USER MOD reduce.3.24.130724 H: found=0, std=0, add=594, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : B 411 MET CE :methyl 137:sc= -2.3! (180deg=-4.75!) USER MOD Single : B 413 LYS NZ :NH3+ -175:sc= -0.607 (180deg=-0.662) USER MOD Single : B 415 GLN :FLIP amide:sc= -1.97 F(o=-5.4!,f=-2) USER MOD Single : B 417 GLN :FLIP amide:sc= -2.21! C(o=-3.2!,f=-2.2!) USER MOD Single : B 418 HIS :FLIP no HD1:sc= -0.353 F(o=-1.1,f=-0.35) USER MOD Single : B 420 TYR OH : rot 85:sc= 0.279 USER MOD Single : B 421 THR OG1 : rot 180:sc= 0 USER MOD Single : B 423 THR OG1 : rot 46:sc= 0.444 USER MOD Single : B 425 THR OG1 : rot 180:sc= 0 USER MOD Single : B 429 GLN : amide:sc= -0.0797 X(o=-0.08,f=0) USER MOD Single : B 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 453 MET CE :methyl 142:sc= -3.03 (180deg=-5.74!) USER MOD Single : B 456 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 458 SER OG : rot 180:sc= 0 USER MOD Single : B 461 ASN :FLIP amide:sc= 0.00216 F(o=-1.1,f=0.0022) USER MOD Single : B 462 GLN :FLIP amide:sc= -0.125 F(o=-2.3,f=-0.12) USER MOD Single : B 463 HIS : no HD1:sc= -0.0443 X(o=-0.044,f=-0.044) USER MOD Single : B 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 465 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 468 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 469 CYS SG : rot 100:sc= -4.78! USER MOD Single : B 476 ASN : amide:sc= -2.11! C(o=-2.1!,f=-9.5!) USER MOD Single : B 478 THR OG1 : rot -88:sc= -0.727 USER MOD ----------------------------------------------------------------- ATOM 67 N PRO A 59 4.338 -7.719 -8.992 1.00 0.00 N ATOM 68 CA PRO A 59 4.951 -9.034 -9.071 1.00 0.00 C ATOM 69 C PRO A 59 5.716 -9.205 -10.385 1.00 0.00 C ATOM 70 O PRO A 59 5.621 -8.363 -11.276 1.00 0.00 O ATOM 71 CB PRO A 59 3.798 -10.015 -8.924 1.00 0.00 C ATOM 72 CG PRO A 59 2.537 -9.225 -9.234 1.00 0.00 C ATOM 73 CD PRO A 59 2.895 -7.748 -9.213 1.00 0.00 C ATOM 0 HA PRO A 59 5.698 -9.197 -8.294 1.00 0.00 H new ATOM 0 HB2 PRO A 59 3.911 -10.856 -9.609 1.00 0.00 H new ATOM 0 HB3 PRO A 59 3.762 -10.428 -7.916 1.00 0.00 H new ATOM 0 HG2 PRO A 59 2.140 -9.508 -10.209 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.761 -9.440 -8.499 1.00 0.00 H new ATOM 0 HD2 PRO A 59 2.628 -7.263 -10.152 1.00 0.00 H new ATOM 0 HD3 PRO A 59 2.362 -7.223 -8.420 1.00 0.00 H new ATOM 81 N PRO A 60 6.478 -10.329 -10.464 1.00 0.00 N ATOM 82 CA PRO A 60 7.259 -10.621 -11.654 1.00 0.00 C ATOM 83 C PRO A 60 6.361 -11.107 -12.794 1.00 0.00 C ATOM 84 O PRO A 60 5.231 -11.531 -12.560 1.00 0.00 O ATOM 85 CB PRO A 60 8.275 -11.662 -11.212 1.00 0.00 C ATOM 86 CG PRO A 60 7.730 -12.254 -9.923 1.00 0.00 C ATOM 87 CD PRO A 60 6.616 -11.347 -9.427 1.00 0.00 C ATOM 0 HA PRO A 60 7.760 -9.740 -12.055 1.00 0.00 H new ATOM 0 HB2 PRO A 60 8.401 -12.432 -11.973 1.00 0.00 H new ATOM 0 HB3 PRO A 60 9.253 -11.209 -11.051 1.00 0.00 H new ATOM 0 HG2 PRO A 60 7.353 -13.262 -10.096 1.00 0.00 H new ATOM 0 HG3 PRO A 60 8.519 -12.333 -9.175 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.687 -11.900 -9.289 1.00 0.00 H new ATOM 0 HD3 PRO A 60 6.867 -10.901 -8.465 1.00 0.00 H new ATOM 95 N LEU A 61 6.899 -11.028 -14.002 1.00 0.00 N ATOM 96 CA LEU A 61 6.160 -11.455 -15.178 1.00 0.00 C ATOM 97 C LEU A 61 5.785 -12.931 -15.033 1.00 0.00 C ATOM 98 O LEU A 61 6.639 -13.766 -14.738 1.00 0.00 O ATOM 99 CB LEU A 61 6.952 -11.145 -16.450 1.00 0.00 C ATOM 100 CG LEU A 61 6.137 -10.637 -17.641 1.00 0.00 C ATOM 101 CD1 LEU A 61 5.119 -11.685 -18.095 1.00 0.00 C ATOM 102 CD2 LEU A 61 5.474 -9.296 -17.321 1.00 0.00 C ATOM 0 H LEU A 61 7.837 -10.675 -14.192 1.00 0.00 H new ATOM 0 HA LEU A 61 5.228 -10.896 -15.265 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.710 -10.400 -16.210 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.479 -12.049 -16.755 1.00 0.00 H new ATOM 0 HG LEU A 61 6.819 -10.468 -18.474 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.553 -11.299 -18.943 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.641 -12.595 -18.391 1.00 0.00 H new ATOM 0 HD13 LEU A 61 4.437 -11.909 -17.275 1.00 0.00 H new ATOM 0 HD21 LEU A 61 4.901 -8.958 -18.185 1.00 0.00 H new ATOM 0 HD22 LEU A 61 4.807 -9.414 -16.467 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.241 -8.559 -17.083 1.00 0.00 H new ATOM 114 N SER A 62 4.507 -13.208 -15.245 1.00 0.00 N ATOM 115 CA SER A 62 4.009 -14.569 -15.142 1.00 0.00 C ATOM 116 C SER A 62 4.057 -15.250 -16.511 1.00 0.00 C ATOM 117 O SER A 62 4.081 -14.578 -17.542 1.00 0.00 O ATOM 118 CB SER A 62 2.583 -14.593 -14.587 1.00 0.00 C ATOM 119 OG SER A 62 1.634 -14.110 -15.534 1.00 0.00 O ATOM 0 H SER A 62 3.801 -12.513 -15.488 1.00 0.00 H new ATOM 0 HA SER A 62 4.649 -15.115 -14.449 1.00 0.00 H new ATOM 0 HB2 SER A 62 2.323 -15.612 -14.300 1.00 0.00 H new ATOM 0 HB3 SER A 62 2.535 -13.985 -13.683 1.00 0.00 H new ATOM 0 HG SER A 62 0.736 -14.143 -15.143 1.00 0.00 H new ATOM 125 N PRO A 63 4.070 -16.609 -16.478 1.00 0.00 N ATOM 126 CA PRO A 63 4.114 -17.388 -17.704 1.00 0.00 C ATOM 127 C PRO A 63 2.755 -17.383 -18.406 1.00 0.00 C ATOM 128 O PRO A 63 1.768 -16.898 -17.853 1.00 0.00 O ATOM 129 CB PRO A 63 4.555 -18.777 -17.272 1.00 0.00 C ATOM 130 CG PRO A 63 4.292 -18.851 -15.776 1.00 0.00 C ATOM 131 CD PRO A 63 4.042 -17.438 -15.276 1.00 0.00 C ATOM 0 HA PRO A 63 4.805 -16.976 -18.439 1.00 0.00 H new ATOM 0 HB2 PRO A 63 3.998 -19.547 -17.805 1.00 0.00 H new ATOM 0 HB3 PRO A 63 5.611 -18.938 -17.492 1.00 0.00 H new ATOM 0 HG2 PRO A 63 3.430 -19.486 -15.571 1.00 0.00 H new ATOM 0 HG3 PRO A 63 5.144 -19.293 -15.260 1.00 0.00 H new ATOM 0 HD2 PRO A 63 3.082 -17.363 -14.765 1.00 0.00 H new ATOM 0 HD3 PRO A 63 4.807 -17.129 -14.564 1.00 0.00 H new ATOM 279 N LEU B 406 -24.682 -17.501 -12.428 1.00 0.00 N ATOM 280 CA LEU B 406 -23.364 -17.194 -11.898 1.00 0.00 C ATOM 281 C LEU B 406 -22.401 -18.331 -12.248 1.00 0.00 C ATOM 282 O LEU B 406 -22.831 -19.446 -12.537 1.00 0.00 O ATOM 283 CB LEU B 406 -23.445 -16.895 -10.400 1.00 0.00 C ATOM 284 CG LEU B 406 -22.808 -17.933 -9.474 1.00 0.00 C ATOM 285 CD1 LEU B 406 -22.458 -17.316 -8.118 1.00 0.00 C ATOM 286 CD2 LEU B 406 -23.706 -19.163 -9.329 1.00 0.00 C ATOM 0 HA LEU B 406 -22.969 -16.288 -12.359 1.00 0.00 H new ATOM 0 HB2 LEU B 406 -22.969 -15.932 -10.216 1.00 0.00 H new ATOM 0 HB3 LEU B 406 -24.495 -16.789 -10.127 1.00 0.00 H new ATOM 0 HG LEU B 406 -21.875 -18.268 -9.927 1.00 0.00 H new ATOM 0 HD11 LEU B 406 -22.007 -18.075 -7.479 1.00 0.00 H new ATOM 0 HD12 LEU B 406 -21.753 -16.497 -8.262 1.00 0.00 H new ATOM 0 HD13 LEU B 406 -23.364 -16.936 -7.646 1.00 0.00 H new ATOM 0 HD21 LEU B 406 -23.230 -19.885 -8.666 1.00 0.00 H new ATOM 0 HD22 LEU B 406 -24.667 -18.865 -8.910 1.00 0.00 H new ATOM 0 HD23 LEU B 406 -23.862 -19.617 -10.308 1.00 0.00 H new ATOM 298 N PRO B 407 -21.083 -18.000 -12.207 1.00 0.00 N ATOM 299 CA PRO B 407 -20.055 -18.980 -12.516 1.00 0.00 C ATOM 300 C PRO B 407 -19.878 -19.970 -11.363 1.00 0.00 C ATOM 301 O PRO B 407 -19.797 -19.569 -10.203 1.00 0.00 O ATOM 302 CB PRO B 407 -18.804 -18.163 -12.796 1.00 0.00 C ATOM 303 CG PRO B 407 -19.054 -16.795 -12.184 1.00 0.00 C ATOM 304 CD PRO B 407 -20.537 -16.689 -11.868 1.00 0.00 C ATOM 0 HA PRO B 407 -20.309 -19.600 -13.375 1.00 0.00 H new ATOM 0 HB2 PRO B 407 -17.924 -18.633 -12.356 1.00 0.00 H new ATOM 0 HB3 PRO B 407 -18.621 -18.084 -13.868 1.00 0.00 H new ATOM 0 HG2 PRO B 407 -18.461 -16.668 -11.278 1.00 0.00 H new ATOM 0 HG3 PRO B 407 -18.754 -16.007 -12.875 1.00 0.00 H new ATOM 0 HD2 PRO B 407 -20.702 -16.451 -10.817 1.00 0.00 H new ATOM 0 HD3 PRO B 407 -21.011 -15.900 -12.452 1.00 0.00 H new ATOM 312 N PRO B 408 -19.820 -21.277 -11.732 1.00 0.00 N ATOM 313 CA PRO B 408 -19.653 -22.328 -10.742 1.00 0.00 C ATOM 314 C PRO B 408 -18.212 -22.373 -10.229 1.00 0.00 C ATOM 315 O PRO B 408 -17.273 -22.128 -10.984 1.00 0.00 O ATOM 316 CB PRO B 408 -20.072 -23.606 -11.449 1.00 0.00 C ATOM 317 CG PRO B 408 -20.014 -23.297 -12.937 1.00 0.00 C ATOM 318 CD PRO B 408 -19.913 -21.789 -13.096 1.00 0.00 C ATOM 0 HA PRO B 408 -20.259 -22.166 -9.850 1.00 0.00 H new ATOM 0 HB2 PRO B 408 -19.405 -24.430 -11.195 1.00 0.00 H new ATOM 0 HB3 PRO B 408 -21.077 -23.906 -11.151 1.00 0.00 H new ATOM 0 HG2 PRO B 408 -19.155 -23.788 -13.396 1.00 0.00 H new ATOM 0 HG3 PRO B 408 -20.904 -23.675 -13.440 1.00 0.00 H new ATOM 0 HD2 PRO B 408 -19.038 -21.511 -13.684 1.00 0.00 H new ATOM 0 HD3 PRO B 408 -20.785 -21.386 -13.611 1.00 0.00 H new ATOM 326 N GLY B 409 -18.083 -22.689 -8.948 1.00 0.00 N ATOM 327 CA GLY B 409 -16.773 -22.770 -8.326 1.00 0.00 C ATOM 328 C GLY B 409 -16.328 -21.402 -7.805 1.00 0.00 C ATOM 329 O GLY B 409 -15.480 -21.317 -6.917 1.00 0.00 O ATOM 0 H GLY B 409 -18.864 -22.892 -8.325 1.00 0.00 H new ATOM 0 HA2 GLY B 409 -16.801 -23.485 -7.504 1.00 0.00 H new ATOM 0 HA3 GLY B 409 -16.046 -23.142 -9.048 1.00 0.00 H new ATOM 333 N PHE B 410 -16.920 -20.365 -8.378 1.00 0.00 N ATOM 334 CA PHE B 410 -16.595 -19.005 -7.983 1.00 0.00 C ATOM 335 C PHE B 410 -16.329 -18.920 -6.479 1.00 0.00 C ATOM 336 O PHE B 410 -16.916 -19.667 -5.697 1.00 0.00 O ATOM 337 CB PHE B 410 -17.809 -18.138 -8.323 1.00 0.00 C ATOM 338 CG PHE B 410 -17.885 -16.833 -7.527 1.00 0.00 C ATOM 339 CD1 PHE B 410 -17.115 -15.772 -7.887 1.00 0.00 C ATOM 340 CD2 PHE B 410 -18.723 -16.735 -6.460 1.00 0.00 C ATOM 341 CE1 PHE B 410 -17.185 -14.561 -7.149 1.00 0.00 C ATOM 342 CE2 PHE B 410 -18.793 -15.524 -5.722 1.00 0.00 C ATOM 343 CZ PHE B 410 -18.023 -14.463 -6.082 1.00 0.00 C ATOM 0 H PHE B 410 -17.623 -20.439 -9.113 1.00 0.00 H new ATOM 0 HA PHE B 410 -15.697 -18.671 -8.504 1.00 0.00 H new ATOM 0 HB2 PHE B 410 -17.787 -17.902 -9.387 1.00 0.00 H new ATOM 0 HB3 PHE B 410 -18.716 -18.715 -8.143 1.00 0.00 H new ATOM 0 HD1 PHE B 410 -16.450 -15.850 -8.734 1.00 0.00 H new ATOM 0 HD2 PHE B 410 -19.335 -17.578 -6.174 1.00 0.00 H new ATOM 0 HE1 PHE B 410 -16.573 -13.718 -7.435 1.00 0.00 H new ATOM 0 HE2 PHE B 410 -19.458 -15.446 -4.875 1.00 0.00 H new ATOM 0 HZ PHE B 410 -18.077 -13.542 -5.521 1.00 0.00 H new ATOM 353 N MET B 411 -15.442 -18.004 -6.118 1.00 0.00 N ATOM 354 CA MET B 411 -15.091 -17.812 -4.721 1.00 0.00 C ATOM 355 C MET B 411 -15.675 -16.503 -4.184 1.00 0.00 C ATOM 356 O MET B 411 -16.609 -16.518 -3.384 1.00 0.00 O ATOM 357 CB MET B 411 -13.568 -17.789 -4.576 1.00 0.00 C ATOM 358 CG MET B 411 -12.946 -19.078 -5.115 1.00 0.00 C ATOM 359 SD MET B 411 -11.259 -19.226 -4.549 1.00 0.00 S ATOM 360 CE MET B 411 -10.443 -19.576 -6.097 1.00 0.00 C ATOM 0 H MET B 411 -14.956 -17.387 -6.769 1.00 0.00 H new ATOM 0 HA MET B 411 -15.507 -18.638 -4.144 1.00 0.00 H new ATOM 0 HB2 MET B 411 -13.161 -16.932 -5.113 1.00 0.00 H new ATOM 0 HB3 MET B 411 -13.301 -17.663 -3.527 1.00 0.00 H new ATOM 0 HG2 MET B 411 -13.527 -19.938 -4.782 1.00 0.00 H new ATOM 0 HG3 MET B 411 -12.974 -19.077 -6.205 1.00 0.00 H new ATOM 0 HE1 MET B 411 -9.521 -18.998 -6.161 1.00 0.00 H new ATOM 0 HE2 MET B 411 -10.210 -20.639 -6.153 1.00 0.00 H new ATOM 0 HE3 MET B 411 -11.099 -19.304 -6.924 1.00 0.00 H new ATOM 370 N PHE B 412 -15.101 -15.402 -4.647 1.00 0.00 N ATOM 371 CA PHE B 412 -15.552 -14.088 -4.222 1.00 0.00 C ATOM 372 C PHE B 412 -15.123 -13.012 -5.222 1.00 0.00 C ATOM 373 O PHE B 412 -14.478 -13.313 -6.225 1.00 0.00 O ATOM 374 CB PHE B 412 -14.892 -13.804 -2.871 1.00 0.00 C ATOM 375 CG PHE B 412 -13.396 -14.120 -2.830 1.00 0.00 C ATOM 376 CD1 PHE B 412 -12.495 -13.202 -3.272 1.00 0.00 C ATOM 377 CD2 PHE B 412 -12.967 -15.318 -2.352 1.00 0.00 C ATOM 378 CE1 PHE B 412 -11.106 -13.496 -3.235 1.00 0.00 C ATOM 379 CE2 PHE B 412 -11.578 -15.612 -2.314 1.00 0.00 C ATOM 380 CZ PHE B 412 -10.677 -14.694 -2.756 1.00 0.00 C ATOM 0 H PHE B 412 -14.328 -15.393 -5.312 1.00 0.00 H new ATOM 0 HA PHE B 412 -16.640 -14.071 -4.155 1.00 0.00 H new ATOM 0 HB2 PHE B 412 -15.038 -12.753 -2.621 1.00 0.00 H new ATOM 0 HB3 PHE B 412 -15.397 -14.388 -2.102 1.00 0.00 H new ATOM 0 HD1 PHE B 412 -12.836 -12.250 -3.651 1.00 0.00 H new ATOM 0 HD2 PHE B 412 -13.683 -16.047 -2.001 1.00 0.00 H new ATOM 0 HE1 PHE B 412 -10.390 -12.768 -3.587 1.00 0.00 H new ATOM 0 HE2 PHE B 412 -11.237 -16.564 -1.934 1.00 0.00 H new ATOM 0 HZ PHE B 412 -9.621 -14.917 -2.726 1.00 0.00 H new ATOM 390 N LYS B 413 -15.499 -11.779 -4.913 1.00 0.00 N ATOM 391 CA LYS B 413 -15.163 -10.657 -5.772 1.00 0.00 C ATOM 392 C LYS B 413 -13.955 -9.919 -5.190 1.00 0.00 C ATOM 393 O LYS B 413 -13.820 -9.806 -3.973 1.00 0.00 O ATOM 394 CB LYS B 413 -16.385 -9.762 -5.988 1.00 0.00 C ATOM 395 CG LYS B 413 -16.388 -9.169 -7.399 1.00 0.00 C ATOM 396 CD LYS B 413 -16.775 -7.689 -7.371 1.00 0.00 C ATOM 397 CE LYS B 413 -15.582 -6.819 -6.970 1.00 0.00 C ATOM 398 NZ LYS B 413 -16.025 -5.698 -6.110 1.00 0.00 N ATOM 0 H LYS B 413 -16.033 -11.533 -4.080 1.00 0.00 H new ATOM 0 HA LYS B 413 -14.876 -11.009 -6.763 1.00 0.00 H new ATOM 0 HB2 LYS B 413 -17.296 -10.340 -5.831 1.00 0.00 H new ATOM 0 HB3 LYS B 413 -16.386 -8.958 -5.252 1.00 0.00 H new ATOM 0 HG2 LYS B 413 -15.401 -9.282 -7.847 1.00 0.00 H new ATOM 0 HG3 LYS B 413 -17.088 -9.720 -8.027 1.00 0.00 H new ATOM 0 HD2 LYS B 413 -17.138 -7.385 -8.353 1.00 0.00 H new ATOM 0 HD3 LYS B 413 -17.594 -7.537 -6.668 1.00 0.00 H new ATOM 0 HE2 LYS B 413 -14.846 -7.423 -6.440 1.00 0.00 H new ATOM 0 HE3 LYS B 413 -15.092 -6.429 -7.862 1.00 0.00 H new ATOM 0 HZ1 LYS B 413 -15.219 -5.070 -5.916 1.00 0.00 H new ATOM 0 HZ2 LYS B 413 -16.773 -5.162 -6.596 1.00 0.00 H new ATOM 0 HZ3 LYS B 413 -16.395 -6.073 -5.213 1.00 0.00 H new ATOM 412 N VAL B 414 -13.108 -9.436 -6.087 1.00 0.00 N ATOM 413 CA VAL B 414 -11.916 -8.713 -5.678 1.00 0.00 C ATOM 414 C VAL B 414 -11.927 -7.321 -6.311 1.00 0.00 C ATOM 415 O VAL B 414 -12.716 -7.052 -7.215 1.00 0.00 O ATOM 416 CB VAL B 414 -10.667 -9.522 -6.032 1.00 0.00 C ATOM 417 CG1 VAL B 414 -10.808 -10.977 -5.580 1.00 0.00 C ATOM 418 CG2 VAL B 414 -10.367 -9.440 -7.530 1.00 0.00 C ATOM 0 H VAL B 414 -13.224 -9.531 -7.096 1.00 0.00 H new ATOM 0 HA VAL B 414 -11.903 -8.577 -4.597 1.00 0.00 H new ATOM 0 HB VAL B 414 -9.824 -9.086 -5.497 1.00 0.00 H new ATOM 0 HG11 VAL B 414 -9.906 -11.529 -5.844 1.00 0.00 H new ATOM 0 HG12 VAL B 414 -10.951 -11.010 -4.500 1.00 0.00 H new ATOM 0 HG13 VAL B 414 -11.668 -11.430 -6.074 1.00 0.00 H new ATOM 0 HG21 VAL B 414 -9.474 -10.024 -7.755 1.00 0.00 H new ATOM 0 HG22 VAL B 414 -11.212 -9.838 -8.093 1.00 0.00 H new ATOM 0 HG23 VAL B 414 -10.201 -8.400 -7.811 1.00 0.00 H new ATOM 428 N GLN B 415 -11.041 -6.471 -5.810 1.00 0.00 N ATOM 429 CA GLN B 415 -10.939 -5.113 -6.316 1.00 0.00 C ATOM 430 C GLN B 415 -9.474 -4.749 -6.566 1.00 0.00 C ATOM 431 O GLN B 415 -8.665 -4.743 -5.639 1.00 0.00 O ATOM 432 CB GLN B 415 -11.594 -4.119 -5.355 1.00 0.00 C ATOM 433 CG GLN B 415 -11.375 -2.679 -5.822 1.00 0.00 C ATOM 434 CD GLN B 415 -12.538 -2.203 -6.695 1.00 0.00 C ATOM 435 OE1 GLN B 415 -12.182 -1.855 -7.929 1.00 0.00 O flip ATOM 436 NE2 GLN B 415 -13.683 -2.155 -6.277 1.00 0.00 N flip ATOM 0 H GLN B 415 -10.388 -6.697 -5.060 1.00 0.00 H new ATOM 0 HA GLN B 415 -11.474 -5.058 -7.264 1.00 0.00 H new ATOM 0 HB2 GLN B 415 -12.662 -4.324 -5.286 1.00 0.00 H new ATOM 0 HB3 GLN B 415 -11.180 -4.248 -4.355 1.00 0.00 H new ATOM 0 HG2 GLN B 415 -11.273 -2.024 -4.957 1.00 0.00 H new ATOM 0 HG3 GLN B 415 -10.443 -2.613 -6.384 1.00 0.00 H new ATOM 0 HE21 GLN B 415 -13.888 -2.437 -5.318 1.00 0.00 H new ATOM 0 HE22 GLN B 415 -14.435 -1.833 -6.886 1.00 0.00 H new ATOM 445 N ALA B 416 -9.176 -4.454 -7.823 1.00 0.00 N ATOM 446 CA ALA B 416 -7.823 -4.090 -8.206 1.00 0.00 C ATOM 447 C ALA B 416 -7.456 -2.754 -7.557 1.00 0.00 C ATOM 448 O ALA B 416 -8.319 -1.903 -7.349 1.00 0.00 O ATOM 449 CB ALA B 416 -7.719 -4.045 -9.732 1.00 0.00 C ATOM 0 H ALA B 416 -9.849 -4.460 -8.589 1.00 0.00 H new ATOM 0 HA ALA B 416 -7.110 -4.835 -7.852 1.00 0.00 H new ATOM 0 HB1 ALA B 416 -6.704 -3.772 -10.020 1.00 0.00 H new ATOM 0 HB2 ALA B 416 -7.961 -5.025 -10.142 1.00 0.00 H new ATOM 0 HB3 ALA B 416 -8.418 -3.306 -10.123 1.00 0.00 H new ATOM 455 N GLN B 417 -6.173 -2.612 -7.256 1.00 0.00 N ATOM 456 CA GLN B 417 -5.681 -1.394 -6.635 1.00 0.00 C ATOM 457 C GLN B 417 -4.640 -0.723 -7.533 1.00 0.00 C ATOM 458 O GLN B 417 -4.120 0.341 -7.200 1.00 0.00 O ATOM 459 CB GLN B 417 -5.104 -1.680 -5.247 1.00 0.00 C ATOM 460 CG GLN B 417 -5.849 -2.834 -4.571 1.00 0.00 C ATOM 461 CD GLN B 417 -5.515 -2.903 -3.080 1.00 0.00 C ATOM 462 OE1 GLN B 417 -5.002 -4.068 -2.693 1.00 0.00 O flip ATOM 463 NE2 GLN B 417 -5.710 -1.961 -2.329 1.00 0.00 N flip ATOM 0 H GLN B 417 -5.460 -3.320 -7.431 1.00 0.00 H new ATOM 0 HA GLN B 417 -6.520 -0.710 -6.510 1.00 0.00 H new ATOM 0 HB2 GLN B 417 -4.046 -1.926 -5.333 1.00 0.00 H new ATOM 0 HB3 GLN B 417 -5.174 -0.785 -4.629 1.00 0.00 H new ATOM 0 HG2 GLN B 417 -6.923 -2.704 -4.701 1.00 0.00 H new ATOM 0 HG3 GLN B 417 -5.582 -3.775 -5.051 1.00 0.00 H new ATOM 0 HE21 GLN B 417 -6.107 -1.094 -2.691 1.00 0.00 H new ATOM 0 HE22 GLN B 417 -5.476 -2.041 -1.339 1.00 0.00 H new ATOM 472 N HIS B 418 -4.367 -1.373 -8.655 1.00 0.00 N ATOM 473 CA HIS B 418 -3.397 -0.853 -9.604 1.00 0.00 C ATOM 474 C HIS B 418 -3.859 -1.160 -11.030 1.00 0.00 C ATOM 475 O HIS B 418 -4.801 -1.926 -11.230 1.00 0.00 O ATOM 476 CB HIS B 418 -1.998 -1.395 -9.305 1.00 0.00 C ATOM 477 CG HIS B 418 -1.447 -0.966 -7.966 1.00 0.00 C ATOM 478 ND1 HIS B 418 -1.680 -1.446 -6.711 1.00 0.00 N flip ATOM 479 CD2 HIS B 418 -0.545 0.074 -7.825 1.00 0.00 C flip ATOM 480 CE1 HIS B 418 -0.959 -0.739 -5.850 1.00 0.00 C flip ATOM 481 NE2 HIS B 418 -0.255 0.205 -6.539 1.00 0.00 N flip ATOM 0 H HIS B 418 -4.801 -2.255 -8.928 1.00 0.00 H new ATOM 0 HA HIS B 418 -3.332 0.231 -9.505 1.00 0.00 H new ATOM 0 HB2 HIS B 418 -2.025 -2.484 -9.343 1.00 0.00 H new ATOM 0 HB3 HIS B 418 -1.317 -1.066 -10.089 1.00 0.00 H new ATOM 0 HD2 HIS B 418 -0.145 0.677 -8.627 1.00 0.00 H new ATOM 0 HE1 HIS B 418 -0.934 -0.887 -4.780 1.00 0.00 H new ATOM 0 HE2 HIS B 418 0.383 0.891 -6.135 1.00 0.00 H new ATOM 489 N ASP B 419 -3.175 -0.547 -11.985 1.00 0.00 N ATOM 490 CA ASP B 419 -3.504 -0.745 -13.386 1.00 0.00 C ATOM 491 C ASP B 419 -2.385 -1.543 -14.059 1.00 0.00 C ATOM 492 O ASP B 419 -1.333 -0.993 -14.382 1.00 0.00 O ATOM 493 CB ASP B 419 -3.635 0.593 -14.116 1.00 0.00 C ATOM 494 CG ASP B 419 -2.904 1.764 -13.456 1.00 0.00 C ATOM 495 OD1 ASP B 419 -1.658 1.692 -13.393 1.00 0.00 O ATOM 496 OD2 ASP B 419 -3.608 2.705 -13.030 1.00 0.00 O ATOM 0 H ASP B 419 -2.394 0.087 -11.816 1.00 0.00 H new ATOM 0 HA ASP B 419 -4.453 -1.278 -13.438 1.00 0.00 H new ATOM 0 HB2 ASP B 419 -3.257 0.474 -15.131 1.00 0.00 H new ATOM 0 HB3 ASP B 419 -4.693 0.844 -14.197 1.00 0.00 H new ATOM 501 N TYR B 420 -2.650 -2.827 -14.251 1.00 0.00 N ATOM 502 CA TYR B 420 -1.679 -3.706 -14.880 1.00 0.00 C ATOM 503 C TYR B 420 -2.202 -4.235 -16.216 1.00 0.00 C ATOM 504 O TYR B 420 -3.170 -4.994 -16.252 1.00 0.00 O ATOM 505 CB TYR B 420 -1.489 -4.881 -13.918 1.00 0.00 C ATOM 506 CG TYR B 420 -1.132 -6.198 -14.609 1.00 0.00 C ATOM 507 CD1 TYR B 420 0.141 -6.395 -15.103 1.00 0.00 C ATOM 508 CD2 TYR B 420 -2.083 -7.190 -14.737 1.00 0.00 C ATOM 509 CE1 TYR B 420 0.478 -7.635 -15.753 1.00 0.00 C ATOM 510 CE2 TYR B 420 -1.746 -8.430 -15.387 1.00 0.00 C ATOM 511 CZ TYR B 420 -0.482 -8.592 -15.863 1.00 0.00 C ATOM 512 OH TYR B 420 -0.165 -9.763 -16.477 1.00 0.00 O ATOM 0 H TYR B 420 -3.524 -3.280 -13.982 1.00 0.00 H new ATOM 0 HA TYR B 420 -0.749 -3.172 -15.077 1.00 0.00 H new ATOM 0 HB2 TYR B 420 -0.702 -4.631 -13.206 1.00 0.00 H new ATOM 0 HB3 TYR B 420 -2.406 -5.020 -13.345 1.00 0.00 H new ATOM 0 HD1 TYR B 420 0.885 -5.619 -15.002 1.00 0.00 H new ATOM 0 HD2 TYR B 420 -3.079 -7.036 -14.350 1.00 0.00 H new ATOM 0 HE1 TYR B 420 1.471 -7.801 -16.144 1.00 0.00 H new ATOM 0 HE2 TYR B 420 -2.481 -9.214 -15.494 1.00 0.00 H new ATOM 0 HH TYR B 420 0.252 -10.369 -15.830 1.00 0.00 H new ATOM 522 N THR B 421 -1.540 -3.814 -17.284 1.00 0.00 N ATOM 523 CA THR B 421 -1.925 -4.237 -18.619 1.00 0.00 C ATOM 524 C THR B 421 -1.377 -5.634 -18.915 1.00 0.00 C ATOM 525 O THR B 421 -0.165 -5.823 -19.010 1.00 0.00 O ATOM 526 CB THR B 421 -1.445 -3.174 -19.609 1.00 0.00 C ATOM 527 OG1 THR B 421 -2.346 -2.087 -19.416 1.00 0.00 O ATOM 528 CG2 THR B 421 -1.666 -3.587 -21.065 1.00 0.00 C ATOM 0 H THR B 421 -0.739 -3.184 -17.251 1.00 0.00 H new ATOM 0 HA THR B 421 -3.008 -4.321 -18.710 1.00 0.00 H new ATOM 0 HB THR B 421 -0.386 -2.978 -19.444 1.00 0.00 H new ATOM 0 HG1 THR B 421 -2.106 -1.352 -20.018 1.00 0.00 H new ATOM 0 HG21 THR B 421 -1.308 -2.797 -21.726 1.00 0.00 H new ATOM 0 HG22 THR B 421 -1.118 -4.507 -21.269 1.00 0.00 H new ATOM 0 HG23 THR B 421 -2.729 -3.751 -21.239 1.00 0.00 H new ATOM 536 N ALA B 422 -2.297 -6.579 -19.053 1.00 0.00 N ATOM 537 CA ALA B 422 -1.921 -7.953 -19.336 1.00 0.00 C ATOM 538 C ALA B 422 -2.386 -8.325 -20.745 1.00 0.00 C ATOM 539 O ALA B 422 -3.584 -8.341 -21.024 1.00 0.00 O ATOM 540 CB ALA B 422 -2.510 -8.875 -18.266 1.00 0.00 C ATOM 0 H ALA B 422 -3.301 -6.419 -18.974 1.00 0.00 H new ATOM 0 HA ALA B 422 -0.837 -8.068 -19.305 1.00 0.00 H new ATOM 0 HB1 ALA B 422 -2.228 -9.906 -18.479 1.00 0.00 H new ATOM 0 HB2 ALA B 422 -2.126 -8.588 -17.287 1.00 0.00 H new ATOM 0 HB3 ALA B 422 -3.597 -8.788 -18.269 1.00 0.00 H new ATOM 546 N THR B 423 -1.413 -8.613 -21.598 1.00 0.00 N ATOM 547 CA THR B 423 -1.708 -8.983 -22.972 1.00 0.00 C ATOM 548 C THR B 423 -1.172 -10.383 -23.274 1.00 0.00 C ATOM 549 O THR B 423 -0.011 -10.541 -23.648 1.00 0.00 O ATOM 550 CB THR B 423 -1.130 -7.901 -23.886 1.00 0.00 C ATOM 551 OG1 THR B 423 0.218 -7.757 -23.446 1.00 0.00 O ATOM 552 CG2 THR B 423 -1.753 -6.526 -23.633 1.00 0.00 C ATOM 0 H THR B 423 -0.420 -8.598 -21.364 1.00 0.00 H new ATOM 0 HA THR B 423 -2.783 -9.037 -23.146 1.00 0.00 H new ATOM 0 HB THR B 423 -1.286 -8.185 -24.927 1.00 0.00 H new ATOM 0 HG1 THR B 423 0.623 -8.643 -23.338 1.00 0.00 H new ATOM 0 HG21 THR B 423 -1.308 -5.795 -24.308 1.00 0.00 H new ATOM 0 HG22 THR B 423 -2.827 -6.575 -23.810 1.00 0.00 H new ATOM 0 HG23 THR B 423 -1.568 -6.227 -22.601 1.00 0.00 H new ATOM 560 N ASP B 424 -2.044 -11.366 -23.102 1.00 0.00 N ATOM 561 CA ASP B 424 -1.673 -12.748 -23.350 1.00 0.00 C ATOM 562 C ASP B 424 -2.855 -13.483 -23.986 1.00 0.00 C ATOM 563 O ASP B 424 -3.882 -12.874 -24.282 1.00 0.00 O ATOM 564 CB ASP B 424 -1.317 -13.466 -22.047 1.00 0.00 C ATOM 565 CG ASP B 424 -0.135 -14.433 -22.143 1.00 0.00 C ATOM 566 OD1 ASP B 424 0.389 -14.579 -23.269 1.00 0.00 O ATOM 567 OD2 ASP B 424 0.219 -15.004 -21.089 1.00 0.00 O ATOM 0 H ASP B 424 -3.007 -11.232 -22.794 1.00 0.00 H new ATOM 0 HA ASP B 424 -0.807 -12.750 -24.011 1.00 0.00 H new ATOM 0 HB2 ASP B 424 -1.094 -12.718 -21.287 1.00 0.00 H new ATOM 0 HB3 ASP B 424 -2.192 -14.018 -21.703 1.00 0.00 H new ATOM 572 N THR B 425 -2.670 -14.780 -24.179 1.00 0.00 N ATOM 573 CA THR B 425 -3.709 -15.604 -24.774 1.00 0.00 C ATOM 574 C THR B 425 -4.776 -15.951 -23.734 1.00 0.00 C ATOM 575 O THR B 425 -5.866 -16.401 -24.084 1.00 0.00 O ATOM 576 CB THR B 425 -3.041 -16.834 -25.392 1.00 0.00 C ATOM 577 OG1 THR B 425 -4.119 -17.555 -25.981 1.00 0.00 O ATOM 578 CG2 THR B 425 -2.484 -17.791 -24.337 1.00 0.00 C ATOM 0 H THR B 425 -1.816 -15.281 -23.934 1.00 0.00 H new ATOM 0 HA THR B 425 -4.233 -15.068 -25.565 1.00 0.00 H new ATOM 0 HB THR B 425 -2.235 -16.515 -26.053 1.00 0.00 H new ATOM 0 HG1 THR B 425 -3.775 -18.368 -26.406 1.00 0.00 H new ATOM 0 HG21 THR B 425 -2.021 -18.646 -24.830 1.00 0.00 H new ATOM 0 HG22 THR B 425 -1.739 -17.273 -23.733 1.00 0.00 H new ATOM 0 HG23 THR B 425 -3.294 -18.137 -23.695 1.00 0.00 H new ATOM 586 N ASP B 426 -4.425 -15.729 -22.476 1.00 0.00 N ATOM 587 CA ASP B 426 -5.338 -16.014 -21.382 1.00 0.00 C ATOM 588 C ASP B 426 -5.000 -15.113 -20.193 1.00 0.00 C ATOM 589 O ASP B 426 -5.037 -15.553 -19.045 1.00 0.00 O ATOM 590 CB ASP B 426 -5.212 -17.468 -20.924 1.00 0.00 C ATOM 591 CG ASP B 426 -6.232 -18.430 -21.537 1.00 0.00 C ATOM 592 OD1 ASP B 426 -6.490 -18.285 -22.751 1.00 0.00 O ATOM 593 OD2 ASP B 426 -6.730 -19.289 -20.777 1.00 0.00 O ATOM 0 H ASP B 426 -3.520 -15.355 -22.190 1.00 0.00 H new ATOM 0 HA ASP B 426 -6.353 -15.834 -21.735 1.00 0.00 H new ATOM 0 HB2 ASP B 426 -4.210 -17.823 -21.164 1.00 0.00 H new ATOM 0 HB3 ASP B 426 -5.310 -17.501 -19.839 1.00 0.00 H new ATOM 598 N GLU B 427 -4.678 -13.867 -20.508 1.00 0.00 N ATOM 599 CA GLU B 427 -4.334 -12.900 -19.480 1.00 0.00 C ATOM 600 C GLU B 427 -5.582 -12.135 -19.032 1.00 0.00 C ATOM 601 O GLU B 427 -6.601 -12.147 -19.719 1.00 0.00 O ATOM 602 CB GLU B 427 -3.250 -11.939 -19.972 1.00 0.00 C ATOM 603 CG GLU B 427 -1.995 -12.036 -19.101 1.00 0.00 C ATOM 604 CD GLU B 427 -1.593 -13.496 -18.880 1.00 0.00 C ATOM 605 OE1 GLU B 427 -2.179 -14.357 -19.571 1.00 0.00 O ATOM 606 OE2 GLU B 427 -0.709 -13.718 -18.026 1.00 0.00 O ATOM 0 H GLU B 427 -4.648 -13.505 -21.461 1.00 0.00 H new ATOM 0 HA GLU B 427 -3.934 -13.439 -18.621 1.00 0.00 H new ATOM 0 HB2 GLU B 427 -2.997 -12.169 -21.007 1.00 0.00 H new ATOM 0 HB3 GLU B 427 -3.630 -10.918 -19.956 1.00 0.00 H new ATOM 0 HG2 GLU B 427 -1.175 -11.497 -19.576 1.00 0.00 H new ATOM 0 HG3 GLU B 427 -2.177 -11.556 -18.140 1.00 0.00 H new ATOM 613 N LEU B 428 -5.459 -11.490 -17.881 1.00 0.00 N ATOM 614 CA LEU B 428 -6.564 -10.722 -17.333 1.00 0.00 C ATOM 615 C LEU B 428 -6.095 -9.294 -17.046 1.00 0.00 C ATOM 616 O LEU B 428 -5.264 -9.076 -16.166 1.00 0.00 O ATOM 617 CB LEU B 428 -7.157 -11.432 -16.113 1.00 0.00 C ATOM 618 CG LEU B 428 -8.659 -11.244 -15.892 1.00 0.00 C ATOM 619 CD1 LEU B 428 -9.468 -12.041 -16.917 1.00 0.00 C ATOM 620 CD2 LEU B 428 -9.050 -11.594 -14.455 1.00 0.00 C ATOM 0 H LEU B 428 -4.612 -11.484 -17.313 1.00 0.00 H new ATOM 0 HA LEU B 428 -7.375 -10.651 -18.058 1.00 0.00 H new ATOM 0 HB2 LEU B 428 -6.954 -12.499 -16.204 1.00 0.00 H new ATOM 0 HB3 LEU B 428 -6.633 -11.083 -15.224 1.00 0.00 H new ATOM 0 HG LEU B 428 -8.897 -10.191 -16.043 1.00 0.00 H new ATOM 0 HD11 LEU B 428 -10.532 -11.890 -16.737 1.00 0.00 H new ATOM 0 HD12 LEU B 428 -9.218 -11.701 -17.922 1.00 0.00 H new ATOM 0 HD13 LEU B 428 -9.231 -13.101 -16.823 1.00 0.00 H new ATOM 0 HD21 LEU B 428 -10.123 -11.452 -14.325 1.00 0.00 H new ATOM 0 HD22 LEU B 428 -8.795 -12.634 -14.251 1.00 0.00 H new ATOM 0 HD23 LEU B 428 -8.512 -10.946 -13.763 1.00 0.00 H new ATOM 632 N GLN B 429 -6.648 -8.360 -17.805 1.00 0.00 N ATOM 633 CA GLN B 429 -6.297 -6.959 -17.642 1.00 0.00 C ATOM 634 C GLN B 429 -6.980 -6.382 -16.400 1.00 0.00 C ATOM 635 O GLN B 429 -8.155 -6.647 -16.154 1.00 0.00 O ATOM 636 CB GLN B 429 -6.661 -6.154 -18.891 1.00 0.00 C ATOM 637 CG GLN B 429 -5.807 -4.889 -18.996 1.00 0.00 C ATOM 638 CD GLN B 429 -5.537 -4.529 -20.458 1.00 0.00 C ATOM 639 OE1 GLN B 429 -5.974 -3.509 -20.965 1.00 0.00 O ATOM 640 NE2 GLN B 429 -4.793 -5.422 -21.106 1.00 0.00 N ATOM 0 H GLN B 429 -7.336 -8.545 -18.534 1.00 0.00 H new ATOM 0 HA GLN B 429 -5.218 -6.888 -17.506 1.00 0.00 H new ATOM 0 HB2 GLN B 429 -6.517 -6.769 -19.779 1.00 0.00 H new ATOM 0 HB3 GLN B 429 -7.716 -5.883 -18.859 1.00 0.00 H new ATOM 0 HG2 GLN B 429 -6.315 -4.061 -18.502 1.00 0.00 H new ATOM 0 HG3 GLN B 429 -4.862 -5.040 -18.474 1.00 0.00 H new ATOM 0 HE21 GLN B 429 -4.459 -6.255 -20.622 1.00 0.00 H new ATOM 0 HE22 GLN B 429 -4.557 -5.273 -22.087 1.00 0.00 H new ATOM 649 N LEU B 430 -6.213 -5.604 -15.650 1.00 0.00 N ATOM 650 CA LEU B 430 -6.729 -4.987 -14.440 1.00 0.00 C ATOM 651 C LEU B 430 -6.406 -3.492 -14.457 1.00 0.00 C ATOM 652 O LEU B 430 -5.331 -3.091 -14.900 1.00 0.00 O ATOM 653 CB LEU B 430 -6.203 -5.716 -13.201 1.00 0.00 C ATOM 654 CG LEU B 430 -6.964 -6.979 -12.793 1.00 0.00 C ATOM 655 CD1 LEU B 430 -8.421 -6.657 -12.455 1.00 0.00 C ATOM 656 CD2 LEU B 430 -6.851 -8.059 -13.871 1.00 0.00 C ATOM 0 H LEU B 430 -5.238 -5.387 -15.857 1.00 0.00 H new ATOM 0 HA LEU B 430 -7.814 -5.078 -14.399 1.00 0.00 H new ATOM 0 HB2 LEU B 430 -5.161 -5.984 -13.377 1.00 0.00 H new ATOM 0 HB3 LEU B 430 -6.216 -5.021 -12.362 1.00 0.00 H new ATOM 0 HG LEU B 430 -6.505 -7.377 -11.888 1.00 0.00 H new ATOM 0 HD11 LEU B 430 -8.939 -7.572 -12.168 1.00 0.00 H new ATOM 0 HD12 LEU B 430 -8.454 -5.947 -11.629 1.00 0.00 H new ATOM 0 HD13 LEU B 430 -8.909 -6.222 -13.327 1.00 0.00 H new ATOM 0 HD21 LEU B 430 -7.401 -8.946 -13.556 1.00 0.00 H new ATOM 0 HD22 LEU B 430 -7.270 -7.685 -14.806 1.00 0.00 H new ATOM 0 HD23 LEU B 430 -5.802 -8.316 -14.020 1.00 0.00 H new ATOM 668 N LYS B 431 -7.356 -2.708 -13.969 1.00 0.00 N ATOM 669 CA LYS B 431 -7.185 -1.266 -13.922 1.00 0.00 C ATOM 670 C LYS B 431 -7.370 -0.782 -12.483 1.00 0.00 C ATOM 671 O LYS B 431 -8.332 -1.159 -11.815 1.00 0.00 O ATOM 672 CB LYS B 431 -8.117 -0.583 -14.925 1.00 0.00 C ATOM 673 CG LYS B 431 -9.583 -0.769 -14.526 1.00 0.00 C ATOM 674 CD LYS B 431 -10.179 -2.010 -15.193 1.00 0.00 C ATOM 675 CE LYS B 431 -10.312 -1.810 -16.704 1.00 0.00 C ATOM 676 NZ LYS B 431 -11.710 -1.482 -17.062 1.00 0.00 N ATOM 0 H LYS B 431 -8.247 -3.044 -13.603 1.00 0.00 H new ATOM 0 HA LYS B 431 -6.174 -0.992 -14.224 1.00 0.00 H new ATOM 0 HB2 LYS B 431 -7.883 0.480 -14.979 1.00 0.00 H new ATOM 0 HB3 LYS B 431 -7.952 -0.996 -15.920 1.00 0.00 H new ATOM 0 HG2 LYS B 431 -9.660 -0.862 -13.443 1.00 0.00 H new ATOM 0 HG3 LYS B 431 -10.156 0.113 -14.812 1.00 0.00 H new ATOM 0 HD2 LYS B 431 -9.547 -2.875 -14.991 1.00 0.00 H new ATOM 0 HD3 LYS B 431 -11.158 -2.224 -14.763 1.00 0.00 H new ATOM 0 HE2 LYS B 431 -9.649 -1.009 -17.031 1.00 0.00 H new ATOM 0 HE3 LYS B 431 -9.999 -2.715 -17.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 431 -11.783 -1.349 -18.091 1.00 0.00 H new ATOM 0 HZ2 LYS B 431 -12.335 -2.259 -16.768 1.00 0.00 H new ATOM 0 HZ3 LYS B 431 -11.996 -0.606 -16.579 1.00 0.00 H new ATOM 690 N ALA B 432 -6.432 0.047 -12.046 1.00 0.00 N ATOM 691 CA ALA B 432 -6.480 0.587 -10.698 1.00 0.00 C ATOM 692 C ALA B 432 -7.929 0.915 -10.335 1.00 0.00 C ATOM 693 O ALA B 432 -8.439 1.974 -10.699 1.00 0.00 O ATOM 694 CB ALA B 432 -5.564 1.809 -10.605 1.00 0.00 C ATOM 0 H ALA B 432 -5.635 0.357 -12.602 1.00 0.00 H new ATOM 0 HA ALA B 432 -6.119 -0.147 -9.978 1.00 0.00 H new ATOM 0 HB1 ALA B 432 -5.600 2.214 -9.594 1.00 0.00 H new ATOM 0 HB2 ALA B 432 -4.541 1.516 -10.843 1.00 0.00 H new ATOM 0 HB3 ALA B 432 -5.897 2.568 -11.312 1.00 0.00 H new ATOM 700 N GLY B 433 -8.552 -0.012 -9.623 1.00 0.00 N ATOM 701 CA GLY B 433 -9.933 0.166 -9.206 1.00 0.00 C ATOM 702 C GLY B 433 -10.883 -0.629 -10.104 1.00 0.00 C ATOM 703 O GLY B 433 -11.910 -0.111 -10.540 1.00 0.00 O ATOM 0 H GLY B 433 -8.126 -0.889 -9.324 1.00 0.00 H new ATOM 0 HA2 GLY B 433 -10.049 -0.157 -8.171 1.00 0.00 H new ATOM 0 HA3 GLY B 433 -10.194 1.224 -9.241 1.00 0.00 H new ATOM 707 N ASP B 434 -10.507 -1.875 -10.352 1.00 0.00 N ATOM 708 CA ASP B 434 -11.313 -2.746 -11.191 1.00 0.00 C ATOM 709 C ASP B 434 -11.984 -3.809 -10.319 1.00 0.00 C ATOM 710 O ASP B 434 -11.652 -3.952 -9.143 1.00 0.00 O ATOM 711 CB ASP B 434 -10.449 -3.464 -12.230 1.00 0.00 C ATOM 712 CG ASP B 434 -11.193 -4.478 -13.101 1.00 0.00 C ATOM 713 OD1 ASP B 434 -12.243 -4.088 -13.655 1.00 0.00 O ATOM 714 OD2 ASP B 434 -10.695 -5.621 -13.193 1.00 0.00 O ATOM 0 H ASP B 434 -9.656 -2.302 -9.987 1.00 0.00 H new ATOM 0 HA ASP B 434 -12.054 -2.131 -11.701 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -9.992 -2.717 -12.879 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -9.638 -3.977 -11.714 1.00 0.00 H new ATOM 719 N VAL B 435 -12.915 -4.528 -10.929 1.00 0.00 N ATOM 720 CA VAL B 435 -13.635 -5.574 -10.222 1.00 0.00 C ATOM 721 C VAL B 435 -13.365 -6.919 -10.899 1.00 0.00 C ATOM 722 O VAL B 435 -13.533 -7.054 -12.110 1.00 0.00 O ATOM 723 CB VAL B 435 -15.124 -5.228 -10.152 1.00 0.00 C ATOM 724 CG1 VAL B 435 -15.398 -4.203 -9.050 1.00 0.00 C ATOM 725 CG2 VAL B 435 -15.635 -4.728 -11.505 1.00 0.00 C ATOM 0 H VAL B 435 -13.187 -4.407 -11.905 1.00 0.00 H new ATOM 0 HA VAL B 435 -13.284 -5.652 -9.193 1.00 0.00 H new ATOM 0 HB VAL B 435 -15.668 -6.139 -9.904 1.00 0.00 H new ATOM 0 HG11 VAL B 435 -16.463 -3.975 -9.022 1.00 0.00 H new ATOM 0 HG12 VAL B 435 -15.089 -4.612 -8.088 1.00 0.00 H new ATOM 0 HG13 VAL B 435 -14.837 -3.291 -9.254 1.00 0.00 H new ATOM 0 HG21 VAL B 435 -16.696 -4.489 -11.428 1.00 0.00 H new ATOM 0 HG22 VAL B 435 -15.082 -3.835 -11.795 1.00 0.00 H new ATOM 0 HG23 VAL B 435 -15.492 -5.504 -12.257 1.00 0.00 H new ATOM 735 N VAL B 436 -12.952 -7.881 -10.086 1.00 0.00 N ATOM 736 CA VAL B 436 -12.658 -9.211 -10.591 1.00 0.00 C ATOM 737 C VAL B 436 -13.235 -10.255 -9.632 1.00 0.00 C ATOM 738 O VAL B 436 -13.329 -10.014 -8.430 1.00 0.00 O ATOM 739 CB VAL B 436 -11.151 -9.368 -10.808 1.00 0.00 C ATOM 740 CG1 VAL B 436 -10.788 -10.825 -11.101 1.00 0.00 C ATOM 741 CG2 VAL B 436 -10.659 -8.445 -11.924 1.00 0.00 C ATOM 0 H VAL B 436 -12.814 -7.765 -9.082 1.00 0.00 H new ATOM 0 HA VAL B 436 -13.130 -9.364 -11.561 1.00 0.00 H new ATOM 0 HB VAL B 436 -10.648 -9.077 -9.886 1.00 0.00 H new ATOM 0 HG11 VAL B 436 -9.712 -10.909 -11.251 1.00 0.00 H new ATOM 0 HG12 VAL B 436 -11.087 -11.451 -10.260 1.00 0.00 H new ATOM 0 HG13 VAL B 436 -11.307 -11.155 -12.001 1.00 0.00 H new ATOM 0 HG21 VAL B 436 -9.585 -8.576 -12.058 1.00 0.00 H new ATOM 0 HG22 VAL B 436 -11.173 -8.691 -12.853 1.00 0.00 H new ATOM 0 HG23 VAL B 436 -10.867 -7.409 -11.658 1.00 0.00 H new ATOM 751 N LEU B 437 -13.608 -11.392 -10.201 1.00 0.00 N ATOM 752 CA LEU B 437 -14.175 -12.473 -9.412 1.00 0.00 C ATOM 753 C LEU B 437 -13.198 -13.651 -9.393 1.00 0.00 C ATOM 754 O LEU B 437 -12.754 -14.110 -10.444 1.00 0.00 O ATOM 755 CB LEU B 437 -15.569 -12.837 -9.926 1.00 0.00 C ATOM 756 CG LEU B 437 -16.053 -12.065 -11.155 1.00 0.00 C ATOM 757 CD1 LEU B 437 -17.296 -12.722 -11.760 1.00 0.00 C ATOM 758 CD2 LEU B 437 -16.291 -10.592 -10.818 1.00 0.00 C ATOM 0 H LEU B 437 -13.529 -11.588 -11.199 1.00 0.00 H new ATOM 0 HA LEU B 437 -14.315 -12.158 -8.378 1.00 0.00 H new ATOM 0 HB2 LEU B 437 -15.581 -13.901 -10.162 1.00 0.00 H new ATOM 0 HB3 LEU B 437 -16.284 -12.681 -9.119 1.00 0.00 H new ATOM 0 HG LEU B 437 -15.269 -12.100 -11.911 1.00 0.00 H new ATOM 0 HD11 LEU B 437 -17.620 -12.154 -12.632 1.00 0.00 H new ATOM 0 HD12 LEU B 437 -17.059 -13.743 -12.060 1.00 0.00 H new ATOM 0 HD13 LEU B 437 -18.096 -12.738 -11.020 1.00 0.00 H new ATOM 0 HD21 LEU B 437 -16.634 -10.066 -11.709 1.00 0.00 H new ATOM 0 HD22 LEU B 437 -17.047 -10.515 -10.037 1.00 0.00 H new ATOM 0 HD23 LEU B 437 -15.361 -10.144 -10.468 1.00 0.00 H new ATOM 770 N VAL B 438 -12.894 -14.106 -8.187 1.00 0.00 N ATOM 771 CA VAL B 438 -11.979 -15.222 -8.017 1.00 0.00 C ATOM 772 C VAL B 438 -12.719 -16.531 -8.301 1.00 0.00 C ATOM 773 O VAL B 438 -13.654 -16.887 -7.584 1.00 0.00 O ATOM 774 CB VAL B 438 -11.354 -15.179 -6.621 1.00 0.00 C ATOM 775 CG1 VAL B 438 -10.272 -16.250 -6.472 1.00 0.00 C ATOM 776 CG2 VAL B 438 -10.796 -13.788 -6.313 1.00 0.00 C ATOM 0 H VAL B 438 -13.265 -13.722 -7.318 1.00 0.00 H new ATOM 0 HA VAL B 438 -11.156 -15.153 -8.729 1.00 0.00 H new ATOM 0 HB VAL B 438 -12.139 -15.393 -5.895 1.00 0.00 H new ATOM 0 HG11 VAL B 438 -9.844 -16.198 -5.471 1.00 0.00 H new ATOM 0 HG12 VAL B 438 -10.711 -17.235 -6.628 1.00 0.00 H new ATOM 0 HG13 VAL B 438 -9.489 -16.081 -7.211 1.00 0.00 H new ATOM 0 HG21 VAL B 438 -10.358 -13.785 -5.315 1.00 0.00 H new ATOM 0 HG22 VAL B 438 -10.031 -13.532 -7.046 1.00 0.00 H new ATOM 0 HG23 VAL B 438 -11.601 -13.055 -6.358 1.00 0.00 H new ATOM 786 N ILE B 439 -12.274 -17.210 -9.347 1.00 0.00 N ATOM 787 CA ILE B 439 -12.883 -18.472 -9.734 1.00 0.00 C ATOM 788 C ILE B 439 -11.817 -19.570 -9.731 1.00 0.00 C ATOM 789 O ILE B 439 -10.633 -19.290 -9.912 1.00 0.00 O ATOM 790 CB ILE B 439 -13.613 -18.327 -11.071 1.00 0.00 C ATOM 791 CG1 ILE B 439 -12.624 -18.081 -12.212 1.00 0.00 C ATOM 792 CG2 ILE B 439 -14.684 -17.237 -10.995 1.00 0.00 C ATOM 793 CD1 ILE B 439 -12.445 -16.583 -12.468 1.00 0.00 C ATOM 0 H ILE B 439 -11.499 -16.911 -9.939 1.00 0.00 H new ATOM 0 HA ILE B 439 -13.645 -18.765 -9.011 1.00 0.00 H new ATOM 0 HB ILE B 439 -14.124 -19.266 -11.285 1.00 0.00 H new ATOM 0 HG12 ILE B 439 -11.661 -18.529 -11.967 1.00 0.00 H new ATOM 0 HG13 ILE B 439 -12.981 -18.569 -13.119 1.00 0.00 H new ATOM 0 HG21 ILE B 439 -15.188 -17.154 -11.958 1.00 0.00 H new ATOM 0 HG22 ILE B 439 -15.412 -17.495 -10.226 1.00 0.00 H new ATOM 0 HG23 ILE B 439 -14.216 -16.284 -10.747 1.00 0.00 H new ATOM 0 HD11 ILE B 439 -11.737 -16.435 -13.284 1.00 0.00 H new ATOM 0 HD12 ILE B 439 -13.405 -16.142 -12.737 1.00 0.00 H new ATOM 0 HD13 ILE B 439 -12.065 -16.103 -11.566 1.00 0.00 H new ATOM 805 N PRO B 440 -12.288 -20.827 -9.518 1.00 0.00 N ATOM 806 CA PRO B 440 -11.389 -21.968 -9.489 1.00 0.00 C ATOM 807 C PRO B 440 -10.931 -22.342 -10.900 1.00 0.00 C ATOM 808 O PRO B 440 -11.744 -22.733 -11.737 1.00 0.00 O ATOM 809 CB PRO B 440 -12.179 -23.075 -8.808 1.00 0.00 C ATOM 810 CG PRO B 440 -13.638 -22.661 -8.900 1.00 0.00 C ATOM 811 CD PRO B 440 -13.684 -21.196 -9.299 1.00 0.00 C ATOM 0 HA PRO B 440 -10.467 -21.762 -8.945 1.00 0.00 H new ATOM 0 HB2 PRO B 440 -12.013 -24.033 -9.300 1.00 0.00 H new ATOM 0 HB3 PRO B 440 -11.871 -23.193 -7.769 1.00 0.00 H new ATOM 0 HG2 PRO B 440 -14.163 -23.273 -9.634 1.00 0.00 H new ATOM 0 HG3 PRO B 440 -14.138 -22.812 -7.943 1.00 0.00 H new ATOM 0 HD2 PRO B 440 -14.278 -21.050 -10.201 1.00 0.00 H new ATOM 0 HD3 PRO B 440 -14.137 -20.587 -8.517 1.00 0.00 H new ATOM 819 N PHE B 441 -9.632 -22.208 -11.121 1.00 0.00 N ATOM 820 CA PHE B 441 -9.057 -22.526 -12.417 1.00 0.00 C ATOM 821 C PHE B 441 -9.354 -23.975 -12.809 1.00 0.00 C ATOM 822 O PHE B 441 -10.098 -24.668 -12.117 1.00 0.00 O ATOM 823 CB PHE B 441 -7.543 -22.344 -12.291 1.00 0.00 C ATOM 824 CG PHE B 441 -6.974 -22.782 -10.940 1.00 0.00 C ATOM 825 CD1 PHE B 441 -7.562 -23.796 -10.251 1.00 0.00 C ATOM 826 CD2 PHE B 441 -5.880 -22.157 -10.428 1.00 0.00 C ATOM 827 CE1 PHE B 441 -7.034 -24.202 -8.997 1.00 0.00 C ATOM 828 CE2 PHE B 441 -5.352 -22.563 -9.174 1.00 0.00 C ATOM 829 CZ PHE B 441 -5.940 -23.577 -8.485 1.00 0.00 C ATOM 0 H PHE B 441 -8.961 -21.884 -10.425 1.00 0.00 H new ATOM 0 HA PHE B 441 -9.483 -21.877 -13.182 1.00 0.00 H new ATOM 0 HB2 PHE B 441 -7.052 -22.911 -13.082 1.00 0.00 H new ATOM 0 HB3 PHE B 441 -7.299 -21.294 -12.453 1.00 0.00 H new ATOM 0 HD1 PHE B 441 -8.431 -24.293 -10.658 1.00 0.00 H new ATOM 0 HD2 PHE B 441 -5.413 -21.352 -10.975 1.00 0.00 H new ATOM 0 HE1 PHE B 441 -7.501 -25.007 -8.450 1.00 0.00 H new ATOM 0 HE2 PHE B 441 -4.483 -22.066 -8.767 1.00 0.00 H new ATOM 0 HZ PHE B 441 -5.538 -23.886 -7.531 1.00 0.00 H new ATOM 931 N ASP B 448 -0.194 -19.661 -11.358 1.00 0.00 N ATOM 932 CA ASP B 448 1.088 -18.981 -11.291 1.00 0.00 C ATOM 933 C ASP B 448 1.311 -18.460 -9.870 1.00 0.00 C ATOM 934 O ASP B 448 0.358 -18.106 -9.178 1.00 0.00 O ATOM 935 CB ASP B 448 1.128 -17.785 -12.244 1.00 0.00 C ATOM 936 CG ASP B 448 2.328 -16.854 -12.063 1.00 0.00 C ATOM 937 OD1 ASP B 448 3.440 -17.391 -11.867 1.00 0.00 O ATOM 938 OD2 ASP B 448 2.107 -15.625 -12.124 1.00 0.00 O ATOM 0 HA ASP B 448 1.862 -19.694 -11.574 1.00 0.00 H new ATOM 0 HB2 ASP B 448 1.127 -18.156 -13.269 1.00 0.00 H new ATOM 0 HB3 ASP B 448 0.214 -17.205 -12.114 1.00 0.00 H new ATOM 943 N GLU B 449 2.576 -18.430 -9.476 1.00 0.00 N ATOM 944 CA GLU B 449 2.936 -17.958 -8.150 1.00 0.00 C ATOM 945 C GLU B 449 2.747 -16.443 -8.056 1.00 0.00 C ATOM 946 O GLU B 449 3.457 -15.683 -8.714 1.00 0.00 O ATOM 947 CB GLU B 449 4.371 -18.354 -7.798 1.00 0.00 C ATOM 948 CG GLU B 449 4.392 -19.560 -6.856 1.00 0.00 C ATOM 949 CD GLU B 449 5.768 -19.725 -6.207 1.00 0.00 C ATOM 950 OE1 GLU B 449 6.371 -18.679 -5.881 1.00 0.00 O ATOM 951 OE2 GLU B 449 6.185 -20.893 -6.051 1.00 0.00 O ATOM 0 H GLU B 449 3.364 -18.725 -10.052 1.00 0.00 H new ATOM 0 HA GLU B 449 2.275 -18.433 -7.425 1.00 0.00 H new ATOM 0 HB2 GLU B 449 4.921 -18.590 -8.709 1.00 0.00 H new ATOM 0 HB3 GLU B 449 4.879 -17.512 -7.328 1.00 0.00 H new ATOM 0 HG2 GLU B 449 3.634 -19.435 -6.083 1.00 0.00 H new ATOM 0 HG3 GLU B 449 4.137 -20.463 -7.410 1.00 0.00 H new ATOM 958 N GLY B 450 1.786 -16.048 -7.234 1.00 0.00 N ATOM 959 CA GLY B 450 1.495 -14.637 -7.045 1.00 0.00 C ATOM 960 C GLY B 450 0.331 -14.194 -7.934 1.00 0.00 C ATOM 961 O GLY B 450 -0.100 -13.043 -7.870 1.00 0.00 O ATOM 0 H GLY B 450 1.199 -16.681 -6.691 1.00 0.00 H new ATOM 0 HA2 GLY B 450 1.251 -14.449 -5.999 1.00 0.00 H new ATOM 0 HA3 GLY B 450 2.380 -14.045 -7.277 1.00 0.00 H new ATOM 965 N TRP B 451 -0.144 -15.129 -8.743 1.00 0.00 N ATOM 966 CA TRP B 451 -1.249 -14.850 -9.643 1.00 0.00 C ATOM 967 C TRP B 451 -2.221 -16.030 -9.580 1.00 0.00 C ATOM 968 O TRP B 451 -1.814 -17.159 -9.311 1.00 0.00 O ATOM 969 CB TRP B 451 -0.744 -14.565 -11.059 1.00 0.00 C ATOM 970 CG TRP B 451 0.495 -13.670 -11.110 1.00 0.00 C ATOM 971 CD1 TRP B 451 1.638 -13.804 -10.424 1.00 0.00 C ATOM 972 CD2 TRP B 451 0.671 -12.490 -11.922 1.00 0.00 C ATOM 973 NE1 TRP B 451 2.534 -12.801 -10.733 1.00 0.00 N ATOM 974 CE2 TRP B 451 1.928 -11.977 -11.673 1.00 0.00 C ATOM 975 CE3 TRP B 451 -0.203 -11.877 -12.837 1.00 0.00 C ATOM 976 CZ2 TRP B 451 2.424 -10.827 -12.299 1.00 0.00 C ATOM 977 CZ3 TRP B 451 0.308 -10.729 -13.454 1.00 0.00 C ATOM 978 CH2 TRP B 451 1.571 -10.199 -13.214 1.00 0.00 C ATOM 0 H TRP B 451 0.217 -16.082 -8.794 1.00 0.00 H new ATOM 0 HA TRP B 451 -1.778 -13.948 -9.336 1.00 0.00 H new ATOM 0 HB2 TRP B 451 -0.516 -15.511 -11.550 1.00 0.00 H new ATOM 0 HB3 TRP B 451 -1.544 -14.094 -11.631 1.00 0.00 H new ATOM 0 HD1 TRP B 451 1.834 -14.597 -9.718 1.00 0.00 H new ATOM 0 HE1 TRP B 451 3.469 -12.686 -10.343 1.00 0.00 H new ATOM 0 HE3 TRP B 451 -1.190 -12.261 -13.047 1.00 0.00 H new ATOM 0 HZ2 TRP B 451 3.412 -10.445 -12.087 1.00 0.00 H new ATOM 0 HZ3 TRP B 451 -0.323 -10.219 -14.167 1.00 0.00 H new ATOM 0 HH2 TRP B 451 1.892 -9.307 -13.731 1.00 0.00 H new ATOM 989 N LEU B 452 -3.486 -15.728 -9.834 1.00 0.00 N ATOM 990 CA LEU B 452 -4.518 -16.750 -9.810 1.00 0.00 C ATOM 991 C LEU B 452 -5.485 -16.519 -10.973 1.00 0.00 C ATOM 992 O LEU B 452 -5.421 -15.489 -11.643 1.00 0.00 O ATOM 993 CB LEU B 452 -5.200 -16.792 -8.441 1.00 0.00 C ATOM 994 CG LEU B 452 -4.766 -15.717 -7.443 1.00 0.00 C ATOM 995 CD1 LEU B 452 -5.889 -15.403 -6.452 1.00 0.00 C ATOM 996 CD2 LEU B 452 -3.471 -16.120 -6.733 1.00 0.00 C ATOM 0 H LEU B 452 -3.819 -14.790 -10.057 1.00 0.00 H new ATOM 0 HA LEU B 452 -4.079 -17.738 -9.951 1.00 0.00 H new ATOM 0 HB2 LEU B 452 -6.276 -16.708 -8.591 1.00 0.00 H new ATOM 0 HB3 LEU B 452 -5.016 -17.769 -7.995 1.00 0.00 H new ATOM 0 HG LEU B 452 -4.559 -14.801 -7.996 1.00 0.00 H new ATOM 0 HD11 LEU B 452 -5.554 -14.636 -5.754 1.00 0.00 H new ATOM 0 HD12 LEU B 452 -6.763 -15.043 -6.995 1.00 0.00 H new ATOM 0 HD13 LEU B 452 -6.151 -16.306 -5.901 1.00 0.00 H new ATOM 0 HD21 LEU B 452 -3.184 -15.339 -6.029 1.00 0.00 H new ATOM 0 HD22 LEU B 452 -3.627 -17.055 -6.194 1.00 0.00 H new ATOM 0 HD23 LEU B 452 -2.679 -16.254 -7.470 1.00 0.00 H new ATOM 1008 N MET B 453 -6.359 -17.494 -11.177 1.00 0.00 N ATOM 1009 CA MET B 453 -7.339 -17.409 -12.247 1.00 0.00 C ATOM 1010 C MET B 453 -8.599 -16.680 -11.779 1.00 0.00 C ATOM 1011 O MET B 453 -9.330 -17.180 -10.924 1.00 0.00 O ATOM 1012 CB MET B 453 -7.708 -18.818 -12.714 1.00 0.00 C ATOM 1013 CG MET B 453 -8.958 -18.794 -13.596 1.00 0.00 C ATOM 1014 SD MET B 453 -8.637 -19.643 -15.133 1.00 0.00 S ATOM 1015 CE MET B 453 -7.321 -18.625 -15.781 1.00 0.00 C ATOM 0 H MET B 453 -6.409 -18.347 -10.620 1.00 0.00 H new ATOM 0 HA MET B 453 -6.901 -16.846 -13.072 1.00 0.00 H new ATOM 0 HB2 MET B 453 -6.875 -19.251 -13.269 1.00 0.00 H new ATOM 0 HB3 MET B 453 -7.881 -19.458 -11.849 1.00 0.00 H new ATOM 0 HG2 MET B 453 -9.790 -19.269 -13.075 1.00 0.00 H new ATOM 0 HG3 MET B 453 -9.253 -17.764 -13.795 1.00 0.00 H new ATOM 0 HE1 MET B 453 -6.584 -19.256 -16.278 1.00 0.00 H new ATOM 0 HE2 MET B 453 -7.731 -17.913 -16.497 1.00 0.00 H new ATOM 0 HE3 MET B 453 -6.843 -18.084 -14.964 1.00 0.00 H new ATOM 1025 N GLY B 454 -8.817 -15.508 -12.359 1.00 0.00 N ATOM 1026 CA GLY B 454 -9.976 -14.705 -12.012 1.00 0.00 C ATOM 1027 C GLY B 454 -10.669 -14.171 -13.267 1.00 0.00 C ATOM 1028 O GLY B 454 -10.180 -14.362 -14.379 1.00 0.00 O ATOM 0 H GLY B 454 -8.210 -15.096 -13.067 1.00 0.00 H new ATOM 0 HA2 GLY B 454 -10.678 -15.304 -11.432 1.00 0.00 H new ATOM 0 HA3 GLY B 454 -9.669 -13.872 -11.379 1.00 0.00 H new ATOM 1032 N VAL B 455 -11.798 -13.513 -13.046 1.00 0.00 N ATOM 1033 CA VAL B 455 -12.562 -12.949 -14.146 1.00 0.00 C ATOM 1034 C VAL B 455 -13.028 -11.541 -13.768 1.00 0.00 C ATOM 1035 O VAL B 455 -13.362 -11.283 -12.613 1.00 0.00 O ATOM 1036 CB VAL B 455 -13.718 -13.882 -14.513 1.00 0.00 C ATOM 1037 CG1 VAL B 455 -14.743 -13.958 -13.380 1.00 0.00 C ATOM 1038 CG2 VAL B 455 -14.378 -13.447 -15.823 1.00 0.00 C ATOM 0 H VAL B 455 -12.202 -13.358 -12.122 1.00 0.00 H new ATOM 0 HA VAL B 455 -11.940 -12.858 -15.036 1.00 0.00 H new ATOM 0 HB VAL B 455 -13.309 -14.881 -14.660 1.00 0.00 H new ATOM 0 HG11 VAL B 455 -15.554 -14.628 -13.667 1.00 0.00 H new ATOM 0 HG12 VAL B 455 -14.261 -14.337 -12.479 1.00 0.00 H new ATOM 0 HG13 VAL B 455 -15.145 -12.964 -13.186 1.00 0.00 H new ATOM 0 HG21 VAL B 455 -15.196 -14.126 -16.061 1.00 0.00 H new ATOM 0 HG22 VAL B 455 -14.767 -12.434 -15.716 1.00 0.00 H new ATOM 0 HG23 VAL B 455 -13.642 -13.470 -16.626 1.00 0.00 H new ATOM 1048 N LYS B 456 -13.035 -10.667 -14.764 1.00 0.00 N ATOM 1049 CA LYS B 456 -13.454 -9.293 -14.551 1.00 0.00 C ATOM 1050 C LYS B 456 -14.983 -9.224 -14.548 1.00 0.00 C ATOM 1051 O LYS B 456 -15.649 -10.129 -15.050 1.00 0.00 O ATOM 1052 CB LYS B 456 -12.799 -8.367 -15.578 1.00 0.00 C ATOM 1053 CG LYS B 456 -11.702 -7.519 -14.930 1.00 0.00 C ATOM 1054 CD LYS B 456 -11.301 -6.355 -15.839 1.00 0.00 C ATOM 1055 CE LYS B 456 -10.858 -6.861 -17.214 1.00 0.00 C ATOM 1056 NZ LYS B 456 -11.878 -6.540 -18.237 1.00 0.00 N ATOM 0 H LYS B 456 -12.757 -10.884 -15.721 1.00 0.00 H new ATOM 0 HA LYS B 456 -13.117 -8.940 -13.577 1.00 0.00 H new ATOM 0 HB2 LYS B 456 -12.375 -8.959 -16.389 1.00 0.00 H new ATOM 0 HB3 LYS B 456 -13.554 -7.716 -16.020 1.00 0.00 H new ATOM 0 HG2 LYS B 456 -12.053 -7.134 -13.973 1.00 0.00 H new ATOM 0 HG3 LYS B 456 -10.831 -8.141 -14.723 1.00 0.00 H new ATOM 0 HD2 LYS B 456 -12.142 -5.671 -15.953 1.00 0.00 H new ATOM 0 HD3 LYS B 456 -10.491 -5.790 -15.377 1.00 0.00 H new ATOM 0 HE2 LYS B 456 -9.906 -6.406 -17.486 1.00 0.00 H new ATOM 0 HE3 LYS B 456 -10.698 -7.939 -17.177 1.00 0.00 H new ATOM 0 HZ1 LYS B 456 -11.562 -6.890 -19.164 1.00 0.00 H new ATOM 0 HZ2 LYS B 456 -12.779 -6.994 -17.984 1.00 0.00 H new ATOM 0 HZ3 LYS B 456 -12.011 -5.510 -18.283 1.00 0.00 H new ATOM 1070 N GLU B 457 -15.494 -8.143 -13.978 1.00 0.00 N ATOM 1071 CA GLU B 457 -16.932 -7.946 -13.904 1.00 0.00 C ATOM 1072 C GLU B 457 -17.543 -7.962 -15.307 1.00 0.00 C ATOM 1073 O GLU B 457 -18.604 -8.547 -15.519 1.00 0.00 O ATOM 1074 CB GLU B 457 -17.269 -6.644 -13.174 1.00 0.00 C ATOM 1075 CG GLU B 457 -18.739 -6.270 -13.372 1.00 0.00 C ATOM 1076 CD GLU B 457 -19.291 -5.545 -12.142 1.00 0.00 C ATOM 1077 OE1 GLU B 457 -19.125 -4.307 -12.091 1.00 0.00 O ATOM 1078 OE2 GLU B 457 -19.866 -6.245 -11.281 1.00 0.00 O ATOM 0 H GLU B 457 -14.939 -7.395 -13.563 1.00 0.00 H new ATOM 0 HA GLU B 457 -17.363 -8.768 -13.332 1.00 0.00 H new ATOM 0 HB2 GLU B 457 -17.058 -6.754 -12.110 1.00 0.00 H new ATOM 0 HB3 GLU B 457 -16.632 -5.840 -13.544 1.00 0.00 H new ATOM 0 HG2 GLU B 457 -18.841 -5.633 -14.250 1.00 0.00 H new ATOM 0 HG3 GLU B 457 -19.325 -7.170 -13.562 1.00 0.00 H new ATOM 1085 N SER B 458 -16.847 -7.312 -16.228 1.00 0.00 N ATOM 1086 CA SER B 458 -17.307 -7.245 -17.605 1.00 0.00 C ATOM 1087 C SER B 458 -17.338 -8.647 -18.216 1.00 0.00 C ATOM 1088 O SER B 458 -18.215 -8.959 -19.019 1.00 0.00 O ATOM 1089 CB SER B 458 -16.417 -6.321 -18.439 1.00 0.00 C ATOM 1090 OG SER B 458 -17.179 -5.381 -19.190 1.00 0.00 O ATOM 0 H SER B 458 -15.968 -6.827 -16.048 1.00 0.00 H new ATOM 0 HA SER B 458 -18.316 -6.833 -17.608 1.00 0.00 H new ATOM 0 HB2 SER B 458 -15.731 -5.788 -17.781 1.00 0.00 H new ATOM 0 HB3 SER B 458 -15.809 -6.919 -19.117 1.00 0.00 H new ATOM 0 HG SER B 458 -16.575 -4.809 -19.707 1.00 0.00 H new ATOM 1096 N ASP B 459 -16.368 -9.455 -17.812 1.00 0.00 N ATOM 1097 CA ASP B 459 -16.273 -10.817 -18.309 1.00 0.00 C ATOM 1098 C ASP B 459 -17.458 -11.630 -17.786 1.00 0.00 C ATOM 1099 O ASP B 459 -17.944 -12.534 -18.464 1.00 0.00 O ATOM 1100 CB ASP B 459 -14.987 -11.491 -17.828 1.00 0.00 C ATOM 1101 CG ASP B 459 -13.717 -11.063 -18.566 1.00 0.00 C ATOM 1102 OD1 ASP B 459 -13.864 -10.354 -19.584 1.00 0.00 O ATOM 1103 OD2 ASP B 459 -12.627 -11.454 -18.094 1.00 0.00 O ATOM 0 H ASP B 459 -15.641 -9.192 -17.146 1.00 0.00 H new ATOM 0 HA ASP B 459 -16.274 -10.779 -19.398 1.00 0.00 H new ATOM 0 HB2 ASP B 459 -14.860 -11.281 -16.766 1.00 0.00 H new ATOM 0 HB3 ASP B 459 -15.101 -12.570 -17.928 1.00 0.00 H new ATOM 1108 N TRP B 460 -17.890 -11.280 -16.583 1.00 0.00 N ATOM 1109 CA TRP B 460 -19.008 -11.967 -15.960 1.00 0.00 C ATOM 1110 C TRP B 460 -20.171 -11.975 -16.954 1.00 0.00 C ATOM 1111 O TRP B 460 -20.791 -13.013 -17.183 1.00 0.00 O ATOM 1112 CB TRP B 460 -19.371 -11.322 -14.621 1.00 0.00 C ATOM 1113 CG TRP B 460 -20.277 -12.184 -13.740 1.00 0.00 C ATOM 1114 CD1 TRP B 460 -21.132 -13.143 -14.124 1.00 0.00 C ATOM 1115 CD2 TRP B 460 -20.384 -12.128 -12.302 1.00 0.00 C ATOM 1116 NE1 TRP B 460 -21.779 -13.705 -13.043 1.00 0.00 N ATOM 1117 CE2 TRP B 460 -21.310 -13.069 -11.899 1.00 0.00 C ATOM 1118 CE3 TRP B 460 -19.721 -11.309 -11.371 1.00 0.00 C ATOM 1119 CZ2 TRP B 460 -21.657 -13.279 -10.559 1.00 0.00 C ATOM 1120 CZ3 TRP B 460 -20.078 -11.532 -10.036 1.00 0.00 C ATOM 1121 CH2 TRP B 460 -21.008 -12.475 -9.615 1.00 0.00 C ATOM 0 H TRP B 460 -17.485 -10.529 -16.023 1.00 0.00 H new ATOM 0 HA TRP B 460 -18.744 -12.998 -15.724 1.00 0.00 H new ATOM 0 HB2 TRP B 460 -18.454 -11.102 -14.075 1.00 0.00 H new ATOM 0 HB3 TRP B 460 -19.866 -10.369 -14.811 1.00 0.00 H new ATOM 0 HD1 TRP B 460 -21.294 -13.438 -15.150 1.00 0.00 H new ATOM 0 HE1 TRP B 460 -22.474 -14.451 -13.077 1.00 0.00 H new ATOM 0 HE3 TRP B 460 -18.993 -10.566 -11.663 1.00 0.00 H new ATOM 0 HZ2 TRP B 460 -22.386 -14.021 -10.269 1.00 0.00 H new ATOM 0 HZ3 TRP B 460 -19.597 -10.929 -9.280 1.00 0.00 H new ATOM 0 HH2 TRP B 460 -21.229 -12.587 -8.564 1.00 0.00 H new ATOM 1132 N ASN B 461 -20.433 -10.805 -17.519 1.00 0.00 N ATOM 1133 CA ASN B 461 -21.511 -10.664 -18.483 1.00 0.00 C ATOM 1134 C ASN B 461 -21.310 -11.672 -19.616 1.00 0.00 C ATOM 1135 O ASN B 461 -22.272 -12.080 -20.266 1.00 0.00 O ATOM 1136 CB ASN B 461 -21.522 -9.262 -19.095 1.00 0.00 C ATOM 1137 CG ASN B 461 -21.793 -8.200 -18.027 1.00 0.00 C ATOM 1138 OD1 ASN B 461 -20.697 -7.742 -17.429 1.00 0.00 O flip ATOM 1139 ND2 ASN B 461 -22.922 -7.821 -17.763 1.00 0.00 N flip ATOM 0 H ASN B 461 -19.917 -9.946 -17.327 1.00 0.00 H new ATOM 0 HA ASN B 461 -22.453 -10.839 -17.964 1.00 0.00 H new ATOM 0 HB2 ASN B 461 -20.564 -9.064 -19.576 1.00 0.00 H new ATOM 0 HB3 ASN B 461 -22.286 -9.206 -19.871 1.00 0.00 H new ATOM 0 HD21 ASN B 461 -23.721 -8.214 -18.260 1.00 0.00 H new ATOM 0 HD22 ASN B 461 -23.067 -7.111 -17.045 1.00 0.00 H new ATOM 1146 N GLN B 462 -20.055 -12.045 -19.819 1.00 0.00 N ATOM 1147 CA GLN B 462 -19.716 -12.997 -20.863 1.00 0.00 C ATOM 1148 C GLN B 462 -19.667 -14.416 -20.292 1.00 0.00 C ATOM 1149 O GLN B 462 -19.110 -15.320 -20.913 1.00 0.00 O ATOM 1150 CB GLN B 462 -18.391 -12.629 -21.532 1.00 0.00 C ATOM 1151 CG GLN B 462 -18.623 -11.757 -22.767 1.00 0.00 C ATOM 1152 CD GLN B 462 -18.643 -10.273 -22.395 1.00 0.00 C ATOM 1153 OE1 GLN B 462 -19.739 -9.892 -21.746 1.00 0.00 O flip ATOM 1154 NE2 GLN B 462 -17.723 -9.523 -22.679 1.00 0.00 N flip ATOM 0 H GLN B 462 -19.260 -11.705 -19.278 1.00 0.00 H new ATOM 0 HA GLN B 462 -20.493 -12.960 -21.627 1.00 0.00 H new ATOM 0 HB2 GLN B 462 -17.756 -12.099 -20.822 1.00 0.00 H new ATOM 0 HB3 GLN B 462 -17.860 -13.537 -21.818 1.00 0.00 H new ATOM 0 HG2 GLN B 462 -17.837 -11.941 -23.499 1.00 0.00 H new ATOM 0 HG3 GLN B 462 -19.568 -12.030 -23.237 1.00 0.00 H new ATOM 0 HE21 GLN B 462 -16.909 -9.881 -23.179 1.00 0.00 H new ATOM 0 HE22 GLN B 462 -17.768 -8.538 -22.416 1.00 0.00 H new ATOM 1163 N HIS B 463 -20.257 -14.567 -19.115 1.00 0.00 N ATOM 1164 CA HIS B 463 -20.287 -15.860 -18.453 1.00 0.00 C ATOM 1165 C HIS B 463 -20.677 -16.943 -19.460 1.00 0.00 C ATOM 1166 O HIS B 463 -20.359 -18.116 -19.271 1.00 0.00 O ATOM 1167 CB HIS B 463 -21.209 -15.825 -17.233 1.00 0.00 C ATOM 1168 CG HIS B 463 -21.854 -17.152 -16.912 1.00 0.00 C ATOM 1169 ND1 HIS B 463 -21.232 -18.123 -16.148 1.00 0.00 N ATOM 1170 CD2 HIS B 463 -23.073 -17.657 -17.260 1.00 0.00 C ATOM 1171 CE1 HIS B 463 -22.047 -19.162 -16.047 1.00 0.00 C ATOM 1172 NE2 HIS B 463 -23.187 -18.872 -16.737 1.00 0.00 N ATOM 0 H HIS B 463 -20.718 -13.815 -18.603 1.00 0.00 H new ATOM 0 HA HIS B 463 -19.293 -16.103 -18.077 1.00 0.00 H new ATOM 0 HB2 HIS B 463 -20.636 -15.492 -16.367 1.00 0.00 H new ATOM 0 HB3 HIS B 463 -21.991 -15.084 -17.402 1.00 0.00 H new ATOM 0 HD2 HIS B 463 -23.818 -17.154 -17.859 1.00 0.00 H new ATOM 0 HE1 HIS B 463 -21.844 -20.078 -15.512 1.00 0.00 H new ATOM 0 HE2 HIS B 463 -23.995 -19.487 -16.835 1.00 0.00 H new ATOM 1180 N LYS B 464 -21.362 -16.512 -20.510 1.00 0.00 N ATOM 1181 CA LYS B 464 -21.799 -17.430 -21.547 1.00 0.00 C ATOM 1182 C LYS B 464 -20.580 -18.142 -22.139 1.00 0.00 C ATOM 1183 O LYS B 464 -20.682 -19.280 -22.593 1.00 0.00 O ATOM 1184 CB LYS B 464 -22.649 -16.698 -22.588 1.00 0.00 C ATOM 1185 CG LYS B 464 -21.778 -15.815 -23.484 1.00 0.00 C ATOM 1186 CD LYS B 464 -22.638 -14.863 -24.317 1.00 0.00 C ATOM 1187 CE LYS B 464 -21.773 -13.809 -25.012 1.00 0.00 C ATOM 1188 NZ LYS B 464 -22.460 -12.498 -25.021 1.00 0.00 N ATOM 0 H LYS B 464 -21.625 -15.539 -20.664 1.00 0.00 H new ATOM 0 HA LYS B 464 -22.445 -18.200 -21.126 1.00 0.00 H new ATOM 0 HB2 LYS B 464 -23.187 -17.423 -23.199 1.00 0.00 H new ATOM 0 HB3 LYS B 464 -23.398 -16.086 -22.086 1.00 0.00 H new ATOM 0 HG2 LYS B 464 -21.084 -15.241 -22.871 1.00 0.00 H new ATOM 0 HG3 LYS B 464 -21.178 -16.441 -24.144 1.00 0.00 H new ATOM 0 HD2 LYS B 464 -23.196 -15.429 -25.062 1.00 0.00 H new ATOM 0 HD3 LYS B 464 -23.370 -14.372 -23.675 1.00 0.00 H new ATOM 0 HE2 LYS B 464 -20.815 -13.721 -24.499 1.00 0.00 H new ATOM 0 HE3 LYS B 464 -21.560 -14.121 -26.034 1.00 0.00 H new ATOM 0 HZ1 LYS B 464 -21.859 -11.795 -25.496 1.00 0.00 H new ATOM 0 HZ2 LYS B 464 -23.363 -12.583 -25.530 1.00 0.00 H new ATOM 0 HZ3 LYS B 464 -22.641 -12.194 -24.043 1.00 0.00 H new ATOM 1202 N LYS B 465 -19.456 -17.441 -22.115 1.00 0.00 N ATOM 1203 CA LYS B 465 -18.220 -17.991 -22.643 1.00 0.00 C ATOM 1204 C LYS B 465 -17.089 -17.746 -21.642 1.00 0.00 C ATOM 1205 O LYS B 465 -15.986 -17.361 -22.028 1.00 0.00 O ATOM 1206 CB LYS B 465 -17.937 -17.432 -24.039 1.00 0.00 C ATOM 1207 CG LYS B 465 -18.804 -18.125 -25.093 1.00 0.00 C ATOM 1208 CD LYS B 465 -18.532 -17.556 -26.487 1.00 0.00 C ATOM 1209 CE LYS B 465 -17.179 -18.033 -27.019 1.00 0.00 C ATOM 1210 NZ LYS B 465 -17.345 -19.256 -27.836 1.00 0.00 N ATOM 0 H LYS B 465 -19.376 -16.497 -21.738 1.00 0.00 H new ATOM 0 HA LYS B 465 -18.307 -19.070 -22.769 1.00 0.00 H new ATOM 0 HB2 LYS B 465 -18.131 -16.359 -24.051 1.00 0.00 H new ATOM 0 HB3 LYS B 465 -16.883 -17.568 -24.283 1.00 0.00 H new ATOM 0 HG2 LYS B 465 -18.602 -19.196 -25.088 1.00 0.00 H new ATOM 0 HG3 LYS B 465 -19.857 -17.998 -24.844 1.00 0.00 H new ATOM 0 HD2 LYS B 465 -19.324 -17.863 -27.170 1.00 0.00 H new ATOM 0 HD3 LYS B 465 -18.548 -16.467 -26.449 1.00 0.00 H new ATOM 0 HE2 LYS B 465 -16.720 -17.247 -27.619 1.00 0.00 H new ATOM 0 HE3 LYS B 465 -16.504 -18.233 -26.187 1.00 0.00 H new ATOM 0 HZ1 LYS B 465 -16.417 -19.566 -28.189 1.00 0.00 H new ATOM 0 HZ2 LYS B 465 -17.763 -20.009 -27.253 1.00 0.00 H new ATOM 0 HZ3 LYS B 465 -17.972 -19.053 -28.641 1.00 0.00 H new ATOM 1224 N LEU B 466 -17.401 -17.980 -20.376 1.00 0.00 N ATOM 1225 CA LEU B 466 -16.424 -17.790 -19.317 1.00 0.00 C ATOM 1226 C LEU B 466 -15.173 -18.613 -19.629 1.00 0.00 C ATOM 1227 O LEU B 466 -14.063 -18.221 -19.273 1.00 0.00 O ATOM 1228 CB LEU B 466 -17.044 -18.106 -17.954 1.00 0.00 C ATOM 1229 CG LEU B 466 -17.093 -19.585 -17.566 1.00 0.00 C ATOM 1230 CD1 LEU B 466 -17.021 -19.756 -16.047 1.00 0.00 C ATOM 1231 CD2 LEU B 466 -18.325 -20.268 -18.162 1.00 0.00 C ATOM 0 H LEU B 466 -18.317 -18.299 -20.059 1.00 0.00 H new ATOM 0 HA LEU B 466 -16.114 -16.746 -19.267 1.00 0.00 H new ATOM 0 HB2 LEU B 466 -16.484 -17.569 -17.189 1.00 0.00 H new ATOM 0 HB3 LEU B 466 -18.061 -17.713 -17.940 1.00 0.00 H new ATOM 0 HG LEU B 466 -16.217 -20.078 -17.987 1.00 0.00 H new ATOM 0 HD11 LEU B 466 -17.058 -20.817 -15.798 1.00 0.00 H new ATOM 0 HD12 LEU B 466 -16.089 -19.328 -15.676 1.00 0.00 H new ATOM 0 HD13 LEU B 466 -17.865 -19.245 -15.583 1.00 0.00 H new ATOM 0 HD21 LEU B 466 -18.335 -21.318 -17.871 1.00 0.00 H new ATOM 0 HD22 LEU B 466 -19.226 -19.780 -17.792 1.00 0.00 H new ATOM 0 HD23 LEU B 466 -18.292 -20.193 -19.249 1.00 0.00 H new ATOM 1243 N GLU B 467 -15.394 -19.739 -20.292 1.00 0.00 N ATOM 1244 CA GLU B 467 -14.299 -20.621 -20.655 1.00 0.00 C ATOM 1245 C GLU B 467 -13.303 -19.887 -21.556 1.00 0.00 C ATOM 1246 O GLU B 467 -12.145 -20.288 -21.662 1.00 0.00 O ATOM 1247 CB GLU B 467 -14.818 -21.891 -21.333 1.00 0.00 C ATOM 1248 CG GLU B 467 -14.945 -23.037 -20.327 1.00 0.00 C ATOM 1249 CD GLU B 467 -15.138 -24.375 -21.042 1.00 0.00 C ATOM 1250 OE1 GLU B 467 -15.878 -24.379 -22.049 1.00 0.00 O ATOM 1251 OE2 GLU B 467 -14.543 -25.365 -20.564 1.00 0.00 O ATOM 0 H GLU B 467 -16.316 -20.060 -20.587 1.00 0.00 H new ATOM 0 HA GLU B 467 -13.783 -20.921 -19.743 1.00 0.00 H new ATOM 0 HB2 GLU B 467 -15.788 -21.694 -21.789 1.00 0.00 H new ATOM 0 HB3 GLU B 467 -14.141 -22.181 -22.137 1.00 0.00 H new ATOM 0 HG2 GLU B 467 -14.052 -23.079 -19.704 1.00 0.00 H new ATOM 0 HG3 GLU B 467 -15.789 -22.851 -19.663 1.00 0.00 H new ATOM 1258 N LYS B 468 -13.791 -18.826 -22.182 1.00 0.00 N ATOM 1259 CA LYS B 468 -12.958 -18.033 -23.070 1.00 0.00 C ATOM 1260 C LYS B 468 -12.790 -16.629 -22.486 1.00 0.00 C ATOM 1261 O LYS B 468 -12.235 -15.745 -23.137 1.00 0.00 O ATOM 1262 CB LYS B 468 -13.528 -18.044 -24.490 1.00 0.00 C ATOM 1263 CG LYS B 468 -13.852 -19.471 -24.940 1.00 0.00 C ATOM 1264 CD LYS B 468 -13.192 -19.784 -26.285 1.00 0.00 C ATOM 1265 CE LYS B 468 -12.318 -21.036 -26.188 1.00 0.00 C ATOM 1266 NZ LYS B 468 -12.273 -21.739 -27.490 1.00 0.00 N ATOM 0 H LYS B 468 -14.752 -18.497 -22.092 1.00 0.00 H new ATOM 0 HA LYS B 468 -11.961 -18.468 -23.147 1.00 0.00 H new ATOM 0 HB2 LYS B 468 -14.430 -17.433 -24.528 1.00 0.00 H new ATOM 0 HB3 LYS B 468 -12.810 -17.596 -25.177 1.00 0.00 H new ATOM 0 HG2 LYS B 468 -13.508 -20.181 -24.188 1.00 0.00 H new ATOM 0 HG3 LYS B 468 -14.932 -19.594 -25.023 1.00 0.00 H new ATOM 0 HD2 LYS B 468 -13.959 -19.930 -27.046 1.00 0.00 H new ATOM 0 HD3 LYS B 468 -12.585 -18.936 -26.603 1.00 0.00 H new ATOM 0 HE2 LYS B 468 -11.309 -20.759 -25.882 1.00 0.00 H new ATOM 0 HE3 LYS B 468 -12.712 -21.703 -25.421 1.00 0.00 H new ATOM 0 HZ1 LYS B 468 -11.676 -22.586 -27.407 1.00 0.00 H new ATOM 0 HZ2 LYS B 468 -13.235 -22.020 -27.766 1.00 0.00 H new ATOM 0 HZ3 LYS B 468 -11.876 -21.106 -28.213 1.00 0.00 H new ATOM 1280 N CYS B 469 -13.279 -16.468 -21.265 1.00 0.00 N ATOM 1281 CA CYS B 469 -13.189 -15.187 -20.587 1.00 0.00 C ATOM 1282 C CYS B 469 -12.175 -15.316 -19.448 1.00 0.00 C ATOM 1283 O CYS B 469 -11.607 -14.320 -19.003 1.00 0.00 O ATOM 1284 CB CYS B 469 -14.556 -14.717 -20.084 1.00 0.00 C ATOM 1285 SG CYS B 469 -14.846 -12.982 -20.590 1.00 0.00 S ATOM 0 H CYS B 469 -13.739 -17.204 -20.728 1.00 0.00 H new ATOM 0 HA CYS B 469 -12.851 -14.424 -21.288 1.00 0.00 H new ATOM 0 HB2 CYS B 469 -15.341 -15.358 -20.486 1.00 0.00 H new ATOM 0 HB3 CYS B 469 -14.602 -14.800 -18.998 1.00 0.00 H new ATOM 0 HG CYS B 469 -15.612 -12.958 -21.640 1.00 0.00 H new ATOM 1291 N ARG B 470 -11.980 -16.551 -19.010 1.00 0.00 N ATOM 1292 CA ARG B 470 -11.045 -16.823 -17.932 1.00 0.00 C ATOM 1293 C ARG B 470 -9.693 -16.169 -18.224 1.00 0.00 C ATOM 1294 O ARG B 470 -9.320 -15.996 -19.384 1.00 0.00 O ATOM 1295 CB ARG B 470 -10.845 -18.328 -17.742 1.00 0.00 C ATOM 1296 CG ARG B 470 -12.185 -19.038 -17.542 1.00 0.00 C ATOM 1297 CD ARG B 470 -12.121 -20.009 -16.361 1.00 0.00 C ATOM 1298 NE ARG B 470 -12.727 -21.305 -16.738 1.00 0.00 N ATOM 1299 CZ ARG B 470 -12.923 -22.319 -15.885 1.00 0.00 C ATOM 1300 NH1 ARG B 470 -12.561 -22.194 -14.601 1.00 0.00 N ATOM 1301 NH2 ARG B 470 -13.480 -23.459 -16.316 1.00 0.00 N ATOM 0 H ARG B 470 -12.454 -17.374 -19.382 1.00 0.00 H new ATOM 0 HA ARG B 470 -11.465 -16.405 -17.017 1.00 0.00 H new ATOM 0 HB2 ARG B 470 -10.335 -18.743 -18.611 1.00 0.00 H new ATOM 0 HB3 ARG B 470 -10.202 -18.507 -16.880 1.00 0.00 H new ATOM 0 HG2 ARG B 470 -12.969 -18.301 -17.369 1.00 0.00 H new ATOM 0 HG3 ARG B 470 -12.452 -19.580 -18.449 1.00 0.00 H new ATOM 0 HD2 ARG B 470 -11.085 -20.157 -16.057 1.00 0.00 H new ATOM 0 HD3 ARG B 470 -12.647 -19.588 -15.504 1.00 0.00 H new ATOM 0 HE ARG B 470 -13.014 -21.434 -17.708 1.00 0.00 H new ATOM 0 HH11 ARG B 470 -12.136 -21.327 -14.273 1.00 0.00 H new ATOM 0 HH12 ARG B 470 -12.710 -22.966 -13.952 1.00 0.00 H new ATOM 0 HH21 ARG B 470 -13.755 -23.555 -17.294 1.00 0.00 H new ATOM 0 HH22 ARG B 470 -13.629 -24.231 -15.666 1.00 0.00 H new ATOM 1315 N GLY B 471 -8.995 -15.822 -17.153 1.00 0.00 N ATOM 1316 CA GLY B 471 -7.693 -15.189 -17.280 1.00 0.00 C ATOM 1317 C GLY B 471 -6.890 -15.321 -15.984 1.00 0.00 C ATOM 1318 O GLY B 471 -7.364 -15.909 -15.013 1.00 0.00 O ATOM 0 H GLY B 471 -9.307 -15.967 -16.193 1.00 0.00 H new ATOM 0 HA2 GLY B 471 -7.141 -15.646 -18.102 1.00 0.00 H new ATOM 0 HA3 GLY B 471 -7.820 -14.135 -17.528 1.00 0.00 H new ATOM 1322 N VAL B 472 -5.688 -14.764 -16.011 1.00 0.00 N ATOM 1323 CA VAL B 472 -4.815 -14.811 -14.850 1.00 0.00 C ATOM 1324 C VAL B 472 -4.424 -13.386 -14.453 1.00 0.00 C ATOM 1325 O VAL B 472 -4.218 -12.533 -15.315 1.00 0.00 O ATOM 1326 CB VAL B 472 -3.607 -15.704 -15.140 1.00 0.00 C ATOM 1327 CG1 VAL B 472 -2.542 -15.556 -14.052 1.00 0.00 C ATOM 1328 CG2 VAL B 472 -4.031 -17.166 -15.297 1.00 0.00 C ATOM 0 H VAL B 472 -5.298 -14.278 -16.818 1.00 0.00 H new ATOM 0 HA VAL B 472 -5.333 -15.254 -14.000 1.00 0.00 H new ATOM 0 HB VAL B 472 -3.169 -15.379 -16.084 1.00 0.00 H new ATOM 0 HG11 VAL B 472 -1.694 -16.201 -14.282 1.00 0.00 H new ATOM 0 HG12 VAL B 472 -2.208 -14.519 -14.009 1.00 0.00 H new ATOM 0 HG13 VAL B 472 -2.964 -15.842 -13.088 1.00 0.00 H new ATOM 0 HG21 VAL B 472 -3.154 -17.779 -15.503 1.00 0.00 H new ATOM 0 HG22 VAL B 472 -4.505 -17.508 -14.377 1.00 0.00 H new ATOM 0 HG23 VAL B 472 -4.736 -17.254 -16.123 1.00 0.00 H new ATOM 1338 N PHE B 473 -4.333 -13.174 -13.149 1.00 0.00 N ATOM 1339 CA PHE B 473 -3.968 -11.867 -12.627 1.00 0.00 C ATOM 1340 C PHE B 473 -3.252 -11.995 -11.281 1.00 0.00 C ATOM 1341 O PHE B 473 -3.477 -12.951 -10.542 1.00 0.00 O ATOM 1342 CB PHE B 473 -5.269 -11.087 -12.427 1.00 0.00 C ATOM 1343 CG PHE B 473 -6.113 -11.576 -11.249 1.00 0.00 C ATOM 1344 CD1 PHE B 473 -6.730 -12.787 -11.311 1.00 0.00 C ATOM 1345 CD2 PHE B 473 -6.248 -10.800 -10.140 1.00 0.00 C ATOM 1346 CE1 PHE B 473 -7.514 -13.241 -10.217 1.00 0.00 C ATOM 1347 CE2 PHE B 473 -7.031 -11.254 -9.047 1.00 0.00 C ATOM 1348 CZ PHE B 473 -7.648 -12.465 -9.108 1.00 0.00 C ATOM 0 H PHE B 473 -4.505 -13.885 -12.438 1.00 0.00 H new ATOM 0 HA PHE B 473 -3.294 -11.364 -13.320 1.00 0.00 H new ATOM 0 HB2 PHE B 473 -5.030 -10.034 -12.277 1.00 0.00 H new ATOM 0 HB3 PHE B 473 -5.863 -11.152 -13.338 1.00 0.00 H new ATOM 0 HD1 PHE B 473 -6.624 -13.403 -12.192 1.00 0.00 H new ATOM 0 HD2 PHE B 473 -5.759 -9.838 -10.091 1.00 0.00 H new ATOM 0 HE1 PHE B 473 -8.004 -14.202 -10.266 1.00 0.00 H new ATOM 0 HE2 PHE B 473 -7.137 -10.638 -8.166 1.00 0.00 H new ATOM 0 HZ PHE B 473 -8.244 -12.810 -8.276 1.00 0.00 H new ATOM 1358 N PRO B 474 -2.380 -10.990 -10.997 1.00 0.00 N ATOM 1359 CA PRO B 474 -1.629 -10.981 -9.753 1.00 0.00 C ATOM 1360 C PRO B 474 -2.523 -10.585 -8.576 1.00 0.00 C ATOM 1361 O PRO B 474 -3.021 -9.462 -8.521 1.00 0.00 O ATOM 1362 CB PRO B 474 -0.490 -10.003 -9.989 1.00 0.00 C ATOM 1363 CG PRO B 474 -0.907 -9.156 -11.180 1.00 0.00 C ATOM 1364 CD PRO B 474 -2.087 -9.841 -11.849 1.00 0.00 C ATOM 0 HA PRO B 474 -1.243 -11.965 -9.487 1.00 0.00 H new ATOM 0 HB2 PRO B 474 -0.320 -9.383 -9.109 1.00 0.00 H new ATOM 0 HB3 PRO B 474 0.442 -10.531 -10.192 1.00 0.00 H new ATOM 0 HG2 PRO B 474 -1.182 -8.152 -10.857 1.00 0.00 H new ATOM 0 HG3 PRO B 474 -0.079 -9.050 -11.881 1.00 0.00 H new ATOM 0 HD2 PRO B 474 -2.945 -9.172 -11.921 1.00 0.00 H new ATOM 0 HD3 PRO B 474 -1.841 -10.153 -12.864 1.00 0.00 H new ATOM 1372 N GLU B 475 -2.698 -11.530 -7.664 1.00 0.00 N ATOM 1373 CA GLU B 475 -3.524 -11.294 -6.492 1.00 0.00 C ATOM 1374 C GLU B 475 -2.848 -10.284 -5.561 1.00 0.00 C ATOM 1375 O GLU B 475 -3.524 -9.520 -4.873 1.00 0.00 O ATOM 1376 CB GLU B 475 -3.820 -12.603 -5.757 1.00 0.00 C ATOM 1377 CG GLU B 475 -4.267 -12.336 -4.319 1.00 0.00 C ATOM 1378 CD GLU B 475 -5.388 -13.291 -3.906 1.00 0.00 C ATOM 1379 OE1 GLU B 475 -6.465 -13.209 -4.537 1.00 0.00 O ATOM 1380 OE2 GLU B 475 -5.144 -14.083 -2.970 1.00 0.00 O ATOM 0 H GLU B 475 -2.282 -12.460 -7.713 1.00 0.00 H new ATOM 0 HA GLU B 475 -4.476 -10.877 -6.821 1.00 0.00 H new ATOM 0 HB2 GLU B 475 -4.597 -13.154 -6.287 1.00 0.00 H new ATOM 0 HB3 GLU B 475 -2.930 -13.232 -5.754 1.00 0.00 H new ATOM 0 HG2 GLU B 475 -3.419 -12.451 -3.644 1.00 0.00 H new ATOM 0 HG3 GLU B 475 -4.610 -11.306 -4.227 1.00 0.00 H new ATOM 1387 N ASN B 476 -1.524 -10.313 -5.571 1.00 0.00 N ATOM 1388 CA ASN B 476 -0.749 -9.410 -4.736 1.00 0.00 C ATOM 1389 C ASN B 476 -0.905 -7.980 -5.258 1.00 0.00 C ATOM 1390 O ASN B 476 -0.456 -7.030 -4.618 1.00 0.00 O ATOM 1391 CB ASN B 476 0.738 -9.767 -4.771 1.00 0.00 C ATOM 1392 CG ASN B 476 1.095 -10.505 -6.063 1.00 0.00 C ATOM 1393 OD1 ASN B 476 0.439 -10.375 -7.084 1.00 0.00 O ATOM 1394 ND2 ASN B 476 2.168 -11.284 -5.962 1.00 0.00 N ATOM 0 H ASN B 476 -0.968 -10.947 -6.144 1.00 0.00 H new ATOM 0 HA ASN B 476 -1.116 -9.497 -3.713 1.00 0.00 H new ATOM 0 HB2 ASN B 476 1.336 -8.859 -4.690 1.00 0.00 H new ATOM 0 HB3 ASN B 476 0.986 -10.390 -3.912 1.00 0.00 H new ATOM 0 HD21 ASN B 476 2.488 -11.819 -6.770 1.00 0.00 H new ATOM 0 HD22 ASN B 476 2.671 -11.347 -5.077 1.00 0.00 H new ATOM 1401 N PHE B 477 -1.543 -7.873 -6.414 1.00 0.00 N ATOM 1402 CA PHE B 477 -1.764 -6.575 -7.028 1.00 0.00 C ATOM 1403 C PHE B 477 -3.237 -6.170 -6.940 1.00 0.00 C ATOM 1404 O PHE B 477 -3.623 -5.109 -7.429 1.00 0.00 O ATOM 1405 CB PHE B 477 -1.370 -6.704 -8.501 1.00 0.00 C ATOM 1406 CG PHE B 477 -2.284 -5.938 -9.459 1.00 0.00 C ATOM 1407 CD1 PHE B 477 -3.519 -6.424 -9.757 1.00 0.00 C ATOM 1408 CD2 PHE B 477 -1.861 -4.770 -10.014 1.00 0.00 C ATOM 1409 CE1 PHE B 477 -4.367 -5.713 -10.646 1.00 0.00 C ATOM 1410 CE2 PHE B 477 -2.709 -4.059 -10.903 1.00 0.00 C ATOM 1411 CZ PHE B 477 -3.944 -4.545 -11.201 1.00 0.00 C ATOM 0 H PHE B 477 -1.914 -8.663 -6.941 1.00 0.00 H new ATOM 0 HA PHE B 477 -1.175 -5.815 -6.514 1.00 0.00 H new ATOM 0 HB2 PHE B 477 -0.348 -6.346 -8.626 1.00 0.00 H new ATOM 0 HB3 PHE B 477 -1.374 -7.759 -8.777 1.00 0.00 H new ATOM 0 HD1 PHE B 477 -3.855 -7.351 -9.317 1.00 0.00 H new ATOM 0 HD2 PHE B 477 -0.880 -4.384 -9.778 1.00 0.00 H new ATOM 0 HE1 PHE B 477 -5.348 -6.099 -10.882 1.00 0.00 H new ATOM 0 HE2 PHE B 477 -2.373 -3.132 -11.343 1.00 0.00 H new ATOM 0 HZ PHE B 477 -4.589 -4.004 -11.878 1.00 0.00 H new ATOM 1421 N THR B 478 -4.019 -7.036 -6.314 1.00 0.00 N ATOM 1422 CA THR B 478 -5.441 -6.781 -6.154 1.00 0.00 C ATOM 1423 C THR B 478 -5.844 -6.912 -4.684 1.00 0.00 C ATOM 1424 O THR B 478 -5.028 -7.288 -3.844 1.00 0.00 O ATOM 1425 CB THR B 478 -6.199 -7.736 -7.079 1.00 0.00 C ATOM 1426 OG1 THR B 478 -5.417 -8.926 -7.066 1.00 0.00 O ATOM 1427 CG2 THR B 478 -6.167 -7.284 -8.540 1.00 0.00 C ATOM 0 H THR B 478 -3.695 -7.915 -5.911 1.00 0.00 H new ATOM 0 HA THR B 478 -5.694 -5.760 -6.438 1.00 0.00 H new ATOM 0 HB THR B 478 -7.234 -7.817 -6.747 1.00 0.00 H new ATOM 0 HG1 THR B 478 -4.736 -8.877 -7.769 1.00 0.00 H new ATOM 0 HG21 THR B 478 -6.719 -7.996 -9.153 1.00 0.00 H new ATOM 0 HG22 THR B 478 -6.625 -6.299 -8.626 1.00 0.00 H new ATOM 0 HG23 THR B 478 -5.134 -7.234 -8.883 1.00 0.00 H new ATOM 1435 N GLU B 479 -7.102 -6.593 -4.418 1.00 0.00 N ATOM 1436 CA GLU B 479 -7.624 -6.670 -3.064 1.00 0.00 C ATOM 1437 C GLU B 479 -8.909 -7.499 -3.036 1.00 0.00 C ATOM 1438 O GLU B 479 -9.679 -7.490 -3.996 1.00 0.00 O ATOM 1439 CB GLU B 479 -7.860 -5.273 -2.487 1.00 0.00 C ATOM 1440 CG GLU B 479 -7.491 -5.223 -1.003 1.00 0.00 C ATOM 1441 CD GLU B 479 -8.386 -4.237 -0.249 1.00 0.00 C ATOM 1442 OE1 GLU B 479 -9.588 -4.549 -0.115 1.00 0.00 O ATOM 1443 OE2 GLU B 479 -7.846 -3.193 0.177 1.00 0.00 O ATOM 0 H GLU B 479 -7.775 -6.281 -5.117 1.00 0.00 H new ATOM 0 HA GLU B 479 -6.882 -7.165 -2.438 1.00 0.00 H new ATOM 0 HB2 GLU B 479 -7.267 -4.543 -3.038 1.00 0.00 H new ATOM 0 HB3 GLU B 479 -8.906 -4.995 -2.615 1.00 0.00 H new ATOM 0 HG2 GLU B 479 -7.590 -6.217 -0.566 1.00 0.00 H new ATOM 0 HG3 GLU B 479 -6.447 -4.929 -0.894 1.00 0.00 H new ATOM 1450 N ARG B 480 -9.102 -8.197 -1.926 1.00 0.00 N ATOM 1451 CA ARG B 480 -10.282 -9.029 -1.761 1.00 0.00 C ATOM 1452 C ARG B 480 -11.448 -8.197 -1.223 1.00 0.00 C ATOM 1453 O ARG B 480 -11.271 -7.392 -0.311 1.00 0.00 O ATOM 1454 CB ARG B 480 -10.007 -10.189 -0.802 1.00 0.00 C ATOM 1455 CG ARG B 480 -8.879 -11.080 -1.328 1.00 0.00 C ATOM 1456 CD ARG B 480 -9.119 -12.545 -0.958 1.00 0.00 C ATOM 1457 NE ARG B 480 -8.404 -12.874 0.295 1.00 0.00 N ATOM 1458 CZ ARG B 480 -7.079 -13.055 0.379 1.00 0.00 C ATOM 1459 NH1 ARG B 480 -6.317 -12.941 -0.718 1.00 0.00 N ATOM 1460 NH2 ARG B 480 -6.516 -13.351 1.558 1.00 0.00 N ATOM 0 H ARG B 480 -8.461 -8.203 -1.132 1.00 0.00 H new ATOM 0 HA ARG B 480 -10.542 -9.434 -2.739 1.00 0.00 H new ATOM 0 HB2 ARG B 480 -9.739 -9.798 0.180 1.00 0.00 H new ATOM 0 HB3 ARG B 480 -10.913 -10.781 -0.673 1.00 0.00 H new ATOM 0 HG2 ARG B 480 -8.808 -10.982 -2.411 1.00 0.00 H new ATOM 0 HG3 ARG B 480 -7.926 -10.748 -0.915 1.00 0.00 H new ATOM 0 HD2 ARG B 480 -10.187 -12.728 -0.836 1.00 0.00 H new ATOM 0 HD3 ARG B 480 -8.775 -13.193 -1.764 1.00 0.00 H new ATOM 0 HE ARG B 480 -8.954 -12.969 1.148 1.00 0.00 H new ATOM 0 HH11 ARG B 480 -6.746 -12.717 -1.616 1.00 0.00 H new ATOM 0 HH12 ARG B 480 -5.308 -13.079 -0.655 1.00 0.00 H new ATOM 0 HH21 ARG B 480 -7.096 -13.439 2.392 1.00 0.00 H new ATOM 0 HH22 ARG B 480 -5.507 -13.489 1.621 1.00 0.00 H new ATOM 1474 N VAL B 481 -12.613 -8.421 -1.812 1.00 0.00 N ATOM 1475 CA VAL B 481 -13.808 -7.702 -1.404 1.00 0.00 C ATOM 1476 C VAL B 481 -14.729 -8.648 -0.631 1.00 0.00 C ATOM 1477 O VAL B 481 -14.870 -9.815 -0.992 1.00 0.00 O ATOM 1478 CB VAL B 481 -14.484 -7.074 -2.625 1.00 0.00 C ATOM 1479 CG1 VAL B 481 -15.640 -6.164 -2.204 1.00 0.00 C ATOM 1480 CG2 VAL B 481 -13.470 -6.313 -3.482 1.00 0.00 C ATOM 0 H VAL B 481 -12.755 -9.090 -2.569 1.00 0.00 H new ATOM 0 HA VAL B 481 -13.550 -6.881 -0.735 1.00 0.00 H new ATOM 0 HB VAL B 481 -14.897 -7.880 -3.232 1.00 0.00 H new ATOM 0 HG11 VAL B 481 -16.103 -5.730 -3.090 1.00 0.00 H new ATOM 0 HG12 VAL B 481 -16.380 -6.746 -1.656 1.00 0.00 H new ATOM 0 HG13 VAL B 481 -15.261 -5.366 -1.566 1.00 0.00 H new ATOM 0 HG21 VAL B 481 -13.976 -5.877 -4.343 1.00 0.00 H new ATOM 0 HG22 VAL B 481 -13.014 -5.520 -2.889 1.00 0.00 H new ATOM 0 HG23 VAL B 481 -12.696 -6.999 -3.826 1.00 0.00 H new ATOM 1490 N PRO B 482 -15.349 -8.095 0.446 1.00 0.00 N ATOM 1491 CA PRO B 482 -16.251 -8.877 1.273 1.00 0.00 C ATOM 1492 C PRO B 482 -17.592 -9.093 0.569 1.00 0.00 C ATOM 1493 O PRO B 482 -17.697 -9.923 -0.333 1.00 0.00 O ATOM 1494 CB PRO B 482 -16.380 -8.090 2.567 1.00 0.00 C ATOM 1495 CG PRO B 482 -15.921 -6.678 2.244 1.00 0.00 C ATOM 1496 CD PRO B 482 -15.207 -6.715 0.902 1.00 0.00 C ATOM 0 HA PRO B 482 -15.877 -9.882 1.469 1.00 0.00 H new ATOM 0 HB2 PRO B 482 -17.409 -8.094 2.925 1.00 0.00 H new ATOM 0 HB3 PRO B 482 -15.767 -8.529 3.354 1.00 0.00 H new ATOM 0 HG2 PRO B 482 -16.773 -5.999 2.204 1.00 0.00 H new ATOM 0 HG3 PRO B 482 -15.253 -6.306 3.021 1.00 0.00 H new ATOM 0 HD2 PRO B 482 -15.655 -6.016 0.195 1.00 0.00 H new ATOM 0 HD3 PRO B 482 -14.158 -6.437 1.004 1.00 0.00 H new