USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 572 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 379 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 380 THR OG1 : rot 180:sc= 0 USER MOD Single : A 353 HIS :FLIP no HD1:sc= 0.161 F(o=-0.62,f=0.16) USER MOD Single : A 358 THR OG1 : rot 94:sc= 0.718 USER MOD Single : A 360 THR OG1 : rot -52:sc= 0.67 USER MOD Single : A 361 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 362 TYR OH : rot 30:sc= 0 USER MOD Single : A 371 THR OG1 : rot 96:sc= -0.136 USER MOD Single : A 386 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 MET CE :methyl -140:sc= -14.5! (180deg=-18.3!) USER MOD Single : A 390 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 THR OG1 : rot 171:sc= -0.054 USER MOD Single : A 411 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 412 ASN : amide:sc= -1.45 K(o=-1.4,f=-2.2!) USER MOD Single : A 416 THR OG1 : rot 180:sc= 0 USER MOD Single : A 419 GLN : amide:sc= -1.29 K(o=-1.3,f=-3.5!) USER MOD Single : A 421 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 351 -12.472 7.200 -22.365 1.00 0.00 N ATOM 2 CA GLU A 351 -11.989 5.800 -22.209 1.00 0.00 C ATOM 3 C GLU A 351 -10.968 5.735 -21.072 1.00 0.00 C ATOM 4 O GLU A 351 -10.861 4.746 -20.374 1.00 0.00 O ATOM 5 CB GLU A 351 -11.333 5.338 -23.512 1.00 0.00 C ATOM 6 CG GLU A 351 -10.996 3.849 -23.414 1.00 0.00 C ATOM 7 CD GLU A 351 -10.278 3.403 -24.689 1.00 0.00 C ATOM 8 OE1 GLU A 351 -10.069 4.241 -25.551 1.00 0.00 O ATOM 9 OE2 GLU A 351 -9.951 2.232 -24.783 1.00 0.00 O ATOM 0 HA GLU A 351 -12.832 5.149 -21.976 1.00 0.00 H new ATOM 0 HB2 GLU A 351 -12.004 5.515 -24.352 1.00 0.00 H new ATOM 0 HB3 GLU A 351 -10.428 5.915 -23.700 1.00 0.00 H new ATOM 0 HG2 GLU A 351 -10.364 3.665 -22.545 1.00 0.00 H new ATOM 0 HG3 GLU A 351 -11.907 3.267 -23.275 1.00 0.00 H new ATOM 16 N ALA A 352 -10.214 6.784 -20.880 1.00 0.00 N ATOM 17 CA ALA A 352 -9.199 6.782 -19.789 1.00 0.00 C ATOM 18 C ALA A 352 -9.901 6.610 -18.440 1.00 0.00 C ATOM 19 O ALA A 352 -9.336 6.089 -17.498 1.00 0.00 O ATOM 20 CB ALA A 352 -8.436 8.108 -19.803 1.00 0.00 C ATOM 0 H ALA A 352 -10.257 7.641 -21.431 1.00 0.00 H new ATOM 0 HA ALA A 352 -8.501 5.959 -19.942 1.00 0.00 H new ATOM 0 HB1 ALA A 352 -7.693 8.109 -19.006 1.00 0.00 H new ATOM 0 HB2 ALA A 352 -7.937 8.230 -20.764 1.00 0.00 H new ATOM 0 HB3 ALA A 352 -9.134 8.931 -19.649 1.00 0.00 H new ATOM 26 N HIS A 353 -11.128 7.042 -18.338 1.00 0.00 N ATOM 27 CA HIS A 353 -11.861 6.900 -17.048 1.00 0.00 C ATOM 28 C HIS A 353 -11.958 5.420 -16.674 1.00 0.00 C ATOM 29 O HIS A 353 -11.898 5.056 -15.516 1.00 0.00 O ATOM 30 CB HIS A 353 -13.269 7.483 -17.192 1.00 0.00 C ATOM 31 CG HIS A 353 -13.979 7.415 -15.867 1.00 0.00 C ATOM 32 ND1 HIS A 353 -15.061 6.684 -15.442 1.00 0.00 N flip ATOM 33 CD2 HIS A 353 -13.585 8.176 -14.777 1.00 0.00 C flip ATOM 34 CE1 HIS A 353 -15.335 6.983 -14.111 1.00 0.00 C flip ATOM 35 NE2 HIS A 353 -14.417 7.886 -13.760 1.00 0.00 N flip ATOM 0 H HIS A 353 -11.654 7.486 -19.091 1.00 0.00 H new ATOM 0 HA HIS A 353 -11.324 7.437 -16.266 1.00 0.00 H new ATOM 0 HB2 HIS A 353 -13.213 8.517 -17.534 1.00 0.00 H new ATOM 0 HB3 HIS A 353 -13.828 6.928 -17.945 1.00 0.00 H new ATOM 0 HD2 HIS A 353 -12.761 8.874 -14.749 1.00 0.00 H new ATOM 0 HE1 HIS A 353 -16.121 6.573 -13.495 1.00 0.00 H new ATOM 0 HE2 HIS A 353 -14.354 8.306 -12.833 1.00 0.00 H new ATOM 43 N ALA A 354 -12.109 4.565 -17.646 1.00 0.00 N ATOM 44 CA ALA A 354 -12.210 3.108 -17.349 1.00 0.00 C ATOM 45 C ALA A 354 -10.890 2.615 -16.753 1.00 0.00 C ATOM 46 O ALA A 354 -10.868 1.746 -15.904 1.00 0.00 O ATOM 47 CB ALA A 354 -12.504 2.343 -18.641 1.00 0.00 C ATOM 0 H ALA A 354 -12.167 4.812 -18.634 1.00 0.00 H new ATOM 0 HA ALA A 354 -13.016 2.938 -16.635 1.00 0.00 H new ATOM 0 HB1 ALA A 354 -12.578 1.277 -18.424 1.00 0.00 H new ATOM 0 HB2 ALA A 354 -13.445 2.693 -19.065 1.00 0.00 H new ATOM 0 HB3 ALA A 354 -11.699 2.513 -19.356 1.00 0.00 H new ATOM 53 N ALA A 355 -9.790 3.162 -17.191 1.00 0.00 N ATOM 54 CA ALA A 355 -8.472 2.724 -16.651 1.00 0.00 C ATOM 55 C ALA A 355 -8.375 3.106 -15.173 1.00 0.00 C ATOM 56 O ALA A 355 -7.667 2.483 -14.407 1.00 0.00 O ATOM 57 CB ALA A 355 -7.349 3.406 -17.433 1.00 0.00 C ATOM 0 H ALA A 355 -9.747 3.894 -17.900 1.00 0.00 H new ATOM 0 HA ALA A 355 -8.377 1.643 -16.752 1.00 0.00 H new ATOM 0 HB1 ALA A 355 -6.385 3.086 -17.038 1.00 0.00 H new ATOM 0 HB2 ALA A 355 -7.420 3.131 -18.485 1.00 0.00 H new ATOM 0 HB3 ALA A 355 -7.441 4.488 -17.333 1.00 0.00 H new ATOM 63 N ILE A 356 -9.085 4.121 -14.766 1.00 0.00 N ATOM 64 CA ILE A 356 -9.037 4.535 -13.337 1.00 0.00 C ATOM 65 C ILE A 356 -9.769 3.497 -12.489 1.00 0.00 C ATOM 66 O ILE A 356 -9.237 2.973 -11.531 1.00 0.00 O ATOM 67 CB ILE A 356 -9.718 5.895 -13.174 1.00 0.00 C ATOM 68 CG1 ILE A 356 -9.190 6.860 -14.237 1.00 0.00 C ATOM 69 CG2 ILE A 356 -9.412 6.454 -11.783 1.00 0.00 C ATOM 70 CD1 ILE A 356 -7.667 6.941 -14.133 1.00 0.00 C ATOM 0 H ILE A 356 -9.696 4.681 -15.361 1.00 0.00 H new ATOM 0 HA ILE A 356 -7.999 4.610 -13.013 1.00 0.00 H new ATOM 0 HB ILE A 356 -10.795 5.778 -13.291 1.00 0.00 H new ATOM 0 HG12 ILE A 356 -9.481 6.519 -15.231 1.00 0.00 H new ATOM 0 HG13 ILE A 356 -9.629 7.848 -14.098 1.00 0.00 H new ATOM 0 HG21 ILE A 356 -9.897 7.423 -11.666 1.00 0.00 H new ATOM 0 HG22 ILE A 356 -9.786 5.767 -11.024 1.00 0.00 H new ATOM 0 HG23 ILE A 356 -8.335 6.571 -11.667 1.00 0.00 H new ATOM 0 HD11 ILE A 356 -7.287 7.628 -14.889 1.00 0.00 H new ATOM 0 HD12 ILE A 356 -7.389 7.301 -13.143 1.00 0.00 H new ATOM 0 HD13 ILE A 356 -7.238 5.952 -14.293 1.00 0.00 H new ATOM 82 N ASP A 357 -10.986 3.198 -12.840 1.00 0.00 N ATOM 83 CA ASP A 357 -11.764 2.194 -12.063 1.00 0.00 C ATOM 84 C ASP A 357 -11.155 0.807 -12.262 1.00 0.00 C ATOM 85 O ASP A 357 -11.083 0.016 -11.341 1.00 0.00 O ATOM 86 CB ASP A 357 -13.215 2.193 -12.546 1.00 0.00 C ATOM 87 CG ASP A 357 -14.058 1.303 -11.629 1.00 0.00 C ATOM 88 OD1 ASP A 357 -14.491 1.789 -10.597 1.00 0.00 O ATOM 89 OD2 ASP A 357 -14.256 0.150 -11.976 1.00 0.00 O ATOM 0 H ASP A 357 -11.478 3.607 -13.634 1.00 0.00 H new ATOM 0 HA ASP A 357 -11.734 2.450 -11.004 1.00 0.00 H new ATOM 0 HB2 ASP A 357 -13.610 3.209 -12.547 1.00 0.00 H new ATOM 0 HB3 ASP A 357 -13.268 1.829 -13.572 1.00 0.00 H new ATOM 94 N THR A 358 -10.707 0.498 -13.449 1.00 0.00 N ATOM 95 CA THR A 358 -10.101 -0.842 -13.679 1.00 0.00 C ATOM 96 C THR A 358 -9.012 -1.074 -12.634 1.00 0.00 C ATOM 97 O THR A 358 -9.004 -2.068 -11.937 1.00 0.00 O ATOM 98 CB THR A 358 -9.488 -0.897 -15.081 1.00 0.00 C ATOM 99 OG1 THR A 358 -10.478 -0.560 -16.042 1.00 0.00 O ATOM 100 CG2 THR A 358 -8.967 -2.309 -15.354 1.00 0.00 C ATOM 0 H THR A 358 -10.735 1.112 -14.263 1.00 0.00 H new ATOM 0 HA THR A 358 -10.866 -1.614 -13.596 1.00 0.00 H new ATOM 0 HB THR A 358 -8.663 -0.188 -15.147 1.00 0.00 H new ATOM 0 HG1 THR A 358 -10.426 0.398 -16.244 1.00 0.00 H new ATOM 0 HG21 THR A 358 -8.530 -2.349 -16.352 1.00 0.00 H new ATOM 0 HG22 THR A 358 -8.208 -2.566 -14.615 1.00 0.00 H new ATOM 0 HG23 THR A 358 -9.791 -3.020 -15.290 1.00 0.00 H new ATOM 108 N PHE A 359 -8.101 -0.154 -12.515 1.00 0.00 N ATOM 109 CA PHE A 359 -7.016 -0.305 -11.510 1.00 0.00 C ATOM 110 C PHE A 359 -7.642 -0.497 -10.126 1.00 0.00 C ATOM 111 O PHE A 359 -7.237 -1.352 -9.364 1.00 0.00 O ATOM 112 CB PHE A 359 -6.145 0.954 -11.509 1.00 0.00 C ATOM 113 CG PHE A 359 -5.258 0.976 -12.736 1.00 0.00 C ATOM 114 CD1 PHE A 359 -5.226 -0.118 -13.614 1.00 0.00 C ATOM 115 CD2 PHE A 359 -4.460 2.099 -12.993 1.00 0.00 C ATOM 116 CE1 PHE A 359 -4.400 -0.085 -14.744 1.00 0.00 C ATOM 117 CE2 PHE A 359 -3.635 2.128 -14.122 1.00 0.00 C ATOM 118 CZ PHE A 359 -3.604 1.037 -14.998 1.00 0.00 C ATOM 0 H PHE A 359 -8.060 0.699 -13.072 1.00 0.00 H new ATOM 0 HA PHE A 359 -6.399 -1.169 -11.757 1.00 0.00 H new ATOM 0 HB2 PHE A 359 -6.777 1.842 -11.492 1.00 0.00 H new ATOM 0 HB3 PHE A 359 -5.533 0.981 -10.608 1.00 0.00 H new ATOM 0 HD1 PHE A 359 -5.839 -0.986 -13.418 1.00 0.00 H new ATOM 0 HD2 PHE A 359 -4.482 2.942 -12.319 1.00 0.00 H new ATOM 0 HE1 PHE A 359 -4.377 -0.927 -15.420 1.00 0.00 H new ATOM 0 HE2 PHE A 359 -3.021 2.994 -14.318 1.00 0.00 H new ATOM 0 HZ PHE A 359 -2.966 1.061 -15.869 1.00 0.00 H new ATOM 128 N THR A 360 -8.634 0.290 -9.798 1.00 0.00 N ATOM 129 CA THR A 360 -9.287 0.142 -8.465 1.00 0.00 C ATOM 130 C THR A 360 -9.820 -1.285 -8.326 1.00 0.00 C ATOM 131 O THR A 360 -9.838 -1.851 -7.252 1.00 0.00 O ATOM 132 CB THR A 360 -10.447 1.131 -8.337 1.00 0.00 C ATOM 133 OG1 THR A 360 -11.558 0.655 -9.081 1.00 0.00 O ATOM 134 CG2 THR A 360 -10.018 2.498 -8.867 1.00 0.00 C ATOM 0 H THR A 360 -9.018 1.025 -10.392 1.00 0.00 H new ATOM 0 HA THR A 360 -8.558 0.346 -7.681 1.00 0.00 H new ATOM 0 HB THR A 360 -10.729 1.227 -7.288 1.00 0.00 H new ATOM 0 HG1 THR A 360 -11.275 0.451 -9.997 1.00 0.00 H new ATOM 0 HG21 THR A 360 -10.846 3.200 -8.775 1.00 0.00 H new ATOM 0 HG22 THR A 360 -9.168 2.862 -8.290 1.00 0.00 H new ATOM 0 HG23 THR A 360 -9.733 2.409 -9.915 1.00 0.00 H new ATOM 142 N LYS A 361 -10.256 -1.867 -9.410 1.00 0.00 N ATOM 143 CA LYS A 361 -10.789 -3.256 -9.347 1.00 0.00 C ATOM 144 C LYS A 361 -9.628 -4.244 -9.236 1.00 0.00 C ATOM 145 O LYS A 361 -9.724 -5.264 -8.583 1.00 0.00 O ATOM 146 CB LYS A 361 -11.580 -3.557 -10.623 1.00 0.00 C ATOM 147 CG LYS A 361 -12.065 -5.008 -10.588 1.00 0.00 C ATOM 148 CD LYS A 361 -12.881 -5.307 -11.847 1.00 0.00 C ATOM 149 CE LYS A 361 -13.512 -6.695 -11.728 1.00 0.00 C ATOM 150 NZ LYS A 361 -13.801 -7.229 -13.089 1.00 0.00 N ATOM 0 H LYS A 361 -10.266 -1.440 -10.336 1.00 0.00 H new ATOM 0 HA LYS A 361 -11.439 -3.353 -8.478 1.00 0.00 H new ATOM 0 HB2 LYS A 361 -12.430 -2.880 -10.706 1.00 0.00 H new ATOM 0 HB3 LYS A 361 -10.954 -3.392 -11.500 1.00 0.00 H new ATOM 0 HG2 LYS A 361 -11.213 -5.685 -10.525 1.00 0.00 H new ATOM 0 HG3 LYS A 361 -12.673 -5.177 -9.699 1.00 0.00 H new ATOM 0 HD2 LYS A 361 -13.657 -4.553 -11.978 1.00 0.00 H new ATOM 0 HD3 LYS A 361 -12.241 -5.261 -12.728 1.00 0.00 H new ATOM 0 HE2 LYS A 361 -12.838 -7.368 -11.197 1.00 0.00 H new ATOM 0 HE3 LYS A 361 -14.431 -6.639 -11.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 361 -14.230 -8.173 -13.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 361 -14.459 -6.591 -13.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 361 -12.916 -7.297 -13.631 1.00 0.00 H new ATOM 164 N TYR A 362 -8.534 -3.954 -9.884 1.00 0.00 N ATOM 165 CA TYR A 362 -7.370 -4.880 -9.835 1.00 0.00 C ATOM 166 C TYR A 362 -6.390 -4.442 -8.739 1.00 0.00 C ATOM 167 O TYR A 362 -6.176 -5.147 -7.772 1.00 0.00 O ATOM 168 CB TYR A 362 -6.665 -4.864 -11.194 1.00 0.00 C ATOM 169 CG TYR A 362 -7.556 -5.517 -12.225 1.00 0.00 C ATOM 170 CD1 TYR A 362 -8.827 -4.992 -12.487 1.00 0.00 C ATOM 171 CD2 TYR A 362 -7.111 -6.649 -12.919 1.00 0.00 C ATOM 172 CE1 TYR A 362 -9.654 -5.597 -13.440 1.00 0.00 C ATOM 173 CE2 TYR A 362 -7.937 -7.255 -13.874 1.00 0.00 C ATOM 174 CZ TYR A 362 -9.209 -6.729 -14.134 1.00 0.00 C ATOM 175 OH TYR A 362 -10.023 -7.327 -15.075 1.00 0.00 O ATOM 0 H TYR A 362 -8.396 -3.114 -10.446 1.00 0.00 H new ATOM 0 HA TYR A 362 -7.718 -5.888 -9.609 1.00 0.00 H new ATOM 0 HB2 TYR A 362 -6.440 -3.839 -11.488 1.00 0.00 H new ATOM 0 HB3 TYR A 362 -5.714 -5.394 -11.130 1.00 0.00 H new ATOM 0 HD1 TYR A 362 -9.170 -4.118 -11.953 1.00 0.00 H new ATOM 0 HD2 TYR A 362 -6.131 -7.055 -12.718 1.00 0.00 H new ATOM 0 HE1 TYR A 362 -10.635 -5.191 -13.640 1.00 0.00 H new ATOM 0 HE2 TYR A 362 -7.593 -8.128 -14.410 1.00 0.00 H new ATOM 0 HH TYR A 362 -10.604 -6.651 -15.482 1.00 0.00 H new ATOM 185 N LEU A 363 -5.788 -3.293 -8.882 1.00 0.00 N ATOM 186 CA LEU A 363 -4.817 -2.826 -7.849 1.00 0.00 C ATOM 187 C LEU A 363 -5.529 -2.632 -6.506 1.00 0.00 C ATOM 188 O LEU A 363 -4.899 -2.435 -5.486 1.00 0.00 O ATOM 189 CB LEU A 363 -4.200 -1.493 -8.286 1.00 0.00 C ATOM 190 CG LEU A 363 -3.263 -1.714 -9.478 1.00 0.00 C ATOM 191 CD1 LEU A 363 -2.434 -2.981 -9.256 1.00 0.00 C ATOM 192 CD2 LEU A 363 -4.088 -1.861 -10.757 1.00 0.00 C ATOM 0 H LEU A 363 -5.925 -2.657 -9.668 1.00 0.00 H new ATOM 0 HA LEU A 363 -4.034 -3.577 -7.738 1.00 0.00 H new ATOM 0 HB2 LEU A 363 -4.988 -0.790 -8.558 1.00 0.00 H new ATOM 0 HB3 LEU A 363 -3.649 -1.049 -7.457 1.00 0.00 H new ATOM 0 HG LEU A 363 -2.594 -0.858 -9.573 1.00 0.00 H new ATOM 0 HD11 LEU A 363 -1.769 -3.134 -10.106 1.00 0.00 H new ATOM 0 HD12 LEU A 363 -1.842 -2.874 -8.347 1.00 0.00 H new ATOM 0 HD13 LEU A 363 -3.100 -3.838 -9.157 1.00 0.00 H new ATOM 0 HD21 LEU A 363 -3.421 -2.018 -11.604 1.00 0.00 H new ATOM 0 HD22 LEU A 363 -4.759 -2.714 -10.661 1.00 0.00 H new ATOM 0 HD23 LEU A 363 -4.673 -0.956 -10.919 1.00 0.00 H new ATOM 204 N ASP A 364 -6.833 -2.673 -6.492 1.00 0.00 N ATOM 205 CA ASP A 364 -7.560 -2.476 -5.206 1.00 0.00 C ATOM 206 C ASP A 364 -7.166 -1.117 -4.625 1.00 0.00 C ATOM 207 O ASP A 364 -6.787 -1.001 -3.476 1.00 0.00 O ATOM 208 CB ASP A 364 -7.177 -3.583 -4.221 1.00 0.00 C ATOM 209 CG ASP A 364 -7.687 -4.928 -4.741 1.00 0.00 C ATOM 210 OD1 ASP A 364 -8.509 -4.920 -5.644 1.00 0.00 O ATOM 211 OD2 ASP A 364 -7.250 -5.944 -4.228 1.00 0.00 O ATOM 0 H ASP A 364 -7.423 -2.833 -7.309 1.00 0.00 H new ATOM 0 HA ASP A 364 -8.636 -2.512 -5.379 1.00 0.00 H new ATOM 0 HB2 ASP A 364 -6.095 -3.616 -4.097 1.00 0.00 H new ATOM 0 HB3 ASP A 364 -7.604 -3.375 -3.240 1.00 0.00 H new ATOM 216 N ILE A 365 -7.245 -0.091 -5.425 1.00 0.00 N ATOM 217 CA ILE A 365 -6.870 1.268 -4.946 1.00 0.00 C ATOM 218 C ILE A 365 -8.067 2.209 -5.080 1.00 0.00 C ATOM 219 O ILE A 365 -9.187 1.782 -5.286 1.00 0.00 O ATOM 220 CB ILE A 365 -5.709 1.798 -5.791 1.00 0.00 C ATOM 221 CG1 ILE A 365 -6.025 1.595 -7.274 1.00 0.00 C ATOM 222 CG2 ILE A 365 -4.431 1.039 -5.433 1.00 0.00 C ATOM 223 CD1 ILE A 365 -4.980 2.322 -8.122 1.00 0.00 C ATOM 0 H ILE A 365 -7.555 -0.136 -6.396 1.00 0.00 H new ATOM 0 HA ILE A 365 -6.569 1.214 -3.900 1.00 0.00 H new ATOM 0 HB ILE A 365 -5.568 2.860 -5.591 1.00 0.00 H new ATOM 0 HG12 ILE A 365 -6.028 0.532 -7.514 1.00 0.00 H new ATOM 0 HG13 ILE A 365 -7.021 1.976 -7.500 1.00 0.00 H new ATOM 0 HG21 ILE A 365 -3.604 1.416 -6.034 1.00 0.00 H new ATOM 0 HG22 ILE A 365 -4.206 1.183 -4.376 1.00 0.00 H new ATOM 0 HG23 ILE A 365 -4.571 -0.023 -5.633 1.00 0.00 H new ATOM 0 HD11 ILE A 365 -5.205 2.178 -9.179 1.00 0.00 H new ATOM 0 HD12 ILE A 365 -4.999 3.387 -7.889 1.00 0.00 H new ATOM 0 HD13 ILE A 365 -3.991 1.920 -7.903 1.00 0.00 H new ATOM 235 N ASP A 366 -7.840 3.489 -4.968 1.00 0.00 N ATOM 236 CA ASP A 366 -8.962 4.458 -5.093 1.00 0.00 C ATOM 237 C ASP A 366 -8.912 5.108 -6.477 1.00 0.00 C ATOM 238 O ASP A 366 -7.931 5.007 -7.186 1.00 0.00 O ATOM 239 CB ASP A 366 -8.835 5.535 -4.015 1.00 0.00 C ATOM 240 CG ASP A 366 -8.735 4.870 -2.639 1.00 0.00 C ATOM 241 OD1 ASP A 366 -9.165 3.735 -2.519 1.00 0.00 O ATOM 242 OD2 ASP A 366 -8.228 5.509 -1.731 1.00 0.00 O ATOM 0 H ASP A 366 -6.925 3.905 -4.795 1.00 0.00 H new ATOM 0 HA ASP A 366 -9.911 3.937 -4.967 1.00 0.00 H new ATOM 0 HB2 ASP A 366 -7.953 6.147 -4.200 1.00 0.00 H new ATOM 0 HB3 ASP A 366 -9.698 6.201 -4.047 1.00 0.00 H new ATOM 247 N GLU A 367 -9.967 5.764 -6.869 1.00 0.00 N ATOM 248 CA GLU A 367 -9.988 6.410 -8.212 1.00 0.00 C ATOM 249 C GLU A 367 -8.915 7.499 -8.290 1.00 0.00 C ATOM 250 O GLU A 367 -8.275 7.678 -9.306 1.00 0.00 O ATOM 251 CB GLU A 367 -11.364 7.033 -8.455 1.00 0.00 C ATOM 252 CG GLU A 367 -11.457 7.510 -9.905 1.00 0.00 C ATOM 253 CD GLU A 367 -12.768 8.273 -10.107 1.00 0.00 C ATOM 254 OE1 GLU A 367 -13.531 8.361 -9.159 1.00 0.00 O ATOM 255 OE2 GLU A 367 -12.986 8.756 -11.206 1.00 0.00 O ATOM 0 H GLU A 367 -10.817 5.882 -6.318 1.00 0.00 H new ATOM 0 HA GLU A 367 -9.785 5.656 -8.973 1.00 0.00 H new ATOM 0 HB2 GLU A 367 -12.147 6.303 -8.250 1.00 0.00 H new ATOM 0 HB3 GLU A 367 -11.522 7.870 -7.775 1.00 0.00 H new ATOM 0 HG2 GLU A 367 -10.609 8.153 -10.143 1.00 0.00 H new ATOM 0 HG3 GLU A 367 -11.411 6.658 -10.583 1.00 0.00 H new ATOM 262 N ASP A 368 -8.723 8.235 -7.232 1.00 0.00 N ATOM 263 CA ASP A 368 -7.700 9.320 -7.255 1.00 0.00 C ATOM 264 C ASP A 368 -6.295 8.716 -7.332 1.00 0.00 C ATOM 265 O ASP A 368 -5.377 9.325 -7.846 1.00 0.00 O ATOM 266 CB ASP A 368 -7.820 10.159 -5.983 1.00 0.00 C ATOM 267 CG ASP A 368 -9.168 10.885 -5.975 1.00 0.00 C ATOM 268 OD1 ASP A 368 -9.809 10.917 -7.012 1.00 0.00 O ATOM 269 OD2 ASP A 368 -9.535 11.398 -4.930 1.00 0.00 O ATOM 0 H ASP A 368 -9.229 8.133 -6.352 1.00 0.00 H new ATOM 0 HA ASP A 368 -7.868 9.949 -8.130 1.00 0.00 H new ATOM 0 HB2 ASP A 368 -7.734 9.520 -5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 368 -7.005 10.882 -5.933 1.00 0.00 H new ATOM 274 N PHE A 369 -6.112 7.529 -6.823 1.00 0.00 N ATOM 275 CA PHE A 369 -4.760 6.902 -6.869 1.00 0.00 C ATOM 276 C PHE A 369 -4.543 6.246 -8.235 1.00 0.00 C ATOM 277 O PHE A 369 -3.545 6.468 -8.888 1.00 0.00 O ATOM 278 CB PHE A 369 -4.649 5.842 -5.772 1.00 0.00 C ATOM 279 CG PHE A 369 -3.228 5.335 -5.701 1.00 0.00 C ATOM 280 CD1 PHE A 369 -2.777 4.381 -6.621 1.00 0.00 C ATOM 281 CD2 PHE A 369 -2.359 5.821 -4.715 1.00 0.00 C ATOM 282 CE1 PHE A 369 -1.459 3.911 -6.554 1.00 0.00 C ATOM 283 CE2 PHE A 369 -1.041 5.352 -4.650 1.00 0.00 C ATOM 284 CZ PHE A 369 -0.592 4.397 -5.569 1.00 0.00 C ATOM 0 H PHE A 369 -6.838 6.967 -6.378 1.00 0.00 H new ATOM 0 HA PHE A 369 -4.002 7.669 -6.711 1.00 0.00 H new ATOM 0 HB2 PHE A 369 -4.943 6.265 -4.812 1.00 0.00 H new ATOM 0 HB3 PHE A 369 -5.331 5.017 -5.979 1.00 0.00 H new ATOM 0 HD1 PHE A 369 -3.445 4.007 -7.383 1.00 0.00 H new ATOM 0 HD2 PHE A 369 -2.706 6.557 -4.005 1.00 0.00 H new ATOM 0 HE1 PHE A 369 -1.112 3.174 -7.263 1.00 0.00 H new ATOM 0 HE2 PHE A 369 -0.371 5.727 -3.891 1.00 0.00 H new ATOM 0 HZ PHE A 369 0.424 4.035 -5.518 1.00 0.00 H new ATOM 294 N ALA A 370 -5.470 5.437 -8.669 1.00 0.00 N ATOM 295 CA ALA A 370 -5.313 4.768 -9.990 1.00 0.00 C ATOM 296 C ALA A 370 -4.993 5.817 -11.058 1.00 0.00 C ATOM 297 O ALA A 370 -4.071 5.666 -11.834 1.00 0.00 O ATOM 298 CB ALA A 370 -6.611 4.045 -10.354 1.00 0.00 C ATOM 0 H ALA A 370 -6.328 5.211 -8.166 1.00 0.00 H new ATOM 0 HA ALA A 370 -4.499 4.045 -9.937 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -6.496 3.555 -11.321 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.837 3.298 -9.593 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -7.427 4.766 -10.407 1.00 0.00 H new ATOM 304 N THR A 371 -5.754 6.876 -11.108 1.00 0.00 N ATOM 305 CA THR A 371 -5.493 7.928 -12.131 1.00 0.00 C ATOM 306 C THR A 371 -4.011 8.304 -12.116 1.00 0.00 C ATOM 307 O THR A 371 -3.403 8.488 -13.146 1.00 0.00 O ATOM 308 CB THR A 371 -6.336 9.169 -11.829 1.00 0.00 C ATOM 309 OG1 THR A 371 -7.637 8.769 -11.423 1.00 0.00 O ATOM 310 CG2 THR A 371 -6.434 10.035 -13.086 1.00 0.00 C ATOM 0 H THR A 371 -6.543 7.058 -10.487 1.00 0.00 H new ATOM 0 HA THR A 371 -5.761 7.542 -13.114 1.00 0.00 H new ATOM 0 HB THR A 371 -5.868 9.743 -11.029 1.00 0.00 H new ATOM 0 HG1 THR A 371 -7.680 8.739 -10.444 1.00 0.00 H new ATOM 0 HG21 THR A 371 -7.034 10.919 -12.873 1.00 0.00 H new ATOM 0 HG22 THR A 371 -5.435 10.341 -13.396 1.00 0.00 H new ATOM 0 HG23 THR A 371 -6.903 9.463 -13.886 1.00 0.00 H new ATOM 318 N VAL A 372 -3.425 8.426 -10.960 1.00 0.00 N ATOM 319 CA VAL A 372 -1.983 8.795 -10.899 1.00 0.00 C ATOM 320 C VAL A 372 -1.158 7.782 -11.695 1.00 0.00 C ATOM 321 O VAL A 372 -0.156 8.119 -12.294 1.00 0.00 O ATOM 322 CB VAL A 372 -1.522 8.802 -9.443 1.00 0.00 C ATOM 323 CG1 VAL A 372 -0.012 9.038 -9.384 1.00 0.00 C ATOM 324 CG2 VAL A 372 -2.245 9.921 -8.694 1.00 0.00 C ATOM 0 H VAL A 372 -3.879 8.287 -10.057 1.00 0.00 H new ATOM 0 HA VAL A 372 -1.844 9.787 -11.329 1.00 0.00 H new ATOM 0 HB VAL A 372 -1.753 7.842 -8.981 1.00 0.00 H new ATOM 0 HG11 VAL A 372 0.315 9.043 -8.344 1.00 0.00 H new ATOM 0 HG12 VAL A 372 0.502 8.242 -9.923 1.00 0.00 H new ATOM 0 HG13 VAL A 372 0.224 9.998 -9.843 1.00 0.00 H new ATOM 0 HG21 VAL A 372 -1.920 9.931 -7.654 1.00 0.00 H new ATOM 0 HG22 VAL A 372 -2.010 10.879 -9.157 1.00 0.00 H new ATOM 0 HG23 VAL A 372 -3.321 9.751 -8.737 1.00 0.00 H new ATOM 334 N LEU A 373 -1.572 6.544 -11.717 1.00 0.00 N ATOM 335 CA LEU A 373 -0.811 5.523 -12.487 1.00 0.00 C ATOM 336 C LEU A 373 -1.160 5.664 -13.968 1.00 0.00 C ATOM 337 O LEU A 373 -0.299 5.641 -14.826 1.00 0.00 O ATOM 338 CB LEU A 373 -1.192 4.124 -11.997 1.00 0.00 C ATOM 339 CG LEU A 373 -0.846 3.983 -10.511 1.00 0.00 C ATOM 340 CD1 LEU A 373 0.478 4.692 -10.221 1.00 0.00 C ATOM 341 CD2 LEU A 373 -1.956 4.610 -9.668 1.00 0.00 C ATOM 0 H LEU A 373 -2.402 6.198 -11.236 1.00 0.00 H new ATOM 0 HA LEU A 373 0.260 5.670 -12.345 1.00 0.00 H new ATOM 0 HB2 LEU A 373 -2.258 3.953 -12.150 1.00 0.00 H new ATOM 0 HB3 LEU A 373 -0.662 3.369 -12.577 1.00 0.00 H new ATOM 0 HG LEU A 373 -0.751 2.926 -10.261 1.00 0.00 H new ATOM 0 HD11 LEU A 373 0.721 4.590 -9.163 1.00 0.00 H new ATOM 0 HD12 LEU A 373 1.270 4.243 -10.821 1.00 0.00 H new ATOM 0 HD13 LEU A 373 0.387 5.749 -10.472 1.00 0.00 H new ATOM 0 HD21 LEU A 373 -1.710 4.510 -8.611 1.00 0.00 H new ATOM 0 HD22 LEU A 373 -2.052 5.666 -9.920 1.00 0.00 H new ATOM 0 HD23 LEU A 373 -2.899 4.102 -9.871 1.00 0.00 H new ATOM 353 N VAL A 374 -2.418 5.825 -14.272 1.00 0.00 N ATOM 354 CA VAL A 374 -2.829 5.986 -15.694 1.00 0.00 C ATOM 355 C VAL A 374 -2.457 7.398 -16.149 1.00 0.00 C ATOM 356 O VAL A 374 -2.223 7.651 -17.315 1.00 0.00 O ATOM 357 CB VAL A 374 -4.342 5.791 -15.811 1.00 0.00 C ATOM 358 CG1 VAL A 374 -4.803 6.211 -17.209 1.00 0.00 C ATOM 359 CG2 VAL A 374 -4.686 4.319 -15.579 1.00 0.00 C ATOM 0 H VAL A 374 -3.180 5.852 -13.595 1.00 0.00 H new ATOM 0 HA VAL A 374 -2.325 5.248 -16.318 1.00 0.00 H new ATOM 0 HB VAL A 374 -4.847 6.403 -15.063 1.00 0.00 H new ATOM 0 HG11 VAL A 374 -5.881 6.072 -17.294 1.00 0.00 H new ATOM 0 HG12 VAL A 374 -4.558 7.260 -17.373 1.00 0.00 H new ATOM 0 HG13 VAL A 374 -4.299 5.600 -17.957 1.00 0.00 H new ATOM 0 HG21 VAL A 374 -5.764 4.180 -15.662 1.00 0.00 H new ATOM 0 HG22 VAL A 374 -4.182 3.706 -16.326 1.00 0.00 H new ATOM 0 HG23 VAL A 374 -4.358 4.021 -14.583 1.00 0.00 H new ATOM 369 N GLU A 375 -2.401 8.315 -15.224 1.00 0.00 N ATOM 370 CA GLU A 375 -2.045 9.718 -15.568 1.00 0.00 C ATOM 371 C GLU A 375 -0.583 9.774 -16.010 1.00 0.00 C ATOM 372 O GLU A 375 -0.233 10.448 -16.958 1.00 0.00 O ATOM 373 CB GLU A 375 -2.239 10.597 -14.330 1.00 0.00 C ATOM 374 CG GLU A 375 -3.715 10.970 -14.192 1.00 0.00 C ATOM 375 CD GLU A 375 -4.137 11.837 -15.380 1.00 0.00 C ATOM 376 OE1 GLU A 375 -3.260 12.362 -16.047 1.00 0.00 O ATOM 377 OE2 GLU A 375 -5.330 11.961 -15.604 1.00 0.00 O ATOM 0 H GLU A 375 -2.589 8.150 -14.235 1.00 0.00 H new ATOM 0 HA GLU A 375 -2.681 10.076 -16.377 1.00 0.00 H new ATOM 0 HB2 GLU A 375 -1.903 10.067 -13.439 1.00 0.00 H new ATOM 0 HB3 GLU A 375 -1.632 11.498 -14.413 1.00 0.00 H new ATOM 0 HG2 GLU A 375 -4.326 10.068 -14.151 1.00 0.00 H new ATOM 0 HG3 GLU A 375 -3.879 11.509 -13.259 1.00 0.00 H new ATOM 384 N GLU A 376 0.272 9.067 -15.326 1.00 0.00 N ATOM 385 CA GLU A 376 1.714 9.071 -15.698 1.00 0.00 C ATOM 386 C GLU A 376 1.905 8.331 -17.024 1.00 0.00 C ATOM 387 O GLU A 376 2.787 8.649 -17.800 1.00 0.00 O ATOM 388 CB GLU A 376 2.521 8.374 -14.603 1.00 0.00 C ATOM 389 CG GLU A 376 4.012 8.445 -14.940 1.00 0.00 C ATOM 390 CD GLU A 376 4.799 7.579 -13.956 1.00 0.00 C ATOM 391 OE1 GLU A 376 4.171 6.941 -13.126 1.00 0.00 O ATOM 392 OE2 GLU A 376 6.015 7.568 -14.048 1.00 0.00 O ATOM 0 H GLU A 376 0.034 8.485 -14.523 1.00 0.00 H new ATOM 0 HA GLU A 376 2.058 10.099 -15.807 1.00 0.00 H new ATOM 0 HB2 GLU A 376 2.332 8.849 -13.640 1.00 0.00 H new ATOM 0 HB3 GLU A 376 2.207 7.334 -14.512 1.00 0.00 H new ATOM 0 HG2 GLU A 376 4.182 8.101 -15.960 1.00 0.00 H new ATOM 0 HG3 GLU A 376 4.358 9.477 -14.890 1.00 0.00 H new ATOM 399 N GLY A 377 1.089 7.349 -17.296 1.00 0.00 N ATOM 400 CA GLY A 377 1.233 6.599 -18.577 1.00 0.00 C ATOM 401 C GLY A 377 1.083 5.096 -18.323 1.00 0.00 C ATOM 402 O GLY A 377 1.637 4.281 -19.035 1.00 0.00 O ATOM 0 H GLY A 377 0.332 7.034 -16.689 1.00 0.00 H new ATOM 0 HA2 GLY A 377 0.479 6.933 -19.290 1.00 0.00 H new ATOM 0 HA3 GLY A 377 2.206 6.806 -19.022 1.00 0.00 H new ATOM 406 N PHE A 378 0.338 4.720 -17.320 1.00 0.00 N ATOM 407 CA PHE A 378 0.156 3.270 -17.031 1.00 0.00 C ATOM 408 C PHE A 378 -1.334 2.927 -17.091 1.00 0.00 C ATOM 409 O PHE A 378 -2.006 2.866 -16.082 1.00 0.00 O ATOM 410 CB PHE A 378 0.697 2.953 -15.634 1.00 0.00 C ATOM 411 CG PHE A 378 2.199 3.120 -15.629 1.00 0.00 C ATOM 412 CD1 PHE A 378 3.023 2.050 -15.992 1.00 0.00 C ATOM 413 CD2 PHE A 378 2.766 4.347 -15.260 1.00 0.00 C ATOM 414 CE1 PHE A 378 4.414 2.204 -15.988 1.00 0.00 C ATOM 415 CE2 PHE A 378 4.157 4.501 -15.255 1.00 0.00 C ATOM 416 CZ PHE A 378 4.982 3.429 -15.619 1.00 0.00 C ATOM 0 H PHE A 378 -0.152 5.354 -16.689 1.00 0.00 H new ATOM 0 HA PHE A 378 0.698 2.680 -17.770 1.00 0.00 H new ATOM 0 HB2 PHE A 378 0.244 3.616 -14.897 1.00 0.00 H new ATOM 0 HB3 PHE A 378 0.432 1.934 -15.352 1.00 0.00 H new ATOM 0 HD1 PHE A 378 2.586 1.104 -16.276 1.00 0.00 H new ATOM 0 HD2 PHE A 378 2.130 5.174 -14.980 1.00 0.00 H new ATOM 0 HE1 PHE A 378 5.049 1.377 -16.270 1.00 0.00 H new ATOM 0 HE2 PHE A 378 4.594 5.447 -14.970 1.00 0.00 H new ATOM 0 HZ PHE A 378 6.055 3.548 -15.615 1.00 0.00 H new ATOM 426 N SER A 379 -1.858 2.712 -18.269 1.00 0.00 N ATOM 427 CA SER A 379 -3.309 2.385 -18.391 1.00 0.00 C ATOM 428 C SER A 379 -3.501 0.868 -18.455 1.00 0.00 C ATOM 429 O SER A 379 -4.612 0.380 -18.528 1.00 0.00 O ATOM 430 CB SER A 379 -3.866 3.019 -19.667 1.00 0.00 C ATOM 431 OG SER A 379 -3.372 2.318 -20.799 1.00 0.00 O ATOM 0 H SER A 379 -1.345 2.749 -19.150 1.00 0.00 H new ATOM 0 HA SER A 379 -3.837 2.777 -17.522 1.00 0.00 H new ATOM 0 HB2 SER A 379 -4.956 2.989 -19.655 1.00 0.00 H new ATOM 0 HB3 SER A 379 -3.576 4.068 -19.721 1.00 0.00 H new ATOM 0 HG SER A 379 -3.730 2.723 -21.616 1.00 0.00 H new ATOM 437 N THR A 380 -2.435 0.116 -18.431 1.00 0.00 N ATOM 438 CA THR A 380 -2.575 -1.365 -18.494 1.00 0.00 C ATOM 439 C THR A 380 -1.890 -1.995 -17.282 1.00 0.00 C ATOM 440 O THR A 380 -0.850 -1.547 -16.843 1.00 0.00 O ATOM 441 CB THR A 380 -1.919 -1.885 -19.776 1.00 0.00 C ATOM 442 OG1 THR A 380 -2.458 -1.195 -20.895 1.00 0.00 O ATOM 443 CG2 THR A 380 -2.191 -3.383 -19.917 1.00 0.00 C ATOM 0 H THR A 380 -1.477 0.462 -18.371 1.00 0.00 H new ATOM 0 HA THR A 380 -3.632 -1.629 -18.492 1.00 0.00 H new ATOM 0 HB THR A 380 -0.843 -1.716 -19.730 1.00 0.00 H new ATOM 0 HG1 THR A 380 -2.038 -1.525 -21.716 1.00 0.00 H new ATOM 0 HG21 THR A 380 -1.724 -3.753 -20.830 1.00 0.00 H new ATOM 0 HG22 THR A 380 -1.777 -3.910 -19.058 1.00 0.00 H new ATOM 0 HG23 THR A 380 -3.266 -3.555 -19.964 1.00 0.00 H new ATOM 451 N LEU A 381 -2.459 -3.037 -16.743 1.00 0.00 N ATOM 452 CA LEU A 381 -1.832 -3.698 -15.567 1.00 0.00 C ATOM 453 C LEU A 381 -0.452 -4.217 -15.965 1.00 0.00 C ATOM 454 O LEU A 381 0.444 -4.320 -15.150 1.00 0.00 O ATOM 455 CB LEU A 381 -2.702 -4.871 -15.114 1.00 0.00 C ATOM 456 CG LEU A 381 -4.101 -4.365 -14.762 1.00 0.00 C ATOM 457 CD1 LEU A 381 -4.921 -5.515 -14.174 1.00 0.00 C ATOM 458 CD2 LEU A 381 -3.994 -3.236 -13.735 1.00 0.00 C ATOM 0 H LEU A 381 -3.330 -3.458 -17.066 1.00 0.00 H new ATOM 0 HA LEU A 381 -1.738 -2.982 -14.751 1.00 0.00 H new ATOM 0 HB2 LEU A 381 -2.763 -5.619 -15.905 1.00 0.00 H new ATOM 0 HB3 LEU A 381 -2.252 -5.358 -14.249 1.00 0.00 H new ATOM 0 HG LEU A 381 -4.590 -3.990 -15.661 1.00 0.00 H new ATOM 0 HD11 LEU A 381 -5.919 -5.158 -13.922 1.00 0.00 H new ATOM 0 HD12 LEU A 381 -4.997 -6.319 -14.906 1.00 0.00 H new ATOM 0 HD13 LEU A 381 -4.431 -5.888 -13.275 1.00 0.00 H new ATOM 0 HD21 LEU A 381 -4.992 -2.876 -13.485 1.00 0.00 H new ATOM 0 HD22 LEU A 381 -3.506 -3.609 -12.834 1.00 0.00 H new ATOM 0 HD23 LEU A 381 -3.408 -2.418 -14.153 1.00 0.00 H new ATOM 470 N GLU A 382 -0.274 -4.544 -17.215 1.00 0.00 N ATOM 471 CA GLU A 382 1.048 -5.055 -17.667 1.00 0.00 C ATOM 472 C GLU A 382 2.106 -3.978 -17.438 1.00 0.00 C ATOM 473 O GLU A 382 3.163 -4.237 -16.904 1.00 0.00 O ATOM 474 CB GLU A 382 0.981 -5.404 -19.155 1.00 0.00 C ATOM 475 CG GLU A 382 0.336 -6.781 -19.324 1.00 0.00 C ATOM 476 CD GLU A 382 0.240 -7.120 -20.812 1.00 0.00 C ATOM 477 OE1 GLU A 382 0.668 -6.307 -21.615 1.00 0.00 O ATOM 478 OE2 GLU A 382 -0.260 -8.188 -21.125 1.00 0.00 O ATOM 0 H GLU A 382 -0.987 -4.479 -17.942 1.00 0.00 H new ATOM 0 HA GLU A 382 1.309 -5.949 -17.101 1.00 0.00 H new ATOM 0 HB2 GLU A 382 0.403 -4.651 -19.691 1.00 0.00 H new ATOM 0 HB3 GLU A 382 1.982 -5.404 -19.586 1.00 0.00 H new ATOM 0 HG2 GLU A 382 0.926 -7.537 -18.805 1.00 0.00 H new ATOM 0 HG3 GLU A 382 -0.657 -6.787 -18.874 1.00 0.00 H new ATOM 485 N GLU A 383 1.830 -2.766 -17.826 1.00 0.00 N ATOM 486 CA GLU A 383 2.824 -1.682 -17.613 1.00 0.00 C ATOM 487 C GLU A 383 3.096 -1.550 -16.113 1.00 0.00 C ATOM 488 O GLU A 383 4.222 -1.391 -15.685 1.00 0.00 O ATOM 489 CB GLU A 383 2.267 -0.365 -18.156 1.00 0.00 C ATOM 490 CG GLU A 383 1.989 -0.514 -19.653 1.00 0.00 C ATOM 491 CD GLU A 383 1.583 0.841 -20.236 1.00 0.00 C ATOM 492 OE1 GLU A 383 1.437 1.774 -19.465 1.00 0.00 O ATOM 493 OE2 GLU A 383 1.426 0.922 -21.443 1.00 0.00 O ATOM 0 H GLU A 383 0.962 -2.480 -18.280 1.00 0.00 H new ATOM 0 HA GLU A 383 3.751 -1.918 -18.135 1.00 0.00 H new ATOM 0 HB2 GLU A 383 1.351 -0.099 -17.629 1.00 0.00 H new ATOM 0 HB3 GLU A 383 2.979 0.443 -17.985 1.00 0.00 H new ATOM 0 HG2 GLU A 383 2.876 -0.889 -20.163 1.00 0.00 H new ATOM 0 HG3 GLU A 383 1.196 -1.244 -19.815 1.00 0.00 H new ATOM 500 N LEU A 384 2.067 -1.612 -15.311 1.00 0.00 N ATOM 501 CA LEU A 384 2.254 -1.488 -13.838 1.00 0.00 C ATOM 502 C LEU A 384 3.005 -2.708 -13.297 1.00 0.00 C ATOM 503 O LEU A 384 3.896 -2.588 -12.480 1.00 0.00 O ATOM 504 CB LEU A 384 0.885 -1.403 -13.159 1.00 0.00 C ATOM 505 CG LEU A 384 0.187 -0.099 -13.552 1.00 0.00 C ATOM 506 CD1 LEU A 384 -1.208 -0.061 -12.921 1.00 0.00 C ATOM 507 CD2 LEU A 384 1.005 1.094 -13.051 1.00 0.00 C ATOM 0 H LEU A 384 1.102 -1.744 -15.615 1.00 0.00 H new ATOM 0 HA LEU A 384 2.832 -0.588 -13.629 1.00 0.00 H new ATOM 0 HB2 LEU A 384 0.272 -2.256 -13.450 1.00 0.00 H new ATOM 0 HB3 LEU A 384 1.003 -1.450 -12.076 1.00 0.00 H new ATOM 0 HG LEU A 384 0.100 -0.047 -14.637 1.00 0.00 H new ATOM 0 HD11 LEU A 384 -1.708 0.867 -13.199 1.00 0.00 H new ATOM 0 HD12 LEU A 384 -1.792 -0.909 -13.278 1.00 0.00 H new ATOM 0 HD13 LEU A 384 -1.118 -0.114 -11.836 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.506 2.021 -13.332 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.094 1.044 -11.966 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.999 1.067 -13.498 1.00 0.00 H new ATOM 519 N ALA A 385 2.639 -3.881 -13.731 1.00 0.00 N ATOM 520 CA ALA A 385 3.318 -5.110 -13.225 1.00 0.00 C ATOM 521 C ALA A 385 4.638 -5.329 -13.969 1.00 0.00 C ATOM 522 O ALA A 385 5.607 -5.797 -13.405 1.00 0.00 O ATOM 523 CB ALA A 385 2.406 -6.319 -13.446 1.00 0.00 C ATOM 0 H ALA A 385 1.899 -4.044 -14.414 1.00 0.00 H new ATOM 0 HA ALA A 385 3.525 -4.990 -12.162 1.00 0.00 H new ATOM 0 HB1 ALA A 385 2.899 -7.219 -13.078 1.00 0.00 H new ATOM 0 HB2 ALA A 385 1.470 -6.172 -12.908 1.00 0.00 H new ATOM 0 HB3 ALA A 385 2.199 -6.429 -14.511 1.00 0.00 H new ATOM 529 N TYR A 386 4.684 -5.001 -15.229 1.00 0.00 N ATOM 530 CA TYR A 386 5.942 -5.200 -16.002 1.00 0.00 C ATOM 531 C TYR A 386 6.985 -4.185 -15.536 1.00 0.00 C ATOM 532 O TYR A 386 8.155 -4.490 -15.423 1.00 0.00 O ATOM 533 CB TYR A 386 5.665 -5.012 -17.495 1.00 0.00 C ATOM 534 CG TYR A 386 4.900 -6.206 -18.019 1.00 0.00 C ATOM 535 CD1 TYR A 386 3.764 -6.669 -17.340 1.00 0.00 C ATOM 536 CD2 TYR A 386 5.326 -6.852 -19.187 1.00 0.00 C ATOM 537 CE1 TYR A 386 3.057 -7.771 -17.827 1.00 0.00 C ATOM 538 CE2 TYR A 386 4.617 -7.957 -19.673 1.00 0.00 C ATOM 539 CZ TYR A 386 3.482 -8.416 -18.995 1.00 0.00 C ATOM 540 OH TYR A 386 2.784 -9.506 -19.474 1.00 0.00 O ATOM 0 H TYR A 386 3.907 -4.604 -15.757 1.00 0.00 H new ATOM 0 HA TYR A 386 6.318 -6.209 -15.835 1.00 0.00 H new ATOM 0 HB2 TYR A 386 5.092 -4.099 -17.657 1.00 0.00 H new ATOM 0 HB3 TYR A 386 6.603 -4.900 -18.039 1.00 0.00 H new ATOM 0 HD1 TYR A 386 3.435 -6.173 -16.439 1.00 0.00 H new ATOM 0 HD2 TYR A 386 6.201 -6.498 -19.712 1.00 0.00 H new ATOM 0 HE1 TYR A 386 2.182 -8.126 -17.302 1.00 0.00 H new ATOM 0 HE2 TYR A 386 4.946 -8.456 -20.572 1.00 0.00 H new ATOM 0 HH TYR A 386 3.211 -9.834 -20.293 1.00 0.00 H new ATOM 550 N VAL A 387 6.569 -2.982 -15.252 1.00 0.00 N ATOM 551 CA VAL A 387 7.537 -1.956 -14.779 1.00 0.00 C ATOM 552 C VAL A 387 8.008 -2.340 -13.375 1.00 0.00 C ATOM 553 O VAL A 387 7.224 -2.748 -12.542 1.00 0.00 O ATOM 554 CB VAL A 387 6.856 -0.587 -14.742 1.00 0.00 C ATOM 555 CG1 VAL A 387 5.706 -0.615 -13.733 1.00 0.00 C ATOM 556 CG2 VAL A 387 7.874 0.477 -14.329 1.00 0.00 C ATOM 0 H VAL A 387 5.602 -2.666 -15.327 1.00 0.00 H new ATOM 0 HA VAL A 387 8.391 -1.907 -15.455 1.00 0.00 H new ATOM 0 HB VAL A 387 6.464 -0.349 -15.731 1.00 0.00 H new ATOM 0 HG11 VAL A 387 5.221 0.361 -13.707 1.00 0.00 H new ATOM 0 HG12 VAL A 387 4.981 -1.373 -14.029 1.00 0.00 H new ATOM 0 HG13 VAL A 387 6.096 -0.853 -12.743 1.00 0.00 H new ATOM 0 HG21 VAL A 387 7.390 1.453 -14.302 1.00 0.00 H new ATOM 0 HG22 VAL A 387 8.267 0.240 -13.340 1.00 0.00 H new ATOM 0 HG23 VAL A 387 8.692 0.497 -15.049 1.00 0.00 H new ATOM 566 N PRO A 388 9.316 -2.219 -13.112 1.00 0.00 N ATOM 567 CA PRO A 388 9.893 -2.568 -11.810 1.00 0.00 C ATOM 568 C PRO A 388 9.485 -1.591 -10.708 1.00 0.00 C ATOM 569 O PRO A 388 8.954 -0.528 -10.960 1.00 0.00 O ATOM 570 CB PRO A 388 11.397 -2.476 -12.044 1.00 0.00 C ATOM 571 CG PRO A 388 11.539 -1.527 -13.180 1.00 0.00 C ATOM 572 CD PRO A 388 10.335 -1.735 -14.057 1.00 0.00 C ATOM 0 HA PRO A 388 9.553 -3.548 -11.475 1.00 0.00 H new ATOM 0 HB2 PRO A 388 11.915 -2.113 -11.156 1.00 0.00 H new ATOM 0 HB3 PRO A 388 11.822 -3.450 -12.285 1.00 0.00 H new ATOM 0 HG2 PRO A 388 11.587 -0.498 -12.823 1.00 0.00 H new ATOM 0 HG3 PRO A 388 12.460 -1.716 -13.732 1.00 0.00 H new ATOM 0 HD2 PRO A 388 10.026 -0.810 -14.545 1.00 0.00 H new ATOM 0 HD3 PRO A 388 10.531 -2.461 -14.846 1.00 0.00 H new ATOM 580 N MET A 389 9.725 -1.964 -9.486 1.00 0.00 N ATOM 581 CA MET A 389 9.355 -1.087 -8.340 1.00 0.00 C ATOM 582 C MET A 389 10.034 0.277 -8.484 1.00 0.00 C ATOM 583 O MET A 389 9.383 1.288 -8.656 1.00 0.00 O ATOM 584 CB MET A 389 9.802 -1.745 -7.033 1.00 0.00 C ATOM 585 CG MET A 389 9.430 -0.844 -5.855 1.00 0.00 C ATOM 586 SD MET A 389 10.926 -0.423 -4.927 1.00 0.00 S ATOM 587 CE MET A 389 10.988 1.328 -5.379 1.00 0.00 C ATOM 0 H MET A 389 10.166 -2.847 -9.227 1.00 0.00 H new ATOM 0 HA MET A 389 8.274 -0.947 -8.330 1.00 0.00 H new ATOM 0 HB2 MET A 389 9.327 -2.720 -6.923 1.00 0.00 H new ATOM 0 HB3 MET A 389 10.879 -1.915 -7.049 1.00 0.00 H new ATOM 0 HG2 MET A 389 8.945 0.063 -6.215 1.00 0.00 H new ATOM 0 HG3 MET A 389 8.716 -1.351 -5.206 1.00 0.00 H new ATOM 0 HE1 MET A 389 12.022 1.619 -5.566 1.00 0.00 H new ATOM 0 HE2 MET A 389 10.397 1.492 -6.280 1.00 0.00 H new ATOM 0 HE3 MET A 389 10.583 1.929 -4.564 1.00 0.00 H new ATOM 597 N LYS A 390 11.338 0.318 -8.400 1.00 0.00 N ATOM 598 CA LYS A 390 12.055 1.622 -8.518 1.00 0.00 C ATOM 599 C LYS A 390 11.415 2.477 -9.614 1.00 0.00 C ATOM 600 O LYS A 390 11.057 3.617 -9.393 1.00 0.00 O ATOM 601 CB LYS A 390 13.522 1.371 -8.870 1.00 0.00 C ATOM 602 CG LYS A 390 14.207 0.639 -7.716 1.00 0.00 C ATOM 603 CD LYS A 390 15.702 0.513 -8.013 1.00 0.00 C ATOM 604 CE LYS A 390 16.377 -0.296 -6.904 1.00 0.00 C ATOM 605 NZ LYS A 390 17.619 -0.922 -7.437 1.00 0.00 N ATOM 0 H LYS A 390 11.937 -0.495 -8.255 1.00 0.00 H new ATOM 0 HA LYS A 390 11.988 2.148 -7.566 1.00 0.00 H new ATOM 0 HB2 LYS A 390 13.592 0.779 -9.782 1.00 0.00 H new ATOM 0 HB3 LYS A 390 14.027 2.317 -9.065 1.00 0.00 H new ATOM 0 HG2 LYS A 390 14.054 1.183 -6.784 1.00 0.00 H new ATOM 0 HG3 LYS A 390 13.766 -0.349 -7.584 1.00 0.00 H new ATOM 0 HD2 LYS A 390 15.852 0.025 -8.976 1.00 0.00 H new ATOM 0 HD3 LYS A 390 16.154 1.502 -8.083 1.00 0.00 H new ATOM 0 HE2 LYS A 390 16.616 0.351 -6.060 1.00 0.00 H new ATOM 0 HE3 LYS A 390 15.698 -1.065 -6.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 18.080 -1.473 -6.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 17.378 -1.551 -8.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 18.267 -0.179 -7.769 1.00 0.00 H new ATOM 619 N GLU A 391 11.267 1.941 -10.794 1.00 0.00 N ATOM 620 CA GLU A 391 10.653 2.735 -11.895 1.00 0.00 C ATOM 621 C GLU A 391 9.329 3.313 -11.408 1.00 0.00 C ATOM 622 O GLU A 391 8.968 4.430 -11.725 1.00 0.00 O ATOM 623 CB GLU A 391 10.409 1.832 -13.105 1.00 0.00 C ATOM 624 CG GLU A 391 11.732 1.586 -13.833 1.00 0.00 C ATOM 625 CD GLU A 391 12.299 2.918 -14.329 1.00 0.00 C ATOM 626 OE1 GLU A 391 11.538 3.867 -14.420 1.00 0.00 O ATOM 627 OE2 GLU A 391 13.485 2.966 -14.610 1.00 0.00 O ATOM 0 H GLU A 391 11.543 0.991 -11.043 1.00 0.00 H new ATOM 0 HA GLU A 391 11.323 3.544 -12.186 1.00 0.00 H new ATOM 0 HB2 GLU A 391 9.977 0.884 -12.784 1.00 0.00 H new ATOM 0 HB3 GLU A 391 9.691 2.297 -13.780 1.00 0.00 H new ATOM 0 HG2 GLU A 391 12.443 1.103 -13.163 1.00 0.00 H new ATOM 0 HG3 GLU A 391 11.576 0.910 -14.674 1.00 0.00 H new ATOM 634 N LEU A 392 8.600 2.557 -10.636 1.00 0.00 N ATOM 635 CA LEU A 392 7.294 3.056 -10.121 1.00 0.00 C ATOM 636 C LEU A 392 7.533 3.977 -8.921 1.00 0.00 C ATOM 637 O LEU A 392 6.934 5.027 -8.804 1.00 0.00 O ATOM 638 CB LEU A 392 6.430 1.869 -9.695 1.00 0.00 C ATOM 639 CG LEU A 392 5.985 1.094 -10.936 1.00 0.00 C ATOM 640 CD1 LEU A 392 5.029 -0.027 -10.526 1.00 0.00 C ATOM 641 CD2 LEU A 392 5.272 2.043 -11.901 1.00 0.00 C ATOM 0 H LEU A 392 8.852 1.614 -10.339 1.00 0.00 H new ATOM 0 HA LEU A 392 6.782 3.614 -10.905 1.00 0.00 H new ATOM 0 HB2 LEU A 392 6.993 1.216 -9.027 1.00 0.00 H new ATOM 0 HB3 LEU A 392 5.560 2.219 -9.140 1.00 0.00 H new ATOM 0 HG LEU A 392 6.859 0.664 -11.426 1.00 0.00 H new ATOM 0 HD11 LEU A 392 4.713 -0.578 -11.412 1.00 0.00 H new ATOM 0 HD12 LEU A 392 5.536 -0.704 -9.839 1.00 0.00 H new ATOM 0 HD13 LEU A 392 4.155 0.401 -10.035 1.00 0.00 H new ATOM 0 HD21 LEU A 392 4.955 1.491 -12.786 1.00 0.00 H new ATOM 0 HD22 LEU A 392 4.400 2.474 -11.410 1.00 0.00 H new ATOM 0 HD23 LEU A 392 5.953 2.841 -12.196 1.00 0.00 H new ATOM 653 N LEU A 393 8.404 3.591 -8.027 1.00 0.00 N ATOM 654 CA LEU A 393 8.676 4.447 -6.835 1.00 0.00 C ATOM 655 C LEU A 393 9.313 5.764 -7.282 1.00 0.00 C ATOM 656 O LEU A 393 9.108 6.799 -6.679 1.00 0.00 O ATOM 657 CB LEU A 393 9.628 3.715 -5.889 1.00 0.00 C ATOM 658 CG LEU A 393 9.892 4.585 -4.658 1.00 0.00 C ATOM 659 CD1 LEU A 393 9.564 3.790 -3.392 1.00 0.00 C ATOM 660 CD2 LEU A 393 11.365 4.997 -4.632 1.00 0.00 C ATOM 0 H LEU A 393 8.938 2.723 -8.070 1.00 0.00 H new ATOM 0 HA LEU A 393 7.739 4.656 -6.319 1.00 0.00 H new ATOM 0 HB2 LEU A 393 9.196 2.761 -5.587 1.00 0.00 H new ATOM 0 HB3 LEU A 393 10.566 3.493 -6.399 1.00 0.00 H new ATOM 0 HG LEU A 393 9.265 5.476 -4.701 1.00 0.00 H new ATOM 0 HD11 LEU A 393 9.752 4.409 -2.515 1.00 0.00 H new ATOM 0 HD12 LEU A 393 8.515 3.494 -3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 393 10.191 2.900 -3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 393 11.554 5.617 -3.756 1.00 0.00 H new ATOM 0 HD22 LEU A 393 11.991 4.106 -4.588 1.00 0.00 H new ATOM 0 HD23 LEU A 393 11.601 5.562 -5.534 1.00 0.00 H new ATOM 672 N GLU A 394 10.085 5.735 -8.333 1.00 0.00 N ATOM 673 CA GLU A 394 10.733 6.988 -8.814 1.00 0.00 C ATOM 674 C GLU A 394 9.683 7.876 -9.479 1.00 0.00 C ATOM 675 O GLU A 394 9.842 9.076 -9.574 1.00 0.00 O ATOM 676 CB GLU A 394 11.826 6.645 -9.827 1.00 0.00 C ATOM 677 CG GLU A 394 12.941 5.866 -9.129 1.00 0.00 C ATOM 678 CD GLU A 394 14.090 5.630 -10.112 1.00 0.00 C ATOM 679 OE1 GLU A 394 13.899 5.891 -11.289 1.00 0.00 O ATOM 680 OE2 GLU A 394 15.141 5.192 -9.672 1.00 0.00 O ATOM 0 H GLU A 394 10.295 4.899 -8.879 1.00 0.00 H new ATOM 0 HA GLU A 394 11.177 7.515 -7.969 1.00 0.00 H new ATOM 0 HB2 GLU A 394 11.409 6.053 -10.642 1.00 0.00 H new ATOM 0 HB3 GLU A 394 12.227 7.557 -10.269 1.00 0.00 H new ATOM 0 HG2 GLU A 394 13.299 6.420 -8.261 1.00 0.00 H new ATOM 0 HG3 GLU A 394 12.559 4.913 -8.763 1.00 0.00 H new ATOM 687 N ILE A 395 8.618 7.288 -9.949 1.00 0.00 N ATOM 688 CA ILE A 395 7.547 8.079 -10.620 1.00 0.00 C ATOM 689 C ILE A 395 7.434 9.467 -9.990 1.00 0.00 C ATOM 690 O ILE A 395 7.152 10.439 -10.661 1.00 0.00 O ATOM 691 CB ILE A 395 6.216 7.343 -10.471 1.00 0.00 C ATOM 692 CG1 ILE A 395 6.245 6.070 -11.317 1.00 0.00 C ATOM 693 CG2 ILE A 395 5.075 8.245 -10.946 1.00 0.00 C ATOM 694 CD1 ILE A 395 4.892 5.364 -11.231 1.00 0.00 C ATOM 0 H ILE A 395 8.442 6.285 -9.897 1.00 0.00 H new ATOM 0 HA ILE A 395 7.796 8.193 -11.675 1.00 0.00 H new ATOM 0 HB ILE A 395 6.059 7.083 -9.424 1.00 0.00 H new ATOM 0 HG12 ILE A 395 6.472 6.316 -12.354 1.00 0.00 H new ATOM 0 HG13 ILE A 395 7.035 5.406 -10.966 1.00 0.00 H new ATOM 0 HG21 ILE A 395 4.127 7.719 -10.839 1.00 0.00 H new ATOM 0 HG22 ILE A 395 5.055 9.154 -10.345 1.00 0.00 H new ATOM 0 HG23 ILE A 395 5.229 8.506 -11.993 1.00 0.00 H new ATOM 0 HD11 ILE A 395 4.916 4.457 -11.835 1.00 0.00 H new ATOM 0 HD12 ILE A 395 4.683 5.104 -10.193 1.00 0.00 H new ATOM 0 HD13 ILE A 395 4.111 6.027 -11.603 1.00 0.00 H new ATOM 706 N GLU A 396 7.649 9.573 -8.711 1.00 0.00 N ATOM 707 CA GLU A 396 7.549 10.907 -8.054 1.00 0.00 C ATOM 708 C GLU A 396 7.874 10.776 -6.564 1.00 0.00 C ATOM 709 O GLU A 396 9.014 10.889 -6.156 1.00 0.00 O ATOM 710 CB GLU A 396 6.130 11.454 -8.221 1.00 0.00 C ATOM 711 CG GLU A 396 6.008 12.784 -7.473 1.00 0.00 C ATOM 712 CD GLU A 396 4.565 13.284 -7.548 1.00 0.00 C ATOM 713 OE1 GLU A 396 3.727 12.545 -8.040 1.00 0.00 O ATOM 714 OE2 GLU A 396 4.320 14.397 -7.111 1.00 0.00 O ATOM 0 H GLU A 396 7.889 8.798 -8.092 1.00 0.00 H new ATOM 0 HA GLU A 396 8.260 11.590 -8.518 1.00 0.00 H new ATOM 0 HB2 GLU A 396 5.905 11.596 -9.278 1.00 0.00 H new ATOM 0 HB3 GLU A 396 5.404 10.738 -7.834 1.00 0.00 H new ATOM 0 HG2 GLU A 396 6.306 12.656 -6.432 1.00 0.00 H new ATOM 0 HG3 GLU A 396 6.682 13.521 -7.909 1.00 0.00 H new ATOM 721 N GLY A 397 6.883 10.546 -5.745 1.00 0.00 N ATOM 722 CA GLY A 397 7.141 10.418 -4.282 1.00 0.00 C ATOM 723 C GLY A 397 6.363 9.228 -3.720 1.00 0.00 C ATOM 724 O GLY A 397 5.754 9.311 -2.671 1.00 0.00 O ATOM 0 H GLY A 397 5.908 10.441 -6.025 1.00 0.00 H new ATOM 0 HA2 GLY A 397 8.208 10.284 -4.102 1.00 0.00 H new ATOM 0 HA3 GLY A 397 6.844 11.333 -3.770 1.00 0.00 H new ATOM 728 N LEU A 398 6.380 8.123 -4.407 1.00 0.00 N ATOM 729 CA LEU A 398 5.644 6.926 -3.910 1.00 0.00 C ATOM 730 C LEU A 398 6.480 6.230 -2.834 1.00 0.00 C ATOM 731 O LEU A 398 7.688 6.348 -2.802 1.00 0.00 O ATOM 732 CB LEU A 398 5.387 5.964 -5.070 1.00 0.00 C ATOM 733 CG LEU A 398 4.580 6.684 -6.153 1.00 0.00 C ATOM 734 CD1 LEU A 398 4.278 5.713 -7.296 1.00 0.00 C ATOM 735 CD2 LEU A 398 3.267 7.195 -5.555 1.00 0.00 C ATOM 0 H LEU A 398 6.871 7.995 -5.292 1.00 0.00 H new ATOM 0 HA LEU A 398 4.689 7.234 -3.484 1.00 0.00 H new ATOM 0 HB2 LEU A 398 6.333 5.609 -5.480 1.00 0.00 H new ATOM 0 HB3 LEU A 398 4.844 5.087 -4.717 1.00 0.00 H new ATOM 0 HG LEU A 398 5.156 7.526 -6.536 1.00 0.00 H new ATOM 0 HD11 LEU A 398 3.703 6.226 -8.067 1.00 0.00 H new ATOM 0 HD12 LEU A 398 5.213 5.350 -7.722 1.00 0.00 H new ATOM 0 HD13 LEU A 398 3.702 4.870 -6.915 1.00 0.00 H new ATOM 0 HD21 LEU A 398 2.692 7.708 -6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 398 2.690 6.354 -5.171 1.00 0.00 H new ATOM 0 HD23 LEU A 398 3.483 7.888 -4.742 1.00 0.00 H new ATOM 747 N ASP A 399 5.848 5.507 -1.948 1.00 0.00 N ATOM 748 CA ASP A 399 6.612 4.813 -0.872 1.00 0.00 C ATOM 749 C ASP A 399 7.156 3.482 -1.393 1.00 0.00 C ATOM 750 O ASP A 399 6.659 2.926 -2.351 1.00 0.00 O ATOM 751 CB ASP A 399 5.696 4.554 0.326 1.00 0.00 C ATOM 752 CG ASP A 399 4.852 5.800 0.601 1.00 0.00 C ATOM 753 OD1 ASP A 399 5.312 6.884 0.283 1.00 0.00 O ATOM 754 OD2 ASP A 399 3.760 5.649 1.124 1.00 0.00 O ATOM 0 H ASP A 399 4.838 5.367 -1.923 1.00 0.00 H new ATOM 0 HA ASP A 399 7.444 5.446 -0.564 1.00 0.00 H new ATOM 0 HB2 ASP A 399 5.049 3.700 0.125 1.00 0.00 H new ATOM 0 HB3 ASP A 399 6.290 4.303 1.204 1.00 0.00 H new ATOM 759 N GLU A 400 8.179 2.973 -0.765 1.00 0.00 N ATOM 760 CA GLU A 400 8.774 1.682 -1.214 1.00 0.00 C ATOM 761 C GLU A 400 7.743 0.554 -1.101 1.00 0.00 C ATOM 762 O GLU A 400 7.546 -0.204 -2.029 1.00 0.00 O ATOM 763 CB GLU A 400 9.983 1.354 -0.335 1.00 0.00 C ATOM 764 CG GLU A 400 10.474 -0.060 -0.653 1.00 0.00 C ATOM 765 CD GLU A 400 11.693 -0.383 0.214 1.00 0.00 C ATOM 766 OE1 GLU A 400 12.364 0.548 0.628 1.00 0.00 O ATOM 767 OE2 GLU A 400 11.934 -1.556 0.449 1.00 0.00 O ATOM 0 H GLU A 400 8.631 3.398 0.045 1.00 0.00 H new ATOM 0 HA GLU A 400 9.083 1.775 -2.255 1.00 0.00 H new ATOM 0 HB2 GLU A 400 10.781 2.076 -0.511 1.00 0.00 H new ATOM 0 HB3 GLU A 400 9.712 1.428 0.718 1.00 0.00 H new ATOM 0 HG2 GLU A 400 9.680 -0.783 -0.467 1.00 0.00 H new ATOM 0 HG3 GLU A 400 10.734 -0.137 -1.709 1.00 0.00 H new ATOM 774 N PRO A 401 7.081 0.432 0.062 1.00 0.00 N ATOM 775 CA PRO A 401 6.079 -0.619 0.291 1.00 0.00 C ATOM 776 C PRO A 401 4.819 -0.410 -0.555 1.00 0.00 C ATOM 777 O PRO A 401 4.272 -1.342 -1.107 1.00 0.00 O ATOM 778 CB PRO A 401 5.747 -0.481 1.777 1.00 0.00 C ATOM 779 CG PRO A 401 6.076 0.936 2.105 1.00 0.00 C ATOM 780 CD PRO A 401 7.250 1.303 1.240 1.00 0.00 C ATOM 0 HA PRO A 401 6.454 -1.605 0.015 1.00 0.00 H new ATOM 0 HB2 PRO A 401 4.697 -0.699 1.971 1.00 0.00 H new ATOM 0 HB3 PRO A 401 6.333 -1.174 2.380 1.00 0.00 H new ATOM 0 HG2 PRO A 401 5.226 1.589 1.906 1.00 0.00 H new ATOM 0 HG3 PRO A 401 6.321 1.045 3.161 1.00 0.00 H new ATOM 0 HD2 PRO A 401 7.236 2.358 0.967 1.00 0.00 H new ATOM 0 HD3 PRO A 401 8.197 1.118 1.746 1.00 0.00 H new ATOM 788 N THR A 402 4.355 0.804 -0.662 1.00 0.00 N ATOM 789 CA THR A 402 3.132 1.059 -1.474 1.00 0.00 C ATOM 790 C THR A 402 3.386 0.634 -2.922 1.00 0.00 C ATOM 791 O THR A 402 2.565 -0.008 -3.545 1.00 0.00 O ATOM 792 CB THR A 402 2.795 2.552 -1.433 1.00 0.00 C ATOM 793 OG1 THR A 402 2.677 2.971 -0.081 1.00 0.00 O ATOM 794 CG2 THR A 402 1.473 2.799 -2.163 1.00 0.00 C ATOM 0 H THR A 402 4.768 1.628 -0.224 1.00 0.00 H new ATOM 0 HA THR A 402 2.298 0.487 -1.067 1.00 0.00 H new ATOM 0 HB THR A 402 3.588 3.118 -1.922 1.00 0.00 H new ATOM 0 HG1 THR A 402 2.606 3.948 -0.046 1.00 0.00 H new ATOM 0 HG21 THR A 402 1.234 3.862 -2.133 1.00 0.00 H new ATOM 0 HG22 THR A 402 1.564 2.477 -3.200 1.00 0.00 H new ATOM 0 HG23 THR A 402 0.678 2.235 -1.676 1.00 0.00 H new ATOM 802 N VAL A 403 4.520 0.989 -3.461 1.00 0.00 N ATOM 803 CA VAL A 403 4.830 0.608 -4.868 1.00 0.00 C ATOM 804 C VAL A 403 4.932 -0.912 -4.975 1.00 0.00 C ATOM 805 O VAL A 403 4.394 -1.516 -5.882 1.00 0.00 O ATOM 806 CB VAL A 403 6.162 1.233 -5.286 1.00 0.00 C ATOM 807 CG1 VAL A 403 6.301 1.165 -6.809 1.00 0.00 C ATOM 808 CG2 VAL A 403 6.206 2.692 -4.834 1.00 0.00 C ATOM 0 H VAL A 403 5.246 1.527 -2.987 1.00 0.00 H new ATOM 0 HA VAL A 403 4.036 0.968 -5.522 1.00 0.00 H new ATOM 0 HB VAL A 403 6.982 0.685 -4.821 1.00 0.00 H new ATOM 0 HG11 VAL A 403 7.250 1.610 -7.108 1.00 0.00 H new ATOM 0 HG12 VAL A 403 6.271 0.124 -7.131 1.00 0.00 H new ATOM 0 HG13 VAL A 403 5.481 1.712 -7.274 1.00 0.00 H new ATOM 0 HG21 VAL A 403 7.155 3.137 -5.132 1.00 0.00 H new ATOM 0 HG22 VAL A 403 5.387 3.241 -5.297 1.00 0.00 H new ATOM 0 HG23 VAL A 403 6.108 2.740 -3.750 1.00 0.00 H new ATOM 818 N GLU A 404 5.620 -1.535 -4.060 1.00 0.00 N ATOM 819 CA GLU A 404 5.758 -3.018 -4.114 1.00 0.00 C ATOM 820 C GLU A 404 4.375 -3.669 -4.027 1.00 0.00 C ATOM 821 O GLU A 404 4.066 -4.591 -4.757 1.00 0.00 O ATOM 822 CB GLU A 404 6.618 -3.491 -2.940 1.00 0.00 C ATOM 823 CG GLU A 404 8.058 -3.015 -3.138 1.00 0.00 C ATOM 824 CD GLU A 404 8.926 -3.517 -1.981 1.00 0.00 C ATOM 825 OE1 GLU A 404 8.376 -4.110 -1.069 1.00 0.00 O ATOM 826 OE2 GLU A 404 10.126 -3.300 -2.029 1.00 0.00 O ATOM 0 H GLU A 404 6.093 -1.083 -3.277 1.00 0.00 H new ATOM 0 HA GLU A 404 6.232 -3.303 -5.053 1.00 0.00 H new ATOM 0 HB2 GLU A 404 6.220 -3.100 -2.003 1.00 0.00 H new ATOM 0 HB3 GLU A 404 6.590 -4.578 -2.869 1.00 0.00 H new ATOM 0 HG2 GLU A 404 8.448 -3.386 -4.086 1.00 0.00 H new ATOM 0 HG3 GLU A 404 8.089 -1.926 -3.184 1.00 0.00 H new ATOM 833 N ALA A 405 3.541 -3.201 -3.139 1.00 0.00 N ATOM 834 CA ALA A 405 2.180 -3.797 -3.007 1.00 0.00 C ATOM 835 C ALA A 405 1.341 -3.436 -4.232 1.00 0.00 C ATOM 836 O ALA A 405 0.537 -4.218 -4.699 1.00 0.00 O ATOM 837 CB ALA A 405 1.504 -3.252 -1.748 1.00 0.00 C ATOM 0 H ALA A 405 3.742 -2.432 -2.499 1.00 0.00 H new ATOM 0 HA ALA A 405 2.266 -4.881 -2.934 1.00 0.00 H new ATOM 0 HB1 ALA A 405 0.509 -3.687 -1.652 1.00 0.00 H new ATOM 0 HB2 ALA A 405 2.100 -3.512 -0.873 1.00 0.00 H new ATOM 0 HB3 ALA A 405 1.420 -2.168 -1.821 1.00 0.00 H new ATOM 843 N LEU A 406 1.520 -2.256 -4.754 1.00 0.00 N ATOM 844 CA LEU A 406 0.731 -1.842 -5.947 1.00 0.00 C ATOM 845 C LEU A 406 1.108 -2.723 -7.139 1.00 0.00 C ATOM 846 O LEU A 406 0.264 -3.135 -7.910 1.00 0.00 O ATOM 847 CB LEU A 406 1.035 -0.379 -6.273 1.00 0.00 C ATOM 848 CG LEU A 406 0.159 0.074 -7.443 1.00 0.00 C ATOM 849 CD1 LEU A 406 -1.270 0.308 -6.949 1.00 0.00 C ATOM 850 CD2 LEU A 406 0.717 1.373 -8.027 1.00 0.00 C ATOM 0 H LEU A 406 2.179 -1.559 -4.406 1.00 0.00 H new ATOM 0 HA LEU A 406 -0.333 -1.954 -5.738 1.00 0.00 H new ATOM 0 HB2 LEU A 406 0.847 0.246 -5.400 1.00 0.00 H new ATOM 0 HB3 LEU A 406 2.089 -0.263 -6.527 1.00 0.00 H new ATOM 0 HG LEU A 406 0.155 -0.697 -8.214 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -1.895 0.631 -7.782 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -1.668 -0.618 -6.535 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -1.267 1.079 -6.178 1.00 0.00 H new ATOM 0 HD21 LEU A 406 0.093 1.695 -8.860 1.00 0.00 H new ATOM 0 HD22 LEU A 406 0.722 2.145 -7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 406 1.735 1.206 -8.380 1.00 0.00 H new ATOM 862 N ARG A 407 2.368 -3.022 -7.293 1.00 0.00 N ATOM 863 CA ARG A 407 2.796 -3.882 -8.433 1.00 0.00 C ATOM 864 C ARG A 407 2.316 -5.311 -8.193 1.00 0.00 C ATOM 865 O ARG A 407 1.716 -5.931 -9.049 1.00 0.00 O ATOM 866 CB ARG A 407 4.320 -3.872 -8.532 1.00 0.00 C ATOM 867 CG ARG A 407 4.802 -2.448 -8.798 1.00 0.00 C ATOM 868 CD ARG A 407 6.317 -2.455 -9.000 1.00 0.00 C ATOM 869 NE ARG A 407 6.981 -2.987 -7.777 1.00 0.00 N ATOM 870 CZ ARG A 407 7.516 -4.178 -7.790 1.00 0.00 C ATOM 871 NH1 ARG A 407 8.342 -4.512 -8.744 1.00 0.00 N ATOM 872 NH2 ARG A 407 7.225 -5.034 -6.850 1.00 0.00 N ATOM 0 H ARG A 407 3.120 -2.708 -6.679 1.00 0.00 H new ATOM 0 HA ARG A 407 2.367 -3.501 -9.360 1.00 0.00 H new ATOM 0 HB2 ARG A 407 4.758 -4.249 -7.608 1.00 0.00 H new ATOM 0 HB3 ARG A 407 4.648 -4.534 -9.333 1.00 0.00 H new ATOM 0 HG2 ARG A 407 4.308 -2.044 -9.682 1.00 0.00 H new ATOM 0 HG3 ARG A 407 4.538 -1.801 -7.962 1.00 0.00 H new ATOM 0 HD2 ARG A 407 6.576 -3.068 -9.863 1.00 0.00 H new ATOM 0 HD3 ARG A 407 6.671 -1.445 -9.209 1.00 0.00 H new ATOM 0 HE ARG A 407 7.018 -2.421 -6.929 1.00 0.00 H new ATOM 0 HH11 ARG A 407 8.569 -3.843 -9.479 1.00 0.00 H new ATOM 0 HH12 ARG A 407 8.760 -5.442 -8.754 1.00 0.00 H new ATOM 0 HH21 ARG A 407 6.579 -4.773 -6.105 1.00 0.00 H new ATOM 0 HH22 ARG A 407 7.643 -5.964 -6.860 1.00 0.00 H new ATOM 886 N GLU A 408 2.573 -5.838 -7.028 1.00 0.00 N ATOM 887 CA GLU A 408 2.129 -7.226 -6.725 1.00 0.00 C ATOM 888 C GLU A 408 0.698 -7.417 -7.227 1.00 0.00 C ATOM 889 O GLU A 408 0.370 -8.417 -7.834 1.00 0.00 O ATOM 890 CB GLU A 408 2.176 -7.465 -5.215 1.00 0.00 C ATOM 891 CG GLU A 408 1.882 -8.940 -4.927 1.00 0.00 C ATOM 892 CD GLU A 408 1.886 -9.177 -3.416 1.00 0.00 C ATOM 893 OE1 GLU A 408 2.088 -8.220 -2.686 1.00 0.00 O ATOM 894 OE2 GLU A 408 1.686 -10.311 -3.014 1.00 0.00 O ATOM 0 H GLU A 408 3.071 -5.367 -6.273 1.00 0.00 H new ATOM 0 HA GLU A 408 2.791 -7.936 -7.221 1.00 0.00 H new ATOM 0 HB2 GLU A 408 3.156 -7.194 -4.823 1.00 0.00 H new ATOM 0 HB3 GLU A 408 1.445 -6.832 -4.712 1.00 0.00 H new ATOM 0 HG2 GLU A 408 0.915 -9.217 -5.346 1.00 0.00 H new ATOM 0 HG3 GLU A 408 2.630 -9.571 -5.407 1.00 0.00 H new ATOM 901 N ARG A 409 -0.159 -6.463 -6.981 1.00 0.00 N ATOM 902 CA ARG A 409 -1.567 -6.590 -7.449 1.00 0.00 C ATOM 903 C ARG A 409 -1.596 -6.565 -8.977 1.00 0.00 C ATOM 904 O ARG A 409 -2.266 -7.356 -9.609 1.00 0.00 O ATOM 905 CB ARG A 409 -2.395 -5.424 -6.906 1.00 0.00 C ATOM 906 CG ARG A 409 -2.401 -5.465 -5.377 1.00 0.00 C ATOM 907 CD ARG A 409 -3.298 -4.348 -4.842 1.00 0.00 C ATOM 908 NE ARG A 409 -3.048 -4.162 -3.384 1.00 0.00 N ATOM 909 CZ ARG A 409 -3.980 -4.459 -2.519 1.00 0.00 C ATOM 910 NH1 ARG A 409 -4.688 -5.545 -2.668 1.00 0.00 N ATOM 911 NH2 ARG A 409 -4.203 -3.669 -1.505 1.00 0.00 N ATOM 0 H ARG A 409 0.056 -5.603 -6.477 1.00 0.00 H new ATOM 0 HA ARG A 409 -1.986 -7.530 -7.090 1.00 0.00 H new ATOM 0 HB2 ARG A 409 -1.980 -4.478 -7.253 1.00 0.00 H new ATOM 0 HB3 ARG A 409 -3.415 -5.482 -7.285 1.00 0.00 H new ATOM 0 HG2 ARG A 409 -2.761 -6.433 -5.030 1.00 0.00 H new ATOM 0 HG3 ARG A 409 -1.387 -5.346 -4.995 1.00 0.00 H new ATOM 0 HD2 ARG A 409 -3.098 -3.420 -5.377 1.00 0.00 H new ATOM 0 HD3 ARG A 409 -4.346 -4.595 -5.013 1.00 0.00 H new ATOM 0 HE ARG A 409 -2.149 -3.803 -3.062 1.00 0.00 H new ATOM 0 HH11 ARG A 409 -4.514 -6.163 -3.461 1.00 0.00 H new ATOM 0 HH12 ARG A 409 -5.416 -5.776 -1.992 1.00 0.00 H new ATOM 0 HH21 ARG A 409 -3.650 -2.820 -1.388 1.00 0.00 H new ATOM 0 HH22 ARG A 409 -4.931 -3.900 -0.829 1.00 0.00 H new ATOM 925 N ALA A 410 -0.872 -5.659 -9.579 1.00 0.00 N ATOM 926 CA ALA A 410 -0.858 -5.583 -11.065 1.00 0.00 C ATOM 927 C ALA A 410 -0.369 -6.913 -11.641 1.00 0.00 C ATOM 928 O ALA A 410 -0.921 -7.430 -12.591 1.00 0.00 O ATOM 929 CB ALA A 410 0.082 -4.460 -11.509 1.00 0.00 C ATOM 0 H ALA A 410 -0.290 -4.969 -9.104 1.00 0.00 H new ATOM 0 HA ALA A 410 -1.866 -5.379 -11.427 1.00 0.00 H new ATOM 0 HB1 ALA A 410 0.093 -4.404 -12.597 1.00 0.00 H new ATOM 0 HB2 ALA A 410 -0.266 -3.511 -11.100 1.00 0.00 H new ATOM 0 HB3 ALA A 410 1.089 -4.664 -11.146 1.00 0.00 H new ATOM 935 N LYS A 411 0.666 -7.470 -11.075 1.00 0.00 N ATOM 936 CA LYS A 411 1.190 -8.765 -11.593 1.00 0.00 C ATOM 937 C LYS A 411 0.180 -9.876 -11.304 1.00 0.00 C ATOM 938 O LYS A 411 -0.237 -10.595 -12.191 1.00 0.00 O ATOM 939 CB LYS A 411 2.517 -9.090 -10.906 1.00 0.00 C ATOM 940 CG LYS A 411 3.519 -9.594 -11.947 1.00 0.00 C ATOM 941 CD LYS A 411 2.940 -10.815 -12.663 1.00 0.00 C ATOM 942 CE LYS A 411 3.965 -11.354 -13.662 1.00 0.00 C ATOM 943 NZ LYS A 411 3.971 -12.843 -13.614 1.00 0.00 N ATOM 0 H LYS A 411 1.171 -7.085 -10.277 1.00 0.00 H new ATOM 0 HA LYS A 411 1.348 -8.689 -12.669 1.00 0.00 H new ATOM 0 HB2 LYS A 411 2.908 -8.203 -10.408 1.00 0.00 H new ATOM 0 HB3 LYS A 411 2.365 -9.846 -10.136 1.00 0.00 H new ATOM 0 HG2 LYS A 411 3.738 -8.806 -12.668 1.00 0.00 H new ATOM 0 HG3 LYS A 411 4.461 -9.855 -11.464 1.00 0.00 H new ATOM 0 HD2 LYS A 411 2.682 -11.587 -11.938 1.00 0.00 H new ATOM 0 HD3 LYS A 411 2.020 -10.544 -13.180 1.00 0.00 H new ATOM 0 HE2 LYS A 411 3.722 -11.013 -14.668 1.00 0.00 H new ATOM 0 HE3 LYS A 411 4.957 -10.968 -13.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 4.668 -13.209 -14.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 4.223 -13.158 -12.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 3.026 -13.202 -13.860 1.00 0.00 H new ATOM 957 N ASN A 412 -0.214 -10.025 -10.069 1.00 0.00 N ATOM 958 CA ASN A 412 -1.196 -11.091 -9.725 1.00 0.00 C ATOM 959 C ASN A 412 -2.477 -10.885 -10.535 1.00 0.00 C ATOM 960 O ASN A 412 -3.022 -11.814 -11.099 1.00 0.00 O ATOM 961 CB ASN A 412 -1.518 -11.025 -8.230 1.00 0.00 C ATOM 962 CG ASN A 412 -0.265 -11.377 -7.424 1.00 0.00 C ATOM 963 OD1 ASN A 412 0.677 -11.930 -7.955 1.00 0.00 O ATOM 964 ND2 ASN A 412 -0.215 -11.076 -6.155 1.00 0.00 N ATOM 0 H ASN A 412 0.101 -9.455 -9.284 1.00 0.00 H new ATOM 0 HA ASN A 412 -0.772 -12.067 -9.961 1.00 0.00 H new ATOM 0 HB2 ASN A 412 -1.865 -10.026 -7.965 1.00 0.00 H new ATOM 0 HB3 ASN A 412 -2.325 -11.717 -7.990 1.00 0.00 H new ATOM 0 HD21 ASN A 412 0.615 -11.305 -5.609 1.00 0.00 H new ATOM 0 HD22 ASN A 412 -1.006 -10.612 -5.709 1.00 0.00 H new ATOM 971 N ALA A 413 -2.962 -9.675 -10.602 1.00 0.00 N ATOM 972 CA ALA A 413 -4.205 -9.415 -11.380 1.00 0.00 C ATOM 973 C ALA A 413 -3.937 -9.683 -12.862 1.00 0.00 C ATOM 974 O ALA A 413 -4.781 -10.194 -13.573 1.00 0.00 O ATOM 975 CB ALA A 413 -4.633 -7.958 -11.192 1.00 0.00 C ATOM 0 H ALA A 413 -2.551 -8.857 -10.152 1.00 0.00 H new ATOM 0 HA ALA A 413 -5.001 -10.071 -11.027 1.00 0.00 H new ATOM 0 HB1 ALA A 413 -5.543 -7.770 -11.762 1.00 0.00 H new ATOM 0 HB2 ALA A 413 -4.821 -7.767 -10.135 1.00 0.00 H new ATOM 0 HB3 ALA A 413 -3.841 -7.298 -11.544 1.00 0.00 H new ATOM 981 N LEU A 414 -2.765 -9.353 -13.333 1.00 0.00 N ATOM 982 CA LEU A 414 -2.445 -9.601 -14.767 1.00 0.00 C ATOM 983 C LEU A 414 -2.384 -11.109 -15.006 1.00 0.00 C ATOM 984 O LEU A 414 -2.936 -11.619 -15.960 1.00 0.00 O ATOM 985 CB LEU A 414 -1.093 -8.968 -15.109 1.00 0.00 C ATOM 986 CG LEU A 414 -0.982 -8.771 -16.623 1.00 0.00 C ATOM 987 CD1 LEU A 414 -1.224 -10.105 -17.335 1.00 0.00 C ATOM 988 CD2 LEU A 414 -2.024 -7.750 -17.086 1.00 0.00 C ATOM 0 H LEU A 414 -2.017 -8.924 -12.788 1.00 0.00 H new ATOM 0 HA LEU A 414 -3.214 -9.159 -15.400 1.00 0.00 H new ATOM 0 HB2 LEU A 414 -0.990 -8.010 -14.600 1.00 0.00 H new ATOM 0 HB3 LEU A 414 -0.283 -9.605 -14.755 1.00 0.00 H new ATOM 0 HG LEU A 414 0.016 -8.407 -16.866 1.00 0.00 H new ATOM 0 HD11 LEU A 414 -1.144 -9.962 -18.413 1.00 0.00 H new ATOM 0 HD12 LEU A 414 -0.479 -10.832 -17.009 1.00 0.00 H new ATOM 0 HD13 LEU A 414 -2.221 -10.472 -17.090 1.00 0.00 H new ATOM 0 HD21 LEU A 414 -1.943 -7.611 -18.164 1.00 0.00 H new ATOM 0 HD22 LEU A 414 -3.022 -8.112 -16.840 1.00 0.00 H new ATOM 0 HD23 LEU A 414 -1.849 -6.799 -16.584 1.00 0.00 H new ATOM 1000 N ALA A 415 -1.722 -11.829 -14.141 1.00 0.00 N ATOM 1001 CA ALA A 415 -1.636 -13.305 -14.316 1.00 0.00 C ATOM 1002 C ALA A 415 -3.026 -13.846 -14.647 1.00 0.00 C ATOM 1003 O ALA A 415 -3.206 -14.604 -15.580 1.00 0.00 O ATOM 1004 CB ALA A 415 -1.134 -13.948 -13.021 1.00 0.00 C ATOM 0 H ALA A 415 -1.238 -11.459 -13.323 1.00 0.00 H new ATOM 0 HA ALA A 415 -0.944 -13.540 -15.125 1.00 0.00 H new ATOM 0 HB1 ALA A 415 -1.072 -15.028 -13.151 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -0.147 -13.554 -12.778 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -1.825 -13.720 -12.210 1.00 0.00 H new ATOM 1010 N THR A 416 -4.015 -13.456 -13.889 1.00 0.00 N ATOM 1011 CA THR A 416 -5.397 -13.939 -14.156 1.00 0.00 C ATOM 1012 C THR A 416 -5.782 -13.601 -15.597 1.00 0.00 C ATOM 1013 O THR A 416 -6.194 -14.455 -16.355 1.00 0.00 O ATOM 1014 CB THR A 416 -6.368 -13.252 -13.195 1.00 0.00 C ATOM 1015 OG1 THR A 416 -5.901 -13.406 -11.863 1.00 0.00 O ATOM 1016 CG2 THR A 416 -7.755 -13.884 -13.328 1.00 0.00 C ATOM 0 H THR A 416 -3.924 -12.822 -13.095 1.00 0.00 H new ATOM 0 HA THR A 416 -5.443 -15.018 -14.010 1.00 0.00 H new ATOM 0 HB THR A 416 -6.431 -12.191 -13.438 1.00 0.00 H new ATOM 0 HG1 THR A 416 -6.521 -12.965 -11.246 1.00 0.00 H new ATOM 0 HG21 THR A 416 -8.446 -13.393 -12.642 1.00 0.00 H new ATOM 0 HG22 THR A 416 -8.113 -13.765 -14.351 1.00 0.00 H new ATOM 0 HG23 THR A 416 -7.696 -14.945 -13.086 1.00 0.00 H new ATOM 1024 N ILE A 417 -5.647 -12.361 -15.984 1.00 0.00 N ATOM 1025 CA ILE A 417 -6.001 -11.976 -17.379 1.00 0.00 C ATOM 1026 C ILE A 417 -5.392 -12.993 -18.343 1.00 0.00 C ATOM 1027 O ILE A 417 -5.990 -13.360 -19.336 1.00 0.00 O ATOM 1028 CB ILE A 417 -5.446 -10.584 -17.683 1.00 0.00 C ATOM 1029 CG1 ILE A 417 -5.948 -9.592 -16.630 1.00 0.00 C ATOM 1030 CG2 ILE A 417 -5.918 -10.139 -19.069 1.00 0.00 C ATOM 1031 CD1 ILE A 417 -7.459 -9.758 -16.449 1.00 0.00 C ATOM 0 H ILE A 417 -5.308 -11.600 -15.395 1.00 0.00 H new ATOM 0 HA ILE A 417 -7.085 -11.961 -17.495 1.00 0.00 H new ATOM 0 HB ILE A 417 -4.357 -10.615 -17.662 1.00 0.00 H new ATOM 0 HG12 ILE A 417 -5.437 -9.762 -15.682 1.00 0.00 H new ATOM 0 HG13 ILE A 417 -5.718 -8.572 -16.938 1.00 0.00 H new ATOM 0 HG21 ILE A 417 -5.523 -9.147 -19.287 1.00 0.00 H new ATOM 0 HG22 ILE A 417 -5.560 -10.845 -19.819 1.00 0.00 H new ATOM 0 HG23 ILE A 417 -7.007 -10.108 -19.090 1.00 0.00 H new ATOM 0 HD11 ILE A 417 -7.815 -9.052 -15.699 1.00 0.00 H new ATOM 0 HD12 ILE A 417 -7.962 -9.566 -17.397 1.00 0.00 H new ATOM 0 HD13 ILE A 417 -7.677 -10.775 -16.122 1.00 0.00 H new ATOM 1043 N ALA A 418 -4.208 -13.459 -18.053 1.00 0.00 N ATOM 1044 CA ALA A 418 -3.561 -14.459 -18.944 1.00 0.00 C ATOM 1045 C ALA A 418 -4.403 -15.735 -18.957 1.00 0.00 C ATOM 1046 O ALA A 418 -4.361 -16.512 -19.889 1.00 0.00 O ATOM 1047 CB ALA A 418 -2.157 -14.776 -18.423 1.00 0.00 C ATOM 0 H ALA A 418 -3.661 -13.189 -17.236 1.00 0.00 H new ATOM 0 HA ALA A 418 -3.487 -14.058 -19.955 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -1.683 -15.509 -19.076 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -1.560 -13.864 -18.408 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -2.226 -15.181 -17.413 1.00 0.00 H new ATOM 1053 N GLN A 419 -5.172 -15.955 -17.925 1.00 0.00 N ATOM 1054 CA GLN A 419 -6.023 -17.177 -17.875 1.00 0.00 C ATOM 1055 C GLN A 419 -6.969 -17.179 -19.075 1.00 0.00 C ATOM 1056 O GLN A 419 -7.243 -18.207 -19.662 1.00 0.00 O ATOM 1057 CB GLN A 419 -6.838 -17.177 -16.581 1.00 0.00 C ATOM 1058 CG GLN A 419 -5.895 -17.315 -15.385 1.00 0.00 C ATOM 1059 CD GLN A 419 -6.710 -17.314 -14.090 1.00 0.00 C ATOM 1060 OE1 GLN A 419 -7.883 -16.997 -14.097 1.00 0.00 O ATOM 1061 NE2 GLN A 419 -6.135 -17.657 -12.969 1.00 0.00 N ATOM 0 H GLN A 419 -5.247 -15.341 -17.114 1.00 0.00 H new ATOM 0 HA GLN A 419 -5.393 -18.066 -17.905 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -7.412 -16.254 -16.500 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -7.554 -17.999 -16.590 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -5.321 -18.238 -15.465 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -5.178 -16.494 -15.377 1.00 0.00 H new ATOM 0 HE21 GLN A 419 -5.150 -17.923 -12.961 1.00 0.00 H new ATOM 0 HE22 GLN A 419 -6.670 -17.659 -12.101 1.00 0.00 H new ATOM 1070 N ALA A 420 -7.467 -16.032 -19.447 1.00 0.00 N ATOM 1071 CA ALA A 420 -8.392 -15.964 -20.612 1.00 0.00 C ATOM 1072 C ALA A 420 -7.582 -16.072 -21.904 1.00 0.00 C ATOM 1073 O ALA A 420 -8.113 -16.346 -22.962 1.00 0.00 O ATOM 1074 CB ALA A 420 -9.145 -14.631 -20.587 1.00 0.00 C ATOM 0 H ALA A 420 -7.273 -15.139 -18.994 1.00 0.00 H new ATOM 0 HA ALA A 420 -9.109 -16.784 -20.561 1.00 0.00 H new ATOM 0 HB1 ALA A 420 -9.823 -14.580 -21.439 1.00 0.00 H new ATOM 0 HB2 ALA A 420 -9.718 -14.554 -19.663 1.00 0.00 H new ATOM 0 HB3 ALA A 420 -8.431 -13.809 -20.641 1.00 0.00 H new ATOM 1080 N GLN A 421 -6.297 -15.859 -21.826 1.00 0.00 N ATOM 1081 CA GLN A 421 -5.449 -15.951 -23.046 1.00 0.00 C ATOM 1082 C GLN A 421 -5.672 -17.308 -23.714 1.00 0.00 C ATOM 1083 O GLN A 421 -5.722 -17.415 -24.924 1.00 0.00 O ATOM 1084 CB GLN A 421 -3.977 -15.810 -22.652 1.00 0.00 C ATOM 1085 CG GLN A 421 -3.119 -15.705 -23.914 1.00 0.00 C ATOM 1086 CD GLN A 421 -1.653 -15.512 -23.518 1.00 0.00 C ATOM 1087 OE1 GLN A 421 -1.346 -15.322 -22.357 1.00 0.00 O ATOM 1088 NE2 GLN A 421 -0.729 -15.553 -24.438 1.00 0.00 N ATOM 0 H GLN A 421 -5.798 -15.625 -20.968 1.00 0.00 H new ATOM 0 HA GLN A 421 -5.716 -15.155 -23.741 1.00 0.00 H new ATOM 0 HB2 GLN A 421 -3.839 -14.925 -22.031 1.00 0.00 H new ATOM 0 HB3 GLN A 421 -3.665 -16.669 -22.057 1.00 0.00 H new ATOM 0 HG2 GLN A 421 -3.228 -16.606 -24.517 1.00 0.00 H new ATOM 0 HG3 GLN A 421 -3.455 -14.868 -24.527 1.00 0.00 H new ATOM 0 HE21 GLN A 421 -0.986 -15.712 -25.412 1.00 0.00 H new ATOM 0 HE22 GLN A 421 0.250 -15.426 -24.183 1.00 0.00 H new ATOM 1097 N GLU A 422 -5.809 -18.347 -22.936 1.00 0.00 N ATOM 1098 CA GLU A 422 -6.032 -19.695 -23.526 1.00 0.00 C ATOM 1099 C GLU A 422 -7.283 -19.661 -24.406 1.00 0.00 C ATOM 1100 O GLU A 422 -7.323 -20.248 -25.470 1.00 0.00 O ATOM 1101 CB GLU A 422 -6.224 -20.719 -22.405 1.00 0.00 C ATOM 1102 CG GLU A 422 -4.930 -20.840 -21.597 1.00 0.00 C ATOM 1103 CD GLU A 422 -5.090 -21.935 -20.540 1.00 0.00 C ATOM 1104 OE1 GLU A 422 -6.199 -22.414 -20.375 1.00 0.00 O ATOM 1105 OE2 GLU A 422 -4.099 -22.276 -19.914 1.00 0.00 O ATOM 0 H GLU A 422 -5.776 -18.319 -21.917 1.00 0.00 H new ATOM 0 HA GLU A 422 -5.169 -19.977 -24.129 1.00 0.00 H new ATOM 0 HB2 GLU A 422 -7.044 -20.413 -21.755 1.00 0.00 H new ATOM 0 HB3 GLU A 422 -6.495 -21.688 -22.825 1.00 0.00 H new ATOM 0 HG2 GLU A 422 -4.096 -21.077 -22.258 1.00 0.00 H new ATOM 0 HG3 GLU A 422 -4.697 -19.889 -21.118 1.00 0.00 H new ATOM 1112 N GLU A 423 -8.307 -18.977 -23.970 1.00 0.00 N ATOM 1113 CA GLU A 423 -9.554 -18.904 -24.782 1.00 0.00 C ATOM 1114 C GLU A 423 -9.273 -18.140 -26.077 1.00 0.00 C ATOM 1115 O GLU A 423 -9.822 -18.440 -27.119 1.00 0.00 O ATOM 1116 CB GLU A 423 -10.638 -18.176 -23.986 1.00 0.00 C ATOM 1117 CG GLU A 423 -11.956 -18.220 -24.761 1.00 0.00 C ATOM 1118 CD GLU A 423 -13.013 -17.399 -24.019 1.00 0.00 C ATOM 1119 OE1 GLU A 423 -12.681 -16.835 -22.990 1.00 0.00 O ATOM 1120 OE2 GLU A 423 -14.136 -17.351 -24.492 1.00 0.00 O ATOM 0 H GLU A 423 -8.333 -18.466 -23.087 1.00 0.00 H new ATOM 0 HA GLU A 423 -9.893 -19.912 -25.020 1.00 0.00 H new ATOM 0 HB2 GLU A 423 -10.762 -18.643 -23.009 1.00 0.00 H new ATOM 0 HB3 GLU A 423 -10.342 -17.142 -23.809 1.00 0.00 H new ATOM 0 HG2 GLU A 423 -11.812 -17.824 -25.766 1.00 0.00 H new ATOM 0 HG3 GLU A 423 -12.292 -19.251 -24.870 1.00 0.00 H new ATOM 1127 N SER A 424 -8.421 -17.153 -26.021 1.00 0.00 N ATOM 1128 CA SER A 424 -8.106 -16.371 -27.250 1.00 0.00 C ATOM 1129 C SER A 424 -7.009 -17.088 -28.042 1.00 0.00 C ATOM 1130 O SER A 424 -6.301 -17.926 -27.520 1.00 0.00 O ATOM 1131 CB SER A 424 -7.619 -14.976 -26.854 1.00 0.00 C ATOM 1132 OG SER A 424 -8.635 -14.309 -26.119 1.00 0.00 O ATOM 0 H SER A 424 -7.930 -16.855 -25.178 1.00 0.00 H new ATOM 0 HA SER A 424 -9.001 -16.283 -27.866 1.00 0.00 H new ATOM 0 HB2 SER A 424 -6.712 -15.053 -26.254 1.00 0.00 H new ATOM 0 HB3 SER A 424 -7.364 -14.402 -27.745 1.00 0.00 H new ATOM 0 HG SER A 424 -8.322 -13.416 -25.864 1.00 0.00 H new ATOM 1138 N LEU A 425 -6.866 -16.767 -29.298 1.00 0.00 N ATOM 1139 CA LEU A 425 -5.817 -17.432 -30.122 1.00 0.00 C ATOM 1140 C LEU A 425 -4.529 -16.609 -30.070 1.00 0.00 C ATOM 1141 O LEU A 425 -4.555 -15.395 -30.081 1.00 0.00 O ATOM 1142 CB LEU A 425 -6.298 -17.537 -31.570 1.00 0.00 C ATOM 1143 CG LEU A 425 -7.648 -18.255 -31.607 1.00 0.00 C ATOM 1144 CD1 LEU A 425 -8.071 -18.473 -33.061 1.00 0.00 C ATOM 1145 CD2 LEU A 425 -7.526 -19.609 -30.904 1.00 0.00 C ATOM 0 H LEU A 425 -7.430 -16.073 -29.790 1.00 0.00 H new ATOM 0 HA LEU A 425 -5.625 -18.431 -29.729 1.00 0.00 H new ATOM 0 HB2 LEU A 425 -6.391 -16.543 -32.007 1.00 0.00 H new ATOM 0 HB3 LEU A 425 -5.568 -18.081 -32.169 1.00 0.00 H new ATOM 0 HG LEU A 425 -8.396 -17.647 -31.098 1.00 0.00 H new ATOM 0 HD11 LEU A 425 -9.033 -18.985 -33.087 1.00 0.00 H new ATOM 0 HD12 LEU A 425 -8.159 -17.509 -33.563 1.00 0.00 H new ATOM 0 HD13 LEU A 425 -7.323 -19.081 -33.570 1.00 0.00 H new ATOM 0 HD21 LEU A 425 -8.488 -20.121 -30.930 1.00 0.00 H new ATOM 0 HD22 LEU A 425 -6.778 -20.217 -31.413 1.00 0.00 H new ATOM 0 HD23 LEU A 425 -7.225 -19.455 -29.868 1.00 0.00 H new ATOM 1157 N GLY A 426 -3.400 -17.261 -30.013 1.00 0.00 N ATOM 1158 CA GLY A 426 -2.111 -16.516 -29.960 1.00 0.00 C ATOM 1159 C GLY A 426 -1.782 -16.168 -28.507 1.00 0.00 C ATOM 1160 O GLY A 426 -2.027 -15.069 -28.051 1.00 0.00 O ATOM 0 H GLY A 426 -3.315 -18.277 -30.001 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -1.312 -17.120 -30.390 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -2.180 -15.606 -30.556 1.00 0.00 H new TER 1164 GLY A 426