USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 816 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 108 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 112 THR OG1 : rot 113:sc= 1.2 USER MOD Single : A 21 LYS NZ :NH3+ -165:sc= -0.0792 (180deg=-0.385) USER MOD Single : A 22 TYR OH : rot 118:sc= 0.00552 USER MOD Single : A 23 HIS : no HD1:sc= -0.38 X(o=-0.38,f=-0.19) USER MOD Single : A 29 TYR OH : rot 150:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=-0.067) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -28:sc= -1.39 USER MOD Single : A 44 HIS : no HD1:sc= -5.44! C(o=-5.4!,f=-5!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -0.345 X(o=-0.34,f=-0.18) USER MOD Single : A 58 MET CE :methyl 136:sc= -0.54 (180deg=-5.27!) USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.471 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= -1.19 USER MOD Single : A 71 ASN : amide:sc= -4.62! C(o=-4.6!,f=-11!) USER MOD Single : A 72 LYS NZ :NH3+ -112:sc= -2.86! (180deg=-9.81!) USER MOD Single : A 73 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.47) USER MOD Single : A 76 ASN : amide:sc= -2.56! C(o=-2.6!,f=-5!) USER MOD Single : A 77 LYS NZ :NH3+ -106:sc= -0.0337 (180deg=-0.636) USER MOD Single : A 78 GLN : amide:sc= -0.74 K(o=-0.74,f=0.82) USER MOD Single : A 83 SER OG : rot 180:sc= 0.119 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 SER OG : rot 63:sc= 1.05 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 THR OG1 : rot 150:sc= -0.961 USER MOD Single : A 106 LYS NZ :NH3+ -105:sc= 0.556 (180deg=-0.0714) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 90:sc= 0.618 USER MOD Single : A 121 LYS NZ :NH3+ 154:sc= -0.115 (180deg=-1.02) USER MOD Single : A 122 SER OG : rot 180:sc= 0.0129 USER MOD Single : A 123 GLN : amide:sc= -0.0724 K(o=-0.072,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 251 N PRO A 18 9.881 -24.666 -12.107 1.00 0.00 N ATOM 252 CA PRO A 18 10.669 -23.582 -11.513 1.00 0.00 C ATOM 253 C PRO A 18 9.850 -22.729 -10.551 1.00 0.00 C ATOM 254 O PRO A 18 9.377 -21.650 -10.911 1.00 0.00 O ATOM 255 CB PRO A 18 11.104 -22.755 -12.725 1.00 0.00 C ATOM 256 CG PRO A 18 10.069 -23.028 -13.761 1.00 0.00 C ATOM 257 CD PRO A 18 9.628 -24.449 -13.541 1.00 0.00 C ATOM 0 HA PRO A 18 11.500 -23.961 -10.918 1.00 0.00 H new ATOM 0 HB2 PRO A 18 11.152 -21.693 -12.483 1.00 0.00 H new ATOM 0 HB3 PRO A 18 12.096 -23.048 -13.069 1.00 0.00 H new ATOM 0 HG2 PRO A 18 9.229 -22.339 -13.665 1.00 0.00 H new ATOM 0 HG3 PRO A 18 10.476 -22.896 -14.764 1.00 0.00 H new ATOM 0 HD2 PRO A 18 8.575 -24.586 -13.789 1.00 0.00 H new ATOM 0 HD3 PRO A 18 10.194 -25.146 -14.159 1.00 0.00 H new ATOM 265 N LEU A 19 9.687 -23.217 -9.327 1.00 0.00 N ATOM 266 CA LEU A 19 8.924 -22.498 -8.312 1.00 0.00 C ATOM 267 C LEU A 19 9.210 -21.001 -8.375 1.00 0.00 C ATOM 268 O LEU A 19 8.291 -20.183 -8.355 1.00 0.00 O ATOM 269 CB LEU A 19 9.260 -23.034 -6.919 1.00 0.00 C ATOM 270 CG LEU A 19 8.756 -24.442 -6.603 1.00 0.00 C ATOM 271 CD1 LEU A 19 9.858 -25.273 -5.965 1.00 0.00 C ATOM 272 CD2 LEU A 19 7.537 -24.381 -5.693 1.00 0.00 C ATOM 0 H LEU A 19 10.073 -24.107 -9.013 1.00 0.00 H new ATOM 0 HA LEU A 19 7.864 -22.656 -8.510 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.343 -23.022 -6.798 1.00 0.00 H new ATOM 0 HB3 LEU A 19 8.849 -22.348 -6.179 1.00 0.00 H new ATOM 0 HG LEU A 19 8.463 -24.920 -7.538 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.481 -26.272 -5.747 1.00 0.00 H new ATOM 0 HD12 LEU A 19 10.702 -25.346 -6.651 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.182 -24.798 -5.039 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.192 -25.392 -5.479 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.804 -23.883 -4.761 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.741 -23.823 -6.187 1.00 0.00 H new ATOM 284 N GLU A 20 10.490 -20.650 -8.454 1.00 0.00 N ATOM 285 CA GLU A 20 10.896 -19.251 -8.522 1.00 0.00 C ATOM 286 C GLU A 20 10.184 -18.533 -9.664 1.00 0.00 C ATOM 287 O GLU A 20 9.679 -17.423 -9.496 1.00 0.00 O ATOM 288 CB GLU A 20 12.411 -19.145 -8.704 1.00 0.00 C ATOM 289 CG GLU A 20 13.161 -18.862 -7.413 1.00 0.00 C ATOM 290 CD GLU A 20 14.503 -18.198 -7.651 1.00 0.00 C ATOM 291 OE1 GLU A 20 14.549 -16.951 -7.690 1.00 0.00 O ATOM 292 OE2 GLU A 20 15.507 -18.926 -7.799 1.00 0.00 O ATOM 0 H GLU A 20 11.263 -21.315 -8.472 1.00 0.00 H new ATOM 0 HA GLU A 20 10.616 -18.772 -7.584 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.783 -20.075 -9.134 1.00 0.00 H new ATOM 0 HB3 GLU A 20 12.628 -18.353 -9.421 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.551 -18.222 -6.776 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.313 -19.797 -6.873 1.00 0.00 H new ATOM 299 N LYS A 21 10.147 -19.175 -10.827 1.00 0.00 N ATOM 300 CA LYS A 21 9.497 -18.600 -11.999 1.00 0.00 C ATOM 301 C LYS A 21 7.988 -18.518 -11.798 1.00 0.00 C ATOM 302 O LYS A 21 7.332 -17.611 -12.311 1.00 0.00 O ATOM 303 CB LYS A 21 9.812 -19.434 -13.243 1.00 0.00 C ATOM 304 CG LYS A 21 9.390 -18.771 -14.542 1.00 0.00 C ATOM 305 CD LYS A 21 10.182 -17.501 -14.804 1.00 0.00 C ATOM 306 CE LYS A 21 9.786 -16.859 -16.125 1.00 0.00 C ATOM 307 NZ LYS A 21 9.967 -17.792 -17.271 1.00 0.00 N ATOM 0 H LYS A 21 10.560 -20.095 -10.983 1.00 0.00 H new ATOM 0 HA LYS A 21 9.883 -17.590 -12.139 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.884 -19.631 -13.277 1.00 0.00 H new ATOM 0 HB3 LYS A 21 9.313 -20.400 -13.159 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.532 -19.466 -15.369 1.00 0.00 H new ATOM 0 HG3 LYS A 21 8.326 -18.536 -14.503 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.017 -16.794 -13.991 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.247 -17.731 -14.815 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.745 -16.541 -16.077 1.00 0.00 H new ATOM 0 HE3 LYS A 21 10.385 -15.963 -16.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 9.935 -17.257 -18.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 10.886 -18.271 -17.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 9.206 -18.501 -17.265 1.00 0.00 H new ATOM 321 N TYR A 22 7.443 -19.469 -11.048 1.00 0.00 N ATOM 322 CA TYR A 22 6.010 -19.505 -10.780 1.00 0.00 C ATOM 323 C TYR A 22 5.594 -18.343 -9.883 1.00 0.00 C ATOM 324 O TYR A 22 4.624 -17.640 -10.166 1.00 0.00 O ATOM 325 CB TYR A 22 5.625 -20.833 -10.126 1.00 0.00 C ATOM 326 CG TYR A 22 4.549 -20.699 -9.072 1.00 0.00 C ATOM 327 CD1 TYR A 22 4.853 -20.238 -7.797 1.00 0.00 C ATOM 328 CD2 TYR A 22 3.230 -21.034 -9.350 1.00 0.00 C ATOM 329 CE1 TYR A 22 3.874 -20.114 -6.830 1.00 0.00 C ATOM 330 CE2 TYR A 22 2.244 -20.912 -8.390 1.00 0.00 C ATOM 331 CZ TYR A 22 2.571 -20.452 -7.132 1.00 0.00 C ATOM 332 OH TYR A 22 1.592 -20.331 -6.172 1.00 0.00 O ATOM 0 H TYR A 22 7.972 -20.226 -10.615 1.00 0.00 H new ATOM 0 HA TYR A 22 5.486 -19.411 -11.731 1.00 0.00 H new ATOM 0 HB2 TYR A 22 5.282 -21.523 -10.898 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.512 -21.276 -9.673 1.00 0.00 H new ATOM 0 HD1 TYR A 22 5.872 -19.972 -7.558 1.00 0.00 H new ATOM 0 HD2 TYR A 22 2.971 -21.396 -10.334 1.00 0.00 H new ATOM 0 HE1 TYR A 22 4.127 -19.755 -5.844 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.223 -21.175 -8.624 1.00 0.00 H new ATOM 0 HH TYR A 22 0.919 -19.684 -6.471 1.00 0.00 H new ATOM 342 N HIS A 23 6.337 -18.147 -8.798 1.00 0.00 N ATOM 343 CA HIS A 23 6.048 -17.070 -7.858 1.00 0.00 C ATOM 344 C HIS A 23 6.307 -15.708 -8.495 1.00 0.00 C ATOM 345 O HIS A 23 5.666 -14.718 -8.146 1.00 0.00 O ATOM 346 CB HIS A 23 6.896 -17.225 -6.595 1.00 0.00 C ATOM 347 CG HIS A 23 6.089 -17.463 -5.357 1.00 0.00 C ATOM 348 ND1 HIS A 23 6.594 -18.089 -4.237 1.00 0.00 N ATOM 349 CD2 HIS A 23 4.804 -17.152 -5.064 1.00 0.00 C ATOM 350 CE1 HIS A 23 5.655 -18.155 -3.310 1.00 0.00 C ATOM 351 NE2 HIS A 23 4.559 -17.594 -3.787 1.00 0.00 N ATOM 0 H HIS A 23 7.143 -18.720 -8.548 1.00 0.00 H new ATOM 0 HA HIS A 23 4.994 -17.130 -7.588 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.589 -18.055 -6.732 1.00 0.00 H new ATOM 0 HB3 HIS A 23 7.498 -16.327 -6.459 1.00 0.00 H new ATOM 0 HD2 HIS A 23 4.102 -16.650 -5.714 1.00 0.00 H new ATOM 0 HE1 HIS A 23 5.765 -18.593 -2.329 1.00 0.00 H new ATOM 0 HE2 HIS A 23 3.674 -17.504 -3.288 1.00 0.00 H new ATOM 359 N GLU A 24 7.251 -15.668 -9.430 1.00 0.00 N ATOM 360 CA GLU A 24 7.596 -14.427 -10.115 1.00 0.00 C ATOM 361 C GLU A 24 6.496 -14.022 -11.092 1.00 0.00 C ATOM 362 O GLU A 24 6.174 -12.842 -11.224 1.00 0.00 O ATOM 363 CB GLU A 24 8.924 -14.581 -10.859 1.00 0.00 C ATOM 364 CG GLU A 24 10.138 -14.232 -10.015 1.00 0.00 C ATOM 365 CD GLU A 24 11.409 -14.129 -10.835 1.00 0.00 C ATOM 366 OE1 GLU A 24 11.345 -13.595 -11.963 1.00 0.00 O ATOM 367 OE2 GLU A 24 12.467 -14.583 -10.351 1.00 0.00 O ATOM 0 H GLU A 24 7.790 -16.480 -9.731 1.00 0.00 H new ATOM 0 HA GLU A 24 7.698 -13.643 -9.364 1.00 0.00 H new ATOM 0 HB2 GLU A 24 9.018 -15.609 -11.208 1.00 0.00 H new ATOM 0 HB3 GLU A 24 8.911 -13.944 -11.743 1.00 0.00 H new ATOM 0 HG2 GLU A 24 9.961 -13.285 -9.505 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.269 -14.990 -9.243 1.00 0.00 H new ATOM 374 N GLU A 25 5.927 -15.010 -11.776 1.00 0.00 N ATOM 375 CA GLU A 25 4.865 -14.755 -12.742 1.00 0.00 C ATOM 376 C GLU A 25 3.569 -14.366 -12.037 1.00 0.00 C ATOM 377 O GLU A 25 2.959 -13.345 -12.355 1.00 0.00 O ATOM 378 CB GLU A 25 4.632 -15.991 -13.614 1.00 0.00 C ATOM 379 CG GLU A 25 5.695 -16.192 -14.681 1.00 0.00 C ATOM 380 CD GLU A 25 5.634 -17.569 -15.313 1.00 0.00 C ATOM 381 OE1 GLU A 25 4.600 -18.250 -15.151 1.00 0.00 O ATOM 382 OE2 GLU A 25 6.620 -17.966 -15.969 1.00 0.00 O ATOM 0 H GLU A 25 6.183 -15.993 -11.679 1.00 0.00 H new ATOM 0 HA GLU A 25 5.177 -13.925 -13.375 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.598 -16.874 -12.976 1.00 0.00 H new ATOM 0 HB3 GLU A 25 3.657 -15.907 -14.095 1.00 0.00 H new ATOM 0 HG2 GLU A 25 5.574 -15.435 -15.456 1.00 0.00 H new ATOM 0 HG3 GLU A 25 6.680 -16.042 -14.240 1.00 0.00 H new ATOM 389 N ALA A 26 3.154 -15.187 -11.078 1.00 0.00 N ATOM 390 CA ALA A 26 1.932 -14.928 -10.326 1.00 0.00 C ATOM 391 C ALA A 26 2.054 -13.651 -9.503 1.00 0.00 C ATOM 392 O ALA A 26 1.121 -12.850 -9.439 1.00 0.00 O ATOM 393 CB ALA A 26 1.606 -16.110 -9.426 1.00 0.00 C ATOM 0 H ALA A 26 3.646 -16.037 -10.803 1.00 0.00 H new ATOM 0 HA ALA A 26 1.118 -14.793 -11.038 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.691 -15.903 -8.870 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.466 -17.003 -10.035 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.426 -16.272 -8.727 1.00 0.00 H new ATOM 399 N ASP A 27 3.210 -13.466 -8.874 1.00 0.00 N ATOM 400 CA ASP A 27 3.454 -12.285 -8.054 1.00 0.00 C ATOM 401 C ASP A 27 3.397 -11.016 -8.898 1.00 0.00 C ATOM 402 O ASP A 27 2.709 -10.057 -8.549 1.00 0.00 O ATOM 403 CB ASP A 27 4.813 -12.391 -7.361 1.00 0.00 C ATOM 404 CG ASP A 27 5.132 -11.170 -6.521 1.00 0.00 C ATOM 405 OD1 ASP A 27 4.475 -10.127 -6.719 1.00 0.00 O ATOM 406 OD2 ASP A 27 6.038 -11.258 -5.666 1.00 0.00 O ATOM 0 H ASP A 27 3.993 -14.119 -8.916 1.00 0.00 H new ATOM 0 HA ASP A 27 2.672 -12.231 -7.297 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.826 -13.278 -6.727 1.00 0.00 H new ATOM 0 HB3 ASP A 27 5.591 -12.525 -8.112 1.00 0.00 H new ATOM 411 N ASP A 28 4.125 -11.018 -10.009 1.00 0.00 N ATOM 412 CA ASP A 28 4.157 -9.867 -10.904 1.00 0.00 C ATOM 413 C ASP A 28 2.835 -9.721 -11.650 1.00 0.00 C ATOM 414 O ASP A 28 2.424 -8.613 -11.995 1.00 0.00 O ATOM 415 CB ASP A 28 5.308 -10.002 -11.902 1.00 0.00 C ATOM 416 CG ASP A 28 5.781 -8.660 -12.426 1.00 0.00 C ATOM 417 OD1 ASP A 28 5.029 -8.025 -13.194 1.00 0.00 O ATOM 418 OD2 ASP A 28 6.904 -8.246 -12.069 1.00 0.00 O ATOM 0 H ASP A 28 4.701 -11.804 -10.312 1.00 0.00 H new ATOM 0 HA ASP A 28 4.313 -8.973 -10.300 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.142 -10.516 -11.423 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.988 -10.623 -12.739 1.00 0.00 H new ATOM 423 N TYR A 29 2.174 -10.846 -11.897 1.00 0.00 N ATOM 424 CA TYR A 29 0.899 -10.844 -12.606 1.00 0.00 C ATOM 425 C TYR A 29 -0.188 -10.176 -11.770 1.00 0.00 C ATOM 426 O TYR A 29 -0.883 -9.274 -12.240 1.00 0.00 O ATOM 427 CB TYR A 29 0.483 -12.274 -12.954 1.00 0.00 C ATOM 428 CG TYR A 29 1.153 -12.813 -14.198 1.00 0.00 C ATOM 429 CD1 TYR A 29 2.227 -12.148 -14.776 1.00 0.00 C ATOM 430 CD2 TYR A 29 0.711 -13.987 -14.797 1.00 0.00 C ATOM 431 CE1 TYR A 29 2.842 -12.636 -15.913 1.00 0.00 C ATOM 432 CE2 TYR A 29 1.320 -14.483 -15.933 1.00 0.00 C ATOM 433 CZ TYR A 29 2.385 -13.804 -16.487 1.00 0.00 C ATOM 434 OH TYR A 29 2.993 -14.294 -17.620 1.00 0.00 O ATOM 0 H TYR A 29 2.499 -11.771 -11.617 1.00 0.00 H new ATOM 0 HA TYR A 29 1.025 -10.275 -13.527 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.718 -12.927 -12.113 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -0.598 -12.306 -13.091 1.00 0.00 H new ATOM 0 HD1 TYR A 29 2.588 -11.233 -14.329 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -0.123 -14.521 -14.366 1.00 0.00 H new ATOM 0 HE1 TYR A 29 3.676 -12.106 -16.350 1.00 0.00 H new ATOM 0 HE2 TYR A 29 0.964 -15.397 -16.385 1.00 0.00 H new ATOM 0 HH TYR A 29 2.921 -15.271 -17.633 1.00 0.00 H new ATOM 444 N LEU A 30 -0.329 -10.624 -10.527 1.00 0.00 N ATOM 445 CA LEU A 30 -1.330 -10.071 -9.623 1.00 0.00 C ATOM 446 C LEU A 30 -1.000 -8.625 -9.264 1.00 0.00 C ATOM 447 O LEU A 30 -1.889 -7.777 -9.181 1.00 0.00 O ATOM 448 CB LEU A 30 -1.421 -10.916 -8.351 1.00 0.00 C ATOM 449 CG LEU A 30 -2.166 -12.245 -8.480 1.00 0.00 C ATOM 450 CD1 LEU A 30 -3.341 -12.293 -7.516 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.640 -12.454 -9.911 1.00 0.00 C ATOM 0 H LEU A 30 0.238 -11.369 -10.123 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.293 -10.089 -10.133 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.409 -11.122 -8.003 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.909 -10.322 -7.578 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.479 -13.051 -8.224 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.860 -13.246 -7.622 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.977 -12.189 -6.494 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.029 -11.478 -7.741 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -3.168 -13.405 -9.984 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.311 -11.643 -10.194 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.780 -12.464 -10.581 1.00 0.00 H new ATOM 463 N ASP A 31 0.283 -8.351 -9.055 1.00 0.00 N ATOM 464 CA ASP A 31 0.731 -7.008 -8.708 1.00 0.00 C ATOM 465 C ASP A 31 0.355 -6.011 -9.800 1.00 0.00 C ATOM 466 O ASP A 31 -0.250 -4.973 -9.527 1.00 0.00 O ATOM 467 CB ASP A 31 2.244 -6.993 -8.487 1.00 0.00 C ATOM 468 CG ASP A 31 2.615 -7.059 -7.018 1.00 0.00 C ATOM 469 OD1 ASP A 31 2.176 -8.009 -6.338 1.00 0.00 O ATOM 470 OD2 ASP A 31 3.343 -6.159 -6.549 1.00 0.00 O ATOM 0 H ASP A 31 1.031 -9.041 -9.120 1.00 0.00 H new ATOM 0 HA ASP A 31 0.234 -6.713 -7.784 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.693 -7.837 -9.011 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.663 -6.087 -8.924 1.00 0.00 H new ATOM 475 N HIS A 32 0.717 -6.332 -11.038 1.00 0.00 N ATOM 476 CA HIS A 32 0.417 -5.464 -12.172 1.00 0.00 C ATOM 477 C HIS A 32 -1.084 -5.419 -12.440 1.00 0.00 C ATOM 478 O HIS A 32 -1.595 -4.453 -13.009 1.00 0.00 O ATOM 479 CB HIS A 32 1.156 -5.948 -13.420 1.00 0.00 C ATOM 480 CG HIS A 32 2.104 -4.936 -13.985 1.00 0.00 C ATOM 481 ND1 HIS A 32 1.718 -3.662 -14.346 1.00 0.00 N ATOM 482 CD2 HIS A 32 3.429 -5.015 -14.250 1.00 0.00 C ATOM 483 CE1 HIS A 32 2.764 -3.002 -14.809 1.00 0.00 C ATOM 484 NE2 HIS A 32 3.815 -3.801 -14.761 1.00 0.00 N ATOM 0 H HIS A 32 1.218 -7.186 -11.282 1.00 0.00 H new ATOM 0 HA HIS A 32 0.754 -4.457 -11.927 1.00 0.00 H new ATOM 0 HB2 HIS A 32 1.709 -6.855 -13.176 1.00 0.00 H new ATOM 0 HB3 HIS A 32 0.426 -6.216 -14.184 1.00 0.00 H new ATOM 0 HD2 HIS A 32 4.064 -5.873 -14.089 1.00 0.00 H new ATOM 0 HE1 HIS A 32 2.761 -1.983 -15.166 1.00 0.00 H new ATOM 0 HE2 HIS A 32 4.760 -3.556 -15.056 1.00 0.00 H new ATOM 492 N LEU A 33 -1.786 -6.469 -12.027 1.00 0.00 N ATOM 493 CA LEU A 33 -3.229 -6.549 -12.223 1.00 0.00 C ATOM 494 C LEU A 33 -3.954 -5.519 -11.363 1.00 0.00 C ATOM 495 O LEU A 33 -4.739 -4.715 -11.867 1.00 0.00 O ATOM 496 CB LEU A 33 -3.731 -7.954 -11.887 1.00 0.00 C ATOM 497 CG LEU A 33 -4.302 -8.760 -13.055 1.00 0.00 C ATOM 498 CD1 LEU A 33 -5.773 -8.433 -13.261 1.00 0.00 C ATOM 499 CD2 LEU A 33 -3.510 -8.490 -14.326 1.00 0.00 C ATOM 0 H LEU A 33 -1.379 -7.276 -11.555 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.441 -6.334 -13.270 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.907 -8.518 -11.451 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.500 -7.869 -11.120 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.217 -9.820 -12.816 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.162 -9.016 -14.096 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.330 -8.678 -12.357 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.883 -7.370 -13.478 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.930 -9.072 -15.147 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.563 -7.429 -14.569 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.469 -8.776 -14.174 1.00 0.00 H new ATOM 511 N LEU A 34 -3.683 -5.546 -10.062 1.00 0.00 N ATOM 512 CA LEU A 34 -4.307 -4.612 -9.131 1.00 0.00 C ATOM 513 C LEU A 34 -3.788 -3.195 -9.351 1.00 0.00 C ATOM 514 O LEU A 34 -4.478 -2.218 -9.057 1.00 0.00 O ATOM 515 CB LEU A 34 -4.042 -5.046 -7.689 1.00 0.00 C ATOM 516 CG LEU A 34 -2.589 -5.372 -7.342 1.00 0.00 C ATOM 517 CD1 LEU A 34 -1.921 -4.182 -6.670 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.517 -6.601 -6.448 1.00 0.00 C ATOM 0 H LEU A 34 -3.036 -6.204 -9.628 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.381 -4.618 -9.314 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.384 -4.253 -7.024 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.651 -5.925 -7.478 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.054 -5.588 -8.267 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.888 -4.432 -6.430 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.940 -3.326 -7.344 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.456 -3.934 -5.753 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.475 -6.818 -6.211 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.067 -6.413 -5.526 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.957 -7.454 -6.965 1.00 0.00 H new ATOM 530 N ASP A 35 -2.571 -3.090 -9.873 1.00 0.00 N ATOM 531 CA ASP A 35 -1.961 -1.792 -10.136 1.00 0.00 C ATOM 532 C ASP A 35 -2.663 -1.086 -11.291 1.00 0.00 C ATOM 533 O ASP A 35 -2.943 0.111 -11.222 1.00 0.00 O ATOM 534 CB ASP A 35 -0.474 -1.959 -10.451 1.00 0.00 C ATOM 535 CG ASP A 35 0.288 -0.651 -10.357 1.00 0.00 C ATOM 536 OD1 ASP A 35 -0.036 0.161 -9.465 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.209 -0.440 -11.174 1.00 0.00 O ATOM 0 H ASP A 35 -1.987 -3.888 -10.122 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.068 -1.179 -9.241 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -0.038 -2.681 -9.760 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.362 -2.370 -11.454 1.00 0.00 H new ATOM 542 N SER A 36 -2.943 -1.834 -12.353 1.00 0.00 N ATOM 543 CA SER A 36 -3.608 -1.279 -13.526 1.00 0.00 C ATOM 544 C SER A 36 -5.080 -1.001 -13.235 1.00 0.00 C ATOM 545 O SER A 36 -5.629 0.014 -13.665 1.00 0.00 O ATOM 546 CB SER A 36 -3.483 -2.237 -14.711 1.00 0.00 C ATOM 547 OG SER A 36 -3.373 -1.527 -15.933 1.00 0.00 O ATOM 0 H SER A 36 -2.720 -2.827 -12.425 1.00 0.00 H new ATOM 0 HA SER A 36 -3.121 -0.337 -13.777 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.608 -2.874 -14.577 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.353 -2.893 -14.745 1.00 0.00 H new ATOM 0 HG SER A 36 -3.293 -2.163 -16.675 1.00 0.00 H new ATOM 553 N LEU A 37 -5.714 -1.910 -12.503 1.00 0.00 N ATOM 554 CA LEU A 37 -7.123 -1.765 -12.154 1.00 0.00 C ATOM 555 C LEU A 37 -7.332 -0.581 -11.215 1.00 0.00 C ATOM 556 O LEU A 37 -8.276 0.191 -11.377 1.00 0.00 O ATOM 557 CB LEU A 37 -7.641 -3.047 -11.499 1.00 0.00 C ATOM 558 CG LEU A 37 -8.063 -4.164 -12.453 1.00 0.00 C ATOM 559 CD1 LEU A 37 -7.261 -4.096 -13.743 1.00 0.00 C ATOM 560 CD2 LEU A 37 -7.895 -5.524 -11.789 1.00 0.00 C ATOM 0 H LEU A 37 -5.275 -2.756 -12.139 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.682 -1.581 -13.071 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.864 -3.434 -10.839 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.494 -2.791 -10.871 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.117 -4.028 -12.697 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.575 -4.899 -14.410 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -7.432 -3.135 -14.227 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.200 -4.206 -13.518 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.200 -6.308 -12.482 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.850 -5.669 -11.515 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.515 -5.571 -10.893 1.00 0.00 H new ATOM 572 N GLU A 38 -6.442 -0.443 -10.237 1.00 0.00 N ATOM 573 CA GLU A 38 -6.530 0.649 -9.274 1.00 0.00 C ATOM 574 C GLU A 38 -6.321 1.996 -9.959 1.00 0.00 C ATOM 575 O GLU A 38 -6.999 2.974 -9.646 1.00 0.00 O ATOM 576 CB GLU A 38 -5.493 0.463 -8.164 1.00 0.00 C ATOM 577 CG GLU A 38 -5.844 -0.642 -7.182 1.00 0.00 C ATOM 578 CD GLU A 38 -4.652 -1.094 -6.361 1.00 0.00 C ATOM 579 OE1 GLU A 38 -3.507 -0.883 -6.812 1.00 0.00 O ATOM 580 OE2 GLU A 38 -4.865 -1.659 -5.268 1.00 0.00 O ATOM 0 H GLU A 38 -5.653 -1.073 -10.091 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.528 0.634 -8.836 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.526 0.243 -8.615 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.384 1.401 -7.619 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.630 -0.292 -6.512 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -6.248 -1.494 -7.729 1.00 0.00 H new ATOM 587 N GLU A 39 -5.378 2.038 -10.895 1.00 0.00 N ATOM 588 CA GLU A 39 -5.080 3.266 -11.624 1.00 0.00 C ATOM 589 C GLU A 39 -6.235 3.646 -12.545 1.00 0.00 C ATOM 590 O GLU A 39 -6.473 4.826 -12.807 1.00 0.00 O ATOM 591 CB GLU A 39 -3.795 3.102 -12.439 1.00 0.00 C ATOM 592 CG GLU A 39 -4.017 3.156 -13.941 1.00 0.00 C ATOM 593 CD GLU A 39 -2.807 2.689 -14.726 1.00 0.00 C ATOM 594 OE1 GLU A 39 -1.673 3.028 -14.328 1.00 0.00 O ATOM 595 OE2 GLU A 39 -2.994 1.983 -15.740 1.00 0.00 O ATOM 0 H GLU A 39 -4.808 1.237 -11.166 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.941 4.066 -10.897 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.092 3.886 -12.156 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.331 2.150 -12.183 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.875 2.536 -14.200 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -4.262 4.177 -14.232 1.00 0.00 H new ATOM 602 N LEU A 40 -6.949 2.639 -13.035 1.00 0.00 N ATOM 603 CA LEU A 40 -8.080 2.866 -13.929 1.00 0.00 C ATOM 604 C LEU A 40 -9.329 3.247 -13.140 1.00 0.00 C ATOM 605 O LEU A 40 -10.042 4.183 -13.502 1.00 0.00 O ATOM 606 CB LEU A 40 -8.353 1.615 -14.765 1.00 0.00 C ATOM 607 CG LEU A 40 -7.524 1.467 -16.041 1.00 0.00 C ATOM 608 CD1 LEU A 40 -8.074 0.344 -16.908 1.00 0.00 C ATOM 609 CD2 LEU A 40 -7.498 2.776 -16.816 1.00 0.00 C ATOM 0 H LEU A 40 -6.765 1.657 -12.829 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.827 3.692 -14.594 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.180 0.739 -14.139 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.408 1.608 -15.038 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.502 1.214 -15.759 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.471 0.254 -17.812 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.040 -0.594 -16.354 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.106 0.567 -17.181 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.903 2.651 -17.721 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.515 3.059 -17.086 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.057 3.557 -16.197 1.00 0.00 H new ATOM 621 N SER A 41 -9.586 2.517 -12.060 1.00 0.00 N ATOM 622 CA SER A 41 -10.750 2.778 -11.221 1.00 0.00 C ATOM 623 C SER A 41 -10.624 4.128 -10.521 1.00 0.00 C ATOM 624 O SER A 41 -11.623 4.734 -10.136 1.00 0.00 O ATOM 625 CB SER A 41 -10.916 1.666 -10.183 1.00 0.00 C ATOM 626 OG SER A 41 -9.903 1.736 -9.195 1.00 0.00 O ATOM 0 H SER A 41 -9.004 1.740 -11.745 1.00 0.00 H new ATOM 0 HA SER A 41 -11.631 2.802 -11.862 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.895 1.748 -9.711 1.00 0.00 H new ATOM 0 HB3 SER A 41 -10.880 0.695 -10.677 1.00 0.00 H new ATOM 0 HG SER A 41 -9.098 2.142 -9.580 1.00 0.00 H new ATOM 632 N GLU A 42 -9.389 4.591 -10.361 1.00 0.00 N ATOM 633 CA GLU A 42 -9.131 5.869 -9.707 1.00 0.00 C ATOM 634 C GLU A 42 -9.518 7.033 -10.616 1.00 0.00 C ATOM 635 O GLU A 42 -10.172 7.981 -10.183 1.00 0.00 O ATOM 636 CB GLU A 42 -7.656 5.980 -9.318 1.00 0.00 C ATOM 637 CG GLU A 42 -7.262 7.357 -8.810 1.00 0.00 C ATOM 638 CD GLU A 42 -6.070 7.933 -9.550 1.00 0.00 C ATOM 639 OE1 GLU A 42 -6.064 7.877 -10.798 1.00 0.00 O ATOM 640 OE2 GLU A 42 -5.145 8.439 -8.882 1.00 0.00 O ATOM 0 H GLU A 42 -8.551 4.101 -10.675 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.741 5.916 -8.805 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.436 5.241 -8.548 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.041 5.732 -10.183 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.110 8.034 -8.912 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.030 7.295 -7.747 1.00 0.00 H new ATOM 647 N ALA A 43 -9.107 6.953 -11.877 1.00 0.00 N ATOM 648 CA ALA A 43 -9.411 7.997 -12.847 1.00 0.00 C ATOM 649 C ALA A 43 -10.878 7.953 -13.260 1.00 0.00 C ATOM 650 O ALA A 43 -11.368 8.850 -13.947 1.00 0.00 O ATOM 651 CB ALA A 43 -8.513 7.861 -14.068 1.00 0.00 C ATOM 0 H ALA A 43 -8.562 6.176 -12.251 1.00 0.00 H new ATOM 0 HA ALA A 43 -9.222 8.962 -12.376 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.751 8.647 -14.784 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.470 7.951 -13.764 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.674 6.888 -14.531 1.00 0.00 H new ATOM 657 N HIS A 44 -11.576 6.903 -12.839 1.00 0.00 N ATOM 658 CA HIS A 44 -12.988 6.742 -13.165 1.00 0.00 C ATOM 659 C HIS A 44 -13.178 6.530 -14.664 1.00 0.00 C ATOM 660 O HIS A 44 -13.244 7.478 -15.446 1.00 0.00 O ATOM 661 CB HIS A 44 -13.782 7.965 -12.706 1.00 0.00 C ATOM 662 CG HIS A 44 -14.888 8.347 -13.642 1.00 0.00 C ATOM 663 ND1 HIS A 44 -15.656 7.421 -14.317 1.00 0.00 N ATOM 664 CD2 HIS A 44 -15.354 9.562 -14.012 1.00 0.00 C ATOM 665 CE1 HIS A 44 -16.545 8.051 -15.063 1.00 0.00 C ATOM 666 NE2 HIS A 44 -16.384 9.351 -14.895 1.00 0.00 N ATOM 0 H HIS A 44 -11.186 6.151 -12.271 1.00 0.00 H new ATOM 0 HA HIS A 44 -13.359 5.861 -12.641 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -14.204 7.766 -11.721 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -13.102 8.810 -12.597 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -14.985 10.519 -13.676 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -17.279 7.583 -15.702 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -16.935 10.080 -15.348 1.00 0.00 H new ATOM 674 N PRO A 45 -13.269 5.256 -15.075 1.00 0.00 N ATOM 675 CA PRO A 45 -13.452 4.890 -16.483 1.00 0.00 C ATOM 676 C PRO A 45 -14.838 5.259 -17.002 1.00 0.00 C ATOM 677 O PRO A 45 -14.976 5.807 -18.096 1.00 0.00 O ATOM 678 CB PRO A 45 -13.269 3.370 -16.481 1.00 0.00 C ATOM 679 CG PRO A 45 -13.624 2.948 -15.097 1.00 0.00 C ATOM 680 CD PRO A 45 -13.199 4.076 -14.198 1.00 0.00 C ATOM 0 HA PRO A 45 -12.755 5.416 -17.135 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -13.914 2.893 -17.218 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.244 3.094 -16.728 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.694 2.761 -15.009 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.115 2.022 -14.829 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -13.861 4.175 -13.337 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -12.192 3.923 -13.810 1.00 0.00 H new ATOM 688 N ASP A 46 -15.861 4.956 -16.211 1.00 0.00 N ATOM 689 CA ASP A 46 -17.236 5.258 -16.590 1.00 0.00 C ATOM 690 C ASP A 46 -18.119 5.412 -15.355 1.00 0.00 C ATOM 691 O ASP A 46 -19.001 6.270 -15.314 1.00 0.00 O ATOM 692 CB ASP A 46 -17.791 4.156 -17.495 1.00 0.00 C ATOM 693 CG ASP A 46 -19.042 4.590 -18.234 1.00 0.00 C ATOM 694 OD1 ASP A 46 -18.914 5.319 -19.240 1.00 0.00 O ATOM 695 OD2 ASP A 46 -20.148 4.200 -17.807 1.00 0.00 O ATOM 0 H ASP A 46 -15.764 4.501 -15.303 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.238 6.202 -17.136 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -17.028 3.864 -18.217 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -18.015 3.274 -16.894 1.00 0.00 H new ATOM 700 N CYS A 47 -17.877 4.574 -14.353 1.00 0.00 N ATOM 701 CA CYS A 47 -18.651 4.616 -13.117 1.00 0.00 C ATOM 702 C CYS A 47 -17.742 4.845 -11.914 1.00 0.00 C ATOM 703 O CYS A 47 -17.416 5.984 -11.578 1.00 0.00 O ATOM 704 CB CYS A 47 -19.436 3.316 -12.939 1.00 0.00 C ATOM 705 SG CYS A 47 -20.821 3.127 -14.087 1.00 0.00 S ATOM 0 H CYS A 47 -17.151 3.857 -14.372 1.00 0.00 H new ATOM 0 HA CYS A 47 -19.351 5.449 -13.183 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -18.756 2.473 -13.065 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -19.815 3.270 -11.918 1.00 0.00 H new ATOM 0 HG CYS A 47 -21.422 1.997 -13.860 1.00 0.00 H new ATOM 711 N ILE A 48 -17.339 3.756 -11.268 1.00 0.00 N ATOM 712 CA ILE A 48 -16.469 3.838 -10.102 1.00 0.00 C ATOM 713 C ILE A 48 -16.319 2.477 -9.430 1.00 0.00 C ATOM 714 O ILE A 48 -16.847 2.231 -8.346 1.00 0.00 O ATOM 715 CB ILE A 48 -17.004 4.850 -9.071 1.00 0.00 C ATOM 716 CG1 ILE A 48 -18.518 5.008 -9.217 1.00 0.00 C ATOM 717 CG2 ILE A 48 -16.307 6.193 -9.237 1.00 0.00 C ATOM 718 CD1 ILE A 48 -19.239 5.168 -7.897 1.00 0.00 C ATOM 0 H ILE A 48 -17.601 2.807 -11.533 1.00 0.00 H new ATOM 0 HA ILE A 48 -15.495 4.174 -10.458 1.00 0.00 H new ATOM 0 HB ILE A 48 -16.792 4.474 -8.070 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -18.726 5.876 -9.843 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -18.918 4.137 -9.737 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -16.695 6.898 -8.502 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -15.235 6.067 -9.088 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -16.491 6.577 -10.240 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -20.309 5.275 -8.077 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -19.062 4.289 -7.277 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -18.867 6.055 -7.384 1.00 0.00 H new ATOM 730 N PRO A 49 -15.580 1.571 -10.088 1.00 0.00 N ATOM 731 CA PRO A 49 -15.341 0.220 -9.573 1.00 0.00 C ATOM 732 C PRO A 49 -14.431 0.219 -8.350 1.00 0.00 C ATOM 733 O PRO A 49 -13.754 1.208 -8.066 1.00 0.00 O ATOM 734 CB PRO A 49 -14.662 -0.492 -10.745 1.00 0.00 C ATOM 735 CG PRO A 49 -14.023 0.600 -11.533 1.00 0.00 C ATOM 736 CD PRO A 49 -14.921 1.797 -11.386 1.00 0.00 C ATOM 0 HA PRO A 49 -16.263 -0.259 -9.242 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -13.923 -1.213 -10.396 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -15.385 -1.043 -11.346 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.022 0.815 -11.160 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -13.919 0.316 -12.580 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -14.354 2.728 -11.392 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -15.645 1.859 -12.199 1.00 0.00 H new ATOM 744 N ASP A 50 -14.418 -0.896 -7.629 1.00 0.00 N ATOM 745 CA ASP A 50 -13.588 -1.026 -6.436 1.00 0.00 C ATOM 746 C ASP A 50 -12.499 -2.074 -6.643 1.00 0.00 C ATOM 747 O ASP A 50 -12.782 -3.213 -7.016 1.00 0.00 O ATOM 748 CB ASP A 50 -14.449 -1.399 -5.228 1.00 0.00 C ATOM 749 CG ASP A 50 -14.241 -0.461 -4.056 1.00 0.00 C ATOM 750 OD1 ASP A 50 -13.783 0.679 -4.283 1.00 0.00 O ATOM 751 OD2 ASP A 50 -14.536 -0.866 -2.913 1.00 0.00 O ATOM 0 H ASP A 50 -14.972 -1.723 -7.849 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.111 -0.064 -6.249 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.500 -1.387 -5.517 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.215 -2.418 -4.920 1.00 0.00 H new ATOM 756 N VAL A 51 -11.253 -1.681 -6.400 1.00 0.00 N ATOM 757 CA VAL A 51 -10.121 -2.586 -6.560 1.00 0.00 C ATOM 758 C VAL A 51 -9.643 -3.112 -5.211 1.00 0.00 C ATOM 759 O VAL A 51 -9.092 -2.365 -4.403 1.00 0.00 O ATOM 760 CB VAL A 51 -8.945 -1.894 -7.274 1.00 0.00 C ATOM 761 CG1 VAL A 51 -8.132 -2.906 -8.067 1.00 0.00 C ATOM 762 CG2 VAL A 51 -9.453 -0.780 -8.177 1.00 0.00 C ATOM 0 H VAL A 51 -11.002 -0.742 -6.092 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.467 -3.420 -7.171 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.293 -1.452 -6.520 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.305 -2.399 -8.565 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.738 -3.665 -7.392 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.769 -3.380 -8.814 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.609 -0.301 -8.674 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -10.126 -1.197 -8.926 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -9.988 -0.042 -7.579 1.00 0.00 H new ATOM 772 N GLU A 52 -9.857 -4.402 -4.975 1.00 0.00 N ATOM 773 CA GLU A 52 -9.448 -5.028 -3.722 1.00 0.00 C ATOM 774 C GLU A 52 -8.329 -6.038 -3.959 1.00 0.00 C ATOM 775 O GLU A 52 -8.440 -6.915 -4.817 1.00 0.00 O ATOM 776 CB GLU A 52 -10.641 -5.717 -3.057 1.00 0.00 C ATOM 777 CG GLU A 52 -10.277 -7.009 -2.344 1.00 0.00 C ATOM 778 CD GLU A 52 -9.133 -6.832 -1.365 1.00 0.00 C ATOM 779 OE1 GLU A 52 -8.749 -5.673 -1.105 1.00 0.00 O ATOM 780 OE2 GLU A 52 -8.621 -7.853 -0.859 1.00 0.00 O ATOM 0 H GLU A 52 -10.311 -5.034 -5.634 1.00 0.00 H new ATOM 0 HA GLU A 52 -9.074 -4.247 -3.060 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -11.093 -5.031 -2.340 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.396 -5.930 -3.814 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.151 -7.385 -1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -10.005 -7.763 -3.083 1.00 0.00 H new ATOM 787 N LEU A 53 -7.252 -5.909 -3.193 1.00 0.00 N ATOM 788 CA LEU A 53 -6.112 -6.810 -3.318 1.00 0.00 C ATOM 789 C LEU A 53 -5.831 -7.520 -1.998 1.00 0.00 C ATOM 790 O LEU A 53 -5.511 -6.882 -0.994 1.00 0.00 O ATOM 791 CB LEU A 53 -4.871 -6.035 -3.768 1.00 0.00 C ATOM 792 CG LEU A 53 -3.524 -6.699 -3.479 1.00 0.00 C ATOM 793 CD1 LEU A 53 -3.151 -6.532 -2.014 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.563 -8.172 -3.857 1.00 0.00 C ATOM 0 H LEU A 53 -7.144 -5.189 -2.479 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.356 -7.562 -4.069 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.945 -5.861 -4.842 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.883 -5.058 -3.286 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.762 -6.210 -4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.190 -7.011 -1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -3.081 -5.471 -1.775 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.915 -6.995 -1.389 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.596 -8.628 -3.644 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.337 -8.676 -3.278 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.784 -8.269 -4.920 1.00 0.00 H new ATOM 806 N SER A 54 -5.950 -8.844 -2.006 1.00 0.00 N ATOM 807 CA SER A 54 -5.710 -9.640 -0.809 1.00 0.00 C ATOM 808 C SER A 54 -4.533 -10.589 -1.014 1.00 0.00 C ATOM 809 O SER A 54 -4.655 -11.611 -1.690 1.00 0.00 O ATOM 810 CB SER A 54 -6.964 -10.437 -0.441 1.00 0.00 C ATOM 811 OG SER A 54 -7.169 -10.446 0.961 1.00 0.00 O ATOM 0 H SER A 54 -6.211 -9.388 -2.829 1.00 0.00 H new ATOM 0 HA SER A 54 -5.468 -8.959 0.007 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.833 -10.003 -0.936 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.868 -11.460 -0.804 1.00 0.00 H new ATOM 0 HG SER A 54 -7.977 -10.960 1.170 1.00 0.00 H new ATOM 817 N HIS A 55 -3.393 -10.243 -0.425 1.00 0.00 N ATOM 818 CA HIS A 55 -2.192 -11.063 -0.542 1.00 0.00 C ATOM 819 C HIS A 55 -2.543 -12.477 -0.998 1.00 0.00 C ATOM 820 O HIS A 55 -2.799 -13.358 -0.179 1.00 0.00 O ATOM 821 CB HIS A 55 -1.452 -11.115 0.795 1.00 0.00 C ATOM 822 CG HIS A 55 -0.323 -10.135 0.892 1.00 0.00 C ATOM 823 ND1 HIS A 55 0.376 -9.907 2.058 1.00 0.00 N ATOM 824 CD2 HIS A 55 0.228 -9.324 -0.041 1.00 0.00 C ATOM 825 CE1 HIS A 55 1.308 -8.996 1.839 1.00 0.00 C ATOM 826 NE2 HIS A 55 1.240 -8.627 0.573 1.00 0.00 N ATOM 0 H HIS A 55 -3.275 -9.401 0.138 1.00 0.00 H new ATOM 0 HA HIS A 55 -1.543 -10.609 -1.290 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.160 -10.922 1.601 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.063 -12.122 0.947 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -0.072 -9.240 -1.075 1.00 0.00 H new ATOM 0 HE1 HIS A 55 2.006 -8.618 2.571 1.00 0.00 H new ATOM 0 HE2 HIS A 55 1.841 -7.936 0.124 1.00 0.00 H new ATOM 834 N GLY A 56 -2.552 -12.685 -2.311 1.00 0.00 N ATOM 835 CA GLY A 56 -2.873 -13.992 -2.853 1.00 0.00 C ATOM 836 C GLY A 56 -4.187 -14.000 -3.609 1.00 0.00 C ATOM 837 O GLY A 56 -4.659 -15.054 -4.037 1.00 0.00 O ATOM 0 H GLY A 56 -2.343 -11.971 -3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.072 -14.312 -3.519 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.921 -14.717 -2.041 1.00 0.00 H new ATOM 841 N VAL A 57 -4.781 -12.822 -3.773 1.00 0.00 N ATOM 842 CA VAL A 57 -6.049 -12.697 -4.481 1.00 0.00 C ATOM 843 C VAL A 57 -6.243 -11.283 -5.015 1.00 0.00 C ATOM 844 O VAL A 57 -5.681 -10.325 -4.483 1.00 0.00 O ATOM 845 CB VAL A 57 -7.238 -13.060 -3.572 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.489 -13.304 -4.401 1.00 0.00 C ATOM 847 CG2 VAL A 57 -6.906 -14.276 -2.721 1.00 0.00 C ATOM 0 H VAL A 57 -4.404 -11.941 -3.425 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.015 -13.396 -5.317 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.432 -12.220 -2.904 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.318 -13.559 -3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.735 -12.402 -4.962 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.311 -14.126 -5.095 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.757 -14.518 -2.085 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.684 -15.124 -3.369 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.038 -14.058 -2.098 1.00 0.00 H new ATOM 857 N MET A 58 -7.043 -11.158 -6.068 1.00 0.00 N ATOM 858 CA MET A 58 -7.314 -9.859 -6.673 1.00 0.00 C ATOM 859 C MET A 58 -8.798 -9.705 -6.990 1.00 0.00 C ATOM 860 O MET A 58 -9.264 -10.126 -8.050 1.00 0.00 O ATOM 861 CB MET A 58 -6.487 -9.684 -7.948 1.00 0.00 C ATOM 862 CG MET A 58 -5.666 -8.404 -7.969 1.00 0.00 C ATOM 863 SD MET A 58 -6.205 -7.255 -9.249 1.00 0.00 S ATOM 864 CE MET A 58 -7.834 -6.817 -8.647 1.00 0.00 C ATOM 0 H MET A 58 -7.515 -11.941 -6.521 1.00 0.00 H new ATOM 0 HA MET A 58 -7.032 -9.087 -5.957 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.818 -10.537 -8.057 1.00 0.00 H new ATOM 0 HB3 MET A 58 -7.156 -9.691 -8.809 1.00 0.00 H new ATOM 0 HG2 MET A 58 -5.735 -7.917 -6.996 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.617 -8.652 -8.128 1.00 0.00 H new ATOM 0 HE1 MET A 58 -7.979 -5.741 -8.739 1.00 0.00 H new ATOM 0 HE2 MET A 58 -8.591 -7.336 -9.235 1.00 0.00 H new ATOM 0 HE3 MET A 58 -7.925 -7.107 -7.600 1.00 0.00 H new ATOM 874 N THR A 59 -9.537 -9.100 -6.066 1.00 0.00 N ATOM 875 CA THR A 59 -10.968 -8.892 -6.246 1.00 0.00 C ATOM 876 C THR A 59 -11.264 -7.467 -6.699 1.00 0.00 C ATOM 877 O THR A 59 -11.115 -6.516 -5.930 1.00 0.00 O ATOM 878 CB THR A 59 -11.745 -9.178 -4.947 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.871 -9.751 -3.969 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.909 -10.121 -5.210 1.00 0.00 C ATOM 0 H THR A 59 -9.167 -8.745 -5.184 1.00 0.00 H new ATOM 0 HA THR A 59 -11.294 -9.590 -7.017 1.00 0.00 H new ATOM 0 HB THR A 59 -12.140 -8.234 -4.571 1.00 0.00 H new ATOM 0 HG1 THR A 59 -11.372 -9.928 -3.146 1.00 0.00 H new ATOM 0 HG21 THR A 59 -13.443 -10.309 -4.278 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.588 -9.668 -5.933 1.00 0.00 H new ATOM 0 HG23 THR A 59 -12.531 -11.063 -5.608 1.00 0.00 H new ATOM 888 N LEU A 60 -11.684 -7.324 -7.951 1.00 0.00 N ATOM 889 CA LEU A 60 -12.003 -6.014 -8.507 1.00 0.00 C ATOM 890 C LEU A 60 -13.500 -5.882 -8.767 1.00 0.00 C ATOM 891 O LEU A 60 -14.021 -6.428 -9.739 1.00 0.00 O ATOM 892 CB LEU A 60 -11.226 -5.786 -9.805 1.00 0.00 C ATOM 893 CG LEU A 60 -11.769 -4.696 -10.730 1.00 0.00 C ATOM 894 CD1 LEU A 60 -11.349 -3.320 -10.237 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.292 -4.922 -12.157 1.00 0.00 C ATOM 0 H LEU A 60 -11.812 -8.100 -8.601 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.712 -5.257 -7.779 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.196 -5.538 -9.549 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.200 -6.724 -10.359 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.858 -4.746 -10.720 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.744 -2.557 -10.907 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -11.740 -3.158 -9.233 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -10.261 -3.257 -10.217 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -11.688 -4.137 -12.802 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.203 -4.899 -12.184 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -11.643 -5.892 -12.509 1.00 0.00 H new ATOM 907 N GLU A 61 -14.185 -5.151 -7.893 1.00 0.00 N ATOM 908 CA GLU A 61 -15.622 -4.946 -8.031 1.00 0.00 C ATOM 909 C GLU A 61 -15.929 -4.001 -9.188 1.00 0.00 C ATOM 910 O GLU A 61 -15.248 -2.992 -9.377 1.00 0.00 O ATOM 911 CB GLU A 61 -16.206 -4.386 -6.732 1.00 0.00 C ATOM 912 CG GLU A 61 -17.623 -3.857 -6.880 1.00 0.00 C ATOM 913 CD GLU A 61 -18.250 -3.487 -5.550 1.00 0.00 C ATOM 914 OE1 GLU A 61 -18.878 -4.367 -4.924 1.00 0.00 O ATOM 915 OE2 GLU A 61 -18.111 -2.318 -5.134 1.00 0.00 O ATOM 0 H GLU A 61 -13.769 -4.692 -7.083 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.082 -5.911 -8.242 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.197 -5.168 -5.973 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.563 -3.583 -6.371 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.614 -2.981 -7.529 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.239 -4.611 -7.370 1.00 0.00 H new ATOM 922 N ILE A 62 -16.958 -4.335 -9.960 1.00 0.00 N ATOM 923 CA ILE A 62 -17.355 -3.516 -11.099 1.00 0.00 C ATOM 924 C ILE A 62 -18.866 -3.313 -11.129 1.00 0.00 C ATOM 925 O ILE A 62 -19.620 -4.147 -11.631 1.00 0.00 O ATOM 926 CB ILE A 62 -16.907 -4.148 -12.430 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.437 -4.565 -12.353 1.00 0.00 C ATOM 928 CG2 ILE A 62 -17.128 -3.175 -13.579 1.00 0.00 C ATOM 929 CD1 ILE A 62 -15.195 -6.004 -12.753 1.00 0.00 C ATOM 0 H ILE A 62 -17.531 -5.166 -9.818 1.00 0.00 H new ATOM 0 HA ILE A 62 -16.863 -2.551 -10.981 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.508 -5.039 -12.613 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -14.849 -3.913 -12.999 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.078 -4.414 -11.335 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -16.807 -3.636 -14.513 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -18.187 -2.923 -13.644 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -16.549 -2.268 -13.404 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -14.131 -6.230 -12.674 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -15.756 -6.665 -12.092 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -15.523 -6.156 -13.781 1.00 0.00 H new ATOM 941 N PRO A 63 -19.321 -2.176 -10.580 1.00 0.00 N ATOM 942 CA PRO A 63 -20.746 -1.835 -10.534 1.00 0.00 C ATOM 943 C PRO A 63 -21.310 -1.510 -11.913 1.00 0.00 C ATOM 944 O PRO A 63 -21.729 -0.383 -12.173 1.00 0.00 O ATOM 945 CB PRO A 63 -20.785 -0.596 -9.635 1.00 0.00 C ATOM 946 CG PRO A 63 -19.431 0.011 -9.769 1.00 0.00 C ATOM 947 CD PRO A 63 -18.479 -1.137 -9.964 1.00 0.00 C ATOM 0 HA PRO A 63 -21.352 -2.664 -10.168 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.563 0.098 -9.951 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -20.998 -0.864 -8.600 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.393 0.697 -10.615 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.172 0.586 -8.880 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -17.644 -0.862 -10.608 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.054 -1.472 -9.018 1.00 0.00 H new ATOM 955 N ALA A 64 -21.317 -2.505 -12.793 1.00 0.00 N ATOM 956 CA ALA A 64 -21.832 -2.326 -14.145 1.00 0.00 C ATOM 957 C ALA A 64 -21.965 -3.664 -14.864 1.00 0.00 C ATOM 958 O ALA A 64 -22.924 -3.891 -15.602 1.00 0.00 O ATOM 959 CB ALA A 64 -20.929 -1.388 -14.934 1.00 0.00 C ATOM 0 H ALA A 64 -20.972 -3.444 -12.594 1.00 0.00 H new ATOM 0 HA ALA A 64 -22.825 -1.882 -14.073 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -21.325 -1.263 -15.942 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -20.889 -0.419 -14.437 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -19.925 -1.810 -14.989 1.00 0.00 H new ATOM 965 N PHE A 65 -20.997 -4.547 -14.645 1.00 0.00 N ATOM 966 CA PHE A 65 -21.006 -5.863 -15.274 1.00 0.00 C ATOM 967 C PHE A 65 -20.910 -6.967 -14.225 1.00 0.00 C ATOM 968 O PHE A 65 -21.213 -8.128 -14.500 1.00 0.00 O ATOM 969 CB PHE A 65 -19.848 -5.985 -16.267 1.00 0.00 C ATOM 970 CG PHE A 65 -19.061 -4.716 -16.428 1.00 0.00 C ATOM 971 CD1 PHE A 65 -19.696 -3.526 -16.745 1.00 0.00 C ATOM 972 CD2 PHE A 65 -17.685 -4.712 -16.262 1.00 0.00 C ATOM 973 CE1 PHE A 65 -18.974 -2.357 -16.895 1.00 0.00 C ATOM 974 CE2 PHE A 65 -16.958 -3.546 -16.410 1.00 0.00 C ATOM 975 CZ PHE A 65 -17.603 -2.367 -16.726 1.00 0.00 C ATOM 0 H PHE A 65 -20.196 -4.376 -14.037 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.948 -5.976 -15.810 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.178 -6.779 -15.936 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -20.242 -6.284 -17.238 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.768 -3.512 -16.876 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -17.175 -5.631 -16.014 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.481 -1.437 -17.144 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -15.886 -3.557 -16.279 1.00 0.00 H new ATOM 0 HZ PHE A 65 -17.037 -1.454 -16.841 1.00 0.00 H new ATOM 985 N GLY A 66 -20.484 -6.597 -13.021 1.00 0.00 N ATOM 986 CA GLY A 66 -20.355 -7.567 -11.950 1.00 0.00 C ATOM 987 C GLY A 66 -19.094 -7.364 -11.133 1.00 0.00 C ATOM 988 O GLY A 66 -18.654 -6.232 -10.927 1.00 0.00 O ATOM 0 H GLY A 66 -20.226 -5.643 -12.769 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.224 -7.498 -11.295 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.353 -8.572 -12.372 1.00 0.00 H new ATOM 992 N THR A 67 -18.511 -8.462 -10.663 1.00 0.00 N ATOM 993 CA THR A 67 -17.296 -8.400 -9.862 1.00 0.00 C ATOM 994 C THR A 67 -16.257 -9.398 -10.359 1.00 0.00 C ATOM 995 O THR A 67 -16.503 -10.604 -10.384 1.00 0.00 O ATOM 996 CB THR A 67 -17.588 -8.678 -8.375 1.00 0.00 C ATOM 997 OG1 THR A 67 -18.736 -7.933 -7.953 1.00 0.00 O ATOM 998 CG2 THR A 67 -16.392 -8.310 -7.510 1.00 0.00 C ATOM 0 H THR A 67 -18.862 -9.406 -10.824 1.00 0.00 H new ATOM 0 HA THR A 67 -16.902 -7.389 -9.965 1.00 0.00 H new ATOM 0 HB THR A 67 -17.785 -9.744 -8.260 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.916 -8.117 -7.007 1.00 0.00 H new ATOM 0 HG21 THR A 67 -16.622 -8.515 -6.465 1.00 0.00 H new ATOM 0 HG22 THR A 67 -15.528 -8.901 -7.814 1.00 0.00 H new ATOM 0 HG23 THR A 67 -16.168 -7.250 -7.631 1.00 0.00 H new ATOM 1006 N TYR A 68 -15.096 -8.889 -10.754 1.00 0.00 N ATOM 1007 CA TYR A 68 -14.019 -9.737 -11.253 1.00 0.00 C ATOM 1008 C TYR A 68 -13.085 -10.154 -10.121 1.00 0.00 C ATOM 1009 O TYR A 68 -12.853 -9.395 -9.180 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.228 -9.006 -12.339 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.574 -9.450 -13.742 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.362 -10.761 -14.150 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.113 -8.557 -14.661 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -13.676 -11.170 -15.431 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -14.432 -8.958 -15.944 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.211 -10.265 -16.325 1.00 0.00 C ATOM 1017 OH TYR A 68 -14.526 -10.669 -17.602 1.00 0.00 O ATOM 0 H TYR A 68 -14.876 -7.893 -10.739 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.466 -10.635 -11.680 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.410 -7.935 -12.251 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -12.163 -9.164 -12.169 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.944 -11.473 -13.453 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.285 -7.532 -14.367 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.504 -12.193 -15.732 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.852 -8.252 -16.645 1.00 0.00 H new ATOM 0 HH TYR A 68 -14.894 -9.911 -18.103 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.551 -11.367 -10.220 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.641 -11.887 -9.206 1.00 0.00 C ATOM 1029 C VAL A 69 -10.501 -12.674 -9.843 1.00 0.00 C ATOM 1030 O VAL A 69 -10.714 -13.448 -10.777 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.378 -12.793 -8.202 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.611 -12.872 -6.891 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.795 -12.291 -7.971 1.00 0.00 C ATOM 0 H VAL A 69 -12.733 -12.008 -10.992 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.233 -11.027 -8.675 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.437 -13.797 -8.622 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -12.147 -13.516 -6.194 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.618 -13.283 -7.075 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.518 -11.874 -6.463 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.301 -12.943 -7.259 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.761 -11.277 -7.573 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.340 -12.293 -8.915 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.292 -12.470 -9.332 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.118 -13.162 -9.850 1.00 0.00 C ATOM 1045 C ILE A 70 -7.140 -13.501 -8.730 1.00 0.00 C ATOM 1046 O ILE A 70 -6.554 -12.611 -8.114 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.390 -12.318 -10.913 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.404 -11.619 -11.822 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.451 -13.191 -11.731 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -8.899 -10.300 -11.274 1.00 0.00 C ATOM 0 H ILE A 70 -9.099 -11.832 -8.560 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.474 -14.084 -10.310 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.797 -11.556 -10.407 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.949 -11.450 -12.798 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -9.256 -12.281 -11.978 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -5.944 -12.580 -12.478 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.712 -13.647 -11.072 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.023 -13.973 -12.230 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -9.614 -9.862 -11.970 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -9.384 -10.465 -10.312 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -8.056 -9.621 -11.144 1.00 0.00 H new ATOM 1062 N ASN A 71 -6.969 -14.793 -8.472 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.061 -15.250 -7.426 1.00 0.00 C ATOM 1064 C ASN A 71 -4.966 -16.140 -8.007 1.00 0.00 C ATOM 1065 O ASN A 71 -5.094 -16.658 -9.117 1.00 0.00 O ATOM 1066 CB ASN A 71 -6.834 -16.012 -6.348 1.00 0.00 C ATOM 1067 CG ASN A 71 -6.177 -17.331 -5.988 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -5.965 -18.186 -6.848 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -5.853 -17.501 -4.712 1.00 0.00 N ATOM 0 H ASN A 71 -7.447 -15.542 -8.973 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.593 -14.374 -6.977 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.912 -15.393 -5.455 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -7.850 -16.198 -6.697 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -5.409 -18.368 -4.410 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -6.048 -16.764 -4.034 1.00 0.00 H new ATOM 1076 N LYS A 72 -3.889 -16.314 -7.249 1.00 0.00 N ATOM 1077 CA LYS A 72 -2.771 -17.142 -7.686 1.00 0.00 C ATOM 1078 C LYS A 72 -2.048 -17.754 -6.490 1.00 0.00 C ATOM 1079 O LYS A 72 -0.905 -18.196 -6.605 1.00 0.00 O ATOM 1080 CB LYS A 72 -1.791 -16.314 -8.520 1.00 0.00 C ATOM 1081 CG LYS A 72 -0.753 -15.581 -7.688 1.00 0.00 C ATOM 1082 CD LYS A 72 -1.391 -14.845 -6.522 1.00 0.00 C ATOM 1083 CE LYS A 72 -0.450 -13.803 -5.938 1.00 0.00 C ATOM 1084 NZ LYS A 72 -1.188 -12.740 -5.200 1.00 0.00 N ATOM 0 H LYS A 72 -3.766 -15.892 -6.328 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.168 -17.950 -8.301 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.282 -16.971 -9.225 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.351 -15.588 -9.109 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.018 -16.293 -7.312 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.216 -14.871 -8.317 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.310 -14.361 -6.855 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.669 -15.560 -5.748 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.257 -14.289 -5.265 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.133 -13.350 -6.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.106 -11.840 -5.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.191 -13.004 -5.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.783 -12.633 -4.248 1.00 0.00 H new ATOM 1098 N GLN A 73 -2.721 -17.777 -5.345 1.00 0.00 N ATOM 1099 CA GLN A 73 -2.142 -18.335 -4.129 1.00 0.00 C ATOM 1100 C GLN A 73 -3.036 -19.427 -3.551 1.00 0.00 C ATOM 1101 O GLN A 73 -3.258 -19.507 -2.343 1.00 0.00 O ATOM 1102 CB GLN A 73 -1.924 -17.234 -3.090 1.00 0.00 C ATOM 1103 CG GLN A 73 -1.234 -17.718 -1.825 1.00 0.00 C ATOM 1104 CD GLN A 73 -1.984 -17.331 -0.566 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -2.020 -16.161 -0.186 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -2.588 -18.315 0.090 1.00 0.00 N ATOM 0 H GLN A 73 -3.668 -17.416 -5.234 1.00 0.00 H new ATOM 0 HA GLN A 73 -1.179 -18.778 -4.386 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.329 -16.438 -3.536 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.888 -16.801 -2.825 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.132 -18.803 -1.864 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -0.226 -17.304 -1.785 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.532 -19.271 -0.261 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -3.108 -18.115 0.945 1.00 0.00 H new ATOM 1115 N PRO A 74 -3.564 -20.289 -4.433 1.00 0.00 N ATOM 1116 CA PRO A 74 -4.443 -21.391 -4.033 1.00 0.00 C ATOM 1117 C PRO A 74 -3.697 -22.479 -3.269 1.00 0.00 C ATOM 1118 O PRO A 74 -2.468 -22.485 -3.189 1.00 0.00 O ATOM 1119 CB PRO A 74 -4.960 -21.935 -5.368 1.00 0.00 C ATOM 1120 CG PRO A 74 -3.912 -21.562 -6.360 1.00 0.00 C ATOM 1121 CD PRO A 74 -3.343 -20.253 -5.889 1.00 0.00 C ATOM 0 HA PRO A 74 -5.232 -21.059 -3.358 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -5.101 -23.015 -5.328 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -5.924 -21.498 -5.627 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.137 -22.327 -6.415 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.337 -21.466 -7.359 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.284 -20.164 -6.133 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.849 -19.405 -6.351 1.00 0.00 H new ATOM 1129 N PRO A 75 -4.454 -23.424 -2.692 1.00 0.00 N ATOM 1130 CA PRO A 75 -3.885 -24.535 -1.924 1.00 0.00 C ATOM 1131 C PRO A 75 -3.144 -25.532 -2.808 1.00 0.00 C ATOM 1132 O PRO A 75 -3.540 -26.691 -2.921 1.00 0.00 O ATOM 1133 CB PRO A 75 -5.113 -25.194 -1.290 1.00 0.00 C ATOM 1134 CG PRO A 75 -6.242 -24.844 -2.198 1.00 0.00 C ATOM 1135 CD PRO A 75 -5.925 -23.480 -2.746 1.00 0.00 C ATOM 0 HA PRO A 75 -3.146 -24.193 -1.200 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -4.987 -26.274 -1.213 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -5.286 -24.820 -0.281 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.338 -25.575 -3.001 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -7.189 -24.837 -1.658 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -6.295 -23.360 -3.764 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.379 -22.691 -2.147 1.00 0.00 H new ATOM 1143 N ASN A 76 -2.065 -25.072 -3.433 1.00 0.00 N ATOM 1144 CA ASN A 76 -1.267 -25.924 -4.308 1.00 0.00 C ATOM 1145 C ASN A 76 -0.399 -25.085 -5.241 1.00 0.00 C ATOM 1146 O ASN A 76 0.773 -24.835 -4.960 1.00 0.00 O ATOM 1147 CB ASN A 76 -2.176 -26.842 -5.128 1.00 0.00 C ATOM 1148 CG ASN A 76 -2.264 -28.239 -4.545 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -1.440 -28.631 -3.718 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -3.265 -28.998 -4.975 1.00 0.00 N ATOM 0 H ASN A 76 -1.723 -24.115 -3.350 1.00 0.00 H new ATOM 0 HA ASN A 76 -0.614 -26.533 -3.683 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -3.175 -26.409 -5.179 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -1.802 -26.901 -6.150 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -3.374 -29.948 -4.619 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -3.924 -28.632 -5.661 1.00 0.00 H new ATOM 1157 N LYS A 77 -0.983 -24.651 -6.353 1.00 0.00 N ATOM 1158 CA LYS A 77 -0.266 -23.838 -7.328 1.00 0.00 C ATOM 1159 C LYS A 77 -1.095 -23.648 -8.594 1.00 0.00 C ATOM 1160 O LYS A 77 -0.988 -24.430 -9.538 1.00 0.00 O ATOM 1161 CB LYS A 77 1.075 -24.487 -7.676 1.00 0.00 C ATOM 1162 CG LYS A 77 1.568 -24.154 -9.074 1.00 0.00 C ATOM 1163 CD LYS A 77 3.084 -24.200 -9.156 1.00 0.00 C ATOM 1164 CE LYS A 77 3.645 -25.420 -8.442 1.00 0.00 C ATOM 1165 NZ LYS A 77 3.033 -26.684 -8.939 1.00 0.00 N ATOM 0 H LYS A 77 -1.952 -24.849 -6.601 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.085 -22.859 -6.884 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.823 -24.167 -6.950 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.981 -25.569 -7.581 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.143 -24.859 -9.788 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.217 -23.162 -9.358 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.392 -24.215 -10.201 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.501 -23.295 -8.714 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.725 -25.459 -8.584 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.467 -25.327 -7.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.366 -27.049 -8.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.526 -26.498 -9.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.779 -27.388 -9.107 1.00 0.00 H new ATOM 1179 N GLN A 78 -1.919 -22.606 -8.606 1.00 0.00 N ATOM 1180 CA GLN A 78 -2.765 -22.314 -9.757 1.00 0.00 C ATOM 1181 C GLN A 78 -3.312 -20.892 -9.685 1.00 0.00 C ATOM 1182 O GLN A 78 -3.141 -20.202 -8.680 1.00 0.00 O ATOM 1183 CB GLN A 78 -3.920 -23.314 -9.834 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.621 -24.523 -10.705 1.00 0.00 C ATOM 1185 CD GLN A 78 -3.680 -25.827 -9.935 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -2.663 -26.319 -9.444 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -4.875 -26.396 -9.823 1.00 0.00 N ATOM 0 H GLN A 78 -2.019 -21.950 -7.832 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.155 -22.404 -10.656 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.163 -23.653 -8.827 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.803 -22.807 -10.222 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.335 -24.559 -11.528 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.631 -24.411 -11.147 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.692 -25.954 -10.245 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -4.976 -27.275 -9.315 1.00 0.00 H new ATOM 1196 N ILE A 79 -3.970 -20.462 -10.756 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.542 -19.122 -10.813 1.00 0.00 C ATOM 1198 C ILE A 79 -6.062 -19.178 -10.915 1.00 0.00 C ATOM 1199 O ILE A 79 -6.611 -19.721 -11.874 1.00 0.00 O ATOM 1200 CB ILE A 79 -3.988 -18.323 -12.007 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -2.723 -17.565 -11.599 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.041 -17.362 -12.536 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -2.410 -16.386 -12.493 1.00 0.00 C ATOM 0 H ILE A 79 -4.120 -21.021 -11.596 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.260 -18.619 -9.888 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.729 -19.021 -12.803 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -2.835 -17.213 -10.573 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.878 -18.253 -11.610 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.634 -16.805 -13.380 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.916 -17.924 -12.861 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.329 -16.667 -11.747 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.501 -15.896 -12.144 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -2.266 -16.733 -13.516 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -3.238 -15.677 -12.464 1.00 0.00 H new ATOM 1215 N TRP A 80 -6.737 -18.612 -9.921 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.196 -18.595 -9.900 1.00 0.00 C ATOM 1217 C TRP A 80 -8.737 -17.378 -10.642 1.00 0.00 C ATOM 1218 O TRP A 80 -8.241 -16.264 -10.472 1.00 0.00 O ATOM 1219 CB TRP A 80 -8.705 -18.597 -8.458 1.00 0.00 C ATOM 1220 CG TRP A 80 -8.969 -19.972 -7.922 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.159 -21.066 -8.039 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -10.121 -20.400 -7.188 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -8.739 -22.148 -7.422 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -9.943 -21.765 -6.891 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.285 -19.762 -6.751 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -10.886 -22.501 -6.179 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -12.220 -20.494 -6.045 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -12.016 -21.852 -5.764 1.00 0.00 C ATOM 0 H TRP A 80 -6.298 -18.159 -9.119 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.553 -19.493 -10.405 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -7.972 -18.101 -7.821 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.623 -18.011 -8.404 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.204 -21.078 -8.542 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -8.338 -23.084 -7.368 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.451 -18.716 -6.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -10.731 -23.548 -5.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.124 -20.012 -5.704 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -12.766 -22.396 -5.209 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.757 -17.598 -11.464 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.366 -16.518 -12.233 1.00 0.00 C ATOM 1241 C LEU A 81 -11.883 -16.524 -12.072 1.00 0.00 C ATOM 1242 O LEU A 81 -12.575 -17.363 -12.648 1.00 0.00 O ATOM 1243 CB LEU A 81 -9.998 -16.647 -13.712 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.055 -15.358 -14.533 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -11.484 -15.058 -14.956 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -9.476 -14.195 -13.740 1.00 0.00 C ATOM 0 H LEU A 81 -10.180 -18.514 -11.615 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.982 -15.572 -11.851 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.989 -17.053 -13.781 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.667 -17.376 -14.170 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.453 -15.495 -15.431 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.505 -14.137 -15.539 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -11.864 -15.880 -15.562 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.109 -14.941 -14.070 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.525 -13.286 -14.339 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.051 -14.057 -12.824 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.437 -14.408 -13.488 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.393 -15.581 -11.287 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.828 -15.475 -11.054 1.00 0.00 C ATOM 1260 C ALA A 82 -14.446 -14.382 -11.920 1.00 0.00 C ATOM 1261 O ALA A 82 -14.081 -13.211 -11.811 1.00 0.00 O ATOM 1262 CB ALA A 82 -14.106 -15.205 -9.583 1.00 0.00 C ATOM 0 H ALA A 82 -11.834 -14.879 -10.802 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.286 -16.424 -11.331 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -15.182 -15.128 -9.424 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.708 -16.022 -8.981 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.628 -14.271 -9.288 1.00 0.00 H new ATOM 1268 N SER A 83 -15.381 -14.771 -12.779 1.00 0.00 N ATOM 1269 CA SER A 83 -16.046 -13.825 -13.667 1.00 0.00 C ATOM 1270 C SER A 83 -16.954 -12.885 -12.878 1.00 0.00 C ATOM 1271 O SER A 83 -17.209 -13.080 -11.690 1.00 0.00 O ATOM 1272 CB SER A 83 -16.862 -14.571 -14.725 1.00 0.00 C ATOM 1273 OG SER A 83 -16.725 -15.974 -14.578 1.00 0.00 O ATOM 0 H SER A 83 -15.696 -15.736 -12.879 1.00 0.00 H new ATOM 0 HA SER A 83 -15.279 -13.231 -14.163 1.00 0.00 H new ATOM 0 HB2 SER A 83 -17.913 -14.294 -14.640 1.00 0.00 H new ATOM 0 HB3 SER A 83 -16.533 -14.272 -15.720 1.00 0.00 H new ATOM 0 HG SER A 83 -17.257 -16.428 -15.264 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.453 -11.841 -13.555 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.341 -10.850 -12.938 1.00 0.00 C ATOM 1281 C PRO A 84 -19.716 -11.424 -12.616 1.00 0.00 C ATOM 1282 O PRO A 84 -20.592 -10.720 -12.112 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.453 -9.761 -14.008 1.00 0.00 C ATOM 1284 CG PRO A 84 -18.184 -10.463 -15.294 1.00 0.00 C ATOM 1285 CD PRO A 84 -17.191 -11.546 -14.973 1.00 0.00 C ATOM 0 HA PRO A 84 -17.953 -10.492 -11.984 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.443 -9.305 -14.006 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.733 -8.961 -13.836 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -19.100 -10.884 -15.708 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -17.784 -9.775 -16.038 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.339 -12.425 -15.600 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -16.166 -11.211 -15.131 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.899 -12.707 -12.909 1.00 0.00 N ATOM 1294 CA LEU A 85 -21.169 -13.377 -12.649 1.00 0.00 C ATOM 1295 C LEU A 85 -20.988 -14.524 -11.660 1.00 0.00 C ATOM 1296 O LEU A 85 -21.904 -15.315 -11.437 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.766 -13.904 -13.955 1.00 0.00 C ATOM 1298 CG LEU A 85 -20.815 -14.687 -14.860 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -20.422 -16.004 -14.210 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -21.453 -14.931 -16.220 1.00 0.00 C ATOM 0 H LEU A 85 -19.185 -13.304 -13.326 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.852 -12.649 -12.211 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -22.613 -14.545 -13.711 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -22.158 -13.058 -14.519 1.00 0.00 H new ATOM 0 HG LEU A 85 -19.912 -14.094 -15.005 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -19.745 -16.547 -14.869 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -19.924 -15.807 -13.261 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -21.315 -16.603 -14.034 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -20.762 -15.490 -16.851 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -22.372 -15.503 -16.093 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -21.683 -13.975 -16.691 1.00 0.00 H new ATOM 1312 N SER A 86 -19.800 -14.606 -11.069 1.00 0.00 N ATOM 1313 CA SER A 86 -19.498 -15.657 -10.104 1.00 0.00 C ATOM 1314 C SER A 86 -19.088 -16.944 -10.814 1.00 0.00 C ATOM 1315 O SER A 86 -19.804 -17.943 -10.775 1.00 0.00 O ATOM 1316 CB SER A 86 -20.709 -15.919 -9.207 1.00 0.00 C ATOM 1317 OG SER A 86 -20.308 -16.204 -7.878 1.00 0.00 O ATOM 0 H SER A 86 -19.032 -13.958 -11.241 1.00 0.00 H new ATOM 0 HA SER A 86 -18.665 -15.321 -9.487 1.00 0.00 H new ATOM 0 HB2 SER A 86 -21.365 -15.049 -9.213 1.00 0.00 H new ATOM 0 HB3 SER A 86 -21.285 -16.755 -9.604 1.00 0.00 H new ATOM 0 HG SER A 86 -21.101 -16.366 -7.325 1.00 0.00 H new ATOM 1323 N GLY A 87 -17.928 -16.911 -11.463 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.441 -18.079 -12.173 1.00 0.00 C ATOM 1325 C GLY A 87 -15.939 -18.245 -12.056 1.00 0.00 C ATOM 1326 O GLY A 87 -15.178 -17.831 -12.931 1.00 0.00 O ATOM 0 H GLY A 87 -17.317 -16.096 -11.510 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.933 -18.969 -11.782 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.714 -18.000 -13.225 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.492 -18.862 -10.953 1.00 0.00 N ATOM 1331 CA PRO A 88 -14.067 -19.094 -10.698 1.00 0.00 C ATOM 1332 C PRO A 88 -13.472 -20.135 -11.640 1.00 0.00 C ATOM 1333 O PRO A 88 -14.096 -21.155 -11.927 1.00 0.00 O ATOM 1334 CB PRO A 88 -14.043 -19.604 -9.255 1.00 0.00 C ATOM 1335 CG PRO A 88 -15.391 -20.201 -9.041 1.00 0.00 C ATOM 1336 CD PRO A 88 -16.343 -19.382 -9.869 1.00 0.00 C ATOM 0 HA PRO A 88 -13.473 -18.194 -10.856 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -13.255 -20.343 -9.110 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.853 -18.793 -8.552 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -15.408 -21.247 -9.347 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.667 -20.173 -7.987 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.162 -19.988 -10.257 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.790 -18.576 -9.287 1.00 0.00 H new ATOM 1344 N ASN A 89 -12.260 -19.870 -12.118 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.581 -20.784 -13.029 1.00 0.00 C ATOM 1346 C ASN A 89 -10.150 -21.046 -12.569 1.00 0.00 C ATOM 1347 O ASN A 89 -9.383 -20.113 -12.329 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.576 -20.214 -14.448 1.00 0.00 C ATOM 1349 CG ASN A 89 -12.518 -20.959 -15.374 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -13.738 -20.863 -15.245 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -11.953 -21.708 -16.314 1.00 0.00 N ATOM 0 H ASN A 89 -11.728 -19.030 -11.889 1.00 0.00 H new ATOM 0 HA ASN A 89 -12.124 -21.729 -13.027 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -11.860 -19.162 -14.415 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.564 -20.259 -14.851 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -12.535 -22.233 -16.966 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -10.937 -21.758 -16.384 1.00 0.00 H new ATOM 1358 N ARG A 90 -9.796 -22.321 -12.449 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.458 -22.706 -12.017 1.00 0.00 C ATOM 1360 C ARG A 90 -7.512 -22.812 -13.210 1.00 0.00 C ATOM 1361 O ARG A 90 -7.744 -23.592 -14.133 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.504 -24.040 -11.270 1.00 0.00 C ATOM 1363 CG ARG A 90 -9.772 -24.239 -10.455 1.00 0.00 C ATOM 1364 CD ARG A 90 -10.731 -25.197 -11.143 1.00 0.00 C ATOM 1365 NE ARG A 90 -10.138 -26.517 -11.342 1.00 0.00 N ATOM 1366 CZ ARG A 90 -10.721 -27.488 -12.036 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -11.906 -27.288 -12.596 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -10.118 -28.662 -12.173 1.00 0.00 N ATOM 0 H ARG A 90 -10.418 -23.106 -12.645 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.084 -21.934 -11.345 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.414 -24.853 -11.990 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.642 -24.105 -10.606 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -9.515 -24.625 -9.469 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.263 -23.278 -10.303 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -11.638 -25.293 -10.546 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.027 -24.784 -12.107 1.00 0.00 H new ATOM 0 HE ARG A 90 -9.226 -26.703 -10.925 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -12.372 -26.387 -12.495 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -12.351 -28.036 -13.128 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -9.206 -28.820 -11.745 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -10.567 -29.407 -12.706 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.444 -22.021 -13.183 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.463 -22.023 -14.262 1.00 0.00 C ATOM 1384 C PHE A 91 -4.142 -22.626 -13.794 1.00 0.00 C ATOM 1385 O PHE A 91 -3.718 -22.415 -12.658 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.234 -20.600 -14.775 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.371 -20.070 -15.601 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -7.497 -19.538 -14.993 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -6.314 -20.105 -16.985 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -8.545 -19.049 -15.750 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -7.359 -19.617 -17.747 1.00 0.00 C ATOM 1392 CZ PHE A 91 -8.476 -19.090 -17.129 1.00 0.00 C ATOM 0 H PHE A 91 -6.236 -21.370 -12.425 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.854 -22.635 -15.074 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.074 -19.937 -13.925 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.322 -20.580 -15.371 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.556 -19.505 -13.915 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -5.444 -20.518 -17.474 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -9.416 -18.636 -15.264 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.302 -19.648 -18.825 1.00 0.00 H new ATOM 0 HZ PHE A 91 -9.294 -18.711 -17.723 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.496 -23.379 -14.679 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.223 -24.013 -14.358 1.00 0.00 C ATOM 1404 C ASP A 92 -1.073 -23.319 -15.082 1.00 0.00 C ATOM 1405 O ASP A 92 -1.288 -22.563 -16.030 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.258 -25.495 -14.733 1.00 0.00 C ATOM 1407 CG ASP A 92 -1.325 -26.331 -13.879 1.00 0.00 C ATOM 1408 OD1 ASP A 92 -0.862 -25.824 -12.836 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -1.057 -27.492 -14.254 1.00 0.00 O ATOM 0 H ASP A 92 -3.833 -23.565 -15.624 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.060 -23.922 -13.284 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.276 -25.870 -14.627 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.984 -25.608 -15.782 1.00 0.00 H new ATOM 1414 N LEU A 93 0.148 -23.580 -14.629 1.00 0.00 N ATOM 1415 CA LEU A 93 1.333 -22.981 -15.232 1.00 0.00 C ATOM 1416 C LEU A 93 1.729 -23.721 -16.506 1.00 0.00 C ATOM 1417 O LEU A 93 2.434 -24.730 -16.456 1.00 0.00 O ATOM 1418 CB LEU A 93 2.496 -22.991 -14.239 1.00 0.00 C ATOM 1419 CG LEU A 93 2.409 -24.023 -13.114 1.00 0.00 C ATOM 1420 CD1 LEU A 93 1.353 -23.616 -12.098 1.00 0.00 C ATOM 1421 CD2 LEU A 93 2.105 -25.403 -13.678 1.00 0.00 C ATOM 0 H LEU A 93 0.343 -24.203 -13.845 1.00 0.00 H new ATOM 0 HA LEU A 93 1.096 -21.949 -15.492 1.00 0.00 H new ATOM 0 HB2 LEU A 93 3.419 -23.164 -14.793 1.00 0.00 H new ATOM 0 HB3 LEU A 93 2.574 -22.000 -13.791 1.00 0.00 H new ATOM 0 HG LEU A 93 3.374 -24.064 -12.609 1.00 0.00 H new ATOM 0 HD11 LEU A 93 1.305 -24.362 -11.305 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.613 -22.648 -11.670 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.383 -23.546 -12.590 1.00 0.00 H new ATOM 0 HD21 LEU A 93 2.047 -26.124 -12.863 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.153 -25.378 -14.209 1.00 0.00 H new ATOM 0 HD23 LEU A 93 2.897 -25.697 -14.367 1.00 0.00 H new ATOM 1433 N LEU A 94 1.274 -23.213 -17.645 1.00 0.00 N ATOM 1434 CA LEU A 94 1.583 -23.824 -18.933 1.00 0.00 C ATOM 1435 C LEU A 94 2.174 -22.799 -19.895 1.00 0.00 C ATOM 1436 O LEU A 94 1.630 -21.709 -20.067 1.00 0.00 O ATOM 1437 CB LEU A 94 0.323 -24.444 -19.541 1.00 0.00 C ATOM 1438 CG LEU A 94 0.319 -25.967 -19.669 1.00 0.00 C ATOM 1439 CD1 LEU A 94 0.455 -26.618 -18.302 1.00 0.00 C ATOM 1440 CD2 LEU A 94 -0.949 -26.441 -20.364 1.00 0.00 C ATOM 0 H LEU A 94 0.689 -22.379 -17.703 1.00 0.00 H new ATOM 0 HA LEU A 94 2.323 -24.607 -18.767 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.532 -24.148 -18.934 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.174 -24.016 -20.532 1.00 0.00 H new ATOM 0 HG LEU A 94 1.174 -26.263 -20.276 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.450 -27.702 -18.413 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.392 -26.305 -17.841 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.379 -26.314 -17.670 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -0.934 -27.528 -20.446 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.819 -26.133 -19.784 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.003 -26.002 -21.360 1.00 0.00 H new ATOM 1452 N ASN A 95 3.290 -23.157 -20.522 1.00 0.00 N ATOM 1453 CA ASN A 95 3.954 -22.268 -21.468 1.00 0.00 C ATOM 1454 C ASN A 95 4.322 -20.944 -20.805 1.00 0.00 C ATOM 1455 O ASN A 95 4.160 -19.877 -21.395 1.00 0.00 O ATOM 1456 CB ASN A 95 3.054 -22.013 -22.678 1.00 0.00 C ATOM 1457 CG ASN A 95 2.754 -23.282 -23.453 1.00 0.00 C ATOM 1458 OD1 ASN A 95 1.706 -23.901 -23.270 1.00 0.00 O ATOM 1459 ND2 ASN A 95 3.675 -23.674 -24.325 1.00 0.00 N ATOM 0 H ASN A 95 3.753 -24.056 -20.392 1.00 0.00 H new ATOM 0 HA ASN A 95 4.871 -22.753 -21.802 1.00 0.00 H new ATOM 0 HB2 ASN A 95 2.118 -21.565 -22.343 1.00 0.00 H new ATOM 0 HB3 ASN A 95 3.534 -21.292 -23.339 1.00 0.00 H new ATOM 0 HD21 ASN A 95 3.528 -24.520 -24.876 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.529 -23.130 -24.444 1.00 0.00 H new ATOM 1466 N GLY A 96 4.818 -21.022 -19.574 1.00 0.00 N ATOM 1467 CA GLY A 96 5.201 -19.824 -18.852 1.00 0.00 C ATOM 1468 C GLY A 96 4.033 -18.885 -18.624 1.00 0.00 C ATOM 1469 O GLY A 96 4.223 -17.724 -18.265 1.00 0.00 O ATOM 0 H GLY A 96 4.961 -21.894 -19.064 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.630 -20.105 -17.890 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.980 -19.302 -19.408 1.00 0.00 H new ATOM 1473 N GLU A 97 2.821 -19.389 -18.837 1.00 0.00 N ATOM 1474 CA GLU A 97 1.618 -18.585 -18.655 1.00 0.00 C ATOM 1475 C GLU A 97 0.487 -19.424 -18.066 1.00 0.00 C ATOM 1476 O GLU A 97 0.391 -20.624 -18.325 1.00 0.00 O ATOM 1477 CB GLU A 97 1.177 -17.979 -19.989 1.00 0.00 C ATOM 1478 CG GLU A 97 1.679 -16.561 -20.208 1.00 0.00 C ATOM 1479 CD GLU A 97 0.568 -15.532 -20.137 1.00 0.00 C ATOM 1480 OE1 GLU A 97 -0.500 -15.850 -19.572 1.00 0.00 O ATOM 1481 OE2 GLU A 97 0.766 -14.409 -20.646 1.00 0.00 O ATOM 0 H GLU A 97 2.647 -20.349 -19.135 1.00 0.00 H new ATOM 0 HA GLU A 97 1.851 -17.780 -17.958 1.00 0.00 H new ATOM 0 HB2 GLU A 97 1.534 -18.612 -20.802 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.088 -17.982 -20.038 1.00 0.00 H new ATOM 0 HG2 GLU A 97 2.434 -16.327 -19.458 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.166 -16.498 -21.181 1.00 0.00 H new ATOM 1488 N TRP A 98 -0.364 -18.784 -17.273 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.488 -19.471 -16.646 1.00 0.00 C ATOM 1490 C TRP A 98 -2.574 -19.785 -17.670 1.00 0.00 C ATOM 1491 O TRP A 98 -3.239 -18.883 -18.180 1.00 0.00 O ATOM 1492 CB TRP A 98 -2.067 -18.619 -15.516 1.00 0.00 C ATOM 1493 CG TRP A 98 -1.021 -18.047 -14.607 1.00 0.00 C ATOM 1494 CD1 TRP A 98 -0.449 -16.810 -14.692 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.420 -18.693 -13.479 1.00 0.00 C ATOM 1496 NE1 TRP A 98 0.470 -16.647 -13.684 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.506 -17.787 -12.926 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.576 -19.946 -12.881 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.272 -18.098 -11.806 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.185 -20.253 -11.769 1.00 0.00 C ATOM 1501 CH2 TRP A 98 1.099 -19.332 -11.240 1.00 0.00 C ATOM 0 H TRP A 98 -0.298 -17.791 -17.049 1.00 0.00 H new ATOM 0 HA TRP A 98 -1.122 -20.411 -16.232 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.649 -17.804 -15.947 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.756 -19.227 -14.929 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.684 -16.069 -15.441 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.034 -15.812 -13.526 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.279 -20.662 -13.281 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 1.978 -17.390 -11.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.073 -21.219 -11.300 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.678 -19.601 -10.369 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.748 -21.068 -17.967 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.755 -21.500 -18.929 1.00 0.00 C ATOM 1514 C VAL A 99 -4.620 -22.617 -18.356 1.00 0.00 C ATOM 1515 O VAL A 99 -4.156 -23.426 -17.553 1.00 0.00 O ATOM 1516 CB VAL A 99 -3.107 -21.989 -20.238 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -1.734 -21.359 -20.422 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -3.011 -23.508 -20.250 1.00 0.00 C ATOM 0 H VAL A 99 -2.205 -21.827 -17.555 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.380 -20.633 -19.143 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.737 -21.681 -21.072 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.291 -21.716 -21.352 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.834 -20.274 -20.461 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.092 -21.635 -19.585 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.551 -23.836 -21.182 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.403 -23.841 -19.408 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -4.010 -23.936 -20.168 1.00 0.00 H new ATOM 1528 N SER A 100 -5.881 -22.655 -18.774 1.00 0.00 N ATOM 1529 CA SER A 100 -6.814 -23.671 -18.300 1.00 0.00 C ATOM 1530 C SER A 100 -7.108 -24.692 -19.395 1.00 0.00 C ATOM 1531 O SER A 100 -7.326 -24.332 -20.553 1.00 0.00 O ATOM 1532 CB SER A 100 -8.116 -23.019 -17.831 1.00 0.00 C ATOM 1533 OG SER A 100 -8.507 -23.516 -16.562 1.00 0.00 O ATOM 0 H SER A 100 -6.280 -21.994 -19.440 1.00 0.00 H new ATOM 0 HA SER A 100 -6.352 -24.189 -17.459 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.986 -21.938 -17.778 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.905 -23.210 -18.559 1.00 0.00 H new ATOM 0 HG SER A 100 -7.826 -23.285 -15.896 1.00 0.00 H new ATOM 1539 N LEU A 101 -7.114 -25.966 -19.020 1.00 0.00 N ATOM 1540 CA LEU A 101 -7.383 -27.041 -19.969 1.00 0.00 C ATOM 1541 C LEU A 101 -8.476 -26.638 -20.954 1.00 0.00 C ATOM 1542 O LEU A 101 -8.417 -26.979 -22.135 1.00 0.00 O ATOM 1543 CB LEU A 101 -7.793 -28.314 -19.226 1.00 0.00 C ATOM 1544 CG LEU A 101 -7.432 -29.634 -19.907 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -5.970 -29.636 -20.327 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -7.725 -30.808 -18.983 1.00 0.00 C ATOM 0 H LEU A 101 -6.936 -26.280 -18.066 1.00 0.00 H new ATOM 0 HA LEU A 101 -6.468 -27.234 -20.530 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -7.331 -28.299 -18.239 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -8.872 -28.290 -19.073 1.00 0.00 H new ATOM 0 HG LEU A 101 -8.046 -29.739 -20.802 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.731 -30.584 -20.810 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -5.791 -28.818 -21.025 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.339 -29.508 -19.448 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -7.462 -31.740 -19.484 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -7.137 -30.708 -18.070 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -8.786 -30.818 -18.732 1.00 0.00 H new ATOM 1558 N ARG A 102 -9.471 -25.910 -20.459 1.00 0.00 N ATOM 1559 CA ARG A 102 -10.577 -25.459 -21.295 1.00 0.00 C ATOM 1560 C ARG A 102 -10.085 -25.076 -22.688 1.00 0.00 C ATOM 1561 O ARG A 102 -9.676 -23.940 -22.922 1.00 0.00 O ATOM 1562 CB ARG A 102 -11.283 -24.267 -20.646 1.00 0.00 C ATOM 1563 CG ARG A 102 -12.719 -24.085 -21.107 1.00 0.00 C ATOM 1564 CD ARG A 102 -13.022 -22.629 -21.426 1.00 0.00 C ATOM 1565 NE ARG A 102 -13.139 -21.817 -20.218 1.00 0.00 N ATOM 1566 CZ ARG A 102 -13.786 -20.658 -20.172 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -14.371 -20.177 -21.260 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -13.848 -19.976 -19.035 1.00 0.00 N ATOM 0 H ARG A 102 -9.534 -25.620 -19.483 1.00 0.00 H new ATOM 0 HA ARG A 102 -11.285 -26.282 -21.392 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.271 -24.394 -19.563 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.722 -23.359 -20.867 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -12.899 -24.697 -21.991 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -13.399 -24.438 -20.331 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.232 -22.225 -22.059 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.950 -22.568 -21.995 1.00 0.00 H new ATOM 0 HE ARG A 102 -12.700 -22.158 -19.363 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.325 -20.697 -22.136 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.867 -19.287 -21.221 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -13.399 -20.342 -18.196 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -14.345 -19.086 -19.001 1.00 0.00 H new ATOM 1582 N ASN A 103 -10.128 -26.034 -23.609 1.00 0.00 N ATOM 1583 CA ASN A 103 -9.686 -25.797 -24.978 1.00 0.00 C ATOM 1584 C ASN A 103 -8.407 -24.965 -25.001 1.00 0.00 C ATOM 1585 O ASN A 103 -8.110 -24.291 -25.986 1.00 0.00 O ATOM 1586 CB ASN A 103 -10.783 -25.089 -25.776 1.00 0.00 C ATOM 1587 CG ASN A 103 -12.009 -25.960 -25.972 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -11.956 -26.978 -26.662 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -13.121 -25.562 -25.365 1.00 0.00 N ATOM 0 H ASN A 103 -10.464 -26.981 -23.432 1.00 0.00 H new ATOM 0 HA ASN A 103 -9.478 -26.763 -25.438 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -11.070 -24.173 -25.260 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -10.389 -24.796 -26.749 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -13.978 -26.107 -25.461 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -13.118 -24.711 -24.803 1.00 0.00 H new ATOM 1596 N GLY A 104 -7.653 -25.018 -23.907 1.00 0.00 N ATOM 1597 CA GLY A 104 -6.415 -24.266 -23.822 1.00 0.00 C ATOM 1598 C GLY A 104 -6.648 -22.768 -23.801 1.00 0.00 C ATOM 1599 O GLY A 104 -6.339 -22.071 -24.768 1.00 0.00 O ATOM 0 H GLY A 104 -7.878 -25.568 -23.078 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.876 -24.560 -22.921 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.780 -24.520 -24.671 1.00 0.00 H new ATOM 1603 N THR A 105 -7.195 -22.270 -22.697 1.00 0.00 N ATOM 1604 CA THR A 105 -7.471 -20.847 -22.555 1.00 0.00 C ATOM 1605 C THR A 105 -6.478 -20.185 -21.606 1.00 0.00 C ATOM 1606 O THR A 105 -5.872 -20.848 -20.764 1.00 0.00 O ATOM 1607 CB THR A 105 -8.901 -20.601 -22.037 1.00 0.00 C ATOM 1608 OG1 THR A 105 -9.294 -21.662 -21.160 1.00 0.00 O ATOM 1609 CG2 THR A 105 -9.885 -20.500 -23.193 1.00 0.00 C ATOM 0 H THR A 105 -7.456 -22.833 -21.887 1.00 0.00 H new ATOM 0 HA THR A 105 -7.370 -20.406 -23.547 1.00 0.00 H new ATOM 0 HB THR A 105 -8.909 -19.658 -21.491 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.922 -21.318 -20.491 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.888 -20.326 -22.803 1.00 0.00 H new ATOM 0 HG22 THR A 105 -9.600 -19.672 -23.842 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.873 -21.429 -23.763 1.00 0.00 H new ATOM 1617 N LYS A 106 -6.316 -18.874 -21.747 1.00 0.00 N ATOM 1618 CA LYS A 106 -5.398 -18.121 -20.901 1.00 0.00 C ATOM 1619 C LYS A 106 -6.162 -17.256 -19.903 1.00 0.00 C ATOM 1620 O LYS A 106 -7.365 -17.036 -20.051 1.00 0.00 O ATOM 1621 CB LYS A 106 -4.485 -17.242 -21.759 1.00 0.00 C ATOM 1622 CG LYS A 106 -3.123 -17.860 -22.027 1.00 0.00 C ATOM 1623 CD LYS A 106 -2.211 -16.897 -22.769 1.00 0.00 C ATOM 1624 CE LYS A 106 -2.447 -16.949 -24.270 1.00 0.00 C ATOM 1625 NZ LYS A 106 -1.858 -15.771 -24.965 1.00 0.00 N ATOM 0 H LYS A 106 -6.809 -18.311 -22.440 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.789 -18.834 -20.345 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -4.977 -17.041 -22.711 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -4.348 -16.282 -21.262 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -2.660 -18.147 -21.083 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -3.245 -18.772 -22.612 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -2.381 -15.883 -22.408 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -1.171 -17.142 -22.555 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -2.013 -17.864 -24.674 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.518 -16.989 -24.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.617 -15.114 -25.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.194 -15.288 -24.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -1.351 -16.088 -25.816 1.00 0.00 H new ATOM 1639 N LEU A 107 -5.457 -16.767 -18.890 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.068 -15.925 -17.868 1.00 0.00 C ATOM 1641 C LEU A 107 -6.187 -14.483 -18.351 1.00 0.00 C ATOM 1642 O LEU A 107 -7.286 -13.992 -18.613 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.248 -15.976 -16.578 1.00 0.00 C ATOM 1644 CG LEU A 107 -5.943 -15.454 -15.320 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -6.732 -14.192 -15.630 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -6.852 -16.523 -14.730 1.00 0.00 C ATOM 0 H LEU A 107 -4.461 -16.939 -18.754 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.069 -16.307 -17.669 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.949 -17.009 -16.402 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.334 -15.401 -16.729 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.179 -15.208 -14.582 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.219 -13.836 -14.723 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.056 -13.423 -16.005 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.487 -14.411 -16.385 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.338 -16.134 -13.835 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -7.609 -16.801 -15.463 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.260 -17.400 -14.469 1.00 0.00 H new ATOM 1658 N THR A 108 -5.047 -13.808 -18.470 1.00 0.00 N ATOM 1659 CA THR A 108 -5.023 -12.423 -18.923 1.00 0.00 C ATOM 1660 C THR A 108 -5.700 -12.276 -20.280 1.00 0.00 C ATOM 1661 O THR A 108 -6.178 -11.198 -20.633 1.00 0.00 O ATOM 1662 CB THR A 108 -3.581 -11.890 -19.021 1.00 0.00 C ATOM 1663 OG1 THR A 108 -3.595 -10.505 -19.387 1.00 0.00 O ATOM 1664 CG2 THR A 108 -2.779 -12.682 -20.042 1.00 0.00 C ATOM 0 H THR A 108 -4.129 -14.199 -18.259 1.00 0.00 H new ATOM 0 HA THR A 108 -5.570 -11.839 -18.183 1.00 0.00 H new ATOM 0 HB THR A 108 -3.108 -12.003 -18.045 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.675 -10.173 -19.446 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.764 -12.287 -20.093 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.746 -13.730 -19.745 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.251 -12.597 -21.021 1.00 0.00 H new ATOM 1672 N ASP A 109 -5.739 -13.367 -21.038 1.00 0.00 N ATOM 1673 CA ASP A 109 -6.360 -13.360 -22.357 1.00 0.00 C ATOM 1674 C ASP A 109 -7.881 -13.394 -22.242 1.00 0.00 C ATOM 1675 O ASP A 109 -8.582 -12.648 -22.926 1.00 0.00 O ATOM 1676 CB ASP A 109 -5.872 -14.553 -23.181 1.00 0.00 C ATOM 1677 CG ASP A 109 -5.302 -14.135 -24.522 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -5.558 -12.989 -24.944 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -4.601 -14.956 -25.151 1.00 0.00 O ATOM 0 H ASP A 109 -5.348 -14.267 -20.761 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.072 -12.438 -22.862 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.111 -15.093 -22.618 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.700 -15.244 -23.341 1.00 0.00 H new ATOM 1684 N ILE A 110 -8.384 -14.265 -21.373 1.00 0.00 N ATOM 1685 CA ILE A 110 -9.821 -14.396 -21.169 1.00 0.00 C ATOM 1686 C ILE A 110 -10.369 -13.229 -20.355 1.00 0.00 C ATOM 1687 O ILE A 110 -11.511 -12.807 -20.545 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.170 -15.714 -20.453 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -10.439 -16.820 -21.477 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.375 -15.521 -19.545 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -9.606 -16.696 -22.733 1.00 0.00 C ATOM 0 H ILE A 110 -7.818 -14.890 -20.799 1.00 0.00 H new ATOM 0 HA ILE A 110 -10.281 -14.395 -22.157 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.321 -16.012 -19.838 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.243 -17.787 -21.015 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.495 -16.804 -21.748 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.609 -16.461 -19.046 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -11.149 -14.760 -18.798 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.231 -15.203 -20.140 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.849 -17.513 -23.413 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.819 -15.744 -23.219 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -8.548 -16.742 -22.474 1.00 0.00 H new ATOM 1703 N LEU A 111 -9.548 -12.709 -19.450 1.00 0.00 N ATOM 1704 CA LEU A 111 -9.949 -11.587 -18.608 1.00 0.00 C ATOM 1705 C LEU A 111 -9.952 -10.284 -19.401 1.00 0.00 C ATOM 1706 O LEU A 111 -10.828 -9.437 -19.221 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.009 -11.464 -17.407 1.00 0.00 C ATOM 1708 CG LEU A 111 -9.676 -11.191 -16.058 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.317 -9.811 -16.049 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -10.710 -12.263 -15.747 1.00 0.00 C ATOM 0 H LEU A 111 -8.600 -13.046 -19.280 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.962 -11.776 -18.252 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.434 -12.386 -17.325 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.299 -10.662 -17.608 1.00 0.00 H new ATOM 0 HG LEU A 111 -8.910 -11.219 -15.283 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -10.787 -9.634 -15.081 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -9.553 -9.054 -16.225 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.071 -9.755 -16.834 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.174 -12.052 -14.784 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.474 -12.268 -16.524 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.224 -13.238 -15.710 1.00 0.00 H new ATOM 1722 N THR A 112 -8.968 -10.131 -20.281 1.00 0.00 N ATOM 1723 CA THR A 112 -8.857 -8.932 -21.103 1.00 0.00 C ATOM 1724 C THR A 112 -9.909 -8.923 -22.206 1.00 0.00 C ATOM 1725 O THR A 112 -10.477 -7.879 -22.525 1.00 0.00 O ATOM 1726 CB THR A 112 -7.460 -8.815 -21.741 1.00 0.00 C ATOM 1727 OG1 THR A 112 -6.465 -8.677 -20.720 1.00 0.00 O ATOM 1728 CG2 THR A 112 -7.394 -7.624 -22.684 1.00 0.00 C ATOM 0 H THR A 112 -8.236 -10.823 -20.443 1.00 0.00 H new ATOM 0 HA THR A 112 -9.019 -8.080 -20.443 1.00 0.00 H new ATOM 0 HB THR A 112 -7.269 -9.723 -22.314 1.00 0.00 H new ATOM 0 HG1 THR A 112 -5.900 -9.478 -20.703 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.398 -7.562 -23.122 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.132 -7.746 -23.476 1.00 0.00 H new ATOM 0 HG23 THR A 112 -7.604 -6.709 -22.130 1.00 0.00 H new ATOM 1736 N GLU A 113 -10.164 -10.093 -22.784 1.00 0.00 N ATOM 1737 CA GLU A 113 -11.149 -10.218 -23.852 1.00 0.00 C ATOM 1738 C GLU A 113 -12.568 -10.144 -23.295 1.00 0.00 C ATOM 1739 O GLU A 113 -13.456 -9.552 -23.908 1.00 0.00 O ATOM 1740 CB GLU A 113 -10.953 -11.535 -24.606 1.00 0.00 C ATOM 1741 CG GLU A 113 -9.725 -11.548 -25.500 1.00 0.00 C ATOM 1742 CD GLU A 113 -9.135 -12.935 -25.661 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -9.618 -13.867 -24.984 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -8.190 -13.090 -26.463 1.00 0.00 O ATOM 0 H GLU A 113 -9.703 -10.967 -22.531 1.00 0.00 H new ATOM 0 HA GLU A 113 -11.005 -9.388 -24.543 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.875 -12.349 -23.885 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -11.836 -11.731 -25.214 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -9.990 -11.154 -26.481 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -8.970 -10.882 -25.083 1.00 0.00 H new ATOM 1751 N GLU A 114 -12.772 -10.750 -22.130 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.083 -10.754 -21.491 1.00 0.00 C ATOM 1753 C GLU A 114 -14.463 -9.353 -21.020 1.00 0.00 C ATOM 1754 O GLU A 114 -15.581 -8.891 -21.248 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.095 -11.723 -20.307 1.00 0.00 C ATOM 1756 CG GLU A 114 -14.249 -13.179 -20.714 1.00 0.00 C ATOM 1757 CD GLU A 114 -14.225 -14.121 -19.526 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -13.800 -13.688 -18.434 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -14.630 -15.291 -19.688 1.00 0.00 O ATOM 0 H GLU A 114 -12.047 -11.244 -21.610 1.00 0.00 H new ATOM 0 HA GLU A 114 -14.817 -11.082 -22.227 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.168 -11.608 -19.745 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -14.911 -11.454 -19.636 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.188 -13.304 -21.254 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -13.447 -13.447 -21.402 1.00 0.00 H new ATOM 1766 N VAL A 115 -13.524 -8.682 -20.361 1.00 0.00 N ATOM 1767 CA VAL A 115 -13.759 -7.333 -19.858 1.00 0.00 C ATOM 1768 C VAL A 115 -13.876 -6.333 -21.002 1.00 0.00 C ATOM 1769 O VAL A 115 -14.606 -5.346 -20.904 1.00 0.00 O ATOM 1770 CB VAL A 115 -12.630 -6.884 -18.911 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -12.595 -7.760 -17.668 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -11.290 -6.909 -19.630 1.00 0.00 C ATOM 0 H VAL A 115 -12.594 -9.050 -20.163 1.00 0.00 H new ATOM 0 HA VAL A 115 -14.698 -7.359 -19.305 1.00 0.00 H new ATOM 0 HB VAL A 115 -12.828 -5.859 -18.598 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -11.791 -7.428 -17.011 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -13.547 -7.685 -17.143 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -12.421 -8.796 -17.958 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -10.504 -6.589 -18.946 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -11.081 -7.922 -19.975 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -11.323 -6.234 -20.485 1.00 0.00 H new ATOM 1782 N GLU A 116 -13.153 -6.594 -22.086 1.00 0.00 N ATOM 1783 CA GLU A 116 -13.177 -5.715 -23.250 1.00 0.00 C ATOM 1784 C GLU A 116 -14.531 -5.778 -23.952 1.00 0.00 C ATOM 1785 O GLU A 116 -15.119 -4.748 -24.283 1.00 0.00 O ATOM 1786 CB GLU A 116 -12.065 -6.097 -24.228 1.00 0.00 C ATOM 1787 CG GLU A 116 -11.911 -5.125 -25.386 1.00 0.00 C ATOM 1788 CD GLU A 116 -12.964 -5.324 -26.458 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -12.908 -6.354 -27.162 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -13.845 -4.449 -26.593 1.00 0.00 O ATOM 0 H GLU A 116 -12.544 -7.406 -22.183 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.013 -4.694 -22.906 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.121 -6.156 -23.686 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.268 -7.092 -24.624 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.970 -4.104 -25.009 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.922 -5.245 -25.827 1.00 0.00 H new ATOM 1797 N LYS A 117 -15.019 -6.993 -24.175 1.00 0.00 N ATOM 1798 CA LYS A 117 -16.303 -7.193 -24.837 1.00 0.00 C ATOM 1799 C LYS A 117 -17.454 -7.028 -23.851 1.00 0.00 C ATOM 1800 O LYS A 117 -18.615 -6.933 -24.248 1.00 0.00 O ATOM 1801 CB LYS A 117 -16.360 -8.582 -25.476 1.00 0.00 C ATOM 1802 CG LYS A 117 -15.360 -8.774 -26.603 1.00 0.00 C ATOM 1803 CD LYS A 117 -15.045 -10.244 -26.824 1.00 0.00 C ATOM 1804 CE LYS A 117 -16.313 -11.073 -26.953 1.00 0.00 C ATOM 1805 NZ LYS A 117 -16.063 -12.365 -27.650 1.00 0.00 N ATOM 0 H LYS A 117 -14.544 -7.855 -23.907 1.00 0.00 H new ATOM 0 HA LYS A 117 -16.404 -6.437 -25.616 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.178 -9.334 -24.708 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -17.365 -8.755 -25.860 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -15.759 -8.344 -27.522 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.441 -8.235 -26.371 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -14.442 -10.356 -27.725 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -14.448 -10.618 -25.993 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -16.721 -11.268 -25.961 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -17.064 -10.504 -27.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -16.952 -12.901 -27.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -15.697 -12.179 -28.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.365 -12.919 -27.114 1.00 0.00 H new ATOM 1819 N ALA A 118 -17.125 -6.993 -22.563 1.00 0.00 N ATOM 1820 CA ALA A 118 -18.132 -6.836 -21.521 1.00 0.00 C ATOM 1821 C ALA A 118 -18.297 -5.370 -21.134 1.00 0.00 C ATOM 1822 O ALA A 118 -19.369 -4.951 -20.696 1.00 0.00 O ATOM 1823 CB ALA A 118 -17.763 -7.667 -20.302 1.00 0.00 C ATOM 0 H ALA A 118 -16.169 -7.071 -22.217 1.00 0.00 H new ATOM 0 HA ALA A 118 -19.085 -7.190 -21.914 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -18.524 -7.540 -19.532 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -17.703 -8.718 -20.583 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -16.798 -7.339 -19.916 1.00 0.00 H new ATOM 1829 N ILE A 119 -17.230 -4.596 -21.298 1.00 0.00 N ATOM 1830 CA ILE A 119 -17.258 -3.177 -20.966 1.00 0.00 C ATOM 1831 C ILE A 119 -17.564 -2.330 -22.196 1.00 0.00 C ATOM 1832 O ILE A 119 -18.173 -1.265 -22.094 1.00 0.00 O ATOM 1833 CB ILE A 119 -15.920 -2.714 -20.358 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -15.781 -3.232 -18.924 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -15.820 -1.197 -20.391 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -14.501 -4.001 -18.682 1.00 0.00 C ATOM 0 H ILE A 119 -16.335 -4.927 -21.659 1.00 0.00 H new ATOM 0 HA ILE A 119 -18.049 -3.042 -20.229 1.00 0.00 H new ATOM 0 HB ILE A 119 -15.105 -3.125 -20.954 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -15.824 -2.388 -18.235 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -16.631 -3.875 -18.694 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -14.869 -0.886 -19.958 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -15.880 -0.851 -21.423 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -16.639 -0.766 -19.816 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -14.469 -4.338 -17.646 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -14.464 -4.865 -19.346 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -13.646 -3.355 -18.880 1.00 0.00 H new ATOM 1848 N SER A 120 -17.137 -2.811 -23.360 1.00 0.00 N ATOM 1849 CA SER A 120 -17.364 -2.097 -24.611 1.00 0.00 C ATOM 1850 C SER A 120 -18.679 -2.529 -25.252 1.00 0.00 C ATOM 1851 O SER A 120 -19.292 -1.776 -26.009 1.00 0.00 O ATOM 1852 CB SER A 120 -16.206 -2.344 -25.580 1.00 0.00 C ATOM 1853 OG SER A 120 -14.960 -2.056 -24.970 1.00 0.00 O ATOM 0 H SER A 120 -16.632 -3.692 -23.462 1.00 0.00 H new ATOM 0 HA SER A 120 -17.422 -1.032 -24.388 1.00 0.00 H new ATOM 0 HB2 SER A 120 -16.221 -3.382 -25.912 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.332 -1.724 -26.468 1.00 0.00 H new ATOM 0 HG SER A 120 -14.611 -2.865 -24.541 1.00 0.00 H new ATOM 1859 N LYS A 121 -19.108 -3.749 -24.944 1.00 0.00 N ATOM 1860 CA LYS A 121 -20.351 -4.283 -25.488 1.00 0.00 C ATOM 1861 C LYS A 121 -21.462 -3.240 -25.433 1.00 0.00 C ATOM 1862 O LYS A 121 -22.313 -3.178 -26.321 1.00 0.00 O ATOM 1863 CB LYS A 121 -20.773 -5.534 -24.714 1.00 0.00 C ATOM 1864 CG LYS A 121 -22.266 -5.607 -24.443 1.00 0.00 C ATOM 1865 CD LYS A 121 -22.672 -6.976 -23.923 1.00 0.00 C ATOM 1866 CE LYS A 121 -23.832 -6.878 -22.943 1.00 0.00 C ATOM 1867 NZ LYS A 121 -24.794 -5.808 -23.327 1.00 0.00 N ATOM 0 H LYS A 121 -18.613 -4.386 -24.320 1.00 0.00 H new ATOM 0 HA LYS A 121 -20.178 -4.548 -26.531 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -20.471 -6.418 -25.276 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.238 -5.561 -23.765 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -22.542 -4.844 -23.716 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -22.814 -5.387 -25.359 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -22.954 -7.615 -24.760 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -21.820 -7.448 -23.434 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -24.352 -7.835 -22.899 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -23.447 -6.678 -21.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -25.735 -6.035 -22.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -24.475 -4.898 -22.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -24.845 -5.742 -24.364 1.00 0.00 H new ATOM 1881 N SER A 122 -21.447 -2.420 -24.387 1.00 0.00 N ATOM 1882 CA SER A 122 -22.455 -1.381 -24.216 1.00 0.00 C ATOM 1883 C SER A 122 -22.087 -0.131 -25.010 1.00 0.00 C ATOM 1884 O SER A 122 -22.929 0.454 -25.690 1.00 0.00 O ATOM 1885 CB SER A 122 -22.610 -1.030 -22.735 1.00 0.00 C ATOM 1886 OG SER A 122 -21.348 -0.835 -22.122 1.00 0.00 O ATOM 0 H SER A 122 -20.748 -2.455 -23.645 1.00 0.00 H new ATOM 0 HA SER A 122 -23.403 -1.764 -24.593 1.00 0.00 H new ATOM 0 HB2 SER A 122 -23.211 -0.126 -22.633 1.00 0.00 H new ATOM 0 HB3 SER A 122 -23.147 -1.829 -22.223 1.00 0.00 H new ATOM 0 HG SER A 122 -21.475 -0.610 -21.177 1.00 0.00 H new ATOM 1892 N GLN A 123 -20.823 0.270 -24.918 1.00 0.00 N ATOM 1893 CA GLN A 123 -20.343 1.450 -25.627 1.00 0.00 C ATOM 1894 C GLN A 123 -20.031 1.121 -27.083 1.00 0.00 C ATOM 1895 O GLN A 123 -20.930 0.824 -27.870 1.00 0.00 O ATOM 1896 CB GLN A 123 -19.098 2.012 -24.940 1.00 0.00 C ATOM 1897 CG GLN A 123 -18.233 2.868 -25.853 1.00 0.00 C ATOM 1898 CD GLN A 123 -18.934 4.136 -26.299 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -19.679 4.135 -27.280 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -18.698 5.227 -25.581 1.00 0.00 N ATOM 0 H GLN A 123 -20.113 -0.205 -24.360 1.00 0.00 H new ATOM 0 HA GLN A 123 -21.132 2.202 -25.605 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -19.405 2.608 -24.081 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -18.500 1.185 -24.557 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -17.311 3.130 -25.333 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -17.950 2.286 -26.730 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -18.074 5.182 -24.776 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -19.141 6.110 -25.834 1.00 0.00 H new