USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 769 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 MET CE :methyl -106:sc= -3.5! (180deg=-0.342) USER MOD Set 1.2: A 125 GLN : amide:sc= -5.13! C(o=-8.6!,f=-10!) USER MOD Set 2.1: A 70 THR OG1 : rot -64:sc= 0.564 USER MOD Set 2.2: A 109 THR OG1 : rot 67:sc= 1.01 USER MOD Set 3.1: A 86 HIS : no HE2:sc= -1.68 K(o=-4.3,f=-7.1) USER MOD Set 3.2: A 88 ASN : amide:sc= -2.57 K(o=-4.3,f=-10!) USER MOD Set 3.3: A 108 SER OG : rot -140:sc= 0 USER MOD Set 4.1: A 36 ASN : amide:sc= -0.739 K(o=-0.74,f=-6.3!) USER MOD Set 4.2: A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 90:sc= -2.82! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 112:sc= -2.92! USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.342 USER MOD Single : A 37 ASN : amide:sc= -0.936 K(o=-0.94,f=0) USER MOD Single : A 57 GLN : amide:sc= -0.604 X(o=-0.6,f=-0.55) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -110:sc= -0.142 USER MOD Single : A 62 MET CE :methyl 174:sc= -7.14! (180deg=-7.51!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0945 USER MOD Single : A 67 LYS NZ :NH3+ -143:sc= -0.765 (180deg=-1.99) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.00549) USER MOD Single : A 82 LYS NZ :NH3+ -162:sc= -0.0224 (180deg=-0.181) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 121:sc= 1.26 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 MET CE :methyl -176:sc= -2.16! (180deg=-2.42!) USER MOD Single : A 111 SER OG : rot 50:sc= -0.783 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.00596 USER MOD Single : A 123 GLN : amide:sc=-0.00648 X(o=-0.0065,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 83:sc= 0.115 USER MOD ----------------------------------------------------------------- ATOM 318 N ASP A 21 -4.762 -13.122 -8.671 1.00 0.00 N ATOM 319 CA ASP A 21 -4.464 -14.222 -7.762 1.00 0.00 C ATOM 320 C ASP A 21 -3.636 -13.737 -6.577 1.00 0.00 C ATOM 321 O ASP A 21 -2.452 -13.433 -6.716 1.00 0.00 O ATOM 322 CB ASP A 21 -3.718 -15.335 -8.501 1.00 0.00 C ATOM 323 CG ASP A 21 -4.611 -16.087 -9.467 1.00 0.00 C ATOM 324 OD1 ASP A 21 -5.035 -15.484 -10.477 1.00 0.00 O ATOM 325 OD2 ASP A 21 -4.888 -17.278 -9.216 1.00 0.00 O ATOM 0 HA ASP A 21 -5.408 -14.616 -7.386 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -2.878 -14.905 -9.047 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.303 -16.034 -7.775 1.00 0.00 H new ATOM 330 N ARG A 22 -4.268 -13.670 -5.408 1.00 0.00 N ATOM 331 CA ARG A 22 -3.599 -13.219 -4.189 1.00 0.00 C ATOM 332 C ARG A 22 -2.238 -13.894 -4.009 1.00 0.00 C ATOM 333 O ARG A 22 -1.342 -13.338 -3.375 1.00 0.00 O ATOM 334 CB ARG A 22 -4.483 -13.500 -2.972 1.00 0.00 C ATOM 335 CG ARG A 22 -5.197 -12.266 -2.443 1.00 0.00 C ATOM 336 CD ARG A 22 -6.664 -12.549 -2.154 1.00 0.00 C ATOM 337 NE ARG A 22 -7.377 -13.010 -3.344 1.00 0.00 N ATOM 338 CZ ARG A 22 -8.701 -12.984 -3.471 1.00 0.00 C ATOM 339 NH1 ARG A 22 -9.461 -12.521 -2.488 1.00 0.00 N ATOM 340 NH2 ARG A 22 -9.267 -13.422 -4.588 1.00 0.00 N ATOM 0 H ARG A 22 -5.247 -13.924 -5.278 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.431 -12.146 -4.280 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -5.225 -14.253 -3.238 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.869 -13.924 -2.177 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -4.706 -11.923 -1.532 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -5.118 -11.459 -3.171 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -6.740 -13.303 -1.371 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -7.140 -11.645 -1.774 1.00 0.00 H new ATOM 0 HE ARG A 22 -6.827 -13.373 -4.123 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -9.031 -12.182 -1.627 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.476 -12.504 -2.592 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.687 -13.778 -5.348 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -10.282 -13.403 -4.687 1.00 0.00 H new ATOM 354 N GLU A 23 -2.091 -15.096 -4.561 1.00 0.00 N ATOM 355 CA GLU A 23 -0.841 -15.840 -4.444 1.00 0.00 C ATOM 356 C GLU A 23 0.011 -15.712 -5.706 1.00 0.00 C ATOM 357 O GLU A 23 1.211 -15.453 -5.632 1.00 0.00 O ATOM 358 CB GLU A 23 -1.128 -17.315 -4.160 1.00 0.00 C ATOM 359 CG GLU A 23 -1.534 -17.588 -2.721 1.00 0.00 C ATOM 360 CD GLU A 23 -1.693 -19.069 -2.433 1.00 0.00 C ATOM 361 OE1 GLU A 23 -2.537 -19.714 -3.092 1.00 0.00 O ATOM 362 OE2 GLU A 23 -0.978 -19.582 -1.549 1.00 0.00 O ATOM 0 H GLU A 23 -2.819 -15.574 -5.092 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.280 -15.412 -3.613 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -1.922 -17.657 -4.824 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.240 -17.902 -4.396 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.784 -17.169 -2.050 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -2.473 -17.077 -2.509 1.00 0.00 H new ATOM 369 N LYS A 24 -0.615 -15.903 -6.865 1.00 0.00 N ATOM 370 CA LYS A 24 0.095 -15.817 -8.140 1.00 0.00 C ATOM 371 C LYS A 24 -0.019 -14.420 -8.747 1.00 0.00 C ATOM 372 O LYS A 24 0.011 -14.262 -9.968 1.00 0.00 O ATOM 373 CB LYS A 24 -0.450 -16.860 -9.118 1.00 0.00 C ATOM 374 CG LYS A 24 0.632 -17.712 -9.762 1.00 0.00 C ATOM 375 CD LYS A 24 0.974 -18.918 -8.903 1.00 0.00 C ATOM 376 CE LYS A 24 2.221 -19.627 -9.410 1.00 0.00 C ATOM 377 NZ LYS A 24 1.928 -20.499 -10.579 1.00 0.00 N ATOM 0 H LYS A 24 -1.609 -16.118 -6.948 1.00 0.00 H new ATOM 0 HA LYS A 24 1.150 -16.017 -7.951 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.148 -17.511 -8.591 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -1.015 -16.353 -9.900 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.297 -18.046 -10.744 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.527 -17.109 -9.918 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.129 -18.600 -7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.135 -19.613 -8.899 1.00 0.00 H new ATOM 0 HE2 LYS A 24 2.971 -18.887 -9.688 1.00 0.00 H new ATOM 0 HE3 LYS A 24 2.648 -20.228 -8.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 2.804 -20.964 -10.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 1.231 -21.222 -10.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 1.544 -19.922 -11.355 1.00 0.00 H new ATOM 391 N THR A 25 -0.152 -13.413 -7.891 1.00 0.00 N ATOM 392 CA THR A 25 -0.272 -12.032 -8.346 1.00 0.00 C ATOM 393 C THR A 25 1.057 -11.503 -8.877 1.00 0.00 C ATOM 394 O THR A 25 2.115 -12.083 -8.629 1.00 0.00 O ATOM 395 CB THR A 25 -0.749 -11.139 -7.203 1.00 0.00 C ATOM 396 OG1 THR A 25 -0.706 -9.778 -7.587 1.00 0.00 O ATOM 397 CG2 THR A 25 0.081 -11.287 -5.945 1.00 0.00 C ATOM 0 H THR A 25 -0.179 -13.527 -6.878 1.00 0.00 H new ATOM 0 HA THR A 25 -1.001 -12.015 -9.156 1.00 0.00 H new ATOM 0 HB THR A 25 -1.768 -11.459 -6.986 1.00 0.00 H new ATOM 0 HG1 THR A 25 -1.562 -9.525 -7.991 1.00 0.00 H new ATOM 0 HG21 THR A 25 -0.310 -10.626 -5.171 1.00 0.00 H new ATOM 0 HG22 THR A 25 0.034 -12.319 -5.598 1.00 0.00 H new ATOM 0 HG23 THR A 25 1.117 -11.023 -6.159 1.00 0.00 H new ATOM 405 N SER A 26 0.991 -10.388 -9.597 1.00 0.00 N ATOM 406 CA SER A 26 2.185 -9.761 -10.153 1.00 0.00 C ATOM 407 C SER A 26 2.533 -8.494 -9.371 1.00 0.00 C ATOM 408 O SER A 26 1.680 -7.630 -9.168 1.00 0.00 O ATOM 409 CB SER A 26 1.969 -9.421 -11.629 1.00 0.00 C ATOM 410 OG SER A 26 1.897 -10.597 -12.418 1.00 0.00 O ATOM 0 H SER A 26 0.121 -9.899 -9.810 1.00 0.00 H new ATOM 0 HA SER A 26 3.014 -10.464 -10.071 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.050 -8.846 -11.742 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.785 -8.791 -11.983 1.00 0.00 H new ATOM 0 HG SER A 26 1.757 -10.353 -13.357 1.00 0.00 H new ATOM 416 N PRO A 27 3.790 -8.367 -8.909 1.00 0.00 N ATOM 417 CA PRO A 27 4.231 -7.199 -8.138 1.00 0.00 C ATOM 418 C PRO A 27 4.377 -5.945 -8.998 1.00 0.00 C ATOM 419 O PRO A 27 4.952 -5.989 -10.085 1.00 0.00 O ATOM 420 CB PRO A 27 5.590 -7.635 -7.592 1.00 0.00 C ATOM 421 CG PRO A 27 6.091 -8.635 -8.574 1.00 0.00 C ATOM 422 CD PRO A 27 4.875 -9.351 -9.093 1.00 0.00 C ATOM 0 HA PRO A 27 3.510 -6.925 -7.368 1.00 0.00 H new ATOM 0 HB2 PRO A 27 6.272 -6.789 -7.506 1.00 0.00 H new ATOM 0 HB3 PRO A 27 5.495 -8.070 -6.597 1.00 0.00 H new ATOM 0 HG2 PRO A 27 6.633 -8.148 -9.385 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.783 -9.333 -8.102 1.00 0.00 H new ATOM 0 HD2 PRO A 27 4.990 -9.630 -10.140 1.00 0.00 H new ATOM 0 HD3 PRO A 27 4.682 -10.269 -8.538 1.00 0.00 H new ATOM 430 N LEU A 28 3.855 -4.826 -8.498 1.00 0.00 N ATOM 431 CA LEU A 28 3.931 -3.557 -9.214 1.00 0.00 C ATOM 432 C LEU A 28 4.480 -2.454 -8.309 1.00 0.00 C ATOM 433 O LEU A 28 4.296 -2.487 -7.093 1.00 0.00 O ATOM 434 CB LEU A 28 2.552 -3.161 -9.749 1.00 0.00 C ATOM 435 CG LEU A 28 1.451 -3.052 -8.691 1.00 0.00 C ATOM 436 CD1 LEU A 28 1.122 -1.594 -8.406 1.00 0.00 C ATOM 437 CD2 LEU A 28 0.206 -3.803 -9.138 1.00 0.00 C ATOM 0 H LEU A 28 3.375 -4.774 -7.599 1.00 0.00 H new ATOM 0 HA LEU A 28 4.612 -3.684 -10.056 1.00 0.00 H new ATOM 0 HB2 LEU A 28 2.639 -2.202 -10.260 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.245 -3.893 -10.496 1.00 0.00 H new ATOM 0 HG LEU A 28 1.815 -3.506 -7.770 1.00 0.00 H new ATOM 0 HD11 LEU A 28 0.337 -1.539 -7.651 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.014 -1.085 -8.040 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.779 -1.113 -9.322 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.566 -3.715 -8.374 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.159 -3.378 -10.073 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.450 -4.855 -9.288 1.00 0.00 H new ATOM 449 N LEU A 29 5.158 -1.484 -8.916 1.00 0.00 N ATOM 450 CA LEU A 29 5.745 -0.373 -8.170 1.00 0.00 C ATOM 451 C LEU A 29 4.668 0.534 -7.580 1.00 0.00 C ATOM 452 O LEU A 29 3.782 1.010 -8.290 1.00 0.00 O ATOM 453 CB LEU A 29 6.673 0.438 -9.082 1.00 0.00 C ATOM 454 CG LEU A 29 7.157 1.774 -8.509 1.00 0.00 C ATOM 455 CD1 LEU A 29 7.658 1.597 -7.083 1.00 0.00 C ATOM 456 CD2 LEU A 29 8.247 2.367 -9.391 1.00 0.00 C ATOM 0 H LEU A 29 5.315 -1.444 -9.923 1.00 0.00 H new ATOM 0 HA LEU A 29 6.322 -0.790 -7.344 1.00 0.00 H new ATOM 0 HB2 LEU A 29 7.544 -0.172 -9.320 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.153 0.632 -10.020 1.00 0.00 H new ATOM 0 HG LEU A 29 6.315 2.466 -8.490 1.00 0.00 H new ATOM 0 HD11 LEU A 29 7.997 2.557 -6.695 1.00 0.00 H new ATOM 0 HD12 LEU A 29 6.850 1.218 -6.458 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.487 0.889 -7.074 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.580 3.316 -8.970 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.089 1.677 -9.442 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.853 2.533 -10.394 1.00 0.00 H new ATOM 468 N LEU A 30 4.758 0.774 -6.273 1.00 0.00 N ATOM 469 CA LEU A 30 3.797 1.629 -5.581 1.00 0.00 C ATOM 470 C LEU A 30 4.509 2.703 -4.760 1.00 0.00 C ATOM 471 O LEU A 30 5.603 2.479 -4.245 1.00 0.00 O ATOM 472 CB LEU A 30 2.904 0.788 -4.667 1.00 0.00 C ATOM 473 CG LEU A 30 1.630 1.479 -4.177 1.00 0.00 C ATOM 474 CD1 LEU A 30 1.955 2.533 -3.130 1.00 0.00 C ATOM 475 CD2 LEU A 30 0.872 2.096 -5.345 1.00 0.00 C ATOM 0 H LEU A 30 5.487 0.388 -5.673 1.00 0.00 H new ATOM 0 HA LEU A 30 3.182 2.121 -6.334 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.622 -0.121 -5.199 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.488 0.482 -3.799 1.00 0.00 H new ATOM 0 HG LEU A 30 0.992 0.727 -3.713 1.00 0.00 H new ATOM 0 HD11 LEU A 30 1.034 3.011 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 30 2.448 2.061 -2.280 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.617 3.283 -3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.031 2.583 -4.976 1.00 0.00 H new ATOM 0 HD22 LEU A 30 1.504 2.832 -5.841 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.599 1.315 -6.055 1.00 0.00 H new ATOM 487 N ARG A 31 3.875 3.866 -4.637 1.00 0.00 N ATOM 488 CA ARG A 31 4.443 4.972 -3.872 1.00 0.00 C ATOM 489 C ARG A 31 3.747 5.104 -2.520 1.00 0.00 C ATOM 490 O ARG A 31 2.535 5.318 -2.449 1.00 0.00 O ATOM 491 CB ARG A 31 4.320 6.279 -4.654 1.00 0.00 C ATOM 492 CG ARG A 31 5.107 6.284 -5.956 1.00 0.00 C ATOM 493 CD ARG A 31 4.190 6.173 -7.164 1.00 0.00 C ATOM 494 NE ARG A 31 4.756 6.827 -8.342 1.00 0.00 N ATOM 495 CZ ARG A 31 4.737 8.142 -8.541 1.00 0.00 C ATOM 496 NH1 ARG A 31 4.182 8.948 -7.644 1.00 0.00 N ATOM 497 NH2 ARG A 31 5.274 8.655 -9.640 1.00 0.00 N ATOM 0 H ARG A 31 2.968 4.067 -5.057 1.00 0.00 H new ATOM 0 HA ARG A 31 5.499 4.762 -3.701 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.269 6.464 -4.874 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.664 7.102 -4.027 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.692 7.201 -6.025 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.814 5.455 -5.958 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.008 5.121 -7.385 1.00 0.00 H new ATOM 0 HD3 ARG A 31 3.225 6.621 -6.929 1.00 0.00 H new ATOM 0 HE ARG A 31 5.191 6.240 -9.054 1.00 0.00 H new ATOM 0 HH11 ARG A 31 3.767 8.560 -6.797 1.00 0.00 H new ATOM 0 HH12 ARG A 31 4.170 9.956 -7.802 1.00 0.00 H new ATOM 0 HH21 ARG A 31 5.702 8.041 -10.333 1.00 0.00 H new ATOM 0 HH22 ARG A 31 5.259 9.663 -9.792 1.00 0.00 H new ATOM 511 N VAL A 32 4.523 4.972 -1.448 1.00 0.00 N ATOM 512 CA VAL A 32 3.984 5.073 -0.095 1.00 0.00 C ATOM 513 C VAL A 32 4.756 6.091 0.735 1.00 0.00 C ATOM 514 O VAL A 32 5.983 6.138 0.687 1.00 0.00 O ATOM 515 CB VAL A 32 4.024 3.715 0.628 1.00 0.00 C ATOM 516 CG1 VAL A 32 2.867 2.836 0.185 1.00 0.00 C ATOM 517 CG2 VAL A 32 5.354 3.019 0.382 1.00 0.00 C ATOM 0 H VAL A 32 5.527 4.795 -1.490 1.00 0.00 H new ATOM 0 HA VAL A 32 2.949 5.398 -0.196 1.00 0.00 H new ATOM 0 HB VAL A 32 3.923 3.893 1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 32 2.914 1.881 0.708 1.00 0.00 H new ATOM 0 HG12 VAL A 32 1.924 3.331 0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 32 2.931 2.664 -0.890 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.364 2.060 0.901 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.486 2.854 -0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.166 3.643 0.756 1.00 0.00 H new ATOM 527 N PHE A 33 4.028 6.892 1.506 1.00 0.00 N ATOM 528 CA PHE A 33 4.642 7.901 2.358 1.00 0.00 C ATOM 529 C PHE A 33 4.522 7.489 3.816 1.00 0.00 C ATOM 530 O PHE A 33 3.420 7.406 4.360 1.00 0.00 O ATOM 531 CB PHE A 33 3.978 9.262 2.129 1.00 0.00 C ATOM 532 CG PHE A 33 3.817 9.604 0.676 1.00 0.00 C ATOM 533 CD1 PHE A 33 2.919 8.906 -0.118 1.00 0.00 C ATOM 534 CD2 PHE A 33 4.565 10.617 0.100 1.00 0.00 C ATOM 535 CE1 PHE A 33 2.772 9.214 -1.457 1.00 0.00 C ATOM 536 CE2 PHE A 33 4.423 10.929 -1.239 1.00 0.00 C ATOM 537 CZ PHE A 33 3.524 10.226 -2.018 1.00 0.00 C ATOM 0 H PHE A 33 3.010 6.861 1.557 1.00 0.00 H new ATOM 0 HA PHE A 33 5.699 7.986 2.104 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.999 9.266 2.607 1.00 0.00 H new ATOM 0 HB3 PHE A 33 4.573 10.036 2.614 1.00 0.00 H new ATOM 0 HD1 PHE A 33 2.328 8.113 0.315 1.00 0.00 H new ATOM 0 HD2 PHE A 33 5.268 11.170 0.705 1.00 0.00 H new ATOM 0 HE1 PHE A 33 2.069 8.663 -2.064 1.00 0.00 H new ATOM 0 HE2 PHE A 33 5.014 11.721 -1.676 1.00 0.00 H new ATOM 0 HZ PHE A 33 3.410 10.468 -3.064 1.00 0.00 H new ATOM 547 N THR A 34 5.657 7.198 4.441 1.00 0.00 N ATOM 548 CA THR A 34 5.665 6.759 5.827 1.00 0.00 C ATOM 549 C THR A 34 6.311 7.778 6.756 1.00 0.00 C ATOM 550 O THR A 34 7.448 8.201 6.546 1.00 0.00 O ATOM 551 CB THR A 34 6.394 5.424 5.948 1.00 0.00 C ATOM 552 OG1 THR A 34 7.489 5.369 5.053 1.00 0.00 O ATOM 553 CG2 THR A 34 5.508 4.233 5.661 1.00 0.00 C ATOM 0 H THR A 34 6.579 7.258 4.010 1.00 0.00 H new ATOM 0 HA THR A 34 4.625 6.647 6.133 1.00 0.00 H new ATOM 0 HB THR A 34 6.727 5.368 6.984 1.00 0.00 H new ATOM 0 HG1 THR A 34 8.327 5.368 5.561 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.087 3.315 5.764 1.00 0.00 H new ATOM 0 HG22 THR A 34 4.677 4.219 6.367 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.120 4.305 4.645 1.00 0.00 H new ATOM 561 N THR A 35 5.583 8.131 7.806 1.00 0.00 N ATOM 562 CA THR A 35 6.082 9.064 8.811 1.00 0.00 C ATOM 563 C THR A 35 6.564 8.267 10.022 1.00 0.00 C ATOM 564 O THR A 35 6.167 7.118 10.196 1.00 0.00 O ATOM 565 CB THR A 35 4.999 10.076 9.224 1.00 0.00 C ATOM 566 OG1 THR A 35 5.068 10.357 10.612 1.00 0.00 O ATOM 567 CG2 THR A 35 3.583 9.622 8.924 1.00 0.00 C ATOM 0 H THR A 35 4.641 7.785 7.986 1.00 0.00 H new ATOM 0 HA THR A 35 6.910 9.634 8.389 1.00 0.00 H new ATOM 0 HB THR A 35 5.210 10.962 8.625 1.00 0.00 H new ATOM 0 HG1 THR A 35 4.371 11.004 10.850 1.00 0.00 H new ATOM 0 HG21 THR A 35 2.879 10.390 9.245 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.474 9.454 7.853 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.377 8.695 9.459 1.00 0.00 H new ATOM 575 N ASN A 36 7.425 8.862 10.849 1.00 0.00 N ATOM 576 CA ASN A 36 7.942 8.160 12.019 1.00 0.00 C ATOM 577 C ASN A 36 7.194 8.564 13.284 1.00 0.00 C ATOM 578 O ASN A 36 7.718 8.428 14.390 1.00 0.00 O ATOM 579 CB ASN A 36 9.436 8.438 12.182 1.00 0.00 C ATOM 580 CG ASN A 36 10.189 7.242 12.733 1.00 0.00 C ATOM 581 OD1 ASN A 36 10.921 6.567 12.010 1.00 0.00 O ATOM 582 ND2 ASN A 36 10.010 6.972 14.020 1.00 0.00 N ATOM 0 H ASN A 36 7.773 9.813 10.732 1.00 0.00 H new ATOM 0 HA ASN A 36 7.790 7.092 11.864 1.00 0.00 H new ATOM 0 HB2 ASN A 36 9.859 8.717 11.217 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.574 9.289 12.848 1.00 0.00 H new ATOM 0 HD21 ASN A 36 10.489 6.178 14.446 1.00 0.00 H new ATOM 0 HD22 ASN A 36 9.394 7.558 14.583 1.00 0.00 H new ATOM 589 N ASN A 37 5.972 9.058 13.120 1.00 0.00 N ATOM 590 CA ASN A 37 5.164 9.476 14.259 1.00 0.00 C ATOM 591 C ASN A 37 3.703 9.050 14.100 1.00 0.00 C ATOM 592 O ASN A 37 2.867 9.361 14.948 1.00 0.00 O ATOM 593 CB ASN A 37 5.255 10.993 14.439 1.00 0.00 C ATOM 594 CG ASN A 37 5.743 11.382 15.822 1.00 0.00 C ATOM 595 OD1 ASN A 37 6.931 11.274 16.126 1.00 0.00 O ATOM 596 ND2 ASN A 37 4.826 11.835 16.667 1.00 0.00 N ATOM 0 H ASN A 37 5.521 9.178 12.213 1.00 0.00 H new ATOM 0 HA ASN A 37 5.559 8.983 15.147 1.00 0.00 H new ATOM 0 HB2 ASN A 37 5.930 11.406 13.689 1.00 0.00 H new ATOM 0 HB3 ASN A 37 4.275 11.437 14.264 1.00 0.00 H new ATOM 0 HD21 ASN A 37 5.095 12.110 17.612 1.00 0.00 H new ATOM 0 HD22 ASN A 37 3.852 11.908 16.372 1.00 0.00 H new ATOM 603 N GLY A 38 3.398 8.335 13.018 1.00 0.00 N ATOM 604 CA GLY A 38 2.037 7.884 12.791 1.00 0.00 C ATOM 605 C GLY A 38 1.035 9.020 12.802 1.00 0.00 C ATOM 606 O GLY A 38 0.092 9.012 13.592 1.00 0.00 O ATOM 0 H GLY A 38 4.067 8.062 12.298 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.985 7.368 11.832 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.766 7.159 13.558 1.00 0.00 H new ATOM 610 N ARG A 39 1.241 10.007 11.935 1.00 0.00 N ATOM 611 CA ARG A 39 0.343 11.155 11.871 1.00 0.00 C ATOM 612 C ARG A 39 -0.148 11.418 10.449 1.00 0.00 C ATOM 613 O ARG A 39 0.630 11.417 9.494 1.00 0.00 O ATOM 614 CB ARG A 39 1.038 12.399 12.422 1.00 0.00 C ATOM 615 CG ARG A 39 0.808 12.609 13.912 1.00 0.00 C ATOM 616 CD ARG A 39 2.113 12.559 14.692 1.00 0.00 C ATOM 617 NE ARG A 39 2.007 13.233 15.983 1.00 0.00 N ATOM 618 CZ ARG A 39 1.509 12.663 17.079 1.00 0.00 C ATOM 619 NH1 ARG A 39 1.062 11.414 17.044 1.00 0.00 N ATOM 620 NH2 ARG A 39 1.456 13.347 18.215 1.00 0.00 N ATOM 0 H ARG A 39 2.016 10.035 11.272 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.528 10.923 12.484 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.109 12.321 12.235 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.682 13.275 11.880 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.323 13.572 14.074 1.00 0.00 H new ATOM 0 HG3 ARG A 39 0.129 11.843 14.288 1.00 0.00 H new ATOM 0 HD2 ARG A 39 2.402 11.520 14.849 1.00 0.00 H new ATOM 0 HD3 ARG A 39 2.904 13.024 14.104 1.00 0.00 H new ATOM 0 HE ARG A 39 2.334 14.197 16.049 1.00 0.00 H new ATOM 0 HH11 ARG A 39 1.098 10.884 16.174 1.00 0.00 H new ATOM 0 HH12 ARG A 39 0.682 10.984 17.888 1.00 0.00 H new ATOM 0 HH21 ARG A 39 1.796 14.308 18.248 1.00 0.00 H new ATOM 0 HH22 ARG A 39 1.075 12.912 19.055 1.00 0.00 H new ATOM 864 N GLU A 55 8.650 9.220 0.450 1.00 0.00 N ATOM 865 CA GLU A 55 7.998 8.172 -0.325 1.00 0.00 C ATOM 866 C GLU A 55 8.942 6.997 -0.563 1.00 0.00 C ATOM 867 O GLU A 55 10.133 7.184 -0.810 1.00 0.00 O ATOM 868 CB GLU A 55 7.506 8.726 -1.664 1.00 0.00 C ATOM 869 CG GLU A 55 8.598 9.396 -2.484 1.00 0.00 C ATOM 870 CD GLU A 55 8.840 8.706 -3.813 1.00 0.00 C ATOM 871 OE1 GLU A 55 7.902 8.656 -4.636 1.00 0.00 O ATOM 872 OE2 GLU A 55 9.967 8.215 -4.028 1.00 0.00 O ATOM 0 HA GLU A 55 7.143 7.815 0.248 1.00 0.00 H new ATOM 0 HB2 GLU A 55 7.073 7.913 -2.247 1.00 0.00 H new ATOM 0 HB3 GLU A 55 6.709 9.446 -1.479 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.325 10.436 -2.664 1.00 0.00 H new ATOM 0 HG3 GLU A 55 9.524 9.404 -1.910 1.00 0.00 H new ATOM 879 N LEU A 56 8.399 5.783 -0.497 1.00 0.00 N ATOM 880 CA LEU A 56 9.195 4.576 -0.715 1.00 0.00 C ATOM 881 C LEU A 56 8.555 3.691 -1.777 1.00 0.00 C ATOM 882 O LEU A 56 7.339 3.709 -1.970 1.00 0.00 O ATOM 883 CB LEU A 56 9.373 3.774 0.584 1.00 0.00 C ATOM 884 CG LEU A 56 8.437 4.138 1.743 1.00 0.00 C ATOM 885 CD1 LEU A 56 7.825 2.883 2.347 1.00 0.00 C ATOM 886 CD2 LEU A 56 9.185 4.928 2.808 1.00 0.00 C ATOM 0 H LEU A 56 7.414 5.609 -0.295 1.00 0.00 H new ATOM 0 HA LEU A 56 10.178 4.897 -1.059 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.238 2.717 0.354 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.401 3.897 0.924 1.00 0.00 H new ATOM 0 HG LEU A 56 7.634 4.762 1.352 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.164 3.160 3.168 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.255 2.353 1.584 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.618 2.236 2.722 1.00 0.00 H new ATOM 0 HD21 LEU A 56 8.504 5.177 3.622 1.00 0.00 H new ATOM 0 HD22 LEU A 56 10.009 4.328 3.195 1.00 0.00 H new ATOM 0 HD23 LEU A 56 9.579 5.846 2.371 1.00 0.00 H new ATOM 898 N GLN A 57 9.385 2.908 -2.461 1.00 0.00 N ATOM 899 CA GLN A 57 8.903 2.007 -3.499 1.00 0.00 C ATOM 900 C GLN A 57 8.590 0.633 -2.915 1.00 0.00 C ATOM 901 O GLN A 57 9.391 0.064 -2.173 1.00 0.00 O ATOM 902 CB GLN A 57 9.942 1.875 -4.613 1.00 0.00 C ATOM 903 CG GLN A 57 10.204 3.175 -5.358 1.00 0.00 C ATOM 904 CD GLN A 57 11.136 4.102 -4.602 1.00 0.00 C ATOM 905 OE1 GLN A 57 12.337 3.852 -4.507 1.00 0.00 O ATOM 906 NE2 GLN A 57 10.584 5.181 -4.059 1.00 0.00 N ATOM 0 H GLN A 57 10.394 2.881 -2.314 1.00 0.00 H new ATOM 0 HA GLN A 57 7.987 2.426 -3.916 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.878 1.516 -4.185 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.607 1.120 -5.324 1.00 0.00 H new ATOM 0 HG2 GLN A 57 10.634 2.950 -6.334 1.00 0.00 H new ATOM 0 HG3 GLN A 57 9.257 3.684 -5.537 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.583 5.349 -4.163 1.00 0.00 H new ATOM 0 HE22 GLN A 57 11.161 5.842 -3.538 1.00 0.00 H new ATOM 915 N ILE A 58 7.418 0.109 -3.254 1.00 0.00 N ATOM 916 CA ILE A 58 6.993 -1.199 -2.764 1.00 0.00 C ATOM 917 C ILE A 58 6.343 -2.009 -3.875 1.00 0.00 C ATOM 918 O ILE A 58 5.294 -1.632 -4.399 1.00 0.00 O ATOM 919 CB ILE A 58 5.994 -1.089 -1.592 1.00 0.00 C ATOM 920 CG1 ILE A 58 5.267 0.257 -1.608 1.00 0.00 C ATOM 921 CG2 ILE A 58 6.711 -1.293 -0.271 1.00 0.00 C ATOM 922 CD1 ILE A 58 3.827 0.167 -1.149 1.00 0.00 C ATOM 0 H ILE A 58 6.744 0.569 -3.866 1.00 0.00 H new ATOM 0 HA ILE A 58 7.895 -1.699 -2.411 1.00 0.00 H new ATOM 0 HB ILE A 58 5.245 -1.872 -1.710 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.802 0.958 -0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.294 0.664 -2.619 1.00 0.00 H new ATOM 0 HG21 ILE A 58 5.996 -1.213 0.547 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.171 -2.281 -0.256 1.00 0.00 H new ATOM 0 HG23 ILE A 58 7.482 -0.532 -0.154 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.371 1.156 -1.185 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.278 -0.509 -1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.794 -0.211 -0.127 1.00 0.00 H new ATOM 934 N TYR A 59 6.961 -3.130 -4.221 1.00 0.00 N ATOM 935 CA TYR A 59 6.423 -3.996 -5.255 1.00 0.00 C ATOM 936 C TYR A 59 5.315 -4.861 -4.671 1.00 0.00 C ATOM 937 O TYR A 59 5.535 -6.020 -4.318 1.00 0.00 O ATOM 938 CB TYR A 59 7.529 -4.869 -5.849 1.00 0.00 C ATOM 939 CG TYR A 59 8.194 -4.257 -7.064 1.00 0.00 C ATOM 940 CD1 TYR A 59 9.254 -3.371 -6.925 1.00 0.00 C ATOM 941 CD2 TYR A 59 7.759 -4.565 -8.347 1.00 0.00 C ATOM 942 CE1 TYR A 59 9.863 -2.808 -8.032 1.00 0.00 C ATOM 943 CE2 TYR A 59 8.364 -4.009 -9.459 1.00 0.00 C ATOM 944 CZ TYR A 59 9.414 -3.132 -9.296 1.00 0.00 C ATOM 945 OH TYR A 59 10.019 -2.576 -10.400 1.00 0.00 O ATOM 0 H TYR A 59 7.831 -3.458 -3.802 1.00 0.00 H new ATOM 0 HA TYR A 59 6.009 -3.382 -6.055 1.00 0.00 H new ATOM 0 HB2 TYR A 59 8.285 -5.054 -5.085 1.00 0.00 H new ATOM 0 HB3 TYR A 59 7.109 -5.837 -6.123 1.00 0.00 H new ATOM 0 HD1 TYR A 59 9.609 -3.117 -5.937 1.00 0.00 H new ATOM 0 HD2 TYR A 59 6.935 -5.250 -8.478 1.00 0.00 H new ATOM 0 HE1 TYR A 59 10.685 -2.119 -7.908 1.00 0.00 H new ATOM 0 HE2 TYR A 59 8.015 -4.261 -10.450 1.00 0.00 H new ATOM 0 HH TYR A 59 9.585 -2.908 -11.213 1.00 0.00 H new ATOM 955 N THR A 60 4.125 -4.280 -4.557 1.00 0.00 N ATOM 956 CA THR A 60 2.976 -4.984 -4.002 1.00 0.00 C ATOM 957 C THR A 60 1.943 -5.291 -5.080 1.00 0.00 C ATOM 958 O THR A 60 2.156 -5.003 -6.257 1.00 0.00 O ATOM 959 CB THR A 60 2.330 -4.158 -2.887 1.00 0.00 C ATOM 960 OG1 THR A 60 1.336 -4.915 -2.222 1.00 0.00 O ATOM 961 CG2 THR A 60 1.674 -2.886 -3.382 1.00 0.00 C ATOM 0 H THR A 60 3.932 -3.320 -4.843 1.00 0.00 H new ATOM 0 HA THR A 60 3.334 -5.927 -3.589 1.00 0.00 H new ATOM 0 HB THR A 60 3.147 -3.890 -2.217 1.00 0.00 H new ATOM 0 HG1 THR A 60 0.451 -4.553 -2.437 1.00 0.00 H new ATOM 0 HG21 THR A 60 1.237 -2.350 -2.539 1.00 0.00 H new ATOM 0 HG22 THR A 60 2.421 -2.256 -3.865 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.892 -3.135 -4.099 1.00 0.00 H new ATOM 969 N TRP A 61 0.825 -5.873 -4.668 1.00 0.00 N ATOM 970 CA TRP A 61 -0.241 -6.212 -5.604 1.00 0.00 C ATOM 971 C TRP A 61 -1.602 -5.759 -5.095 1.00 0.00 C ATOM 972 O TRP A 61 -2.059 -6.185 -4.037 1.00 0.00 O ATOM 973 CB TRP A 61 -0.260 -7.715 -5.883 1.00 0.00 C ATOM 974 CG TRP A 61 -0.317 -8.563 -4.651 1.00 0.00 C ATOM 975 CD1 TRP A 61 -1.406 -9.223 -4.162 1.00 0.00 C ATOM 976 CD2 TRP A 61 0.764 -8.851 -3.757 1.00 0.00 C ATOM 977 NE1 TRP A 61 -1.070 -9.909 -3.020 1.00 0.00 N ATOM 978 CE2 TRP A 61 0.257 -9.695 -2.750 1.00 0.00 C ATOM 979 CE3 TRP A 61 2.110 -8.479 -3.711 1.00 0.00 C ATOM 980 CZ2 TRP A 61 1.050 -10.171 -1.711 1.00 0.00 C ATOM 981 CZ3 TRP A 61 2.897 -8.952 -2.676 1.00 0.00 C ATOM 982 CH2 TRP A 61 2.364 -9.793 -1.690 1.00 0.00 C ATOM 0 H TRP A 61 0.632 -6.120 -3.697 1.00 0.00 H new ATOM 0 HA TRP A 61 -0.035 -5.681 -6.534 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -1.120 -7.947 -6.511 1.00 0.00 H new ATOM 0 HB3 TRP A 61 0.631 -7.980 -6.453 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -2.390 -9.208 -4.608 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -1.704 -10.483 -2.464 1.00 0.00 H new ATOM 0 HE3 TRP A 61 2.528 -7.834 -4.469 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 0.642 -10.817 -0.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.938 -8.669 -2.627 1.00 0.00 H new ATOM 0 HH2 TRP A 61 3.004 -10.150 -0.897 1.00 0.00 H new ATOM 993 N MET A 62 -2.231 -4.872 -5.863 1.00 0.00 N ATOM 994 CA MET A 62 -3.553 -4.312 -5.524 1.00 0.00 C ATOM 995 C MET A 62 -4.430 -5.298 -4.744 1.00 0.00 C ATOM 996 O MET A 62 -5.197 -4.896 -3.870 1.00 0.00 O ATOM 997 CB MET A 62 -4.316 -3.838 -6.780 1.00 0.00 C ATOM 998 CG MET A 62 -3.713 -4.279 -8.110 1.00 0.00 C ATOM 999 SD MET A 62 -2.916 -2.926 -9.005 1.00 0.00 S ATOM 1000 CE MET A 62 -2.199 -1.974 -7.665 1.00 0.00 C ATOM 0 H MET A 62 -1.846 -4.517 -6.738 1.00 0.00 H new ATOM 0 HA MET A 62 -3.349 -3.454 -4.884 1.00 0.00 H new ATOM 0 HB2 MET A 62 -5.340 -4.206 -6.724 1.00 0.00 H new ATOM 0 HB3 MET A 62 -4.367 -2.749 -6.765 1.00 0.00 H new ATOM 0 HG2 MET A 62 -2.983 -5.067 -7.928 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.497 -4.708 -8.734 1.00 0.00 H new ATOM 0 HE1 MET A 62 -1.588 -1.170 -8.076 1.00 0.00 H new ATOM 0 HE2 MET A 62 -2.995 -1.549 -7.054 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.577 -2.624 -7.049 1.00 0.00 H new ATOM 1010 N ASP A 63 -4.314 -6.586 -5.057 1.00 0.00 N ATOM 1011 CA ASP A 63 -5.099 -7.613 -4.375 1.00 0.00 C ATOM 1012 C ASP A 63 -4.361 -8.162 -3.152 1.00 0.00 C ATOM 1013 O ASP A 63 -4.529 -9.325 -2.786 1.00 0.00 O ATOM 1014 CB ASP A 63 -5.427 -8.755 -5.339 1.00 0.00 C ATOM 1015 CG ASP A 63 -6.633 -8.453 -6.205 1.00 0.00 C ATOM 1016 OD1 ASP A 63 -6.598 -7.444 -6.941 1.00 0.00 O ATOM 1017 OD2 ASP A 63 -7.615 -9.224 -6.148 1.00 0.00 O ATOM 0 H ASP A 63 -3.686 -6.943 -5.777 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.025 -7.150 -4.033 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.564 -8.947 -5.977 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.611 -9.666 -4.769 1.00 0.00 H new ATOM 1022 N ALA A 64 -3.535 -7.323 -2.529 1.00 0.00 N ATOM 1023 CA ALA A 64 -2.763 -7.727 -1.359 1.00 0.00 C ATOM 1024 C ALA A 64 -3.493 -7.401 -0.061 1.00 0.00 C ATOM 1025 O ALA A 64 -4.156 -6.368 0.046 1.00 0.00 O ATOM 1026 CB ALA A 64 -1.401 -7.046 -1.365 1.00 0.00 C ATOM 0 H ALA A 64 -3.384 -6.356 -2.818 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.632 -8.808 -1.411 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -0.835 -7.356 -0.486 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.857 -7.329 -2.266 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.535 -5.964 -1.347 1.00 0.00 H new ATOM 1032 N THR A 65 -3.346 -8.274 0.931 1.00 0.00 N ATOM 1033 CA THR A 65 -3.968 -8.061 2.229 1.00 0.00 C ATOM 1034 C THR A 65 -3.152 -7.047 3.025 1.00 0.00 C ATOM 1035 O THR A 65 -1.938 -6.946 2.842 1.00 0.00 O ATOM 1036 CB THR A 65 -4.074 -9.380 3.001 1.00 0.00 C ATOM 1037 OG1 THR A 65 -3.207 -10.354 2.451 1.00 0.00 O ATOM 1038 CG2 THR A 65 -5.472 -9.958 3.006 1.00 0.00 C ATOM 0 H THR A 65 -2.802 -9.134 0.859 1.00 0.00 H new ATOM 0 HA THR A 65 -4.976 -7.674 2.078 1.00 0.00 H new ATOM 0 HB THR A 65 -3.795 -9.139 4.027 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.288 -11.188 2.959 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.478 -10.891 3.569 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.157 -9.249 3.471 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.790 -10.151 1.981 1.00 0.00 H new ATOM 1046 N LEU A 66 -3.813 -6.294 3.905 1.00 0.00 N ATOM 1047 CA LEU A 66 -3.131 -5.288 4.716 1.00 0.00 C ATOM 1048 C LEU A 66 -1.837 -5.844 5.303 1.00 0.00 C ATOM 1049 O LEU A 66 -0.873 -5.108 5.522 1.00 0.00 O ATOM 1050 CB LEU A 66 -4.053 -4.804 5.839 1.00 0.00 C ATOM 1051 CG LEU A 66 -4.879 -3.543 5.538 1.00 0.00 C ATOM 1052 CD1 LEU A 66 -4.223 -2.317 6.151 1.00 0.00 C ATOM 1053 CD2 LEU A 66 -5.072 -3.344 4.041 1.00 0.00 C ATOM 0 H LEU A 66 -4.817 -6.362 4.073 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.879 -4.445 4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.740 -5.612 6.092 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.446 -4.613 6.724 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.863 -3.680 5.987 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.822 -1.434 5.928 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.153 -2.444 7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.223 -2.193 5.734 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.660 -2.443 3.867 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.100 -3.241 3.559 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.594 -4.205 3.624 1.00 0.00 H new ATOM 1065 N LYS A 67 -1.821 -7.149 5.546 1.00 0.00 N ATOM 1066 CA LYS A 67 -0.642 -7.803 6.093 1.00 0.00 C ATOM 1067 C LYS A 67 0.541 -7.661 5.141 1.00 0.00 C ATOM 1068 O LYS A 67 1.605 -7.186 5.533 1.00 0.00 O ATOM 1069 CB LYS A 67 -0.921 -9.281 6.365 1.00 0.00 C ATOM 1070 CG LYS A 67 -0.138 -9.842 7.543 1.00 0.00 C ATOM 1071 CD LYS A 67 -0.579 -11.258 7.882 1.00 0.00 C ATOM 1072 CE LYS A 67 -1.319 -11.311 9.209 1.00 0.00 C ATOM 1073 NZ LYS A 67 -2.736 -10.877 9.072 1.00 0.00 N ATOM 0 H LYS A 67 -2.609 -7.773 5.373 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.393 -7.316 7.036 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -1.987 -9.412 6.552 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -0.681 -9.858 5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 67 0.927 -9.838 7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.276 -9.199 8.412 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -1.224 -11.638 7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.293 -11.911 7.925 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.287 -12.327 9.602 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.812 -10.673 9.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -3.018 -10.340 9.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -2.835 -10.275 8.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -3.347 -11.713 8.973 1.00 0.00 H new ATOM 1087 N GLU A 68 0.354 -8.070 3.882 1.00 0.00 N ATOM 1088 CA GLU A 68 1.409 -7.980 2.887 1.00 0.00 C ATOM 1089 C GLU A 68 1.998 -6.574 2.832 1.00 0.00 C ATOM 1090 O GLU A 68 3.202 -6.400 2.631 1.00 0.00 O ATOM 1091 CB GLU A 68 0.852 -8.367 1.518 1.00 0.00 C ATOM 1092 CG GLU A 68 0.413 -9.821 1.433 1.00 0.00 C ATOM 1093 CD GLU A 68 1.587 -10.777 1.342 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.709 -10.376 1.716 1.00 0.00 O ATOM 1095 OE2 GLU A 68 1.383 -11.925 0.894 1.00 0.00 O ATOM 0 H GLU A 68 -0.520 -8.465 3.535 1.00 0.00 H new ATOM 0 HA GLU A 68 2.207 -8.667 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.003 -7.725 1.285 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.611 -8.180 0.759 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.186 -10.068 2.310 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.228 -9.953 0.561 1.00 0.00 H new ATOM 1102 N LEU A 69 1.148 -5.572 3.017 1.00 0.00 N ATOM 1103 CA LEU A 69 1.598 -4.184 2.994 1.00 0.00 C ATOM 1104 C LEU A 69 2.422 -3.873 4.237 1.00 0.00 C ATOM 1105 O LEU A 69 3.308 -3.018 4.210 1.00 0.00 O ATOM 1106 CB LEU A 69 0.408 -3.223 2.892 1.00 0.00 C ATOM 1107 CG LEU A 69 -0.484 -3.403 1.655 1.00 0.00 C ATOM 1108 CD1 LEU A 69 0.353 -3.596 0.400 1.00 0.00 C ATOM 1109 CD2 LEU A 69 -1.431 -4.574 1.853 1.00 0.00 C ATOM 0 H LEU A 69 0.149 -5.692 3.184 1.00 0.00 H new ATOM 0 HA LEU A 69 2.224 -4.046 2.113 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.209 -3.340 3.783 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.787 -2.201 2.899 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.074 -2.496 1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.305 -3.721 -0.460 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.987 -2.723 0.248 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.977 -4.483 0.512 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.057 -4.689 0.968 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.854 -5.485 2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.062 -4.389 2.722 1.00 0.00 H new ATOM 1121 N THR A 70 2.132 -4.584 5.323 1.00 0.00 N ATOM 1122 CA THR A 70 2.851 -4.398 6.575 1.00 0.00 C ATOM 1123 C THR A 70 4.316 -4.775 6.409 1.00 0.00 C ATOM 1124 O THR A 70 5.195 -4.163 7.009 1.00 0.00 O ATOM 1125 CB THR A 70 2.220 -5.246 7.678 1.00 0.00 C ATOM 1126 OG1 THR A 70 0.847 -4.930 7.831 1.00 0.00 O ATOM 1127 CG2 THR A 70 2.885 -5.068 9.024 1.00 0.00 C ATOM 0 H THR A 70 1.402 -5.295 5.359 1.00 0.00 H new ATOM 0 HA THR A 70 2.788 -3.346 6.854 1.00 0.00 H new ATOM 0 HB THR A 70 2.354 -6.280 7.359 1.00 0.00 H new ATOM 0 HG1 THR A 70 0.757 -4.002 8.132 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.388 -5.698 9.762 1.00 0.00 H new ATOM 0 HG22 THR A 70 3.935 -5.353 8.952 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.812 -4.025 9.331 1.00 0.00 H new ATOM 1135 N SER A 71 4.569 -5.793 5.589 1.00 0.00 N ATOM 1136 CA SER A 71 5.930 -6.258 5.344 1.00 0.00 C ATOM 1137 C SER A 71 6.608 -5.428 4.260 1.00 0.00 C ATOM 1138 O SER A 71 7.771 -5.054 4.388 1.00 0.00 O ATOM 1139 CB SER A 71 5.919 -7.733 4.940 1.00 0.00 C ATOM 1140 OG SER A 71 7.006 -8.430 5.527 1.00 0.00 O ATOM 0 H SER A 71 3.849 -6.310 5.084 1.00 0.00 H new ATOM 0 HA SER A 71 6.497 -6.142 6.268 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.979 -8.191 5.249 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.973 -7.817 3.855 1.00 0.00 H new ATOM 0 HG SER A 71 6.976 -9.371 5.255 1.00 0.00 H new ATOM 1146 N LEU A 72 5.875 -5.143 3.190 1.00 0.00 N ATOM 1147 CA LEU A 72 6.403 -4.356 2.079 1.00 0.00 C ATOM 1148 C LEU A 72 7.002 -3.038 2.568 1.00 0.00 C ATOM 1149 O LEU A 72 8.135 -2.699 2.227 1.00 0.00 O ATOM 1150 CB LEU A 72 5.295 -4.092 1.060 1.00 0.00 C ATOM 1151 CG LEU A 72 5.163 -5.159 -0.029 1.00 0.00 C ATOM 1152 CD1 LEU A 72 3.701 -5.455 -0.312 1.00 0.00 C ATOM 1153 CD2 LEU A 72 5.876 -4.718 -1.298 1.00 0.00 C ATOM 0 H LEU A 72 4.909 -5.446 3.067 1.00 0.00 H new ATOM 0 HA LEU A 72 7.201 -4.926 1.603 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.345 -4.012 1.589 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.478 -3.128 0.585 1.00 0.00 H new ATOM 0 HG LEU A 72 5.634 -6.075 0.328 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.628 -6.216 -1.089 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.220 -5.817 0.597 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.204 -4.545 -0.647 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.771 -5.489 -2.061 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.435 -3.789 -1.659 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.933 -4.560 -1.085 1.00 0.00 H new ATOM 1165 N VAL A 73 6.244 -2.301 3.375 1.00 0.00 N ATOM 1166 CA VAL A 73 6.710 -1.027 3.912 1.00 0.00 C ATOM 1167 C VAL A 73 7.803 -1.247 4.954 1.00 0.00 C ATOM 1168 O VAL A 73 8.880 -0.656 4.876 1.00 0.00 O ATOM 1169 CB VAL A 73 5.546 -0.242 4.552 1.00 0.00 C ATOM 1170 CG1 VAL A 73 6.057 0.977 5.303 1.00 0.00 C ATOM 1171 CG2 VAL A 73 4.532 0.169 3.494 1.00 0.00 C ATOM 0 H VAL A 73 5.304 -2.565 3.671 1.00 0.00 H new ATOM 0 HA VAL A 73 7.117 -0.449 3.082 1.00 0.00 H new ATOM 0 HB VAL A 73 5.052 -0.898 5.269 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.216 1.512 5.744 1.00 0.00 H new ATOM 0 HG12 VAL A 73 6.739 0.659 6.092 1.00 0.00 H new ATOM 0 HG13 VAL A 73 6.584 1.636 4.612 1.00 0.00 H new ATOM 0 HG21 VAL A 73 3.719 0.721 3.965 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.018 0.801 2.751 1.00 0.00 H new ATOM 0 HG23 VAL A 73 4.132 -0.721 3.008 1.00 0.00 H new ATOM 1181 N LYS A 74 7.512 -2.102 5.929 1.00 0.00 N ATOM 1182 CA LYS A 74 8.460 -2.406 6.996 1.00 0.00 C ATOM 1183 C LYS A 74 9.805 -2.865 6.426 1.00 0.00 C ATOM 1184 O LYS A 74 10.856 -2.603 7.011 1.00 0.00 O ATOM 1185 CB LYS A 74 7.857 -3.470 7.925 1.00 0.00 C ATOM 1186 CG LYS A 74 8.870 -4.343 8.650 1.00 0.00 C ATOM 1187 CD LYS A 74 8.949 -5.724 8.021 1.00 0.00 C ATOM 1188 CE LYS A 74 8.984 -6.822 9.073 1.00 0.00 C ATOM 1189 NZ LYS A 74 10.212 -7.659 8.968 1.00 0.00 N ATOM 0 H LYS A 74 6.624 -2.598 6.003 1.00 0.00 H new ATOM 0 HA LYS A 74 8.649 -1.500 7.572 1.00 0.00 H new ATOM 0 HB2 LYS A 74 7.234 -2.971 8.667 1.00 0.00 H new ATOM 0 HB3 LYS A 74 7.201 -4.113 7.338 1.00 0.00 H new ATOM 0 HG2 LYS A 74 9.851 -3.869 8.620 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.592 -4.433 9.700 1.00 0.00 H new ATOM 0 HD2 LYS A 74 8.091 -5.875 7.366 1.00 0.00 H new ATOM 0 HD3 LYS A 74 9.841 -5.789 7.398 1.00 0.00 H new ATOM 0 HE2 LYS A 74 8.935 -6.374 10.066 1.00 0.00 H new ATOM 0 HE3 LYS A 74 8.104 -7.455 8.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 10.271 -8.293 9.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 10.173 -8.225 8.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 11.050 -7.044 8.944 1.00 0.00 H new ATOM 1203 N GLU A 75 9.765 -3.546 5.284 1.00 0.00 N ATOM 1204 CA GLU A 75 10.983 -4.034 4.643 1.00 0.00 C ATOM 1205 C GLU A 75 11.755 -2.881 4.012 1.00 0.00 C ATOM 1206 O GLU A 75 12.987 -2.870 4.007 1.00 0.00 O ATOM 1207 CB GLU A 75 10.646 -5.077 3.577 1.00 0.00 C ATOM 1208 CG GLU A 75 11.808 -5.995 3.238 1.00 0.00 C ATOM 1209 CD GLU A 75 11.365 -7.421 2.979 1.00 0.00 C ATOM 1210 OE1 GLU A 75 10.889 -7.701 1.858 1.00 0.00 O ATOM 1211 OE2 GLU A 75 11.494 -8.257 3.897 1.00 0.00 O ATOM 0 H GLU A 75 8.905 -3.772 4.784 1.00 0.00 H new ATOM 0 HA GLU A 75 11.606 -4.498 5.407 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.806 -5.680 3.923 1.00 0.00 H new ATOM 0 HB3 GLU A 75 10.320 -4.566 2.671 1.00 0.00 H new ATOM 0 HG2 GLU A 75 12.324 -5.613 2.357 1.00 0.00 H new ATOM 0 HG3 GLU A 75 12.526 -5.984 4.058 1.00 0.00 H new ATOM 1218 N VAL A 76 11.019 -1.902 3.500 1.00 0.00 N ATOM 1219 CA VAL A 76 11.628 -0.729 2.876 1.00 0.00 C ATOM 1220 C VAL A 76 11.818 0.388 3.891 1.00 0.00 C ATOM 1221 O VAL A 76 12.271 1.479 3.549 1.00 0.00 O ATOM 1222 CB VAL A 76 10.770 -0.181 1.718 1.00 0.00 C ATOM 1223 CG1 VAL A 76 11.602 0.719 0.818 1.00 0.00 C ATOM 1224 CG2 VAL A 76 10.134 -1.311 0.921 1.00 0.00 C ATOM 0 H VAL A 76 9.999 -1.895 3.504 1.00 0.00 H new ATOM 0 HA VAL A 76 12.592 -1.055 2.486 1.00 0.00 H new ATOM 0 HB VAL A 76 9.964 0.414 2.147 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.980 1.097 0.006 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.989 1.556 1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 76 12.434 0.150 0.403 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.535 -0.893 0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.915 -1.947 0.504 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.495 -1.904 1.576 1.00 0.00 H new ATOM 1234 N TYR A 77 11.451 0.117 5.139 1.00 0.00 N ATOM 1235 CA TYR A 77 11.563 1.106 6.196 1.00 0.00 C ATOM 1236 C TYR A 77 11.892 0.437 7.531 1.00 0.00 C ATOM 1237 O TYR A 77 11.001 -0.066 8.216 1.00 0.00 O ATOM 1238 CB TYR A 77 10.249 1.883 6.296 1.00 0.00 C ATOM 1239 CG TYR A 77 10.378 3.267 6.904 1.00 0.00 C ATOM 1240 CD1 TYR A 77 11.573 3.704 7.467 1.00 0.00 C ATOM 1241 CD2 TYR A 77 9.296 4.138 6.908 1.00 0.00 C ATOM 1242 CE1 TYR A 77 11.684 4.966 8.015 1.00 0.00 C ATOM 1243 CE2 TYR A 77 9.400 5.403 7.455 1.00 0.00 C ATOM 1244 CZ TYR A 77 10.595 5.811 8.007 1.00 0.00 C ATOM 1245 OH TYR A 77 10.702 7.071 8.553 1.00 0.00 O ATOM 0 H TYR A 77 11.073 -0.781 5.440 1.00 0.00 H new ATOM 0 HA TYR A 77 12.375 1.794 5.959 1.00 0.00 H new ATOM 0 HB2 TYR A 77 9.821 1.977 5.298 1.00 0.00 H new ATOM 0 HB3 TYR A 77 9.544 1.303 6.892 1.00 0.00 H new ATOM 0 HD1 TYR A 77 12.428 3.045 7.475 1.00 0.00 H new ATOM 0 HD2 TYR A 77 8.358 3.821 6.477 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.619 5.290 8.448 1.00 0.00 H new ATOM 0 HE2 TYR A 77 8.549 6.068 7.450 1.00 0.00 H new ATOM 0 HH TYR A 77 9.846 7.539 8.466 1.00 0.00 H new ATOM 1255 N PRO A 78 13.183 0.413 7.916 1.00 0.00 N ATOM 1256 CA PRO A 78 13.625 -0.209 9.170 1.00 0.00 C ATOM 1257 C PRO A 78 12.885 0.336 10.386 1.00 0.00 C ATOM 1258 O PRO A 78 12.725 -0.361 11.389 1.00 0.00 O ATOM 1259 CB PRO A 78 15.120 0.136 9.250 1.00 0.00 C ATOM 1260 CG PRO A 78 15.344 1.202 8.230 1.00 0.00 C ATOM 1261 CD PRO A 78 14.314 0.980 7.164 1.00 0.00 C ATOM 0 HA PRO A 78 13.426 -1.281 9.175 1.00 0.00 H new ATOM 0 HB2 PRO A 78 15.388 0.486 10.247 1.00 0.00 H new ATOM 0 HB3 PRO A 78 15.735 -0.739 9.043 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.240 2.193 8.672 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.351 1.141 7.818 1.00 0.00 H new ATOM 0 HD2 PRO A 78 14.042 1.910 6.665 1.00 0.00 H new ATOM 0 HD3 PRO A 78 14.670 0.297 6.393 1.00 0.00 H new ATOM 1269 N GLU A 79 12.438 1.584 10.297 1.00 0.00 N ATOM 1270 CA GLU A 79 11.717 2.215 11.398 1.00 0.00 C ATOM 1271 C GLU A 79 10.444 1.444 11.738 1.00 0.00 C ATOM 1272 O GLU A 79 9.899 1.586 12.833 1.00 0.00 O ATOM 1273 CB GLU A 79 11.370 3.662 11.042 1.00 0.00 C ATOM 1274 CG GLU A 79 12.589 4.543 10.828 1.00 0.00 C ATOM 1275 CD GLU A 79 13.346 4.815 12.113 1.00 0.00 C ATOM 1276 OE1 GLU A 79 13.831 3.846 12.732 1.00 0.00 O ATOM 1277 OE2 GLU A 79 13.454 5.998 12.498 1.00 0.00 O ATOM 0 H GLU A 79 12.561 2.178 9.477 1.00 0.00 H new ATOM 0 HA GLU A 79 12.366 2.205 12.274 1.00 0.00 H new ATOM 0 HB2 GLU A 79 10.763 3.669 10.137 1.00 0.00 H new ATOM 0 HB3 GLU A 79 10.760 4.087 11.839 1.00 0.00 H new ATOM 0 HG2 GLU A 79 13.257 4.065 10.112 1.00 0.00 H new ATOM 0 HG3 GLU A 79 12.275 5.490 10.388 1.00 0.00 H new ATOM 1284 N ALA A 80 9.973 0.631 10.798 1.00 0.00 N ATOM 1285 CA ALA A 80 8.763 -0.156 11.005 1.00 0.00 C ATOM 1286 C ALA A 80 9.092 -1.565 11.494 1.00 0.00 C ATOM 1287 O ALA A 80 8.329 -2.162 12.252 1.00 0.00 O ATOM 1288 CB ALA A 80 7.951 -0.214 9.721 1.00 0.00 C ATOM 0 H ALA A 80 10.411 0.500 9.886 1.00 0.00 H new ATOM 0 HA ALA A 80 8.170 0.332 11.778 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.050 -0.804 9.887 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.673 0.796 9.420 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.547 -0.676 8.934 1.00 0.00 H new ATOM 1294 N ARG A 81 10.231 -2.091 11.048 1.00 0.00 N ATOM 1295 CA ARG A 81 10.663 -3.434 11.434 1.00 0.00 C ATOM 1296 C ARG A 81 10.526 -3.658 12.938 1.00 0.00 C ATOM 1297 O ARG A 81 10.331 -4.786 13.391 1.00 0.00 O ATOM 1298 CB ARG A 81 12.112 -3.668 10.998 1.00 0.00 C ATOM 1299 CG ARG A 81 12.269 -4.796 9.994 1.00 0.00 C ATOM 1300 CD ARG A 81 13.333 -4.475 8.954 1.00 0.00 C ATOM 1301 NE ARG A 81 14.683 -4.708 9.465 1.00 0.00 N ATOM 1302 CZ ARG A 81 15.607 -5.434 8.837 1.00 0.00 C ATOM 1303 NH1 ARG A 81 15.344 -6.002 7.666 1.00 0.00 N ATOM 1304 NH2 ARG A 81 16.804 -5.592 9.384 1.00 0.00 N ATOM 0 H ARG A 81 10.872 -1.608 10.419 1.00 0.00 H new ATOM 0 HA ARG A 81 10.014 -4.150 10.929 1.00 0.00 H new ATOM 0 HB2 ARG A 81 12.505 -2.749 10.564 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.716 -3.889 11.878 1.00 0.00 H new ATOM 0 HG2 ARG A 81 12.535 -5.715 10.517 1.00 0.00 H new ATOM 0 HG3 ARG A 81 11.316 -4.977 9.497 1.00 0.00 H new ATOM 0 HD2 ARG A 81 13.170 -5.087 8.067 1.00 0.00 H new ATOM 0 HD3 ARG A 81 13.236 -3.434 8.645 1.00 0.00 H new ATOM 0 HE ARG A 81 14.934 -4.288 10.360 1.00 0.00 H new ATOM 0 HH11 ARG A 81 14.426 -5.885 7.237 1.00 0.00 H new ATOM 0 HH12 ARG A 81 16.060 -6.555 7.195 1.00 0.00 H new ATOM 0 HH21 ARG A 81 17.015 -5.158 10.283 1.00 0.00 H new ATOM 0 HH22 ARG A 81 17.514 -6.147 8.906 1.00 0.00 H new ATOM 1318 N LYS A 82 10.627 -2.579 13.709 1.00 0.00 N ATOM 1319 CA LYS A 82 10.513 -2.665 15.162 1.00 0.00 C ATOM 1320 C LYS A 82 9.183 -3.292 15.568 1.00 0.00 C ATOM 1321 O LYS A 82 8.148 -3.028 14.959 1.00 0.00 O ATOM 1322 CB LYS A 82 10.647 -1.276 15.787 1.00 0.00 C ATOM 1323 CG LYS A 82 12.087 -0.816 15.941 1.00 0.00 C ATOM 1324 CD LYS A 82 12.764 -1.495 17.121 1.00 0.00 C ATOM 1325 CE LYS A 82 12.580 -0.699 18.403 1.00 0.00 C ATOM 1326 NZ LYS A 82 13.389 0.551 18.402 1.00 0.00 N ATOM 0 H LYS A 82 10.787 -1.637 13.353 1.00 0.00 H new ATOM 0 HA LYS A 82 11.320 -3.300 15.528 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.108 -0.556 15.171 1.00 0.00 H new ATOM 0 HB3 LYS A 82 10.168 -1.279 16.766 1.00 0.00 H new ATOM 0 HG2 LYS A 82 12.640 -1.035 15.027 1.00 0.00 H new ATOM 0 HG3 LYS A 82 12.112 0.265 16.078 1.00 0.00 H new ATOM 0 HD2 LYS A 82 12.353 -2.496 17.251 1.00 0.00 H new ATOM 0 HD3 LYS A 82 13.828 -1.612 16.914 1.00 0.00 H new ATOM 0 HE2 LYS A 82 11.526 -0.449 18.527 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.864 -1.315 19.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.484 0.904 19.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 14.333 0.353 18.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.917 1.270 17.817 1.00 0.00 H new ATOM 1340 N LYS A 83 9.219 -4.127 16.603 1.00 0.00 N ATOM 1341 CA LYS A 83 8.016 -4.791 17.091 1.00 0.00 C ATOM 1342 C LYS A 83 7.103 -3.801 17.807 1.00 0.00 C ATOM 1343 O LYS A 83 7.567 -2.961 18.579 1.00 0.00 O ATOM 1344 CB LYS A 83 8.386 -5.938 18.033 1.00 0.00 C ATOM 1345 CG LYS A 83 9.257 -5.506 19.202 1.00 0.00 C ATOM 1346 CD LYS A 83 8.686 -5.979 20.531 1.00 0.00 C ATOM 1347 CE LYS A 83 9.400 -7.223 21.038 1.00 0.00 C ATOM 1348 NZ LYS A 83 9.929 -7.036 22.417 1.00 0.00 N ATOM 0 H LYS A 83 10.068 -4.359 17.119 1.00 0.00 H new ATOM 0 HA LYS A 83 7.480 -5.197 16.233 1.00 0.00 H new ATOM 0 HB2 LYS A 83 7.472 -6.390 18.419 1.00 0.00 H new ATOM 0 HB3 LYS A 83 8.908 -6.709 17.466 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.263 -5.906 19.074 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.345 -4.420 19.209 1.00 0.00 H new ATOM 0 HD2 LYS A 83 8.774 -5.182 21.269 1.00 0.00 H new ATOM 0 HD3 LYS A 83 7.623 -6.191 20.416 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.711 -8.068 21.025 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.221 -7.470 20.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.408 -7.906 22.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 10.606 -6.246 22.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 9.143 -6.825 23.065 1.00 0.00 H new ATOM 1362 N GLY A 84 5.805 -3.906 17.545 1.00 0.00 N ATOM 1363 CA GLY A 84 4.849 -3.011 18.171 1.00 0.00 C ATOM 1364 C GLY A 84 4.636 -1.735 17.379 1.00 0.00 C ATOM 1365 O GLY A 84 4.011 -0.793 17.869 1.00 0.00 O ATOM 0 H GLY A 84 5.398 -4.594 16.911 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.895 -3.527 18.285 1.00 0.00 H new ATOM 0 HA3 GLY A 84 5.196 -2.758 19.173 1.00 0.00 H new ATOM 1369 N THR A 85 5.154 -1.700 16.154 1.00 0.00 N ATOM 1370 CA THR A 85 5.014 -0.527 15.299 1.00 0.00 C ATOM 1371 C THR A 85 3.591 -0.414 14.763 1.00 0.00 C ATOM 1372 O THR A 85 3.090 -1.325 14.106 1.00 0.00 O ATOM 1373 CB THR A 85 6.007 -0.594 14.140 1.00 0.00 C ATOM 1374 OG1 THR A 85 7.334 -0.709 14.623 1.00 0.00 O ATOM 1375 CG2 THR A 85 5.951 0.612 13.232 1.00 0.00 C ATOM 0 H THR A 85 5.674 -2.470 15.733 1.00 0.00 H new ATOM 0 HA THR A 85 5.228 0.358 15.898 1.00 0.00 H new ATOM 0 HB THR A 85 5.719 -1.473 13.564 1.00 0.00 H new ATOM 0 HG1 THR A 85 7.737 -1.533 14.279 1.00 0.00 H new ATOM 0 HG21 THR A 85 6.682 0.499 12.431 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.953 0.698 12.803 1.00 0.00 H new ATOM 0 HG23 THR A 85 6.178 1.510 13.806 1.00 0.00 H new ATOM 1383 N HIS A 86 2.946 0.711 15.052 1.00 0.00 N ATOM 1384 CA HIS A 86 1.578 0.947 14.604 1.00 0.00 C ATOM 1385 C HIS A 86 1.556 1.775 13.324 1.00 0.00 C ATOM 1386 O HIS A 86 1.788 2.983 13.353 1.00 0.00 O ATOM 1387 CB HIS A 86 0.785 1.661 15.700 1.00 0.00 C ATOM 1388 CG HIS A 86 -0.701 1.583 15.520 1.00 0.00 C ATOM 1389 ND1 HIS A 86 -1.365 2.178 14.470 1.00 0.00 N ATOM 1390 CD2 HIS A 86 -1.652 0.979 16.271 1.00 0.00 C ATOM 1391 CE1 HIS A 86 -2.661 1.945 14.582 1.00 0.00 C ATOM 1392 NE2 HIS A 86 -2.860 1.218 15.665 1.00 0.00 N ATOM 0 H HIS A 86 3.349 1.475 15.595 1.00 0.00 H new ATOM 0 HA HIS A 86 1.117 -0.018 14.394 1.00 0.00 H new ATOM 0 HB2 HIS A 86 1.048 1.229 16.666 1.00 0.00 H new ATOM 0 HB3 HIS A 86 1.084 2.709 15.728 1.00 0.00 H new ATOM 0 HD1 HIS A 86 -0.925 2.715 13.723 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.490 0.415 17.177 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -3.426 2.291 13.903 1.00 0.00 H new ATOM 1400 N PHE A 87 1.267 1.121 12.199 1.00 0.00 N ATOM 1401 CA PHE A 87 1.212 1.819 10.914 1.00 0.00 C ATOM 1402 C PHE A 87 -0.218 1.890 10.388 1.00 0.00 C ATOM 1403 O PHE A 87 -0.924 0.884 10.339 1.00 0.00 O ATOM 1404 CB PHE A 87 2.120 1.149 9.873 1.00 0.00 C ATOM 1405 CG PHE A 87 2.686 -0.172 10.304 1.00 0.00 C ATOM 1406 CD1 PHE A 87 1.895 -1.306 10.306 1.00 0.00 C ATOM 1407 CD2 PHE A 87 4.008 -0.277 10.699 1.00 0.00 C ATOM 1408 CE1 PHE A 87 2.412 -2.525 10.696 1.00 0.00 C ATOM 1409 CE2 PHE A 87 4.532 -1.492 11.092 1.00 0.00 C ATOM 1410 CZ PHE A 87 3.732 -2.618 11.090 1.00 0.00 C ATOM 0 H PHE A 87 1.070 0.121 12.150 1.00 0.00 H new ATOM 0 HA PHE A 87 1.573 2.833 11.083 1.00 0.00 H new ATOM 0 HB2 PHE A 87 1.553 1.005 8.953 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.943 1.824 9.638 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.862 -1.237 9.999 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.637 0.601 10.700 1.00 0.00 H new ATOM 0 HE1 PHE A 87 1.785 -3.404 10.693 1.00 0.00 H new ATOM 0 HE2 PHE A 87 5.565 -1.562 11.400 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.139 -3.570 11.396 1.00 0.00 H new ATOM 1420 N ASN A 88 -0.636 3.093 9.996 1.00 0.00 N ATOM 1421 CA ASN A 88 -1.981 3.304 9.473 1.00 0.00 C ATOM 1422 C ASN A 88 -1.946 3.605 7.977 1.00 0.00 C ATOM 1423 O ASN A 88 -1.344 4.586 7.546 1.00 0.00 O ATOM 1424 CB ASN A 88 -2.666 4.451 10.219 1.00 0.00 C ATOM 1425 CG ASN A 88 -2.916 4.125 11.678 1.00 0.00 C ATOM 1426 OD1 ASN A 88 -1.984 3.854 12.434 1.00 0.00 O ATOM 1427 ND2 ASN A 88 -4.181 4.148 12.081 1.00 0.00 N ATOM 0 H ASN A 88 -0.061 3.935 10.032 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.550 2.387 9.626 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -2.047 5.346 10.151 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.614 4.681 9.733 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.411 3.936 13.052 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.923 4.378 11.420 1.00 0.00 H new ATOM 1434 N PHE A 89 -2.602 2.754 7.193 1.00 0.00 N ATOM 1435 CA PHE A 89 -2.649 2.925 5.744 1.00 0.00 C ATOM 1436 C PHE A 89 -3.743 3.906 5.338 1.00 0.00 C ATOM 1437 O PHE A 89 -4.905 3.749 5.716 1.00 0.00 O ATOM 1438 CB PHE A 89 -2.885 1.578 5.056 1.00 0.00 C ATOM 1439 CG PHE A 89 -1.947 0.498 5.512 1.00 0.00 C ATOM 1440 CD1 PHE A 89 -2.190 -0.193 6.686 1.00 0.00 C ATOM 1441 CD2 PHE A 89 -0.826 0.174 4.768 1.00 0.00 C ATOM 1442 CE1 PHE A 89 -1.337 -1.185 7.113 1.00 0.00 C ATOM 1443 CE2 PHE A 89 0.035 -0.823 5.189 1.00 0.00 C ATOM 1444 CZ PHE A 89 -0.220 -1.503 6.365 1.00 0.00 C ATOM 0 H PHE A 89 -3.109 1.938 7.537 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.688 3.330 5.427 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.911 1.259 5.242 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.781 1.707 3.979 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.062 0.050 7.276 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.622 0.705 3.850 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.541 -1.714 8.032 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.906 -1.070 4.600 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.452 -2.280 6.698 1.00 0.00 H new ATOM 1454 N ALA A 90 -3.357 4.913 4.560 1.00 0.00 N ATOM 1455 CA ALA A 90 -4.295 5.924 4.087 1.00 0.00 C ATOM 1456 C ALA A 90 -4.064 6.240 2.614 1.00 0.00 C ATOM 1457 O ALA A 90 -3.092 5.782 2.015 1.00 0.00 O ATOM 1458 CB ALA A 90 -4.171 7.192 4.921 1.00 0.00 C ATOM 0 H ALA A 90 -2.397 5.050 4.243 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.304 5.525 4.196 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -4.877 7.938 4.556 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -4.390 6.964 5.964 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -3.157 7.583 4.840 1.00 0.00 H new ATOM 1464 N ILE A 91 -4.960 7.033 2.042 1.00 0.00 N ATOM 1465 CA ILE A 91 -4.858 7.429 0.647 1.00 0.00 C ATOM 1466 C ILE A 91 -4.765 8.944 0.536 1.00 0.00 C ATOM 1467 O ILE A 91 -5.766 9.646 0.685 1.00 0.00 O ATOM 1468 CB ILE A 91 -6.066 6.936 -0.173 1.00 0.00 C ATOM 1469 CG1 ILE A 91 -6.304 5.444 0.071 1.00 0.00 C ATOM 1470 CG2 ILE A 91 -5.849 7.209 -1.654 1.00 0.00 C ATOM 1471 CD1 ILE A 91 -7.734 5.012 -0.179 1.00 0.00 C ATOM 0 H ILE A 91 -5.771 7.416 2.528 1.00 0.00 H new ATOM 0 HA ILE A 91 -3.955 6.970 0.243 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.952 7.482 0.151 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -5.641 4.868 -0.574 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.035 5.205 1.100 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.711 6.855 -2.219 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.726 8.280 -1.812 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.954 6.687 -1.993 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -7.830 3.943 0.013 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -8.401 5.562 0.485 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -8.001 5.220 -1.215 1.00 0.00 H new ATOM 1483 N VAL A 92 -3.557 9.440 0.288 1.00 0.00 N ATOM 1484 CA VAL A 92 -3.326 10.876 0.172 1.00 0.00 C ATOM 1485 C VAL A 92 -2.454 11.199 -1.041 1.00 0.00 C ATOM 1486 O VAL A 92 -1.582 10.416 -1.414 1.00 0.00 O ATOM 1487 CB VAL A 92 -2.663 11.443 1.455 1.00 0.00 C ATOM 1488 CG1 VAL A 92 -3.094 10.652 2.682 1.00 0.00 C ATOM 1489 CG2 VAL A 92 -1.143 11.450 1.333 1.00 0.00 C ATOM 0 H VAL A 92 -2.722 8.868 0.163 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.300 11.348 0.041 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.998 12.473 1.573 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.616 11.068 3.569 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.177 10.711 2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.798 9.610 2.565 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.706 11.853 2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.786 10.432 1.178 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -0.849 12.071 0.487 1.00 0.00 H new ATOM 1673 N VAL A 103 -7.748 12.773 1.439 1.00 0.00 N ATOM 1674 CA VAL A 103 -6.754 12.146 2.300 1.00 0.00 C ATOM 1675 C VAL A 103 -7.421 11.515 3.519 1.00 0.00 C ATOM 1676 O VAL A 103 -7.852 12.214 4.437 1.00 0.00 O ATOM 1677 CB VAL A 103 -5.675 13.165 2.751 1.00 0.00 C ATOM 1678 CG1 VAL A 103 -6.300 14.522 3.052 1.00 0.00 C ATOM 1679 CG2 VAL A 103 -4.897 12.652 3.958 1.00 0.00 C ATOM 0 HA VAL A 103 -6.262 11.364 1.721 1.00 0.00 H new ATOM 0 HB VAL A 103 -4.972 13.287 1.927 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.523 15.219 3.366 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.789 14.904 2.156 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.035 14.415 3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.149 13.389 4.249 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.583 12.484 4.788 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.402 11.715 3.701 1.00 0.00 H new ATOM 1689 N LYS A 104 -7.509 10.187 3.517 1.00 0.00 N ATOM 1690 CA LYS A 104 -8.132 9.461 4.621 1.00 0.00 C ATOM 1691 C LYS A 104 -7.515 8.077 4.794 1.00 0.00 C ATOM 1692 O LYS A 104 -6.900 7.542 3.874 1.00 0.00 O ATOM 1693 CB LYS A 104 -9.639 9.333 4.386 1.00 0.00 C ATOM 1694 CG LYS A 104 -10.459 9.337 5.667 1.00 0.00 C ATOM 1695 CD LYS A 104 -11.280 8.066 5.810 1.00 0.00 C ATOM 1696 CE LYS A 104 -12.700 8.260 5.301 1.00 0.00 C ATOM 1697 NZ LYS A 104 -13.567 7.092 5.617 1.00 0.00 N ATOM 0 H LYS A 104 -7.158 9.593 2.766 1.00 0.00 H new ATOM 0 HA LYS A 104 -7.956 10.028 5.535 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.970 10.154 3.750 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.836 8.409 3.842 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -9.794 9.440 6.525 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -11.122 10.202 5.672 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -10.801 7.258 5.257 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -11.306 7.764 6.857 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -13.126 9.159 5.746 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -12.681 8.417 4.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -14.526 7.263 5.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -13.175 6.238 5.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -13.606 6.957 6.648 1.00 0.00 H new ATOM 1711 N GLU A 105 -7.684 7.502 5.983 1.00 0.00 N ATOM 1712 CA GLU A 105 -7.144 6.179 6.279 1.00 0.00 C ATOM 1713 C GLU A 105 -8.211 5.100 6.092 1.00 0.00 C ATOM 1714 O GLU A 105 -9.396 5.338 6.321 1.00 0.00 O ATOM 1715 CB GLU A 105 -6.580 6.149 7.706 1.00 0.00 C ATOM 1716 CG GLU A 105 -6.245 4.755 8.217 1.00 0.00 C ATOM 1717 CD GLU A 105 -7.227 4.264 9.263 1.00 0.00 C ATOM 1718 OE1 GLU A 105 -8.388 3.982 8.901 1.00 0.00 O ATOM 1719 OE2 GLU A 105 -6.834 4.162 10.443 1.00 0.00 O ATOM 0 H GLU A 105 -8.191 7.933 6.756 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.334 5.969 5.580 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.680 6.762 7.741 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.304 6.606 8.380 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.234 4.058 7.379 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.241 4.759 8.641 1.00 0.00 H new ATOM 1726 N ILE A 106 -7.777 3.916 5.665 1.00 0.00 N ATOM 1727 CA ILE A 106 -8.693 2.801 5.434 1.00 0.00 C ATOM 1728 C ILE A 106 -8.459 1.664 6.427 1.00 0.00 C ATOM 1729 O ILE A 106 -9.346 0.842 6.659 1.00 0.00 O ATOM 1730 CB ILE A 106 -8.566 2.248 3.998 1.00 0.00 C ATOM 1731 CG1 ILE A 106 -7.099 2.201 3.558 1.00 0.00 C ATOM 1732 CG2 ILE A 106 -9.384 3.093 3.034 1.00 0.00 C ATOM 1733 CD1 ILE A 106 -6.284 1.150 4.277 1.00 0.00 C ATOM 0 H ILE A 106 -6.798 3.704 5.472 1.00 0.00 H new ATOM 0 HA ILE A 106 -9.699 3.197 5.576 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.955 1.230 3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.056 2.011 2.486 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.646 3.178 3.727 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -9.286 2.692 2.025 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.432 3.073 3.332 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.021 4.121 3.053 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.256 1.175 3.914 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.296 1.351 5.348 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.712 0.165 4.088 1.00 0.00 H new ATOM 1745 N GLY A 107 -7.265 1.617 7.011 1.00 0.00 N ATOM 1746 CA GLY A 107 -6.948 0.572 7.972 1.00 0.00 C ATOM 1747 C GLY A 107 -5.499 0.621 8.410 1.00 0.00 C ATOM 1748 O GLY A 107 -4.654 1.128 7.679 1.00 0.00 O ATOM 0 H GLY A 107 -6.512 2.282 6.837 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.594 0.674 8.844 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.160 -0.402 7.531 1.00 0.00 H new ATOM 1752 N SER A 108 -5.213 0.114 9.608 1.00 0.00 N ATOM 1753 CA SER A 108 -3.854 0.124 10.136 1.00 0.00 C ATOM 1754 C SER A 108 -3.435 -1.258 10.636 1.00 0.00 C ATOM 1755 O SER A 108 -4.229 -1.979 11.238 1.00 0.00 O ATOM 1756 CB SER A 108 -3.753 1.134 11.278 1.00 0.00 C ATOM 1757 OG SER A 108 -4.508 0.712 12.400 1.00 0.00 O ATOM 0 H SER A 108 -5.904 -0.308 10.229 1.00 0.00 H new ATOM 0 HA SER A 108 -3.182 0.408 9.327 1.00 0.00 H new ATOM 0 HB2 SER A 108 -2.709 1.260 11.565 1.00 0.00 H new ATOM 0 HB3 SER A 108 -4.111 2.107 10.940 1.00 0.00 H new ATOM 0 HG SER A 108 -4.960 1.484 12.799 1.00 0.00 H new ATOM 1763 N THR A 109 -2.175 -1.611 10.390 1.00 0.00 N ATOM 1764 CA THR A 109 -1.641 -2.899 10.825 1.00 0.00 C ATOM 1765 C THR A 109 -0.565 -2.703 11.887 1.00 0.00 C ATOM 1766 O THR A 109 -0.381 -1.602 12.406 1.00 0.00 O ATOM 1767 CB THR A 109 -1.068 -3.677 9.640 1.00 0.00 C ATOM 1768 OG1 THR A 109 -0.063 -2.929 8.980 1.00 0.00 O ATOM 1769 CG2 THR A 109 -2.110 -4.056 8.617 1.00 0.00 C ATOM 0 H THR A 109 -1.506 -1.024 9.892 1.00 0.00 H new ATOM 0 HA THR A 109 -2.461 -3.474 11.256 1.00 0.00 H new ATOM 0 HB THR A 109 -0.655 -4.590 10.069 1.00 0.00 H new ATOM 0 HG1 THR A 109 0.711 -2.826 9.573 1.00 0.00 H new ATOM 0 HG21 THR A 109 -1.638 -4.606 7.803 1.00 0.00 H new ATOM 0 HG22 THR A 109 -2.869 -4.683 9.086 1.00 0.00 H new ATOM 0 HG23 THR A 109 -2.578 -3.154 8.222 1.00 0.00 H new ATOM 1777 N MET A 110 0.141 -3.781 12.208 1.00 0.00 N ATOM 1778 CA MET A 110 1.199 -3.737 13.208 1.00 0.00 C ATOM 1779 C MET A 110 2.355 -4.649 12.810 1.00 0.00 C ATOM 1780 O MET A 110 2.204 -5.516 11.950 1.00 0.00 O ATOM 1781 CB MET A 110 0.656 -4.173 14.565 1.00 0.00 C ATOM 1782 CG MET A 110 -0.595 -3.429 15.010 1.00 0.00 C ATOM 1783 SD MET A 110 -0.250 -1.781 15.655 1.00 0.00 S ATOM 1784 CE MET A 110 1.262 -2.066 16.573 1.00 0.00 C ATOM 0 H MET A 110 -0.002 -4.699 11.788 1.00 0.00 H new ATOM 0 HA MET A 110 1.563 -2.712 13.273 1.00 0.00 H new ATOM 0 HB2 MET A 110 0.436 -5.240 14.529 1.00 0.00 H new ATOM 0 HB3 MET A 110 1.434 -4.033 15.316 1.00 0.00 H new ATOM 0 HG2 MET A 110 -1.280 -3.346 14.166 1.00 0.00 H new ATOM 0 HG3 MET A 110 -1.104 -4.013 15.777 1.00 0.00 H new ATOM 0 HE1 MET A 110 1.555 -1.150 17.085 1.00 0.00 H new ATOM 0 HE2 MET A 110 1.099 -2.856 17.306 1.00 0.00 H new ATOM 0 HE3 MET A 110 2.053 -2.366 15.886 1.00 0.00 H new ATOM 1794 N SER A 111 3.505 -4.458 13.446 1.00 0.00 N ATOM 1795 CA SER A 111 4.676 -5.277 13.156 1.00 0.00 C ATOM 1796 C SER A 111 4.674 -6.537 14.014 1.00 0.00 C ATOM 1797 O SER A 111 5.443 -6.654 14.969 1.00 0.00 O ATOM 1798 CB SER A 111 5.961 -4.483 13.397 1.00 0.00 C ATOM 1799 OG SER A 111 6.064 -3.393 12.498 1.00 0.00 O ATOM 0 H SER A 111 3.652 -3.747 14.162 1.00 0.00 H new ATOM 0 HA SER A 111 4.635 -5.567 12.106 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.978 -4.115 14.423 1.00 0.00 H new ATOM 0 HB3 SER A 111 6.824 -5.138 13.279 1.00 0.00 H new ATOM 0 HG SER A 111 5.228 -2.881 12.507 1.00 0.00 H new ATOM 1805 N GLY A 112 3.802 -7.478 13.667 1.00 0.00 N ATOM 1806 CA GLY A 112 3.712 -8.719 14.413 1.00 0.00 C ATOM 1807 C GLY A 112 2.458 -8.804 15.264 1.00 0.00 C ATOM 1808 O GLY A 112 2.419 -9.548 16.243 1.00 0.00 O ATOM 0 H GLY A 112 3.156 -7.403 12.882 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.731 -9.558 13.717 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.588 -8.817 15.054 1.00 0.00 H new ATOM 1812 N ARG A 113 1.431 -8.048 14.888 1.00 0.00 N ATOM 1813 CA ARG A 113 0.172 -8.056 15.627 1.00 0.00 C ATOM 1814 C ARG A 113 -1.012 -8.118 14.668 1.00 0.00 C ATOM 1815 O ARG A 113 -1.281 -7.170 13.931 1.00 0.00 O ATOM 1816 CB ARG A 113 0.071 -6.822 16.529 1.00 0.00 C ATOM 1817 CG ARG A 113 0.417 -7.110 17.982 1.00 0.00 C ATOM 1818 CD ARG A 113 -0.282 -6.149 18.929 1.00 0.00 C ATOM 1819 NE ARG A 113 -1.208 -6.841 19.823 1.00 0.00 N ATOM 1820 CZ ARG A 113 -1.538 -6.406 21.038 1.00 0.00 C ATOM 1821 NH1 ARG A 113 -1.030 -5.274 21.509 1.00 0.00 N ATOM 1822 NH2 ARG A 113 -2.382 -7.105 21.784 1.00 0.00 N ATOM 0 H ARG A 113 1.445 -7.425 14.080 1.00 0.00 H new ATOM 0 HA ARG A 113 0.149 -8.945 16.257 1.00 0.00 H new ATOM 0 HB2 ARG A 113 0.738 -6.048 16.150 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.942 -6.423 16.476 1.00 0.00 H new ATOM 0 HG2 ARG A 113 0.133 -8.133 18.227 1.00 0.00 H new ATOM 0 HG3 ARG A 113 1.496 -7.037 18.120 1.00 0.00 H new ATOM 0 HD2 ARG A 113 0.463 -5.616 19.520 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -0.826 -5.401 18.351 1.00 0.00 H new ATOM 0 HE ARG A 113 -1.628 -7.711 19.496 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -0.382 -4.730 20.940 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -1.288 -4.948 22.440 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -2.778 -7.975 21.427 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -2.635 -6.773 22.715 1.00 0.00 H new ATOM 1836 N LYS A 114 -1.702 -9.253 14.677 1.00 0.00 N ATOM 1837 CA LYS A 114 -2.848 -9.466 13.800 1.00 0.00 C ATOM 1838 C LYS A 114 -3.991 -8.502 14.111 1.00 0.00 C ATOM 1839 O LYS A 114 -4.710 -8.671 15.095 1.00 0.00 O ATOM 1840 CB LYS A 114 -3.342 -10.910 13.925 1.00 0.00 C ATOM 1841 CG LYS A 114 -3.027 -11.768 12.711 1.00 0.00 C ATOM 1842 CD LYS A 114 -3.506 -13.198 12.902 1.00 0.00 C ATOM 1843 CE LYS A 114 -3.642 -13.922 11.572 1.00 0.00 C ATOM 1844 NZ LYS A 114 -4.142 -15.314 11.746 1.00 0.00 N ATOM 0 H LYS A 114 -1.487 -10.043 15.285 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.519 -9.275 12.778 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.891 -11.364 14.807 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.420 -10.904 14.085 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.501 -11.339 11.828 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -1.952 -11.764 12.530 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.805 -13.736 13.540 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.467 -13.195 13.416 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.324 -13.369 10.926 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.675 -13.944 11.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.221 -15.773 10.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.478 -15.849 12.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.077 -15.293 12.202 1.00 0.00 H new ATOM 1858 N GLY A 115 -4.164 -7.506 13.249 1.00 0.00 N ATOM 1859 CA GLY A 115 -5.237 -6.546 13.429 1.00 0.00 C ATOM 1860 C GLY A 115 -6.504 -6.997 12.726 1.00 0.00 C ATOM 1861 O GLY A 115 -6.578 -8.127 12.245 1.00 0.00 O ATOM 0 H GLY A 115 -3.580 -7.346 12.428 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -5.436 -6.415 14.493 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -4.929 -5.576 13.040 1.00 0.00 H new ATOM 1865 N THR A 116 -7.500 -6.122 12.658 1.00 0.00 N ATOM 1866 CA THR A 116 -8.755 -6.459 11.996 1.00 0.00 C ATOM 1867 C THR A 116 -8.678 -6.169 10.501 1.00 0.00 C ATOM 1868 O THR A 116 -9.251 -6.892 9.685 1.00 0.00 O ATOM 1869 CB THR A 116 -9.918 -5.684 12.618 1.00 0.00 C ATOM 1870 OG1 THR A 116 -9.841 -5.716 14.032 1.00 0.00 O ATOM 1871 CG2 THR A 116 -11.277 -6.222 12.221 1.00 0.00 C ATOM 0 H THR A 116 -7.465 -5.181 13.050 1.00 0.00 H new ATOM 0 HA THR A 116 -8.928 -7.526 12.134 1.00 0.00 H new ATOM 0 HB THR A 116 -9.823 -4.666 12.239 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.592 -5.214 14.412 1.00 0.00 H new ATOM 0 HG21 THR A 116 -12.057 -5.627 12.697 1.00 0.00 H new ATOM 0 HG22 THR A 116 -11.388 -6.167 11.138 1.00 0.00 H new ATOM 0 HG23 THR A 116 -11.365 -7.260 12.542 1.00 0.00 H new ATOM 1879 N ASP A 117 -7.964 -5.104 10.150 1.00 0.00 N ATOM 1880 CA ASP A 117 -7.807 -4.709 8.755 1.00 0.00 C ATOM 1881 C ASP A 117 -6.778 -5.585 8.045 1.00 0.00 C ATOM 1882 O ASP A 117 -6.798 -5.709 6.822 1.00 0.00 O ATOM 1883 CB ASP A 117 -7.390 -3.240 8.665 1.00 0.00 C ATOM 1884 CG ASP A 117 -8.421 -2.308 9.270 1.00 0.00 C ATOM 1885 OD1 ASP A 117 -8.449 -2.179 10.512 1.00 0.00 O ATOM 1886 OD2 ASP A 117 -9.200 -1.705 8.501 1.00 0.00 O ATOM 0 H ASP A 117 -7.484 -4.498 10.815 1.00 0.00 H new ATOM 0 HA ASP A 117 -8.769 -4.842 8.259 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.437 -3.104 9.176 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.232 -2.973 7.620 1.00 0.00 H new ATOM 1891 N ASP A 118 -5.877 -6.184 8.819 1.00 0.00 N ATOM 1892 CA ASP A 118 -4.832 -7.046 8.266 1.00 0.00 C ATOM 1893 C ASP A 118 -5.395 -8.022 7.230 1.00 0.00 C ATOM 1894 O ASP A 118 -4.835 -8.176 6.144 1.00 0.00 O ATOM 1895 CB ASP A 118 -4.143 -7.824 9.390 1.00 0.00 C ATOM 1896 CG ASP A 118 -2.707 -7.384 9.604 1.00 0.00 C ATOM 1897 OD1 ASP A 118 -1.873 -7.625 8.704 1.00 0.00 O ATOM 1898 OD2 ASP A 118 -2.417 -6.801 10.669 1.00 0.00 O ATOM 0 H ASP A 118 -5.848 -6.089 9.834 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.105 -6.406 7.765 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.702 -7.691 10.316 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.163 -8.888 9.156 1.00 0.00 H new ATOM 1903 N SER A 119 -6.495 -8.683 7.575 1.00 0.00 N ATOM 1904 CA SER A 119 -7.122 -9.648 6.677 1.00 0.00 C ATOM 1905 C SER A 119 -7.784 -8.960 5.483 1.00 0.00 C ATOM 1906 O SER A 119 -8.177 -9.618 4.520 1.00 0.00 O ATOM 1907 CB SER A 119 -8.157 -10.482 7.438 1.00 0.00 C ATOM 1908 OG SER A 119 -7.656 -11.775 7.726 1.00 0.00 O ATOM 0 H SER A 119 -6.971 -8.569 8.470 1.00 0.00 H new ATOM 0 HA SER A 119 -6.338 -10.302 6.295 1.00 0.00 H new ATOM 0 HB2 SER A 119 -8.425 -9.977 8.366 1.00 0.00 H new ATOM 0 HB3 SER A 119 -9.068 -10.565 6.846 1.00 0.00 H new ATOM 0 HG SER A 119 -8.334 -12.288 8.214 1.00 0.00 H new ATOM 1914 N MET A 120 -7.902 -7.637 5.546 1.00 0.00 N ATOM 1915 CA MET A 120 -8.514 -6.874 4.465 1.00 0.00 C ATOM 1916 C MET A 120 -7.554 -6.743 3.289 1.00 0.00 C ATOM 1917 O MET A 120 -6.337 -6.785 3.464 1.00 0.00 O ATOM 1918 CB MET A 120 -8.925 -5.486 4.962 1.00 0.00 C ATOM 1919 CG MET A 120 -10.245 -5.000 4.390 1.00 0.00 C ATOM 1920 SD MET A 120 -10.915 -3.590 5.293 1.00 0.00 S ATOM 1921 CE MET A 120 -9.529 -2.459 5.230 1.00 0.00 C ATOM 0 H MET A 120 -7.582 -7.073 6.333 1.00 0.00 H new ATOM 0 HA MET A 120 -9.403 -7.408 4.130 1.00 0.00 H new ATOM 0 HB2 MET A 120 -8.995 -5.505 6.050 1.00 0.00 H new ATOM 0 HB3 MET A 120 -8.143 -4.771 4.706 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.104 -4.724 3.345 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.968 -5.816 4.410 1.00 0.00 H new ATOM 0 HE1 MET A 120 -9.051 -2.415 6.208 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.809 -2.807 4.489 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.882 -1.466 4.954 1.00 0.00 H new ATOM 1931 N THR A 121 -8.108 -6.583 2.090 1.00 0.00 N ATOM 1932 CA THR A 121 -7.296 -6.446 0.887 1.00 0.00 C ATOM 1933 C THR A 121 -7.276 -5.000 0.401 1.00 0.00 C ATOM 1934 O THR A 121 -8.205 -4.236 0.659 1.00 0.00 O ATOM 1935 CB THR A 121 -7.823 -7.365 -0.216 1.00 0.00 C ATOM 1936 OG1 THR A 121 -9.238 -7.424 -0.189 1.00 0.00 O ATOM 1937 CG2 THR A 121 -7.302 -8.783 -0.110 1.00 0.00 C ATOM 0 H THR A 121 -9.114 -6.545 1.927 1.00 0.00 H new ATOM 0 HA THR A 121 -6.275 -6.737 1.134 1.00 0.00 H new ATOM 0 HB THR A 121 -7.465 -6.931 -1.150 1.00 0.00 H new ATOM 0 HG1 THR A 121 -9.554 -8.016 -0.903 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.713 -9.383 -0.921 1.00 0.00 H new ATOM 0 HG22 THR A 121 -6.214 -8.777 -0.178 1.00 0.00 H new ATOM 0 HG23 THR A 121 -7.603 -9.211 0.846 1.00 0.00 H new ATOM 1945 N LEU A 122 -6.207 -4.632 -0.301 1.00 0.00 N ATOM 1946 CA LEU A 122 -6.060 -3.279 -0.822 1.00 0.00 C ATOM 1947 C LEU A 122 -7.192 -2.934 -1.787 1.00 0.00 C ATOM 1948 O LEU A 122 -7.802 -1.871 -1.689 1.00 0.00 O ATOM 1949 CB LEU A 122 -4.713 -3.133 -1.530 1.00 0.00 C ATOM 1950 CG LEU A 122 -3.565 -2.644 -0.648 1.00 0.00 C ATOM 1951 CD1 LEU A 122 -2.235 -2.819 -1.365 1.00 0.00 C ATOM 1952 CD2 LEU A 122 -3.776 -1.189 -0.251 1.00 0.00 C ATOM 0 H LEU A 122 -5.430 -5.254 -0.521 1.00 0.00 H new ATOM 0 HA LEU A 122 -6.104 -2.587 0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.438 -4.098 -1.956 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.831 -2.440 -2.363 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.547 -3.245 0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.427 -2.466 -0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.082 -3.873 -1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.242 -2.243 -2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.948 -0.859 0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.821 -0.570 -1.147 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.711 -1.095 0.302 1.00 0.00 H new ATOM 1964 N GLN A 123 -7.454 -3.837 -2.726 1.00 0.00 N ATOM 1965 CA GLN A 123 -8.500 -3.640 -3.730 1.00 0.00 C ATOM 1966 C GLN A 123 -9.777 -3.048 -3.128 1.00 0.00 C ATOM 1967 O GLN A 123 -10.518 -2.338 -3.807 1.00 0.00 O ATOM 1968 CB GLN A 123 -8.824 -4.968 -4.416 1.00 0.00 C ATOM 1969 CG GLN A 123 -9.341 -6.034 -3.462 1.00 0.00 C ATOM 1970 CD GLN A 123 -9.708 -7.323 -4.170 1.00 0.00 C ATOM 1971 OE1 GLN A 123 -10.534 -7.331 -5.083 1.00 0.00 O ATOM 1972 NE2 GLN A 123 -9.094 -8.424 -3.751 1.00 0.00 N ATOM 0 H GLN A 123 -6.953 -4.721 -2.815 1.00 0.00 H new ATOM 0 HA GLN A 123 -8.117 -2.927 -4.460 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -9.569 -4.794 -5.192 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -7.927 -5.340 -4.912 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -8.581 -6.241 -2.709 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -10.215 -5.652 -2.935 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -8.416 -8.372 -2.991 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -9.301 -9.321 -4.189 1.00 0.00 H new ATOM 1981 N SER A 124 -10.039 -3.352 -1.860 1.00 0.00 N ATOM 1982 CA SER A 124 -11.236 -2.852 -1.188 1.00 0.00 C ATOM 1983 C SER A 124 -11.091 -1.383 -0.802 1.00 0.00 C ATOM 1984 O SER A 124 -12.083 -0.661 -0.699 1.00 0.00 O ATOM 1985 CB SER A 124 -11.539 -3.694 0.052 1.00 0.00 C ATOM 1986 OG SER A 124 -12.918 -4.013 0.128 1.00 0.00 O ATOM 0 H SER A 124 -9.442 -3.940 -1.278 1.00 0.00 H new ATOM 0 HA SER A 124 -12.067 -2.933 -1.889 1.00 0.00 H new ATOM 0 HB2 SER A 124 -10.951 -4.612 0.025 1.00 0.00 H new ATOM 0 HB3 SER A 124 -11.239 -3.150 0.947 1.00 0.00 H new ATOM 0 HG SER A 124 -13.085 -4.553 0.928 1.00 0.00 H new ATOM 1992 N GLN A 125 -9.856 -0.943 -0.591 1.00 0.00 N ATOM 1993 CA GLN A 125 -9.595 0.445 -0.219 1.00 0.00 C ATOM 1994 C GLN A 125 -9.426 1.325 -1.457 1.00 0.00 C ATOM 1995 O GLN A 125 -8.951 2.457 -1.362 1.00 0.00 O ATOM 1996 CB GLN A 125 -8.343 0.543 0.659 1.00 0.00 C ATOM 1997 CG GLN A 125 -8.079 -0.695 1.505 1.00 0.00 C ATOM 1998 CD GLN A 125 -9.303 -1.148 2.275 1.00 0.00 C ATOM 1999 OE1 GLN A 125 -10.051 -0.331 2.812 1.00 0.00 O ATOM 2000 NE2 GLN A 125 -9.512 -2.458 2.334 1.00 0.00 N ATOM 0 H GLN A 125 -9.021 -1.524 -0.670 1.00 0.00 H new ATOM 0 HA GLN A 125 -10.456 0.802 0.346 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -7.478 0.725 0.021 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.441 1.406 1.318 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.740 -1.506 0.860 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -7.271 -0.486 2.206 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.866 -3.099 1.874 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -10.319 -2.823 2.840 1.00 0.00 H new ATOM 2009 N LYS A 126 -9.815 0.800 -2.617 1.00 0.00 N ATOM 2010 CA LYS A 126 -9.703 1.538 -3.870 1.00 0.00 C ATOM 2011 C LYS A 126 -8.241 1.761 -4.242 1.00 0.00 C ATOM 2012 O LYS A 126 -7.892 2.765 -4.861 1.00 0.00 O ATOM 2013 CB LYS A 126 -10.428 2.883 -3.770 1.00 0.00 C ATOM 2014 CG LYS A 126 -11.812 2.784 -3.146 1.00 0.00 C ATOM 2015 CD LYS A 126 -12.146 4.027 -2.335 1.00 0.00 C ATOM 2016 CE LYS A 126 -11.997 3.777 -0.843 1.00 0.00 C ATOM 2017 NZ LYS A 126 -12.917 4.631 -0.042 1.00 0.00 N ATOM 0 H LYS A 126 -10.211 -0.135 -2.714 1.00 0.00 H new ATOM 0 HA LYS A 126 -10.173 0.942 -4.652 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -9.821 3.570 -3.181 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -10.518 3.313 -4.768 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -12.557 2.648 -3.930 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -11.861 1.905 -2.504 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -11.491 4.845 -2.635 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -13.167 4.340 -2.552 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -12.198 2.727 -0.629 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.967 3.972 -0.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -12.784 4.430 0.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -12.709 5.633 -0.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -13.901 4.427 -0.309 1.00 0.00 H new ATOM 2031 N PHE A 127 -7.391 0.816 -3.857 1.00 0.00 N ATOM 2032 CA PHE A 127 -5.965 0.895 -4.142 1.00 0.00 C ATOM 2033 C PHE A 127 -5.642 0.240 -5.484 1.00 0.00 C ATOM 2034 O PHE A 127 -5.934 -0.937 -5.699 1.00 0.00 O ATOM 2035 CB PHE A 127 -5.178 0.230 -3.008 1.00 0.00 C ATOM 2036 CG PHE A 127 -3.738 -0.052 -3.333 1.00 0.00 C ATOM 2037 CD1 PHE A 127 -3.396 -1.121 -4.143 1.00 0.00 C ATOM 2038 CD2 PHE A 127 -2.729 0.747 -2.824 1.00 0.00 C ATOM 2039 CE1 PHE A 127 -2.076 -1.389 -4.442 1.00 0.00 C ATOM 2040 CE2 PHE A 127 -1.405 0.484 -3.117 1.00 0.00 C ATOM 2041 CZ PHE A 127 -1.079 -0.586 -3.928 1.00 0.00 C ATOM 0 H PHE A 127 -7.669 -0.020 -3.343 1.00 0.00 H new ATOM 0 HA PHE A 127 -5.674 1.944 -4.208 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -5.220 0.872 -2.128 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -5.668 -0.707 -2.743 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -4.173 -1.754 -4.546 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -2.980 1.585 -2.191 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.824 -2.225 -5.077 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -0.626 1.114 -2.713 1.00 0.00 H new ATOM 0 HZ PHE A 127 -0.045 -0.794 -4.159 1.00 0.00 H new ATOM 2051 N GLN A 128 -5.039 1.012 -6.382 1.00 0.00 N ATOM 2052 CA GLN A 128 -4.674 0.516 -7.704 1.00 0.00 C ATOM 2053 C GLN A 128 -3.282 1.002 -8.100 1.00 0.00 C ATOM 2054 O GLN A 128 -2.592 1.647 -7.311 1.00 0.00 O ATOM 2055 CB GLN A 128 -5.703 0.971 -8.741 1.00 0.00 C ATOM 2056 CG GLN A 128 -6.947 0.100 -8.786 1.00 0.00 C ATOM 2057 CD GLN A 128 -8.014 0.657 -9.707 1.00 0.00 C ATOM 2058 OE1 GLN A 128 -7.886 0.602 -10.930 1.00 0.00 O ATOM 2059 NE2 GLN A 128 -9.078 1.197 -9.122 1.00 0.00 N ATOM 0 H GLN A 128 -4.792 1.988 -6.217 1.00 0.00 H new ATOM 0 HA GLN A 128 -4.661 -0.573 -7.669 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -5.996 1.998 -8.523 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -5.236 0.975 -9.726 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -6.673 -0.902 -9.117 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -7.355 0.003 -7.780 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -9.143 1.221 -8.104 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -9.830 1.587 -9.691 1.00 0.00 H new ATOM 2068 N ILE A 129 -2.875 0.691 -9.328 1.00 0.00 N ATOM 2069 CA ILE A 129 -1.565 1.101 -9.823 1.00 0.00 C ATOM 2070 C ILE A 129 -1.476 2.618 -9.945 1.00 0.00 C ATOM 2071 O ILE A 129 -2.346 3.254 -10.543 1.00 0.00 O ATOM 2072 CB ILE A 129 -1.253 0.471 -11.194 1.00 0.00 C ATOM 2073 CG1 ILE A 129 -1.521 -1.036 -11.162 1.00 0.00 C ATOM 2074 CG2 ILE A 129 0.190 0.754 -11.587 1.00 0.00 C ATOM 2075 CD1 ILE A 129 -1.110 -1.756 -12.429 1.00 0.00 C ATOM 0 H ILE A 129 -3.432 0.158 -9.996 1.00 0.00 H new ATOM 0 HA ILE A 129 -0.832 0.750 -9.097 1.00 0.00 H new ATOM 0 HB ILE A 129 -1.907 0.918 -11.943 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -0.988 -1.473 -10.318 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -2.584 -1.203 -10.989 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.398 0.304 -12.558 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.347 1.831 -11.646 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.861 0.330 -10.839 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -1.331 -2.819 -12.331 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -1.662 -1.347 -13.275 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.041 -1.621 -12.594 1.00 0.00 H new ATOM 2087 N GLY A 130 -0.422 3.193 -9.374 1.00 0.00 N ATOM 2088 CA GLY A 130 -0.243 4.632 -9.431 1.00 0.00 C ATOM 2089 C GLY A 130 -0.905 5.352 -8.271 1.00 0.00 C ATOM 2090 O GLY A 130 -0.664 6.539 -8.053 1.00 0.00 O ATOM 0 H GLY A 130 0.310 2.689 -8.874 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.823 4.861 -9.435 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -0.653 5.008 -10.368 1.00 0.00 H new ATOM 2094 N ASP A 131 -1.743 4.636 -7.525 1.00 0.00 N ATOM 2095 CA ASP A 131 -2.438 5.221 -6.383 1.00 0.00 C ATOM 2096 C ASP A 131 -1.449 5.766 -5.364 1.00 0.00 C ATOM 2097 O ASP A 131 -0.278 5.382 -5.344 1.00 0.00 O ATOM 2098 CB ASP A 131 -3.347 4.183 -5.726 1.00 0.00 C ATOM 2099 CG ASP A 131 -4.626 4.792 -5.185 1.00 0.00 C ATOM 2100 OD1 ASP A 131 -5.444 5.275 -5.997 1.00 0.00 O ATOM 2101 OD2 ASP A 131 -4.812 4.786 -3.950 1.00 0.00 O ATOM 0 H ASP A 131 -1.956 3.652 -7.691 1.00 0.00 H new ATOM 0 HA ASP A 131 -3.047 6.048 -6.747 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.596 3.410 -6.453 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -2.808 3.695 -4.914 1.00 0.00 H new ATOM 2106 N TYR A 132 -1.922 6.674 -4.526 1.00 0.00 N ATOM 2107 CA TYR A 132 -1.080 7.289 -3.503 1.00 0.00 C ATOM 2108 C TYR A 132 -1.493 6.846 -2.099 1.00 0.00 C ATOM 2109 O TYR A 132 -2.548 7.233 -1.600 1.00 0.00 O ATOM 2110 CB TYR A 132 -1.151 8.815 -3.601 1.00 0.00 C ATOM 2111 CG TYR A 132 -1.149 9.334 -5.022 1.00 0.00 C ATOM 2112 CD1 TYR A 132 -0.042 9.162 -5.846 1.00 0.00 C ATOM 2113 CD2 TYR A 132 -2.253 9.999 -5.539 1.00 0.00 C ATOM 2114 CE1 TYR A 132 -0.040 9.637 -7.144 1.00 0.00 C ATOM 2115 CE2 TYR A 132 -2.258 10.477 -6.835 1.00 0.00 C ATOM 2116 CZ TYR A 132 -1.150 10.293 -7.633 1.00 0.00 C ATOM 2117 OH TYR A 132 -1.150 10.767 -8.926 1.00 0.00 O ATOM 0 H TYR A 132 -2.887 7.005 -4.531 1.00 0.00 H new ATOM 0 HA TYR A 132 -0.056 6.961 -3.679 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -2.054 9.161 -3.099 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -0.304 9.244 -3.066 1.00 0.00 H new ATOM 0 HD1 TYR A 132 0.829 8.649 -5.466 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -3.123 10.145 -4.917 1.00 0.00 H new ATOM 0 HE1 TYR A 132 0.827 9.495 -7.772 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -3.125 10.992 -7.221 1.00 0.00 H new ATOM 0 HH TYR A 132 -2.007 11.203 -9.115 1.00 0.00 H new ATOM 2127 N LEU A 133 -0.647 6.036 -1.468 1.00 0.00 N ATOM 2128 CA LEU A 133 -0.918 5.545 -0.120 1.00 0.00 C ATOM 2129 C LEU A 133 -0.004 6.230 0.892 1.00 0.00 C ATOM 2130 O LEU A 133 1.210 6.275 0.708 1.00 0.00 O ATOM 2131 CB LEU A 133 -0.701 4.029 -0.042 1.00 0.00 C ATOM 2132 CG LEU A 133 -1.868 3.149 -0.500 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -1.638 1.716 -0.051 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -3.194 3.662 0.045 1.00 0.00 C ATOM 0 H LEU A 133 0.231 5.706 -1.868 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.958 5.773 0.115 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.173 3.778 -0.643 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.463 3.771 0.990 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.917 3.185 -1.588 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.471 1.094 -0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -0.712 1.342 -0.487 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -1.566 1.682 1.036 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -4.002 3.016 -0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.165 3.660 1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.365 4.678 -0.311 1.00 0.00 H new ATOM 2146 N ASP A 134 -0.584 6.752 1.964 1.00 0.00 N ATOM 2147 CA ASP A 134 0.198 7.417 3.001 1.00 0.00 C ATOM 2148 C ASP A 134 0.123 6.641 4.308 1.00 0.00 C ATOM 2149 O ASP A 134 -0.882 6.695 5.017 1.00 0.00 O ATOM 2150 CB ASP A 134 -0.298 8.846 3.217 1.00 0.00 C ATOM 2151 CG ASP A 134 0.806 9.781 3.668 1.00 0.00 C ATOM 2152 OD1 ASP A 134 1.234 9.673 4.837 1.00 0.00 O ATOM 2153 OD2 ASP A 134 1.243 10.621 2.854 1.00 0.00 O ATOM 0 H ASP A 134 -1.589 6.729 2.139 1.00 0.00 H new ATOM 0 HA ASP A 134 1.236 7.452 2.671 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.731 9.221 2.290 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -1.094 8.842 3.962 1.00 0.00 H new ATOM 2158 N ILE A 135 1.187 5.909 4.620 1.00 0.00 N ATOM 2159 CA ILE A 135 1.231 5.115 5.838 1.00 0.00 C ATOM 2160 C ILE A 135 1.774 5.929 7.012 1.00 0.00 C ATOM 2161 O ILE A 135 2.728 6.693 6.871 1.00 0.00 O ATOM 2162 CB ILE A 135 2.088 3.844 5.643 1.00 0.00 C ATOM 2163 CG1 ILE A 135 1.422 2.906 4.630 1.00 0.00 C ATOM 2164 CG2 ILE A 135 2.306 3.128 6.970 1.00 0.00 C ATOM 2165 CD1 ILE A 135 2.268 2.639 3.406 1.00 0.00 C ATOM 0 H ILE A 135 2.028 5.850 4.046 1.00 0.00 H new ATOM 0 HA ILE A 135 0.207 4.817 6.065 1.00 0.00 H new ATOM 0 HB ILE A 135 3.062 4.143 5.256 1.00 0.00 H new ATOM 0 HG12 ILE A 135 1.196 1.958 5.119 1.00 0.00 H new ATOM 0 HG13 ILE A 135 0.471 3.338 4.317 1.00 0.00 H new ATOM 0 HG21 ILE A 135 2.912 2.237 6.807 1.00 0.00 H new ATOM 0 HG22 ILE A 135 2.820 3.794 7.663 1.00 0.00 H new ATOM 0 HG23 ILE A 135 1.343 2.840 7.391 1.00 0.00 H new ATOM 0 HD11 ILE A 135 1.734 1.968 2.734 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.473 3.579 2.893 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.208 2.177 3.707 1.00 0.00 H new ATOM 2177 N ALA A 136 1.156 5.754 8.175 1.00 0.00 N ATOM 2178 CA ALA A 136 1.569 6.461 9.381 1.00 0.00 C ATOM 2179 C ALA A 136 2.212 5.497 10.372 1.00 0.00 C ATOM 2180 O ALA A 136 1.515 4.812 11.117 1.00 0.00 O ATOM 2181 CB ALA A 136 0.375 7.157 10.016 1.00 0.00 C ATOM 0 H ALA A 136 0.364 5.126 8.308 1.00 0.00 H new ATOM 0 HA ALA A 136 2.308 7.214 9.107 1.00 0.00 H new ATOM 0 HB1 ALA A 136 0.696 7.682 10.916 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -0.047 7.872 9.310 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -0.381 6.417 10.278 1.00 0.00 H new ATOM 2187 N ILE A 137 3.541 5.446 10.373 1.00 0.00 N ATOM 2188 CA ILE A 137 4.269 4.554 11.273 1.00 0.00 C ATOM 2189 C ILE A 137 4.448 5.180 12.652 1.00 0.00 C ATOM 2190 O ILE A 137 4.956 6.293 12.782 1.00 0.00 O ATOM 2191 CB ILE A 137 5.652 4.186 10.699 1.00 0.00 C ATOM 2192 CG1 ILE A 137 5.519 3.709 9.252 1.00 0.00 C ATOM 2193 CG2 ILE A 137 6.314 3.118 11.556 1.00 0.00 C ATOM 2194 CD1 ILE A 137 6.843 3.361 8.607 1.00 0.00 C ATOM 0 H ILE A 137 4.135 6.009 9.764 1.00 0.00 H new ATOM 0 HA ILE A 137 3.671 3.648 11.370 1.00 0.00 H new ATOM 0 HB ILE A 137 6.282 5.076 10.711 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.869 2.834 9.224 1.00 0.00 H new ATOM 0 HG13 ILE A 137 5.031 4.487 8.665 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.289 2.869 11.138 1.00 0.00 H new ATOM 0 HG22 ILE A 137 6.440 3.493 12.572 1.00 0.00 H new ATOM 0 HG23 ILE A 137 5.688 2.226 11.573 1.00 0.00 H new ATOM 0 HD11 ILE A 137 6.673 3.031 7.582 1.00 0.00 H new ATOM 0 HD12 ILE A 137 7.488 4.240 8.603 1.00 0.00 H new ATOM 0 HD13 ILE A 137 7.323 2.561 9.171 1.00 0.00 H new ATOM 2206 N THR A 138 4.026 4.451 13.682 1.00 0.00 N ATOM 2207 CA THR A 138 4.137 4.926 15.057 1.00 0.00 C ATOM 2208 C THR A 138 4.994 3.978 15.895 1.00 0.00 C ATOM 2209 O THR A 138 4.570 2.869 16.215 1.00 0.00 O ATOM 2210 CB THR A 138 2.747 5.056 15.683 1.00 0.00 C ATOM 2211 OG1 THR A 138 1.764 5.261 14.685 1.00 0.00 O ATOM 2212 CG2 THR A 138 2.641 6.194 16.674 1.00 0.00 C ATOM 0 H THR A 138 3.603 3.527 13.589 1.00 0.00 H new ATOM 0 HA THR A 138 4.618 5.904 15.040 1.00 0.00 H new ATOM 0 HB THR A 138 2.581 4.118 16.213 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.499 4.398 14.305 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.630 6.230 17.080 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.353 6.038 17.485 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.864 7.136 16.172 1.00 0.00 H new ATOM 2220 N PRO A 139 6.216 4.402 16.268 1.00 0.00 N ATOM 2221 CA PRO A 139 7.123 3.577 17.075 1.00 0.00 C ATOM 2222 C PRO A 139 6.507 3.186 18.416 1.00 0.00 C ATOM 2223 O PRO A 139 5.634 3.884 18.933 1.00 0.00 O ATOM 2224 CB PRO A 139 8.343 4.481 17.291 1.00 0.00 C ATOM 2225 CG PRO A 139 8.271 5.496 16.203 1.00 0.00 C ATOM 2226 CD PRO A 139 6.808 5.710 15.936 1.00 0.00 C ATOM 0 HA PRO A 139 7.361 2.635 16.581 1.00 0.00 H new ATOM 0 HB2 PRO A 139 8.315 4.953 18.273 1.00 0.00 H new ATOM 0 HB3 PRO A 139 9.271 3.911 17.238 1.00 0.00 H new ATOM 0 HG2 PRO A 139 8.753 6.426 16.504 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.784 5.146 15.308 1.00 0.00 H new ATOM 0 HD2 PRO A 139 6.397 6.508 16.555 1.00 0.00 H new ATOM 0 HD3 PRO A 139 6.623 5.985 14.898 1.00 0.00 H new ATOM 2234 N PRO A 140 6.956 2.062 18.999 1.00 0.00 N ATOM 2235 CA PRO A 140 6.445 1.580 20.286 1.00 0.00 C ATOM 2236 C PRO A 140 6.946 2.411 21.466 1.00 0.00 C ATOM 2237 O PRO A 140 6.530 2.196 22.606 1.00 0.00 O ATOM 2238 CB PRO A 140 6.990 0.156 20.367 1.00 0.00 C ATOM 2239 CG PRO A 140 8.240 0.185 19.561 1.00 0.00 C ATOM 2240 CD PRO A 140 7.997 1.171 18.449 1.00 0.00 C ATOM 0 HA PRO A 140 5.358 1.643 20.341 1.00 0.00 H new ATOM 0 HB2 PRO A 140 7.190 -0.133 21.399 1.00 0.00 H new ATOM 0 HB3 PRO A 140 6.277 -0.565 19.966 1.00 0.00 H new ATOM 0 HG2 PRO A 140 9.091 0.488 20.172 1.00 0.00 H new ATOM 0 HG3 PRO A 140 8.470 -0.803 19.162 1.00 0.00 H new ATOM 0 HD2 PRO A 140 8.903 1.721 18.195 1.00 0.00 H new ATOM 0 HD3 PRO A 140 7.660 0.675 17.539 1.00 0.00 H new