 0.00 H new ATOM 0 HA ASP A 135 22.184 -18.211 -0.179 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.217 -20.767 -0.594 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.783 -20.530 -1.573 1.00 0.00 H new ATOM 1763 N LEU A 136 20.513 -16.766 -1.327 1.00 0.00 N ATOM 1764 CA LEU A 136 19.519 -15.895 -2.018 1.00 0.00 C ATOM 1765 C LEU A 136 19.566 -16.124 -3.531 1.00 0.00 C ATOM 1766 O LEU A 136 20.620 -16.233 -4.124 1.00 0.00 O ATOM 1767 CB LEU A 136 19.839 -14.430 -1.723 1.00 0.00 C ATOM 1768 CG LEU A 136 19.750 -14.159 -0.216 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.137 -12.700 0.045 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.319 -14.414 0.286 1.00 0.00 C ATOM 0 H LEU A 136 21.392 -16.309 -1.085 1.00 0.00 H new ATOM 0 HA LEU A 136 18.522 -16.142 -1.653 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.839 -14.189 -2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.143 -13.784 -2.257 1.00 0.00 H new ATOM 0 HG LEU A 136 20.428 -14.826 0.316 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.078 -12.493 1.114 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.155 -12.526 -0.303 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.453 -12.041 -0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.269 -14.218 1.357 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.627 -13.753 -0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 136 18.045 -15.451 0.094 1.00 0.00 H new ATOM 1782 N GLN A 137 18.414 -16.186 -4.153 1.00 0.00 N ATOM 1783 CA GLN A 137 18.339 -16.397 -5.632 1.00 0.00 C ATOM 1784 C GLN A 137 17.427 -15.330 -6.247 1.00 0.00 C ATOM 1785 O GLN A 137 17.755 -14.161 -6.131 1.00 0.00 O ATOM 1786 CB GLN A 137 17.764 -17.790 -5.915 1.00 0.00 C ATOM 1787 CG GLN A 137 18.376 -18.805 -4.948 1.00 0.00 C ATOM 1788 CD GLN A 137 19.904 -18.760 -5.060 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.444 -18.833 -6.145 1.00 0.00 O ATOM 1790 NE2 GLN A 137 20.630 -18.643 -3.979 1.00 0.00 N ATOM 1791 OXT GLN A 137 16.417 -15.700 -6.824 1.00 0.00 O ATOM 0 H GLN A 137 17.509 -16.098 -3.691 1.00 0.00 H new ATOM 0 HA GLN A 137 19.335 -16.320 -6.068 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.680 -17.776 -5.805 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.976 -18.080 -6.944 1.00 0.00 H new ATOM 0 HG2 GLN A 137 18.069 -18.581 -3.926 1.00 0.00 H new ATOM 0 HG3 GLN A 137 18.013 -19.807 -5.178 1.00 0.00 H new ATOM 0 HE21 GLN A 137 20.179 -18.581 -3.066 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.647 -18.613 -4.049 1.00 0.00 H new