USER MOD reduce.3.24.130724 H: found=0, std=0, add=1443, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1442 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: B 43 LYS NZ :NH3+ 159:sc= 0.0751 (180deg=-0.199) USER MOD Set 1.2: B 73 SER OG : rot 58:sc= 0.457 USER MOD Set 2.1: A 589 SER OG : rot 13:sc=-0.00251! USER MOD Set 2.2: A 593 HIS : no HE2:sc= -4! C(o=-4!,f=-23!) USER MOD Set 3.1: A 543 THR OG1 : rot 170:sc= 0.407 USER MOD Set 3.2: A 574 TYR OH : rot -16:sc= 1.31 USER MOD Set 3.3: A 580 GLN : amide:sc= -0.131 K(o=1.6,f=-4.3!) USER MOD Set 4.1: A 547 MET CE :methyl 151:sc= -1.74 (180deg=-0.0317) USER MOD Set 4.2: A 587 THR OG1 : rot 45:sc= -0.695 USER MOD Single : A 500 SER OG : rot 6:sc= 0.685 USER MOD Single : A 501 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 502 ASN :FLIP amide:sc= -0.202 F(o=-0.99,f=-0.2) USER MOD Single : A 515 SER OG : rot 180:sc= -0.249 USER MOD Single : A 516 THR OG1 : rot 180:sc= 0.391! USER MOD Single : A 522 THR OG1 : rot 180:sc= 0 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 60:sc= 0.277 USER MOD Single : A 532 HIS : no HD1:sc=-0.00941 X(o=-0.0094,f=-0.29) USER MOD Single : A 537 THR OG1 : rot 178:sc= 0.00891 USER MOD Single : A 538 CYS SG : rot 180:sc= -0.325 USER MOD Single : A 539 ASN : amide:sc= -3.41! C(o=-3.4!,f=-5.4!) USER MOD Single : A 544 THR OG1 : rot -170:sc= -0.537 USER MOD Single : A 545 SER OG : rot -134:sc= -1.8! USER MOD Single : A 549 ASN : amide:sc= -0.501 X(o=-0.5,f=-0.025) USER MOD Single : A 554 THR OG1 : rot 180:sc= 0 USER MOD Single : A 559 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0361) USER MOD Single : A 560 THR OG1 : rot -26:sc= 0.552 USER MOD Single : A 575 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 577 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 595 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 596 THR OG1 : rot -35:sc= 0.79 USER MOD Single : A 597 SER OG : rot 180:sc= -0.134 USER MOD Single : A 605 SER OG : rot 180:sc= 0 USER MOD Single : A 606 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 165:sc= 0.122 (180deg=0.0196) USER MOD Single : B 3 SER OG : rot 42:sc= 0.344 USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 145:sc= 0.585 (180deg=0.0544) USER MOD Single : B 8 ASN : amide:sc= -11! C(o=-11!,f=-18!) USER MOD Single : B 10 LYS NZ :NH3+ -110:sc= -0.797 (180deg=-2.19!) USER MOD Single : B 11 LYS NZ :NH3+ -149:sc= -4.03! (180deg=-6.43!) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 21 SER OG : rot 180:sc= -0.182 USER MOD Single : B 22 ASN : amide:sc= -1.85 K(o=-1.8,f=-7.7!) USER MOD Single : B 23 THR OG1 : rot 180:sc= 0.0994 USER MOD Single : B 27 THR OG1 : rot -120:sc= -1.59! USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 THR OG1 : rot 54:sc= -2.44! USER MOD Single : B 30 LYS NZ :NH3+ -158:sc= -0.0285 (180deg=-0.286) USER MOD Single : B 33 GLN : amide:sc= -2.28! C(o=-2.3!,f=-4.3!) USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 37 CYS SG : rot 180:sc= -0.952 USER MOD Single : B 40 SER OG : rot -32:sc= 0.241 USER MOD Single : B 41 GLN :FLIP amide:sc= -1.88! C(o=-4.3!,f=-1.9!) USER MOD Single : B 46 TYR OH : rot 123:sc= 0.613 USER MOD Single : B 47 SER OG : rot -57:sc= 0.145 USER MOD Single : B 49 LYS NZ :NH3+ -162:sc= 0.557 (180deg=0.404) USER MOD Single : B 52 GLN :FLIP amide:sc= -0.926 F(o=-1.8!,f=-0.93) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 55 LYS NZ :NH3+ 133:sc= -0.298 (180deg=-1.7!) USER MOD Single : B 56 THR OG1 : rot 180:sc= -0.137 USER MOD Single : B 58 SER OG : rot 180:sc= 0 USER MOD Single : B 60 CYS SG : rot -8:sc= -6.61! USER MOD Single : B 63 LYS NZ :NH3+ -130:sc= -6.98! (180deg=-10.6!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 71 MET CE :methyl 136:sc= -0.942 (180deg=-3.93!) USER MOD Single : B 74 GLN : amide:sc= -0.0538 X(o=-0.054,f=-0.062) USER MOD Single : B 75 LYS NZ :NH3+ 141:sc= 0.383 (180deg=-0.0966) USER MOD ----------------------------------------------------------------- ATOM 212 N PHE A 497 19.603 -14.712 -0.756 1.00 0.00 N ATOM 213 CA PHE A 497 18.672 -14.315 0.294 1.00 0.00 C ATOM 214 C PHE A 497 18.397 -15.481 1.237 1.00 0.00 C ATOM 215 O PHE A 497 18.450 -15.331 2.458 1.00 0.00 O ATOM 216 CB PHE A 497 17.357 -13.837 -0.325 1.00 0.00 C ATOM 217 CG PHE A 497 17.649 -12.934 -1.500 1.00 0.00 C ATOM 218 CD1 PHE A 497 18.487 -11.824 -1.340 1.00 0.00 C ATOM 219 CD2 PHE A 497 17.081 -13.206 -2.751 1.00 0.00 C ATOM 220 CE1 PHE A 497 18.756 -10.986 -2.428 1.00 0.00 C ATOM 221 CE2 PHE A 497 17.351 -12.369 -3.839 1.00 0.00 C ATOM 222 CZ PHE A 497 18.188 -11.258 -3.678 1.00 0.00 C ATOM 0 HA PHE A 497 19.123 -13.501 0.862 1.00 0.00 H new ATOM 0 HB2 PHE A 497 16.764 -14.692 -0.649 1.00 0.00 H new ATOM 0 HB3 PHE A 497 16.766 -13.303 0.419 1.00 0.00 H new ATOM 0 HD1 PHE A 497 18.926 -11.614 -0.376 1.00 0.00 H new ATOM 0 HD2 PHE A 497 16.434 -14.062 -2.876 1.00 0.00 H new ATOM 0 HE1 PHE A 497 19.402 -10.129 -2.303 1.00 0.00 H new ATOM 0 HE2 PHE A 497 16.914 -12.580 -4.804 1.00 0.00 H new ATOM 0 HZ PHE A 497 18.395 -10.611 -4.518 1.00 0.00 H new ATOM 232 N ALA A 498 18.104 -16.643 0.664 1.00 0.00 N ATOM 233 CA ALA A 498 17.823 -17.830 1.465 1.00 0.00 C ATOM 234 C ALA A 498 19.002 -18.154 2.376 1.00 0.00 C ATOM 235 O ALA A 498 18.933 -19.070 3.195 1.00 0.00 O ATOM 236 CB ALA A 498 17.541 -19.022 0.549 1.00 0.00 C ATOM 0 H ALA A 498 18.055 -16.789 -0.344 1.00 0.00 H new ATOM 0 HA ALA A 498 16.947 -17.630 2.082 1.00 0.00 H new ATOM 0 HB1 ALA A 498 17.332 -19.904 1.154 1.00 0.00 H new ATOM 0 HB2 ALA A 498 16.679 -18.801 -0.080 1.00 0.00 H new ATOM 0 HB3 ALA A 498 18.411 -19.211 -0.080 1.00 0.00 H new ATOM 242 N GLY A 499 20.084 -17.394 2.229 1.00 0.00 N ATOM 243 CA GLY A 499 21.274 -17.609 3.044 1.00 0.00 C ATOM 244 C GLY A 499 21.380 -16.556 4.141 1.00 0.00 C ATOM 245 O GLY A 499 22.298 -16.590 4.961 1.00 0.00 O ATOM 0 H GLY A 499 20.161 -16.630 1.558 1.00 0.00 H new ATOM 0 HA2 GLY A 499 21.239 -18.603 3.491 1.00 0.00 H new ATOM 0 HA3 GLY A 499 22.163 -17.574 2.414 1.00 0.00 H new ATOM 249 N SER A 500 20.434 -15.622 4.152 1.00 0.00 N ATOM 250 CA SER A 500 20.433 -14.563 5.155 1.00 0.00 C ATOM 251 C SER A 500 19.145 -13.749 5.074 1.00 0.00 C ATOM 252 O SER A 500 19.019 -12.849 4.244 1.00 0.00 O ATOM 253 CB SER A 500 21.633 -13.641 4.943 1.00 0.00 C ATOM 254 OG SER A 500 22.819 -14.315 5.344 1.00 0.00 O ATOM 0 H SER A 500 19.665 -15.577 3.484 1.00 0.00 H new ATOM 0 HA SER A 500 20.498 -15.023 6.141 1.00 0.00 H new ATOM 0 HB2 SER A 500 21.703 -13.351 3.895 1.00 0.00 H new ATOM 0 HB3 SER A 500 21.509 -12.725 5.520 1.00 0.00 H new ATOM 0 HG SER A 500 22.605 -15.243 5.577 1.00 0.00 H new ATOM 260 N LYS A 501 18.191 -14.073 5.942 1.00 0.00 N ATOM 261 CA LYS A 501 16.915 -13.365 5.960 1.00 0.00 C ATOM 262 C LYS A 501 16.986 -12.158 6.890 1.00 0.00 C ATOM 263 O LYS A 501 16.154 -12.002 7.783 1.00 0.00 O ATOM 264 CB LYS A 501 15.803 -14.306 6.425 1.00 0.00 C ATOM 265 CG LYS A 501 15.472 -15.299 5.309 1.00 0.00 C ATOM 266 CD LYS A 501 14.503 -16.357 5.837 1.00 0.00 C ATOM 267 CE LYS A 501 13.928 -17.155 4.665 1.00 0.00 C ATOM 268 NZ LYS A 501 12.970 -18.173 5.180 1.00 0.00 N ATOM 0 H LYS A 501 18.276 -14.815 6.637 1.00 0.00 H new ATOM 0 HA LYS A 501 16.698 -13.018 4.950 1.00 0.00 H new ATOM 0 HB2 LYS A 501 16.117 -14.842 7.321 1.00 0.00 H new ATOM 0 HB3 LYS A 501 14.915 -13.733 6.691 1.00 0.00 H new ATOM 0 HG2 LYS A 501 15.029 -14.775 4.462 1.00 0.00 H new ATOM 0 HG3 LYS A 501 16.384 -15.774 4.948 1.00 0.00 H new ATOM 0 HD2 LYS A 501 15.018 -17.025 6.527 1.00 0.00 H new ATOM 0 HD3 LYS A 501 13.698 -15.881 6.396 1.00 0.00 H new ATOM 0 HE2 LYS A 501 13.424 -16.486 3.968 1.00 0.00 H new ATOM 0 HE3 LYS A 501 14.732 -17.643 4.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 12.579 -18.716 4.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 13.464 -18.818 5.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 12.197 -17.697 5.687 1.00 0.00 H new ATOM 282 N ASN A 502 17.983 -11.307 6.673 1.00 0.00 N ATOM 283 CA ASN A 502 18.152 -10.116 7.498 1.00 0.00 C ATOM 284 C ASN A 502 17.263 -8.984 6.992 1.00 0.00 C ATOM 285 O ASN A 502 16.497 -9.159 6.045 1.00 0.00 O ATOM 286 CB ASN A 502 19.614 -9.669 7.477 1.00 0.00 C ATOM 287 CG ASN A 502 20.486 -10.705 8.179 1.00 0.00 C ATOM 288 OD1 ASN A 502 21.410 -11.332 7.503 1.00 0.00 O flip ATOM 289 ND2 ASN A 502 20.321 -10.951 9.374 1.00 0.00 N flip ATOM 0 H ASN A 502 18.682 -11.418 5.938 1.00 0.00 H new ATOM 0 HA ASN A 502 17.863 -10.360 8.520 1.00 0.00 H new ATOM 0 HB2 ASN A 502 19.948 -9.538 6.448 1.00 0.00 H new ATOM 0 HB3 ASN A 502 19.715 -8.702 7.971 1.00 0.00 H new ATOM 0 HD21 ASN A 502 19.599 -10.460 9.901 1.00 0.00 H new ATOM 0 HD22 ASN A 502 20.907 -11.646 9.837 1.00 0.00 H new ATOM 296 N ASP A 503 17.374 -7.822 7.629 1.00 0.00 N ATOM 297 CA ASP A 503 16.577 -6.667 7.234 1.00 0.00 C ATOM 298 C ASP A 503 17.344 -5.800 6.241 1.00 0.00 C ATOM 299 O ASP A 503 16.874 -4.736 5.839 1.00 0.00 O ATOM 300 CB ASP A 503 16.215 -5.837 8.467 1.00 0.00 C ATOM 301 CG ASP A 503 15.761 -6.753 9.599 1.00 0.00 C ATOM 302 OD1 ASP A 503 14.876 -7.559 9.362 1.00 0.00 O ATOM 303 OD2 ASP A 503 16.306 -6.636 10.684 1.00 0.00 O ATOM 0 H ASP A 503 18.003 -7.656 8.415 1.00 0.00 H new ATOM 0 HA ASP A 503 15.665 -7.025 6.756 1.00 0.00 H new ATOM 0 HB2 ASP A 503 17.077 -5.251 8.786 1.00 0.00 H new ATOM 0 HB3 ASP A 503 15.422 -5.131 8.220 1.00 0.00 H new ATOM 308 N GLU A 504 18.525 -6.263 5.849 1.00 0.00 N ATOM 309 CA GLU A 504 19.349 -5.522 4.902 1.00 0.00 C ATOM 310 C GLU A 504 18.921 -5.830 3.471 1.00 0.00 C ATOM 311 O GLU A 504 18.722 -4.924 2.663 1.00 0.00 O ATOM 312 CB GLU A 504 20.822 -5.892 5.087 1.00 0.00 C ATOM 313 CG GLU A 504 21.690 -4.991 4.205 1.00 0.00 C ATOM 314 CD GLU A 504 23.164 -5.328 4.408 1.00 0.00 C ATOM 315 OE1 GLU A 504 23.556 -5.520 5.546 1.00 0.00 O ATOM 316 OE2 GLU A 504 23.877 -5.389 3.420 1.00 0.00 O ATOM 0 H GLU A 504 18.931 -7.142 6.170 1.00 0.00 H new ATOM 0 HA GLU A 504 19.218 -4.456 5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 504 21.108 -5.779 6.133 1.00 0.00 H new ATOM 0 HB3 GLU A 504 20.981 -6.938 4.824 1.00 0.00 H new ATOM 0 HG2 GLU A 504 21.419 -5.123 3.158 1.00 0.00 H new ATOM 0 HG3 GLU A 504 21.510 -3.945 4.451 1.00 0.00 H new ATOM 323 N VAL A 505 18.779 -7.116 3.168 1.00 0.00 N ATOM 324 CA VAL A 505 18.371 -7.535 1.833 1.00 0.00 C ATOM 325 C VAL A 505 17.169 -6.720 1.365 1.00 0.00 C ATOM 326 O VAL A 505 17.179 -6.155 0.272 1.00 0.00 O ATOM 327 CB VAL A 505 18.013 -9.022 1.842 1.00 0.00 C ATOM 328 CG1 VAL A 505 17.140 -9.348 0.628 1.00 0.00 C ATOM 329 CG2 VAL A 505 19.295 -9.855 1.784 1.00 0.00 C ATOM 0 H VAL A 505 18.939 -7.881 3.824 1.00 0.00 H new ATOM 0 HA VAL A 505 19.200 -7.367 1.146 1.00 0.00 H new ATOM 0 HB VAL A 505 17.466 -9.256 2.755 1.00 0.00 H new ATOM 0 HG11 VAL A 505 16.886 -10.408 0.636 1.00 0.00 H new ATOM 0 HG12 VAL A 505 16.226 -8.756 0.668 1.00 0.00 H new ATOM 0 HG13 VAL A 505 17.685 -9.113 -0.286 1.00 0.00 H new ATOM 0 HG21 VAL A 505 19.041 -10.915 1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 505 19.842 -9.618 0.871 1.00 0.00 H new ATOM 0 HG23 VAL A 505 19.917 -9.626 2.649 1.00 0.00 H new ATOM 339 N LEU A 506 16.136 -6.666 2.200 1.00 0.00 N ATOM 340 CA LEU A 506 14.930 -5.920 1.862 1.00 0.00 C ATOM 341 C LEU A 506 15.205 -4.420 1.865 1.00 0.00 C ATOM 342 O LEU A 506 14.625 -3.672 1.078 1.00 0.00 O ATOM 343 CB LEU A 506 13.824 -6.237 2.872 1.00 0.00 C ATOM 344 CG LEU A 506 12.462 -5.882 2.268 1.00 0.00 C ATOM 345 CD1 LEU A 506 11.895 -7.098 1.534 1.00 0.00 C ATOM 346 CD2 LEU A 506 11.502 -5.469 3.386 1.00 0.00 C ATOM 0 H LEU A 506 16.110 -7.127 3.110 1.00 0.00 H new ATOM 0 HA LEU A 506 14.611 -6.216 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 506 13.851 -7.294 3.137 1.00 0.00 H new ATOM 0 HB3 LEU A 506 13.984 -5.673 3.791 1.00 0.00 H new ATOM 0 HG LEU A 506 12.581 -5.057 1.565 1.00 0.00 H new ATOM 0 HD11 LEU A 506 10.926 -6.844 1.105 1.00 0.00 H new ATOM 0 HD12 LEU A 506 12.578 -7.394 0.738 1.00 0.00 H new ATOM 0 HD13 LEU A 506 11.776 -7.924 2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 506 10.532 -5.216 2.958 1.00 0.00 H new ATOM 0 HD22 LEU A 506 11.384 -6.294 4.088 1.00 0.00 H new ATOM 0 HD23 LEU A 506 11.905 -4.602 3.910 1.00 0.00 H new ATOM 358 N GLY A 507 16.088 -3.985 2.756 1.00 0.00 N ATOM 359 CA GLY A 507 16.426 -2.568 2.854 1.00 0.00 C ATOM 360 C GLY A 507 17.083 -2.067 1.571 1.00 0.00 C ATOM 361 O GLY A 507 17.269 -0.864 1.391 1.00 0.00 O ATOM 0 H GLY A 507 16.580 -4.587 3.417 1.00 0.00 H new ATOM 0 HA2 GLY A 507 15.524 -1.989 3.054 1.00 0.00 H new ATOM 0 HA3 GLY A 507 17.099 -2.410 3.696 1.00 0.00 H new ATOM 365 N LEU A 508 17.437 -2.993 0.686 1.00 0.00 N ATOM 366 CA LEU A 508 18.076 -2.627 -0.575 1.00 0.00 C ATOM 367 C LEU A 508 17.233 -3.082 -1.763 1.00 0.00 C ATOM 368 O LEU A 508 17.099 -2.362 -2.754 1.00 0.00 O ATOM 369 CB LEU A 508 19.464 -3.271 -0.659 1.00 0.00 C ATOM 370 CG LEU A 508 20.514 -2.311 -0.093 1.00 0.00 C ATOM 371 CD1 LEU A 508 20.219 -2.042 1.384 1.00 0.00 C ATOM 372 CD2 LEU A 508 21.902 -2.940 -0.230 1.00 0.00 C ATOM 0 H LEU A 508 17.294 -3.995 0.816 1.00 0.00 H new ATOM 0 HA LEU A 508 18.170 -1.542 -0.609 1.00 0.00 H new ATOM 0 HB2 LEU A 508 19.475 -4.207 -0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 508 19.701 -3.514 -1.695 1.00 0.00 H new ATOM 0 HG LEU A 508 20.483 -1.371 -0.645 1.00 0.00 H new ATOM 0 HD11 LEU A 508 20.967 -1.359 1.786 1.00 0.00 H new ATOM 0 HD12 LEU A 508 19.230 -1.595 1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 508 20.250 -2.980 1.938 1.00 0.00 H new ATOM 0 HD21 LEU A 508 22.652 -2.259 0.172 1.00 0.00 H new ATOM 0 HD22 LEU A 508 21.932 -3.879 0.322 1.00 0.00 H new ATOM 0 HD23 LEU A 508 22.113 -3.131 -1.282 1.00 0.00 H new ATOM 384 N LEU A 509 16.673 -4.281 -1.660 1.00 0.00 N ATOM 385 CA LEU A 509 15.852 -4.828 -2.735 1.00 0.00 C ATOM 386 C LEU A 509 14.558 -4.033 -2.895 1.00 0.00 C ATOM 387 O LEU A 509 14.345 -3.377 -3.915 1.00 0.00 O ATOM 388 CB LEU A 509 15.522 -6.294 -2.444 1.00 0.00 C ATOM 389 CG LEU A 509 15.511 -7.090 -3.752 1.00 0.00 C ATOM 390 CD1 LEU A 509 15.493 -8.588 -3.440 1.00 0.00 C ATOM 391 CD2 LEU A 509 14.264 -6.724 -4.559 1.00 0.00 C ATOM 0 H LEU A 509 16.771 -4.891 -0.848 1.00 0.00 H new ATOM 0 HA LEU A 509 16.417 -4.758 -3.664 1.00 0.00 H new ATOM 0 HB2 LEU A 509 16.258 -6.713 -1.758 1.00 0.00 H new ATOM 0 HB3 LEU A 509 14.551 -6.368 -1.954 1.00 0.00 H new ATOM 0 HG LEU A 509 16.404 -6.851 -4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 509 15.485 -9.154 -4.372 1.00 0.00 H new ATOM 0 HD12 LEU A 509 16.380 -8.850 -2.864 1.00 0.00 H new ATOM 0 HD13 LEU A 509 14.601 -8.829 -2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 509 14.254 -7.290 -5.491 1.00 0.00 H new ATOM 0 HD22 LEU A 509 13.372 -6.964 -3.980 1.00 0.00 H new ATOM 0 HD23 LEU A 509 14.275 -5.657 -4.782 1.00 0.00 H new ATOM 403 N LEU A 510 13.695 -4.102 -1.887 1.00 0.00 N ATOM 404 CA LEU A 510 12.422 -3.390 -1.934 1.00 0.00 C ATOM 405 C LEU A 510 12.587 -2.019 -2.591 1.00 0.00 C ATOM 406 O LEU A 510 11.993 -1.750 -3.634 1.00 0.00 O ATOM 407 CB LEU A 510 11.852 -3.235 -0.518 1.00 0.00 C ATOM 408 CG LEU A 510 10.819 -2.105 -0.495 1.00 0.00 C ATOM 409 CD1 LEU A 510 9.736 -2.377 -1.543 1.00 0.00 C ATOM 410 CD2 LEU A 510 10.176 -2.034 0.893 1.00 0.00 C ATOM 0 H LEU A 510 13.851 -4.639 -1.034 1.00 0.00 H new ATOM 0 HA LEU A 510 11.725 -3.974 -2.536 1.00 0.00 H new ATOM 0 HB2 LEU A 510 11.390 -4.169 -0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 510 12.656 -3.019 0.186 1.00 0.00 H new ATOM 0 HG LEU A 510 11.311 -1.159 -0.720 1.00 0.00 H new ATOM 0 HD11 LEU A 510 9.002 -1.572 -1.525 1.00 0.00 H new ATOM 0 HD12 LEU A 510 10.192 -2.431 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 510 9.243 -3.323 -1.319 1.00 0.00 H new ATOM 0 HD21 LEU A 510 9.440 -1.230 0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 510 9.685 -2.981 1.115 1.00 0.00 H new ATOM 0 HD23 LEU A 510 10.945 -1.840 1.641 1.00 0.00 H new ATOM 422 N PRO A 511 13.376 -1.155 -2.006 1.00 0.00 N ATOM 423 CA PRO A 511 13.614 0.209 -2.550 1.00 0.00 C ATOM 424 C PRO A 511 13.883 0.184 -4.053 1.00 0.00 C ATOM 425 O PRO A 511 13.228 0.885 -4.822 1.00 0.00 O ATOM 426 CB PRO A 511 14.845 0.723 -1.786 1.00 0.00 C ATOM 427 CG PRO A 511 15.264 -0.366 -0.843 1.00 0.00 C ATOM 428 CD PRO A 511 14.124 -1.379 -0.768 1.00 0.00 C ATOM 0 HA PRO A 511 12.741 0.849 -2.420 1.00 0.00 H new ATOM 0 HB2 PRO A 511 15.653 0.967 -2.476 1.00 0.00 H new ATOM 0 HB3 PRO A 511 14.606 1.635 -1.239 1.00 0.00 H new ATOM 0 HG2 PRO A 511 16.178 -0.845 -1.194 1.00 0.00 H new ATOM 0 HG3 PRO A 511 15.477 0.044 0.144 1.00 0.00 H new ATOM 0 HD2 PRO A 511 14.500 -2.400 -0.707 1.00 0.00 H new ATOM 0 HD3 PRO A 511 13.501 -1.216 0.111 1.00 0.00 H new ATOM 436 N ILE A 512 14.852 -0.631 -4.461 1.00 0.00 N ATOM 437 CA ILE A 512 15.200 -0.740 -5.873 1.00 0.00 C ATOM 438 C ILE A 512 13.989 -1.179 -6.691 1.00 0.00 C ATOM 439 O ILE A 512 13.868 -0.838 -7.868 1.00 0.00 O ATOM 440 CB ILE A 512 16.334 -1.750 -6.054 1.00 0.00 C ATOM 441 CG1 ILE A 512 17.616 -1.191 -5.429 1.00 0.00 C ATOM 442 CG2 ILE A 512 16.563 -2.000 -7.546 1.00 0.00 C ATOM 443 CD1 ILE A 512 18.642 -2.316 -5.278 1.00 0.00 C ATOM 0 H ILE A 512 15.406 -1.221 -3.839 1.00 0.00 H new ATOM 0 HA ILE A 512 15.526 0.239 -6.225 1.00 0.00 H new ATOM 0 HB ILE A 512 16.067 -2.687 -5.566 1.00 0.00 H new ATOM 0 HG12 ILE A 512 18.022 -0.396 -6.055 1.00 0.00 H new ATOM 0 HG13 ILE A 512 17.397 -0.751 -4.456 1.00 0.00 H new ATOM 0 HG21 ILE A 512 17.371 -2.720 -7.674 1.00 0.00 H new ATOM 0 HG22 ILE A 512 15.651 -2.395 -7.993 1.00 0.00 H new ATOM 0 HG23 ILE A 512 16.830 -1.063 -8.035 1.00 0.00 H new ATOM 0 HD11 ILE A 512 19.555 -1.919 -4.833 1.00 0.00 H new ATOM 0 HD12 ILE A 512 18.235 -3.096 -4.635 1.00 0.00 H new ATOM 0 HD13 ILE A 512 18.869 -2.736 -6.258 1.00 0.00 H new ATOM 455 N ALA A 513 13.097 -1.935 -6.061 1.00 0.00 N ATOM 456 CA ALA A 513 11.899 -2.415 -6.742 1.00 0.00 C ATOM 457 C ALA A 513 11.048 -1.241 -7.216 1.00 0.00 C ATOM 458 O ALA A 513 10.174 -1.401 -8.069 1.00 0.00 O ATOM 459 CB ALA A 513 11.079 -3.296 -5.800 1.00 0.00 C ATOM 0 H ALA A 513 13.179 -2.227 -5.087 1.00 0.00 H new ATOM 0 HA ALA A 513 12.206 -3.001 -7.609 1.00 0.00 H new ATOM 0 HB1 ALA A 513 10.187 -3.650 -6.317 1.00 0.00 H new ATOM 0 HB2 ALA A 513 11.679 -4.150 -5.486 1.00 0.00 H new ATOM 0 HB3 ALA A 513 10.785 -2.717 -4.924 1.00 0.00 H new ATOM 465 N ALA A 514 11.308 -0.063 -6.659 1.00 0.00 N ATOM 466 CA ALA A 514 10.559 1.131 -7.033 1.00 0.00 C ATOM 467 C ALA A 514 11.344 2.390 -6.682 1.00 0.00 C ATOM 468 O ALA A 514 10.858 3.251 -5.949 1.00 0.00 O ATOM 469 CB ALA A 514 9.211 1.149 -6.310 1.00 0.00 C ATOM 0 H ALA A 514 12.027 0.090 -5.952 1.00 0.00 H new ATOM 0 HA ALA A 514 10.394 1.110 -8.110 1.00 0.00 H new ATOM 0 HB1 ALA A 514 8.657 2.044 -6.595 1.00 0.00 H new ATOM 0 HB2 ALA A 514 8.638 0.264 -6.587 1.00 0.00 H new ATOM 0 HB3 ALA A 514 9.376 1.152 -5.233 1.00 0.00 H new ATOM 475 N SER A 515 12.560 2.489 -7.209 1.00 0.00 N ATOM 476 CA SER A 515 13.404 3.648 -6.944 1.00 0.00 C ATOM 477 C SER A 515 12.998 4.820 -7.833 1.00 0.00 C ATOM 478 O SER A 515 12.007 5.500 -7.567 1.00 0.00 O ATOM 479 CB SER A 515 14.870 3.296 -7.198 1.00 0.00 C ATOM 480 OG SER A 515 15.664 4.467 -7.066 1.00 0.00 O ATOM 0 H SER A 515 12.980 1.787 -7.817 1.00 0.00 H new ATOM 0 HA SER A 515 13.276 3.936 -5.901 1.00 0.00 H new ATOM 0 HB2 SER A 515 15.201 2.536 -6.490 1.00 0.00 H new ATOM 0 HB3 SER A 515 14.987 2.874 -8.196 1.00 0.00 H new ATOM 0 HG SER A 515 16.605 4.244 -7.227 1.00 0.00 H new ATOM 486 N THR A 516 13.772 5.050 -8.889 1.00 0.00 N ATOM 487 CA THR A 516 13.483 6.142 -9.812 1.00 0.00 C ATOM 488 C THR A 516 12.421 5.723 -10.823 1.00 0.00 C ATOM 489 O THR A 516 11.229 5.949 -10.617 1.00 0.00 O ATOM 490 CB THR A 516 14.759 6.555 -10.549 1.00 0.00 C ATOM 491 OG1 THR A 516 15.270 5.440 -11.265 1.00 0.00 O ATOM 492 CG2 THR A 516 15.802 7.035 -9.538 1.00 0.00 C ATOM 0 H THR A 516 14.598 4.500 -9.126 1.00 0.00 H new ATOM 0 HA THR A 516 13.106 6.988 -9.237 1.00 0.00 H new ATOM 0 HB THR A 516 14.533 7.363 -11.245 1.00 0.00 H new ATOM 0 HG1 THR A 516 16.086 5.702 -11.739 1.00 0.00 H new ATOM 0 HG21 THR A 516 16.710 7.329 -10.064 1.00 0.00 H new ATOM 0 HG22 THR A 516 15.409 7.890 -8.988 1.00 0.00 H new ATOM 0 HG23 THR A 516 16.031 6.229 -8.841 1.00 0.00 H new ATOM 500 N ASP A 517 12.864 5.110 -11.916 1.00 0.00 N ATOM 501 CA ASP A 517 11.942 4.663 -12.955 1.00 0.00 C ATOM 502 C ASP A 517 12.573 3.555 -13.791 1.00 0.00 C ATOM 503 O ASP A 517 12.604 3.631 -15.019 1.00 0.00 O ATOM 504 CB ASP A 517 11.566 5.837 -13.860 1.00 0.00 C ATOM 505 CG ASP A 517 11.050 7.000 -13.020 1.00 0.00 C ATOM 506 OD1 ASP A 517 9.868 7.007 -12.716 1.00 0.00 O ATOM 507 OD2 ASP A 517 11.845 7.865 -12.691 1.00 0.00 O ATOM 0 H ASP A 517 13.847 4.913 -12.105 1.00 0.00 H new ATOM 0 HA ASP A 517 11.045 4.273 -12.475 1.00 0.00 H new ATOM 0 HB2 ASP A 517 12.434 6.153 -14.439 1.00 0.00 H new ATOM 0 HB3 ASP A 517 10.803 5.527 -14.574 1.00 0.00 H new ATOM 512 N LEU A 518 13.076 2.525 -13.117 1.00 0.00 N ATOM 513 CA LEU A 518 13.704 1.405 -13.809 1.00 0.00 C ATOM 514 C LEU A 518 12.660 0.596 -14.575 1.00 0.00 C ATOM 515 O LEU A 518 11.510 0.492 -14.149 1.00 0.00 O ATOM 516 CB LEU A 518 14.414 0.501 -12.799 1.00 0.00 C ATOM 517 CG LEU A 518 15.175 1.362 -11.788 1.00 0.00 C ATOM 518 CD1 LEU A 518 15.960 0.458 -10.836 1.00 0.00 C ATOM 519 CD2 LEU A 518 16.145 2.283 -12.532 1.00 0.00 C ATOM 0 H LEU A 518 13.061 2.443 -12.100 1.00 0.00 H new ATOM 0 HA LEU A 518 14.432 1.800 -14.517 1.00 0.00 H new ATOM 0 HB2 LEU A 518 13.687 -0.127 -12.283 1.00 0.00 H new ATOM 0 HB3 LEU A 518 15.103 -0.167 -13.315 1.00 0.00 H new ATOM 0 HG LEU A 518 14.467 1.963 -11.217 1.00 0.00 H new ATOM 0 HD11 LEU A 518 16.502 1.071 -10.116 1.00 0.00 H new ATOM 0 HD12 LEU A 518 15.270 -0.199 -10.306 1.00 0.00 H new ATOM 0 HD13 LEU A 518 16.668 -0.143 -11.406 1.00 0.00 H new ATOM 0 HD21 LEU A 518 16.688 2.897 -11.813 1.00 0.00 H new ATOM 0 HD22 LEU A 518 16.853 1.681 -13.103 1.00 0.00 H new ATOM 0 HD23 LEU A 518 15.587 2.928 -13.211 1.00 0.00 H new ATOM 531 N PRO A 519 13.039 0.031 -15.691 1.00 0.00 N ATOM 532 CA PRO A 519 12.122 -0.783 -16.533 1.00 0.00 C ATOM 533 C PRO A 519 11.290 -1.754 -15.698 1.00 0.00 C ATOM 534 O PRO A 519 11.818 -2.454 -14.834 1.00 0.00 O ATOM 535 CB PRO A 519 13.051 -1.545 -17.493 1.00 0.00 C ATOM 536 CG PRO A 519 14.456 -1.140 -17.157 1.00 0.00 C ATOM 537 CD PRO A 519 14.380 0.102 -16.272 1.00 0.00 C ATOM 0 HA PRO A 519 11.399 -0.158 -17.056 1.00 0.00 H new ATOM 0 HB2 PRO A 519 12.923 -2.622 -17.381 1.00 0.00 H new ATOM 0 HB3 PRO A 519 12.817 -1.303 -18.530 1.00 0.00 H new ATOM 0 HG2 PRO A 519 14.974 -1.948 -16.640 1.00 0.00 H new ATOM 0 HG3 PRO A 519 15.021 -0.929 -18.065 1.00 0.00 H new ATOM 0 HD2 PRO A 519 15.151 0.093 -15.502 1.00 0.00 H new ATOM 0 HD3 PRO A 519 14.518 1.015 -16.851 1.00 0.00 H new ATOM 545 N ILE A 520 9.988 -1.790 -15.963 1.00 0.00 N ATOM 546 CA ILE A 520 9.095 -2.679 -15.229 1.00 0.00 C ATOM 547 C ILE A 520 9.448 -4.138 -15.502 1.00 0.00 C ATOM 548 O ILE A 520 8.779 -5.050 -15.014 1.00 0.00 O ATOM 549 CB ILE A 520 7.645 -2.418 -15.641 1.00 0.00 C ATOM 550 CG1 ILE A 520 7.524 -2.505 -17.164 1.00 0.00 C ATOM 551 CG2 ILE A 520 7.226 -1.022 -15.177 1.00 0.00 C ATOM 552 CD1 ILE A 520 6.059 -2.343 -17.571 1.00 0.00 C ATOM 0 H ILE A 520 9.531 -1.219 -16.674 1.00 0.00 H new ATOM 0 HA ILE A 520 9.212 -2.482 -14.163 1.00 0.00 H new ATOM 0 HB ILE A 520 6.997 -3.164 -15.181 1.00 0.00 H new ATOM 0 HG12 ILE A 520 8.130 -1.729 -17.632 1.00 0.00 H new ATOM 0 HG13 ILE A 520 7.906 -3.464 -17.515 1.00 0.00 H new ATOM 0 HG21 ILE A 520 6.193 -0.836 -15.470 1.00 0.00 H new ATOM 0 HG22 ILE A 520 7.312 -0.958 -14.092 1.00 0.00 H new ATOM 0 HG23 ILE A 520 7.874 -0.276 -15.637 1.00 0.00 H new ATOM 0 HD11 ILE A 520 5.974 -2.405 -18.656 1.00 0.00 H new ATOM 0 HD12 ILE A 520 5.465 -3.135 -17.114 1.00 0.00 H new ATOM 0 HD13 ILE A 520 5.693 -1.374 -17.233 1.00 0.00 H new ATOM 564 N GLU A 521 10.503 -4.350 -16.282 1.00 0.00 N ATOM 565 CA GLU A 521 10.935 -5.702 -16.613 1.00 0.00 C ATOM 566 C GLU A 521 11.697 -6.322 -15.445 1.00 0.00 C ATOM 567 O GLU A 521 11.176 -7.187 -14.742 1.00 0.00 O ATOM 568 CB GLU A 521 11.833 -5.676 -17.851 1.00 0.00 C ATOM 569 CG GLU A 521 10.999 -5.301 -19.079 1.00 0.00 C ATOM 570 CD GLU A 521 11.908 -5.116 -20.290 1.00 0.00 C ATOM 571 OE1 GLU A 521 12.690 -6.011 -20.561 1.00 0.00 O ATOM 572 OE2 GLU A 521 11.808 -4.080 -20.927 1.00 0.00 O ATOM 0 H GLU A 521 11.070 -3.609 -16.694 1.00 0.00 H new ATOM 0 HA GLU A 521 10.050 -6.305 -16.818 1.00 0.00 H new ATOM 0 HB2 GLU A 521 12.640 -4.957 -17.713 1.00 0.00 H new ATOM 0 HB3 GLU A 521 12.297 -6.651 -17.997 1.00 0.00 H new ATOM 0 HG2 GLU A 521 10.264 -6.080 -19.281 1.00 0.00 H new ATOM 0 HG3 GLU A 521 10.445 -4.382 -18.886 1.00 0.00 H new ATOM 579 N THR A 522 12.931 -5.872 -15.244 1.00 0.00 N ATOM 580 CA THR A 522 13.755 -6.389 -14.158 1.00 0.00 C ATOM 581 C THR A 522 13.071 -6.165 -12.813 1.00 0.00 C ATOM 582 O THR A 522 13.241 -6.950 -11.880 1.00 0.00 O ATOM 583 CB THR A 522 15.119 -5.696 -14.161 1.00 0.00 C ATOM 584 OG1 THR A 522 15.797 -5.997 -15.373 1.00 0.00 O ATOM 585 CG2 THR A 522 15.947 -6.189 -12.974 1.00 0.00 C ATOM 0 H THR A 522 13.380 -5.155 -15.814 1.00 0.00 H new ATOM 0 HA THR A 522 13.892 -7.460 -14.309 1.00 0.00 H new ATOM 0 HB THR A 522 14.980 -4.618 -14.080 1.00 0.00 H new ATOM 0 HG1 THR A 522 16.671 -5.553 -15.378 1.00 0.00 H new ATOM 0 HG21 THR A 522 16.918 -5.694 -12.978 1.00 0.00 H new ATOM 0 HG22 THR A 522 15.425 -5.958 -12.045 1.00 0.00 H new ATOM 0 HG23 THR A 522 16.088 -7.267 -13.052 1.00 0.00 H new ATOM 593 N ALA A 523 12.298 -5.088 -12.720 1.00 0.00 N ATOM 594 CA ALA A 523 11.593 -4.769 -11.484 1.00 0.00 C ATOM 595 C ALA A 523 10.595 -5.870 -11.137 1.00 0.00 C ATOM 596 O ALA A 523 10.565 -6.359 -10.007 1.00 0.00 O ATOM 597 CB ALA A 523 10.855 -3.437 -11.631 1.00 0.00 C ATOM 0 H ALA A 523 12.144 -4.425 -13.480 1.00 0.00 H new ATOM 0 HA ALA A 523 12.325 -4.691 -10.681 1.00 0.00 H new ATOM 0 HB1 ALA A 523 10.331 -3.207 -10.703 1.00 0.00 H new ATOM 0 HB2 ALA A 523 11.572 -2.646 -11.849 1.00 0.00 H new ATOM 0 HB3 ALA A 523 10.135 -3.508 -12.446 1.00 0.00 H new ATOM 603 N ALA A 524 9.782 -6.255 -12.114 1.00 0.00 N ATOM 604 CA ALA A 524 8.788 -7.299 -11.900 1.00 0.00 C ATOM 605 C ALA A 524 9.461 -8.608 -11.498 1.00 0.00 C ATOM 606 O ALA A 524 9.110 -9.212 -10.484 1.00 0.00 O ATOM 607 CB ALA A 524 7.972 -7.514 -13.175 1.00 0.00 C ATOM 0 H ALA A 524 9.791 -5.863 -13.056 1.00 0.00 H new ATOM 0 HA ALA A 524 8.126 -6.982 -11.094 1.00 0.00 H new ATOM 0 HB1 ALA A 524 7.232 -8.296 -13.006 1.00 0.00 H new ATOM 0 HB2 ALA A 524 7.466 -6.587 -13.444 1.00 0.00 H new ATOM 0 HB3 ALA A 524 8.636 -7.813 -13.986 1.00 0.00 H new ATOM 613 N MET A 525 10.430 -9.038 -12.298 1.00 0.00 N ATOM 614 CA MET A 525 11.146 -10.278 -12.016 1.00 0.00 C ATOM 615 C MET A 525 11.675 -10.275 -10.584 1.00 0.00 C ATOM 616 O MET A 525 11.631 -11.295 -9.895 1.00 0.00 O ATOM 617 CB MET A 525 12.313 -10.440 -12.992 1.00 0.00 C ATOM 618 CG MET A 525 11.771 -10.785 -14.381 1.00 0.00 C ATOM 619 SD MET A 525 13.086 -10.575 -15.609 1.00 0.00 S ATOM 620 CE MET A 525 12.499 -11.821 -16.782 1.00 0.00 C ATOM 0 H MET A 525 10.737 -8.552 -13.140 1.00 0.00 H new ATOM 0 HA MET A 525 10.454 -11.112 -12.135 1.00 0.00 H new ATOM 0 HB2 MET A 525 12.895 -9.520 -13.035 1.00 0.00 H new ATOM 0 HB3 MET A 525 12.984 -11.226 -12.646 1.00 0.00 H new ATOM 0 HG2 MET A 525 11.405 -11.812 -14.396 1.00 0.00 H new ATOM 0 HG3 MET A 525 10.925 -10.141 -14.624 1.00 0.00 H new ATOM 0 HE1 MET A 525 13.174 -11.863 -17.637 1.00 0.00 H new ATOM 0 HE2 MET A 525 12.470 -12.795 -16.294 1.00 0.00 H new ATOM 0 HE3 MET A 525 11.498 -11.557 -17.123 1.00 0.00 H new ATOM 630 N ALA A 526 12.172 -9.124 -10.144 1.00 0.00 N ATOM 631 CA ALA A 526 12.706 -9.002 -8.793 1.00 0.00 C ATOM 632 C ALA A 526 11.584 -9.094 -7.764 1.00 0.00 C ATOM 633 O ALA A 526 11.818 -9.437 -6.605 1.00 0.00 O ATOM 634 CB ALA A 526 13.435 -7.666 -8.638 1.00 0.00 C ATOM 0 H ALA A 526 12.216 -8.269 -10.698 1.00 0.00 H new ATOM 0 HA ALA A 526 13.407 -9.819 -8.624 1.00 0.00 H new ATOM 0 HB1 ALA A 526 13.831 -7.583 -7.626 1.00 0.00 H new ATOM 0 HB2 ALA A 526 14.255 -7.614 -9.354 1.00 0.00 H new ATOM 0 HB3 ALA A 526 12.739 -6.848 -8.824 1.00 0.00 H new ATOM 640 N SER A 527 10.365 -8.786 -8.195 1.00 0.00 N ATOM 641 CA SER A 527 9.214 -8.839 -7.303 1.00 0.00 C ATOM 642 C SER A 527 8.875 -10.283 -6.948 1.00 0.00 C ATOM 643 O SER A 527 8.461 -10.577 -5.827 1.00 0.00 O ATOM 644 CB SER A 527 8.006 -8.180 -7.969 1.00 0.00 C ATOM 645 OG SER A 527 8.415 -6.967 -8.589 1.00 0.00 O ATOM 0 H SER A 527 10.150 -8.499 -9.150 1.00 0.00 H new ATOM 0 HA SER A 527 9.464 -8.301 -6.388 1.00 0.00 H new ATOM 0 HB2 SER A 527 7.573 -8.852 -8.710 1.00 0.00 H new ATOM 0 HB3 SER A 527 7.232 -7.980 -7.228 1.00 0.00 H new ATOM 0 HG SER A 527 9.104 -7.158 -9.259 1.00 0.00 H new ATOM 651 N LEU A 528 9.056 -11.182 -7.910 1.00 0.00 N ATOM 652 CA LEU A 528 8.767 -12.594 -7.689 1.00 0.00 C ATOM 653 C LEU A 528 9.846 -13.231 -6.819 1.00 0.00 C ATOM 654 O LEU A 528 9.562 -14.106 -6.001 1.00 0.00 O ATOM 655 CB LEU A 528 8.689 -13.328 -9.028 1.00 0.00 C ATOM 656 CG LEU A 528 7.924 -12.469 -10.038 1.00 0.00 C ATOM 657 CD1 LEU A 528 7.757 -13.245 -11.345 1.00 0.00 C ATOM 658 CD2 LEU A 528 6.545 -12.124 -9.470 1.00 0.00 C ATOM 0 H LEU A 528 9.399 -10.960 -8.844 1.00 0.00 H new ATOM 0 HA LEU A 528 7.808 -12.673 -7.176 1.00 0.00 H new ATOM 0 HB2 LEU A 528 9.692 -13.537 -9.399 1.00 0.00 H new ATOM 0 HB3 LEU A 528 8.190 -14.288 -8.900 1.00 0.00 H new ATOM 0 HG LEU A 528 8.480 -11.551 -10.230 1.00 0.00 H new ATOM 0 HD11 LEU A 528 7.212 -12.633 -12.064 1.00 0.00 H new ATOM 0 HD12 LEU A 528 8.739 -13.493 -11.749 1.00 0.00 H new ATOM 0 HD13 LEU A 528 7.201 -14.163 -11.155 1.00 0.00 H new ATOM 0 HD21 LEU A 528 5.999 -11.512 -10.188 1.00 0.00 H new ATOM 0 HD22 LEU A 528 5.990 -13.042 -9.279 1.00 0.00 H new ATOM 0 HD23 LEU A 528 6.663 -11.571 -8.538 1.00 0.00 H new ATOM 670 N ALA A 529 11.085 -12.787 -7.002 1.00 0.00 N ATOM 671 CA ALA A 529 12.201 -13.322 -6.228 1.00 0.00 C ATOM 672 C ALA A 529 12.020 -13.015 -4.745 1.00 0.00 C ATOM 673 O ALA A 529 12.324 -13.845 -3.887 1.00 0.00 O ATOM 674 CB ALA A 529 13.516 -12.717 -6.720 1.00 0.00 C ATOM 0 H ALA A 529 11.341 -12.064 -7.674 1.00 0.00 H new ATOM 0 HA ALA A 529 12.227 -14.403 -6.363 1.00 0.00 H new ATOM 0 HB1 ALA A 529 14.343 -13.122 -6.137 1.00 0.00 H new ATOM 0 HB2 ALA A 529 13.659 -12.963 -7.772 1.00 0.00 H new ATOM 0 HB3 ALA A 529 13.485 -11.634 -6.602 1.00 0.00 H new ATOM 680 N LEU A 530 11.524 -11.818 -4.450 1.00 0.00 N ATOM 681 CA LEU A 530 11.308 -11.411 -3.066 1.00 0.00 C ATOM 682 C LEU A 530 10.179 -12.224 -2.440 1.00 0.00 C ATOM 683 O LEU A 530 10.382 -12.924 -1.447 1.00 0.00 O ATOM 684 CB LEU A 530 10.961 -9.921 -3.009 1.00 0.00 C ATOM 685 CG LEU A 530 11.620 -9.287 -1.781 1.00 0.00 C ATOM 686 CD1 LEU A 530 11.354 -7.780 -1.777 1.00 0.00 C ATOM 687 CD2 LEU A 530 11.034 -9.910 -0.511 1.00 0.00 C ATOM 0 H LEU A 530 11.266 -11.117 -5.145 1.00 0.00 H new ATOM 0 HA LEU A 530 12.225 -11.592 -2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 530 11.303 -9.423 -3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 530 9.880 -9.791 -2.962 1.00 0.00 H new ATOM 0 HG LEU A 530 12.695 -9.465 -1.814 1.00 0.00 H new ATOM 0 HD11 LEU A 530 11.824 -7.330 -0.902 1.00 0.00 H new ATOM 0 HD12 LEU A 530 11.769 -7.335 -2.681 1.00 0.00 H new ATOM 0 HD13 LEU A 530 10.279 -7.600 -1.745 1.00 0.00 H new ATOM 0 HD21 LEU A 530 11.502 -9.460 0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 530 9.959 -9.731 -0.480 1.00 0.00 H new ATOM 0 HD23 LEU A 530 11.223 -10.983 -0.512 1.00 0.00 H new ATOM 699 N ALA A 531 8.990 -12.127 -3.026 1.00 0.00 N ATOM 700 CA ALA A 531 7.836 -12.858 -2.515 1.00 0.00 C ATOM 701 C ALA A 531 8.189 -14.325 -2.289 1.00 0.00 C ATOM 702 O ALA A 531 7.805 -14.918 -1.281 1.00 0.00 O ATOM 703 CB ALA A 531 6.674 -12.758 -3.506 1.00 0.00 C ATOM 0 H ALA A 531 8.801 -11.554 -3.849 1.00 0.00 H new ATOM 0 HA ALA A 531 7.541 -12.416 -1.563 1.00 0.00 H new ATOM 0 HB1 ALA A 531 5.816 -13.306 -3.117 1.00 0.00 H new ATOM 0 HB2 ALA A 531 6.403 -11.711 -3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 531 6.974 -13.185 -4.463 1.00 0.00 H new ATOM 709 N HIS A 532 8.922 -14.904 -3.235 1.00 0.00 N ATOM 710 CA HIS A 532 9.322 -16.303 -3.128 1.00 0.00 C ATOM 711 C HIS A 532 10.090 -16.545 -1.832 1.00 0.00 C ATOM 712 O HIS A 532 9.929 -17.582 -1.189 1.00 0.00 O ATOM 713 CB HIS A 532 10.198 -16.687 -4.322 1.00 0.00 C ATOM 714 CG HIS A 532 10.438 -18.172 -4.312 1.00 0.00 C ATOM 715 ND1 HIS A 532 11.533 -18.738 -3.677 1.00 0.00 N ATOM 716 CD2 HIS A 532 9.736 -19.219 -4.853 1.00 0.00 C ATOM 717 CE1 HIS A 532 11.458 -20.071 -3.852 1.00 0.00 C ATOM 718 NE2 HIS A 532 10.380 -20.417 -4.561 1.00 0.00 N ATOM 0 H HIS A 532 9.249 -14.431 -4.078 1.00 0.00 H new ATOM 0 HA HIS A 532 8.423 -16.919 -3.123 1.00 0.00 H new ATOM 0 HB2 HIS A 532 9.712 -16.393 -5.252 1.00 0.00 H new ATOM 0 HB3 HIS A 532 11.148 -16.154 -4.276 1.00 0.00 H new ATOM 0 HD2 HIS A 532 8.821 -19.127 -5.420 1.00 0.00 H new ATOM 0 HE1 HIS A 532 12.181 -20.774 -3.466 1.00 0.00 H new ATOM 0 HE2 HIS A 532 10.091 -21.357 -4.830 1.00 0.00 H new ATOM 726 N VAL A 533 10.923 -15.581 -1.455 1.00 0.00 N ATOM 727 CA VAL A 533 11.710 -15.700 -0.235 1.00 0.00 C ATOM 728 C VAL A 533 10.842 -15.439 0.992 1.00 0.00 C ATOM 729 O VAL A 533 10.700 -16.301 1.858 1.00 0.00 O ATOM 730 CB VAL A 533 12.871 -14.703 -0.262 1.00 0.00 C ATOM 731 CG1 VAL A 533 13.623 -14.757 1.069 1.00 0.00 C ATOM 732 CG2 VAL A 533 13.825 -15.065 -1.402 1.00 0.00 C ATOM 0 H VAL A 533 11.070 -14.715 -1.973 1.00 0.00 H new ATOM 0 HA VAL A 533 12.104 -16.715 -0.178 1.00 0.00 H new ATOM 0 HB VAL A 533 12.482 -13.697 -0.417 1.00 0.00 H new ATOM 0 HG11 VAL A 533 14.450 -14.047 1.049 1.00 0.00 H new ATOM 0 HG12 VAL A 533 12.943 -14.500 1.882 1.00 0.00 H new ATOM 0 HG13 VAL A 533 14.013 -15.763 1.226 1.00 0.00 H new ATOM 0 HG21 VAL A 533 14.653 -14.356 -1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 533 14.213 -16.071 -1.246 1.00 0.00 H new ATOM 0 HG23 VAL A 533 13.290 -15.026 -2.351 1.00 0.00 H new ATOM 742 N PHE A 534 10.263 -14.245 1.057 1.00 0.00 N ATOM 743 CA PHE A 534 9.409 -13.881 2.183 1.00 0.00 C ATOM 744 C PHE A 534 8.088 -14.641 2.119 1.00 0.00 C ATOM 745 O PHE A 534 7.131 -14.302 2.816 1.00 0.00 O ATOM 746 CB PHE A 534 9.136 -12.375 2.167 1.00 0.00 C ATOM 747 CG PHE A 534 10.303 -11.642 2.784 1.00 0.00 C ATOM 748 CD1 PHE A 534 11.579 -11.759 2.220 1.00 0.00 C ATOM 749 CD2 PHE A 534 10.109 -10.847 3.920 1.00 0.00 C ATOM 750 CE1 PHE A 534 12.662 -11.080 2.793 1.00 0.00 C ATOM 751 CE2 PHE A 534 11.192 -10.169 4.492 1.00 0.00 C ATOM 752 CZ PHE A 534 12.468 -10.285 3.928 1.00 0.00 C ATOM 0 H PHE A 534 10.368 -13.518 0.350 1.00 0.00 H new ATOM 0 HA PHE A 534 9.924 -14.146 3.107 1.00 0.00 H new ATOM 0 HB2 PHE A 534 8.980 -12.034 1.143 1.00 0.00 H new ATOM 0 HB3 PHE A 534 8.222 -12.155 2.719 1.00 0.00 H new ATOM 0 HD1 PHE A 534 11.728 -12.372 1.344 1.00 0.00 H new ATOM 0 HD2 PHE A 534 9.124 -10.757 4.355 1.00 0.00 H new ATOM 0 HE1 PHE A 534 13.647 -11.170 2.359 1.00 0.00 H new ATOM 0 HE2 PHE A 534 11.043 -9.556 5.369 1.00 0.00 H new ATOM 0 HZ PHE A 534 13.303 -9.761 4.369 1.00 0.00 H new ATOM 762 N VAL A 535 8.044 -15.672 1.281 1.00 0.00 N ATOM 763 CA VAL A 535 6.834 -16.475 1.136 1.00 0.00 C ATOM 764 C VAL A 535 6.240 -16.799 2.502 1.00 0.00 C ATOM 765 O VAL A 535 5.025 -16.736 2.692 1.00 0.00 O ATOM 766 CB VAL A 535 7.155 -17.773 0.395 1.00 0.00 C ATOM 767 CG1 VAL A 535 8.084 -18.635 1.253 1.00 0.00 C ATOM 768 CG2 VAL A 535 5.858 -18.538 0.124 1.00 0.00 C ATOM 0 H VAL A 535 8.825 -15.970 0.696 1.00 0.00 H new ATOM 0 HA VAL A 535 6.105 -15.901 0.563 1.00 0.00 H new ATOM 0 HB VAL A 535 7.646 -17.540 -0.550 1.00 0.00 H new ATOM 0 HG11 VAL A 535 8.313 -19.560 0.725 1.00 0.00 H new ATOM 0 HG12 VAL A 535 9.008 -18.091 1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 535 7.594 -18.869 2.198 1.00 0.00 H new ATOM 0 HG21 VAL A 535 6.085 -19.464 -0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 535 5.368 -18.771 1.070 1.00 0.00 H new ATOM 0 HG23 VAL A 535 5.195 -17.925 -0.487 1.00 0.00 H new ATOM 778 N GLY A 536 7.104 -17.147 3.451 1.00 0.00 N ATOM 779 CA GLY A 536 6.653 -17.479 4.797 1.00 0.00 C ATOM 780 C GLY A 536 6.376 -16.216 5.606 1.00 0.00 C ATOM 781 O GLY A 536 5.301 -16.061 6.186 1.00 0.00 O ATOM 0 H GLY A 536 8.113 -17.206 3.314 1.00 0.00 H new ATOM 0 HA2 GLY A 536 5.749 -18.086 4.743 1.00 0.00 H new ATOM 0 HA3 GLY A 536 7.411 -18.079 5.301 1.00 0.00 H new ATOM 785 N THR A 537 7.354 -15.317 5.640 1.00 0.00 N ATOM 786 CA THR A 537 7.205 -14.069 6.381 1.00 0.00 C ATOM 787 C THR A 537 6.091 -13.217 5.779 1.00 0.00 C ATOM 788 O THR A 537 5.327 -13.685 4.936 1.00 0.00 O ATOM 789 CB THR A 537 8.520 -13.286 6.357 1.00 0.00 C ATOM 790 OG1 THR A 537 8.871 -12.998 5.010 1.00 0.00 O ATOM 791 CG2 THR A 537 9.624 -14.118 7.008 1.00 0.00 C ATOM 0 H THR A 537 8.251 -15.427 5.168 1.00 0.00 H new ATOM 0 HA THR A 537 6.945 -14.310 7.412 1.00 0.00 H new ATOM 0 HB THR A 537 8.400 -12.354 6.909 1.00 0.00 H new ATOM 0 HG1 THR A 537 9.695 -12.467 4.993 1.00 0.00 H new ATOM 0 HG21 THR A 537 10.560 -13.559 6.990 1.00 0.00 H new ATOM 0 HG22 THR A 537 9.353 -14.338 8.040 1.00 0.00 H new ATOM 0 HG23 THR A 537 9.748 -15.051 6.459 1.00 0.00 H new ATOM 799 N CYS A 538 6.007 -11.966 6.218 1.00 0.00 N ATOM 800 CA CYS A 538 4.983 -11.058 5.716 1.00 0.00 C ATOM 801 C CYS A 538 5.249 -9.633 6.189 1.00 0.00 C ATOM 802 O CYS A 538 5.834 -9.422 7.251 1.00 0.00 O ATOM 803 CB CYS A 538 3.603 -11.509 6.198 1.00 0.00 C ATOM 804 SG CYS A 538 2.322 -10.628 5.271 1.00 0.00 S ATOM 0 H CYS A 538 6.631 -11.560 6.915 1.00 0.00 H new ATOM 0 HA CYS A 538 5.011 -11.077 4.627 1.00 0.00 H new ATOM 0 HB2 CYS A 538 3.492 -12.585 6.060 1.00 0.00 H new ATOM 0 HB3 CYS A 538 3.496 -11.311 7.265 1.00 0.00 H new ATOM 0 HG CYS A 538 1.149 -11.013 5.679 1.00 0.00 H new ATOM 810 N ASN A 539 4.816 -8.660 5.395 1.00 0.00 N ATOM 811 CA ASN A 539 5.014 -7.258 5.744 1.00 0.00 C ATOM 812 C ASN A 539 4.105 -6.365 4.906 1.00 0.00 C ATOM 813 O ASN A 539 3.786 -6.687 3.761 1.00 0.00 O ATOM 814 CB ASN A 539 6.474 -6.863 5.514 1.00 0.00 C ATOM 815 CG ASN A 539 6.715 -5.443 6.015 1.00 0.00 C ATOM 816 OD1 ASN A 539 7.357 -4.645 5.333 1.00 0.00 O ATOM 817 ND2 ASN A 539 6.236 -5.080 7.173 1.00 0.00 N ATOM 0 H ASN A 539 4.329 -8.814 4.512 1.00 0.00 H new ATOM 0 HA ASN A 539 4.765 -7.126 6.797 1.00 0.00 H new ATOM 0 HB2 ASN A 539 7.134 -7.558 6.034 1.00 0.00 H new ATOM 0 HB3 ASN A 539 6.714 -6.929 4.453 1.00 0.00 H new ATOM 0 HD21 ASN A 539 6.393 -4.132 7.516 1.00 0.00 H new ATOM 0 HD22 ASN A 539 5.704 -5.744 7.736 1.00 0.00 H new ATOM 824 N GLY A 540 3.691 -5.241 5.483 1.00 0.00 N ATOM 825 CA GLY A 540 2.817 -4.310 4.780 1.00 0.00 C ATOM 826 C GLY A 540 3.621 -3.402 3.854 1.00 0.00 C ATOM 827 O GLY A 540 3.233 -3.169 2.709 1.00 0.00 O ATOM 0 H GLY A 540 3.945 -4.955 6.429 1.00 0.00 H new ATOM 0 HA2 GLY A 540 2.079 -4.865 4.201 1.00 0.00 H new ATOM 0 HA3 GLY A 540 2.267 -3.705 5.502 1.00 0.00 H new ATOM 831 N ASP A 541 4.740 -2.893 4.357 1.00 0.00 N ATOM 832 CA ASP A 541 5.590 -2.011 3.566 1.00 0.00 C ATOM 833 C ASP A 541 5.735 -2.542 2.143 1.00 0.00 C ATOM 834 O ASP A 541 5.626 -1.788 1.175 1.00 0.00 O ATOM 835 CB ASP A 541 6.972 -1.899 4.214 1.00 0.00 C ATOM 836 CG ASP A 541 6.864 -1.162 5.544 1.00 0.00 C ATOM 837 OD1 ASP A 541 5.881 -0.467 5.736 1.00 0.00 O ATOM 838 OD2 ASP A 541 7.768 -1.304 6.352 1.00 0.00 O ATOM 0 H ASP A 541 5.078 -3.074 5.302 1.00 0.00 H new ATOM 0 HA ASP A 541 5.125 -1.026 3.529 1.00 0.00 H new ATOM 0 HB2 ASP A 541 7.391 -2.893 4.372 1.00 0.00 H new ATOM 0 HB3 ASP A 541 7.653 -1.368 3.549 1.00 0.00 H new ATOM 843 N ILE A 542 5.983 -3.842 2.023 1.00 0.00 N ATOM 844 CA ILE A 542 6.142 -4.463 0.714 1.00 0.00 C ATOM 845 C ILE A 542 4.936 -4.163 -0.172 1.00 0.00 C ATOM 846 O ILE A 542 5.071 -3.996 -1.384 1.00 0.00 O ATOM 847 CB ILE A 542 6.298 -5.976 0.870 1.00 0.00 C ATOM 848 CG1 ILE A 542 7.541 -6.276 1.711 1.00 0.00 C ATOM 849 CG2 ILE A 542 6.450 -6.619 -0.511 1.00 0.00 C ATOM 850 CD1 ILE A 542 7.579 -7.765 2.057 1.00 0.00 C ATOM 0 H ILE A 542 6.078 -4.482 2.811 1.00 0.00 H new ATOM 0 HA ILE A 542 7.035 -4.052 0.244 1.00 0.00 H new ATOM 0 HB ILE A 542 5.416 -6.383 1.365 1.00 0.00 H new ATOM 0 HG12 ILE A 542 8.440 -5.997 1.162 1.00 0.00 H new ATOM 0 HG13 ILE A 542 7.527 -5.680 2.624 1.00 0.00 H new ATOM 0 HG21 ILE A 542 6.561 -7.698 -0.400 1.00 0.00 H new ATOM 0 HG22 ILE A 542 5.566 -6.405 -1.111 1.00 0.00 H new ATOM 0 HG23 ILE A 542 7.332 -6.212 -1.007 1.00 0.00 H new ATOM 0 HD11 ILE A 542 8.465 -7.977 2.656 1.00 0.00 H new ATOM 0 HD12 ILE A 542 6.686 -8.030 2.623 1.00 0.00 H new ATOM 0 HD13 ILE A 542 7.613 -8.351 1.139 1.00 0.00 H new ATOM 862 N THR A 543 3.760 -4.095 0.442 1.00 0.00 N ATOM 863 CA THR A 543 2.536 -3.815 -0.301 1.00 0.00 C ATOM 864 C THR A 543 2.431 -2.326 -0.620 1.00 0.00 C ATOM 865 O THR A 543 1.694 -1.925 -1.520 1.00 0.00 O ATOM 866 CB THR A 543 1.318 -4.251 0.515 1.00 0.00 C ATOM 867 OG1 THR A 543 1.507 -5.584 0.968 1.00 0.00 O ATOM 868 CG2 THR A 543 0.064 -4.180 -0.359 1.00 0.00 C ATOM 0 H THR A 543 3.628 -4.229 1.445 1.00 0.00 H new ATOM 0 HA THR A 543 2.565 -4.374 -1.236 1.00 0.00 H new ATOM 0 HB THR A 543 1.198 -3.589 1.372 1.00 0.00 H new ATOM 0 HG1 THR A 543 0.807 -5.812 1.614 1.00 0.00 H new ATOM 0 HG21 THR A 543 -0.803 -4.491 0.223 1.00 0.00 H new ATOM 0 HG22 THR A 543 -0.080 -3.157 -0.706 1.00 0.00 H new ATOM 0 HG23 THR A 543 0.181 -4.842 -1.217 1.00 0.00 H new ATOM 876 N THR A 544 3.175 -1.513 0.124 1.00 0.00 N ATOM 877 CA THR A 544 3.156 -0.070 -0.089 1.00 0.00 C ATOM 878 C THR A 544 3.786 0.282 -1.432 1.00 0.00 C ATOM 879 O THR A 544 3.177 0.966 -2.254 1.00 0.00 O ATOM 880 CB THR A 544 3.919 0.633 1.035 1.00 0.00 C ATOM 881 OG1 THR A 544 3.511 0.102 2.287 1.00 0.00 O ATOM 882 CG2 THR A 544 3.622 2.134 0.994 1.00 0.00 C ATOM 0 H THR A 544 3.793 -1.825 0.873 1.00 0.00 H new ATOM 0 HA THR A 544 2.119 0.265 -0.089 1.00 0.00 H new ATOM 0 HB THR A 544 4.989 0.472 0.904 1.00 0.00 H new ATOM 0 HG1 THR A 544 3.876 0.653 3.011 1.00 0.00 H new ATOM 0 HG21 THR A 544 4.166 2.635 1.795 1.00 0.00 H new ATOM 0 HG22 THR A 544 3.936 2.541 0.033 1.00 0.00 H new ATOM 0 HG23 THR A 544 2.552 2.297 1.125 1.00 0.00 H new ATOM 890 N SER A 545 5.010 -0.192 -1.648 1.00 0.00 N ATOM 891 CA SER A 545 5.711 0.079 -2.898 1.00 0.00 C ATOM 892 C SER A 545 5.013 -0.614 -4.062 1.00 0.00 C ATOM 893 O SER A 545 4.836 -0.030 -5.132 1.00 0.00 O ATOM 894 CB SER A 545 7.155 -0.411 -2.802 1.00 0.00 C ATOM 895 OG SER A 545 7.733 0.065 -1.594 1.00 0.00 O ATOM 0 H SER A 545 5.532 -0.760 -0.981 1.00 0.00 H new ATOM 0 HA SER A 545 5.704 1.155 -3.073 1.00 0.00 H new ATOM 0 HB2 SER A 545 7.184 -1.500 -2.828 1.00 0.00 H new ATOM 0 HB3 SER A 545 7.729 -0.056 -3.658 1.00 0.00 H new ATOM 0 HG SER A 545 8.625 0.427 -1.779 1.00 0.00 H new ATOM 901 N ILE A 546 4.614 -1.863 -3.845 1.00 0.00 N ATOM 902 CA ILE A 546 3.933 -2.629 -4.881 1.00 0.00 C ATOM 903 C ILE A 546 2.652 -1.920 -5.311 1.00 0.00 C ATOM 904 O ILE A 546 2.259 -1.981 -6.478 1.00 0.00 O ATOM 905 CB ILE A 546 3.603 -4.031 -4.358 1.00 0.00 C ATOM 906 CG1 ILE A 546 4.687 -5.012 -4.811 1.00 0.00 C ATOM 907 CG2 ILE A 546 2.248 -4.485 -4.905 1.00 0.00 C ATOM 908 CD1 ILE A 546 4.498 -6.351 -4.096 1.00 0.00 C ATOM 0 H ILE A 546 4.750 -2.363 -2.967 1.00 0.00 H new ATOM 0 HA ILE A 546 4.592 -2.713 -5.745 1.00 0.00 H new ATOM 0 HB ILE A 546 3.561 -4.006 -3.269 1.00 0.00 H new ATOM 0 HG12 ILE A 546 4.635 -5.154 -5.890 1.00 0.00 H new ATOM 0 HG13 ILE A 546 5.674 -4.606 -4.590 1.00 0.00 H new ATOM 0 HG21 ILE A 546 2.020 -5.482 -4.529 1.00 0.00 H new ATOM 0 HG22 ILE A 546 1.474 -3.789 -4.582 1.00 0.00 H new ATOM 0 HG23 ILE A 546 2.284 -4.507 -5.994 1.00 0.00 H new ATOM 0 HD11 ILE A 546 5.271 -7.048 -4.420 1.00 0.00 H new ATOM 0 HD12 ILE A 546 4.572 -6.202 -3.019 1.00 0.00 H new ATOM 0 HD13 ILE A 546 3.517 -6.758 -4.339 1.00 0.00 H new ATOM 920 N MET A 547 2.006 -1.248 -4.364 1.00 0.00 N ATOM 921 CA MET A 547 0.771 -0.531 -4.661 1.00 0.00 C ATOM 922 C MET A 547 1.037 0.605 -5.642 1.00 0.00 C ATOM 923 O MET A 547 0.406 0.690 -6.695 1.00 0.00 O ATOM 924 CB MET A 547 0.171 0.035 -3.371 1.00 0.00 C ATOM 925 CG MET A 547 -1.165 0.710 -3.684 1.00 0.00 C ATOM 926 SD MET A 547 -1.954 1.231 -2.141 1.00 0.00 S ATOM 927 CE MET A 547 -2.887 -0.290 -1.839 1.00 0.00 C ATOM 0 H MET A 547 2.313 -1.185 -3.393 1.00 0.00 H new ATOM 0 HA MET A 547 0.066 -1.229 -5.112 1.00 0.00 H new ATOM 0 HB2 MET A 547 0.026 -0.764 -2.644 1.00 0.00 H new ATOM 0 HB3 MET A 547 0.857 0.753 -2.923 1.00 0.00 H new ATOM 0 HG2 MET A 547 -1.006 1.572 -4.333 1.00 0.00 H new ATOM 0 HG3 MET A 547 -1.815 0.021 -4.223 1.00 0.00 H new ATOM 0 HE1 MET A 547 -3.027 -0.424 -0.766 1.00 0.00 H new ATOM 0 HE2 MET A 547 -3.860 -0.223 -2.327 1.00 0.00 H new ATOM 0 HE3 MET A 547 -2.337 -1.140 -2.242 1.00 0.00 H new ATOM 937 N ASP A 548 1.977 1.477 -5.290 1.00 0.00 N ATOM 938 CA ASP A 548 2.319 2.603 -6.150 1.00 0.00 C ATOM 939 C ASP A 548 2.539 2.132 -7.583 1.00 0.00 C ATOM 940 O ASP A 548 2.203 2.834 -8.537 1.00 0.00 O ATOM 941 CB ASP A 548 3.586 3.290 -5.635 1.00 0.00 C ATOM 942 CG ASP A 548 3.303 3.976 -4.304 1.00 0.00 C ATOM 943 OD1 ASP A 548 2.355 4.744 -4.246 1.00 0.00 O ATOM 944 OD2 ASP A 548 4.036 3.725 -3.362 1.00 0.00 O ATOM 0 H ASP A 548 2.511 1.426 -4.423 1.00 0.00 H new ATOM 0 HA ASP A 548 1.492 3.313 -6.135 1.00 0.00 H new ATOM 0 HB2 ASP A 548 4.383 2.557 -5.513 1.00 0.00 H new ATOM 0 HB3 ASP A 548 3.935 4.022 -6.364 1.00 0.00 H new ATOM 949 N ASN A 549 3.107 0.938 -7.726 1.00 0.00 N ATOM 950 CA ASN A 549 3.367 0.381 -9.048 1.00 0.00 C ATOM 951 C ASN A 549 2.057 0.103 -9.779 1.00 0.00 C ATOM 952 O ASN A 549 1.897 0.461 -10.945 1.00 0.00 O ATOM 953 CB ASN A 549 4.166 -0.917 -8.920 1.00 0.00 C ATOM 954 CG ASN A 549 4.697 -1.339 -10.287 1.00 0.00 C ATOM 955 OD1 ASN A 549 4.585 -2.505 -10.665 1.00 0.00 O ATOM 956 ND2 ASN A 549 5.274 -0.454 -11.053 1.00 0.00 N ATOM 0 H ASN A 549 3.394 0.342 -6.949 1.00 0.00 H new ATOM 0 HA ASN A 549 3.943 1.108 -9.621 1.00 0.00 H new ATOM 0 HB2 ASN A 549 4.995 -0.777 -8.226 1.00 0.00 H new ATOM 0 HB3 ASN A 549 3.534 -1.704 -8.507 1.00 0.00 H new ATOM 0 HD21 ASN A 549 5.633 -0.728 -11.967 1.00 0.00 H new ATOM 0 HD22 ASN A 549 5.365 0.512 -10.737 1.00 0.00 H new ATOM 963 N PHE A 550 1.122 -0.536 -9.083 1.00 0.00 N ATOM 964 CA PHE A 550 -0.172 -0.855 -9.676 1.00 0.00 C ATOM 965 C PHE A 550 -0.788 0.384 -10.316 1.00 0.00 C ATOM 966 O PHE A 550 -1.532 0.287 -11.293 1.00 0.00 O ATOM 967 CB PHE A 550 -1.119 -1.402 -8.604 1.00 0.00 C ATOM 968 CG PHE A 550 -0.966 -2.902 -8.510 1.00 0.00 C ATOM 969 CD1 PHE A 550 0.308 -3.480 -8.534 1.00 0.00 C ATOM 970 CD2 PHE A 550 -2.102 -3.714 -8.400 1.00 0.00 C ATOM 971 CE1 PHE A 550 0.447 -4.871 -8.448 1.00 0.00 C ATOM 972 CE2 PHE A 550 -1.963 -5.104 -8.313 1.00 0.00 C ATOM 973 CZ PHE A 550 -0.688 -5.683 -8.337 1.00 0.00 C ATOM 0 H PHE A 550 1.234 -0.841 -8.116 1.00 0.00 H new ATOM 0 HA PHE A 550 -0.020 -1.611 -10.446 1.00 0.00 H new ATOM 0 HB2 PHE A 550 -0.898 -0.943 -7.641 1.00 0.00 H new ATOM 0 HB3 PHE A 550 -2.150 -1.146 -8.850 1.00 0.00 H new ATOM 0 HD1 PHE A 550 1.184 -2.854 -8.619 1.00 0.00 H new ATOM 0 HD2 PHE A 550 -3.085 -3.268 -8.382 1.00 0.00 H new ATOM 0 HE1 PHE A 550 1.430 -5.317 -8.467 1.00 0.00 H new ATOM 0 HE2 PHE A 550 -2.839 -5.730 -8.227 1.00 0.00 H new ATOM 0 HZ PHE A 550 -0.580 -6.756 -8.270 1.00 0.00 H new ATOM 983 N LEU A 551 -0.474 1.550 -9.760 1.00 0.00 N ATOM 984 CA LEU A 551 -1.005 2.803 -10.284 1.00 0.00 C ATOM 985 C LEU A 551 -0.299 3.184 -11.582 1.00 0.00 C ATOM 986 O LEU A 551 -0.851 3.022 -12.670 1.00 0.00 O ATOM 987 CB LEU A 551 -0.821 3.921 -9.255 1.00 0.00 C ATOM 988 CG LEU A 551 -1.262 3.425 -7.876 1.00 0.00 C ATOM 989 CD1 LEU A 551 -1.032 4.527 -6.840 1.00 0.00 C ATOM 990 CD2 LEU A 551 -2.749 3.065 -7.916 1.00 0.00 C ATOM 0 H LEU A 551 0.141 1.653 -8.953 1.00 0.00 H new ATOM 0 HA LEU A 551 -2.067 2.667 -10.487 1.00 0.00 H new ATOM 0 HB2 LEU A 551 0.223 4.233 -9.224 1.00 0.00 H new ATOM 0 HB3 LEU A 551 -1.406 4.794 -9.543 1.00 0.00 H new ATOM 0 HG LEU A 551 -0.681 2.544 -7.604 1.00 0.00 H new ATOM 0 HD11 LEU A 551 -1.346 4.174 -5.858 1.00 0.00 H new ATOM 0 HD12 LEU A 551 0.027 4.785 -6.812 1.00 0.00 H new ATOM 0 HD13 LEU A 551 -1.613 5.409 -7.112 1.00 0.00 H new ATOM 0 HD21 LEU A 551 -3.064 2.712 -6.934 1.00 0.00 H new ATOM 0 HD22 LEU A 551 -3.330 3.947 -8.188 1.00 0.00 H new ATOM 0 HD23 LEU A 551 -2.914 2.280 -8.654 1.00 0.00 H new ATOM 1002 N GLU A 552 0.923 3.692 -11.459 1.00 0.00 N ATOM 1003 CA GLU A 552 1.694 4.094 -12.630 1.00 0.00 C ATOM 1004 C GLU A 552 1.634 3.017 -13.709 1.00 0.00 C ATOM 1005 O GLU A 552 1.947 3.274 -14.872 1.00 0.00 O ATOM 1006 CB GLU A 552 3.151 4.344 -12.235 1.00 0.00 C ATOM 1007 CG GLU A 552 3.836 3.011 -11.930 1.00 0.00 C ATOM 1008 CD GLU A 552 5.117 3.251 -11.139 1.00 0.00 C ATOM 1009 OE1 GLU A 552 5.038 3.883 -10.099 1.00 0.00 O ATOM 1010 OE2 GLU A 552 6.159 2.799 -11.585 1.00 0.00 O ATOM 0 H GLU A 552 1.398 3.834 -10.568 1.00 0.00 H new ATOM 0 HA GLU A 552 1.263 5.013 -13.027 1.00 0.00 H new ATOM 0 HB2 GLU A 552 3.674 4.857 -13.042 1.00 0.00 H new ATOM 0 HB3 GLU A 552 3.195 4.995 -11.362 1.00 0.00 H new ATOM 0 HG2 GLU A 552 3.163 2.369 -11.362 1.00 0.00 H new ATOM 0 HG3 GLU A 552 4.065 2.490 -12.859 1.00 0.00 H new ATOM 1017 N ARG A 553 1.231 1.814 -13.317 1.00 0.00 N ATOM 1018 CA ARG A 553 1.134 0.706 -14.262 1.00 0.00 C ATOM 1019 C ARG A 553 0.501 1.172 -15.569 1.00 0.00 C ATOM 1020 O ARG A 553 -0.672 1.541 -15.605 1.00 0.00 O ATOM 1021 CB ARG A 553 0.295 -0.422 -13.659 1.00 0.00 C ATOM 1022 CG ARG A 553 0.308 -1.627 -14.601 1.00 0.00 C ATOM 1023 CD ARG A 553 -0.221 -2.858 -13.864 1.00 0.00 C ATOM 1024 NE ARG A 553 -0.183 -4.026 -14.737 1.00 0.00 N ATOM 1025 CZ ARG A 553 0.969 -4.495 -15.207 1.00 0.00 C ATOM 1026 NH1 ARG A 553 2.050 -4.418 -14.479 1.00 0.00 N ATOM 1027 NH2 ARG A 553 1.018 -5.032 -16.395 1.00 0.00 N ATOM 0 H ARG A 553 0.968 1.581 -12.359 1.00 0.00 H new ATOM 0 HA ARG A 553 2.139 0.339 -14.469 1.00 0.00 H new ATOM 0 HB2 ARG A 553 0.693 -0.705 -12.684 1.00 0.00 H new ATOM 0 HB3 ARG A 553 -0.729 -0.083 -13.499 1.00 0.00 H new ATOM 0 HG2 ARG A 553 -0.307 -1.423 -15.478 1.00 0.00 H new ATOM 0 HG3 ARG A 553 1.321 -1.812 -14.958 1.00 0.00 H new ATOM 0 HD2 ARG A 553 0.379 -3.042 -12.973 1.00 0.00 H new ATOM 0 HD3 ARG A 553 -1.243 -2.679 -13.529 1.00 0.00 H new ATOM 0 HE ARG A 553 -1.055 -4.491 -14.991 1.00 0.00 H new ATOM 0 HH11 ARG A 553 2.011 -3.998 -13.550 1.00 0.00 H new ATOM 0 HH12 ARG A 553 2.934 -4.778 -14.839 1.00 0.00 H new ATOM 0 HH21 ARG A 553 0.173 -5.092 -16.963 1.00 0.00 H new ATOM 0 HH22 ARG A 553 1.902 -5.392 -16.756 1.00 0.00 H new ATOM 1041 N THR A 554 1.287 1.151 -16.642 1.00 0.00 N ATOM 1042 CA THR A 554 0.794 1.573 -17.947 1.00 0.00 C ATOM 1043 C THR A 554 0.455 0.361 -18.806 1.00 0.00 C ATOM 1044 O THR A 554 -0.383 0.442 -19.705 1.00 0.00 O ATOM 1045 CB THR A 554 1.856 2.414 -18.657 1.00 0.00 C ATOM 1046 OG1 THR A 554 2.684 3.044 -17.688 1.00 0.00 O ATOM 1047 CG2 THR A 554 1.176 3.478 -19.520 1.00 0.00 C ATOM 0 H THR A 554 2.261 0.848 -16.633 1.00 0.00 H new ATOM 0 HA THR A 554 -0.107 2.168 -17.800 1.00 0.00 H new ATOM 0 HB THR A 554 2.464 1.770 -19.293 1.00 0.00 H new ATOM 0 HG1 THR A 554 3.366 3.582 -18.141 1.00 0.00 H new ATOM 0 HG21 THR A 554 1.934 4.076 -20.025 1.00 0.00 H new ATOM 0 HG22 THR A 554 0.542 2.994 -20.263 1.00 0.00 H new ATOM 0 HG23 THR A 554 0.566 4.124 -18.888 1.00 0.00 H new ATOM 1055 N ALA A 555 1.115 -0.758 -18.532 1.00 0.00 N ATOM 1056 CA ALA A 555 0.875 -1.974 -19.297 1.00 0.00 C ATOM 1057 C ALA A 555 1.079 -1.698 -20.782 1.00 0.00 C ATOM 1058 O ALA A 555 0.821 -2.554 -21.628 1.00 0.00 O ATOM 1059 CB ALA A 555 -0.552 -2.465 -19.057 1.00 0.00 C ATOM 0 H ALA A 555 1.813 -0.848 -17.794 1.00 0.00 H new ATOM 0 HA ALA A 555 1.578 -2.742 -18.974 1.00 0.00 H new ATOM 0 HB1 ALA A 555 -0.725 -3.375 -19.632 1.00 0.00 H new ATOM 0 HB2 ALA A 555 -0.691 -2.674 -17.996 1.00 0.00 H new ATOM 0 HB3 ALA A 555 -1.259 -1.697 -19.371 1.00 0.00 H new ATOM 1065 N ILE A 556 1.543 -0.491 -21.084 1.00 0.00 N ATOM 1066 CA ILE A 556 1.782 -0.091 -22.463 1.00 0.00 C ATOM 1067 C ILE A 556 2.881 -0.944 -23.090 1.00 0.00 C ATOM 1068 O ILE A 556 2.994 -1.026 -24.313 1.00 0.00 O ATOM 1069 CB ILE A 556 2.177 1.390 -22.504 1.00 0.00 C ATOM 1070 CG1 ILE A 556 1.279 2.135 -23.495 1.00 0.00 C ATOM 1071 CG2 ILE A 556 3.639 1.530 -22.934 1.00 0.00 C ATOM 1072 CD1 ILE A 556 -0.078 2.413 -22.842 1.00 0.00 C ATOM 0 H ILE A 556 1.761 0.226 -20.392 1.00 0.00 H new ATOM 0 HA ILE A 556 0.867 -0.240 -23.036 1.00 0.00 H new ATOM 0 HB ILE A 556 2.054 1.818 -21.509 1.00 0.00 H new ATOM 0 HG12 ILE A 556 1.749 3.071 -23.796 1.00 0.00 H new ATOM 0 HG13 ILE A 556 1.145 1.541 -24.399 1.00 0.00 H new ATOM 0 HG21 ILE A 556 3.911 2.585 -22.960 1.00 0.00 H new ATOM 0 HG22 ILE A 556 4.279 1.008 -22.223 1.00 0.00 H new ATOM 0 HG23 ILE A 556 3.770 1.097 -23.926 1.00 0.00 H new ATOM 0 HD11 ILE A 556 -0.719 2.944 -23.546 1.00 0.00 H new ATOM 0 HD12 ILE A 556 -0.548 1.470 -22.563 1.00 0.00 H new ATOM 0 HD13 ILE A 556 0.065 3.024 -21.951 1.00 0.00 H new ATOM 1084 N GLU A 557 3.687 -1.577 -22.245 1.00 0.00 N ATOM 1085 CA GLU A 557 4.773 -2.422 -22.729 1.00 0.00 C ATOM 1086 C GLU A 557 4.237 -3.776 -23.182 1.00 0.00 C ATOM 1087 O GLU A 557 3.894 -3.958 -24.350 1.00 0.00 O ATOM 1088 CB GLU A 557 5.811 -2.624 -21.623 1.00 0.00 C ATOM 1089 CG GLU A 557 6.296 -1.262 -21.122 1.00 0.00 C ATOM 1090 CD GLU A 557 7.554 -1.436 -20.278 1.00 0.00 C ATOM 1091 OE1 GLU A 557 7.885 -2.569 -19.969 1.00 0.00 O ATOM 1092 OE2 GLU A 557 8.168 -0.434 -19.950 1.00 0.00 O ATOM 0 H GLU A 557 3.611 -1.522 -21.229 1.00 0.00 H new ATOM 0 HA GLU A 557 5.242 -1.927 -23.580 1.00 0.00 H new ATOM 0 HB2 GLU A 557 5.376 -3.192 -20.801 1.00 0.00 H new ATOM 0 HB3 GLU A 557 6.652 -3.205 -22.001 1.00 0.00 H new ATOM 0 HG2 GLU A 557 6.503 -0.607 -21.968 1.00 0.00 H new ATOM 0 HG3 GLU A 557 5.515 -0.783 -20.531 1.00 0.00 H new ATOM 1099 N LEU A 558 4.168 -4.722 -22.251 1.00 0.00 N ATOM 1100 CA LEU A 558 3.671 -6.056 -22.567 1.00 0.00 C ATOM 1101 C LEU A 558 2.163 -6.130 -22.349 1.00 0.00 C ATOM 1102 O LEU A 558 1.660 -5.746 -21.294 1.00 0.00 O ATOM 1103 CB LEU A 558 4.367 -7.097 -21.685 1.00 0.00 C ATOM 1104 CG LEU A 558 5.766 -7.387 -22.236 1.00 0.00 C ATOM 1105 CD1 LEU A 558 5.653 -8.132 -23.569 1.00 0.00 C ATOM 1106 CD2 LEU A 558 6.512 -6.067 -22.451 1.00 0.00 C ATOM 0 H LEU A 558 4.448 -4.591 -21.279 1.00 0.00 H new ATOM 0 HA LEU A 558 3.887 -6.265 -23.615 1.00 0.00 H new ATOM 0 HB2 LEU A 558 4.438 -6.731 -20.661 1.00 0.00 H new ATOM 0 HB3 LEU A 558 3.779 -8.015 -21.656 1.00 0.00 H new ATOM 0 HG LEU A 558 6.313 -8.005 -21.524 1.00 0.00 H new ATOM 0 HD11 LEU A 558 6.651 -8.336 -23.957 1.00 0.00 H new ATOM 0 HD12 LEU A 558 5.123 -9.072 -23.416 1.00 0.00 H new ATOM 0 HD13 LEU A 558 5.104 -7.518 -24.283 1.00 0.00 H new ATOM 0 HD21 LEU A 558 7.508 -6.272 -22.843 1.00 0.00 H new ATOM 0 HD22 LEU A 558 5.962 -5.450 -23.161 1.00 0.00 H new ATOM 0 HD23 LEU A 558 6.597 -5.539 -21.502 1.00 0.00 H new ATOM 1118 N LYS A 559 1.449 -6.626 -23.355 1.00 0.00 N ATOM 1119 CA LYS A 559 -0.003 -6.745 -23.264 1.00 0.00 C ATOM 1120 C LYS A 559 -0.444 -8.169 -23.588 1.00 0.00 C ATOM 1121 O LYS A 559 -1.290 -8.385 -24.456 1.00 0.00 O ATOM 1122 CB LYS A 559 -0.669 -5.770 -24.235 1.00 0.00 C ATOM 1123 CG LYS A 559 -0.066 -5.945 -25.631 1.00 0.00 C ATOM 1124 CD LYS A 559 -0.954 -5.246 -26.663 1.00 0.00 C ATOM 1125 CE LYS A 559 -0.416 -5.519 -28.068 1.00 0.00 C ATOM 1126 NZ LYS A 559 0.808 -4.701 -28.299 1.00 0.00 N ATOM 0 H LYS A 559 1.848 -6.950 -24.236 1.00 0.00 H new ATOM 0 HA LYS A 559 -0.305 -6.505 -22.245 1.00 0.00 H new ATOM 0 HB2 LYS A 559 -1.744 -5.949 -24.267 1.00 0.00 H new ATOM 0 HB3 LYS A 559 -0.527 -4.745 -23.892 1.00 0.00 H new ATOM 0 HG2 LYS A 559 0.940 -5.527 -25.659 1.00 0.00 H new ATOM 0 HG3 LYS A 559 0.022 -7.005 -25.870 1.00 0.00 H new ATOM 0 HD2 LYS A 559 -1.980 -5.605 -26.579 1.00 0.00 H new ATOM 0 HD3 LYS A 559 -0.976 -4.173 -26.473 1.00 0.00 H new ATOM 0 HE2 LYS A 559 -0.185 -6.578 -28.181 1.00 0.00 H new ATOM 0 HE3 LYS A 559 -1.174 -5.277 -28.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 1.126 -4.821 -29.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 0.593 -3.698 -28.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 1.560 -5.012 -27.652 1.00 0.00 H new ATOM 1140 N THR A 560 0.134 -9.136 -22.883 1.00 0.00 N ATOM 1141 CA THR A 560 -0.207 -10.537 -23.105 1.00 0.00 C ATOM 1142 C THR A 560 0.263 -11.395 -21.934 1.00 0.00 C ATOM 1143 O THR A 560 1.463 -11.567 -21.722 1.00 0.00 O ATOM 1144 CB THR A 560 0.441 -11.035 -24.398 1.00 0.00 C ATOM 1145 OG1 THR A 560 0.008 -10.227 -25.484 1.00 0.00 O ATOM 1146 CG2 THR A 560 0.035 -12.489 -24.647 1.00 0.00 C ATOM 0 H THR A 560 0.835 -8.978 -22.159 1.00 0.00 H new ATOM 0 HA THR A 560 -1.291 -10.618 -23.188 1.00 0.00 H new ATOM 0 HB THR A 560 1.526 -10.974 -24.309 1.00 0.00 H new ATOM 0 HG1 THR A 560 -0.868 -9.841 -25.275 1.00 0.00 H new ATOM 0 HG21 THR A 560 0.497 -12.843 -25.569 1.00 0.00 H new ATOM 0 HG22 THR A 560 0.368 -13.107 -23.813 1.00 0.00 H new ATOM 0 HG23 THR A 560 -1.049 -12.554 -24.737 1.00 0.00 H new ATOM 1154 N ASP A 561 -0.690 -11.929 -21.179 1.00 0.00 N ATOM 1155 CA ASP A 561 -0.361 -12.768 -20.032 1.00 0.00 C ATOM 1156 C ASP A 561 0.562 -12.026 -19.071 1.00 0.00 C ATOM 1157 O ASP A 561 1.782 -12.045 -19.229 1.00 0.00 O ATOM 1158 CB ASP A 561 0.319 -14.055 -20.504 1.00 0.00 C ATOM 1159 CG ASP A 561 -0.523 -14.723 -21.585 1.00 0.00 C ATOM 1160 OD1 ASP A 561 -1.729 -14.537 -21.569 1.00 0.00 O ATOM 1161 OD2 ASP A 561 0.050 -15.410 -22.414 1.00 0.00 O ATOM 0 H ASP A 561 -1.689 -11.798 -21.338 1.00 0.00 H new ATOM 0 HA ASP A 561 -1.286 -13.016 -19.511 1.00 0.00 H new ATOM 0 HB2 ASP A 561 1.312 -13.830 -20.892 1.00 0.00 H new ATOM 0 HB3 ASP A 561 0.452 -14.735 -19.663 1.00 0.00 H new ATOM 1166 N TRP A 562 -0.030 -11.373 -18.076 1.00 0.00 N ATOM 1167 CA TRP A 562 0.749 -10.626 -17.095 1.00 0.00 C ATOM 1168 C TRP A 562 -0.064 -10.400 -15.824 1.00 0.00 C ATOM 1169 O TRP A 562 0.471 -10.445 -14.717 1.00 0.00 O ATOM 1170 CB TRP A 562 1.172 -9.278 -17.680 1.00 0.00 C ATOM 1171 CG TRP A 562 2.043 -8.560 -16.699 1.00 0.00 C ATOM 1172 CD1 TRP A 562 1.609 -7.964 -15.565 1.00 0.00 C ATOM 1173 CD2 TRP A 562 3.485 -8.354 -16.744 1.00 0.00 C ATOM 1174 NE1 TRP A 562 2.692 -7.404 -14.911 1.00 0.00 N ATOM 1175 CE2 TRP A 562 3.870 -7.618 -15.598 1.00 0.00 C ATOM 1176 CE3 TRP A 562 4.485 -8.731 -17.658 1.00 0.00 C ATOM 1177 CZ2 TRP A 562 5.202 -7.269 -15.367 1.00 0.00 C ATOM 1178 CZ3 TRP A 562 5.826 -8.380 -17.429 1.00 0.00 C ATOM 1179 CH2 TRP A 562 6.183 -7.650 -16.286 1.00 0.00 C ATOM 0 H TRP A 562 -1.039 -11.346 -17.928 1.00 0.00 H new ATOM 0 HA TRP A 562 1.637 -11.207 -16.846 1.00 0.00 H new ATOM 0 HB2 TRP A 562 1.708 -9.428 -18.617 1.00 0.00 H new ATOM 0 HB3 TRP A 562 0.292 -8.677 -17.909 1.00 0.00 H new ATOM 0 HD1 TRP A 562 0.584 -7.931 -15.225 1.00 0.00 H new ATOM 0 HE1 TRP A 562 2.628 -6.895 -14.029 1.00 0.00 H new ATOM 0 HE3 TRP A 562 4.221 -9.294 -18.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 562 5.472 -6.709 -14.484 1.00 0.00 H new ATOM 0 HZ3 TRP A 562 6.586 -8.674 -18.137 1.00 0.00 H new ATOM 0 HH2 TRP A 562 7.215 -7.383 -16.116 1.00 0.00 H new ATOM 1190 N VAL A 563 -1.359 -10.156 -15.994 1.00 0.00 N ATOM 1191 CA VAL A 563 -2.238 -9.924 -14.853 1.00 0.00 C ATOM 1192 C VAL A 563 -2.253 -11.139 -13.931 1.00 0.00 C ATOM 1193 O VAL A 563 -2.398 -11.007 -12.716 1.00 0.00 O ATOM 1194 CB VAL A 563 -3.659 -9.632 -15.338 1.00 0.00 C ATOM 1195 CG1 VAL A 563 -4.177 -10.822 -16.147 1.00 0.00 C ATOM 1196 CG2 VAL A 563 -4.571 -9.399 -14.132 1.00 0.00 C ATOM 0 H VAL A 563 -1.821 -10.114 -16.903 1.00 0.00 H new ATOM 0 HA VAL A 563 -1.860 -9.065 -14.298 1.00 0.00 H new ATOM 0 HB VAL A 563 -3.653 -8.741 -15.967 1.00 0.00 H new ATOM 0 HG11 VAL A 563 -5.190 -10.614 -16.493 1.00 0.00 H new ATOM 0 HG12 VAL A 563 -3.527 -10.988 -17.006 1.00 0.00 H new ATOM 0 HG13 VAL A 563 -4.184 -11.713 -15.520 1.00 0.00 H new ATOM 0 HG21 VAL A 563 -5.584 -9.191 -14.477 1.00 0.00 H new ATOM 0 HG22 VAL A 563 -4.577 -10.289 -13.503 1.00 0.00 H new ATOM 0 HG23 VAL A 563 -4.202 -8.551 -13.556 1.00 0.00 H new ATOM 1206 N ARG A 564 -2.102 -12.322 -14.517 1.00 0.00 N ATOM 1207 CA ARG A 564 -2.100 -13.555 -13.739 1.00 0.00 C ATOM 1208 C ARG A 564 -1.015 -13.510 -12.667 1.00 0.00 C ATOM 1209 O ARG A 564 -1.311 -13.485 -11.472 1.00 0.00 O ATOM 1210 CB ARG A 564 -1.861 -14.754 -14.659 1.00 0.00 C ATOM 1211 CG ARG A 564 -2.220 -16.045 -13.920 1.00 0.00 C ATOM 1212 CD ARG A 564 -1.976 -17.245 -14.837 1.00 0.00 C ATOM 1213 NE ARG A 564 -2.615 -18.435 -14.290 1.00 0.00 N ATOM 1214 CZ ARG A 564 -3.917 -18.652 -14.449 1.00 0.00 C ATOM 1215 NH1 ARG A 564 -4.774 -18.094 -13.638 1.00 0.00 N ATOM 1216 NH2 ARG A 564 -4.338 -19.421 -15.415 1.00 0.00 N ATOM 0 H ARG A 564 -1.980 -12.453 -15.521 1.00 0.00 H new ATOM 0 HA ARG A 564 -3.071 -13.658 -13.254 1.00 0.00 H new ATOM 0 HB2 ARG A 564 -2.465 -14.659 -15.561 1.00 0.00 H new ATOM 0 HB3 ARG A 564 -0.818 -14.781 -14.975 1.00 0.00 H new ATOM 0 HG2 ARG A 564 -1.619 -16.137 -13.015 1.00 0.00 H new ATOM 0 HG3 ARG A 564 -3.264 -16.019 -13.608 1.00 0.00 H new ATOM 0 HD2 ARG A 564 -2.369 -17.037 -15.832 1.00 0.00 H new ATOM 0 HD3 ARG A 564 -0.905 -17.416 -14.947 1.00 0.00 H new ATOM 0 HE ARG A 564 -2.053 -19.114 -13.776 1.00 0.00 H new ATOM 0 HH11 ARG A 564 -4.445 -17.492 -12.883 1.00 0.00 H new ATOM 0 HH12 ARG A 564 -5.773 -18.260 -13.759 1.00 0.00 H new ATOM 0 HH21 ARG A 564 -3.668 -19.856 -16.049 1.00 0.00 H new ATOM 0 HH22 ARG A 564 -5.337 -19.587 -15.536 1.00 0.00 H new ATOM 1230 N PHE A 565 0.240 -13.499 -13.103 1.00 0.00 N ATOM 1231 CA PHE A 565 1.361 -13.456 -12.170 1.00 0.00 C ATOM 1232 C PHE A 565 1.184 -12.318 -11.171 1.00 0.00 C ATOM 1233 O PHE A 565 1.049 -12.548 -9.970 1.00 0.00 O ATOM 1234 CB PHE A 565 2.671 -13.266 -12.937 1.00 0.00 C ATOM 1235 CG PHE A 565 3.017 -14.542 -13.667 1.00 0.00 C ATOM 1236 CD1 PHE A 565 3.628 -15.598 -12.982 1.00 0.00 C ATOM 1237 CD2 PHE A 565 2.727 -14.668 -15.031 1.00 0.00 C ATOM 1238 CE1 PHE A 565 3.950 -16.780 -13.659 1.00 0.00 C ATOM 1239 CE2 PHE A 565 3.047 -15.851 -15.709 1.00 0.00 C ATOM 1240 CZ PHE A 565 3.658 -16.907 -15.022 1.00 0.00 C ATOM 0 H PHE A 565 0.506 -13.519 -14.088 1.00 0.00 H new ATOM 0 HA PHE A 565 1.393 -14.400 -11.625 1.00 0.00 H new ATOM 0 HB2 PHE A 565 2.574 -12.444 -13.646 1.00 0.00 H new ATOM 0 HB3 PHE A 565 3.473 -13.000 -12.248 1.00 0.00 H new ATOM 0 HD1 PHE A 565 3.851 -15.501 -11.930 1.00 0.00 H new ATOM 0 HD2 PHE A 565 2.256 -13.853 -15.560 1.00 0.00 H new ATOM 0 HE1 PHE A 565 4.424 -17.594 -13.130 1.00 0.00 H new ATOM 0 HE2 PHE A 565 2.823 -15.949 -16.761 1.00 0.00 H new ATOM 0 HZ PHE A 565 3.904 -17.820 -15.544 1.00 0.00 H new ATOM 1250 N LEU A 566 1.187 -11.088 -11.677 1.00 0.00 N ATOM 1251 CA LEU A 566 1.025 -9.920 -10.819 1.00 0.00 C ATOM 1252 C LEU A 566 -0.111 -10.138 -9.825 1.00 0.00 C ATOM 1253 O LEU A 566 0.045 -9.905 -8.627 1.00 0.00 O ATOM 1254 CB LEU A 566 0.733 -8.682 -11.671 1.00 0.00 C ATOM 1255 CG LEU A 566 1.114 -7.421 -10.892 1.00 0.00 C ATOM 1256 CD1 LEU A 566 2.591 -7.097 -11.129 1.00 0.00 C ATOM 1257 CD2 LEU A 566 0.254 -6.248 -11.370 1.00 0.00 C ATOM 0 H LEU A 566 1.299 -10.876 -12.668 1.00 0.00 H new ATOM 0 HA LEU A 566 1.951 -9.768 -10.265 1.00 0.00 H new ATOM 0 HB2 LEU A 566 1.295 -8.729 -12.604 1.00 0.00 H new ATOM 0 HB3 LEU A 566 -0.324 -8.652 -11.937 1.00 0.00 H new ATOM 0 HG LEU A 566 0.946 -7.589 -9.828 1.00 0.00 H new ATOM 0 HD11 LEU A 566 2.860 -6.199 -10.573 1.00 0.00 H new ATOM 0 HD12 LEU A 566 3.205 -7.931 -10.790 1.00 0.00 H new ATOM 0 HD13 LEU A 566 2.761 -6.930 -12.193 1.00 0.00 H new ATOM 0 HD21 LEU A 566 0.524 -5.349 -10.816 1.00 0.00 H new ATOM 0 HD22 LEU A 566 0.423 -6.083 -12.434 1.00 0.00 H new ATOM 0 HD23 LEU A 566 -0.798 -6.476 -11.201 1.00 0.00 H new ATOM 1269 N ALA A 567 -1.254 -10.588 -10.333 1.00 0.00 N ATOM 1270 CA ALA A 567 -2.412 -10.836 -9.479 1.00 0.00 C ATOM 1271 C ALA A 567 -2.057 -11.820 -8.370 1.00 0.00 C ATOM 1272 O ALA A 567 -2.393 -11.606 -7.206 1.00 0.00 O ATOM 1273 CB ALA A 567 -3.565 -11.396 -10.313 1.00 0.00 C ATOM 0 H ALA A 567 -1.404 -10.787 -11.322 1.00 0.00 H new ATOM 0 HA ALA A 567 -2.717 -9.892 -9.027 1.00 0.00 H new ATOM 0 HB1 ALA A 567 -4.425 -11.578 -9.669 1.00 0.00 H new ATOM 0 HB2 ALA A 567 -3.837 -10.678 -11.087 1.00 0.00 H new ATOM 0 HB3 ALA A 567 -3.256 -12.332 -10.779 1.00 0.00 H new ATOM 1279 N LEU A 568 -1.376 -12.900 -8.740 1.00 0.00 N ATOM 1280 CA LEU A 568 -0.980 -13.910 -7.766 1.00 0.00 C ATOM 1281 C LEU A 568 -0.394 -13.253 -6.521 1.00 0.00 C ATOM 1282 O LEU A 568 -0.981 -13.311 -5.441 1.00 0.00 O ATOM 1283 CB LEU A 568 0.055 -14.854 -8.382 1.00 0.00 C ATOM 1284 CG LEU A 568 0.213 -16.092 -7.496 1.00 0.00 C ATOM 1285 CD1 LEU A 568 -0.824 -17.145 -7.893 1.00 0.00 C ATOM 1286 CD2 LEU A 568 1.619 -16.672 -7.678 1.00 0.00 C ATOM 0 H LEU A 568 -1.089 -13.097 -9.699 1.00 0.00 H new ATOM 0 HA LEU A 568 -1.865 -14.479 -7.481 1.00 0.00 H new ATOM 0 HB2 LEU A 568 -0.258 -15.149 -9.384 1.00 0.00 H new ATOM 0 HB3 LEU A 568 1.012 -14.343 -8.484 1.00 0.00 H new ATOM 0 HG LEU A 568 0.064 -15.811 -6.453 1.00 0.00 H new ATOM 0 HD11 LEU A 568 -0.709 -18.025 -7.261 1.00 0.00 H new ATOM 0 HD12 LEU A 568 -1.826 -16.735 -7.766 1.00 0.00 H new ATOM 0 HD13 LEU A 568 -0.677 -17.426 -8.936 1.00 0.00 H new ATOM 0 HD21 LEU A 568 1.733 -17.554 -7.048 1.00 0.00 H new ATOM 0 HD22 LEU A 568 1.765 -16.951 -8.722 1.00 0.00 H new ATOM 0 HD23 LEU A 568 2.360 -15.925 -7.394 1.00 0.00 H new ATOM 1298 N ALA A 569 0.767 -12.624 -6.680 1.00 0.00 N ATOM 1299 CA ALA A 569 1.423 -11.957 -5.562 1.00 0.00 C ATOM 1300 C ALA A 569 0.411 -11.155 -4.750 1.00 0.00 C ATOM 1301 O ALA A 569 0.073 -11.520 -3.624 1.00 0.00 O ATOM 1302 CB ALA A 569 2.518 -11.025 -6.080 1.00 0.00 C ATOM 0 H ALA A 569 1.269 -12.563 -7.566 1.00 0.00 H new ATOM 0 HA ALA A 569 1.868 -12.717 -4.919 1.00 0.00 H new ATOM 0 HB1 ALA A 569 3.003 -10.531 -5.238 1.00 0.00 H new ATOM 0 HB2 ALA A 569 3.256 -11.604 -6.635 1.00 0.00 H new ATOM 0 HB3 ALA A 569 2.077 -10.275 -6.736 1.00 0.00 H new ATOM 1308 N LEU A 570 -0.070 -10.060 -5.331 1.00 0.00 N ATOM 1309 CA LEU A 570 -1.045 -9.211 -4.654 1.00 0.00 C ATOM 1310 C LEU A 570 -2.117 -10.059 -3.977 1.00 0.00 C ATOM 1311 O LEU A 570 -2.836 -9.583 -3.098 1.00 0.00 O ATOM 1312 CB LEU A 570 -1.699 -8.265 -5.667 1.00 0.00 C ATOM 1313 CG LEU A 570 -1.854 -6.870 -5.054 1.00 0.00 C ATOM 1314 CD1 LEU A 570 -2.713 -6.955 -3.791 1.00 0.00 C ATOM 1315 CD2 LEU A 570 -0.474 -6.308 -4.696 1.00 0.00 C ATOM 0 H LEU A 570 0.197 -9.741 -6.262 1.00 0.00 H new ATOM 0 HA LEU A 570 -0.528 -8.628 -3.891 1.00 0.00 H new ATOM 0 HB2 LEU A 570 -1.091 -8.209 -6.570 1.00 0.00 H new ATOM 0 HB3 LEU A 570 -2.674 -8.652 -5.962 1.00 0.00 H new ATOM 0 HG LEU A 570 -2.337 -6.212 -5.777 1.00 0.00 H new ATOM 0 HD11 LEU A 570 -2.821 -5.961 -3.357 1.00 0.00 H new ATOM 0 HD12 LEU A 570 -3.697 -7.349 -4.046 1.00 0.00 H new ATOM 0 HD13 LEU A 570 -2.234 -7.616 -3.069 1.00 0.00 H new ATOM 0 HD21 LEU A 570 -0.587 -5.315 -4.260 1.00 0.00 H new ATOM 0 HD22 LEU A 570 0.012 -6.967 -3.976 1.00 0.00 H new ATOM 0 HD23 LEU A 570 0.136 -6.241 -5.597 1.00 0.00 H new ATOM 1327 N GLY A 571 -2.222 -11.318 -4.393 1.00 0.00 N ATOM 1328 CA GLY A 571 -3.213 -12.221 -3.821 1.00 0.00 C ATOM 1329 C GLY A 571 -2.576 -13.165 -2.806 1.00 0.00 C ATOM 1330 O GLY A 571 -2.621 -12.918 -1.601 1.00 0.00 O ATOM 0 H GLY A 571 -1.637 -11.733 -5.119 1.00 0.00 H new ATOM 0 HA2 GLY A 571 -4.001 -11.642 -3.339 1.00 0.00 H new ATOM 0 HA3 GLY A 571 -3.683 -12.800 -4.616 1.00 0.00 H new ATOM 1334 N ILE A 572 -1.986 -14.249 -3.301 1.00 0.00 N ATOM 1335 CA ILE A 572 -1.345 -15.227 -2.429 1.00 0.00 C ATOM 1336 C ILE A 572 -0.655 -14.537 -1.255 1.00 0.00 C ATOM 1337 O ILE A 572 -0.586 -15.086 -0.155 1.00 0.00 O ATOM 1338 CB ILE A 572 -0.317 -16.038 -3.221 1.00 0.00 C ATOM 1339 CG1 ILE A 572 0.159 -17.221 -2.375 1.00 0.00 C ATOM 1340 CG2 ILE A 572 0.878 -15.149 -3.569 1.00 0.00 C ATOM 1341 CD1 ILE A 572 1.062 -18.121 -3.219 1.00 0.00 C ATOM 0 H ILE A 572 -1.939 -14.471 -4.295 1.00 0.00 H new ATOM 0 HA ILE A 572 -2.115 -15.893 -2.040 1.00 0.00 H new ATOM 0 HB ILE A 572 -0.775 -16.406 -4.139 1.00 0.00 H new ATOM 0 HG12 ILE A 572 0.701 -16.861 -1.500 1.00 0.00 H new ATOM 0 HG13 ILE A 572 -0.697 -17.788 -2.009 1.00 0.00 H new ATOM 0 HG21 ILE A 572 1.610 -15.727 -4.133 1.00 0.00 H new ATOM 0 HG22 ILE A 572 0.541 -14.305 -4.171 1.00 0.00 H new ATOM 0 HG23 ILE A 572 1.336 -14.780 -2.651 1.00 0.00 H new ATOM 0 HD11 ILE A 572 1.401 -18.964 -2.617 1.00 0.00 H new ATOM 0 HD12 ILE A 572 0.505 -18.491 -4.080 1.00 0.00 H new ATOM 0 HD13 ILE A 572 1.925 -17.551 -3.563 1.00 0.00 H new ATOM 1353 N LEU A 573 -0.147 -13.333 -1.496 1.00 0.00 N ATOM 1354 CA LEU A 573 0.534 -12.580 -0.448 1.00 0.00 C ATOM 1355 C LEU A 573 -0.212 -12.712 0.876 1.00 0.00 C ATOM 1356 O LEU A 573 0.369 -12.537 1.947 1.00 0.00 O ATOM 1357 CB LEU A 573 0.628 -11.104 -0.842 1.00 0.00 C ATOM 1358 CG LEU A 573 1.238 -10.300 0.308 1.00 0.00 C ATOM 1359 CD1 LEU A 573 2.605 -10.885 0.675 1.00 0.00 C ATOM 1360 CD2 LEU A 573 1.411 -8.843 -0.127 1.00 0.00 C ATOM 0 H LEU A 573 -0.193 -12.861 -2.399 1.00 0.00 H new ATOM 0 HA LEU A 573 1.538 -12.986 -0.327 1.00 0.00 H new ATOM 0 HB2 LEU A 573 1.239 -10.995 -1.738 1.00 0.00 H new ATOM 0 HB3 LEU A 573 -0.363 -10.718 -1.083 1.00 0.00 H new ATOM 0 HG LEU A 573 0.578 -10.349 1.174 1.00 0.00 H new ATOM 0 HD11 LEU A 573 3.038 -10.311 1.494 1.00 0.00 H new ATOM 0 HD12 LEU A 573 2.485 -11.924 0.983 1.00 0.00 H new ATOM 0 HD13 LEU A 573 3.266 -10.837 -0.191 1.00 0.00 H new ATOM 0 HD21 LEU A 573 1.845 -8.268 0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 573 2.071 -8.798 -0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 573 0.440 -8.424 -0.389 1.00 0.00 H new ATOM 1372 N TYR A 574 -1.502 -13.021 0.794 1.00 0.00 N ATOM 1373 CA TYR A 574 -2.319 -13.175 1.993 1.00 0.00 C ATOM 1374 C TYR A 574 -3.225 -14.397 1.871 1.00 0.00 C ATOM 1375 O TYR A 574 -4.283 -14.337 1.246 1.00 0.00 O ATOM 1376 CB TYR A 574 -3.172 -11.924 2.207 1.00 0.00 C ATOM 1377 CG TYR A 574 -2.272 -10.720 2.357 1.00 0.00 C ATOM 1378 CD1 TYR A 574 -1.436 -10.608 3.474 1.00 0.00 C ATOM 1379 CD2 TYR A 574 -2.274 -9.718 1.380 1.00 0.00 C ATOM 1380 CE1 TYR A 574 -0.600 -9.494 3.614 1.00 0.00 C ATOM 1381 CE2 TYR A 574 -1.439 -8.603 1.520 1.00 0.00 C ATOM 1382 CZ TYR A 574 -0.602 -8.492 2.637 1.00 0.00 C ATOM 1383 OH TYR A 574 0.221 -7.392 2.775 1.00 0.00 O ATOM 0 H TYR A 574 -2.002 -13.169 -0.083 1.00 0.00 H new ATOM 0 HA TYR A 574 -1.656 -13.313 2.847 1.00 0.00 H new ATOM 0 HB2 TYR A 574 -3.848 -11.783 1.364 1.00 0.00 H new ATOM 0 HB3 TYR A 574 -3.792 -12.041 3.096 1.00 0.00 H new ATOM 0 HD1 TYR A 574 -1.436 -11.381 4.228 1.00 0.00 H new ATOM 0 HD2 TYR A 574 -2.919 -9.805 0.518 1.00 0.00 H new ATOM 0 HE1 TYR A 574 0.046 -9.408 4.475 1.00 0.00 H new ATOM 0 HE2 TYR A 574 -1.440 -7.829 0.767 1.00 0.00 H new ATOM 0 HH TYR A 574 0.538 -7.335 3.701 1.00 0.00 H new ATOM 1393 N MET A 575 -2.800 -15.504 2.472 1.00 0.00 N ATOM 1394 CA MET A 575 -3.581 -16.735 2.423 1.00 0.00 C ATOM 1395 C MET A 575 -4.714 -16.693 3.441 1.00 0.00 C ATOM 1396 O MET A 575 -5.787 -17.252 3.215 1.00 0.00 O ATOM 1397 CB MET A 575 -2.678 -17.937 2.710 1.00 0.00 C ATOM 1398 CG MET A 575 -2.035 -17.777 4.089 1.00 0.00 C ATOM 1399 SD MET A 575 -3.193 -18.335 5.363 1.00 0.00 S ATOM 1400 CE MET A 575 -1.984 -18.546 6.692 1.00 0.00 C ATOM 0 H MET A 575 -1.927 -15.574 2.994 1.00 0.00 H new ATOM 0 HA MET A 575 -4.009 -16.832 1.425 1.00 0.00 H new ATOM 0 HB2 MET A 575 -3.259 -18.858 2.673 1.00 0.00 H new ATOM 0 HB3 MET A 575 -1.906 -18.016 1.944 1.00 0.00 H new ATOM 0 HG2 MET A 575 -1.113 -18.356 4.142 1.00 0.00 H new ATOM 0 HG3 MET A 575 -1.766 -16.734 4.258 1.00 0.00 H new ATOM 0 HE1 MET A 575 -2.490 -18.893 7.593 1.00 0.00 H new ATOM 0 HE2 MET A 575 -1.237 -19.280 6.391 1.00 0.00 H new ATOM 0 HE3 MET A 575 -1.496 -17.593 6.894 1.00 0.00 H new ATOM 1410 N GLY A 576 -4.470 -16.025 4.565 1.00 0.00 N ATOM 1411 CA GLY A 576 -5.479 -15.917 5.612 1.00 0.00 C ATOM 1412 C GLY A 576 -4.964 -15.085 6.781 1.00 0.00 C ATOM 1413 O GLY A 576 -3.765 -14.833 6.897 1.00 0.00 O ATOM 0 H GLY A 576 -3.589 -15.554 4.773 1.00 0.00 H new ATOM 0 HA2 GLY A 576 -6.382 -15.461 5.206 1.00 0.00 H new ATOM 0 HA3 GLY A 576 -5.754 -16.912 5.962 1.00 0.00 H new ATOM 1417 N GLN A 577 -5.880 -14.659 7.646 1.00 0.00 N ATOM 1418 CA GLN A 577 -5.507 -13.854 8.803 1.00 0.00 C ATOM 1419 C GLN A 577 -4.537 -12.748 8.399 1.00 0.00 C ATOM 1420 O GLN A 577 -3.326 -12.875 8.579 1.00 0.00 O ATOM 1421 CB GLN A 577 -4.858 -14.740 9.869 1.00 0.00 C ATOM 1422 CG GLN A 577 -5.908 -15.682 10.460 1.00 0.00 C ATOM 1423 CD GLN A 577 -5.323 -16.431 11.653 1.00 0.00 C ATOM 1424 OE1 GLN A 577 -4.191 -16.911 11.591 1.00 0.00 O ATOM 1425 NE2 GLN A 577 -6.032 -16.562 12.741 1.00 0.00 N ATOM 0 H GLN A 577 -6.878 -14.856 7.568 1.00 0.00 H new ATOM 0 HA GLN A 577 -6.410 -13.398 9.209 1.00 0.00 H new ATOM 0 HB2 GLN A 577 -4.043 -15.316 9.431 1.00 0.00 H new ATOM 0 HB3 GLN A 577 -4.425 -14.122 10.656 1.00 0.00 H new ATOM 0 HG2 GLN A 577 -6.785 -15.114 10.771 1.00 0.00 H new ATOM 0 HG3 GLN A 577 -6.240 -16.391 9.702 1.00 0.00 H new ATOM 0 HE21 GLN A 577 -6.970 -16.163 12.790 1.00 0.00 H new ATOM 0 HE22 GLN A 577 -5.648 -17.063 13.542 1.00 0.00 H new ATOM 1434 N GLY A 578 -5.079 -11.665 7.850 1.00 0.00 N ATOM 1435 CA GLY A 578 -4.251 -10.543 7.423 1.00 0.00 C ATOM 1436 C GLY A 578 -5.113 -9.345 7.040 1.00 0.00 C ATOM 1437 O GLY A 578 -5.320 -9.071 5.858 1.00 0.00 O ATOM 0 H GLY A 578 -6.079 -11.541 7.691 1.00 0.00 H new ATOM 0 HA2 GLY A 578 -3.569 -10.263 8.226 1.00 0.00 H new ATOM 0 HA3 GLY A 578 -3.638 -10.841 6.573 1.00 0.00 H new ATOM 1441 N GLU A 579 -5.613 -8.637 8.047 1.00 0.00 N ATOM 1442 CA GLU A 579 -6.452 -7.469 7.804 1.00 0.00 C ATOM 1443 C GLU A 579 -5.850 -6.596 6.708 1.00 0.00 C ATOM 1444 O GLU A 579 -6.559 -5.846 6.036 1.00 0.00 O ATOM 1445 CB GLU A 579 -6.597 -6.653 9.089 1.00 0.00 C ATOM 1446 CG GLU A 579 -7.254 -7.515 10.170 1.00 0.00 C ATOM 1447 CD GLU A 579 -7.516 -6.677 11.416 1.00 0.00 C ATOM 1448 OE1 GLU A 579 -7.209 -5.496 11.389 1.00 0.00 O ATOM 1449 OE2 GLU A 579 -8.019 -7.229 12.382 1.00 0.00 O ATOM 0 H GLU A 579 -5.454 -8.849 9.032 1.00 0.00 H new ATOM 0 HA GLU A 579 -7.435 -7.812 7.480 1.00 0.00 H new ATOM 0 HB2 GLU A 579 -5.619 -6.310 9.427 1.00 0.00 H new ATOM 0 HB3 GLU A 579 -7.199 -5.764 8.902 1.00 0.00 H new ATOM 0 HG2 GLU A 579 -8.190 -7.930 9.797 1.00 0.00 H new ATOM 0 HG3 GLU A 579 -6.608 -8.358 10.417 1.00 0.00 H new ATOM 1456 N GLN A 580 -4.537 -6.699 6.532 1.00 0.00 N ATOM 1457 CA GLN A 580 -3.850 -5.914 5.512 1.00 0.00 C ATOM 1458 C GLN A 580 -4.655 -5.904 4.218 1.00 0.00 C ATOM 1459 O GLN A 580 -4.718 -4.891 3.522 1.00 0.00 O ATOM 1460 CB GLN A 580 -2.461 -6.499 5.249 1.00 0.00 C ATOM 1461 CG GLN A 580 -1.616 -6.403 6.520 1.00 0.00 C ATOM 1462 CD GLN A 580 -0.142 -6.603 6.184 1.00 0.00 C ATOM 1463 OE1 GLN A 580 0.186 -7.166 5.140 1.00 0.00 O ATOM 1464 NE2 GLN A 580 0.771 -6.170 7.010 1.00 0.00 N ATOM 0 H GLN A 580 -3.931 -7.313 7.077 1.00 0.00 H new ATOM 0 HA GLN A 580 -3.748 -4.890 5.873 1.00 0.00 H new ATOM 0 HB2 GLN A 580 -2.547 -7.539 4.935 1.00 0.00 H new ATOM 0 HB3 GLN A 580 -1.976 -5.959 4.436 1.00 0.00 H new ATOM 0 HG2 GLN A 580 -1.761 -5.431 6.990 1.00 0.00 H new ATOM 0 HG3 GLN A 580 -1.939 -7.156 7.239 1.00 0.00 H new ATOM 0 HE21 GLN A 580 0.497 -5.704 7.875 1.00 0.00 H new ATOM 0 HE22 GLN A 580 1.759 -6.298 6.791 1.00 0.00 H new ATOM 1473 N VAL A 581 -5.273 -7.038 3.904 1.00 0.00 N ATOM 1474 CA VAL A 581 -6.076 -7.148 2.692 1.00 0.00 C ATOM 1475 C VAL A 581 -7.199 -6.118 2.701 1.00 0.00 C ATOM 1476 O VAL A 581 -7.552 -5.560 1.662 1.00 0.00 O ATOM 1477 CB VAL A 581 -6.671 -8.553 2.585 1.00 0.00 C ATOM 1478 CG1 VAL A 581 -7.565 -8.637 1.346 1.00 0.00 C ATOM 1479 CG2 VAL A 581 -5.540 -9.577 2.465 1.00 0.00 C ATOM 0 H VAL A 581 -5.234 -7.888 4.467 1.00 0.00 H new ATOM 0 HA VAL A 581 -5.432 -6.961 1.833 1.00 0.00 H new ATOM 0 HB VAL A 581 -7.263 -8.765 3.475 1.00 0.00 H new ATOM 0 HG11 VAL A 581 -7.989 -9.638 1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 581 -8.371 -7.907 1.428 1.00 0.00 H new ATOM 0 HG13 VAL A 581 -6.973 -8.425 0.455 1.00 0.00 H new ATOM 0 HG21 VAL A 581 -5.963 -10.579 2.389 1.00 0.00 H new ATOM 0 HG22 VAL A 581 -4.949 -9.364 1.574 1.00 0.00 H new ATOM 0 HG23 VAL A 581 -4.901 -9.519 3.346 1.00 0.00 H new ATOM 1489 N ASP A 582 -7.756 -5.867 3.882 1.00 0.00 N ATOM 1490 CA ASP A 582 -8.838 -4.899 4.014 1.00 0.00 C ATOM 1491 C ASP A 582 -8.341 -3.497 3.674 1.00 0.00 C ATOM 1492 O ASP A 582 -9.004 -2.751 2.953 1.00 0.00 O ATOM 1493 CB ASP A 582 -9.386 -4.920 5.445 1.00 0.00 C ATOM 1494 CG ASP A 582 -8.628 -3.922 6.314 1.00 0.00 C ATOM 1495 OD1 ASP A 582 -8.793 -2.732 6.101 1.00 0.00 O ATOM 1496 OD2 ASP A 582 -7.892 -4.363 7.182 1.00 0.00 O ATOM 0 H ASP A 582 -7.478 -6.317 4.754 1.00 0.00 H new ATOM 0 HA ASP A 582 -9.633 -5.169 3.319 1.00 0.00 H new ATOM 0 HB2 ASP A 582 -10.448 -4.675 5.439 1.00 0.00 H new ATOM 0 HB3 ASP A 582 -9.292 -5.922 5.863 1.00 0.00 H new ATOM 1501 N ASP A 583 -7.171 -3.148 4.199 1.00 0.00 N ATOM 1502 CA ASP A 583 -6.594 -1.833 3.943 1.00 0.00 C ATOM 1503 C ASP A 583 -6.237 -1.681 2.468 1.00 0.00 C ATOM 1504 O ASP A 583 -6.238 -0.573 1.930 1.00 0.00 O ATOM 1505 CB ASP A 583 -5.337 -1.639 4.796 1.00 0.00 C ATOM 1506 CG ASP A 583 -5.707 -1.638 6.275 1.00 0.00 C ATOM 1507 OD1 ASP A 583 -5.900 -2.713 6.819 1.00 0.00 O ATOM 1508 OD2 ASP A 583 -5.789 -0.562 6.845 1.00 0.00 O ATOM 0 H ASP A 583 -6.608 -3.751 4.799 1.00 0.00 H new ATOM 0 HA ASP A 583 -7.333 -1.076 4.206 1.00 0.00 H new ATOM 0 HB2 ASP A 583 -4.622 -2.436 4.592 1.00 0.00 H new ATOM 0 HB3 ASP A 583 -4.851 -0.700 4.533 1.00 0.00 H new ATOM 1513 N VAL A 584 -5.935 -2.800 1.819 1.00 0.00 N ATOM 1514 CA VAL A 584 -5.579 -2.780 0.405 1.00 0.00 C ATOM 1515 C VAL A 584 -6.789 -2.409 -0.446 1.00 0.00 C ATOM 1516 O VAL A 584 -6.886 -1.288 -0.947 1.00 0.00 O ATOM 1517 CB VAL A 584 -5.054 -4.152 -0.020 1.00 0.00 C ATOM 1518 CG1 VAL A 584 -4.951 -4.213 -1.545 1.00 0.00 C ATOM 1519 CG2 VAL A 584 -3.669 -4.378 0.593 1.00 0.00 C ATOM 0 H VAL A 584 -5.929 -3.726 2.246 1.00 0.00 H new ATOM 0 HA VAL A 584 -4.801 -2.032 0.255 1.00 0.00 H new ATOM 0 HB VAL A 584 -5.739 -4.925 0.327 1.00 0.00 H new ATOM 0 HG11 VAL A 584 -4.577 -5.192 -1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 584 -5.936 -4.051 -1.983 1.00 0.00 H new ATOM 0 HG13 VAL A 584 -4.267 -3.440 -1.895 1.00 0.00 H new ATOM 0 HG21 VAL A 584 -3.293 -5.356 0.291 1.00 0.00 H new ATOM 0 HG22 VAL A 584 -2.986 -3.603 0.245 1.00 0.00 H new ATOM 0 HG23 VAL A 584 -3.741 -4.336 1.680 1.00 0.00 H new ATOM 1529 N LEU A 585 -7.708 -3.356 -0.607 1.00 0.00 N ATOM 1530 CA LEU A 585 -8.907 -3.116 -1.401 1.00 0.00 C ATOM 1531 C LEU A 585 -9.442 -1.710 -1.150 1.00 0.00 C ATOM 1532 O LEU A 585 -10.071 -1.109 -2.022 1.00 0.00 O ATOM 1533 CB LEU A 585 -9.985 -4.143 -1.047 1.00 0.00 C ATOM 1534 CG LEU A 585 -9.411 -5.556 -1.180 1.00 0.00 C ATOM 1535 CD1 LEU A 585 -10.502 -6.582 -0.865 1.00 0.00 C ATOM 1536 CD2 LEU A 585 -8.908 -5.771 -2.610 1.00 0.00 C ATOM 0 H LEU A 585 -7.646 -4.290 -0.201 1.00 0.00 H new ATOM 0 HA LEU A 585 -8.646 -3.213 -2.455 1.00 0.00 H new ATOM 0 HB2 LEU A 585 -10.339 -3.978 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU A 585 -10.845 -4.025 -1.707 1.00 0.00 H new ATOM 0 HG LEU A 585 -8.584 -5.678 -0.481 1.00 0.00 H new ATOM 0 HD11 LEU A 585 -10.094 -7.588 -0.960 1.00 0.00 H new ATOM 0 HD12 LEU A 585 -10.861 -6.430 0.153 1.00 0.00 H new ATOM 0 HD13 LEU A 585 -11.330 -6.459 -1.564 1.00 0.00 H new ATOM 0 HD21 LEU A 585 -8.499 -6.777 -2.705 1.00 0.00 H new ATOM 0 HD22 LEU A 585 -9.735 -5.648 -3.309 1.00 0.00 H new ATOM 0 HD23 LEU A 585 -8.131 -5.041 -2.836 1.00 0.00 H new ATOM 1548 N GLU A 586 -9.186 -1.190 0.046 1.00 0.00 N ATOM 1549 CA GLU A 586 -9.645 0.148 0.402 1.00 0.00 C ATOM 1550 C GLU A 586 -8.925 1.201 -0.434 1.00 0.00 C ATOM 1551 O GLU A 586 -9.540 2.156 -0.911 1.00 0.00 O ATOM 1552 CB GLU A 586 -9.388 0.408 1.887 1.00 0.00 C ATOM 1553 CG GLU A 586 -10.105 1.692 2.313 1.00 0.00 C ATOM 1554 CD GLU A 586 -9.624 2.123 3.695 1.00 0.00 C ATOM 1555 OE1 GLU A 586 -8.428 2.065 3.929 1.00 0.00 O ATOM 1556 OE2 GLU A 586 -10.460 2.503 4.498 1.00 0.00 O ATOM 0 H GLU A 586 -8.667 -1.671 0.781 1.00 0.00 H new ATOM 0 HA GLU A 586 -10.715 0.212 0.202 1.00 0.00 H new ATOM 0 HB2 GLU A 586 -9.744 -0.434 2.481 1.00 0.00 H new ATOM 0 HB3 GLU A 586 -8.317 0.499 2.071 1.00 0.00 H new ATOM 0 HG2 GLU A 586 -9.913 2.483 1.589 1.00 0.00 H new ATOM 0 HG3 GLU A 586 -11.183 1.529 2.328 1.00 0.00 H new ATOM 1563 N THR A 587 -7.621 1.021 -0.607 1.00 0.00 N ATOM 1564 CA THR A 587 -6.825 1.963 -1.386 1.00 0.00 C ATOM 1565 C THR A 587 -7.046 1.747 -2.880 1.00 0.00 C ATOM 1566 O THR A 587 -7.411 2.674 -3.604 1.00 0.00 O ATOM 1567 CB THR A 587 -5.339 1.791 -1.055 1.00 0.00 C ATOM 1568 OG1 THR A 587 -5.132 0.509 -0.480 1.00 0.00 O ATOM 1569 CG2 THR A 587 -4.905 2.873 -0.064 1.00 0.00 C ATOM 0 H THR A 587 -7.095 0.237 -0.221 1.00 0.00 H new ATOM 0 HA THR A 587 -7.139 2.974 -1.128 1.00 0.00 H new ATOM 0 HB THR A 587 -4.749 1.882 -1.967 1.00 0.00 H new ATOM 0 HG1 THR A 587 -5.625 -0.164 -0.995 1.00 0.00 H new ATOM 0 HG21 THR A 587 -3.848 2.749 0.170 1.00 0.00 H new ATOM 0 HG22 THR A 587 -5.066 3.856 -0.506 1.00 0.00 H new ATOM 0 HG23 THR A 587 -5.492 2.785 0.850 1.00 0.00 H new ATOM 1577 N ILE A 588 -6.821 0.519 -3.336 1.00 0.00 N ATOM 1578 CA ILE A 588 -6.999 0.196 -4.747 1.00 0.00 C ATOM 1579 C ILE A 588 -8.259 0.859 -5.296 1.00 0.00 C ATOM 1580 O ILE A 588 -8.184 1.838 -6.037 1.00 0.00 O ATOM 1581 CB ILE A 588 -7.096 -1.320 -4.927 1.00 0.00 C ATOM 1582 CG1 ILE A 588 -5.786 -1.971 -4.478 1.00 0.00 C ATOM 1583 CG2 ILE A 588 -7.347 -1.643 -6.403 1.00 0.00 C ATOM 1584 CD1 ILE A 588 -5.911 -3.492 -4.576 1.00 0.00 C ATOM 0 H ILE A 588 -6.518 -0.263 -2.755 1.00 0.00 H new ATOM 0 HA ILE A 588 -6.137 0.573 -5.298 1.00 0.00 H new ATOM 0 HB ILE A 588 -7.919 -1.706 -4.325 1.00 0.00 H new ATOM 0 HG12 ILE A 588 -4.962 -1.622 -5.101 1.00 0.00 H new ATOM 0 HG13 ILE A 588 -5.556 -1.680 -3.453 1.00 0.00 H new ATOM 0 HG21 ILE A 588 -7.416 -2.723 -6.532 1.00 0.00 H new ATOM 0 HG22 ILE A 588 -8.280 -1.179 -6.724 1.00 0.00 H new ATOM 0 HG23 ILE A 588 -6.524 -1.258 -7.005 1.00 0.00 H new ATOM 0 HD11 ILE A 588 -4.978 -3.955 -4.256 1.00 0.00 H new ATOM 0 HD12 ILE A 588 -6.724 -3.832 -3.934 1.00 0.00 H new ATOM 0 HD13 ILE A 588 -6.121 -3.774 -5.608 1.00 0.00 H new ATOM 1596 N SER A 589 -9.415 0.317 -4.927 1.00 0.00 N ATOM 1597 CA SER A 589 -10.686 0.863 -5.389 1.00 0.00 C ATOM 1598 C SER A 589 -10.712 2.379 -5.225 1.00 0.00 C ATOM 1599 O SER A 589 -10.942 3.113 -6.187 1.00 0.00 O ATOM 1600 CB SER A 589 -11.837 0.244 -4.596 1.00 0.00 C ATOM 1601 OG SER A 589 -13.072 0.742 -5.095 1.00 0.00 O ATOM 0 H SER A 589 -9.498 -0.494 -4.314 1.00 0.00 H new ATOM 0 HA SER A 589 -10.800 0.622 -6.446 1.00 0.00 H new ATOM 0 HB2 SER A 589 -11.809 -0.842 -4.680 1.00 0.00 H new ATOM 0 HB3 SER A 589 -11.736 0.484 -3.538 1.00 0.00 H new ATOM 0 HG SER A 589 -12.920 1.199 -5.949 1.00 0.00 H new ATOM 1607 N ALA A 590 -10.474 2.842 -4.003 1.00 0.00 N ATOM 1608 CA ALA A 590 -10.474 4.275 -3.724 1.00 0.00 C ATOM 1609 C ALA A 590 -9.774 5.041 -4.842 1.00 0.00 C ATOM 1610 O ALA A 590 -10.399 5.830 -5.550 1.00 0.00 O ATOM 1611 CB ALA A 590 -9.765 4.547 -2.396 1.00 0.00 C ATOM 0 H ALA A 590 -10.280 2.252 -3.194 1.00 0.00 H new ATOM 0 HA ALA A 590 -11.508 4.613 -3.661 1.00 0.00 H new ATOM 0 HB1 ALA A 590 -9.769 5.618 -2.194 1.00 0.00 H new ATOM 0 HB2 ALA A 590 -10.284 4.025 -1.593 1.00 0.00 H new ATOM 0 HB3 ALA A 590 -8.736 4.192 -2.454 1.00 0.00 H new ATOM 1617 N ILE A 591 -8.476 4.803 -4.994 1.00 0.00 N ATOM 1618 CA ILE A 591 -7.701 5.478 -6.029 1.00 0.00 C ATOM 1619 C ILE A 591 -8.337 5.265 -7.399 1.00 0.00 C ATOM 1620 O ILE A 591 -7.882 4.433 -8.183 1.00 0.00 O ATOM 1621 CB ILE A 591 -6.268 4.945 -6.040 1.00 0.00 C ATOM 1622 CG1 ILE A 591 -5.653 5.106 -4.648 1.00 0.00 C ATOM 1623 CG2 ILE A 591 -5.438 5.733 -7.056 1.00 0.00 C ATOM 1624 CD1 ILE A 591 -4.357 4.298 -4.565 1.00 0.00 C ATOM 0 H ILE A 591 -7.941 4.153 -4.418 1.00 0.00 H new ATOM 0 HA ILE A 591 -7.689 6.546 -5.809 1.00 0.00 H new ATOM 0 HB ILE A 591 -6.276 3.890 -6.315 1.00 0.00 H new ATOM 0 HG12 ILE A 591 -5.451 6.158 -4.448 1.00 0.00 H new ATOM 0 HG13 ILE A 591 -6.355 4.766 -3.887 1.00 0.00 H new ATOM 0 HG21 ILE A 591 -4.416 5.353 -7.064 1.00 0.00 H new ATOM 0 HG22 ILE A 591 -5.875 5.620 -8.048 1.00 0.00 H new ATOM 0 HG23 ILE A 591 -5.431 6.788 -6.780 1.00 0.00 H new ATOM 0 HD11 ILE A 591 -3.919 4.413 -3.573 1.00 0.00 H new ATOM 0 HD12 ILE A 591 -4.572 3.245 -4.747 1.00 0.00 H new ATOM 0 HD13 ILE A 591 -3.654 4.659 -5.316 1.00 0.00 H new ATOM 1636 N GLU A 592 -9.391 6.025 -7.681 1.00 0.00 N ATOM 1637 CA GLU A 592 -10.082 5.912 -8.960 1.00 0.00 C ATOM 1638 C GLU A 592 -10.248 4.448 -9.353 1.00 0.00 C ATOM 1639 O GLU A 592 -10.035 3.548 -8.540 1.00 0.00 O ATOM 1640 CB GLU A 592 -9.295 6.649 -10.045 1.00 0.00 C ATOM 1641 CG GLU A 592 -9.490 8.159 -9.883 1.00 0.00 C ATOM 1642 CD GLU A 592 -9.210 8.570 -8.442 1.00 0.00 C ATOM 1643 OE1 GLU A 592 -8.049 8.755 -8.115 1.00 0.00 O ATOM 1644 OE2 GLU A 592 -10.160 8.695 -7.687 1.00 0.00 O ATOM 0 H GLU A 592 -9.783 6.721 -7.046 1.00 0.00 H new ATOM 0 HA GLU A 592 -11.070 6.362 -8.859 1.00 0.00 H new ATOM 0 HB2 GLU A 592 -8.236 6.399 -9.974 1.00 0.00 H new ATOM 0 HB3 GLU A 592 -9.632 6.332 -11.032 1.00 0.00 H new ATOM 0 HG2 GLU A 592 -8.823 8.695 -10.559 1.00 0.00 H new ATOM 0 HG3 GLU A 592 -10.509 8.434 -10.157 1.00 0.00 H new ATOM 1651 N HIS A 593 -10.629 4.216 -10.606 1.00 0.00 N ATOM 1652 CA HIS A 593 -10.821 2.855 -11.096 1.00 0.00 C ATOM 1653 C HIS A 593 -10.452 2.762 -12.574 1.00 0.00 C ATOM 1654 O HIS A 593 -11.325 2.684 -13.439 1.00 0.00 O ATOM 1655 CB HIS A 593 -12.278 2.431 -10.904 1.00 0.00 C ATOM 1656 CG HIS A 593 -12.583 2.334 -9.433 1.00 0.00 C ATOM 1657 ND1 HIS A 593 -13.339 3.288 -8.771 1.00 0.00 N ATOM 1658 CD2 HIS A 593 -12.239 1.403 -8.485 1.00 0.00 C ATOM 1659 CE1 HIS A 593 -13.425 2.913 -7.482 1.00 0.00 C ATOM 1660 NE2 HIS A 593 -12.771 1.771 -7.254 1.00 0.00 N ATOM 0 H HIS A 593 -10.810 4.946 -11.295 1.00 0.00 H new ATOM 0 HA HIS A 593 -10.172 2.189 -10.528 1.00 0.00 H new ATOM 0 HB2 HIS A 593 -12.943 3.153 -11.377 1.00 0.00 H new ATOM 0 HB3 HIS A 593 -12.455 1.470 -11.387 1.00 0.00 H new ATOM 0 HD1 HIS A 593 -13.754 4.122 -9.185 1.00 0.00 H new ATOM 0 HD2 HIS A 593 -11.646 0.519 -8.667 1.00 0.00 H new ATOM 0 HE1 HIS A 593 -13.958 3.468 -6.724 1.00 0.00 H new ATOM 1668 N PRO A 594 -9.182 2.770 -12.870 1.00 0.00 N ATOM 1669 CA PRO A 594 -8.675 2.685 -14.267 1.00 0.00 C ATOM 1670 C PRO A 594 -8.786 1.270 -14.830 1.00 0.00 C ATOM 1671 O PRO A 594 -9.554 1.019 -15.758 1.00 0.00 O ATOM 1672 CB PRO A 594 -7.203 3.122 -14.170 1.00 0.00 C ATOM 1673 CG PRO A 594 -6.936 3.440 -12.727 1.00 0.00 C ATOM 1674 CD PRO A 594 -8.085 2.860 -11.906 1.00 0.00 C ATOM 0 HA PRO A 594 -9.256 3.311 -14.944 1.00 0.00 H new ATOM 0 HB2 PRO A 594 -6.541 2.330 -14.520 1.00 0.00 H new ATOM 0 HB3 PRO A 594 -7.017 3.993 -14.798 1.00 0.00 H new ATOM 0 HG2 PRO A 594 -5.985 3.012 -12.410 1.00 0.00 H new ATOM 0 HG3 PRO A 594 -6.866 4.518 -12.579 1.00 0.00 H new ATOM 0 HD2 PRO A 594 -7.831 1.883 -11.494 1.00 0.00 H new ATOM 0 HD3 PRO A 594 -8.342 3.503 -11.065 1.00 0.00 H new ATOM 1682 N MET A 595 -8.014 0.350 -14.262 1.00 0.00 N ATOM 1683 CA MET A 595 -8.033 -1.036 -14.714 1.00 0.00 C ATOM 1684 C MET A 595 -7.586 -1.972 -13.596 1.00 0.00 C ATOM 1685 O MET A 595 -6.633 -2.734 -13.756 1.00 0.00 O ATOM 1686 CB MET A 595 -7.111 -1.203 -15.923 1.00 0.00 C ATOM 1687 CG MET A 595 -7.415 -2.532 -16.619 1.00 0.00 C ATOM 1688 SD MET A 595 -6.422 -2.665 -18.126 1.00 0.00 S ATOM 1689 CE MET A 595 -7.523 -3.785 -19.025 1.00 0.00 C ATOM 0 H MET A 595 -7.371 0.537 -13.493 1.00 0.00 H new ATOM 0 HA MET A 595 -9.054 -1.292 -14.998 1.00 0.00 H new ATOM 0 HB2 MET A 595 -7.253 -0.376 -16.618 1.00 0.00 H new ATOM 0 HB3 MET A 595 -6.069 -1.177 -15.605 1.00 0.00 H new ATOM 0 HG2 MET A 595 -7.194 -3.364 -15.950 1.00 0.00 H new ATOM 0 HG3 MET A 595 -8.476 -2.593 -16.863 1.00 0.00 H new ATOM 0 HE1 MET A 595 -7.097 -4.006 -20.004 1.00 0.00 H new ATOM 0 HE2 MET A 595 -7.639 -4.711 -18.462 1.00 0.00 H new ATOM 0 HE3 MET A 595 -8.498 -3.313 -19.152 1.00 0.00 H new ATOM 1699 N THR A 596 -8.279 -1.907 -12.464 1.00 0.00 N ATOM 1700 CA THR A 596 -7.945 -2.753 -11.323 1.00 0.00 C ATOM 1701 C THR A 596 -9.204 -3.391 -10.744 1.00 0.00 C ATOM 1702 O THR A 596 -9.147 -4.090 -9.731 1.00 0.00 O ATOM 1703 CB THR A 596 -7.247 -1.923 -10.244 1.00 0.00 C ATOM 1704 OG1 THR A 596 -6.856 -2.774 -9.175 1.00 0.00 O ATOM 1705 CG2 THR A 596 -8.204 -0.851 -9.722 1.00 0.00 C ATOM 0 H THR A 596 -9.070 -1.282 -12.312 1.00 0.00 H new ATOM 0 HA THR A 596 -7.275 -3.543 -11.663 1.00 0.00 H new ATOM 0 HB THR A 596 -6.365 -1.442 -10.668 1.00 0.00 H new ATOM 0 HG1 THR A 596 -7.530 -3.475 -9.052 1.00 0.00 H new ATOM 0 HG21 THR A 596 -7.705 -0.261 -8.953 1.00 0.00 H new ATOM 0 HG22 THR A 596 -8.503 -0.199 -10.543 1.00 0.00 H new ATOM 0 HG23 THR A 596 -9.087 -1.328 -9.297 1.00 0.00 H new ATOM 1713 N SER A 597 -10.337 -3.145 -11.392 1.00 0.00 N ATOM 1714 CA SER A 597 -11.605 -3.701 -10.931 1.00 0.00 C ATOM 1715 C SER A 597 -11.552 -5.225 -10.930 1.00 0.00 C ATOM 1716 O SER A 597 -11.859 -5.866 -9.925 1.00 0.00 O ATOM 1717 CB SER A 597 -12.742 -3.227 -11.836 1.00 0.00 C ATOM 1718 OG SER A 597 -12.434 -3.552 -13.185 1.00 0.00 O ATOM 0 H SER A 597 -10.405 -2.569 -12.231 1.00 0.00 H new ATOM 0 HA SER A 597 -11.784 -3.355 -9.913 1.00 0.00 H new ATOM 0 HB2 SER A 597 -13.679 -3.700 -11.541 1.00 0.00 H new ATOM 0 HB3 SER A 597 -12.881 -2.151 -11.732 1.00 0.00 H new ATOM 0 HG SER A 597 -13.162 -3.251 -13.768 1.00 0.00 H new ATOM 1724 N ALA A 598 -11.163 -5.799 -12.064 1.00 0.00 N ATOM 1725 CA ALA A 598 -11.074 -7.250 -12.183 1.00 0.00 C ATOM 1726 C ALA A 598 -10.294 -7.836 -11.011 1.00 0.00 C ATOM 1727 O ALA A 598 -10.722 -8.812 -10.393 1.00 0.00 O ATOM 1728 CB ALA A 598 -10.386 -7.626 -13.497 1.00 0.00 C ATOM 0 H ALA A 598 -10.906 -5.286 -12.908 1.00 0.00 H new ATOM 0 HA ALA A 598 -12.084 -7.659 -12.173 1.00 0.00 H new ATOM 0 HB1 ALA A 598 -10.324 -8.711 -13.578 1.00 0.00 H new ATOM 0 HB2 ALA A 598 -10.962 -7.232 -14.335 1.00 0.00 H new ATOM 0 HB3 ALA A 598 -9.382 -7.203 -13.516 1.00 0.00 H new ATOM 1734 N ILE A 599 -9.147 -7.236 -10.711 1.00 0.00 N ATOM 1735 CA ILE A 599 -8.314 -7.708 -9.612 1.00 0.00 C ATOM 1736 C ILE A 599 -8.982 -7.417 -8.271 1.00 0.00 C ATOM 1737 O ILE A 599 -8.788 -8.147 -7.298 1.00 0.00 O ATOM 1738 CB ILE A 599 -6.947 -7.024 -9.660 1.00 0.00 C ATOM 1739 CG1 ILE A 599 -6.396 -7.090 -11.087 1.00 0.00 C ATOM 1740 CG2 ILE A 599 -5.984 -7.738 -8.711 1.00 0.00 C ATOM 1741 CD1 ILE A 599 -4.981 -6.508 -11.116 1.00 0.00 C ATOM 0 H ILE A 599 -8.775 -6.428 -11.210 1.00 0.00 H new ATOM 0 HA ILE A 599 -8.185 -8.785 -9.716 1.00 0.00 H new ATOM 0 HB ILE A 599 -7.051 -5.983 -9.355 1.00 0.00 H new ATOM 0 HG12 ILE A 599 -6.383 -8.123 -11.436 1.00 0.00 H new ATOM 0 HG13 ILE A 599 -7.044 -6.533 -11.764 1.00 0.00 H new ATOM 0 HG21 ILE A 599 -5.010 -7.250 -8.746 1.00 0.00 H new ATOM 0 HG22 ILE A 599 -6.376 -7.694 -7.695 1.00 0.00 H new ATOM 0 HG23 ILE A 599 -5.879 -8.779 -9.015 1.00 0.00 H new ATOM 0 HD11 ILE A 599 -4.589 -6.555 -12.132 1.00 0.00 H new ATOM 0 HD12 ILE A 599 -5.008 -5.470 -10.785 1.00 0.00 H new ATOM 0 HD13 ILE A 599 -4.337 -7.084 -10.452 1.00 0.00 H new ATOM 1753 N GLU A 600 -9.769 -6.348 -8.228 1.00 0.00 N ATOM 1754 CA GLU A 600 -10.462 -5.970 -7.001 1.00 0.00 C ATOM 1755 C GLU A 600 -11.464 -7.047 -6.598 1.00 0.00 C ATOM 1756 O GLU A 600 -11.529 -7.444 -5.435 1.00 0.00 O ATOM 1757 CB GLU A 600 -11.192 -4.640 -7.202 1.00 0.00 C ATOM 1758 CG GLU A 600 -11.633 -4.090 -5.844 1.00 0.00 C ATOM 1759 CD GLU A 600 -12.658 -2.977 -6.040 1.00 0.00 C ATOM 1760 OE1 GLU A 600 -12.360 -2.048 -6.774 1.00 0.00 O ATOM 1761 OE2 GLU A 600 -13.723 -3.070 -5.455 1.00 0.00 O ATOM 0 H GLU A 600 -9.943 -5.732 -9.022 1.00 0.00 H new ATOM 0 HA GLU A 600 -9.723 -5.862 -6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 600 -10.537 -3.925 -7.701 1.00 0.00 H new ATOM 0 HB3 GLU A 600 -12.059 -4.783 -7.847 1.00 0.00 H new ATOM 0 HG2 GLU A 600 -12.063 -4.890 -5.241 1.00 0.00 H new ATOM 0 HG3 GLU A 600 -10.770 -3.709 -5.299 1.00 0.00 H new ATOM 1768 N VAL A 601 -12.244 -7.515 -7.567 1.00 0.00 N ATOM 1769 CA VAL A 601 -13.240 -8.546 -7.302 1.00 0.00 C ATOM 1770 C VAL A 601 -12.564 -9.886 -7.030 1.00 0.00 C ATOM 1771 O VAL A 601 -13.062 -10.696 -6.248 1.00 0.00 O ATOM 1772 CB VAL A 601 -14.182 -8.682 -8.500 1.00 0.00 C ATOM 1773 CG1 VAL A 601 -15.288 -9.686 -8.168 1.00 0.00 C ATOM 1774 CG2 VAL A 601 -14.808 -7.321 -8.811 1.00 0.00 C ATOM 0 H VAL A 601 -12.206 -7.199 -8.536 1.00 0.00 H new ATOM 0 HA VAL A 601 -13.812 -8.255 -6.421 1.00 0.00 H new ATOM 0 HB VAL A 601 -13.621 -9.032 -9.366 1.00 0.00 H new ATOM 0 HG11 VAL A 601 -15.959 -9.783 -9.021 1.00 0.00 H new ATOM 0 HG12 VAL A 601 -14.844 -10.656 -7.944 1.00 0.00 H new ATOM 0 HG13 VAL A 601 -15.850 -9.335 -7.302 1.00 0.00 H new ATOM 0 HG21 VAL A 601 -15.480 -7.416 -9.664 1.00 0.00 H new ATOM 0 HG22 VAL A 601 -15.370 -6.972 -7.944 1.00 0.00 H new ATOM 0 HG23 VAL A 601 -14.021 -6.604 -9.046 1.00 0.00 H new ATOM 1784 N LEU A 602 -11.427 -10.113 -7.680 1.00 0.00 N ATOM 1785 CA LEU A 602 -10.691 -11.359 -7.500 1.00 0.00 C ATOM 1786 C LEU A 602 -10.256 -11.517 -6.046 1.00 0.00 C ATOM 1787 O LEU A 602 -10.705 -12.426 -5.348 1.00 0.00 O ATOM 1788 CB LEU A 602 -9.460 -11.374 -8.409 1.00 0.00 C ATOM 1789 CG LEU A 602 -9.083 -12.819 -8.739 1.00 0.00 C ATOM 1790 CD1 LEU A 602 -7.855 -12.832 -9.651 1.00 0.00 C ATOM 1791 CD2 LEU A 602 -8.763 -13.572 -7.446 1.00 0.00 C ATOM 0 H LEU A 602 -10.998 -9.456 -8.331 1.00 0.00 H new ATOM 0 HA LEU A 602 -11.346 -12.189 -7.764 1.00 0.00 H new ATOM 0 HB2 LEU A 602 -9.666 -10.823 -9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 602 -8.626 -10.873 -7.917 1.00 0.00 H new ATOM 0 HG LEU A 602 -9.918 -13.303 -9.246 1.00 0.00 H new ATOM 0 HD11 LEU A 602 -7.587 -13.862 -9.886 1.00 0.00 H new ATOM 0 HD12 LEU A 602 -8.081 -12.297 -10.573 1.00 0.00 H new ATOM 0 HD13 LEU A 602 -7.021 -12.346 -9.145 1.00 0.00 H new ATOM 0 HD21 LEU A 602 -8.494 -14.602 -7.682 1.00 0.00 H new ATOM 0 HD22 LEU A 602 -7.929 -13.086 -6.939 1.00 0.00 H new ATOM 0 HD23 LEU A 602 -9.637 -13.565 -6.795 1.00 0.00 H new ATOM 1803 N VAL A 603 -9.377 -10.627 -5.596 1.00 0.00 N ATOM 1804 CA VAL A 603 -8.888 -10.678 -4.223 1.00 0.00 C ATOM 1805 C VAL A 603 -10.024 -10.421 -3.239 1.00 0.00 C ATOM 1806 O VAL A 603 -9.975 -10.859 -2.090 1.00 0.00 O ATOM 1807 CB VAL A 603 -7.789 -9.633 -4.021 1.00 0.00 C ATOM 1808 CG1 VAL A 603 -7.228 -9.748 -2.603 1.00 0.00 C ATOM 1809 CG2 VAL A 603 -6.667 -9.873 -5.033 1.00 0.00 C ATOM 0 H VAL A 603 -8.991 -9.868 -6.157 1.00 0.00 H new ATOM 0 HA VAL A 603 -8.482 -11.673 -4.039 1.00 0.00 H new ATOM 0 HB VAL A 603 -8.205 -8.636 -4.167 1.00 0.00 H new ATOM 0 HG11 VAL A 603 -6.445 -9.003 -2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 603 -8.027 -9.578 -1.881 1.00 0.00 H new ATOM 0 HG13 VAL A 603 -6.812 -10.745 -2.456 1.00 0.00 H new ATOM 0 HG21 VAL A 603 -5.883 -9.129 -4.890 1.00 0.00 H new ATOM 0 HG22 VAL A 603 -6.252 -10.870 -4.886 1.00 0.00 H new ATOM 0 HG23 VAL A 603 -7.065 -9.791 -6.044 1.00 0.00 H new ATOM 1819 N GLY A 604 -11.048 -9.708 -3.698 1.00 0.00 N ATOM 1820 CA GLY A 604 -12.193 -9.399 -2.849 1.00 0.00 C ATOM 1821 C GLY A 604 -12.875 -10.674 -2.368 1.00 0.00 C ATOM 1822 O GLY A 604 -12.988 -10.914 -1.166 1.00 0.00 O ATOM 0 H GLY A 604 -11.109 -9.336 -4.646 1.00 0.00 H new ATOM 0 HA2 GLY A 604 -11.866 -8.811 -1.991 1.00 0.00 H new ATOM 0 HA3 GLY A 604 -12.906 -8.787 -3.402 1.00 0.00 H new ATOM 1826 N SER A 605 -13.328 -11.491 -3.315 1.00 0.00 N ATOM 1827 CA SER A 605 -13.997 -12.740 -2.976 1.00 0.00 C ATOM 1828 C SER A 605 -13.058 -13.659 -2.200 1.00 0.00 C ATOM 1829 O SER A 605 -13.256 -13.901 -1.010 1.00 0.00 O ATOM 1830 CB SER A 605 -14.465 -13.444 -4.250 1.00 0.00 C ATOM 1831 OG SER A 605 -15.356 -14.497 -3.905 1.00 0.00 O ATOM 0 H SER A 605 -13.244 -11.311 -4.316 1.00 0.00 H new ATOM 0 HA SER A 605 -14.859 -12.510 -2.350 1.00 0.00 H new ATOM 0 HB2 SER A 605 -14.962 -12.733 -4.910 1.00 0.00 H new ATOM 0 HB3 SER A 605 -13.609 -13.841 -4.795 1.00 0.00 H new ATOM 0 HG SER A 605 -15.659 -14.949 -4.720 1.00 0.00 H new ATOM 1837 N CYS A 606 -12.038 -14.165 -2.883 1.00 0.00 N ATOM 1838 CA CYS A 606 -11.074 -15.057 -2.248 1.00 0.00 C ATOM 1839 C CYS A 606 -10.082 -14.260 -1.406 1.00 0.00 C ATOM 1840 O CYS A 606 -9.337 -13.429 -1.928 1.00 0.00 O ATOM 1841 CB CYS A 606 -10.318 -15.854 -3.312 1.00 0.00 C ATOM 1842 SG CYS A 606 -9.299 -17.117 -2.510 1.00 0.00 S ATOM 0 H CYS A 606 -11.857 -13.975 -3.869 1.00 0.00 H new ATOM 0 HA CYS A 606 -11.616 -15.744 -1.598 1.00 0.00 H new ATOM 0 HB2 CYS A 606 -11.022 -16.322 -3.999 1.00 0.00 H new ATOM 0 HB3 CYS A 606 -9.691 -15.187 -3.904 1.00 0.00 H new ATOM 0 HG CYS A 606 -8.658 -17.796 -3.414 1.00 0.00 H new ATOM 1848 N ALA A 607 -10.077 -14.519 -0.103 1.00 0.00 N ATOM 1849 CA ALA A 607 -9.172 -13.818 0.801 1.00 0.00 C ATOM 1850 C ALA A 607 -9.022 -14.588 2.111 1.00 0.00 C ATOM 1851 O ALA A 607 -8.285 -15.570 2.184 1.00 0.00 O ATOM 1852 CB ALA A 607 -9.704 -12.414 1.091 1.00 0.00 C ATOM 0 H ALA A 607 -10.684 -15.203 0.348 1.00 0.00 H new ATOM 0 HA ALA A 607 -8.196 -13.743 0.321 1.00 0.00 H new ATOM 0 HB1 ALA A 607 -9.021 -11.899 1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 607 -9.783 -11.855 0.159 1.00 0.00 H new ATOM 0 HB3 ALA A 607 -10.688 -12.486 1.555 1.00 0.00 H new ATOM 1923 N MET B 1 -10.613 24.102 16.466 1.00 0.00 N ATOM 1924 CA MET B 1 -9.639 23.203 17.147 1.00 0.00 C ATOM 1925 C MET B 1 -10.049 21.751 16.924 1.00 0.00 C ATOM 1926 O MET B 1 -10.353 21.030 17.875 1.00 0.00 O ATOM 1927 CB MET B 1 -9.619 23.518 18.644 1.00 0.00 C ATOM 1928 CG MET B 1 -8.435 22.806 19.300 1.00 0.00 C ATOM 1929 SD MET B 1 -8.308 23.318 21.032 1.00 0.00 S ATOM 1930 CE MET B 1 -7.244 24.757 20.766 1.00 0.00 C ATOM 0 H1 MET B 1 -10.493 25.073 16.817 1.00 0.00 H new ATOM 0 H2 MET B 1 -10.445 24.082 15.440 1.00 0.00 H new ATOM 0 H3 MET B 1 -11.581 23.779 16.665 1.00 0.00 H new ATOM 0 HA MET B 1 -8.642 23.360 16.736 1.00 0.00 H new ATOM 0 HB2 MET B 1 -9.541 24.594 18.799 1.00 0.00 H new ATOM 0 HB3 MET B 1 -10.552 23.196 19.107 1.00 0.00 H new ATOM 0 HG2 MET B 1 -8.566 21.726 19.238 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.513 23.046 18.770 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.034 25.236 21.722 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.308 24.438 20.307 1.00 0.00 H new ATOM 0 HE3 MET B 1 -7.748 25.465 20.108 1.00 0.00 H new ATOM 1942 N VAL B 2 -10.055 21.330 15.664 1.00 0.00 N ATOM 1943 CA VAL B 2 -10.429 19.961 15.328 1.00 0.00 C ATOM 1944 C VAL B 2 -9.188 19.080 15.215 1.00 0.00 C ATOM 1945 O VAL B 2 -8.221 19.435 14.544 1.00 0.00 O ATOM 1946 CB VAL B 2 -11.213 19.939 14.010 1.00 0.00 C ATOM 1947 CG1 VAL B 2 -11.483 21.371 13.540 1.00 0.00 C ATOM 1948 CG2 VAL B 2 -10.410 19.199 12.937 1.00 0.00 C ATOM 0 H VAL B 2 -9.807 21.912 14.864 1.00 0.00 H new ATOM 0 HA VAL B 2 -11.061 19.568 16.124 1.00 0.00 H new ATOM 0 HB VAL B 2 -12.160 19.425 14.174 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -12.040 21.348 12.603 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -12.065 21.898 14.296 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -10.536 21.888 13.386 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -10.973 19.188 12.004 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -9.458 19.707 12.780 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -10.226 18.175 13.262 1.00 0.00 H new ATOM 1958 N SER B 3 -9.227 17.931 15.878 1.00 0.00 N ATOM 1959 CA SER B 3 -8.106 16.997 15.850 1.00 0.00 C ATOM 1960 C SER B 3 -8.520 15.692 15.183 1.00 0.00 C ATOM 1961 O SER B 3 -9.296 14.918 15.741 1.00 0.00 O ATOM 1962 CB SER B 3 -7.624 16.715 17.272 1.00 0.00 C ATOM 1963 OG SER B 3 -8.742 16.409 18.095 1.00 0.00 O ATOM 0 H SER B 3 -10.020 17.623 16.441 1.00 0.00 H new ATOM 0 HA SER B 3 -7.295 17.446 15.277 1.00 0.00 H new ATOM 0 HB2 SER B 3 -6.920 15.883 17.271 1.00 0.00 H new ATOM 0 HB3 SER B 3 -7.093 17.581 17.667 1.00 0.00 H new ATOM 0 HG SER B 3 -9.359 15.826 17.605 1.00 0.00 H new ATOM 1969 N LEU B 4 -8.005 15.458 13.981 1.00 0.00 N ATOM 1970 CA LEU B 4 -8.337 14.247 13.241 1.00 0.00 C ATOM 1971 C LEU B 4 -7.194 13.241 13.300 1.00 0.00 C ATOM 1972 O LEU B 4 -6.115 13.539 13.810 1.00 0.00 O ATOM 1973 CB LEU B 4 -8.633 14.599 11.783 1.00 0.00 C ATOM 1974 CG LEU B 4 -9.847 15.528 11.727 1.00 0.00 C ATOM 1975 CD1 LEU B 4 -9.730 16.453 10.514 1.00 0.00 C ATOM 1976 CD2 LEU B 4 -11.124 14.693 11.612 1.00 0.00 C ATOM 0 H LEU B 4 -7.360 16.086 13.501 1.00 0.00 H new ATOM 0 HA LEU B 4 -9.218 13.797 13.698 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -7.768 15.084 11.330 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -8.827 13.693 11.210 1.00 0.00 H new ATOM 0 HG LEU B 4 -9.886 16.128 12.636 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -10.596 17.114 10.476 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -8.821 17.049 10.598 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -9.689 15.855 9.603 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -11.989 15.355 11.572 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -11.085 14.092 10.704 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -11.209 14.037 12.478 1.00 0.00 H new ATOM 1988 N THR B 5 -7.443 12.047 12.772 1.00 0.00 N ATOM 1989 CA THR B 5 -6.429 10.995 12.766 1.00 0.00 C ATOM 1990 C THR B 5 -6.138 10.534 11.344 1.00 0.00 C ATOM 1991 O THR B 5 -7.037 10.096 10.631 1.00 0.00 O ATOM 1992 CB THR B 5 -6.901 9.796 13.592 1.00 0.00 C ATOM 1993 OG1 THR B 5 -6.497 9.965 14.943 1.00 0.00 O ATOM 1994 CG2 THR B 5 -6.284 8.512 13.027 1.00 0.00 C ATOM 0 H THR B 5 -8.331 11.783 12.345 1.00 0.00 H new ATOM 0 HA THR B 5 -5.519 11.406 13.203 1.00 0.00 H new ATOM 0 HB THR B 5 -7.988 9.726 13.545 1.00 0.00 H new ATOM 0 HG1 THR B 5 -6.800 9.199 15.473 1.00 0.00 H new ATOM 0 HG21 THR B 5 -6.620 7.658 13.615 1.00 0.00 H new ATOM 0 HG22 THR B 5 -6.596 8.384 11.990 1.00 0.00 H new ATOM 0 HG23 THR B 5 -5.197 8.580 13.073 1.00 0.00 H new ATOM 2002 N PHE B 6 -4.877 10.620 10.943 1.00 0.00 N ATOM 2003 CA PHE B 6 -4.485 10.192 9.606 1.00 0.00 C ATOM 2004 C PHE B 6 -3.867 8.797 9.662 1.00 0.00 C ATOM 2005 O PHE B 6 -2.843 8.592 10.313 1.00 0.00 O ATOM 2006 CB PHE B 6 -3.471 11.174 9.016 1.00 0.00 C ATOM 2007 CG PHE B 6 -4.141 12.496 8.722 1.00 0.00 C ATOM 2008 CD1 PHE B 6 -4.754 13.218 9.753 1.00 0.00 C ATOM 2009 CD2 PHE B 6 -4.142 13.002 7.417 1.00 0.00 C ATOM 2010 CE1 PHE B 6 -5.369 14.445 9.479 1.00 0.00 C ATOM 2011 CE2 PHE B 6 -4.757 14.230 7.143 1.00 0.00 C ATOM 2012 CZ PHE B 6 -5.371 14.951 8.174 1.00 0.00 C ATOM 0 H PHE B 6 -4.114 10.978 11.517 1.00 0.00 H new ATOM 0 HA PHE B 6 -5.373 10.168 8.974 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -2.647 11.322 9.714 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -3.044 10.762 8.102 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -4.752 12.828 10.760 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -3.669 12.446 6.622 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -5.842 15.001 10.275 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -4.758 14.621 6.136 1.00 0.00 H new ATOM 0 HZ PHE B 6 -5.846 15.898 7.962 1.00 0.00 H new ATOM 2022 N LYS B 7 -4.493 7.840 8.982 1.00 0.00 N ATOM 2023 CA LYS B 7 -3.987 6.473 8.971 1.00 0.00 C ATOM 2024 C LYS B 7 -3.286 6.171 7.648 1.00 0.00 C ATOM 2025 O LYS B 7 -3.718 6.621 6.588 1.00 0.00 O ATOM 2026 CB LYS B 7 -5.137 5.484 9.201 1.00 0.00 C ATOM 2027 CG LYS B 7 -5.843 5.178 7.877 1.00 0.00 C ATOM 2028 CD LYS B 7 -5.354 3.834 7.338 1.00 0.00 C ATOM 2029 CE LYS B 7 -5.896 3.621 5.923 1.00 0.00 C ATOM 2030 NZ LYS B 7 -5.897 2.166 5.604 1.00 0.00 N ATOM 0 H LYS B 7 -5.343 7.985 8.437 1.00 0.00 H new ATOM 0 HA LYS B 7 -3.261 6.364 9.777 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -4.752 4.563 9.638 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -5.849 5.902 9.913 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -6.922 5.151 8.026 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -5.640 5.968 7.153 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -4.264 3.809 7.329 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -5.686 3.026 7.991 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -6.907 4.022 5.845 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -5.283 4.162 5.202 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -6.720 1.942 5.009 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -5.024 1.922 5.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -5.948 1.617 6.486 1.00 0.00 H new ATOM 2044 N ASN B 8 -2.195 5.414 7.723 1.00 0.00 N ATOM 2045 CA ASN B 8 -1.432 5.069 6.528 1.00 0.00 C ATOM 2046 C ASN B 8 -1.895 3.736 5.945 1.00 0.00 C ATOM 2047 O ASN B 8 -3.032 3.608 5.491 1.00 0.00 O ATOM 2048 CB ASN B 8 0.059 4.994 6.865 1.00 0.00 C ATOM 2049 CG ASN B 8 0.258 4.278 8.197 1.00 0.00 C ATOM 2050 OD1 ASN B 8 -0.693 3.735 8.758 1.00 0.00 O ATOM 2051 ND2 ASN B 8 1.445 4.246 8.739 1.00 0.00 N ATOM 0 H ASN B 8 -1.822 5.030 8.591 1.00 0.00 H new ATOM 0 HA ASN B 8 -1.600 5.846 5.783 1.00 0.00 H new ATOM 0 HB2 ASN B 8 0.592 4.465 6.075 1.00 0.00 H new ATOM 0 HB3 ASN B 8 0.480 5.998 6.916 1.00 0.00 H new ATOM 0 HD21 ASN B 8 1.586 3.770 9.630 1.00 0.00 H new ATOM 0 HD22 ASN B 8 2.231 4.697 8.272 1.00 0.00 H new ATOM 2058 N PHE B 9 -1.003 2.749 5.949 1.00 0.00 N ATOM 2059 CA PHE B 9 -1.329 1.432 5.406 1.00 0.00 C ATOM 2060 C PHE B 9 -1.000 0.331 6.409 1.00 0.00 C ATOM 2061 O PHE B 9 -1.414 -0.816 6.242 1.00 0.00 O ATOM 2062 CB PHE B 9 -0.539 1.197 4.119 1.00 0.00 C ATOM 2063 CG PHE B 9 -0.802 -0.201 3.612 1.00 0.00 C ATOM 2064 CD1 PHE B 9 -0.031 -1.272 4.079 1.00 0.00 C ATOM 2065 CD2 PHE B 9 -1.817 -0.425 2.675 1.00 0.00 C ATOM 2066 CE1 PHE B 9 -0.273 -2.567 3.608 1.00 0.00 C ATOM 2067 CE2 PHE B 9 -2.060 -1.721 2.203 1.00 0.00 C ATOM 2068 CZ PHE B 9 -1.288 -2.791 2.670 1.00 0.00 C ATOM 0 H PHE B 9 -0.056 2.834 6.319 1.00 0.00 H new ATOM 0 HA PHE B 9 -2.398 1.403 5.197 1.00 0.00 H new ATOM 0 HB2 PHE B 9 -0.827 1.929 3.364 1.00 0.00 H new ATOM 0 HB3 PHE B 9 0.526 1.333 4.304 1.00 0.00 H new ATOM 0 HD1 PHE B 9 0.751 -1.099 4.803 1.00 0.00 H new ATOM 0 HD2 PHE B 9 -2.413 0.401 2.316 1.00 0.00 H new ATOM 0 HE1 PHE B 9 0.323 -3.393 3.968 1.00 0.00 H new ATOM 0 HE2 PHE B 9 -2.843 -1.895 1.479 1.00 0.00 H new ATOM 0 HZ PHE B 9 -1.475 -3.791 2.306 1.00 0.00 H new ATOM 2078 N LYS B 10 -0.264 0.687 7.455 1.00 0.00 N ATOM 2079 CA LYS B 10 0.101 -0.281 8.481 1.00 0.00 C ATOM 2080 C LYS B 10 -0.891 -0.194 9.628 1.00 0.00 C ATOM 2081 O LYS B 10 -0.663 -0.730 10.713 1.00 0.00 O ATOM 2082 CB LYS B 10 1.517 -0.004 8.992 1.00 0.00 C ATOM 2083 CG LYS B 10 1.561 1.372 9.660 1.00 0.00 C ATOM 2084 CD LYS B 10 2.941 2.001 9.448 1.00 0.00 C ATOM 2085 CE LYS B 10 3.129 2.340 7.966 1.00 0.00 C ATOM 2086 NZ LYS B 10 4.026 1.330 7.336 1.00 0.00 N ATOM 0 H LYS B 10 0.089 1.631 7.614 1.00 0.00 H new ATOM 0 HA LYS B 10 0.077 -1.283 8.054 1.00 0.00 H new ATOM 0 HB2 LYS B 10 1.815 -0.774 9.703 1.00 0.00 H new ATOM 0 HB3 LYS B 10 2.227 -0.041 8.165 1.00 0.00 H new ATOM 0 HG2 LYS B 10 0.788 2.016 9.241 1.00 0.00 H new ATOM 0 HG3 LYS B 10 1.353 1.277 10.726 1.00 0.00 H new ATOM 0 HD2 LYS B 10 3.038 2.903 10.053 1.00 0.00 H new ATOM 0 HD3 LYS B 10 3.720 1.312 9.776 1.00 0.00 H new ATOM 0 HE2 LYS B 10 2.164 2.352 7.459 1.00 0.00 H new ATOM 0 HE3 LYS B 10 3.556 3.337 7.861 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 4.939 1.772 7.107 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 4.179 0.541 7.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 3.587 0.971 6.464 1.00 0.00 H new ATOM 2100 N LYS B 11 -1.996 0.491 9.365 1.00 0.00 N ATOM 2101 CA LYS B 11 -3.045 0.665 10.359 1.00 0.00 C ATOM 2102 C LYS B 11 -2.552 1.506 11.531 1.00 0.00 C ATOM 2103 O LYS B 11 -2.879 1.233 12.686 1.00 0.00 O ATOM 2104 CB LYS B 11 -3.526 -0.698 10.865 1.00 0.00 C ATOM 2105 CG LYS B 11 -4.294 -1.416 9.747 1.00 0.00 C ATOM 2106 CD LYS B 11 -3.587 -2.728 9.387 1.00 0.00 C ATOM 2107 CE LYS B 11 -4.386 -3.909 9.943 1.00 0.00 C ATOM 2108 NZ LYS B 11 -5.725 -3.954 9.288 1.00 0.00 N ATOM 0 H LYS B 11 -2.189 0.936 8.468 1.00 0.00 H new ATOM 0 HA LYS B 11 -3.876 1.187 9.885 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.675 -1.301 11.182 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -4.168 -0.569 11.737 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -5.315 -1.620 10.068 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -4.358 -0.774 8.868 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.492 -2.817 8.305 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -2.577 -2.733 9.797 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -3.850 -4.841 9.764 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -4.500 -3.809 11.022 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -6.423 -4.346 9.952 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -6.010 -2.992 9.014 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -5.677 -4.556 8.441 1.00 0.00 H new ATOM 2122 N GLU B 12 -1.773 2.539 11.225 1.00 0.00 N ATOM 2123 CA GLU B 12 -1.250 3.426 12.258 1.00 0.00 C ATOM 2124 C GLU B 12 -1.967 4.770 12.201 1.00 0.00 C ATOM 2125 O GLU B 12 -2.277 5.269 11.122 1.00 0.00 O ATOM 2126 CB GLU B 12 0.251 3.640 12.060 1.00 0.00 C ATOM 2127 CG GLU B 12 1.031 2.609 12.877 1.00 0.00 C ATOM 2128 CD GLU B 12 1.097 3.042 14.338 1.00 0.00 C ATOM 2129 OE1 GLU B 12 1.877 3.931 14.637 1.00 0.00 O ATOM 2130 OE2 GLU B 12 0.367 2.477 15.136 1.00 0.00 O ATOM 0 H GLU B 12 -1.491 2.782 10.275 1.00 0.00 H new ATOM 0 HA GLU B 12 -1.420 2.966 13.231 1.00 0.00 H new ATOM 0 HB2 GLU B 12 0.505 3.549 11.004 1.00 0.00 H new ATOM 0 HB3 GLU B 12 0.528 4.648 12.369 1.00 0.00 H new ATOM 0 HG2 GLU B 12 0.551 1.633 12.800 1.00 0.00 H new ATOM 0 HG3 GLU B 12 2.039 2.501 12.475 1.00 0.00 H new ATOM 2137 N LYS B 13 -2.233 5.348 13.367 1.00 0.00 N ATOM 2138 CA LYS B 13 -2.921 6.631 13.427 1.00 0.00 C ATOM 2139 C LYS B 13 -1.936 7.763 13.701 1.00 0.00 C ATOM 2140 O LYS B 13 -1.065 7.650 14.562 1.00 0.00 O ATOM 2141 CB LYS B 13 -3.985 6.605 14.525 1.00 0.00 C ATOM 2142 CG LYS B 13 -3.417 5.928 15.776 1.00 0.00 C ATOM 2143 CD LYS B 13 -3.726 4.429 15.737 1.00 0.00 C ATOM 2144 CE LYS B 13 -5.109 4.176 16.340 1.00 0.00 C ATOM 2145 NZ LYS B 13 -5.500 2.757 16.108 1.00 0.00 N ATOM 0 H LYS B 13 -1.986 4.953 14.274 1.00 0.00 H new ATOM 0 HA LYS B 13 -3.397 6.806 12.462 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -4.303 7.621 14.761 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -4.867 6.068 14.177 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.340 6.086 15.829 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -3.849 6.375 16.671 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -3.694 4.067 14.709 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -2.969 3.876 16.293 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -5.096 4.391 17.409 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -5.842 4.845 15.889 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -6.440 2.585 16.518 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -5.528 2.567 15.086 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -4.805 2.127 16.558 1.00 0.00 H new ATOM 2159 N VAL B 14 -2.093 8.858 12.966 1.00 0.00 N ATOM 2160 CA VAL B 14 -1.225 10.018 13.133 1.00 0.00 C ATOM 2161 C VAL B 14 -2.063 11.256 13.429 1.00 0.00 C ATOM 2162 O VAL B 14 -2.352 12.051 12.534 1.00 0.00 O ATOM 2163 CB VAL B 14 -0.404 10.243 11.861 1.00 0.00 C ATOM 2164 CG1 VAL B 14 0.504 11.461 12.049 1.00 0.00 C ATOM 2165 CG2 VAL B 14 0.454 9.008 11.583 1.00 0.00 C ATOM 0 H VAL B 14 -2.811 8.967 12.250 1.00 0.00 H new ATOM 0 HA VAL B 14 -0.549 9.836 13.968 1.00 0.00 H new ATOM 0 HB VAL B 14 -1.076 10.416 11.021 1.00 0.00 H new ATOM 0 HG11 VAL B 14 1.089 11.622 11.144 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -0.106 12.342 12.248 1.00 0.00 H new ATOM 0 HG13 VAL B 14 1.176 11.287 12.889 1.00 0.00 H new ATOM 0 HG21 VAL B 14 1.039 9.168 10.677 1.00 0.00 H new ATOM 0 HG22 VAL B 14 1.126 8.835 12.423 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -0.191 8.139 11.450 1.00 0.00 H new ATOM 2175 N PRO B 15 -2.467 11.426 14.661 1.00 0.00 N ATOM 2176 CA PRO B 15 -3.301 12.582 15.085 1.00 0.00 C ATOM 2177 C PRO B 15 -2.809 13.899 14.499 1.00 0.00 C ATOM 2178 O PRO B 15 -1.606 14.125 14.369 1.00 0.00 O ATOM 2179 CB PRO B 15 -3.198 12.594 16.616 1.00 0.00 C ATOM 2180 CG PRO B 15 -2.309 11.450 17.005 1.00 0.00 C ATOM 2181 CD PRO B 15 -2.174 10.537 15.786 1.00 0.00 C ATOM 0 HA PRO B 15 -4.327 12.479 14.731 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -2.785 13.540 16.967 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -4.183 12.488 17.070 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -1.332 11.814 17.321 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -2.733 10.904 17.848 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -1.173 10.112 15.712 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -2.873 9.702 15.830 1.00 0.00 H new ATOM 2189 N LEU B 16 -3.755 14.761 14.152 1.00 0.00 N ATOM 2190 CA LEU B 16 -3.429 16.061 13.579 1.00 0.00 C ATOM 2191 C LEU B 16 -4.509 17.081 13.908 1.00 0.00 C ATOM 2192 O LEU B 16 -5.696 16.758 13.934 1.00 0.00 O ATOM 2193 CB LEU B 16 -3.303 15.947 12.059 1.00 0.00 C ATOM 2194 CG LEU B 16 -1.920 15.412 11.705 1.00 0.00 C ATOM 2195 CD1 LEU B 16 -1.893 15.003 10.230 1.00 0.00 C ATOM 2196 CD2 LEU B 16 -0.870 16.499 11.955 1.00 0.00 C ATOM 0 H LEU B 16 -4.754 14.584 14.257 1.00 0.00 H new ATOM 0 HA LEU B 16 -2.482 16.390 14.007 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.073 15.282 11.668 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -3.458 16.922 11.596 1.00 0.00 H new ATOM 0 HG LEU B 16 -1.697 14.545 12.326 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -0.904 14.620 9.977 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -2.638 14.227 10.054 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -2.117 15.870 9.608 1.00 0.00 H new ATOM 0 HD21 LEU B 16 0.118 16.115 11.702 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -1.092 17.368 11.336 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -0.889 16.788 13.006 1.00 0.00 H new ATOM 2208 N ASP B 17 -4.088 18.316 14.141 1.00 0.00 N ATOM 2209 CA ASP B 17 -5.028 19.387 14.449 1.00 0.00 C ATOM 2210 C ASP B 17 -5.164 20.312 13.247 1.00 0.00 C ATOM 2211 O ASP B 17 -4.169 20.715 12.645 1.00 0.00 O ATOM 2212 CB ASP B 17 -4.549 20.189 15.656 1.00 0.00 C ATOM 2213 CG ASP B 17 -3.092 20.600 15.468 1.00 0.00 C ATOM 2214 OD1 ASP B 17 -2.325 19.785 14.985 1.00 0.00 O ATOM 2215 OD2 ASP B 17 -2.766 21.726 15.809 1.00 0.00 O ATOM 0 H ASP B 17 -3.109 18.601 14.123 1.00 0.00 H new ATOM 0 HA ASP B 17 -5.996 18.944 14.683 1.00 0.00 H new ATOM 0 HB2 ASP B 17 -5.171 21.075 15.784 1.00 0.00 H new ATOM 0 HB3 ASP B 17 -4.653 19.593 16.563 1.00 0.00 H new ATOM 2220 N LEU B 18 -6.402 20.637 12.899 1.00 0.00 N ATOM 2221 CA LEU B 18 -6.656 21.506 11.757 1.00 0.00 C ATOM 2222 C LEU B 18 -7.793 22.476 12.047 1.00 0.00 C ATOM 2223 O LEU B 18 -8.268 22.582 13.178 1.00 0.00 O ATOM 2224 CB LEU B 18 -7.019 20.662 10.536 1.00 0.00 C ATOM 2225 CG LEU B 18 -5.787 19.890 10.061 1.00 0.00 C ATOM 2226 CD1 LEU B 18 -6.046 18.388 10.183 1.00 0.00 C ATOM 2227 CD2 LEU B 18 -5.499 20.242 8.599 1.00 0.00 C ATOM 0 H LEU B 18 -7.239 20.316 13.385 1.00 0.00 H new ATOM 0 HA LEU B 18 -5.749 22.078 11.561 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -7.821 19.968 10.787 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -7.390 21.303 9.736 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.929 20.160 10.677 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.168 17.839 9.844 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -6.252 18.138 11.224 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -6.904 18.116 9.568 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.621 19.693 8.259 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -6.357 19.972 7.984 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -5.313 21.313 8.512 1.00 0.00 H new ATOM 2239 N GLU B 19 -8.224 23.178 11.006 1.00 0.00 N ATOM 2240 CA GLU B 19 -9.309 24.142 11.133 1.00 0.00 C ATOM 2241 C GLU B 19 -10.151 24.151 9.860 1.00 0.00 C ATOM 2242 O GLU B 19 -9.672 23.781 8.788 1.00 0.00 O ATOM 2243 CB GLU B 19 -8.736 25.541 11.379 1.00 0.00 C ATOM 2244 CG GLU B 19 -7.862 25.523 12.635 1.00 0.00 C ATOM 2245 CD GLU B 19 -8.686 25.085 13.840 1.00 0.00 C ATOM 2246 OE1 GLU B 19 -9.849 25.449 13.903 1.00 0.00 O ATOM 2247 OE2 GLU B 19 -8.142 24.391 14.683 1.00 0.00 O ATOM 0 H GLU B 19 -7.839 23.098 10.065 1.00 0.00 H new ATOM 0 HA GLU B 19 -9.938 23.856 11.976 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -8.148 25.861 10.519 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -9.546 26.261 11.497 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -7.022 24.844 12.493 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -7.444 26.514 12.811 1.00 0.00 H new ATOM 2254 N PRO B 20 -11.385 24.563 9.958 1.00 0.00 N ATOM 2255 CA PRO B 20 -12.303 24.620 8.792 1.00 0.00 C ATOM 2256 C PRO B 20 -11.617 25.261 7.593 1.00 0.00 C ATOM 2257 O PRO B 20 -11.908 24.933 6.443 1.00 0.00 O ATOM 2258 CB PRO B 20 -13.484 25.478 9.268 1.00 0.00 C ATOM 2259 CG PRO B 20 -13.187 25.889 10.680 1.00 0.00 C ATOM 2260 CD PRO B 20 -12.035 25.021 11.183 1.00 0.00 C ATOM 0 HA PRO B 20 -12.618 23.628 8.468 1.00 0.00 H new ATOM 0 HB2 PRO B 20 -13.607 26.353 8.630 1.00 0.00 H new ATOM 0 HB3 PRO B 20 -14.415 24.914 9.218 1.00 0.00 H new ATOM 0 HG2 PRO B 20 -12.918 26.944 10.723 1.00 0.00 H new ATOM 0 HG3 PRO B 20 -14.067 25.759 11.310 1.00 0.00 H new ATOM 0 HD2 PRO B 20 -11.350 25.590 11.811 1.00 0.00 H new ATOM 0 HD3 PRO B 20 -12.396 24.185 11.782 1.00 0.00 H new ATOM 2268 N SER B 21 -10.697 26.176 7.881 1.00 0.00 N ATOM 2269 CA SER B 21 -9.959 26.864 6.828 1.00 0.00 C ATOM 2270 C SER B 21 -8.770 26.026 6.375 1.00 0.00 C ATOM 2271 O SER B 21 -8.689 25.632 5.212 1.00 0.00 O ATOM 2272 CB SER B 21 -9.470 28.222 7.333 1.00 0.00 C ATOM 2273 OG SER B 21 -8.695 28.034 8.509 1.00 0.00 O ATOM 0 H SER B 21 -10.446 26.457 8.829 1.00 0.00 H new ATOM 0 HA SER B 21 -10.627 27.014 5.980 1.00 0.00 H new ATOM 0 HB2 SER B 21 -8.873 28.715 6.565 1.00 0.00 H new ATOM 0 HB3 SER B 21 -10.319 28.872 7.543 1.00 0.00 H new ATOM 0 HG SER B 21 -8.378 28.902 8.834 1.00 0.00 H new ATOM 2279 N ASN B 22 -7.848 25.748 7.297 1.00 0.00 N ATOM 2280 CA ASN B 22 -6.677 24.949 6.961 1.00 0.00 C ATOM 2281 C ASN B 22 -7.010 24.022 5.802 1.00 0.00 C ATOM 2282 O ASN B 22 -8.089 23.431 5.762 1.00 0.00 O ATOM 2283 CB ASN B 22 -6.231 24.125 8.169 1.00 0.00 C ATOM 2284 CG ASN B 22 -5.660 25.042 9.244 1.00 0.00 C ATOM 2285 OD1 ASN B 22 -6.001 24.911 10.420 1.00 0.00 O ATOM 2286 ND2 ASN B 22 -4.805 25.970 8.910 1.00 0.00 N ATOM 0 H ASN B 22 -7.890 26.060 8.267 1.00 0.00 H new ATOM 0 HA ASN B 22 -5.864 25.616 6.673 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -7.076 23.564 8.569 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -5.480 23.396 7.865 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -4.418 26.588 9.624 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -4.524 26.077 7.935 1.00 0.00 H new ATOM 2293 N THR B 23 -6.094 23.912 4.852 1.00 0.00 N ATOM 2294 CA THR B 23 -6.332 23.067 3.690 1.00 0.00 C ATOM 2295 C THR B 23 -5.393 21.867 3.659 1.00 0.00 C ATOM 2296 O THR B 23 -4.513 21.722 4.507 1.00 0.00 O ATOM 2297 CB THR B 23 -6.166 23.886 2.406 1.00 0.00 C ATOM 2298 OG1 THR B 23 -5.189 23.273 1.577 1.00 0.00 O ATOM 2299 CG2 THR B 23 -5.723 25.306 2.757 1.00 0.00 C ATOM 0 H THR B 23 -5.192 24.389 4.860 1.00 0.00 H new ATOM 0 HA THR B 23 -7.353 22.691 3.760 1.00 0.00 H new ATOM 0 HB THR B 23 -7.118 23.927 1.876 1.00 0.00 H new ATOM 0 HG1 THR B 23 -5.083 23.796 0.755 1.00 0.00 H new ATOM 0 HG21 THR B 23 -5.605 25.887 1.842 1.00 0.00 H new ATOM 0 HG22 THR B 23 -6.475 25.776 3.391 1.00 0.00 H new ATOM 0 HG23 THR B 23 -4.772 25.270 3.288 1.00 0.00 H new ATOM 2307 N ILE B 24 -5.607 21.009 2.668 1.00 0.00 N ATOM 2308 CA ILE B 24 -4.806 19.811 2.499 1.00 0.00 C ATOM 2309 C ILE B 24 -3.340 20.164 2.341 1.00 0.00 C ATOM 2310 O ILE B 24 -2.467 19.397 2.735 1.00 0.00 O ATOM 2311 CB ILE B 24 -5.298 19.060 1.261 1.00 0.00 C ATOM 2312 CG1 ILE B 24 -6.590 18.296 1.579 1.00 0.00 C ATOM 2313 CG2 ILE B 24 -4.232 18.076 0.801 1.00 0.00 C ATOM 2314 CD1 ILE B 24 -7.148 18.736 2.934 1.00 0.00 C ATOM 0 H ILE B 24 -6.337 21.126 1.965 1.00 0.00 H new ATOM 0 HA ILE B 24 -4.909 19.182 3.383 1.00 0.00 H new ATOM 0 HB ILE B 24 -5.497 19.783 0.470 1.00 0.00 H new ATOM 0 HG12 ILE B 24 -7.329 18.476 0.798 1.00 0.00 H new ATOM 0 HG13 ILE B 24 -6.393 17.224 1.590 1.00 0.00 H new ATOM 0 HG21 ILE B 24 -4.586 17.543 -0.081 1.00 0.00 H new ATOM 0 HG22 ILE B 24 -3.318 18.618 0.556 1.00 0.00 H new ATOM 0 HG23 ILE B 24 -4.027 17.362 1.599 1.00 0.00 H new ATOM 0 HD11 ILE B 24 -8.065 18.186 3.146 1.00 0.00 H new ATOM 0 HD12 ILE B 24 -6.414 18.532 3.713 1.00 0.00 H new ATOM 0 HD13 ILE B 24 -7.364 19.804 2.909 1.00 0.00 H new ATOM 2326 N LEU B 25 -3.071 21.326 1.773 1.00 0.00 N ATOM 2327 CA LEU B 25 -1.699 21.756 1.590 1.00 0.00 C ATOM 2328 C LEU B 25 -0.966 21.696 2.923 1.00 0.00 C ATOM 2329 O LEU B 25 0.142 21.170 3.017 1.00 0.00 O ATOM 2330 CB LEU B 25 -1.683 23.184 1.051 1.00 0.00 C ATOM 2331 CG LEU B 25 -0.245 23.685 0.925 1.00 0.00 C ATOM 2332 CD1 LEU B 25 0.324 24.009 2.310 1.00 0.00 C ATOM 2333 CD2 LEU B 25 0.622 22.615 0.251 1.00 0.00 C ATOM 0 H LEU B 25 -3.776 21.981 1.435 1.00 0.00 H new ATOM 0 HA LEU B 25 -1.200 21.098 0.878 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -2.174 23.219 0.079 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -2.247 23.838 1.717 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.240 24.590 0.317 1.00 0.00 H new ATOM 0 HD11 LEU B 25 1.349 24.365 2.208 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -0.283 24.782 2.781 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.312 23.111 2.928 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.646 22.978 0.164 1.00 0.00 H new ATOM 0 HD22 LEU B 25 0.609 21.705 0.851 1.00 0.00 H new ATOM 0 HD23 LEU B 25 0.228 22.400 -0.742 1.00 0.00 H new ATOM 2345 N GLU B 26 -1.602 22.244 3.952 1.00 0.00 N ATOM 2346 CA GLU B 26 -1.017 22.263 5.288 1.00 0.00 C ATOM 2347 C GLU B 26 -1.084 20.889 5.950 1.00 0.00 C ATOM 2348 O GLU B 26 -0.103 20.441 6.544 1.00 0.00 O ATOM 2349 CB GLU B 26 -1.742 23.289 6.162 1.00 0.00 C ATOM 2350 CG GLU B 26 -1.467 24.697 5.630 1.00 0.00 C ATOM 2351 CD GLU B 26 -1.982 25.737 6.619 1.00 0.00 C ATOM 2352 OE1 GLU B 26 -2.028 25.433 7.800 1.00 0.00 O ATOM 2353 OE2 GLU B 26 -2.324 26.824 6.182 1.00 0.00 O ATOM 0 H GLU B 26 -2.522 22.681 3.887 1.00 0.00 H new ATOM 0 HA GLU B 26 0.032 22.540 5.187 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -2.814 23.091 6.161 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -1.404 23.206 7.195 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -0.397 24.832 5.471 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -1.952 24.831 4.663 1.00 0.00 H new ATOM 2360 N THR B 27 -2.227 20.211 5.849 1.00 0.00 N ATOM 2361 CA THR B 27 -2.348 18.892 6.454 1.00 0.00 C ATOM 2362 C THR B 27 -1.300 17.976 5.842 1.00 0.00 C ATOM 2363 O THR B 27 -0.719 17.127 6.519 1.00 0.00 O ATOM 2364 CB THR B 27 -3.755 18.332 6.231 1.00 0.00 C ATOM 2365 OG1 THR B 27 -4.275 17.862 7.466 1.00 0.00 O ATOM 2366 CG2 THR B 27 -3.702 17.181 5.230 1.00 0.00 C ATOM 0 H THR B 27 -3.061 20.545 5.366 1.00 0.00 H new ATOM 0 HA THR B 27 -2.184 18.962 7.529 1.00 0.00 H new ATOM 0 HB THR B 27 -4.398 19.119 5.838 1.00 0.00 H new ATOM 0 HG1 THR B 27 -4.477 16.906 7.393 1.00 0.00 H new ATOM 0 HG21 THR B 27 -4.706 16.787 5.075 1.00 0.00 H new ATOM 0 HG22 THR B 27 -3.304 17.542 4.282 1.00 0.00 H new ATOM 0 HG23 THR B 27 -3.058 16.392 5.617 1.00 0.00 H new ATOM 2374 N LYS B 28 -1.053 18.181 4.555 1.00 0.00 N ATOM 2375 CA LYS B 28 -0.056 17.399 3.839 1.00 0.00 C ATOM 2376 C LYS B 28 1.342 17.763 4.330 1.00 0.00 C ATOM 2377 O LYS B 28 2.191 16.892 4.521 1.00 0.00 O ATOM 2378 CB LYS B 28 -0.158 17.676 2.337 1.00 0.00 C ATOM 2379 CG LYS B 28 -1.027 16.606 1.671 1.00 0.00 C ATOM 2380 CD LYS B 28 -0.479 16.302 0.277 1.00 0.00 C ATOM 2381 CE LYS B 28 -1.534 15.550 -0.537 1.00 0.00 C ATOM 2382 NZ LYS B 28 -1.047 15.368 -1.934 1.00 0.00 N ATOM 0 H LYS B 28 -1.529 18.882 3.987 1.00 0.00 H new ATOM 0 HA LYS B 28 -0.238 16.340 4.024 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -0.588 18.663 2.168 1.00 0.00 H new ATOM 0 HB3 LYS B 28 0.836 17.680 1.890 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -1.035 15.700 2.276 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -2.058 16.951 1.601 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -0.208 17.229 -0.228 1.00 0.00 H new ATOM 0 HD3 LYS B 28 0.429 15.704 0.355 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -1.737 14.580 -0.082 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -2.472 16.105 -0.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -1.764 14.857 -2.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -0.875 16.298 -2.366 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -0.162 14.822 -1.925 1.00 0.00 H new ATOM 2396 N THR B 29 1.575 19.060 4.539 1.00 0.00 N ATOM 2397 CA THR B 29 2.872 19.523 5.012 1.00 0.00 C ATOM 2398 C THR B 29 3.166 18.953 6.394 1.00 0.00 C ATOM 2399 O THR B 29 4.226 18.373 6.625 1.00 0.00 O ATOM 2400 CB THR B 29 2.890 21.052 5.070 1.00 0.00 C ATOM 2401 OG1 THR B 29 2.051 21.571 4.048 1.00 0.00 O ATOM 2402 CG2 THR B 29 4.317 21.556 4.864 1.00 0.00 C ATOM 0 H THR B 29 0.888 19.798 4.389 1.00 0.00 H new ATOM 0 HA THR B 29 3.639 19.179 4.318 1.00 0.00 H new ATOM 0 HB THR B 29 2.528 21.383 6.043 1.00 0.00 H new ATOM 0 HG1 THR B 29 1.157 21.179 4.128 1.00 0.00 H new ATOM 0 HG21 THR B 29 4.328 22.645 4.906 1.00 0.00 H new ATOM 0 HG22 THR B 29 4.961 21.157 5.648 1.00 0.00 H new ATOM 0 HG23 THR B 29 4.682 21.226 3.891 1.00 0.00 H new ATOM 2410 N LYS B 30 2.217 19.119 7.309 1.00 0.00 N ATOM 2411 CA LYS B 30 2.386 18.612 8.663 1.00 0.00 C ATOM 2412 C LYS B 30 2.530 17.094 8.642 1.00 0.00 C ATOM 2413 O LYS B 30 3.567 16.556 9.030 1.00 0.00 O ATOM 2414 CB LYS B 30 1.184 19.002 9.525 1.00 0.00 C ATOM 2415 CG LYS B 30 1.460 18.625 10.983 1.00 0.00 C ATOM 2416 CD LYS B 30 2.442 19.625 11.597 1.00 0.00 C ATOM 2417 CE LYS B 30 2.325 19.586 13.122 1.00 0.00 C ATOM 2418 NZ LYS B 30 1.071 20.273 13.542 1.00 0.00 N ATOM 0 H LYS B 30 1.332 19.596 7.139 1.00 0.00 H new ATOM 0 HA LYS B 30 3.289 19.050 9.088 1.00 0.00 H new ATOM 0 HB2 LYS B 30 0.997 20.073 9.444 1.00 0.00 H new ATOM 0 HB3 LYS B 30 0.288 18.494 9.170 1.00 0.00 H new ATOM 0 HG2 LYS B 30 0.529 18.620 11.550 1.00 0.00 H new ATOM 0 HG3 LYS B 30 1.871 17.617 11.037 1.00 0.00 H new ATOM 0 HD2 LYS B 30 3.461 19.383 11.294 1.00 0.00 H new ATOM 0 HD3 LYS B 30 2.230 20.630 11.231 1.00 0.00 H new ATOM 0 HE2 LYS B 30 2.321 18.553 13.471 1.00 0.00 H new ATOM 0 HE3 LYS B 30 3.188 20.072 13.576 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 1.158 20.579 14.532 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 0.910 21.103 12.936 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 0.269 19.617 13.451 1.00 0.00 H new ATOM 2432 N LEU B 31 1.487 16.409 8.182 1.00 0.00 N ATOM 2433 CA LEU B 31 1.520 14.955 8.111 1.00 0.00 C ATOM 2434 C LEU B 31 2.871 14.479 7.588 1.00 0.00 C ATOM 2435 O LEU B 31 3.270 13.338 7.817 1.00 0.00 O ATOM 2436 CB LEU B 31 0.407 14.456 7.187 1.00 0.00 C ATOM 2437 CG LEU B 31 0.410 12.927 7.159 1.00 0.00 C ATOM 2438 CD1 LEU B 31 0.211 12.389 8.577 1.00 0.00 C ATOM 2439 CD2 LEU B 31 -0.727 12.435 6.261 1.00 0.00 C ATOM 0 H LEU B 31 0.618 16.833 7.857 1.00 0.00 H new ATOM 0 HA LEU B 31 1.368 14.553 9.113 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -0.559 14.821 7.535 1.00 0.00 H new ATOM 0 HB3 LEU B 31 0.553 14.848 6.181 1.00 0.00 H new ATOM 0 HG LEU B 31 1.363 12.571 6.768 1.00 0.00 H new ATOM 0 HD11 LEU B 31 0.213 11.299 8.556 1.00 0.00 H new ATOM 0 HD12 LEU B 31 1.020 12.741 9.217 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -0.742 12.742 8.970 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -0.728 11.345 6.239 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -1.680 12.791 6.653 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -0.585 12.818 5.251 1.00 0.00 H new ATOM 2451 N ALA B 32 3.572 15.365 6.886 1.00 0.00 N ATOM 2452 CA ALA B 32 4.880 15.027 6.334 1.00 0.00 C ATOM 2453 C ALA B 32 5.986 15.401 7.316 1.00 0.00 C ATOM 2454 O ALA B 32 7.031 14.751 7.367 1.00 0.00 O ATOM 2455 CB ALA B 32 5.098 15.767 5.012 1.00 0.00 C ATOM 0 H ALA B 32 3.259 16.315 6.687 1.00 0.00 H new ATOM 0 HA ALA B 32 4.912 13.952 6.157 1.00 0.00 H new ATOM 0 HB1 ALA B 32 6.077 15.509 4.607 1.00 0.00 H new ATOM 0 HB2 ALA B 32 4.324 15.478 4.301 1.00 0.00 H new ATOM 0 HB3 ALA B 32 5.049 16.842 5.184 1.00 0.00 H new ATOM 2461 N GLN B 33 5.748 16.450 8.095 1.00 0.00 N ATOM 2462 CA GLN B 33 6.728 16.904 9.074 1.00 0.00 C ATOM 2463 C GLN B 33 6.563 16.142 10.384 1.00 0.00 C ATOM 2464 O GLN B 33 7.278 16.390 11.355 1.00 0.00 O ATOM 2465 CB GLN B 33 6.561 18.403 9.328 1.00 0.00 C ATOM 2466 CG GLN B 33 6.985 19.181 8.081 1.00 0.00 C ATOM 2467 CD GLN B 33 6.649 20.659 8.249 1.00 0.00 C ATOM 2468 OE1 GLN B 33 6.266 21.324 7.287 1.00 0.00 O ATOM 2469 NE2 GLN B 33 6.769 21.217 9.423 1.00 0.00 N ATOM 0 H GLN B 33 4.889 17.000 8.068 1.00 0.00 H new ATOM 0 HA GLN B 33 7.725 16.715 8.677 1.00 0.00 H new ATOM 0 HB2 GLN B 33 5.523 18.628 9.575 1.00 0.00 H new ATOM 0 HB3 GLN B 33 7.165 18.708 10.183 1.00 0.00 H new ATOM 0 HG2 GLN B 33 8.055 19.060 7.913 1.00 0.00 H new ATOM 0 HG3 GLN B 33 6.477 18.782 7.203 1.00 0.00 H new ATOM 0 HE21 GLN B 33 7.086 20.665 10.220 1.00 0.00 H new ATOM 0 HE22 GLN B 33 6.545 22.205 9.543 1.00 0.00 H new ATOM 2478 N SER B 34 5.620 15.206 10.398 1.00 0.00 N ATOM 2479 CA SER B 34 5.371 14.401 11.587 1.00 0.00 C ATOM 2480 C SER B 34 6.031 13.039 11.432 1.00 0.00 C ATOM 2481 O SER B 34 6.646 12.522 12.365 1.00 0.00 O ATOM 2482 CB SER B 34 3.867 14.225 11.796 1.00 0.00 C ATOM 2483 OG SER B 34 3.290 15.479 12.137 1.00 0.00 O ATOM 0 H SER B 34 5.019 14.987 9.604 1.00 0.00 H new ATOM 0 HA SER B 34 5.792 14.910 12.454 1.00 0.00 H new ATOM 0 HB2 SER B 34 3.406 13.834 10.889 1.00 0.00 H new ATOM 0 HB3 SER B 34 3.681 13.499 12.587 1.00 0.00 H new ATOM 0 HG SER B 34 2.325 15.370 12.270 1.00 0.00 H new ATOM 2489 N ILE B 35 5.905 12.470 10.239 1.00 0.00 N ATOM 2490 CA ILE B 35 6.495 11.176 9.951 1.00 0.00 C ATOM 2491 C ILE B 35 7.872 11.362 9.325 1.00 0.00 C ATOM 2492 O ILE B 35 8.690 10.441 9.314 1.00 0.00 O ATOM 2493 CB ILE B 35 5.592 10.404 8.995 1.00 0.00 C ATOM 2494 CG1 ILE B 35 5.458 11.175 7.679 1.00 0.00 C ATOM 2495 CG2 ILE B 35 4.209 10.232 9.626 1.00 0.00 C ATOM 2496 CD1 ILE B 35 4.252 10.646 6.897 1.00 0.00 C ATOM 0 H ILE B 35 5.399 12.887 9.458 1.00 0.00 H new ATOM 0 HA ILE B 35 6.600 10.615 10.879 1.00 0.00 H new ATOM 0 HB ILE B 35 6.028 9.424 8.799 1.00 0.00 H new ATOM 0 HG12 ILE B 35 5.336 12.239 7.880 1.00 0.00 H new ATOM 0 HG13 ILE B 35 6.366 11.064 7.086 1.00 0.00 H new ATOM 0 HG21 ILE B 35 3.563 9.680 8.943 1.00 0.00 H new ATOM 0 HG22 ILE B 35 4.302 9.681 10.562 1.00 0.00 H new ATOM 0 HG23 ILE B 35 3.775 11.212 9.824 1.00 0.00 H new ATOM 0 HD11 ILE B 35 4.157 11.195 5.960 1.00 0.00 H new ATOM 0 HD12 ILE B 35 4.393 9.586 6.684 1.00 0.00 H new ATOM 0 HD13 ILE B 35 3.347 10.780 7.490 1.00 0.00 H new ATOM 2508 N SER B 36 8.122 12.566 8.815 1.00 0.00 N ATOM 2509 CA SER B 36 9.407 12.875 8.195 1.00 0.00 C ATOM 2510 C SER B 36 9.419 12.466 6.725 1.00 0.00 C ATOM 2511 O SER B 36 10.472 12.143 6.172 1.00 0.00 O ATOM 2512 CB SER B 36 10.535 12.153 8.935 1.00 0.00 C ATOM 2513 OG SER B 36 11.728 12.919 8.834 1.00 0.00 O ATOM 0 H SER B 36 7.456 13.339 8.819 1.00 0.00 H new ATOM 0 HA SER B 36 9.560 13.952 8.257 1.00 0.00 H new ATOM 0 HB2 SER B 36 10.267 12.012 9.982 1.00 0.00 H new ATOM 0 HB3 SER B 36 10.689 11.161 8.509 1.00 0.00 H new ATOM 0 HG SER B 36 12.452 12.460 9.308 1.00 0.00 H new ATOM 2519 N CYS B 37 8.250 12.489 6.092 1.00 0.00 N ATOM 2520 CA CYS B 37 8.151 12.125 4.683 1.00 0.00 C ATOM 2521 C CYS B 37 7.552 13.275 3.883 1.00 0.00 C ATOM 2522 O CYS B 37 6.577 13.893 4.306 1.00 0.00 O ATOM 2523 CB CYS B 37 7.283 10.878 4.516 1.00 0.00 C ATOM 2524 SG CYS B 37 7.927 9.548 5.560 1.00 0.00 S ATOM 0 H CYS B 37 7.366 12.753 6.527 1.00 0.00 H new ATOM 0 HA CYS B 37 9.153 11.913 4.311 1.00 0.00 H new ATOM 0 HB2 CYS B 37 6.251 11.101 4.788 1.00 0.00 H new ATOM 0 HB3 CYS B 37 7.276 10.564 3.472 1.00 0.00 H new ATOM 0 HG CYS B 37 7.187 8.489 5.419 1.00 0.00 H new ATOM 2530 N GLU B 38 8.144 13.557 2.729 1.00 0.00 N ATOM 2531 CA GLU B 38 7.664 14.637 1.882 1.00 0.00 C ATOM 2532 C GLU B 38 6.207 14.422 1.507 1.00 0.00 C ATOM 2533 O GLU B 38 5.759 13.291 1.315 1.00 0.00 O ATOM 2534 CB GLU B 38 8.513 14.724 0.613 1.00 0.00 C ATOM 2535 CG GLU B 38 9.465 15.915 0.720 1.00 0.00 C ATOM 2536 CD GLU B 38 10.270 16.059 -0.568 1.00 0.00 C ATOM 2537 OE1 GLU B 38 9.809 15.573 -1.588 1.00 0.00 O ATOM 2538 OE2 GLU B 38 11.335 16.650 -0.514 1.00 0.00 O ATOM 0 H GLU B 38 8.952 13.055 2.361 1.00 0.00 H new ATOM 0 HA GLU B 38 7.747 15.570 2.439 1.00 0.00 H new ATOM 0 HB2 GLU B 38 9.079 13.803 0.477 1.00 0.00 H new ATOM 0 HB3 GLU B 38 7.871 14.835 -0.261 1.00 0.00 H new ATOM 0 HG2 GLU B 38 8.899 16.827 0.908 1.00 0.00 H new ATOM 0 HG3 GLU B 38 10.139 15.777 1.566 1.00 0.00 H new ATOM 2545 N GLU B 39 5.476 15.521 1.400 1.00 0.00 N ATOM 2546 CA GLU B 39 4.065 15.461 1.041 1.00 0.00 C ATOM 2547 C GLU B 39 3.909 15.405 -0.473 1.00 0.00 C ATOM 2548 O GLU B 39 2.794 15.421 -0.995 1.00 0.00 O ATOM 2549 CB GLU B 39 3.331 16.686 1.589 1.00 0.00 C ATOM 2550 CG GLU B 39 3.724 17.930 0.786 1.00 0.00 C ATOM 2551 CD GLU B 39 2.922 17.992 -0.511 1.00 0.00 C ATOM 2552 OE1 GLU B 39 1.752 18.330 -0.444 1.00 0.00 O ATOM 2553 OE2 GLU B 39 3.490 17.704 -1.550 1.00 0.00 O ATOM 0 H GLU B 39 5.834 16.463 1.556 1.00 0.00 H new ATOM 0 HA GLU B 39 3.633 14.560 1.477 1.00 0.00 H new ATOM 0 HB2 GLU B 39 2.254 16.531 1.532 1.00 0.00 H new ATOM 0 HB3 GLU B 39 3.578 16.828 2.641 1.00 0.00 H new ATOM 0 HG2 GLU B 39 3.542 18.827 1.378 1.00 0.00 H new ATOM 0 HG3 GLU B 39 4.791 17.906 0.562 1.00 0.00 H new ATOM 2560 N SER B 40 5.037 15.346 -1.172 1.00 0.00 N ATOM 2561 CA SER B 40 5.022 15.296 -2.629 1.00 0.00 C ATOM 2562 C SER B 40 4.703 13.889 -3.125 1.00 0.00 C ATOM 2563 O SER B 40 4.493 13.675 -4.319 1.00 0.00 O ATOM 2564 CB SER B 40 6.377 15.737 -3.181 1.00 0.00 C ATOM 2565 OG SER B 40 6.287 15.877 -4.592 1.00 0.00 O ATOM 0 H SER B 40 5.968 15.332 -0.756 1.00 0.00 H new ATOM 0 HA SER B 40 4.245 15.973 -2.983 1.00 0.00 H new ATOM 0 HB2 SER B 40 6.676 16.682 -2.729 1.00 0.00 H new ATOM 0 HB3 SER B 40 7.143 15.005 -2.925 1.00 0.00 H new ATOM 0 HG SER B 40 5.650 15.222 -4.946 1.00 0.00 H new ATOM 2571 N GLN B 41 4.664 12.933 -2.203 1.00 0.00 N ATOM 2572 CA GLN B 41 4.364 11.555 -2.558 1.00 0.00 C ATOM 2573 C GLN B 41 3.119 11.101 -1.813 1.00 0.00 C ATOM 2574 O GLN B 41 2.365 10.250 -2.284 1.00 0.00 O ATOM 2575 CB GLN B 41 5.542 10.658 -2.187 1.00 0.00 C ATOM 2576 CG GLN B 41 6.523 11.446 -1.323 1.00 0.00 C ATOM 2577 CD GLN B 41 7.810 10.652 -1.140 1.00 0.00 C ATOM 2578 OE1 GLN B 41 7.778 9.352 -1.231 1.00 0.00 O flip ATOM 2579 NE2 GLN B 41 8.871 11.231 -0.907 1.00 0.00 N flip ATOM 0 H GLN B 41 4.836 13.088 -1.210 1.00 0.00 H new ATOM 0 HA GLN B 41 4.189 11.488 -3.632 1.00 0.00 H new ATOM 0 HB2 GLN B 41 5.189 9.779 -1.647 1.00 0.00 H new ATOM 0 HB3 GLN B 41 6.040 10.300 -3.088 1.00 0.00 H new ATOM 0 HG2 GLN B 41 6.742 12.406 -1.790 1.00 0.00 H new ATOM 0 HG3 GLN B 41 6.076 11.658 -0.352 1.00 0.00 H new ATOM 0 HE21 GLN B 41 8.892 12.248 -0.837 1.00 0.00 H new ATOM 0 HE22 GLN B 41 9.729 10.693 -0.784 1.00 0.00 H new ATOM 2588 N ILE B 42 2.921 11.689 -0.643 1.00 0.00 N ATOM 2589 CA ILE B 42 1.783 11.375 0.191 1.00 0.00 C ATOM 2590 C ILE B 42 0.483 11.486 -0.593 1.00 0.00 C ATOM 2591 O ILE B 42 0.374 12.265 -1.540 1.00 0.00 O ATOM 2592 CB ILE B 42 1.766 12.345 1.370 1.00 0.00 C ATOM 2593 CG1 ILE B 42 2.168 11.608 2.645 1.00 0.00 C ATOM 2594 CG2 ILE B 42 0.373 12.944 1.535 1.00 0.00 C ATOM 2595 CD1 ILE B 42 2.571 12.629 3.707 1.00 0.00 C ATOM 0 H ILE B 42 3.545 12.394 -0.251 1.00 0.00 H new ATOM 0 HA ILE B 42 1.869 10.348 0.546 1.00 0.00 H new ATOM 0 HB ILE B 42 2.475 13.150 1.180 1.00 0.00 H new ATOM 0 HG12 ILE B 42 1.339 10.999 3.005 1.00 0.00 H new ATOM 0 HG13 ILE B 42 2.997 10.930 2.442 1.00 0.00 H new ATOM 0 HG21 ILE B 42 0.371 13.634 2.378 1.00 0.00 H new ATOM 0 HG22 ILE B 42 0.098 13.480 0.627 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -0.347 12.146 1.718 1.00 0.00 H new ATOM 0 HD11 ILE B 42 2.859 12.109 4.621 1.00 0.00 H new ATOM 0 HD12 ILE B 42 3.413 13.219 3.344 1.00 0.00 H new ATOM 0 HD13 ILE B 42 1.729 13.289 3.915 1.00 0.00 H new ATOM 2607 N LYS B 43 -0.500 10.704 -0.177 1.00 0.00 N ATOM 2608 CA LYS B 43 -1.808 10.709 -0.820 1.00 0.00 C ATOM 2609 C LYS B 43 -2.900 10.878 0.230 1.00 0.00 C ATOM 2610 O LYS B 43 -3.403 9.900 0.777 1.00 0.00 O ATOM 2611 CB LYS B 43 -2.024 9.400 -1.582 1.00 0.00 C ATOM 2612 CG LYS B 43 -0.891 9.204 -2.594 1.00 0.00 C ATOM 2613 CD LYS B 43 -1.442 8.532 -3.853 1.00 0.00 C ATOM 2614 CE LYS B 43 -0.280 8.015 -4.705 1.00 0.00 C ATOM 2615 NZ LYS B 43 0.328 6.825 -4.046 1.00 0.00 N ATOM 0 H LYS B 43 -0.418 10.055 0.606 1.00 0.00 H new ATOM 0 HA LYS B 43 -1.852 11.541 -1.523 1.00 0.00 H new ATOM 0 HB2 LYS B 43 -2.053 8.562 -0.886 1.00 0.00 H new ATOM 0 HB3 LYS B 43 -2.985 9.420 -2.096 1.00 0.00 H new ATOM 0 HG2 LYS B 43 -0.445 10.166 -2.848 1.00 0.00 H new ATOM 0 HG3 LYS B 43 -0.101 8.592 -2.158 1.00 0.00 H new ATOM 0 HD2 LYS B 43 -2.101 7.708 -3.580 1.00 0.00 H new ATOM 0 HD3 LYS B 43 -2.039 9.242 -4.425 1.00 0.00 H new ATOM 0 HE2 LYS B 43 -0.635 7.751 -5.701 1.00 0.00 H new ATOM 0 HE3 LYS B 43 0.469 8.797 -4.830 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 0.853 6.269 -4.750 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 0.978 7.137 -3.297 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 -0.422 6.237 -3.630 1.00 0.00 H new ATOM 2629 N LEU B 44 -3.249 12.128 0.516 1.00 0.00 N ATOM 2630 CA LEU B 44 -4.271 12.417 1.515 1.00 0.00 C ATOM 2631 C LEU B 44 -5.650 11.975 1.035 1.00 0.00 C ATOM 2632 O LEU B 44 -6.308 12.681 0.272 1.00 0.00 O ATOM 2633 CB LEU B 44 -4.290 13.918 1.819 1.00 0.00 C ATOM 2634 CG LEU B 44 -4.375 14.136 3.331 1.00 0.00 C ATOM 2635 CD1 LEU B 44 -5.578 13.371 3.893 1.00 0.00 C ATOM 2636 CD2 LEU B 44 -3.089 13.632 3.995 1.00 0.00 C ATOM 0 H LEU B 44 -2.842 12.952 0.073 1.00 0.00 H new ATOM 0 HA LEU B 44 -4.028 11.861 2.420 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -3.391 14.390 1.424 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -5.141 14.388 1.326 1.00 0.00 H new ATOM 0 HG LEU B 44 -4.495 15.200 3.537 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -5.637 13.527 4.970 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -6.492 13.734 3.423 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.461 12.307 3.686 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.150 13.788 5.072 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.965 12.569 3.789 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -2.235 14.180 3.597 1.00 0.00 H new ATOM 2648 N ILE B 45 -6.081 10.803 1.491 1.00 0.00 N ATOM 2649 CA ILE B 45 -7.382 10.273 1.109 1.00 0.00 C ATOM 2650 C ILE B 45 -8.425 10.559 2.184 1.00 0.00 C ATOM 2651 O ILE B 45 -8.097 10.980 3.293 1.00 0.00 O ATOM 2652 CB ILE B 45 -7.276 8.763 0.909 1.00 0.00 C ATOM 2653 CG1 ILE B 45 -5.924 8.432 0.284 1.00 0.00 C ATOM 2654 CG2 ILE B 45 -8.399 8.271 -0.005 1.00 0.00 C ATOM 2655 CD1 ILE B 45 -5.557 7.000 0.642 1.00 0.00 C ATOM 0 H ILE B 45 -5.549 10.205 2.123 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.691 10.757 0.183 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.367 8.267 1.875 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.969 8.551 -0.799 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.161 9.120 0.649 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -8.312 7.193 -0.140 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -9.364 8.504 0.446 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -8.323 8.765 -0.974 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -4.592 6.751 0.201 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -5.498 6.900 1.726 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -6.318 6.322 0.256 1.00 0.00 H new ATOM 2667 N TYR B 46 -9.682 10.310 1.842 1.00 0.00 N ATOM 2668 CA TYR B 46 -10.783 10.524 2.770 1.00 0.00 C ATOM 2669 C TYR B 46 -11.845 9.455 2.558 1.00 0.00 C ATOM 2670 O TYR B 46 -12.642 9.533 1.623 1.00 0.00 O ATOM 2671 CB TYR B 46 -11.391 11.910 2.552 1.00 0.00 C ATOM 2672 CG TYR B 46 -12.483 12.160 3.568 1.00 0.00 C ATOM 2673 CD1 TYR B 46 -12.284 11.826 4.914 1.00 0.00 C ATOM 2674 CD2 TYR B 46 -13.696 12.730 3.163 1.00 0.00 C ATOM 2675 CE1 TYR B 46 -13.297 12.062 5.852 1.00 0.00 C ATOM 2676 CE2 TYR B 46 -14.708 12.967 4.100 1.00 0.00 C ATOM 2677 CZ TYR B 46 -14.508 12.632 5.445 1.00 0.00 C ATOM 2678 OH TYR B 46 -15.506 12.865 6.369 1.00 0.00 O ATOM 0 H TYR B 46 -9.964 9.959 0.927 1.00 0.00 H new ATOM 0 HA TYR B 46 -10.406 10.461 3.791 1.00 0.00 H new ATOM 0 HB2 TYR B 46 -10.618 12.674 2.641 1.00 0.00 H new ATOM 0 HB3 TYR B 46 -11.797 11.984 1.543 1.00 0.00 H new ATOM 0 HD1 TYR B 46 -11.349 11.386 5.228 1.00 0.00 H new ATOM 0 HD2 TYR B 46 -13.851 12.987 2.126 1.00 0.00 H new ATOM 0 HE1 TYR B 46 -13.143 11.804 6.889 1.00 0.00 H new ATOM 0 HE2 TYR B 46 -15.643 13.408 3.786 1.00 0.00 H new ATOM 0 HH TYR B 46 -15.748 13.815 6.357 1.00 0.00 H new ATOM 2688 N SER B 47 -11.841 8.445 3.421 1.00 0.00 N ATOM 2689 CA SER B 47 -12.801 7.357 3.303 1.00 0.00 C ATOM 2690 C SER B 47 -12.654 6.675 1.951 1.00 0.00 C ATOM 2691 O SER B 47 -13.643 6.325 1.307 1.00 0.00 O ATOM 2692 CB SER B 47 -14.225 7.892 3.460 1.00 0.00 C ATOM 2693 OG SER B 47 -15.108 6.807 3.715 1.00 0.00 O ATOM 0 H SER B 47 -11.190 8.358 4.202 1.00 0.00 H new ATOM 0 HA SER B 47 -12.605 6.631 4.092 1.00 0.00 H new ATOM 0 HB2 SER B 47 -14.268 8.611 4.278 1.00 0.00 H new ATOM 0 HB3 SER B 47 -14.530 8.419 2.556 1.00 0.00 H new ATOM 0 HG SER B 47 -15.040 6.152 2.989 1.00 0.00 H new ATOM 2699 N GLY B 48 -11.408 6.493 1.525 1.00 0.00 N ATOM 2700 CA GLY B 48 -11.133 5.856 0.245 1.00 0.00 C ATOM 2701 C GLY B 48 -11.402 6.820 -0.905 1.00 0.00 C ATOM 2702 O GLY B 48 -11.799 6.407 -1.995 1.00 0.00 O ATOM 0 H GLY B 48 -10.578 6.776 2.045 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -10.095 5.525 0.213 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -11.755 4.967 0.134 1.00 0.00 H new ATOM 2706 N LYS B 49 -11.186 8.108 -0.653 1.00 0.00 N ATOM 2707 CA LYS B 49 -11.415 9.123 -1.680 1.00 0.00 C ATOM 2708 C LYS B 49 -10.275 10.138 -1.712 1.00 0.00 C ATOM 2709 O LYS B 49 -10.387 11.229 -1.152 1.00 0.00 O ATOM 2710 CB LYS B 49 -12.736 9.847 -1.411 1.00 0.00 C ATOM 2711 CG LYS B 49 -13.075 10.756 -2.596 1.00 0.00 C ATOM 2712 CD LYS B 49 -13.461 9.902 -3.809 1.00 0.00 C ATOM 2713 CE LYS B 49 -12.415 10.073 -4.914 1.00 0.00 C ATOM 2714 NZ LYS B 49 -12.620 9.029 -5.957 1.00 0.00 N ATOM 0 H LYS B 49 -10.857 8.472 0.241 1.00 0.00 H new ATOM 0 HA LYS B 49 -11.460 8.622 -2.647 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -13.535 9.122 -1.256 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -12.659 10.437 -0.498 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -13.896 11.422 -2.332 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -12.219 11.386 -2.840 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -13.531 8.853 -3.520 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -14.444 10.198 -4.176 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -12.497 11.066 -5.357 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -11.412 9.992 -4.496 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -11.759 8.941 -6.534 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -12.825 8.117 -5.500 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -13.419 9.299 -6.566 1.00 0.00 H new ATOM 2728 N VAL B 50 -9.179 9.771 -2.371 1.00 0.00 N ATOM 2729 CA VAL B 50 -8.021 10.656 -2.474 1.00 0.00 C ATOM 2730 C VAL B 50 -8.457 12.117 -2.563 1.00 0.00 C ATOM 2731 O VAL B 50 -8.992 12.553 -3.582 1.00 0.00 O ATOM 2732 CB VAL B 50 -7.199 10.290 -3.711 1.00 0.00 C ATOM 2733 CG1 VAL B 50 -8.082 10.373 -4.959 1.00 0.00 C ATOM 2734 CG2 VAL B 50 -6.029 11.267 -3.850 1.00 0.00 C ATOM 0 H VAL B 50 -9.068 8.872 -2.840 1.00 0.00 H new ATOM 0 HA VAL B 50 -7.413 10.530 -1.578 1.00 0.00 H new ATOM 0 HB VAL B 50 -6.818 9.274 -3.605 1.00 0.00 H new ATOM 0 HG11 VAL B 50 -7.494 10.112 -5.839 1.00 0.00 H new ATOM 0 HG12 VAL B 50 -8.917 9.679 -4.861 1.00 0.00 H new ATOM 0 HG13 VAL B 50 -8.465 11.388 -5.067 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -5.442 11.008 -4.731 1.00 0.00 H new ATOM 0 HG22 VAL B 50 -6.413 12.282 -3.955 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -5.398 11.208 -2.963 1.00 0.00 H new ATOM 2744 N LEU B 51 -8.221 12.868 -1.491 1.00 0.00 N ATOM 2745 CA LEU B 51 -8.591 14.280 -1.459 1.00 0.00 C ATOM 2746 C LEU B 51 -7.829 15.060 -2.523 1.00 0.00 C ATOM 2747 O LEU B 51 -7.211 14.477 -3.414 1.00 0.00 O ATOM 2748 CB LEU B 51 -8.277 14.874 -0.084 1.00 0.00 C ATOM 2749 CG LEU B 51 -9.163 14.222 0.977 1.00 0.00 C ATOM 2750 CD1 LEU B 51 -8.855 14.842 2.341 1.00 0.00 C ATOM 2751 CD2 LEU B 51 -10.635 14.459 0.626 1.00 0.00 C ATOM 0 H LEU B 51 -7.778 12.526 -0.638 1.00 0.00 H new ATOM 0 HA LEU B 51 -9.660 14.355 -1.658 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -7.226 14.716 0.159 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -8.442 15.951 -0.097 1.00 0.00 H new ATOM 0 HG LEU B 51 -8.968 13.150 1.011 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -9.485 14.380 3.101 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -7.807 14.675 2.588 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -9.054 15.913 2.307 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -11.269 13.995 1.382 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -10.834 15.530 0.594 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -10.852 14.021 -0.348 1.00 0.00 H new ATOM 2763 N GLN B 52 -7.875 16.385 -2.420 1.00 0.00 N ATOM 2764 CA GLN B 52 -7.183 17.243 -3.373 1.00 0.00 C ATOM 2765 C GLN B 52 -6.569 18.443 -2.660 1.00 0.00 C ATOM 2766 O GLN B 52 -7.173 19.016 -1.753 1.00 0.00 O ATOM 2767 CB GLN B 52 -8.160 17.732 -4.444 1.00 0.00 C ATOM 2768 CG GLN B 52 -9.351 16.778 -4.524 1.00 0.00 C ATOM 2769 CD GLN B 52 -10.256 17.169 -5.688 1.00 0.00 C ATOM 2770 OE1 GLN B 52 -10.122 18.344 -6.239 1.00 0.00 O flip ATOM 2771 NE2 GLN B 52 -11.107 16.384 -6.105 1.00 0.00 N flip ATOM 0 H GLN B 52 -8.382 16.885 -1.690 1.00 0.00 H new ATOM 0 HA GLN B 52 -6.388 16.664 -3.844 1.00 0.00 H new ATOM 0 HB2 GLN B 52 -8.503 18.739 -4.206 1.00 0.00 H new ATOM 0 HB3 GLN B 52 -7.659 17.786 -5.410 1.00 0.00 H new ATOM 0 HG2 GLN B 52 -8.999 15.754 -4.654 1.00 0.00 H new ATOM 0 HG3 GLN B 52 -9.913 16.806 -3.590 1.00 0.00 H new ATOM 0 HE21 GLN B 52 -11.210 15.466 -5.672 1.00 0.00 H new ATOM 0 HE22 GLN B 52 -11.710 16.651 -6.883 1.00 0.00 H new ATOM 2780 N ASP B 53 -5.367 18.817 -3.078 1.00 0.00 N ATOM 2781 CA ASP B 53 -4.676 19.949 -2.477 1.00 0.00 C ATOM 2782 C ASP B 53 -5.483 21.231 -2.657 1.00 0.00 C ATOM 2783 O ASP B 53 -5.211 22.243 -2.012 1.00 0.00 O ATOM 2784 CB ASP B 53 -3.309 20.124 -3.135 1.00 0.00 C ATOM 2785 CG ASP B 53 -2.491 18.846 -2.986 1.00 0.00 C ATOM 2786 OD1 ASP B 53 -1.981 18.615 -1.902 1.00 0.00 O ATOM 2787 OD2 ASP B 53 -2.386 18.116 -3.958 1.00 0.00 O ATOM 0 H ASP B 53 -4.852 18.355 -3.828 1.00 0.00 H new ATOM 0 HA ASP B 53 -4.556 19.752 -1.412 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -3.433 20.365 -4.191 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -2.780 20.960 -2.677 1.00 0.00 H new ATOM 2792 N SER B 54 -6.466 21.181 -3.547 1.00 0.00 N ATOM 2793 CA SER B 54 -7.296 22.348 -3.819 1.00 0.00 C ATOM 2794 C SER B 54 -8.529 22.377 -2.918 1.00 0.00 C ATOM 2795 O SER B 54 -9.392 23.242 -3.071 1.00 0.00 O ATOM 2796 CB SER B 54 -7.737 22.340 -5.283 1.00 0.00 C ATOM 2797 OG SER B 54 -6.592 22.228 -6.117 1.00 0.00 O ATOM 0 H SER B 54 -6.707 20.351 -4.089 1.00 0.00 H new ATOM 0 HA SER B 54 -6.701 23.238 -3.614 1.00 0.00 H new ATOM 0 HB2 SER B 54 -8.417 21.508 -5.466 1.00 0.00 H new ATOM 0 HB3 SER B 54 -8.283 23.254 -5.516 1.00 0.00 H new ATOM 0 HG SER B 54 -6.871 22.221 -7.056 1.00 0.00 H new ATOM 2803 N LYS B 55 -8.614 21.435 -1.983 1.00 0.00 N ATOM 2804 CA LYS B 55 -9.760 21.390 -1.080 1.00 0.00 C ATOM 2805 C LYS B 55 -9.320 21.565 0.366 1.00 0.00 C ATOM 2806 O LYS B 55 -8.344 20.956 0.807 1.00 0.00 O ATOM 2807 CB LYS B 55 -10.493 20.057 -1.223 1.00 0.00 C ATOM 2808 CG LYS B 55 -11.000 19.909 -2.656 1.00 0.00 C ATOM 2809 CD LYS B 55 -11.725 18.569 -2.809 1.00 0.00 C ATOM 2810 CE LYS B 55 -13.187 18.726 -2.386 1.00 0.00 C ATOM 2811 NZ LYS B 55 -13.833 19.783 -3.214 1.00 0.00 N ATOM 0 H LYS B 55 -7.918 20.705 -1.832 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.429 22.208 -1.348 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -9.824 19.233 -0.975 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -11.328 20.011 -0.524 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -11.675 20.729 -2.900 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -10.166 19.964 -3.355 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -11.669 18.230 -3.843 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -11.239 17.809 -2.198 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -13.715 17.780 -2.507 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -13.245 18.990 -1.330 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -14.751 19.439 -3.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -13.978 20.636 -2.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -13.221 20.013 -4.023 1.00 0.00 H new ATOM 2825 N THR B 56 -10.054 22.388 1.104 1.00 0.00 N ATOM 2826 CA THR B 56 -9.735 22.617 2.505 1.00 0.00 C ATOM 2827 C THR B 56 -10.226 21.445 3.339 1.00 0.00 C ATOM 2828 O THR B 56 -10.313 20.318 2.851 1.00 0.00 O ATOM 2829 CB THR B 56 -10.391 23.909 3.002 1.00 0.00 C ATOM 2830 OG1 THR B 56 -11.788 23.699 3.158 1.00 0.00 O ATOM 2831 CG2 THR B 56 -10.152 25.031 1.994 1.00 0.00 C ATOM 0 H THR B 56 -10.865 22.902 0.760 1.00 0.00 H new ATOM 0 HA THR B 56 -8.654 22.712 2.605 1.00 0.00 H new ATOM 0 HB THR B 56 -9.955 24.190 3.961 1.00 0.00 H new ATOM 0 HG1 THR B 56 -12.209 24.524 3.478 1.00 0.00 H new ATOM 0 HG21 THR B 56 -10.621 25.948 2.352 1.00 0.00 H new ATOM 0 HG22 THR B 56 -9.080 25.193 1.877 1.00 0.00 H new ATOM 0 HG23 THR B 56 -10.584 24.754 1.032 1.00 0.00 H new ATOM 2839 N VAL B 57 -10.564 21.713 4.593 1.00 0.00 N ATOM 2840 CA VAL B 57 -11.065 20.662 5.469 1.00 0.00 C ATOM 2841 C VAL B 57 -12.586 20.640 5.429 1.00 0.00 C ATOM 2842 O VAL B 57 -13.205 19.576 5.424 1.00 0.00 O ATOM 2843 CB VAL B 57 -10.595 20.890 6.904 1.00 0.00 C ATOM 2844 CG1 VAL B 57 -11.525 20.142 7.860 1.00 0.00 C ATOM 2845 CG2 VAL B 57 -9.168 20.359 7.061 1.00 0.00 C ATOM 0 H VAL B 57 -10.502 22.636 5.023 1.00 0.00 H new ATOM 0 HA VAL B 57 -10.676 19.705 5.120 1.00 0.00 H new ATOM 0 HB VAL B 57 -10.613 21.955 7.133 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -11.195 20.300 8.887 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -12.543 20.515 7.744 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -11.501 19.076 7.632 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -8.830 20.521 8.085 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -9.150 19.292 6.837 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -8.506 20.885 6.373 1.00 0.00 H new ATOM 2855 N SER B 58 -13.181 21.826 5.389 1.00 0.00 N ATOM 2856 CA SER B 58 -14.630 21.942 5.338 1.00 0.00 C ATOM 2857 C SER B 58 -15.155 21.268 4.079 1.00 0.00 C ATOM 2858 O SER B 58 -16.191 20.604 4.099 1.00 0.00 O ATOM 2859 CB SER B 58 -15.030 23.413 5.336 1.00 0.00 C ATOM 2860 OG SER B 58 -16.423 23.524 5.598 1.00 0.00 O ATOM 0 H SER B 58 -12.684 22.717 5.391 1.00 0.00 H new ATOM 0 HA SER B 58 -15.059 21.454 6.213 1.00 0.00 H new ATOM 0 HB2 SER B 58 -14.462 23.957 6.091 1.00 0.00 H new ATOM 0 HB3 SER B 58 -14.793 23.864 4.373 1.00 0.00 H new ATOM 0 HG SER B 58 -16.681 24.469 5.599 1.00 0.00 H new ATOM 2866 N GLU B 59 -14.417 21.435 2.987 1.00 0.00 N ATOM 2867 CA GLU B 59 -14.796 20.831 1.721 1.00 0.00 C ATOM 2868 C GLU B 59 -14.509 19.338 1.765 1.00 0.00 C ATOM 2869 O GLU B 59 -15.269 18.528 1.236 1.00 0.00 O ATOM 2870 CB GLU B 59 -14.009 21.478 0.581 1.00 0.00 C ATOM 2871 CG GLU B 59 -14.561 22.878 0.309 1.00 0.00 C ATOM 2872 CD GLU B 59 -15.919 22.779 -0.377 1.00 0.00 C ATOM 2873 OE1 GLU B 59 -15.940 22.513 -1.568 1.00 0.00 O ATOM 2874 OE2 GLU B 59 -16.916 22.972 0.297 1.00 0.00 O ATOM 0 H GLU B 59 -13.557 21.982 2.956 1.00 0.00 H new ATOM 0 HA GLU B 59 -15.861 20.989 1.550 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -12.952 21.537 0.842 1.00 0.00 H new ATOM 0 HB3 GLU B 59 -14.082 20.866 -0.318 1.00 0.00 H new ATOM 0 HG2 GLU B 59 -14.656 23.428 1.245 1.00 0.00 H new ATOM 0 HG3 GLU B 59 -13.867 23.436 -0.319 1.00 0.00 H new ATOM 2881 N CYS B 60 -13.406 18.986 2.417 1.00 0.00 N ATOM 2882 CA CYS B 60 -13.019 17.587 2.548 1.00 0.00 C ATOM 2883 C CYS B 60 -14.159 16.782 3.157 1.00 0.00 C ATOM 2884 O CYS B 60 -14.302 15.588 2.893 1.00 0.00 O ATOM 2885 CB CYS B 60 -11.776 17.469 3.431 1.00 0.00 C ATOM 2886 SG CYS B 60 -11.449 15.724 3.780 1.00 0.00 S ATOM 0 H CYS B 60 -12.768 19.646 2.861 1.00 0.00 H new ATOM 0 HA CYS B 60 -12.794 17.192 1.557 1.00 0.00 H new ATOM 0 HB2 CYS B 60 -10.918 17.918 2.931 1.00 0.00 H new ATOM 0 HB3 CYS B 60 -11.925 18.016 4.362 1.00 0.00 H new ATOM 0 HG CYS B 60 -12.439 15.002 3.346 1.00 0.00 H new ATOM 2892 N GLY B 61 -14.973 17.448 3.970 1.00 0.00 N ATOM 2893 CA GLY B 61 -16.105 16.789 4.610 1.00 0.00 C ATOM 2894 C GLY B 61 -15.743 16.306 6.010 1.00 0.00 C ATOM 2895 O GLY B 61 -16.507 15.573 6.637 1.00 0.00 O ATOM 0 H GLY B 61 -14.871 18.437 4.200 1.00 0.00 H new ATOM 0 HA2 GLY B 61 -16.946 17.480 4.667 1.00 0.00 H new ATOM 0 HA3 GLY B 61 -16.427 15.943 4.003 1.00 0.00 H new ATOM 2899 N LEU B 62 -14.577 16.719 6.500 1.00 0.00 N ATOM 2900 CA LEU B 62 -14.142 16.312 7.829 1.00 0.00 C ATOM 2901 C LEU B 62 -14.906 17.067 8.901 1.00 0.00 C ATOM 2902 O LEU B 62 -15.559 18.075 8.630 1.00 0.00 O ATOM 2903 CB LEU B 62 -12.648 16.575 8.008 1.00 0.00 C ATOM 2904 CG LEU B 62 -11.859 15.716 7.027 1.00 0.00 C ATOM 2905 CD1 LEU B 62 -10.510 16.379 6.734 1.00 0.00 C ATOM 2906 CD2 LEU B 62 -11.627 14.332 7.639 1.00 0.00 C ATOM 0 H LEU B 62 -13.926 17.327 6.003 1.00 0.00 H new ATOM 0 HA LEU B 62 -14.340 15.245 7.929 1.00 0.00 H new ATOM 0 HB2 LEU B 62 -12.431 17.630 7.840 1.00 0.00 H new ATOM 0 HB3 LEU B 62 -12.348 16.347 9.031 1.00 0.00 H new ATOM 0 HG LEU B 62 -12.420 15.615 6.098 1.00 0.00 H new ATOM 0 HD11 LEU B 62 -9.947 15.764 6.032 1.00 0.00 H new ATOM 0 HD12 LEU B 62 -10.676 17.365 6.300 1.00 0.00 H new ATOM 0 HD13 LEU B 62 -9.946 16.481 7.661 1.00 0.00 H new ATOM 0 HD21 LEU B 62 -11.063 13.715 6.940 1.00 0.00 H new ATOM 0 HD22 LEU B 62 -11.065 14.434 8.568 1.00 0.00 H new ATOM 0 HD23 LEU B 62 -12.587 13.860 7.846 1.00 0.00 H new ATOM 2918 N LYS B 63 -14.808 16.572 10.123 1.00 0.00 N ATOM 2919 CA LYS B 63 -15.479 17.195 11.252 1.00 0.00 C ATOM 2920 C LYS B 63 -14.547 17.237 12.460 1.00 0.00 C ATOM 2921 O LYS B 63 -13.331 17.107 12.320 1.00 0.00 O ATOM 2922 CB LYS B 63 -16.752 16.421 11.588 1.00 0.00 C ATOM 2923 CG LYS B 63 -16.406 14.965 11.901 1.00 0.00 C ATOM 2924 CD LYS B 63 -15.817 14.870 13.308 1.00 0.00 C ATOM 2925 CE LYS B 63 -16.303 13.585 13.983 1.00 0.00 C ATOM 2926 NZ LYS B 63 -16.315 12.476 12.990 1.00 0.00 N ATOM 0 H LYS B 63 -14.269 15.739 10.359 1.00 0.00 H new ATOM 0 HA LYS B 63 -15.748 18.218 10.988 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -17.251 16.878 12.443 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -17.448 16.467 10.751 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -17.299 14.344 11.827 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -15.692 14.585 11.170 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -14.728 14.877 13.258 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -16.115 15.737 13.897 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -15.651 13.332 14.819 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -17.303 13.732 14.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -17.236 11.994 13.019 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -16.156 12.861 12.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -15.562 11.797 13.219 1.00 0.00 H new ATOM 2940 N ASP B 64 -15.121 17.423 13.642 1.00 0.00 N ATOM 2941 CA ASP B 64 -14.324 17.485 14.862 1.00 0.00 C ATOM 2942 C ASP B 64 -14.030 16.085 15.391 1.00 0.00 C ATOM 2943 O ASP B 64 -14.937 15.360 15.801 1.00 0.00 O ATOM 2944 CB ASP B 64 -15.065 18.292 15.929 1.00 0.00 C ATOM 2945 CG ASP B 64 -16.527 17.862 15.988 1.00 0.00 C ATOM 2946 OD1 ASP B 64 -17.165 17.855 14.947 1.00 0.00 O ATOM 2947 OD2 ASP B 64 -16.988 17.545 17.072 1.00 0.00 O ATOM 0 H ASP B 64 -16.125 17.533 13.782 1.00 0.00 H new ATOM 0 HA ASP B 64 -13.378 17.973 14.627 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -14.594 18.143 16.901 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -14.999 19.356 15.702 1.00 0.00 H new ATOM 2952 N GLY B 65 -12.752 15.717 15.386 1.00 0.00 N ATOM 2953 CA GLY B 65 -12.341 14.405 15.876 1.00 0.00 C ATOM 2954 C GLY B 65 -12.861 13.280 14.983 1.00 0.00 C ATOM 2955 O GLY B 65 -13.688 12.473 15.407 1.00 0.00 O ATOM 0 H GLY B 65 -11.988 16.304 15.051 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -11.253 14.359 15.923 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -12.711 14.264 16.892 1.00 0.00 H new ATOM 2959 N ASP B 66 -12.364 13.225 13.750 1.00 0.00 N ATOM 2960 CA ASP B 66 -12.782 12.184 12.813 1.00 0.00 C ATOM 2961 C ASP B 66 -11.589 11.327 12.403 1.00 0.00 C ATOM 2962 O ASP B 66 -10.618 11.198 13.150 1.00 0.00 O ATOM 2963 CB ASP B 66 -13.409 12.814 11.565 1.00 0.00 C ATOM 2964 CG ASP B 66 -14.607 11.989 11.106 1.00 0.00 C ATOM 2965 OD1 ASP B 66 -14.724 10.856 11.543 1.00 0.00 O ATOM 2966 OD2 ASP B 66 -15.388 12.501 10.323 1.00 0.00 O ATOM 0 H ASP B 66 -11.678 13.882 13.378 1.00 0.00 H new ATOM 0 HA ASP B 66 -13.521 11.555 13.309 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -13.723 13.835 11.782 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -12.669 12.871 10.766 1.00 0.00 H new ATOM 2971 N GLN B 67 -11.666 10.747 11.209 1.00 0.00 N ATOM 2972 CA GLN B 67 -10.584 9.906 10.709 1.00 0.00 C ATOM 2973 C GLN B 67 -10.342 10.170 9.227 1.00 0.00 C ATOM 2974 O GLN B 67 -11.285 10.285 8.443 1.00 0.00 O ATOM 2975 CB GLN B 67 -10.930 8.431 10.916 1.00 0.00 C ATOM 2976 CG GLN B 67 -11.196 8.170 12.400 1.00 0.00 C ATOM 2977 CD GLN B 67 -11.115 6.675 12.689 1.00 0.00 C ATOM 2978 OE1 GLN B 67 -10.134 6.206 13.267 1.00 0.00 O ATOM 2979 NE2 GLN B 67 -12.092 5.894 12.320 1.00 0.00 N ATOM 0 H GLN B 67 -12.459 10.843 10.575 1.00 0.00 H new ATOM 0 HA GLN B 67 -9.677 10.147 11.263 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -11.808 8.167 10.327 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -10.111 7.802 10.567 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -10.468 8.706 13.008 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -12.181 8.549 12.674 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -12.904 6.284 11.841 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -12.044 4.893 12.510 1.00 0.00 H new ATOM 2988 N VAL B 68 -9.071 10.261 8.851 1.00 0.00 N ATOM 2989 CA VAL B 68 -8.705 10.507 7.464 1.00 0.00 C ATOM 2990 C VAL B 68 -7.793 9.394 6.963 1.00 0.00 C ATOM 2991 O VAL B 68 -6.925 8.917 7.693 1.00 0.00 O ATOM 2992 CB VAL B 68 -7.986 11.853 7.345 1.00 0.00 C ATOM 2993 CG1 VAL B 68 -8.241 12.455 5.961 1.00 0.00 C ATOM 2994 CG2 VAL B 68 -8.513 12.808 8.421 1.00 0.00 C ATOM 0 H VAL B 68 -8.279 10.168 9.487 1.00 0.00 H new ATOM 0 HA VAL B 68 -9.611 10.529 6.858 1.00 0.00 H new ATOM 0 HB VAL B 68 -6.915 11.703 7.481 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -7.727 13.413 5.881 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -7.866 11.777 5.195 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -9.312 12.604 5.821 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -8.002 13.767 8.338 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -9.584 12.954 8.284 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -8.328 12.383 9.407 1.00 0.00 H new ATOM 3004 N VAL B 69 -7.990 8.983 5.716 1.00 0.00 N ATOM 3005 CA VAL B 69 -7.172 7.925 5.140 1.00 0.00 C ATOM 3006 C VAL B 69 -6.107 8.522 4.232 1.00 0.00 C ATOM 3007 O VAL B 69 -6.394 9.400 3.426 1.00 0.00 O ATOM 3008 CB VAL B 69 -8.049 6.958 4.344 1.00 0.00 C ATOM 3009 CG1 VAL B 69 -7.168 5.894 3.682 1.00 0.00 C ATOM 3010 CG2 VAL B 69 -9.044 6.280 5.289 1.00 0.00 C ATOM 0 H VAL B 69 -8.701 9.362 5.091 1.00 0.00 H new ATOM 0 HA VAL B 69 -6.684 7.380 5.948 1.00 0.00 H new ATOM 0 HB VAL B 69 -8.592 7.508 3.575 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -7.794 5.205 3.115 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -6.458 6.376 3.010 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -6.625 5.343 4.449 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -9.670 5.590 4.724 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -8.500 5.730 6.057 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -9.671 7.036 5.760 1.00 0.00 H new ATOM 3020 N PHE B 70 -4.875 8.046 4.375 1.00 0.00 N ATOM 3021 CA PHE B 70 -3.776 8.550 3.560 1.00 0.00 C ATOM 3022 C PHE B 70 -2.713 7.473 3.363 1.00 0.00 C ATOM 3023 O PHE B 70 -2.776 6.405 3.972 1.00 0.00 O ATOM 3024 CB PHE B 70 -3.147 9.774 4.230 1.00 0.00 C ATOM 3025 CG PHE B 70 -2.095 9.328 5.217 1.00 0.00 C ATOM 3026 CD1 PHE B 70 -2.470 8.900 6.495 1.00 0.00 C ATOM 3027 CD2 PHE B 70 -0.743 9.343 4.852 1.00 0.00 C ATOM 3028 CE1 PHE B 70 -1.495 8.486 7.409 1.00 0.00 C ATOM 3029 CE2 PHE B 70 0.233 8.929 5.766 1.00 0.00 C ATOM 3030 CZ PHE B 70 -0.143 8.500 7.044 1.00 0.00 C ATOM 0 H PHE B 70 -4.614 7.319 5.041 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.174 8.833 2.585 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -2.701 10.424 3.477 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -3.914 10.356 4.740 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.513 8.889 6.776 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.453 9.674 3.866 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -1.785 8.156 8.396 1.00 0.00 H new ATOM 0 HE2 PHE B 70 1.276 8.941 5.485 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.610 8.180 7.749 1.00 0.00 H new ATOM 3040 N MET B 71 -1.739 7.764 2.508 1.00 0.00 N ATOM 3041 CA MET B 71 -0.663 6.819 2.235 1.00 0.00 C ATOM 3042 C MET B 71 0.584 7.555 1.754 1.00 0.00 C ATOM 3043 O MET B 71 0.498 8.677 1.257 1.00 0.00 O ATOM 3044 CB MET B 71 -1.108 5.811 1.171 1.00 0.00 C ATOM 3045 CG MET B 71 -0.828 4.389 1.661 1.00 0.00 C ATOM 3046 SD MET B 71 -1.352 3.201 0.400 1.00 0.00 S ATOM 3047 CE MET B 71 -0.168 3.690 -0.878 1.00 0.00 C ATOM 0 H MET B 71 -1.672 8.643 1.994 1.00 0.00 H new ATOM 0 HA MET B 71 -0.426 6.289 3.158 1.00 0.00 H new ATOM 0 HB2 MET B 71 -2.171 5.932 0.963 1.00 0.00 H new ATOM 0 HB3 MET B 71 -0.578 5.995 0.237 1.00 0.00 H new ATOM 0 HG2 MET B 71 0.235 4.268 1.870 1.00 0.00 H new ATOM 0 HG3 MET B 71 -1.360 4.203 2.594 1.00 0.00 H new ATOM 0 HE1 MET B 71 0.262 2.799 -1.335 1.00 0.00 H new ATOM 0 HE2 MET B 71 -0.678 4.279 -1.640 1.00 0.00 H new ATOM 0 HE3 MET B 71 0.626 4.287 -0.429 1.00 0.00 H new ATOM 3057 N VAL B 72 1.740 6.916 1.905 1.00 0.00 N ATOM 3058 CA VAL B 72 2.998 7.521 1.482 1.00 0.00 C ATOM 3059 C VAL B 72 3.583 6.765 0.295 1.00 0.00 C ATOM 3060 O VAL B 72 3.459 5.543 0.204 1.00 0.00 O ATOM 3061 CB VAL B 72 3.999 7.510 2.639 1.00 0.00 C ATOM 3062 CG1 VAL B 72 5.179 8.425 2.303 1.00 0.00 C ATOM 3063 CG2 VAL B 72 3.312 8.015 3.910 1.00 0.00 C ATOM 0 H VAL B 72 1.832 5.986 2.314 1.00 0.00 H new ATOM 0 HA VAL B 72 2.801 8.550 1.182 1.00 0.00 H new ATOM 0 HB VAL B 72 4.360 6.494 2.797 1.00 0.00 H new ATOM 0 HG11 VAL B 72 5.892 8.417 3.127 1.00 0.00 H new ATOM 0 HG12 VAL B 72 5.669 8.069 1.396 1.00 0.00 H new ATOM 0 HG13 VAL B 72 4.818 9.441 2.145 1.00 0.00 H new ATOM 0 HG21 VAL B 72 4.024 8.008 4.736 1.00 0.00 H new ATOM 0 HG22 VAL B 72 2.952 9.031 3.750 1.00 0.00 H new ATOM 0 HG23 VAL B 72 2.470 7.366 4.151 1.00 0.00 H new ATOM 3073 N SER B 73 4.220 7.496 -0.614 1.00 0.00 N ATOM 3074 CA SER B 73 4.819 6.878 -1.792 1.00 0.00 C ATOM 3075 C SER B 73 6.334 6.782 -1.636 1.00 0.00 C ATOM 3076 O SER B 73 6.893 7.223 -0.634 1.00 0.00 O ATOM 3077 CB SER B 73 4.480 7.694 -3.041 1.00 0.00 C ATOM 3078 OG SER B 73 3.966 6.826 -4.043 1.00 0.00 O ATOM 0 H SER B 73 4.334 8.508 -0.559 1.00 0.00 H new ATOM 0 HA SER B 73 4.413 5.872 -1.897 1.00 0.00 H new ATOM 0 HB2 SER B 73 3.747 8.463 -2.799 1.00 0.00 H new ATOM 0 HB3 SER B 73 5.370 8.206 -3.408 1.00 0.00 H new ATOM 0 HG SER B 73 3.175 6.362 -3.699 1.00 0.00 H new ATOM 3084 N GLN B 74 6.990 6.202 -2.637 1.00 0.00 N ATOM 3085 CA GLN B 74 8.441 6.051 -2.603 1.00 0.00 C ATOM 3086 C GLN B 74 9.098 6.979 -3.619 1.00 0.00 C ATOM 3087 O GLN B 74 10.285 7.289 -3.515 1.00 0.00 O ATOM 3088 CB GLN B 74 8.823 4.602 -2.909 1.00 0.00 C ATOM 3089 CG GLN B 74 8.212 3.678 -1.855 1.00 0.00 C ATOM 3090 CD GLN B 74 8.996 3.782 -0.553 1.00 0.00 C ATOM 3091 OE1 GLN B 74 8.591 4.500 0.363 1.00 0.00 O ATOM 3092 NE2 GLN B 74 10.104 3.106 -0.412 1.00 0.00 N ATOM 0 H GLN B 74 6.544 5.831 -3.476 1.00 0.00 H new ATOM 0 HA GLN B 74 8.793 6.315 -1.606 1.00 0.00 H new ATOM 0 HB2 GLN B 74 8.468 4.323 -3.901 1.00 0.00 H new ATOM 0 HB3 GLN B 74 9.908 4.495 -2.917 1.00 0.00 H new ATOM 0 HG2 GLN B 74 7.170 3.947 -1.684 1.00 0.00 H new ATOM 0 HG3 GLN B 74 8.221 2.649 -2.213 1.00 0.00 H new ATOM 0 HE21 GLN B 74 10.439 2.512 -1.170 1.00 0.00 H new ATOM 0 HE22 GLN B 74 10.635 3.172 0.457 1.00 0.00 H new ATOM 3101 N LYS B 75 8.318 7.418 -4.602 1.00 0.00 N ATOM 3102 CA LYS B 75 8.836 8.309 -5.633 1.00 0.00 C ATOM 3103 C LYS B 75 9.153 9.682 -5.046 1.00 0.00 C ATOM 3104 O LYS B 75 8.260 10.389 -4.580 1.00 0.00 O ATOM 3105 CB LYS B 75 7.809 8.459 -6.758 1.00 0.00 C ATOM 3106 CG LYS B 75 7.597 7.106 -7.445 1.00 0.00 C ATOM 3107 CD LYS B 75 6.285 6.485 -6.960 1.00 0.00 C ATOM 3108 CE LYS B 75 5.106 7.166 -7.660 1.00 0.00 C ATOM 3109 NZ LYS B 75 4.741 6.395 -8.881 1.00 0.00 N ATOM 0 H LYS B 75 7.333 7.174 -4.706 1.00 0.00 H new ATOM 0 HA LYS B 75 9.753 7.876 -6.033 1.00 0.00 H new ATOM 0 HB2 LYS B 75 6.865 8.826 -6.355 1.00 0.00 H new ATOM 0 HB3 LYS B 75 8.154 9.196 -7.483 1.00 0.00 H new ATOM 0 HG2 LYS B 75 7.572 7.236 -8.527 1.00 0.00 H new ATOM 0 HG3 LYS B 75 8.431 6.439 -7.223 1.00 0.00 H new ATOM 0 HD2 LYS B 75 6.277 5.415 -7.170 1.00 0.00 H new ATOM 0 HD3 LYS B 75 6.195 6.598 -5.880 1.00 0.00 H new ATOM 0 HE2 LYS B 75 4.252 7.224 -6.985 1.00 0.00 H new ATOM 0 HE3 LYS B 75 5.370 8.189 -7.928 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 3.706 6.374 -8.982 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 5.162 6.849 -9.717 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 5.100 5.423 -8.798 1.00 0.00 H new