USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 LYS NZ :NH3+ -176:sc= 0.167 (180deg=0) USER MOD Set 1.2: A 99 THR OG1 : rot -110:sc= 0.163 USER MOD Single : A 24 GLN : amide:sc= -2.1 K(o=-2.1,f=-4.1!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -2.48! C(o=-2.5!,f=-10!) USER MOD Single : A 34 SER OG : rot -90:sc= 1.22 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -134:sc= -0.459 (180deg=-2.06!) USER MOD Single : A 46 ASN : amide:sc= -0.116 K(o=-0.12,f=-0.77) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -150:sc= -1.05 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 76:sc= 0.31 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HE2:sc= -2.97! K(o=-3!,f=-3.5) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN :FLIP amide:sc=-0.00438 F(o=-0.63,f=-0.0044) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 84 ASN :FLIP amide:sc= -2.45! C(o=-3.7!,f=-2.5!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -1.84 K(o=-1.8,f=-6.3!) USER MOD Single : A 94 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.24) USER MOD Single : A 97 MET CE :methyl 175:sc= -2.31! (180deg=-2.5!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -113:sc= -11! (180deg=-16.1!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -2.91! C(o=-2.9!,f=-3.4!) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN :FLIP amide:sc= -4.2! C(o=-4.9!,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 283 N GLU A 23 -1.774 15.757 -5.703 1.00 0.00 N ATOM 284 CA GLU A 23 -1.320 14.605 -6.464 1.00 0.00 C ATOM 285 C GLU A 23 -2.216 13.397 -6.184 1.00 0.00 C ATOM 286 O GLU A 23 -2.343 12.966 -5.038 1.00 0.00 O ATOM 287 CB GLU A 23 0.144 14.286 -6.153 1.00 0.00 C ATOM 288 CG GLU A 23 1.084 15.180 -6.965 1.00 0.00 C ATOM 289 CD GLU A 23 1.763 14.388 -8.084 1.00 0.00 C ATOM 290 OE1 GLU A 23 1.177 14.350 -9.188 1.00 0.00 O ATOM 291 OE2 GLU A 23 2.852 13.840 -7.811 1.00 0.00 O ATOM 0 HA GLU A 23 -1.388 14.845 -7.525 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.332 14.426 -5.089 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.348 13.239 -6.378 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.523 16.011 -7.392 1.00 0.00 H new ATOM 0 HG3 GLU A 23 1.840 15.610 -6.308 1.00 0.00 H new ATOM 298 N GLN A 24 -2.814 12.884 -7.249 1.00 0.00 N ATOM 299 CA GLN A 24 -3.694 11.734 -7.132 1.00 0.00 C ATOM 300 C GLN A 24 -3.246 10.624 -8.085 1.00 0.00 C ATOM 301 O GLN A 24 -2.749 10.900 -9.176 1.00 0.00 O ATOM 302 CB GLN A 24 -5.149 12.128 -7.394 1.00 0.00 C ATOM 303 CG GLN A 24 -6.006 10.896 -7.691 1.00 0.00 C ATOM 304 CD GLN A 24 -7.463 11.132 -7.290 1.00 0.00 C ATOM 305 OE1 GLN A 24 -7.772 11.914 -6.406 1.00 0.00 O ATOM 306 NE2 GLN A 24 -8.339 10.415 -7.987 1.00 0.00 N ATOM 0 H GLN A 24 -2.706 13.244 -8.197 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.633 11.356 -6.111 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.549 12.653 -6.527 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.196 12.820 -8.235 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.951 10.658 -8.753 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -5.611 10.035 -7.151 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.013 9.778 -8.714 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -9.337 10.502 -7.795 1.00 0.00 H new ATOM 315 N LEU A 25 -3.439 9.391 -7.639 1.00 0.00 N ATOM 316 CA LEU A 25 -3.062 8.238 -8.439 1.00 0.00 C ATOM 317 C LEU A 25 -4.131 7.154 -8.299 1.00 0.00 C ATOM 318 O LEU A 25 -4.668 6.942 -7.212 1.00 0.00 O ATOM 319 CB LEU A 25 -1.655 7.766 -8.067 1.00 0.00 C ATOM 320 CG LEU A 25 -0.498 8.580 -8.651 1.00 0.00 C ATOM 321 CD1 LEU A 25 0.839 8.141 -8.050 1.00 0.00 C ATOM 322 CD2 LEU A 25 -0.491 8.505 -10.179 1.00 0.00 C ATOM 0 H LEU A 25 -3.852 9.166 -6.734 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.015 8.505 -9.495 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.566 7.773 -6.981 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.544 6.731 -8.389 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.645 9.626 -8.381 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.645 8.735 -8.482 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.818 8.288 -6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.008 7.087 -8.269 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.341 9.092 -10.568 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.380 7.467 -10.492 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.429 8.903 -10.567 1.00 0.00 H new ATOM 334 N THR A 26 -4.410 6.495 -9.414 1.00 0.00 N ATOM 335 CA THR A 26 -5.406 5.437 -9.429 1.00 0.00 C ATOM 336 C THR A 26 -4.789 4.130 -9.931 1.00 0.00 C ATOM 337 O THR A 26 -4.404 4.027 -11.095 1.00 0.00 O ATOM 338 CB THR A 26 -6.589 5.914 -10.275 1.00 0.00 C ATOM 339 OG1 THR A 26 -7.012 7.114 -9.634 1.00 0.00 O ATOM 340 CG2 THR A 26 -7.800 4.985 -10.163 1.00 0.00 C ATOM 0 H THR A 26 -3.964 6.673 -10.314 1.00 0.00 H new ATOM 0 HA THR A 26 -5.770 5.223 -8.424 1.00 0.00 H new ATOM 0 HB THR A 26 -6.283 5.988 -11.319 1.00 0.00 H new ATOM 0 HG1 THR A 26 -7.775 7.492 -10.118 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.611 5.368 -10.782 1.00 0.00 H new ATOM 0 HG22 THR A 26 -7.525 3.986 -10.503 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.127 4.938 -9.124 1.00 0.00 H new ATOM 348 N LEU A 27 -4.713 3.164 -9.027 1.00 0.00 N ATOM 349 CA LEU A 27 -4.149 1.868 -9.363 1.00 0.00 C ATOM 350 C LEU A 27 -5.262 0.819 -9.374 1.00 0.00 C ATOM 351 O LEU A 27 -6.167 0.861 -8.542 1.00 0.00 O ATOM 352 CB LEU A 27 -2.991 1.527 -8.422 1.00 0.00 C ATOM 353 CG LEU A 27 -1.742 2.400 -8.552 1.00 0.00 C ATOM 354 CD1 LEU A 27 -0.955 2.047 -9.816 1.00 0.00 C ATOM 355 CD2 LEU A 27 -2.103 3.886 -8.498 1.00 0.00 C ATOM 0 H LEU A 27 -5.033 3.253 -8.062 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.720 1.888 -10.365 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.351 1.594 -7.395 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.704 0.489 -8.592 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.093 2.195 -7.701 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.072 2.682 -9.884 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.648 1.002 -9.773 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.584 2.205 -10.692 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.197 4.484 -8.593 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.783 4.125 -9.316 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.587 4.109 -7.547 1.00 0.00 H new ATOM 367 N GLU A 28 -5.159 -0.098 -10.325 1.00 0.00 N ATOM 368 CA GLU A 28 -6.147 -1.156 -10.455 1.00 0.00 C ATOM 369 C GLU A 28 -5.529 -2.507 -10.087 1.00 0.00 C ATOM 370 O GLU A 28 -4.494 -2.889 -10.632 1.00 0.00 O ATOM 371 CB GLU A 28 -6.734 -1.188 -11.867 1.00 0.00 C ATOM 372 CG GLU A 28 -8.129 -0.560 -11.895 1.00 0.00 C ATOM 373 CD GLU A 28 -9.175 -1.525 -11.333 1.00 0.00 C ATOM 374 OE1 GLU A 28 -8.986 -1.955 -10.175 1.00 0.00 O ATOM 375 OE2 GLU A 28 -10.141 -1.809 -12.074 1.00 0.00 O ATOM 0 H GLU A 28 -4.407 -0.130 -11.013 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.964 -0.951 -9.763 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.076 -0.651 -12.551 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.788 -2.218 -12.219 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.129 0.361 -11.313 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.390 -0.290 -12.918 1.00 0.00 H new ATOM 382 N ILE A 29 -6.188 -3.192 -9.165 1.00 0.00 N ATOM 383 CA ILE A 29 -5.717 -4.491 -8.718 1.00 0.00 C ATOM 384 C ILE A 29 -6.817 -5.531 -8.938 1.00 0.00 C ATOM 385 O ILE A 29 -7.923 -5.389 -8.419 1.00 0.00 O ATOM 386 CB ILE A 29 -5.223 -4.414 -7.272 1.00 0.00 C ATOM 387 CG1 ILE A 29 -3.967 -3.547 -7.167 1.00 0.00 C ATOM 388 CG2 ILE A 29 -5.004 -5.813 -6.692 1.00 0.00 C ATOM 389 CD1 ILE A 29 -4.167 -2.411 -6.161 1.00 0.00 C ATOM 0 H ILE A 29 -7.045 -2.871 -8.715 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.856 -4.807 -9.307 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.996 -3.934 -6.672 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.120 -4.162 -6.862 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.724 -3.133 -8.145 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.653 -5.730 -5.663 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.943 -6.366 -6.711 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.260 -6.341 -7.288 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.259 -1.810 -6.106 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.999 -1.784 -6.481 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.386 -2.829 -5.179 1.00 0.00 H new ATOM 401 N PRO A 30 -6.466 -6.582 -9.727 1.00 0.00 N ATOM 402 CA PRO A 30 -7.411 -7.645 -10.022 1.00 0.00 C ATOM 403 C PRO A 30 -7.591 -8.568 -8.815 1.00 0.00 C ATOM 404 O PRO A 30 -6.637 -8.838 -8.087 1.00 0.00 O ATOM 405 CB PRO A 30 -6.835 -8.359 -11.234 1.00 0.00 C ATOM 406 CG PRO A 30 -5.367 -7.967 -11.290 1.00 0.00 C ATOM 407 CD PRO A 30 -5.165 -6.784 -10.358 1.00 0.00 C ATOM 0 HA PRO A 30 -8.412 -7.270 -10.236 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.948 -9.439 -11.141 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.354 -8.062 -12.145 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -4.737 -8.803 -10.988 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.081 -7.704 -12.308 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.393 -6.991 -9.617 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -4.849 -5.897 -10.907 1.00 0.00 H new ATOM 415 N LEU A 31 -8.822 -9.028 -8.640 1.00 0.00 N ATOM 416 CA LEU A 31 -9.139 -9.915 -7.534 1.00 0.00 C ATOM 417 C LEU A 31 -9.676 -11.237 -8.084 1.00 0.00 C ATOM 418 O LEU A 31 -10.615 -11.808 -7.532 1.00 0.00 O ATOM 419 CB LEU A 31 -10.089 -9.227 -6.551 1.00 0.00 C ATOM 420 CG LEU A 31 -9.661 -7.842 -6.062 1.00 0.00 C ATOM 421 CD1 LEU A 31 -10.562 -7.359 -4.924 1.00 0.00 C ATOM 422 CD2 LEU A 31 -8.183 -7.832 -5.667 1.00 0.00 C ATOM 0 H LEU A 31 -9.611 -8.803 -9.246 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.240 -10.148 -6.963 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -11.067 -9.137 -7.024 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.213 -9.875 -5.683 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.779 -7.138 -6.886 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.236 -6.372 -4.595 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.592 -7.302 -5.275 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.501 -8.058 -4.090 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.905 -6.836 -5.323 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.016 -8.552 -4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.574 -8.101 -6.530 1.00 0.00 H new ATOM 434 N ASN A 32 -9.057 -11.686 -9.166 1.00 0.00 N ATOM 435 CA ASN A 32 -9.460 -12.931 -9.797 1.00 0.00 C ATOM 436 C ASN A 32 -9.250 -14.087 -8.817 1.00 0.00 C ATOM 437 O ASN A 32 -10.208 -14.744 -8.413 1.00 0.00 O ATOM 438 CB ASN A 32 -8.622 -13.212 -11.046 1.00 0.00 C ATOM 439 CG ASN A 32 -7.178 -12.747 -10.854 1.00 0.00 C ATOM 440 OD1 ASN A 32 -6.409 -13.321 -10.100 1.00 0.00 O ATOM 441 ND2 ASN A 32 -6.853 -11.678 -11.575 1.00 0.00 N ATOM 0 H ASN A 32 -8.279 -11.209 -9.622 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.509 -12.841 -10.079 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -8.638 -14.279 -11.266 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.060 -12.703 -11.904 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -5.911 -11.290 -11.516 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -7.545 -11.246 -12.187 1.00 0.00 H new ATOM 448 N ASP A 33 -7.991 -14.299 -8.463 1.00 0.00 N ATOM 449 CA ASP A 33 -7.643 -15.364 -7.538 1.00 0.00 C ATOM 450 C ASP A 33 -7.486 -14.781 -6.132 1.00 0.00 C ATOM 451 O ASP A 33 -7.659 -15.487 -5.140 1.00 0.00 O ATOM 452 CB ASP A 33 -6.318 -16.021 -7.928 1.00 0.00 C ATOM 453 CG ASP A 33 -6.450 -17.314 -8.735 1.00 0.00 C ATOM 454 OD1 ASP A 33 -7.164 -18.217 -8.248 1.00 0.00 O ATOM 455 OD2 ASP A 33 -5.835 -17.371 -9.822 1.00 0.00 O ATOM 0 H ASP A 33 -7.199 -13.751 -8.800 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.438 -16.110 -7.568 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.733 -15.307 -8.507 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.754 -16.233 -7.020 1.00 0.00 H new ATOM 460 N SER A 34 -7.159 -13.498 -6.092 1.00 0.00 N ATOM 461 CA SER A 34 -6.976 -12.812 -4.824 1.00 0.00 C ATOM 462 C SER A 34 -8.332 -12.583 -4.153 1.00 0.00 C ATOM 463 O SER A 34 -8.472 -12.776 -2.946 1.00 0.00 O ATOM 464 CB SER A 34 -6.248 -11.480 -5.018 1.00 0.00 C ATOM 465 OG SER A 34 -5.453 -11.136 -3.886 1.00 0.00 O ATOM 0 H SER A 34 -7.016 -12.915 -6.917 1.00 0.00 H new ATOM 0 HA SER A 34 -6.361 -13.441 -4.181 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.613 -11.539 -5.902 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.978 -10.691 -5.202 1.00 0.00 H new ATOM 0 HG SER A 34 -5.990 -10.610 -3.257 1.00 0.00 H new ATOM 471 N GLY A 35 -9.296 -12.174 -4.964 1.00 0.00 N ATOM 472 CA GLY A 35 -10.636 -11.916 -4.464 1.00 0.00 C ATOM 473 C GLY A 35 -11.012 -12.914 -3.366 1.00 0.00 C ATOM 474 O GLY A 35 -11.657 -12.548 -2.384 1.00 0.00 O ATOM 0 H GLY A 35 -9.176 -12.015 -5.964 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.693 -10.900 -4.073 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -11.353 -11.983 -5.282 1.00 0.00 H new ATOM 478 N SER A 36 -10.594 -14.154 -3.569 1.00 0.00 N ATOM 479 CA SER A 36 -10.879 -15.207 -2.609 1.00 0.00 C ATOM 480 C SER A 36 -10.738 -14.668 -1.184 1.00 0.00 C ATOM 481 O SER A 36 -11.717 -14.602 -0.442 1.00 0.00 O ATOM 482 CB SER A 36 -9.953 -16.407 -2.816 1.00 0.00 C ATOM 483 OG SER A 36 -10.122 -17.393 -1.802 1.00 0.00 O ATOM 0 H SER A 36 -10.060 -14.454 -4.385 1.00 0.00 H new ATOM 0 HA SER A 36 -11.904 -15.543 -2.764 1.00 0.00 H new ATOM 0 HB2 SER A 36 -10.150 -16.853 -3.791 1.00 0.00 H new ATOM 0 HB3 SER A 36 -8.917 -16.068 -2.823 1.00 0.00 H new ATOM 0 HG SER A 36 -9.515 -18.143 -1.971 1.00 0.00 H new ATOM 489 N ALA A 37 -9.512 -14.295 -0.844 1.00 0.00 N ATOM 490 CA ALA A 37 -9.231 -13.764 0.478 1.00 0.00 C ATOM 491 C ALA A 37 -9.294 -12.236 0.433 1.00 0.00 C ATOM 492 O ALA A 37 -9.482 -11.588 1.462 1.00 0.00 O ATOM 493 CB ALA A 37 -7.871 -14.278 0.956 1.00 0.00 C ATOM 0 H ALA A 37 -8.703 -14.350 -1.462 1.00 0.00 H new ATOM 0 HA ALA A 37 -9.978 -14.104 1.195 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.660 -13.880 1.948 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.888 -15.367 0.998 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -7.095 -13.954 0.262 1.00 0.00 H new ATOM 499 N GLY A 38 -9.133 -11.704 -0.769 1.00 0.00 N ATOM 500 CA GLY A 38 -9.169 -10.264 -0.962 1.00 0.00 C ATOM 501 C GLY A 38 -7.815 -9.742 -1.446 1.00 0.00 C ATOM 502 O GLY A 38 -6.919 -10.525 -1.758 1.00 0.00 O ATOM 0 H GLY A 38 -8.977 -12.244 -1.620 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.941 -10.010 -1.688 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.438 -9.775 -0.026 1.00 0.00 H new ATOM 506 N LEU A 39 -7.708 -8.422 -1.494 1.00 0.00 N ATOM 507 CA LEU A 39 -6.479 -7.786 -1.935 1.00 0.00 C ATOM 508 C LEU A 39 -5.281 -8.569 -1.393 1.00 0.00 C ATOM 509 O LEU A 39 -4.575 -9.233 -2.150 1.00 0.00 O ATOM 510 CB LEU A 39 -6.472 -6.306 -1.548 1.00 0.00 C ATOM 511 CG LEU A 39 -7.239 -5.365 -2.480 1.00 0.00 C ATOM 512 CD1 LEU A 39 -7.593 -4.058 -1.769 1.00 0.00 C ATOM 513 CD2 LEU A 39 -6.459 -5.121 -3.774 1.00 0.00 C ATOM 0 H LEU A 39 -8.453 -7.776 -1.234 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.409 -7.807 -3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.889 -6.211 -0.545 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.437 -5.969 -1.496 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.178 -5.846 -2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.137 -3.407 -2.453 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.215 -4.273 -0.901 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.679 -3.560 -1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.025 -4.449 -4.419 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.495 -4.670 -3.538 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.300 -6.069 -4.288 1.00 0.00 H new ATOM 525 N GLY A 40 -5.090 -8.465 -0.086 1.00 0.00 N ATOM 526 CA GLY A 40 -3.991 -9.155 0.567 1.00 0.00 C ATOM 527 C GLY A 40 -2.996 -8.158 1.166 1.00 0.00 C ATOM 528 O GLY A 40 -1.806 -8.450 1.270 1.00 0.00 O ATOM 0 H GLY A 40 -5.678 -7.913 0.538 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.379 -9.803 1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.481 -9.796 -0.152 1.00 0.00 H new ATOM 532 N VAL A 41 -3.521 -7.002 1.543 1.00 0.00 N ATOM 533 CA VAL A 41 -2.694 -5.960 2.129 1.00 0.00 C ATOM 534 C VAL A 41 -3.243 -5.595 3.509 1.00 0.00 C ATOM 535 O VAL A 41 -4.415 -5.833 3.798 1.00 0.00 O ATOM 536 CB VAL A 41 -2.613 -4.762 1.181 1.00 0.00 C ATOM 537 CG1 VAL A 41 -1.593 -5.011 0.069 1.00 0.00 C ATOM 538 CG2 VAL A 41 -3.988 -4.429 0.600 1.00 0.00 C ATOM 0 H VAL A 41 -4.509 -6.763 1.454 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.673 -6.316 2.270 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.276 -3.901 1.758 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.555 -4.144 -0.591 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.609 -5.176 0.508 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -1.887 -5.890 -0.504 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.902 -3.574 -0.070 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.367 -5.288 0.046 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.676 -4.188 1.410 1.00 0.00 H new ATOM 548 N SER A 42 -2.371 -5.022 4.326 1.00 0.00 N ATOM 549 CA SER A 42 -2.754 -4.621 5.669 1.00 0.00 C ATOM 550 C SER A 42 -2.724 -3.096 5.788 1.00 0.00 C ATOM 551 O SER A 42 -1.730 -2.462 5.438 1.00 0.00 O ATOM 552 CB SER A 42 -1.835 -5.254 6.716 1.00 0.00 C ATOM 553 OG SER A 42 -2.569 -5.952 7.718 1.00 0.00 O ATOM 0 H SER A 42 -1.400 -4.826 4.083 1.00 0.00 H new ATOM 0 HA SER A 42 -3.768 -4.974 5.855 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.146 -5.942 6.226 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.230 -4.478 7.184 1.00 0.00 H new ATOM 0 HG SER A 42 -1.947 -6.343 8.366 1.00 0.00 H new ATOM 559 N LEU A 43 -3.825 -2.552 6.285 1.00 0.00 N ATOM 560 CA LEU A 43 -3.937 -1.113 6.455 1.00 0.00 C ATOM 561 C LEU A 43 -4.036 -0.787 7.946 1.00 0.00 C ATOM 562 O LEU A 43 -4.140 -1.688 8.777 1.00 0.00 O ATOM 563 CB LEU A 43 -5.101 -0.565 5.627 1.00 0.00 C ATOM 564 CG LEU A 43 -5.303 -1.201 4.250 1.00 0.00 C ATOM 565 CD1 LEU A 43 -6.124 -0.286 3.339 1.00 0.00 C ATOM 566 CD2 LEU A 43 -3.962 -1.583 3.621 1.00 0.00 C ATOM 0 H LEU A 43 -4.647 -3.081 6.575 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.045 -0.614 6.077 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.019 -0.689 6.201 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.952 0.506 5.492 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.872 -2.122 4.379 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.253 -0.761 2.367 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.101 -0.107 3.788 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.604 0.663 3.212 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.134 -2.033 2.643 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.346 -0.691 3.507 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.449 -2.298 4.264 1.00 0.00 H new ATOM 578 N LYS A 44 -3.999 0.505 8.241 1.00 0.00 N ATOM 579 CA LYS A 44 -4.083 0.961 9.617 1.00 0.00 C ATOM 580 C LYS A 44 -4.885 2.263 9.671 1.00 0.00 C ATOM 581 O LYS A 44 -4.736 3.124 8.804 1.00 0.00 O ATOM 582 CB LYS A 44 -2.685 1.074 10.230 1.00 0.00 C ATOM 583 CG LYS A 44 -2.046 2.423 9.892 1.00 0.00 C ATOM 584 CD LYS A 44 -1.775 2.539 8.390 1.00 0.00 C ATOM 585 CE LYS A 44 -0.621 3.506 8.115 1.00 0.00 C ATOM 586 NZ LYS A 44 -0.889 4.822 8.736 1.00 0.00 N ATOM 0 H LYS A 44 -3.912 1.250 7.550 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.616 0.232 10.228 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -2.748 0.958 11.312 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -2.055 0.266 9.859 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.704 3.231 10.210 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -1.113 2.536 10.444 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -1.536 1.557 7.983 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -2.674 2.885 7.880 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.308 3.094 8.509 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.487 3.625 7.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.678 5.578 8.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.889 4.877 9.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -0.288 4.938 9.577 1.00 0.00 H new ATOM 600 N GLY A 45 -5.717 2.366 10.696 1.00 0.00 N ATOM 601 CA GLY A 45 -6.543 3.549 10.874 1.00 0.00 C ATOM 602 C GLY A 45 -5.870 4.552 11.812 1.00 0.00 C ATOM 603 O GLY A 45 -5.435 4.190 12.905 1.00 0.00 O ATOM 0 H GLY A 45 -5.838 1.650 11.412 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.727 4.017 9.907 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.513 3.262 11.279 1.00 0.00 H new ATOM 607 N ASN A 46 -5.804 5.792 11.352 1.00 0.00 N ATOM 608 CA ASN A 46 -5.191 6.851 12.136 1.00 0.00 C ATOM 609 C ASN A 46 -6.281 7.786 12.662 1.00 0.00 C ATOM 610 O ASN A 46 -7.186 8.169 11.922 1.00 0.00 O ATOM 611 CB ASN A 46 -4.227 7.679 11.285 1.00 0.00 C ATOM 612 CG ASN A 46 -2.848 7.764 11.944 1.00 0.00 C ATOM 613 OD1 ASN A 46 -2.706 7.719 13.155 1.00 0.00 O ATOM 614 ND2 ASN A 46 -1.843 7.890 11.081 1.00 0.00 N ATOM 0 H ASN A 46 -6.165 6.088 10.445 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.641 6.389 12.956 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.134 7.232 10.295 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.630 8.682 11.145 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -0.884 7.955 11.421 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.032 7.921 10.079 1.00 0.00 H new ATOM 621 N LYS A 47 -6.159 8.128 13.937 1.00 0.00 N ATOM 622 CA LYS A 47 -7.122 9.011 14.571 1.00 0.00 C ATOM 623 C LYS A 47 -6.388 10.209 15.177 1.00 0.00 C ATOM 624 O LYS A 47 -5.247 10.082 15.620 1.00 0.00 O ATOM 625 CB LYS A 47 -7.976 8.239 15.578 1.00 0.00 C ATOM 626 CG LYS A 47 -9.357 8.879 15.731 1.00 0.00 C ATOM 627 CD LYS A 47 -9.939 8.603 17.119 1.00 0.00 C ATOM 628 CE LYS A 47 -11.315 9.253 17.276 1.00 0.00 C ATOM 629 NZ LYS A 47 -12.366 8.389 16.693 1.00 0.00 N ATOM 0 H LYS A 47 -5.407 7.809 14.548 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.820 9.405 13.833 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -8.085 7.205 15.251 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.473 8.216 16.545 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.283 9.955 15.571 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -10.029 8.489 14.967 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -10.021 7.527 17.275 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.263 8.986 17.883 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.523 9.427 18.332 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.322 10.226 16.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.294 8.845 16.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.175 8.244 15.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.369 7.470 17.180 1.00 0.00 H new ATOM 643 N SER A 48 -7.071 11.343 15.178 1.00 0.00 N ATOM 644 CA SER A 48 -6.498 12.562 15.724 1.00 0.00 C ATOM 645 C SER A 48 -7.271 12.991 16.972 1.00 0.00 C ATOM 646 O SER A 48 -8.496 12.885 17.015 1.00 0.00 O ATOM 647 CB SER A 48 -6.502 13.685 14.685 1.00 0.00 C ATOM 648 OG SER A 48 -5.223 13.860 14.083 1.00 0.00 O ATOM 0 H SER A 48 -8.017 11.444 14.809 1.00 0.00 H new ATOM 0 HA SER A 48 -5.462 12.360 15.998 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.238 13.462 13.913 1.00 0.00 H new ATOM 0 HB3 SER A 48 -6.810 14.617 15.160 1.00 0.00 H new ATOM 0 HG SER A 48 -5.110 14.798 13.822 1.00 0.00 H new ATOM 654 N ARG A 49 -6.524 13.466 17.958 1.00 0.00 N ATOM 655 CA ARG A 49 -7.124 13.912 19.204 1.00 0.00 C ATOM 656 C ARG A 49 -7.542 15.380 19.097 1.00 0.00 C ATOM 657 O ARG A 49 -8.625 15.754 19.544 1.00 0.00 O ATOM 658 CB ARG A 49 -6.150 13.750 20.373 1.00 0.00 C ATOM 659 CG ARG A 49 -6.782 12.936 21.504 1.00 0.00 C ATOM 660 CD ARG A 49 -6.858 13.757 22.793 1.00 0.00 C ATOM 661 NE ARG A 49 -6.125 13.066 23.877 1.00 0.00 N ATOM 662 CZ ARG A 49 -4.790 13.049 23.989 1.00 0.00 C ATOM 663 NH1 ARG A 49 -4.034 13.685 23.084 1.00 0.00 N ATOM 664 NH2 ARG A 49 -4.211 12.396 25.006 1.00 0.00 N ATOM 0 H ARG A 49 -5.508 13.552 17.919 1.00 0.00 H new ATOM 0 HA ARG A 49 -8.002 13.294 19.389 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -5.241 13.256 20.028 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -5.857 14.732 20.746 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -7.783 12.617 21.212 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -6.197 12.033 21.678 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -6.433 14.747 22.629 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -7.899 13.901 23.081 1.00 0.00 H new ATOM 0 HE ARG A 49 -6.670 12.572 24.583 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -4.475 14.182 22.310 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.018 13.672 23.169 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -4.787 11.912 25.695 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -3.195 12.383 25.091 1.00 0.00 H new ATOM 678 N GLU A 50 -6.662 16.171 18.501 1.00 0.00 N ATOM 679 CA GLU A 50 -6.926 17.589 18.330 1.00 0.00 C ATOM 680 C GLU A 50 -8.366 17.808 17.862 1.00 0.00 C ATOM 681 O GLU A 50 -9.150 18.470 18.541 1.00 0.00 O ATOM 682 CB GLU A 50 -5.931 18.218 17.353 1.00 0.00 C ATOM 683 CG GLU A 50 -4.906 19.080 18.093 1.00 0.00 C ATOM 684 CD GLU A 50 -4.976 20.536 17.629 1.00 0.00 C ATOM 685 OE1 GLU A 50 -5.793 21.279 18.214 1.00 0.00 O ATOM 686 OE2 GLU A 50 -4.211 20.872 16.699 1.00 0.00 O ATOM 0 H GLU A 50 -5.765 15.856 18.130 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.799 18.081 19.294 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.418 17.434 16.796 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.466 18.828 16.625 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.089 19.028 19.166 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.904 18.688 17.921 1.00 0.00 H new ATOM 693 N THR A 51 -8.672 17.239 16.705 1.00 0.00 N ATOM 694 CA THR A 51 -10.004 17.364 16.138 1.00 0.00 C ATOM 695 C THR A 51 -10.899 16.223 16.625 1.00 0.00 C ATOM 696 O THR A 51 -12.115 16.263 16.445 1.00 0.00 O ATOM 697 CB THR A 51 -9.866 17.421 14.615 1.00 0.00 C ATOM 698 OG1 THR A 51 -9.668 16.062 14.233 1.00 0.00 O ATOM 699 CG2 THR A 51 -8.583 18.124 14.169 1.00 0.00 C ATOM 0 H THR A 51 -8.020 16.690 16.145 1.00 0.00 H new ATOM 0 HA THR A 51 -10.491 18.281 16.469 1.00 0.00 H new ATOM 0 HB THR A 51 -10.728 17.937 14.192 1.00 0.00 H new ATOM 0 HG1 THR A 51 -9.571 16.007 13.259 1.00 0.00 H new ATOM 0 HG21 THR A 51 -8.535 18.137 13.080 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.579 19.147 14.544 1.00 0.00 H new ATOM 0 HG23 THR A 51 -7.719 17.590 14.564 1.00 0.00 H new ATOM 707 N GLY A 52 -10.263 15.232 17.233 1.00 0.00 N ATOM 708 CA GLY A 52 -10.987 14.082 17.747 1.00 0.00 C ATOM 709 C GLY A 52 -11.751 13.370 16.629 1.00 0.00 C ATOM 710 O GLY A 52 -12.799 12.774 16.871 1.00 0.00 O ATOM 0 H GLY A 52 -9.254 15.202 17.381 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.289 13.388 18.214 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -11.684 14.403 18.521 1.00 0.00 H new ATOM 714 N THR A 53 -11.196 13.456 15.429 1.00 0.00 N ATOM 715 CA THR A 53 -11.812 12.828 14.273 1.00 0.00 C ATOM 716 C THR A 53 -10.852 11.819 13.640 1.00 0.00 C ATOM 717 O THR A 53 -9.664 11.802 13.959 1.00 0.00 O ATOM 718 CB THR A 53 -12.252 13.933 13.312 1.00 0.00 C ATOM 719 OG1 THR A 53 -13.141 14.734 14.087 1.00 0.00 O ATOM 720 CG2 THR A 53 -13.124 13.405 12.171 1.00 0.00 C ATOM 0 H THR A 53 -10.326 13.951 15.232 1.00 0.00 H new ATOM 0 HA THR A 53 -12.695 12.255 14.558 1.00 0.00 H new ATOM 0 HB THR A 53 -11.372 14.425 12.898 1.00 0.00 H new ATOM 0 HG1 THR A 53 -12.625 15.283 14.713 1.00 0.00 H new ATOM 0 HG21 THR A 53 -13.408 14.230 11.519 1.00 0.00 H new ATOM 0 HG22 THR A 53 -12.565 12.666 11.598 1.00 0.00 H new ATOM 0 HG23 THR A 53 -14.021 12.942 12.583 1.00 0.00 H new ATOM 728 N ASP A 54 -11.402 11.002 12.753 1.00 0.00 N ATOM 729 CA ASP A 54 -10.609 9.993 12.072 1.00 0.00 C ATOM 730 C ASP A 54 -9.965 10.610 10.829 1.00 0.00 C ATOM 731 O ASP A 54 -10.664 11.040 9.912 1.00 0.00 O ATOM 732 CB ASP A 54 -11.481 8.820 11.621 1.00 0.00 C ATOM 733 CG ASP A 54 -12.852 9.209 11.064 1.00 0.00 C ATOM 734 OD1 ASP A 54 -12.867 9.986 10.085 1.00 0.00 O ATOM 735 OD2 ASP A 54 -13.853 8.721 11.631 1.00 0.00 O ATOM 0 H ASP A 54 -12.387 11.019 12.490 1.00 0.00 H new ATOM 0 HA ASP A 54 -9.852 9.632 12.768 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -10.942 8.258 10.858 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -11.627 8.149 12.467 1.00 0.00 H new ATOM 740 N LEU A 55 -8.641 10.633 10.837 1.00 0.00 N ATOM 741 CA LEU A 55 -7.895 11.189 9.721 1.00 0.00 C ATOM 742 C LEU A 55 -8.279 10.450 8.437 1.00 0.00 C ATOM 743 O LEU A 55 -8.262 11.031 7.353 1.00 0.00 O ATOM 744 CB LEU A 55 -6.394 11.170 10.016 1.00 0.00 C ATOM 745 CG LEU A 55 -5.942 11.960 11.245 1.00 0.00 C ATOM 746 CD1 LEU A 55 -4.451 11.750 11.514 1.00 0.00 C ATOM 747 CD2 LEU A 55 -6.296 13.442 11.105 1.00 0.00 C ATOM 0 H LEU A 55 -8.065 10.275 11.599 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.154 12.238 9.575 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.081 10.133 10.140 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.868 11.560 9.145 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.482 11.580 12.112 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.156 12.323 12.393 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.258 10.692 11.689 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -3.875 12.086 10.652 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.964 13.981 11.992 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.802 13.853 10.225 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.375 13.550 10.998 1.00 0.00 H new ATOM 759 N GLY A 56 -8.617 9.180 8.602 1.00 0.00 N ATOM 760 CA GLY A 56 -9.004 8.355 7.470 1.00 0.00 C ATOM 761 C GLY A 56 -8.314 6.991 7.523 1.00 0.00 C ATOM 762 O GLY A 56 -8.004 6.490 8.603 1.00 0.00 O ATOM 0 H GLY A 56 -8.631 8.702 9.503 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -10.086 8.219 7.468 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -8.744 8.862 6.541 1.00 0.00 H new ATOM 766 N ILE A 57 -8.092 6.429 6.344 1.00 0.00 N ATOM 767 CA ILE A 57 -7.444 5.133 6.243 1.00 0.00 C ATOM 768 C ILE A 57 -6.116 5.288 5.499 1.00 0.00 C ATOM 769 O ILE A 57 -5.990 6.136 4.617 1.00 0.00 O ATOM 770 CB ILE A 57 -8.388 4.110 5.608 1.00 0.00 C ATOM 771 CG1 ILE A 57 -9.674 3.970 6.425 1.00 0.00 C ATOM 772 CG2 ILE A 57 -7.686 2.765 5.410 1.00 0.00 C ATOM 773 CD1 ILE A 57 -9.370 3.508 7.852 1.00 0.00 C ATOM 0 H ILE A 57 -8.350 6.848 5.450 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.211 4.746 7.235 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.672 4.474 4.620 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -10.198 4.926 6.452 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.340 3.255 5.942 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.379 2.056 4.957 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.824 2.897 4.756 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.354 2.382 6.375 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.301 3.417 8.411 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.868 2.541 7.822 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.724 4.237 8.341 1.00 0.00 H new ATOM 785 N PHE A 58 -5.159 4.456 5.882 1.00 0.00 N ATOM 786 CA PHE A 58 -3.845 4.490 5.263 1.00 0.00 C ATOM 787 C PHE A 58 -3.262 3.081 5.135 1.00 0.00 C ATOM 788 O PHE A 58 -3.542 2.213 5.959 1.00 0.00 O ATOM 789 CB PHE A 58 -2.942 5.322 6.175 1.00 0.00 C ATOM 790 CG PHE A 58 -3.492 6.713 6.495 1.00 0.00 C ATOM 791 CD1 PHE A 58 -4.600 6.844 7.272 1.00 0.00 C ATOM 792 CD2 PHE A 58 -2.873 7.819 6.002 1.00 0.00 C ATOM 793 CE1 PHE A 58 -5.111 8.136 7.569 1.00 0.00 C ATOM 794 CE2 PHE A 58 -3.383 9.111 6.298 1.00 0.00 C ATOM 795 CZ PHE A 58 -4.492 9.242 7.076 1.00 0.00 C ATOM 0 H PHE A 58 -5.267 3.754 6.614 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.916 4.917 4.262 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.787 4.780 7.108 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.965 5.429 5.703 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -5.092 5.966 7.664 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.993 7.715 5.385 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.991 8.240 8.186 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.891 9.989 5.906 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.880 10.224 7.302 1.00 0.00 H new ATOM 805 N ILE A 59 -2.463 2.899 4.094 1.00 0.00 N ATOM 806 CA ILE A 59 -1.838 1.610 3.847 1.00 0.00 C ATOM 807 C ILE A 59 -0.727 1.382 4.874 1.00 0.00 C ATOM 808 O ILE A 59 -0.074 2.330 5.308 1.00 0.00 O ATOM 809 CB ILE A 59 -1.364 1.514 2.396 1.00 0.00 C ATOM 810 CG1 ILE A 59 -2.516 1.779 1.424 1.00 0.00 C ATOM 811 CG2 ILE A 59 -0.686 0.168 2.129 1.00 0.00 C ATOM 812 CD1 ILE A 59 -2.063 1.594 -0.026 1.00 0.00 C ATOM 0 H ILE A 59 -2.234 3.622 3.412 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.561 0.805 3.975 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.617 2.290 2.228 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.342 1.101 1.640 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -2.890 2.793 1.565 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.358 0.125 1.090 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.176 0.058 2.786 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.393 -0.640 2.320 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -2.900 1.788 -0.696 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.253 2.290 -0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.712 0.572 -0.170 1.00 0.00 H new ATOM 824 N LYS A 60 -0.546 0.119 5.232 1.00 0.00 N ATOM 825 CA LYS A 60 0.475 -0.245 6.199 1.00 0.00 C ATOM 826 C LYS A 60 1.712 -0.758 5.460 1.00 0.00 C ATOM 827 O LYS A 60 2.818 -0.263 5.675 1.00 0.00 O ATOM 828 CB LYS A 60 -0.085 -1.237 7.221 1.00 0.00 C ATOM 829 CG LYS A 60 0.366 -0.877 8.638 1.00 0.00 C ATOM 830 CD LYS A 60 0.127 -2.041 9.602 1.00 0.00 C ATOM 831 CE LYS A 60 1.277 -3.047 9.542 1.00 0.00 C ATOM 832 NZ LYS A 60 1.575 -3.576 10.892 1.00 0.00 N ATOM 0 H LYS A 60 -1.089 -0.665 4.870 1.00 0.00 H new ATOM 0 HA LYS A 60 0.785 0.629 6.772 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.174 -1.240 7.172 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.248 -2.245 6.975 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.425 -0.617 8.632 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.176 0.003 8.983 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.024 -1.661 10.618 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -0.810 -2.539 9.352 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.016 -3.867 8.873 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.165 -2.569 9.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.358 -4.258 10.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.845 -2.792 11.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.732 -4.050 11.273 1.00 0.00 H new ATOM 846 N SER A 61 1.485 -1.742 4.602 1.00 0.00 N ATOM 847 CA SER A 61 2.567 -2.327 3.830 1.00 0.00 C ATOM 848 C SER A 61 2.017 -3.398 2.885 1.00 0.00 C ATOM 849 O SER A 61 1.024 -4.053 3.196 1.00 0.00 O ATOM 850 CB SER A 61 3.637 -2.925 4.745 1.00 0.00 C ATOM 851 OG SER A 61 3.580 -4.348 4.774 1.00 0.00 O ATOM 0 H SER A 61 0.567 -2.149 4.425 1.00 0.00 H new ATOM 0 HA SER A 61 3.032 -1.537 3.241 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.623 -2.609 4.405 1.00 0.00 H new ATOM 0 HB3 SER A 61 3.509 -2.536 5.755 1.00 0.00 H new ATOM 0 HG SER A 61 4.280 -4.691 5.368 1.00 0.00 H new ATOM 857 N ILE A 62 2.688 -3.543 1.752 1.00 0.00 N ATOM 858 CA ILE A 62 2.279 -4.523 0.761 1.00 0.00 C ATOM 859 C ILE A 62 2.978 -5.853 1.046 1.00 0.00 C ATOM 860 O ILE A 62 4.140 -5.874 1.450 1.00 0.00 O ATOM 861 CB ILE A 62 2.524 -3.990 -0.653 1.00 0.00 C ATOM 862 CG1 ILE A 62 1.924 -2.593 -0.824 1.00 0.00 C ATOM 863 CG2 ILE A 62 2.004 -4.971 -1.706 1.00 0.00 C ATOM 864 CD1 ILE A 62 3.023 -1.533 -0.919 1.00 0.00 C ATOM 0 H ILE A 62 3.512 -2.998 1.498 1.00 0.00 H new ATOM 0 HA ILE A 62 1.206 -4.706 0.827 1.00 0.00 H new ATOM 0 HB ILE A 62 3.600 -3.898 -0.802 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.308 -2.565 -1.723 1.00 0.00 H new ATOM 0 HG13 ILE A 62 1.269 -2.369 0.018 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.190 -4.569 -2.702 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.518 -5.926 -1.599 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.933 -5.118 -1.569 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.570 -0.549 -1.040 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.622 -1.547 -0.008 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.661 -1.747 -1.776 1.00 0.00 H new ATOM 876 N ILE A 63 2.241 -6.932 0.826 1.00 0.00 N ATOM 877 CA ILE A 63 2.776 -8.263 1.055 1.00 0.00 C ATOM 878 C ILE A 63 3.336 -8.816 -0.257 1.00 0.00 C ATOM 879 O ILE A 63 2.806 -8.534 -1.330 1.00 0.00 O ATOM 880 CB ILE A 63 1.718 -9.162 1.699 1.00 0.00 C ATOM 881 CG1 ILE A 63 1.508 -8.796 3.170 1.00 0.00 C ATOM 882 CG2 ILE A 63 2.072 -10.640 1.521 1.00 0.00 C ATOM 883 CD1 ILE A 63 0.586 -7.583 3.306 1.00 0.00 C ATOM 0 H ILE A 63 1.278 -6.911 0.492 1.00 0.00 H new ATOM 0 HA ILE A 63 3.603 -8.224 1.764 1.00 0.00 H new ATOM 0 HB ILE A 63 0.770 -8.994 1.187 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.079 -9.645 3.702 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.470 -8.581 3.636 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.304 -11.257 1.988 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.130 -10.875 0.458 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.035 -10.843 1.990 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.453 -7.344 4.361 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.030 -6.730 2.793 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.383 -7.810 2.861 1.00 0.00 H new ATOM 895 N HIS A 64 4.402 -9.592 -0.127 1.00 0.00 N ATOM 896 CA HIS A 64 5.040 -10.187 -1.289 1.00 0.00 C ATOM 897 C HIS A 64 4.560 -11.630 -1.457 1.00 0.00 C ATOM 898 O HIS A 64 4.119 -12.257 -0.495 1.00 0.00 O ATOM 899 CB HIS A 64 6.563 -10.077 -1.189 1.00 0.00 C ATOM 900 CG HIS A 64 7.308 -10.937 -2.181 1.00 0.00 C ATOM 901 ND1 HIS A 64 8.032 -10.410 -3.236 1.00 0.00 N ATOM 902 CD2 HIS A 64 7.434 -12.293 -2.267 1.00 0.00 C ATOM 903 CE1 HIS A 64 8.565 -11.411 -3.920 1.00 0.00 C ATOM 904 NE2 HIS A 64 8.193 -12.578 -3.318 1.00 0.00 N ATOM 0 H HIS A 64 4.840 -9.822 0.765 1.00 0.00 H new ATOM 0 HA HIS A 64 4.752 -9.639 -2.186 1.00 0.00 H new ATOM 0 HB2 HIS A 64 6.852 -9.037 -1.337 1.00 0.00 H new ATOM 0 HB3 HIS A 64 6.871 -10.353 -0.181 1.00 0.00 H new ATOM 0 HD1 HIS A 64 8.137 -9.418 -3.451 1.00 0.00 H new ATOM 0 HD2 HIS A 64 6.991 -13.012 -1.594 1.00 0.00 H new ATOM 0 HE1 HIS A 64 9.185 -11.320 -4.800 1.00 0.00 H new ATOM 912 N GLY A 65 4.662 -12.115 -2.686 1.00 0.00 N ATOM 913 CA GLY A 65 4.244 -13.472 -2.992 1.00 0.00 C ATOM 914 C GLY A 65 2.724 -13.556 -3.144 1.00 0.00 C ATOM 915 O GLY A 65 2.154 -14.646 -3.128 1.00 0.00 O ATOM 0 H GLY A 65 5.028 -11.592 -3.481 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.724 -13.806 -3.912 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.572 -14.145 -2.199 1.00 0.00 H new ATOM 919 N GLY A 66 2.110 -12.390 -3.288 1.00 0.00 N ATOM 920 CA GLY A 66 0.667 -12.319 -3.444 1.00 0.00 C ATOM 921 C GLY A 66 0.287 -11.430 -4.630 1.00 0.00 C ATOM 922 O GLY A 66 1.072 -11.263 -5.562 1.00 0.00 O ATOM 0 H GLY A 66 2.585 -11.488 -3.300 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.264 -13.321 -3.592 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.218 -11.926 -2.532 1.00 0.00 H new ATOM 926 N ALA A 67 -0.918 -10.883 -4.556 1.00 0.00 N ATOM 927 CA ALA A 67 -1.412 -10.015 -5.611 1.00 0.00 C ATOM 928 C ALA A 67 -0.914 -8.589 -5.368 1.00 0.00 C ATOM 929 O ALA A 67 -0.226 -8.016 -6.212 1.00 0.00 O ATOM 930 CB ALA A 67 -2.938 -10.098 -5.668 1.00 0.00 C ATOM 0 H ALA A 67 -1.566 -11.024 -3.781 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.032 -10.336 -6.581 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.308 -9.447 -6.460 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -3.239 -11.125 -5.873 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.356 -9.781 -4.712 1.00 0.00 H new ATOM 936 N ALA A 68 -1.281 -8.057 -4.212 1.00 0.00 N ATOM 937 CA ALA A 68 -0.881 -6.709 -3.847 1.00 0.00 C ATOM 938 C ALA A 68 0.574 -6.483 -4.265 1.00 0.00 C ATOM 939 O ALA A 68 0.908 -5.439 -4.823 1.00 0.00 O ATOM 940 CB ALA A 68 -1.095 -6.500 -2.347 1.00 0.00 C ATOM 0 H ALA A 68 -1.852 -8.536 -3.515 1.00 0.00 H new ATOM 0 HA ALA A 68 -1.493 -5.973 -4.369 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.795 -5.488 -2.074 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.148 -6.643 -2.106 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.495 -7.219 -1.790 1.00 0.00 H new ATOM 946 N PHE A 69 1.400 -7.478 -3.978 1.00 0.00 N ATOM 947 CA PHE A 69 2.811 -7.402 -4.317 1.00 0.00 C ATOM 948 C PHE A 69 3.017 -6.664 -5.641 1.00 0.00 C ATOM 949 O PHE A 69 3.882 -5.795 -5.744 1.00 0.00 O ATOM 950 CB PHE A 69 3.315 -8.839 -4.463 1.00 0.00 C ATOM 951 CG PHE A 69 4.735 -8.946 -5.021 1.00 0.00 C ATOM 952 CD1 PHE A 69 5.669 -8.016 -4.687 1.00 0.00 C ATOM 953 CD2 PHE A 69 5.065 -9.973 -5.850 1.00 0.00 C ATOM 954 CE1 PHE A 69 6.988 -8.115 -5.204 1.00 0.00 C ATOM 955 CE2 PHE A 69 6.384 -10.073 -6.367 1.00 0.00 C ATOM 956 CZ PHE A 69 7.317 -9.142 -6.033 1.00 0.00 C ATOM 0 H PHE A 69 1.119 -8.342 -3.514 1.00 0.00 H new ATOM 0 HA PHE A 69 3.351 -6.859 -3.541 1.00 0.00 H new ATOM 0 HB2 PHE A 69 3.281 -9.326 -3.488 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.636 -9.387 -5.117 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.408 -7.201 -4.028 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.324 -10.712 -6.115 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.729 -7.375 -4.939 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.646 -10.888 -7.025 1.00 0.00 H new ATOM 0 HZ PHE A 69 8.320 -9.218 -6.426 1.00 0.00 H new ATOM 966 N LYS A 70 2.208 -7.037 -6.622 1.00 0.00 N ATOM 967 CA LYS A 70 2.291 -6.422 -7.936 1.00 0.00 C ATOM 968 C LYS A 70 2.176 -4.903 -7.791 1.00 0.00 C ATOM 969 O LYS A 70 3.036 -4.164 -8.267 1.00 0.00 O ATOM 970 CB LYS A 70 1.252 -7.030 -8.879 1.00 0.00 C ATOM 971 CG LYS A 70 1.469 -8.537 -9.036 1.00 0.00 C ATOM 972 CD LYS A 70 0.340 -9.172 -9.851 1.00 0.00 C ATOM 973 CE LYS A 70 0.899 -10.008 -11.004 1.00 0.00 C ATOM 974 NZ LYS A 70 -0.087 -11.026 -11.431 1.00 0.00 N ATOM 0 H LYS A 70 1.492 -7.758 -6.533 1.00 0.00 H new ATOM 0 HA LYS A 70 3.259 -6.627 -8.392 1.00 0.00 H new ATOM 0 HB2 LYS A 70 0.250 -6.842 -8.492 1.00 0.00 H new ATOM 0 HB3 LYS A 70 1.314 -6.547 -9.854 1.00 0.00 H new ATOM 0 HG2 LYS A 70 2.425 -8.721 -9.527 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.520 -9.005 -8.053 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.271 -9.801 -9.204 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -0.312 -8.392 -10.245 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.148 -9.359 -11.844 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.823 -10.496 -10.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.308 -11.585 -12.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.305 -11.655 -10.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.958 -10.554 -11.747 1.00 0.00 H new ATOM 988 N ASP A 71 1.106 -4.483 -7.132 1.00 0.00 N ATOM 989 CA ASP A 71 0.868 -3.066 -6.919 1.00 0.00 C ATOM 990 C ASP A 71 1.811 -2.552 -5.830 1.00 0.00 C ATOM 991 O ASP A 71 1.956 -1.345 -5.647 1.00 0.00 O ATOM 992 CB ASP A 71 -0.569 -2.813 -6.458 1.00 0.00 C ATOM 993 CG ASP A 71 -0.892 -1.356 -6.119 1.00 0.00 C ATOM 994 OD1 ASP A 71 -0.877 -0.537 -7.064 1.00 0.00 O ATOM 995 OD2 ASP A 71 -1.147 -1.094 -4.924 1.00 0.00 O ATOM 0 H ASP A 71 0.395 -5.099 -6.739 1.00 0.00 H new ATOM 0 HA ASP A 71 1.041 -2.549 -7.863 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.250 -3.148 -7.240 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.766 -3.427 -5.579 1.00 0.00 H new ATOM 1000 N GLY A 72 2.430 -3.496 -5.134 1.00 0.00 N ATOM 1001 CA GLY A 72 3.356 -3.154 -4.068 1.00 0.00 C ATOM 1002 C GLY A 72 4.161 -1.902 -4.422 1.00 0.00 C ATOM 1003 O GLY A 72 4.538 -1.132 -3.539 1.00 0.00 O ATOM 0 H GLY A 72 2.308 -4.497 -5.288 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.805 -2.987 -3.142 1.00 0.00 H new ATOM 0 HA3 GLY A 72 4.034 -3.988 -3.889 1.00 0.00 H new ATOM 1007 N ARG A 73 4.400 -1.736 -5.714 1.00 0.00 N ATOM 1008 CA ARG A 73 5.154 -0.591 -6.195 1.00 0.00 C ATOM 1009 C ARG A 73 4.790 0.659 -5.391 1.00 0.00 C ATOM 1010 O ARG A 73 5.620 1.550 -5.213 1.00 0.00 O ATOM 1011 CB ARG A 73 4.878 -0.333 -7.678 1.00 0.00 C ATOM 1012 CG ARG A 73 3.380 -0.150 -7.933 1.00 0.00 C ATOM 1013 CD ARG A 73 3.121 0.324 -9.364 1.00 0.00 C ATOM 1014 NE ARG A 73 2.782 -0.831 -10.226 1.00 0.00 N ATOM 1015 CZ ARG A 73 2.810 -0.803 -11.565 1.00 0.00 C ATOM 1016 NH1 ARG A 73 3.163 0.321 -12.205 1.00 0.00 N ATOM 1017 NH2 ARG A 73 2.486 -1.898 -12.266 1.00 0.00 N ATOM 0 H ARG A 73 4.085 -2.376 -6.443 1.00 0.00 H new ATOM 0 HA ARG A 73 6.213 -0.814 -6.068 1.00 0.00 H new ATOM 0 HB2 ARG A 73 5.417 0.557 -8.003 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.252 -1.167 -8.272 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.860 -1.092 -7.759 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.973 0.574 -7.227 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.306 1.048 -9.374 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.003 0.832 -9.753 1.00 0.00 H new ATOM 0 HE ARG A 73 2.510 -1.703 -9.772 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.410 1.155 -11.672 1.00 0.00 H new ATOM 0 HH12 ARG A 73 3.184 0.342 -13.225 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.218 -2.754 -11.780 1.00 0.00 H new ATOM 0 HH22 ARG A 73 2.508 -1.876 -13.286 1.00 0.00 H new ATOM 1031 N LEU A 74 3.550 0.685 -4.926 1.00 0.00 N ATOM 1032 CA LEU A 74 3.067 1.811 -4.145 1.00 0.00 C ATOM 1033 C LEU A 74 3.849 1.889 -2.833 1.00 0.00 C ATOM 1034 O LEU A 74 4.759 1.094 -2.600 1.00 0.00 O ATOM 1035 CB LEU A 74 1.552 1.719 -3.953 1.00 0.00 C ATOM 1036 CG LEU A 74 0.696 2.178 -5.136 1.00 0.00 C ATOM 1037 CD1 LEU A 74 -0.771 1.794 -4.934 1.00 0.00 C ATOM 1038 CD2 LEU A 74 0.867 3.678 -5.386 1.00 0.00 C ATOM 0 H LEU A 74 2.865 -0.056 -5.075 1.00 0.00 H new ATOM 0 HA LEU A 74 3.242 2.746 -4.677 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.297 0.684 -3.726 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.280 2.313 -3.081 1.00 0.00 H new ATOM 0 HG LEU A 74 1.043 1.660 -6.030 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.357 2.132 -5.789 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -0.854 0.711 -4.842 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.149 2.265 -4.026 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.248 3.979 -6.232 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.562 4.232 -4.498 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.913 3.893 -5.607 1.00 0.00 H new ATOM 1050 N ARG A 75 3.467 2.854 -2.009 1.00 0.00 N ATOM 1051 CA ARG A 75 4.121 3.046 -0.726 1.00 0.00 C ATOM 1052 C ARG A 75 3.079 3.186 0.386 1.00 0.00 C ATOM 1053 O ARG A 75 2.136 3.966 0.263 1.00 0.00 O ATOM 1054 CB ARG A 75 5.010 4.291 -0.742 1.00 0.00 C ATOM 1055 CG ARG A 75 5.941 4.284 -1.957 1.00 0.00 C ATOM 1056 CD ARG A 75 7.256 5.000 -1.644 1.00 0.00 C ATOM 1057 NE ARG A 75 7.700 5.781 -2.820 1.00 0.00 N ATOM 1058 CZ ARG A 75 8.769 6.588 -2.826 1.00 0.00 C ATOM 1059 NH1 ARG A 75 9.512 6.725 -1.719 1.00 0.00 N ATOM 1060 NH2 ARG A 75 9.097 7.258 -3.940 1.00 0.00 N ATOM 0 H ARG A 75 2.712 3.512 -2.205 1.00 0.00 H new ATOM 0 HA ARG A 75 4.743 2.171 -0.537 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.388 5.186 -0.761 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.601 4.332 0.173 1.00 0.00 H new ATOM 0 HG2 ARG A 75 6.145 3.256 -2.257 1.00 0.00 H new ATOM 0 HG3 ARG A 75 5.449 4.771 -2.799 1.00 0.00 H new ATOM 0 HD2 ARG A 75 7.125 5.661 -0.787 1.00 0.00 H new ATOM 0 HD3 ARG A 75 8.020 4.272 -1.371 1.00 0.00 H new ATOM 0 HE ARG A 75 7.158 5.700 -3.680 1.00 0.00 H new ATOM 0 HH11 ARG A 75 9.263 6.215 -0.872 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.326 7.340 -1.724 1.00 0.00 H new ATOM 0 HH21 ARG A 75 8.532 7.153 -4.783 1.00 0.00 H new ATOM 0 HH22 ARG A 75 9.911 7.873 -3.944 1.00 0.00 H new ATOM 1074 N MET A 76 3.285 2.419 1.446 1.00 0.00 N ATOM 1075 CA MET A 76 2.375 2.448 2.578 1.00 0.00 C ATOM 1076 C MET A 76 2.101 3.885 3.025 1.00 0.00 C ATOM 1077 O MET A 76 2.631 4.831 2.444 1.00 0.00 O ATOM 1078 CB MET A 76 2.981 1.658 3.741 1.00 0.00 C ATOM 1079 CG MET A 76 4.452 2.026 3.945 1.00 0.00 C ATOM 1080 SD MET A 76 5.488 0.615 3.594 1.00 0.00 S ATOM 1081 CE MET A 76 7.045 1.206 4.238 1.00 0.00 C ATOM 0 H MET A 76 4.069 1.774 1.545 1.00 0.00 H new ATOM 0 HA MET A 76 1.431 1.996 2.273 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.421 1.861 4.654 1.00 0.00 H new ATOM 0 HB3 MET A 76 2.893 0.589 3.544 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.721 2.857 3.293 1.00 0.00 H new ATOM 0 HG3 MET A 76 4.613 2.360 4.970 1.00 0.00 H new ATOM 0 HE1 MET A 76 7.810 0.442 4.099 1.00 0.00 H new ATOM 0 HE2 MET A 76 7.337 2.113 3.708 1.00 0.00 H new ATOM 0 HE3 MET A 76 6.940 1.425 5.301 1.00 0.00 H new ATOM 1091 N ASN A 77 1.274 4.004 4.053 1.00 0.00 N ATOM 1092 CA ASN A 77 0.924 5.310 4.585 1.00 0.00 C ATOM 1093 C ASN A 77 0.182 6.110 3.512 1.00 0.00 C ATOM 1094 O ASN A 77 0.176 7.339 3.542 1.00 0.00 O ATOM 1095 CB ASN A 77 2.174 6.097 4.981 1.00 0.00 C ATOM 1096 CG ASN A 77 2.468 5.944 6.474 1.00 0.00 C ATOM 1097 OD1 ASN A 77 2.263 4.716 6.943 1.00 0.00 O flip ATOM 1098 ND2 ASN A 77 2.856 6.878 7.156 1.00 0.00 N flip ATOM 0 H ASN A 77 0.836 3.217 4.532 1.00 0.00 H new ATOM 0 HA ASN A 77 0.299 5.159 5.465 1.00 0.00 H new ATOM 0 HB2 ASN A 77 3.028 5.747 4.401 1.00 0.00 H new ATOM 0 HB3 ASN A 77 2.036 7.151 4.740 1.00 0.00 H new ATOM 0 HD21 ASN A 77 2.993 7.796 6.733 1.00 0.00 H new ATOM 0 HD22 ASN A 77 3.043 6.741 8.149 1.00 0.00 H new ATOM 1105 N ASP A 78 -0.426 5.379 2.589 1.00 0.00 N ATOM 1106 CA ASP A 78 -1.170 6.005 1.509 1.00 0.00 C ATOM 1107 C ASP A 78 -2.625 6.197 1.941 1.00 0.00 C ATOM 1108 O ASP A 78 -3.334 5.225 2.196 1.00 0.00 O ATOM 1109 CB ASP A 78 -1.161 5.129 0.254 1.00 0.00 C ATOM 1110 CG ASP A 78 -0.359 5.691 -0.921 1.00 0.00 C ATOM 1111 OD1 ASP A 78 -0.045 6.899 -0.868 1.00 0.00 O ATOM 1112 OD2 ASP A 78 -0.079 4.899 -1.847 1.00 0.00 O ATOM 0 H ASP A 78 -0.419 4.359 2.567 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.698 6.962 1.285 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.757 4.151 0.515 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.190 4.973 -0.069 1.00 0.00 H new ATOM 1117 N GLN A 79 -3.026 7.458 2.009 1.00 0.00 N ATOM 1118 CA GLN A 79 -4.384 7.790 2.406 1.00 0.00 C ATOM 1119 C GLN A 79 -5.370 7.403 1.302 1.00 0.00 C ATOM 1120 O GLN A 79 -5.179 7.761 0.141 1.00 0.00 O ATOM 1121 CB GLN A 79 -4.506 9.275 2.754 1.00 0.00 C ATOM 1122 CG GLN A 79 -5.798 9.554 3.525 1.00 0.00 C ATOM 1123 CD GLN A 79 -5.920 11.039 3.871 1.00 0.00 C ATOM 1124 OE1 GLN A 79 -4.980 11.808 3.759 1.00 0.00 O ATOM 1125 NE2 GLN A 79 -7.129 11.397 4.296 1.00 0.00 N ATOM 0 H GLN A 79 -2.435 8.262 1.796 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.629 7.219 3.302 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.648 9.584 3.351 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.488 9.869 1.840 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.656 9.244 2.928 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.815 8.961 4.440 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.872 10.701 4.366 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -7.313 12.367 4.552 1.00 0.00 H new ATOM 1134 N LEU A 80 -6.402 6.676 1.703 1.00 0.00 N ATOM 1135 CA LEU A 80 -7.418 6.236 0.762 1.00 0.00 C ATOM 1136 C LEU A 80 -8.547 7.268 0.717 1.00 0.00 C ATOM 1137 O LEU A 80 -9.388 7.312 1.613 1.00 0.00 O ATOM 1138 CB LEU A 80 -7.891 4.822 1.105 1.00 0.00 C ATOM 1139 CG LEU A 80 -6.895 3.695 0.824 1.00 0.00 C ATOM 1140 CD1 LEU A 80 -5.704 3.764 1.781 1.00 0.00 C ATOM 1141 CD2 LEU A 80 -7.586 2.330 0.865 1.00 0.00 C ATOM 0 H LEU A 80 -6.557 6.380 2.667 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.003 6.173 -0.244 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.152 4.794 2.163 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.805 4.620 0.546 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.504 3.828 -0.185 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.012 2.952 1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.194 4.719 1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.057 3.670 2.808 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.856 1.546 0.662 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.023 2.173 1.851 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.372 2.297 0.111 1.00 0.00 H new ATOM 1153 N ILE A 81 -8.529 8.073 -0.335 1.00 0.00 N ATOM 1154 CA ILE A 81 -9.541 9.101 -0.508 1.00 0.00 C ATOM 1155 C ILE A 81 -10.794 8.479 -1.126 1.00 0.00 C ATOM 1156 O ILE A 81 -11.757 9.183 -1.427 1.00 0.00 O ATOM 1157 CB ILE A 81 -8.978 10.276 -1.311 1.00 0.00 C ATOM 1158 CG1 ILE A 81 -8.307 9.791 -2.597 1.00 0.00 C ATOM 1159 CG2 ILE A 81 -8.033 11.122 -0.455 1.00 0.00 C ATOM 1160 CD1 ILE A 81 -8.185 10.927 -3.614 1.00 0.00 C ATOM 0 H ILE A 81 -7.829 8.034 -1.076 1.00 0.00 H new ATOM 0 HA ILE A 81 -9.833 9.514 0.457 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.809 10.918 -1.605 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.317 9.395 -2.368 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -8.886 8.974 -3.027 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.647 11.950 -1.049 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.575 11.515 0.406 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -7.203 10.505 -0.111 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.705 10.555 -4.519 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.178 11.304 -3.859 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.585 11.732 -3.190 1.00 0.00 H new ATOM 1172 N ALA A 82 -10.742 7.166 -1.297 1.00 0.00 N ATOM 1173 CA ALA A 82 -11.861 6.441 -1.873 1.00 0.00 C ATOM 1174 C ALA A 82 -11.389 5.057 -2.322 1.00 0.00 C ATOM 1175 O ALA A 82 -10.208 4.732 -2.208 1.00 0.00 O ATOM 1176 CB ALA A 82 -12.459 7.255 -3.023 1.00 0.00 C ATOM 0 H ALA A 82 -9.942 6.585 -1.046 1.00 0.00 H new ATOM 0 HA ALA A 82 -12.647 6.297 -1.132 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -13.299 6.711 -3.456 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.805 8.217 -2.646 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.699 7.417 -3.788 1.00 0.00 H new ATOM 1182 N VAL A 83 -12.336 4.278 -2.825 1.00 0.00 N ATOM 1183 CA VAL A 83 -12.032 2.936 -3.292 1.00 0.00 C ATOM 1184 C VAL A 83 -13.156 2.454 -4.212 1.00 0.00 C ATOM 1185 O VAL A 83 -14.317 2.408 -3.808 1.00 0.00 O ATOM 1186 CB VAL A 83 -11.797 2.007 -2.099 1.00 0.00 C ATOM 1187 CG1 VAL A 83 -12.917 2.147 -1.066 1.00 0.00 C ATOM 1188 CG2 VAL A 83 -11.649 0.555 -2.556 1.00 0.00 C ATOM 0 H VAL A 83 -13.314 4.551 -2.919 1.00 0.00 H new ATOM 0 HA VAL A 83 -11.111 2.934 -3.875 1.00 0.00 H new ATOM 0 HB VAL A 83 -10.863 2.304 -1.622 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -12.726 1.476 -0.229 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -12.954 3.175 -0.706 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.871 1.890 -1.526 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -11.483 -0.084 -1.689 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -12.558 0.241 -3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -10.801 0.472 -3.236 1.00 0.00 H new ATOM 1198 N ASN A 84 -12.771 2.108 -5.431 1.00 0.00 N ATOM 1199 CA ASN A 84 -13.732 1.631 -6.412 1.00 0.00 C ATOM 1200 C ASN A 84 -14.776 2.719 -6.667 1.00 0.00 C ATOM 1201 O ASN A 84 -15.838 2.447 -7.225 1.00 0.00 O ATOM 1202 CB ASN A 84 -14.461 0.384 -5.908 1.00 0.00 C ATOM 1203 CG ASN A 84 -13.758 -0.890 -6.378 1.00 0.00 C ATOM 1204 OD1 ASN A 84 -13.313 -1.659 -5.388 1.00 0.00 O flip ATOM 1205 ND2 ASN A 84 -13.628 -1.158 -7.561 1.00 0.00 N flip ATOM 0 H ASN A 84 -11.807 2.148 -5.762 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.189 1.386 -7.325 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -14.504 0.399 -4.819 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -15.490 0.390 -6.268 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -13.994 -0.523 -8.271 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -13.154 -2.017 -7.840 1.00 0.00 H new ATOM 1212 N GLY A 85 -14.438 3.930 -6.246 1.00 0.00 N ATOM 1213 CA GLY A 85 -15.334 5.060 -6.422 1.00 0.00 C ATOM 1214 C GLY A 85 -16.038 5.411 -5.110 1.00 0.00 C ATOM 1215 O GLY A 85 -16.624 6.485 -4.984 1.00 0.00 O ATOM 0 H GLY A 85 -13.556 4.152 -5.784 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.771 5.923 -6.779 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.076 4.825 -7.185 1.00 0.00 H new ATOM 1219 N GLU A 86 -15.958 4.484 -4.167 1.00 0.00 N ATOM 1220 CA GLU A 86 -16.581 4.682 -2.869 1.00 0.00 C ATOM 1221 C GLU A 86 -15.673 5.521 -1.967 1.00 0.00 C ATOM 1222 O GLU A 86 -14.468 5.283 -1.899 1.00 0.00 O ATOM 1223 CB GLU A 86 -16.918 3.342 -2.212 1.00 0.00 C ATOM 1224 CG GLU A 86 -17.730 3.547 -0.932 1.00 0.00 C ATOM 1225 CD GLU A 86 -18.639 2.347 -0.660 1.00 0.00 C ATOM 1226 OE1 GLU A 86 -18.267 1.241 -1.108 1.00 0.00 O ATOM 1227 OE2 GLU A 86 -19.685 2.563 -0.010 1.00 0.00 O ATOM 0 H GLU A 86 -15.472 3.594 -4.276 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.516 5.223 -3.016 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.482 2.723 -2.909 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.998 2.805 -1.981 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -17.055 3.695 -0.089 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -18.332 4.451 -1.020 1.00 0.00 H new ATOM 1234 N THR A 87 -16.286 6.486 -1.297 1.00 0.00 N ATOM 1235 CA THR A 87 -15.548 7.362 -0.403 1.00 0.00 C ATOM 1236 C THR A 87 -15.150 6.611 0.869 1.00 0.00 C ATOM 1237 O THR A 87 -15.628 5.505 1.118 1.00 0.00 O ATOM 1238 CB THR A 87 -16.410 8.597 -0.134 1.00 0.00 C ATOM 1239 OG1 THR A 87 -15.469 9.665 -0.056 1.00 0.00 O ATOM 1240 CG2 THR A 87 -17.058 8.569 1.251 1.00 0.00 C ATOM 0 H THR A 87 -17.286 6.680 -1.355 1.00 0.00 H new ATOM 0 HA THR A 87 -14.613 7.692 -0.855 1.00 0.00 H new ATOM 0 HB THR A 87 -17.186 8.671 -0.895 1.00 0.00 H new ATOM 0 HG1 THR A 87 -15.942 10.506 0.115 1.00 0.00 H new ATOM 0 HG21 THR A 87 -17.658 9.468 1.390 1.00 0.00 H new ATOM 0 HG22 THR A 87 -17.696 7.690 1.336 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.282 8.529 2.015 1.00 0.00 H new ATOM 1248 N LEU A 88 -14.277 7.242 1.641 1.00 0.00 N ATOM 1249 CA LEU A 88 -13.808 6.647 2.882 1.00 0.00 C ATOM 1250 C LEU A 88 -13.685 7.736 3.949 1.00 0.00 C ATOM 1251 O LEU A 88 -14.141 7.558 5.078 1.00 0.00 O ATOM 1252 CB LEU A 88 -12.513 5.867 2.646 1.00 0.00 C ATOM 1253 CG LEU A 88 -12.611 4.678 1.689 1.00 0.00 C ATOM 1254 CD1 LEU A 88 -11.233 4.298 1.143 1.00 0.00 C ATOM 1255 CD2 LEU A 88 -13.309 3.492 2.357 1.00 0.00 C ATOM 0 H LEU A 88 -13.882 8.159 1.432 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.529 5.918 3.252 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.762 6.557 2.261 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.150 5.505 3.608 1.00 0.00 H new ATOM 0 HG LEU A 88 -13.224 4.975 0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -11.331 3.450 0.465 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.809 5.145 0.605 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.576 4.028 1.970 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.365 2.660 1.655 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -12.744 3.186 3.237 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.316 3.784 2.656 1.00 0.00 H new ATOM 1267 N LEU A 89 -13.066 8.839 3.555 1.00 0.00 N ATOM 1268 CA LEU A 89 -12.877 9.957 4.465 1.00 0.00 C ATOM 1269 C LEU A 89 -14.196 10.254 5.181 1.00 0.00 C ATOM 1270 O LEU A 89 -14.204 10.557 6.373 1.00 0.00 O ATOM 1271 CB LEU A 89 -12.296 11.161 3.720 1.00 0.00 C ATOM 1272 CG LEU A 89 -11.232 10.848 2.667 1.00 0.00 C ATOM 1273 CD1 LEU A 89 -10.386 12.085 2.358 1.00 0.00 C ATOM 1274 CD2 LEU A 89 -10.371 9.657 3.093 1.00 0.00 C ATOM 0 H LEU A 89 -12.689 8.983 2.618 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.147 9.704 5.234 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.115 11.692 3.234 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.864 11.843 4.453 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.738 10.565 1.744 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.637 11.835 1.606 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -11.029 12.880 1.980 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -9.889 12.422 3.267 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.623 9.456 2.326 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.873 9.887 4.035 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.003 8.779 3.222 1.00 0.00 H new ATOM 1286 N GLY A 90 -15.279 10.157 4.424 1.00 0.00 N ATOM 1287 CA GLY A 90 -16.600 10.412 4.973 1.00 0.00 C ATOM 1288 C GLY A 90 -16.954 9.385 6.050 1.00 0.00 C ATOM 1289 O GLY A 90 -17.690 9.692 6.987 1.00 0.00 O ATOM 0 H GLY A 90 -15.269 9.905 3.436 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -16.634 11.415 5.397 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -17.342 10.378 4.175 1.00 0.00 H new ATOM 1293 N LYS A 91 -16.413 8.187 5.882 1.00 0.00 N ATOM 1294 CA LYS A 91 -16.663 7.114 6.828 1.00 0.00 C ATOM 1295 C LYS A 91 -15.634 7.187 7.959 1.00 0.00 C ATOM 1296 O LYS A 91 -14.856 8.137 8.034 1.00 0.00 O ATOM 1297 CB LYS A 91 -16.692 5.763 6.110 1.00 0.00 C ATOM 1298 CG LYS A 91 -17.245 5.908 4.691 1.00 0.00 C ATOM 1299 CD LYS A 91 -17.481 4.538 4.052 1.00 0.00 C ATOM 1300 CE LYS A 91 -18.618 4.599 3.029 1.00 0.00 C ATOM 1301 NZ LYS A 91 -19.541 3.456 3.212 1.00 0.00 N ATOM 0 H LYS A 91 -15.802 7.936 5.104 1.00 0.00 H new ATOM 0 HA LYS A 91 -17.647 7.229 7.283 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -15.686 5.346 6.071 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -17.306 5.061 6.674 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.180 6.467 4.717 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.547 6.482 4.082 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.567 4.197 3.565 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.721 3.808 4.825 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -19.164 5.536 3.138 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.208 4.585 2.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -20.268 3.474 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -19.007 2.566 3.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -19.997 3.524 4.144 1.00 0.00 H new ATOM 1315 N SER A 92 -15.664 6.172 8.810 1.00 0.00 N ATOM 1316 CA SER A 92 -14.745 6.109 9.933 1.00 0.00 C ATOM 1317 C SER A 92 -13.594 5.153 9.614 1.00 0.00 C ATOM 1318 O SER A 92 -13.485 4.659 8.493 1.00 0.00 O ATOM 1319 CB SER A 92 -15.463 5.668 11.209 1.00 0.00 C ATOM 1320 OG SER A 92 -16.600 6.480 11.490 1.00 0.00 O ATOM 0 H SER A 92 -16.311 5.386 8.744 1.00 0.00 H new ATOM 0 HA SER A 92 -14.343 7.108 10.102 1.00 0.00 H new ATOM 0 HB2 SER A 92 -15.776 4.629 11.108 1.00 0.00 H new ATOM 0 HB3 SER A 92 -14.770 5.712 12.049 1.00 0.00 H new ATOM 0 HG SER A 92 -17.032 6.165 12.311 1.00 0.00 H new ATOM 1326 N ASN A 93 -12.764 4.920 10.620 1.00 0.00 N ATOM 1327 CA ASN A 93 -11.625 4.032 10.461 1.00 0.00 C ATOM 1328 C ASN A 93 -12.123 2.592 10.320 1.00 0.00 C ATOM 1329 O ASN A 93 -11.473 1.767 9.681 1.00 0.00 O ATOM 1330 CB ASN A 93 -10.702 4.096 11.679 1.00 0.00 C ATOM 1331 CG ASN A 93 -9.633 5.176 11.501 1.00 0.00 C ATOM 1332 OD1 ASN A 93 -9.064 5.354 10.436 1.00 0.00 O ATOM 1333 ND2 ASN A 93 -9.392 5.886 12.600 1.00 0.00 N ATOM 0 H ASN A 93 -12.858 5.331 11.549 1.00 0.00 H new ATOM 0 HA ASN A 93 -11.074 4.346 9.575 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -11.289 4.304 12.574 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -10.224 3.128 11.829 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -8.695 6.631 12.583 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -9.904 5.685 13.459 1.00 0.00 H new ATOM 1340 N HIS A 94 -13.271 2.335 10.929 1.00 0.00 N ATOM 1341 CA HIS A 94 -13.864 1.009 10.879 1.00 0.00 C ATOM 1342 C HIS A 94 -14.691 0.864 9.601 1.00 0.00 C ATOM 1343 O HIS A 94 -14.348 0.075 8.721 1.00 0.00 O ATOM 1344 CB HIS A 94 -14.676 0.729 12.146 1.00 0.00 C ATOM 1345 CG HIS A 94 -15.818 -0.237 11.942 1.00 0.00 C ATOM 1346 ND1 HIS A 94 -15.631 -1.539 11.513 1.00 0.00 N ATOM 1347 CD2 HIS A 94 -17.162 -0.076 12.113 1.00 0.00 C ATOM 1348 CE1 HIS A 94 -16.816 -2.127 11.433 1.00 0.00 C ATOM 1349 NE2 HIS A 94 -17.763 -1.219 11.804 1.00 0.00 N ATOM 0 H HIS A 94 -13.806 3.022 11.460 1.00 0.00 H new ATOM 0 HA HIS A 94 -13.077 0.256 10.848 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -14.010 0.332 12.912 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -15.073 1.670 12.526 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -17.653 0.827 12.443 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -16.999 -3.147 11.128 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -18.768 -1.390 11.839 1.00 0.00 H new ATOM 1357 N GLU A 95 -15.765 1.637 9.538 1.00 0.00 N ATOM 1358 CA GLU A 95 -16.644 1.605 8.381 1.00 0.00 C ATOM 1359 C GLU A 95 -15.822 1.541 7.092 1.00 0.00 C ATOM 1360 O GLU A 95 -15.940 0.589 6.323 1.00 0.00 O ATOM 1361 CB GLU A 95 -17.585 2.811 8.373 1.00 0.00 C ATOM 1362 CG GLU A 95 -18.257 2.991 9.736 1.00 0.00 C ATOM 1363 CD GLU A 95 -19.701 3.469 9.576 1.00 0.00 C ATOM 1364 OE1 GLU A 95 -19.873 4.681 9.324 1.00 0.00 O ATOM 1365 OE2 GLU A 95 -20.601 2.612 9.709 1.00 0.00 O ATOM 0 H GLU A 95 -16.047 2.290 10.270 1.00 0.00 H new ATOM 0 HA GLU A 95 -17.259 0.707 8.441 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -17.026 3.711 8.117 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.345 2.678 7.603 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.241 2.047 10.281 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -17.695 3.712 10.330 1.00 0.00 H new ATOM 1372 N ALA A 96 -15.009 2.569 6.895 1.00 0.00 N ATOM 1373 CA ALA A 96 -14.168 2.642 5.712 1.00 0.00 C ATOM 1374 C ALA A 96 -13.615 1.251 5.399 1.00 0.00 C ATOM 1375 O ALA A 96 -14.013 0.627 4.416 1.00 0.00 O ATOM 1376 CB ALA A 96 -13.061 3.674 5.936 1.00 0.00 C ATOM 0 H ALA A 96 -14.915 3.358 7.535 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.747 2.968 4.848 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.430 3.729 5.049 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.507 4.650 6.125 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.456 3.379 6.794 1.00 0.00 H new ATOM 1382 N MET A 97 -12.704 0.805 6.252 1.00 0.00 N ATOM 1383 CA MET A 97 -12.091 -0.501 6.078 1.00 0.00 C ATOM 1384 C MET A 97 -13.147 -1.566 5.777 1.00 0.00 C ATOM 1385 O MET A 97 -12.920 -2.459 4.962 1.00 0.00 O ATOM 1386 CB MET A 97 -11.330 -0.881 7.350 1.00 0.00 C ATOM 1387 CG MET A 97 -9.985 -0.156 7.421 1.00 0.00 C ATOM 1388 SD MET A 97 -8.975 -0.605 6.019 1.00 0.00 S ATOM 1389 CE MET A 97 -7.995 -1.908 6.747 1.00 0.00 C ATOM 0 H MET A 97 -12.376 1.325 7.066 1.00 0.00 H new ATOM 0 HA MET A 97 -11.403 -0.450 5.234 1.00 0.00 H new ATOM 0 HB2 MET A 97 -11.929 -0.630 8.225 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.168 -1.959 7.373 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.144 0.922 7.435 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.472 -0.414 8.347 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.368 -2.363 5.980 1.00 0.00 H new ATOM 0 HE2 MET A 97 -7.364 -1.493 7.533 1.00 0.00 H new ATOM 0 HE3 MET A 97 -8.654 -2.664 7.173 1.00 0.00 H new ATOM 1399 N GLU A 98 -14.280 -1.438 6.452 1.00 0.00 N ATOM 1400 CA GLU A 98 -15.372 -2.379 6.267 1.00 0.00 C ATOM 1401 C GLU A 98 -15.886 -2.319 4.828 1.00 0.00 C ATOM 1402 O GLU A 98 -16.355 -3.321 4.290 1.00 0.00 O ATOM 1403 CB GLU A 98 -16.502 -2.111 7.264 1.00 0.00 C ATOM 1404 CG GLU A 98 -17.784 -1.695 6.541 1.00 0.00 C ATOM 1405 CD GLU A 98 -18.920 -1.451 7.536 1.00 0.00 C ATOM 1406 OE1 GLU A 98 -19.344 -2.443 8.168 1.00 0.00 O ATOM 1407 OE2 GLU A 98 -19.340 -0.279 7.643 1.00 0.00 O ATOM 0 H GLU A 98 -14.466 -0.697 7.128 1.00 0.00 H new ATOM 0 HA GLU A 98 -14.995 -3.384 6.456 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -16.689 -3.007 7.857 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -16.201 -1.326 7.958 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -17.602 -0.789 5.962 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -18.076 -2.472 5.834 1.00 0.00 H new ATOM 1414 N THR A 99 -15.781 -1.134 4.244 1.00 0.00 N ATOM 1415 CA THR A 99 -16.230 -0.931 2.877 1.00 0.00 C ATOM 1416 C THR A 99 -15.208 -1.500 1.891 1.00 0.00 C ATOM 1417 O THR A 99 -15.566 -2.254 0.987 1.00 0.00 O ATOM 1418 CB THR A 99 -16.494 0.564 2.684 1.00 0.00 C ATOM 1419 OG1 THR A 99 -17.884 0.709 2.961 1.00 0.00 O ATOM 1420 CG2 THR A 99 -16.358 0.998 1.223 1.00 0.00 C ATOM 0 H THR A 99 -15.392 -0.305 4.693 1.00 0.00 H new ATOM 0 HA THR A 99 -17.158 -1.468 2.681 1.00 0.00 H new ATOM 0 HB THR A 99 -15.801 1.138 3.299 1.00 0.00 H new ATOM 0 HG1 THR A 99 -18.363 0.914 2.131 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.555 2.067 1.141 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.347 0.788 0.874 1.00 0.00 H new ATOM 0 HG23 THR A 99 -17.075 0.449 0.612 1.00 0.00 H new ATOM 1428 N LEU A 100 -13.957 -1.116 2.097 1.00 0.00 N ATOM 1429 CA LEU A 100 -12.881 -1.579 1.237 1.00 0.00 C ATOM 1430 C LEU A 100 -13.091 -3.060 0.917 1.00 0.00 C ATOM 1431 O LEU A 100 -13.469 -3.411 -0.199 1.00 0.00 O ATOM 1432 CB LEU A 100 -11.522 -1.272 1.867 1.00 0.00 C ATOM 1433 CG LEU A 100 -10.331 -1.228 0.907 1.00 0.00 C ATOM 1434 CD1 LEU A 100 -10.282 0.103 0.155 1.00 0.00 C ATOM 1435 CD2 LEU A 100 -9.022 -1.519 1.642 1.00 0.00 C ATOM 0 H LEU A 100 -13.664 -0.490 2.847 1.00 0.00 H new ATOM 0 HA LEU A 100 -12.894 -1.043 0.288 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.589 -0.310 2.376 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.320 -2.023 2.631 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.464 -2.014 0.163 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.426 0.108 -0.520 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -11.199 0.230 -0.420 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.185 0.921 0.869 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.192 -1.481 0.936 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.869 -0.773 2.422 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -9.070 -2.510 2.093 1.00 0.00 H new ATOM 1447 N ARG A 101 -12.835 -3.890 1.918 1.00 0.00 N ATOM 1448 CA ARG A 101 -12.991 -5.326 1.758 1.00 0.00 C ATOM 1449 C ARG A 101 -14.318 -5.642 1.065 1.00 0.00 C ATOM 1450 O ARG A 101 -14.341 -6.324 0.041 1.00 0.00 O ATOM 1451 CB ARG A 101 -12.948 -6.039 3.111 1.00 0.00 C ATOM 1452 CG ARG A 101 -13.022 -7.557 2.934 1.00 0.00 C ATOM 1453 CD ARG A 101 -12.923 -8.272 4.282 1.00 0.00 C ATOM 1454 NE ARG A 101 -14.268 -8.400 4.887 1.00 0.00 N ATOM 1455 CZ ARG A 101 -15.252 -9.154 4.377 1.00 0.00 C ATOM 1456 NH1 ARG A 101 -15.048 -9.851 3.251 1.00 0.00 N ATOM 1457 NH2 ARG A 101 -16.441 -9.210 4.994 1.00 0.00 N ATOM 0 H ARG A 101 -12.521 -3.595 2.843 1.00 0.00 H new ATOM 0 HA ARG A 101 -12.163 -5.683 1.145 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -12.030 -5.775 3.636 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -13.778 -5.701 3.731 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -13.959 -7.824 2.445 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -12.215 -7.890 2.282 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -12.480 -9.259 4.148 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -12.266 -7.716 4.951 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.458 -7.882 5.745 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -14.144 -9.808 2.781 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -15.797 -10.425 2.863 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -16.596 -8.679 5.851 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -17.190 -9.784 4.606 1.00 0.00 H new ATOM 1471 N ARG A 102 -15.391 -5.131 1.650 1.00 0.00 N ATOM 1472 CA ARG A 102 -16.719 -5.350 1.101 1.00 0.00 C ATOM 1473 C ARG A 102 -16.694 -5.206 -0.422 1.00 0.00 C ATOM 1474 O ARG A 102 -17.313 -5.996 -1.134 1.00 0.00 O ATOM 1475 CB ARG A 102 -17.726 -4.357 1.684 1.00 0.00 C ATOM 1476 CG ARG A 102 -19.161 -4.774 1.354 1.00 0.00 C ATOM 1477 CD ARG A 102 -20.099 -4.487 2.528 1.00 0.00 C ATOM 1478 NE ARG A 102 -21.067 -3.431 2.155 1.00 0.00 N ATOM 1479 CZ ARG A 102 -22.184 -3.159 2.844 1.00 0.00 C ATOM 1480 NH1 ARG A 102 -22.480 -3.863 3.945 1.00 0.00 N ATOM 1481 NH2 ARG A 102 -23.004 -2.183 2.432 1.00 0.00 N ATOM 0 H ARG A 102 -15.368 -4.566 2.499 1.00 0.00 H new ATOM 0 HA ARG A 102 -17.026 -6.361 1.369 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.600 -4.298 2.765 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -17.532 -3.361 1.286 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.505 -4.238 0.470 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -19.188 -5.837 1.113 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -20.630 -5.396 2.810 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -19.522 -4.172 3.397 1.00 0.00 H new ATOM 0 HE ARG A 102 -20.872 -2.876 1.322 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -21.855 -4.606 4.259 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.330 -3.656 4.469 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -22.778 -1.647 1.594 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -23.854 -1.976 2.956 1.00 0.00 H new ATOM 1495 N SER A 103 -15.972 -4.193 -0.877 1.00 0.00 N ATOM 1496 CA SER A 103 -15.858 -3.936 -2.303 1.00 0.00 C ATOM 1497 C SER A 103 -15.079 -5.066 -2.978 1.00 0.00 C ATOM 1498 O SER A 103 -15.511 -5.599 -3.999 1.00 0.00 O ATOM 1499 CB SER A 103 -15.178 -2.591 -2.567 1.00 0.00 C ATOM 1500 OG SER A 103 -16.120 -1.569 -2.884 1.00 0.00 O ATOM 0 H SER A 103 -15.460 -3.540 -0.284 1.00 0.00 H new ATOM 0 HA SER A 103 -16.862 -3.894 -2.724 1.00 0.00 H new ATOM 0 HB2 SER A 103 -14.605 -2.296 -1.688 1.00 0.00 H new ATOM 0 HB3 SER A 103 -14.469 -2.698 -3.388 1.00 0.00 H new ATOM 0 HG SER A 103 -15.647 -0.726 -3.044 1.00 0.00 H new ATOM 1506 N MET A 104 -13.944 -5.398 -2.381 1.00 0.00 N ATOM 1507 CA MET A 104 -13.101 -6.456 -2.912 1.00 0.00 C ATOM 1508 C MET A 104 -13.928 -7.695 -3.258 1.00 0.00 C ATOM 1509 O MET A 104 -13.555 -8.469 -4.138 1.00 0.00 O ATOM 1510 CB MET A 104 -12.034 -6.826 -1.879 1.00 0.00 C ATOM 1511 CG MET A 104 -10.949 -5.751 -1.802 1.00 0.00 C ATOM 1512 SD MET A 104 -9.960 -5.985 -0.334 1.00 0.00 S ATOM 1513 CE MET A 104 -10.212 -4.408 0.464 1.00 0.00 C ATOM 0 H MET A 104 -13.588 -4.953 -1.535 1.00 0.00 H new ATOM 0 HA MET A 104 -12.626 -6.093 -3.824 1.00 0.00 H new ATOM 0 HB2 MET A 104 -12.498 -6.950 -0.900 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.584 -7.783 -2.142 1.00 0.00 H new ATOM 0 HG2 MET A 104 -10.316 -5.798 -2.688 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.406 -4.762 -1.789 1.00 0.00 H new ATOM 0 HE1 MET A 104 -9.274 -3.853 0.478 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.962 -3.838 -0.084 1.00 0.00 H new ATOM 0 HE3 MET A 104 -10.554 -4.568 1.486 1.00 0.00 H new ATOM 1523 N SER A 105 -15.037 -7.845 -2.548 1.00 0.00 N ATOM 1524 CA SER A 105 -15.920 -8.977 -2.770 1.00 0.00 C ATOM 1525 C SER A 105 -17.069 -8.571 -3.695 1.00 0.00 C ATOM 1526 O SER A 105 -17.513 -9.363 -4.524 1.00 0.00 O ATOM 1527 CB SER A 105 -16.469 -9.514 -1.447 1.00 0.00 C ATOM 1528 OG SER A 105 -16.049 -10.854 -1.200 1.00 0.00 O ATOM 0 H SER A 105 -15.344 -7.201 -1.819 1.00 0.00 H new ATOM 0 HA SER A 105 -15.344 -9.772 -3.244 1.00 0.00 H new ATOM 0 HB2 SER A 105 -16.137 -8.873 -0.630 1.00 0.00 H new ATOM 0 HB3 SER A 105 -17.558 -9.472 -1.463 1.00 0.00 H new ATOM 0 HG SER A 105 -16.418 -11.160 -0.346 1.00 0.00 H new ATOM 1534 N MET A 106 -17.518 -7.336 -3.522 1.00 0.00 N ATOM 1535 CA MET A 106 -18.607 -6.815 -4.331 1.00 0.00 C ATOM 1536 C MET A 106 -18.140 -6.528 -5.759 1.00 0.00 C ATOM 1537 O MET A 106 -18.694 -7.064 -6.717 1.00 0.00 O ATOM 1538 CB MET A 106 -19.142 -5.529 -3.699 1.00 0.00 C ATOM 1539 CG MET A 106 -20.672 -5.530 -3.663 1.00 0.00 C ATOM 1540 SD MET A 106 -21.312 -4.372 -4.861 1.00 0.00 S ATOM 1541 CE MET A 106 -23.057 -4.725 -4.732 1.00 0.00 C ATOM 0 H MET A 106 -17.147 -6.681 -2.833 1.00 0.00 H new ATOM 0 HA MET A 106 -19.397 -7.565 -4.372 1.00 0.00 H new ATOM 0 HB2 MET A 106 -18.751 -5.427 -2.687 1.00 0.00 H new ATOM 0 HB3 MET A 106 -18.789 -4.667 -4.265 1.00 0.00 H new ATOM 0 HG2 MET A 106 -21.048 -6.531 -3.875 1.00 0.00 H new ATOM 0 HG3 MET A 106 -21.021 -5.264 -2.665 1.00 0.00 H new ATOM 0 HE1 MET A 106 -23.610 -4.084 -5.419 1.00 0.00 H new ATOM 0 HE2 MET A 106 -23.237 -5.770 -4.986 1.00 0.00 H new ATOM 0 HE3 MET A 106 -23.392 -4.537 -3.712 1.00 0.00 H new ATOM 1551 N GLU A 107 -17.124 -5.682 -5.856 1.00 0.00 N ATOM 1552 CA GLU A 107 -16.576 -5.317 -7.151 1.00 0.00 C ATOM 1553 C GLU A 107 -15.813 -6.496 -7.756 1.00 0.00 C ATOM 1554 O GLU A 107 -15.901 -6.747 -8.957 1.00 0.00 O ATOM 1555 CB GLU A 107 -15.679 -4.083 -7.038 1.00 0.00 C ATOM 1556 CG GLU A 107 -16.514 -2.807 -6.914 1.00 0.00 C ATOM 1557 CD GLU A 107 -17.008 -2.338 -8.284 1.00 0.00 C ATOM 1558 OE1 GLU A 107 -17.667 -3.157 -8.960 1.00 0.00 O ATOM 1559 OE2 GLU A 107 -16.714 -1.172 -8.625 1.00 0.00 O ATOM 0 H GLU A 107 -16.667 -5.239 -5.059 1.00 0.00 H new ATOM 0 HA GLU A 107 -17.402 -5.065 -7.816 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -15.027 -4.181 -6.170 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -15.034 -4.016 -7.914 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -17.366 -2.988 -6.259 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -15.917 -2.021 -6.450 1.00 0.00 H new ATOM 1566 N GLY A 108 -15.081 -7.190 -6.897 1.00 0.00 N ATOM 1567 CA GLY A 108 -14.302 -8.337 -7.332 1.00 0.00 C ATOM 1568 C GLY A 108 -15.214 -9.485 -7.767 1.00 0.00 C ATOM 1569 O GLY A 108 -14.743 -10.493 -8.291 1.00 0.00 O ATOM 0 H GLY A 108 -15.011 -6.980 -5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -13.654 -8.049 -8.160 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -13.654 -8.670 -6.521 1.00 0.00 H new ATOM 1573 N ASN A 109 -16.505 -9.295 -7.533 1.00 0.00 N ATOM 1574 CA ASN A 109 -17.487 -10.302 -7.895 1.00 0.00 C ATOM 1575 C ASN A 109 -17.937 -10.075 -9.339 1.00 0.00 C ATOM 1576 O ASN A 109 -17.663 -10.895 -10.215 1.00 0.00 O ATOM 1577 CB ASN A 109 -18.722 -10.215 -6.996 1.00 0.00 C ATOM 1578 CG ASN A 109 -18.731 -11.345 -5.965 1.00 0.00 C ATOM 1579 OD1 ASN A 109 -18.228 -12.432 -6.193 1.00 0.00 O ATOM 1580 ND2 ASN A 109 -19.330 -11.028 -4.820 1.00 0.00 N ATOM 0 H ASN A 109 -16.893 -8.458 -7.097 1.00 0.00 H new ATOM 0 HA ASN A 109 -17.023 -11.282 -7.778 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -18.737 -9.252 -6.485 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -19.624 -10.267 -7.606 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -19.388 -11.714 -4.068 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -19.731 -10.099 -4.694 1.00 0.00 H new ATOM 1587 N ILE A 110 -18.619 -8.958 -9.545 1.00 0.00 N ATOM 1588 CA ILE A 110 -19.109 -8.613 -10.868 1.00 0.00 C ATOM 1589 C ILE A 110 -17.956 -8.055 -11.705 1.00 0.00 C ATOM 1590 O ILE A 110 -17.840 -8.361 -12.891 1.00 0.00 O ATOM 1591 CB ILE A 110 -20.307 -7.667 -10.766 1.00 0.00 C ATOM 1592 CG1 ILE A 110 -19.854 -6.239 -10.456 1.00 0.00 C ATOM 1593 CG2 ILE A 110 -21.325 -8.180 -9.745 1.00 0.00 C ATOM 1594 CD1 ILE A 110 -19.515 -6.081 -8.972 1.00 0.00 C ATOM 0 H ILE A 110 -18.844 -8.280 -8.817 1.00 0.00 H new ATOM 0 HA ILE A 110 -19.476 -9.502 -11.381 1.00 0.00 H new ATOM 0 HB ILE A 110 -20.806 -7.643 -11.735 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -18.981 -5.991 -11.060 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -20.641 -5.536 -10.730 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -22.167 -7.489 -9.692 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -21.682 -9.164 -10.050 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -20.853 -8.253 -8.765 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.196 -5.057 -8.779 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.396 -6.306 -8.371 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -18.711 -6.768 -8.707 1.00 0.00 H new ATOM 1606 N ARG A 111 -17.131 -7.248 -11.054 1.00 0.00 N ATOM 1607 CA ARG A 111 -15.991 -6.645 -11.724 1.00 0.00 C ATOM 1608 C ARG A 111 -14.804 -7.610 -11.722 1.00 0.00 C ATOM 1609 O ARG A 111 -14.439 -8.153 -12.764 1.00 0.00 O ATOM 1610 CB ARG A 111 -15.579 -5.339 -11.041 1.00 0.00 C ATOM 1611 CG ARG A 111 -15.226 -4.268 -12.075 1.00 0.00 C ATOM 1612 CD ARG A 111 -15.860 -2.924 -11.710 1.00 0.00 C ATOM 1613 NE ARG A 111 -16.837 -2.527 -12.749 1.00 0.00 N ATOM 1614 CZ ARG A 111 -17.335 -1.289 -12.877 1.00 0.00 C ATOM 1615 NH1 ARG A 111 -16.952 -0.322 -12.033 1.00 0.00 N ATOM 1616 NH2 ARG A 111 -18.217 -1.020 -13.850 1.00 0.00 N ATOM 0 H ARG A 111 -17.229 -6.998 -10.070 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.286 -6.428 -12.751 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -16.391 -4.984 -10.407 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -14.723 -5.519 -10.391 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -14.143 -4.159 -12.136 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -15.571 -4.581 -13.061 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -16.356 -2.997 -10.742 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -15.087 -2.161 -11.616 1.00 0.00 H new ATOM 0 HE ARG A 111 -17.151 -3.239 -13.408 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -16.281 -0.527 -11.293 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -17.331 0.620 -12.131 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -18.509 -1.757 -14.492 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -18.597 -0.078 -13.948 1.00 0.00 H new ATOM 1630 N GLY A 112 -14.233 -7.794 -10.541 1.00 0.00 N ATOM 1631 CA GLY A 112 -13.094 -8.684 -10.390 1.00 0.00 C ATOM 1632 C GLY A 112 -11.814 -7.894 -10.113 1.00 0.00 C ATOM 1633 O GLY A 112 -10.720 -8.456 -10.118 1.00 0.00 O ATOM 0 H GLY A 112 -14.538 -7.342 -9.679 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -13.279 -9.382 -9.573 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -12.970 -9.279 -11.295 1.00 0.00 H new ATOM 1637 N MET A 113 -11.992 -6.602 -9.877 1.00 0.00 N ATOM 1638 CA MET A 113 -10.865 -5.730 -9.598 1.00 0.00 C ATOM 1639 C MET A 113 -11.237 -4.668 -8.560 1.00 0.00 C ATOM 1640 O MET A 113 -12.415 -4.460 -8.275 1.00 0.00 O ATOM 1641 CB MET A 113 -10.417 -5.045 -10.891 1.00 0.00 C ATOM 1642 CG MET A 113 -9.607 -6.004 -11.766 1.00 0.00 C ATOM 1643 SD MET A 113 -9.993 -5.732 -13.487 1.00 0.00 S ATOM 1644 CE MET A 113 -10.727 -7.308 -13.893 1.00 0.00 C ATOM 0 H MET A 113 -12.901 -6.139 -9.873 1.00 0.00 H new ATOM 0 HA MET A 113 -10.052 -6.335 -9.196 1.00 0.00 H new ATOM 0 HB2 MET A 113 -11.289 -4.693 -11.442 1.00 0.00 H new ATOM 0 HB3 MET A 113 -9.815 -4.168 -10.653 1.00 0.00 H new ATOM 0 HG2 MET A 113 -8.541 -5.853 -11.595 1.00 0.00 H new ATOM 0 HG3 MET A 113 -9.830 -7.035 -11.493 1.00 0.00 H new ATOM 0 HE1 MET A 113 -11.028 -7.310 -14.941 1.00 0.00 H new ATOM 0 HE2 MET A 113 -10.001 -8.102 -13.722 1.00 0.00 H new ATOM 0 HE3 MET A 113 -11.602 -7.475 -13.264 1.00 0.00 H new ATOM 1654 N ILE A 114 -10.210 -4.025 -8.024 1.00 0.00 N ATOM 1655 CA ILE A 114 -10.414 -2.990 -7.025 1.00 0.00 C ATOM 1656 C ILE A 114 -9.521 -1.791 -7.349 1.00 0.00 C ATOM 1657 O ILE A 114 -8.394 -1.959 -7.811 1.00 0.00 O ATOM 1658 CB ILE A 114 -10.201 -3.554 -5.619 1.00 0.00 C ATOM 1659 CG1 ILE A 114 -10.253 -2.442 -4.569 1.00 0.00 C ATOM 1660 CG2 ILE A 114 -8.901 -4.356 -5.541 1.00 0.00 C ATOM 1661 CD1 ILE A 114 -10.552 -3.012 -3.181 1.00 0.00 C ATOM 0 H ILE A 114 -9.234 -4.201 -8.263 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.444 -2.635 -7.048 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.017 -4.243 -5.400 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -9.302 -1.910 -4.550 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -11.019 -1.716 -4.841 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -8.774 -4.746 -4.531 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -8.942 -5.185 -6.247 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.059 -3.710 -5.789 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.583 -2.201 -2.454 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -11.515 -3.523 -3.197 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -9.771 -3.719 -2.902 1.00 0.00 H new ATOM 1673 N GLN A 115 -10.058 -0.607 -7.094 1.00 0.00 N ATOM 1674 CA GLN A 115 -9.324 0.620 -7.352 1.00 0.00 C ATOM 1675 C GLN A 115 -9.031 1.350 -6.040 1.00 0.00 C ATOM 1676 O GLN A 115 -9.879 1.397 -5.149 1.00 0.00 O ATOM 1677 CB GLN A 115 -10.088 1.522 -8.323 1.00 0.00 C ATOM 1678 CG GLN A 115 -9.413 2.889 -8.448 1.00 0.00 C ATOM 1679 CD GLN A 115 -10.316 3.882 -9.183 1.00 0.00 C ATOM 1680 OE1 GLN A 115 -10.319 3.735 -10.504 1.00 0.00 O flip ATOM 1681 NE2 GLN A 115 -10.968 4.725 -8.589 1.00 0.00 N flip ATOM 0 H GLN A 115 -10.994 -0.471 -6.711 1.00 0.00 H new ATOM 0 HA GLN A 115 -8.374 0.360 -7.820 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -10.139 1.047 -9.303 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -11.114 1.649 -7.976 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.176 3.273 -7.456 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.469 2.785 -8.984 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -10.920 4.784 -7.572 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -11.561 5.371 -9.110 1.00 0.00 H new ATOM 1690 N LEU A 116 -7.829 1.901 -5.962 1.00 0.00 N ATOM 1691 CA LEU A 116 -7.414 2.626 -4.773 1.00 0.00 C ATOM 1692 C LEU A 116 -7.033 4.056 -5.161 1.00 0.00 C ATOM 1693 O LEU A 116 -6.138 4.264 -5.979 1.00 0.00 O ATOM 1694 CB LEU A 116 -6.303 1.869 -4.044 1.00 0.00 C ATOM 1695 CG LEU A 116 -6.639 0.444 -3.603 1.00 0.00 C ATOM 1696 CD1 LEU A 116 -5.378 -0.311 -3.178 1.00 0.00 C ATOM 1697 CD2 LEU A 116 -7.703 0.446 -2.504 1.00 0.00 C ATOM 0 H LEU A 116 -7.129 1.860 -6.703 1.00 0.00 H new ATOM 0 HA LEU A 116 -8.238 2.697 -4.063 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.430 1.830 -4.695 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -6.018 2.443 -3.162 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.059 -0.087 -4.457 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.646 -1.321 -2.869 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.683 -0.360 -4.016 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.905 0.210 -2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -7.923 -0.580 -2.209 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -7.334 1.000 -1.641 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -8.611 0.919 -2.878 1.00 0.00 H new ATOM 1709 N VAL A 117 -7.730 5.006 -4.555 1.00 0.00 N ATOM 1710 CA VAL A 117 -7.475 6.411 -4.826 1.00 0.00 C ATOM 1711 C VAL A 117 -6.653 7.006 -3.682 1.00 0.00 C ATOM 1712 O VAL A 117 -7.135 7.112 -2.555 1.00 0.00 O ATOM 1713 CB VAL A 117 -8.797 7.147 -5.059 1.00 0.00 C ATOM 1714 CG1 VAL A 117 -8.551 8.560 -5.591 1.00 0.00 C ATOM 1715 CG2 VAL A 117 -9.706 6.356 -6.002 1.00 0.00 C ATOM 0 H VAL A 117 -8.471 4.830 -3.877 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.890 6.524 -5.739 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.306 7.235 -4.099 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -9.506 9.061 -5.748 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.960 9.123 -4.868 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -8.011 8.504 -6.536 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.638 6.901 -6.151 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.207 6.222 -6.962 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.921 5.380 -5.566 1.00 0.00 H new ATOM 1725 N ILE A 118 -5.425 7.379 -4.010 1.00 0.00 N ATOM 1726 CA ILE A 118 -4.530 7.961 -3.024 1.00 0.00 C ATOM 1727 C ILE A 118 -4.340 9.448 -3.329 1.00 0.00 C ATOM 1728 O ILE A 118 -4.622 9.899 -4.438 1.00 0.00 O ATOM 1729 CB ILE A 118 -3.220 7.174 -2.959 1.00 0.00 C ATOM 1730 CG1 ILE A 118 -2.370 7.421 -4.207 1.00 0.00 C ATOM 1731 CG2 ILE A 118 -3.485 5.685 -2.731 1.00 0.00 C ATOM 1732 CD1 ILE A 118 -1.134 8.259 -3.871 1.00 0.00 C ATOM 0 H ILE A 118 -5.028 7.290 -4.945 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.965 7.893 -2.027 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.648 7.533 -2.103 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -2.062 6.468 -4.636 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.966 7.933 -4.962 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.537 5.149 -2.689 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.020 5.550 -1.791 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.087 5.293 -3.551 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.547 8.420 -4.775 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.446 9.221 -3.465 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.527 7.733 -3.134 1.00 0.00 H new ATOM 1744 N LEU A 119 -3.864 10.169 -2.324 1.00 0.00 N ATOM 1745 CA LEU A 119 -3.633 11.596 -2.471 1.00 0.00 C ATOM 1746 C LEU A 119 -2.371 11.986 -1.700 1.00 0.00 C ATOM 1747 O LEU A 119 -2.294 11.791 -0.488 1.00 0.00 O ATOM 1748 CB LEU A 119 -4.876 12.386 -2.056 1.00 0.00 C ATOM 1749 CG LEU A 119 -4.844 13.888 -2.345 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -3.846 14.601 -1.430 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -4.559 14.156 -3.824 1.00 0.00 C ATOM 0 H LEU A 119 -3.632 9.792 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.459 11.848 -3.517 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.741 11.957 -2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.031 12.245 -0.986 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.830 14.299 -2.128 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.843 15.667 -1.656 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -4.135 14.451 -0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.848 14.193 -1.592 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.542 15.231 -4.002 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.593 13.728 -4.092 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.339 13.700 -4.433 1.00 0.00 H new ATOM 1763 N ARG A 120 -1.411 12.530 -2.434 1.00 0.00 N ATOM 1764 CA ARG A 120 -0.156 12.949 -1.834 1.00 0.00 C ATOM 1765 C ARG A 120 0.085 14.438 -2.092 1.00 0.00 C ATOM 1766 O ARG A 120 -0.449 15.000 -3.048 1.00 0.00 O ATOM 1767 CB ARG A 120 1.018 12.145 -2.395 1.00 0.00 C ATOM 1768 CG ARG A 120 2.083 11.909 -1.322 1.00 0.00 C ATOM 1769 CD ARG A 120 3.109 10.873 -1.786 1.00 0.00 C ATOM 1770 NE ARG A 120 4.353 11.550 -2.217 1.00 0.00 N ATOM 1771 CZ ARG A 120 5.244 12.090 -1.375 1.00 0.00 C ATOM 1772 NH1 ARG A 120 5.035 12.036 -0.052 1.00 0.00 N ATOM 1773 NH2 ARG A 120 6.345 12.685 -1.855 1.00 0.00 N ATOM 0 H ARG A 120 -1.477 12.690 -3.439 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.225 12.769 -0.761 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.660 11.188 -2.774 1.00 0.00 H new ATOM 0 HB3 ARG A 120 1.458 12.677 -3.238 1.00 0.00 H new ATOM 0 HG2 ARG A 120 2.587 12.848 -1.092 1.00 0.00 H new ATOM 0 HG3 ARG A 120 1.608 11.569 -0.402 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.326 10.176 -0.976 1.00 0.00 H new ATOM 0 HD3 ARG A 120 2.700 10.287 -2.609 1.00 0.00 H new ATOM 0 HE ARG A 120 4.544 11.609 -3.217 1.00 0.00 H new ATOM 0 HH11 ARG A 120 4.197 11.584 0.314 1.00 0.00 H new ATOM 0 HH12 ARG A 120 5.714 12.447 0.589 1.00 0.00 H new ATOM 0 HH21 ARG A 120 6.505 12.727 -2.862 1.00 0.00 H new ATOM 0 HH22 ARG A 120 7.023 13.096 -1.214 1.00 0.00 H new