USER MOD reduce.3.24.130724 H: found=0, std=0, add=729, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 732 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 316 LYS NZ :NH3+ -163:sc= 1.32 (180deg=0) USER MOD Set 1.2: A 381 GLN : amide:sc= 0.308 K(o=1.6,f=-8.9!) USER MOD Set 2.1: A 367 THR OG1 : rot -103:sc= 0.201 USER MOD Set 2.2: A 379 SER OG : rot 180:sc= 0.15 USER MOD Set 3.1: A 352 SER OG : rot -116:sc= 1.2 USER MOD Set 3.2: A 354 THR OG1 : rot 180:sc= 1.02 USER MOD Set 4.1: A 333 THR OG1 : rot -53:sc= 2.3 USER MOD Set 4.2: A 336 CYS SG : rot 22:sc= 0.801 USER MOD Set 4.3: A 338 MET CE :methyl 142:sc= -0.281 (180deg=-0.919) USER MOD Single : A 311 SER OG : rot 30:sc= 0.102 USER MOD Single : A 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 344 THR OG1 : rot 75:sc= 1.18 USER MOD Single : A 345 LYS NZ :NH3+ -164:sc= 0.211 (180deg=-0.531) USER MOD Single : A 349 GLN : amide:sc= 0.702 K(o=0.7,f=-7.5!) USER MOD Single : A 355 ASN : amide:sc= -1.31 X(o=-1.3,f=-1.3) USER MOD Single : A 357 LYS NZ :NH3+ 171:sc=-0.00168 (180deg=-0.0909) USER MOD Single : A 362 SER OG : rot 180:sc= 0 USER MOD Single : A 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 365 SER OG : rot 180:sc= -0.18 USER MOD Single : A 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 374 GLN : amide:sc= -0.59 K(o=-0.59,f=0) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 TYR OH : rot 3:sc= 1.26 USER MOD Single : A 382 THR OG1 : rot 180:sc= 0.244 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0.0431 USER MOD Single : A 387 GLN : amide:sc= -1.45 K(o=-1.5,f=-2.9!) USER MOD Single : A 390 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 395 TYR OH : rot -139:sc= 0.227 USER MOD Single : B 377 ASN : amide:sc= -0.546 K(o=-0.55,f=-4.3!) USER MOD Single : B 380 TYR OH : rot -167:sc= 1.78 USER MOD Single : B 381 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 26 N SER A 311 2.803 6.786 9.197 1.00 0.71 N ATOM 27 CA SER A 311 3.227 5.496 9.718 1.00 0.41 C ATOM 28 C SER A 311 4.049 4.741 8.680 1.00 0.34 C ATOM 29 O SER A 311 3.619 4.576 7.538 1.00 0.47 O ATOM 30 CB SER A 311 2.009 4.670 10.131 1.00 0.59 C ATOM 31 OG SER A 311 1.225 5.363 11.091 1.00 1.06 O ATOM 0 HA SER A 311 3.853 5.666 10.594 1.00 0.41 H new ATOM 0 HB2 SER A 311 1.402 4.447 9.253 1.00 0.59 H new ATOM 0 HB3 SER A 311 2.336 3.716 10.544 1.00 0.59 H new ATOM 0 HG SER A 311 1.313 6.329 10.950 1.00 1.06 H new ATOM 37 N PHE A 312 5.234 4.297 9.076 1.00 0.29 N ATOM 38 CA PHE A 312 6.106 3.551 8.183 1.00 0.27 C ATOM 39 C PHE A 312 6.107 2.074 8.544 1.00 0.26 C ATOM 40 O PHE A 312 6.399 1.700 9.679 1.00 0.34 O ATOM 41 CB PHE A 312 7.532 4.102 8.241 1.00 0.31 C ATOM 42 CG PHE A 312 7.670 5.478 7.658 1.00 0.34 C ATOM 43 CD1 PHE A 312 7.946 5.642 6.311 1.00 0.33 C ATOM 44 CD2 PHE A 312 7.523 6.606 8.450 1.00 0.45 C ATOM 45 CE1 PHE A 312 8.073 6.903 5.765 1.00 0.38 C ATOM 46 CE2 PHE A 312 7.650 7.872 7.908 1.00 0.52 C ATOM 47 CZ PHE A 312 7.924 8.019 6.562 1.00 0.47 C ATOM 0 H PHE A 312 5.613 4.442 10.012 1.00 0.29 H new ATOM 0 HA PHE A 312 5.726 3.663 7.168 1.00 0.27 H new ATOM 0 HB2 PHE A 312 7.863 4.122 9.279 1.00 0.31 H new ATOM 0 HB3 PHE A 312 8.197 3.422 7.708 1.00 0.31 H new ATOM 0 HD1 PHE A 312 8.063 4.773 5.680 1.00 0.33 H new ATOM 0 HD2 PHE A 312 7.307 6.495 9.502 1.00 0.45 H new ATOM 0 HE1 PHE A 312 8.289 7.016 4.713 1.00 0.38 H new ATOM 0 HE2 PHE A 312 7.535 8.744 8.535 1.00 0.52 H new ATOM 0 HZ PHE A 312 8.021 9.006 6.134 1.00 0.47 H new ATOM 57 N PHE A 313 5.764 1.239 7.578 1.00 0.24 N ATOM 58 CA PHE A 313 5.763 -0.203 7.777 1.00 0.26 C ATOM 59 C PHE A 313 6.924 -0.837 7.026 1.00 0.26 C ATOM 60 O PHE A 313 7.201 -0.475 5.881 1.00 0.26 O ATOM 61 CB PHE A 313 4.445 -0.815 7.295 1.00 0.28 C ATOM 62 CG PHE A 313 3.241 -0.352 8.065 1.00 0.30 C ATOM 63 CD1 PHE A 313 2.552 0.787 7.680 1.00 0.32 C ATOM 64 CD2 PHE A 313 2.795 -1.061 9.168 1.00 0.34 C ATOM 65 CE1 PHE A 313 1.441 1.211 8.383 1.00 0.37 C ATOM 66 CE2 PHE A 313 1.685 -0.641 9.875 1.00 0.40 C ATOM 67 CZ PHE A 313 1.006 0.497 9.482 1.00 0.41 C ATOM 0 H PHE A 313 5.481 1.535 6.644 1.00 0.24 H new ATOM 0 HA PHE A 313 5.872 -0.399 8.844 1.00 0.26 H new ATOM 0 HB2 PHE A 313 4.306 -0.571 6.242 1.00 0.28 H new ATOM 0 HB3 PHE A 313 4.513 -1.901 7.364 1.00 0.28 H new ATOM 0 HD1 PHE A 313 2.887 1.349 6.821 1.00 0.32 H new ATOM 0 HD2 PHE A 313 3.321 -1.952 9.479 1.00 0.34 H new ATOM 0 HE1 PHE A 313 0.913 2.101 8.073 1.00 0.37 H new ATOM 0 HE2 PHE A 313 1.348 -1.202 10.734 1.00 0.40 H new ATOM 0 HZ PHE A 313 0.138 0.827 10.033 1.00 0.41 H new ATOM 77 N LEU A 314 7.605 -1.770 7.673 1.00 0.36 N ATOM 78 CA LEU A 314 8.697 -2.488 7.036 1.00 0.38 C ATOM 79 C LEU A 314 8.143 -3.641 6.211 1.00 0.37 C ATOM 80 O LEU A 314 7.782 -4.694 6.746 1.00 0.50 O ATOM 81 CB LEU A 314 9.693 -3.011 8.075 1.00 0.51 C ATOM 82 CG LEU A 314 10.897 -3.762 7.496 1.00 0.57 C ATOM 83 CD1 LEU A 314 11.729 -2.842 6.614 1.00 0.54 C ATOM 84 CD2 LEU A 314 11.748 -4.346 8.612 1.00 0.72 C ATOM 0 H LEU A 314 7.421 -2.047 8.637 1.00 0.36 H new ATOM 0 HA LEU A 314 9.227 -1.797 6.380 1.00 0.38 H new ATOM 0 HB2 LEU A 314 10.058 -2.169 8.663 1.00 0.51 H new ATOM 0 HB3 LEU A 314 9.165 -3.674 8.761 1.00 0.51 H new ATOM 0 HG LEU A 314 10.526 -4.582 6.881 1.00 0.57 H new ATOM 0 HD11 LEU A 314 12.579 -3.394 6.212 1.00 0.54 H new ATOM 0 HD12 LEU A 314 11.115 -2.473 5.792 1.00 0.54 H new ATOM 0 HD13 LEU A 314 12.089 -2.000 7.205 1.00 0.54 H new ATOM 0 HD21 LEU A 314 12.598 -4.876 8.182 1.00 0.72 H new ATOM 0 HD22 LEU A 314 12.108 -3.542 9.254 1.00 0.72 H new ATOM 0 HD23 LEU A 314 11.149 -5.040 9.201 1.00 0.72 H new ATOM 96 N VAL A 315 8.053 -3.424 4.912 1.00 0.26 N ATOM 97 CA VAL A 315 7.522 -4.425 4.005 1.00 0.26 C ATOM 98 C VAL A 315 8.621 -4.956 3.097 1.00 0.24 C ATOM 99 O VAL A 315 9.698 -4.367 3.003 1.00 0.27 O ATOM 100 CB VAL A 315 6.368 -3.858 3.148 1.00 0.26 C ATOM 101 CG1 VAL A 315 5.201 -3.440 4.030 1.00 0.30 C ATOM 102 CG2 VAL A 315 6.844 -2.687 2.299 1.00 0.23 C ATOM 0 H VAL A 315 8.343 -2.557 4.459 1.00 0.26 H new ATOM 0 HA VAL A 315 7.128 -5.240 4.612 1.00 0.26 H new ATOM 0 HB VAL A 315 6.028 -4.646 2.476 1.00 0.26 H new ATOM 0 HG11 VAL A 315 4.399 -3.043 3.408 1.00 0.30 H new ATOM 0 HG12 VAL A 315 4.836 -4.304 4.585 1.00 0.30 H new ATOM 0 HG13 VAL A 315 5.531 -2.672 4.730 1.00 0.30 H new ATOM 0 HG21 VAL A 315 6.013 -2.306 1.705 1.00 0.23 H new ATOM 0 HG22 VAL A 315 7.219 -1.896 2.948 1.00 0.23 H new ATOM 0 HG23 VAL A 315 7.642 -3.020 1.635 1.00 0.23 H new ATOM 112 N LYS A 316 8.357 -6.078 2.450 1.00 0.25 N ATOM 113 CA LYS A 316 9.314 -6.672 1.533 1.00 0.28 C ATOM 114 C LYS A 316 8.741 -6.719 0.122 1.00 0.28 C ATOM 115 O LYS A 316 7.841 -7.509 -0.165 1.00 0.28 O ATOM 116 CB LYS A 316 9.676 -8.081 1.997 1.00 0.34 C ATOM 117 CG LYS A 316 10.272 -8.133 3.395 1.00 0.44 C ATOM 118 CD LYS A 316 10.446 -9.567 3.866 1.00 0.55 C ATOM 119 CE LYS A 316 11.409 -10.334 2.977 1.00 0.67 C ATOM 120 NZ LYS A 316 11.343 -11.795 3.227 1.00 1.44 N ATOM 0 H LYS A 316 7.484 -6.598 2.543 1.00 0.25 H new ATOM 0 HA LYS A 316 10.214 -6.058 1.523 1.00 0.28 H new ATOM 0 HB2 LYS A 316 8.781 -8.703 1.970 1.00 0.34 H new ATOM 0 HB3 LYS A 316 10.387 -8.514 1.293 1.00 0.34 H new ATOM 0 HG2 LYS A 316 11.237 -7.626 3.401 1.00 0.44 H new ATOM 0 HG3 LYS A 316 9.626 -7.596 4.089 1.00 0.44 H new ATOM 0 HD2 LYS A 316 10.815 -9.572 4.892 1.00 0.55 H new ATOM 0 HD3 LYS A 316 9.478 -10.068 3.873 1.00 0.55 H new ATOM 0 HE2 LYS A 316 11.177 -10.133 1.931 1.00 0.67 H new ATOM 0 HE3 LYS A 316 12.425 -9.981 3.152 1.00 0.67 H new ATOM 0 HZ1 LYS A 316 12.188 -12.253 2.831 1.00 1.44 H new ATOM 0 HZ2 LYS A 316 11.301 -11.970 4.251 1.00 1.44 H new ATOM 0 HZ3 LYS A 316 10.493 -12.187 2.774 1.00 1.44 H new ATOM 134 N GLU A 317 9.256 -5.867 -0.751 1.00 0.32 N ATOM 135 CA GLU A 317 8.766 -5.783 -2.119 1.00 0.37 C ATOM 136 C GLU A 317 9.367 -6.885 -2.976 1.00 0.45 C ATOM 137 O GLU A 317 10.582 -6.931 -3.188 1.00 0.48 O ATOM 138 CB GLU A 317 9.108 -4.427 -2.738 1.00 0.39 C ATOM 139 CG GLU A 317 8.594 -3.239 -1.946 1.00 0.41 C ATOM 140 CD GLU A 317 8.949 -1.918 -2.595 1.00 0.49 C ATOM 141 OE1 GLU A 317 10.100 -1.766 -3.051 1.00 0.70 O ATOM 142 OE2 GLU A 317 8.091 -1.015 -2.630 1.00 0.61 O ATOM 0 H GLU A 317 10.016 -5.222 -0.536 1.00 0.32 H new ATOM 0 HA GLU A 317 7.683 -5.901 -2.086 1.00 0.37 H new ATOM 0 HB2 GLU A 317 10.191 -4.346 -2.834 1.00 0.39 H new ATOM 0 HB3 GLU A 317 8.695 -4.385 -3.746 1.00 0.39 H new ATOM 0 HG2 GLU A 317 7.511 -3.313 -1.846 1.00 0.41 H new ATOM 0 HG3 GLU A 317 9.010 -3.270 -0.939 1.00 0.41 H new ATOM 275 N LEU A 325 13.266 -10.316 -1.849 1.00 0.61 N ATOM 276 CA LEU A 325 12.334 -9.223 -1.640 1.00 0.49 C ATOM 277 C LEU A 325 13.058 -8.053 -0.988 1.00 0.45 C ATOM 278 O LEU A 325 13.810 -8.233 -0.030 1.00 0.55 O ATOM 279 CB LEU A 325 11.152 -9.669 -0.769 1.00 0.47 C ATOM 280 CG LEU A 325 10.262 -10.769 -1.365 1.00 0.53 C ATOM 281 CD1 LEU A 325 10.912 -12.138 -1.238 1.00 0.69 C ATOM 282 CD2 LEU A 325 8.898 -10.768 -0.699 1.00 0.56 C ATOM 0 HA LEU A 325 11.940 -8.911 -2.607 1.00 0.49 H new ATOM 0 HB2 LEU A 325 11.541 -10.020 0.187 1.00 0.47 H new ATOM 0 HB3 LEU A 325 10.530 -8.798 -0.559 1.00 0.47 H new ATOM 0 HG LEU A 325 10.136 -10.556 -2.426 1.00 0.53 H new ATOM 0 HD11 LEU A 325 10.256 -12.894 -1.670 1.00 0.69 H new ATOM 0 HD12 LEU A 325 11.865 -12.139 -1.768 1.00 0.69 H new ATOM 0 HD13 LEU A 325 11.082 -12.364 -0.185 1.00 0.69 H new ATOM 0 HD21 LEU A 325 8.280 -11.554 -1.134 1.00 0.56 H new ATOM 0 HD22 LEU A 325 9.015 -10.948 0.370 1.00 0.56 H new ATOM 0 HD23 LEU A 325 8.418 -9.802 -0.854 1.00 0.56 H new ATOM 294 N VAL A 326 12.835 -6.859 -1.511 1.00 0.40 N ATOM 295 CA VAL A 326 13.550 -5.678 -1.050 1.00 0.38 C ATOM 296 C VAL A 326 12.853 -5.050 0.155 1.00 0.32 C ATOM 297 O VAL A 326 11.649 -4.791 0.113 1.00 0.29 O ATOM 298 CB VAL A 326 13.663 -4.624 -2.171 1.00 0.42 C ATOM 299 CG1 VAL A 326 14.559 -3.472 -1.742 1.00 0.45 C ATOM 300 CG2 VAL A 326 14.177 -5.258 -3.454 1.00 0.51 C ATOM 0 H VAL A 326 12.163 -6.680 -2.257 1.00 0.40 H new ATOM 0 HA VAL A 326 14.549 -6.001 -0.759 1.00 0.38 H new ATOM 0 HB VAL A 326 12.667 -4.224 -2.363 1.00 0.42 H new ATOM 0 HG11 VAL A 326 14.624 -2.741 -2.548 1.00 0.45 H new ATOM 0 HG12 VAL A 326 14.141 -2.997 -0.855 1.00 0.45 H new ATOM 0 HG13 VAL A 326 15.555 -3.851 -1.515 1.00 0.45 H new ATOM 0 HG21 VAL A 326 14.249 -4.498 -4.232 1.00 0.51 H new ATOM 0 HG22 VAL A 326 15.162 -5.691 -3.277 1.00 0.51 H new ATOM 0 HG23 VAL A 326 13.489 -6.040 -3.774 1.00 0.51 H new ATOM 310 N PRO A 327 13.598 -4.820 1.250 1.00 0.33 N ATOM 311 CA PRO A 327 13.079 -4.114 2.426 1.00 0.30 C ATOM 312 C PRO A 327 12.663 -2.690 2.077 1.00 0.25 C ATOM 313 O PRO A 327 13.469 -1.896 1.589 1.00 0.32 O ATOM 314 CB PRO A 327 14.262 -4.105 3.402 1.00 0.39 C ATOM 315 CG PRO A 327 15.176 -5.179 2.921 1.00 0.46 C ATOM 316 CD PRO A 327 14.999 -5.233 1.431 1.00 0.42 C ATOM 0 HA PRO A 327 12.190 -4.592 2.837 1.00 0.30 H new ATOM 0 HB2 PRO A 327 14.761 -3.136 3.406 1.00 0.39 H new ATOM 0 HB3 PRO A 327 13.931 -4.298 4.423 1.00 0.39 H new ATOM 0 HG2 PRO A 327 16.211 -4.958 3.184 1.00 0.46 H new ATOM 0 HG3 PRO A 327 14.928 -6.137 3.379 1.00 0.46 H new ATOM 0 HD2 PRO A 327 15.687 -4.561 0.918 1.00 0.42 H new ATOM 0 HD3 PRO A 327 15.179 -6.234 1.039 1.00 0.42 H new ATOM 324 N ARG A 328 11.405 -2.373 2.317 1.00 0.21 N ATOM 325 CA ARG A 328 10.860 -1.084 1.938 1.00 0.23 C ATOM 326 C ARG A 328 10.129 -0.440 3.107 1.00 0.20 C ATOM 327 O ARG A 328 9.444 -1.120 3.871 1.00 0.23 O ATOM 328 CB ARG A 328 9.900 -1.266 0.760 1.00 0.32 C ATOM 329 CG ARG A 328 9.410 0.035 0.144 1.00 0.50 C ATOM 330 CD ARG A 328 10.553 0.812 -0.483 1.00 0.56 C ATOM 331 NE ARG A 328 11.269 0.037 -1.495 1.00 0.47 N ATOM 332 CZ ARG A 328 12.589 0.073 -1.651 1.00 0.58 C ATOM 333 NH1 ARG A 328 13.327 0.768 -0.803 1.00 0.78 N ATOM 334 NH2 ARG A 328 13.172 -0.597 -2.636 1.00 0.65 N ATOM 0 H ARG A 328 10.738 -2.994 2.775 1.00 0.21 H new ATOM 0 HA ARG A 328 11.681 -0.428 1.647 1.00 0.23 H new ATOM 0 HB2 ARG A 328 10.397 -1.855 -0.011 1.00 0.32 H new ATOM 0 HB3 ARG A 328 9.038 -1.843 1.095 1.00 0.32 H new ATOM 0 HG2 ARG A 328 8.655 -0.180 -0.612 1.00 0.50 H new ATOM 0 HG3 ARG A 328 8.930 0.644 0.910 1.00 0.50 H new ATOM 0 HD2 ARG A 328 10.163 1.723 -0.937 1.00 0.56 H new ATOM 0 HD3 ARG A 328 11.251 1.118 0.297 1.00 0.56 H new ATOM 0 HE ARG A 328 10.726 -0.564 -2.115 1.00 0.47 H new ATOM 0 HH11 ARG A 328 12.883 1.272 -0.035 1.00 0.78 H new ATOM 0 HH12 ARG A 328 14.340 0.800 -0.916 1.00 0.78 H new ATOM 0 HH21 ARG A 328 12.607 -1.147 -3.283 1.00 0.65 H new ATOM 0 HH22 ARG A 328 14.185 -0.562 -2.746 1.00 0.65 H new ATOM 348 N LEU A 329 10.286 0.867 3.248 1.00 0.18 N ATOM 349 CA LEU A 329 9.534 1.621 4.235 1.00 0.20 C ATOM 350 C LEU A 329 8.245 2.128 3.611 1.00 0.19 C ATOM 351 O LEU A 329 8.249 3.104 2.860 1.00 0.24 O ATOM 352 CB LEU A 329 10.353 2.798 4.768 1.00 0.25 C ATOM 353 CG LEU A 329 11.537 2.424 5.659 1.00 0.31 C ATOM 354 CD1 LEU A 329 12.310 3.673 6.047 1.00 0.37 C ATOM 355 CD2 LEU A 329 11.054 1.686 6.899 1.00 0.36 C ATOM 0 H LEU A 329 10.929 1.427 2.689 1.00 0.18 H new ATOM 0 HA LEU A 329 9.303 0.962 5.072 1.00 0.20 H new ATOM 0 HB2 LEU A 329 10.726 3.373 3.920 1.00 0.25 H new ATOM 0 HB3 LEU A 329 9.690 3.455 5.331 1.00 0.25 H new ATOM 0 HG LEU A 329 12.201 1.761 5.104 1.00 0.31 H new ATOM 0 HD11 LEU A 329 13.152 3.397 6.682 1.00 0.37 H new ATOM 0 HD12 LEU A 329 12.680 4.166 5.148 1.00 0.37 H new ATOM 0 HD13 LEU A 329 11.654 4.353 6.590 1.00 0.37 H new ATOM 0 HD21 LEU A 329 11.909 1.426 7.524 1.00 0.36 H new ATOM 0 HD22 LEU A 329 10.374 2.326 7.462 1.00 0.36 H new ATOM 0 HD23 LEU A 329 10.533 0.776 6.601 1.00 0.36 H new ATOM 367 N LEU A 330 7.153 1.443 3.889 1.00 0.17 N ATOM 368 CA LEU A 330 5.865 1.833 3.350 1.00 0.17 C ATOM 369 C LEU A 330 5.256 2.925 4.218 1.00 0.18 C ATOM 370 O LEU A 330 4.744 2.655 5.306 1.00 0.24 O ATOM 371 CB LEU A 330 4.929 0.624 3.262 1.00 0.22 C ATOM 372 CG LEU A 330 3.642 0.856 2.472 1.00 0.26 C ATOM 373 CD1 LEU A 330 3.962 1.242 1.035 1.00 0.57 C ATOM 374 CD2 LEU A 330 2.767 -0.387 2.505 1.00 0.49 C ATOM 0 H LEU A 330 7.132 0.615 4.484 1.00 0.17 H new ATOM 0 HA LEU A 330 6.005 2.222 2.341 1.00 0.17 H new ATOM 0 HB2 LEU A 330 5.472 -0.204 2.806 1.00 0.22 H new ATOM 0 HB3 LEU A 330 4.665 0.314 4.273 1.00 0.22 H new ATOM 0 HG LEU A 330 3.095 1.676 2.937 1.00 0.26 H new ATOM 0 HD11 LEU A 330 3.034 1.404 0.486 1.00 0.57 H new ATOM 0 HD12 LEU A 330 4.552 2.158 1.027 1.00 0.57 H new ATOM 0 HD13 LEU A 330 4.529 0.441 0.561 1.00 0.57 H new ATOM 0 HD21 LEU A 330 1.854 -0.205 1.938 1.00 0.49 H new ATOM 0 HD22 LEU A 330 3.308 -1.224 2.064 1.00 0.49 H new ATOM 0 HD23 LEU A 330 2.511 -0.624 3.538 1.00 0.49 H new ATOM 386 N GLY A 331 5.348 4.158 3.745 1.00 0.18 N ATOM 387 CA GLY A 331 4.847 5.282 4.503 1.00 0.22 C ATOM 388 C GLY A 331 3.418 5.611 4.148 1.00 0.22 C ATOM 389 O GLY A 331 3.142 6.135 3.065 1.00 0.29 O ATOM 0 H GLY A 331 5.763 4.400 2.845 1.00 0.18 H new ATOM 0 HA2 GLY A 331 4.914 5.060 5.568 1.00 0.22 H new ATOM 0 HA3 GLY A 331 5.476 6.153 4.319 1.00 0.22 H new ATOM 393 N ILE A 332 2.509 5.299 5.055 1.00 0.22 N ATOM 394 CA ILE A 332 1.100 5.574 4.846 1.00 0.22 C ATOM 395 C ILE A 332 0.732 6.899 5.504 1.00 0.24 C ATOM 396 O ILE A 332 0.747 7.022 6.735 1.00 0.36 O ATOM 397 CB ILE A 332 0.206 4.453 5.420 1.00 0.26 C ATOM 398 CG1 ILE A 332 0.717 3.073 4.990 1.00 0.27 C ATOM 399 CG2 ILE A 332 -1.236 4.643 4.968 1.00 0.28 C ATOM 400 CD1 ILE A 332 0.691 2.846 3.493 1.00 0.27 C ATOM 0 H ILE A 332 2.724 4.853 5.947 1.00 0.22 H new ATOM 0 HA ILE A 332 0.929 5.626 3.771 1.00 0.22 H new ATOM 0 HB ILE A 332 0.246 4.510 6.508 1.00 0.26 H new ATOM 0 HG12 ILE A 332 1.739 2.947 5.349 1.00 0.27 H new ATOM 0 HG13 ILE A 332 0.113 2.306 5.474 1.00 0.27 H new ATOM 0 HG21 ILE A 332 -1.855 3.846 5.380 1.00 0.28 H new ATOM 0 HG22 ILE A 332 -1.604 5.607 5.320 1.00 0.28 H new ATOM 0 HG23 ILE A 332 -1.283 4.613 3.879 1.00 0.28 H new ATOM 0 HD11 ILE A 332 1.067 1.848 3.270 1.00 0.27 H new ATOM 0 HD12 ILE A 332 -0.332 2.938 3.129 1.00 0.27 H new ATOM 0 HD13 ILE A 332 1.319 3.589 3.001 1.00 0.27 H new ATOM 412 N THR A 333 0.429 7.894 4.685 1.00 0.22 N ATOM 413 CA THR A 333 0.085 9.211 5.191 1.00 0.23 C ATOM 414 C THR A 333 -1.374 9.534 4.892 1.00 0.23 C ATOM 415 O THR A 333 -2.055 8.775 4.201 1.00 0.28 O ATOM 416 CB THR A 333 0.988 10.307 4.589 1.00 0.26 C ATOM 417 OG1 THR A 333 0.812 10.364 3.170 1.00 0.34 O ATOM 418 CG2 THR A 333 2.453 10.044 4.909 1.00 0.38 C ATOM 0 H THR A 333 0.415 7.814 3.668 1.00 0.22 H new ATOM 0 HA THR A 333 0.241 9.193 6.270 1.00 0.23 H new ATOM 0 HB THR A 333 0.701 11.261 5.031 1.00 0.26 H new ATOM 0 HG1 THR A 333 0.947 9.472 2.788 1.00 0.34 H new ATOM 0 HG21 THR A 333 3.068 10.831 4.473 1.00 0.38 H new ATOM 0 HG22 THR A 333 2.593 10.031 5.990 1.00 0.38 H new ATOM 0 HG23 THR A 333 2.749 9.081 4.494 1.00 0.38 H new ATOM 426 N LYS A 334 -1.832 10.672 5.392 1.00 0.26 N ATOM 427 CA LYS A 334 -3.234 11.070 5.281 1.00 0.28 C ATOM 428 C LYS A 334 -3.648 11.369 3.842 1.00 0.26 C ATOM 429 O LYS A 334 -4.837 11.460 3.546 1.00 0.43 O ATOM 430 CB LYS A 334 -3.497 12.299 6.157 1.00 0.38 C ATOM 431 CG LYS A 334 -2.605 13.491 5.818 1.00 0.47 C ATOM 432 CD LYS A 334 -2.816 14.671 6.762 1.00 0.63 C ATOM 433 CE LYS A 334 -3.958 15.575 6.313 1.00 0.89 C ATOM 434 NZ LYS A 334 -4.084 16.782 7.172 1.00 1.61 N ATOM 0 H LYS A 334 -1.247 11.346 5.885 1.00 0.26 H new ATOM 0 HA LYS A 334 -3.834 10.227 5.623 1.00 0.28 H new ATOM 0 HB2 LYS A 334 -4.541 12.595 6.050 1.00 0.38 H new ATOM 0 HB3 LYS A 334 -3.347 12.029 7.202 1.00 0.38 H new ATOM 0 HG2 LYS A 334 -1.561 13.181 5.858 1.00 0.47 H new ATOM 0 HG3 LYS A 334 -2.804 13.809 4.795 1.00 0.47 H new ATOM 0 HD2 LYS A 334 -3.024 14.298 7.765 1.00 0.63 H new ATOM 0 HD3 LYS A 334 -1.897 15.254 6.823 1.00 0.63 H new ATOM 0 HE2 LYS A 334 -3.793 15.881 5.280 1.00 0.89 H new ATOM 0 HE3 LYS A 334 -4.893 15.015 6.335 1.00 0.89 H new ATOM 0 HZ1 LYS A 334 -4.872 17.369 6.832 1.00 1.61 H new ATOM 0 HZ2 LYS A 334 -4.267 16.492 8.154 1.00 1.61 H new ATOM 0 HZ3 LYS A 334 -3.201 17.330 7.132 1.00 1.61 H new ATOM 448 N GLU A 335 -2.679 11.525 2.951 1.00 0.27 N ATOM 449 CA GLU A 335 -2.986 11.911 1.581 1.00 0.33 C ATOM 450 C GLU A 335 -2.308 11.014 0.547 1.00 0.27 C ATOM 451 O GLU A 335 -2.700 11.009 -0.623 1.00 0.34 O ATOM 452 CB GLU A 335 -2.591 13.372 1.351 1.00 0.46 C ATOM 453 CG GLU A 335 -1.174 13.701 1.797 1.00 0.56 C ATOM 454 CD GLU A 335 -0.826 15.160 1.587 1.00 0.85 C ATOM 455 OE1 GLU A 335 -1.459 16.025 2.229 1.00 1.04 O ATOM 456 OE2 GLU A 335 0.082 15.452 0.779 1.00 1.79 O ATOM 0 H GLU A 335 -1.687 11.392 3.148 1.00 0.27 H new ATOM 0 HA GLU A 335 -4.061 11.791 1.447 1.00 0.33 H new ATOM 0 HB2 GLU A 335 -2.691 13.603 0.291 1.00 0.46 H new ATOM 0 HB3 GLU A 335 -3.289 14.016 1.885 1.00 0.46 H new ATOM 0 HG2 GLU A 335 -1.061 13.452 2.852 1.00 0.56 H new ATOM 0 HG3 GLU A 335 -0.469 13.079 1.245 1.00 0.56 H new ATOM 463 N CYS A 336 -1.307 10.245 0.956 1.00 0.23 N ATOM 464 CA CYS A 336 -0.544 9.466 -0.008 1.00 0.24 C ATOM 465 C CYS A 336 0.141 8.252 0.613 1.00 0.21 C ATOM 466 O CYS A 336 0.420 8.210 1.814 1.00 0.28 O ATOM 467 CB CYS A 336 0.496 10.363 -0.687 1.00 0.32 C ATOM 468 SG CYS A 336 1.516 11.323 0.460 1.00 1.10 S ATOM 0 H CYS A 336 -1.010 10.145 1.927 1.00 0.23 H new ATOM 0 HA CYS A 336 -1.253 9.084 -0.743 1.00 0.24 H new ATOM 0 HB2 CYS A 336 1.148 9.742 -1.302 1.00 0.32 H new ATOM 0 HB3 CYS A 336 -0.018 11.050 -1.360 1.00 0.32 H new ATOM 0 HG CYS A 336 1.504 10.757 1.630 1.00 1.10 H new ATOM 474 N VAL A 337 0.388 7.261 -0.226 1.00 0.22 N ATOM 475 CA VAL A 337 1.179 6.099 0.139 1.00 0.21 C ATOM 476 C VAL A 337 2.530 6.189 -0.557 1.00 0.19 C ATOM 477 O VAL A 337 2.615 6.072 -1.779 1.00 0.22 O ATOM 478 CB VAL A 337 0.476 4.784 -0.268 1.00 0.26 C ATOM 479 CG1 VAL A 337 1.345 3.578 0.054 1.00 0.27 C ATOM 480 CG2 VAL A 337 -0.877 4.664 0.415 1.00 0.32 C ATOM 0 H VAL A 337 0.043 7.240 -1.186 1.00 0.22 H new ATOM 0 HA VAL A 337 1.304 6.090 1.222 1.00 0.21 H new ATOM 0 HB VAL A 337 0.317 4.809 -1.346 1.00 0.26 H new ATOM 0 HG11 VAL A 337 0.826 2.666 -0.242 1.00 0.27 H new ATOM 0 HG12 VAL A 337 2.287 3.653 -0.489 1.00 0.27 H new ATOM 0 HG13 VAL A 337 1.545 3.549 1.125 1.00 0.27 H new ATOM 0 HG21 VAL A 337 -1.355 3.731 0.115 1.00 0.32 H new ATOM 0 HG22 VAL A 337 -0.740 4.670 1.496 1.00 0.32 H new ATOM 0 HG23 VAL A 337 -1.507 5.504 0.124 1.00 0.32 H new ATOM 490 N MET A 338 3.575 6.427 0.212 1.00 0.17 N ATOM 491 CA MET A 338 4.896 6.642 -0.359 1.00 0.17 C ATOM 492 C MET A 338 5.821 5.465 -0.080 1.00 0.16 C ATOM 493 O MET A 338 5.886 4.958 1.041 1.00 0.20 O ATOM 494 CB MET A 338 5.509 7.939 0.181 1.00 0.22 C ATOM 495 CG MET A 338 5.638 7.977 1.696 1.00 0.24 C ATOM 496 SD MET A 338 6.332 9.527 2.299 1.00 1.08 S ATOM 497 CE MET A 338 5.125 10.701 1.686 1.00 0.62 C ATOM 0 H MET A 338 3.538 6.477 1.230 1.00 0.17 H new ATOM 0 HA MET A 338 4.780 6.729 -1.439 1.00 0.17 H new ATOM 0 HB2 MET A 338 6.496 8.074 -0.261 1.00 0.22 H new ATOM 0 HB3 MET A 338 4.897 8.781 -0.143 1.00 0.22 H new ATOM 0 HG2 MET A 338 4.656 7.825 2.144 1.00 0.24 H new ATOM 0 HG3 MET A 338 6.268 7.150 2.023 1.00 0.24 H new ATOM 0 HE1 MET A 338 4.972 11.486 2.427 1.00 0.62 H new ATOM 0 HE2 MET A 338 5.487 11.144 0.758 1.00 0.62 H new ATOM 0 HE3 MET A 338 4.181 10.189 1.500 1.00 0.62 H new ATOM 507 N ARG A 339 6.523 5.024 -1.112 1.00 0.16 N ATOM 508 CA ARG A 339 7.503 3.961 -0.965 1.00 0.17 C ATOM 509 C ARG A 339 8.864 4.553 -0.631 1.00 0.16 C ATOM 510 O ARG A 339 9.579 5.030 -1.516 1.00 0.18 O ATOM 511 CB ARG A 339 7.595 3.114 -2.240 1.00 0.22 C ATOM 512 CG ARG A 339 6.277 2.476 -2.648 1.00 0.27 C ATOM 513 CD ARG A 339 6.482 1.324 -3.618 1.00 0.31 C ATOM 514 NE ARG A 339 6.987 1.749 -4.925 1.00 0.73 N ATOM 515 CZ ARG A 339 8.052 1.208 -5.517 1.00 1.03 C ATOM 516 NH1 ARG A 339 8.756 0.273 -4.894 1.00 1.15 N ATOM 517 NH2 ARG A 339 8.401 1.585 -6.740 1.00 1.55 N ATOM 0 H ARG A 339 6.432 5.387 -2.061 1.00 0.16 H new ATOM 0 HA ARG A 339 7.183 3.312 -0.150 1.00 0.17 H new ATOM 0 HB2 ARG A 339 7.953 3.741 -3.057 1.00 0.22 H new ATOM 0 HB3 ARG A 339 8.337 2.330 -2.091 1.00 0.22 H new ATOM 0 HG2 ARG A 339 5.758 2.115 -1.760 1.00 0.27 H new ATOM 0 HG3 ARG A 339 5.636 3.228 -3.108 1.00 0.27 H new ATOM 0 HD2 ARG A 339 7.181 0.610 -3.181 1.00 0.31 H new ATOM 0 HD3 ARG A 339 5.536 0.801 -3.755 1.00 0.31 H new ATOM 0 HE ARG A 339 6.497 2.501 -5.410 1.00 0.73 H new ATOM 0 HH11 ARG A 339 8.483 -0.034 -3.960 1.00 1.15 H new ATOM 0 HH12 ARG A 339 9.571 -0.140 -5.349 1.00 1.15 H new ATOM 0 HH21 ARG A 339 7.854 2.292 -7.231 1.00 1.55 H new ATOM 0 HH22 ARG A 339 9.217 1.168 -7.189 1.00 1.55 H new ATOM 531 N VAL A 340 9.206 4.545 0.649 1.00 0.18 N ATOM 532 CA VAL A 340 10.467 5.104 1.105 1.00 0.22 C ATOM 533 C VAL A 340 11.562 4.045 1.073 1.00 0.24 C ATOM 534 O VAL A 340 11.386 2.929 1.567 1.00 0.24 O ATOM 535 CB VAL A 340 10.345 5.693 2.526 1.00 0.25 C ATOM 536 CG1 VAL A 340 11.673 6.277 2.993 1.00 0.31 C ATOM 537 CG2 VAL A 340 9.251 6.751 2.568 1.00 0.28 C ATOM 0 H VAL A 340 8.625 4.156 1.391 1.00 0.18 H new ATOM 0 HA VAL A 340 10.732 5.914 0.425 1.00 0.22 H new ATOM 0 HB VAL A 340 10.076 4.885 3.207 1.00 0.25 H new ATOM 0 HG11 VAL A 340 11.558 6.685 3.997 1.00 0.31 H new ATOM 0 HG12 VAL A 340 12.431 5.494 3.004 1.00 0.31 H new ATOM 0 HG13 VAL A 340 11.981 7.070 2.312 1.00 0.31 H new ATOM 0 HG21 VAL A 340 9.176 7.157 3.577 1.00 0.28 H new ATOM 0 HG22 VAL A 340 9.493 7.553 1.871 1.00 0.28 H new ATOM 0 HG23 VAL A 340 8.299 6.301 2.287 1.00 0.28 H new ATOM 547 N ASP A 341 12.680 4.398 0.468 1.00 0.30 N ATOM 548 CA ASP A 341 13.800 3.488 0.325 1.00 0.36 C ATOM 549 C ASP A 341 14.487 3.264 1.666 1.00 0.38 C ATOM 550 O ASP A 341 14.846 4.216 2.349 1.00 0.41 O ATOM 551 CB ASP A 341 14.792 4.043 -0.701 1.00 0.46 C ATOM 552 CG ASP A 341 15.954 3.109 -0.963 1.00 0.55 C ATOM 553 OD1 ASP A 341 15.746 1.882 -0.975 1.00 0.67 O ATOM 554 OD2 ASP A 341 17.078 3.607 -1.170 1.00 0.77 O ATOM 0 H ASP A 341 12.837 5.321 0.063 1.00 0.30 H new ATOM 0 HA ASP A 341 13.427 2.526 -0.027 1.00 0.36 H new ATOM 0 HB2 ASP A 341 14.269 4.235 -1.638 1.00 0.46 H new ATOM 0 HB3 ASP A 341 15.175 5.000 -0.348 1.00 0.46 H new ATOM 559 N GLU A 342 14.667 2.005 2.038 1.00 0.42 N ATOM 560 CA GLU A 342 15.291 1.668 3.312 1.00 0.47 C ATOM 561 C GLU A 342 16.809 1.782 3.189 1.00 0.60 C ATOM 562 O GLU A 342 17.541 1.809 4.183 1.00 0.72 O ATOM 563 CB GLU A 342 14.886 0.247 3.731 1.00 0.49 C ATOM 564 CG GLU A 342 15.404 -0.183 5.098 1.00 0.60 C ATOM 565 CD GLU A 342 14.851 0.643 6.241 1.00 0.95 C ATOM 566 OE1 GLU A 342 14.984 1.886 6.198 1.00 1.36 O ATOM 567 OE2 GLU A 342 14.252 0.065 7.168 1.00 1.51 O ATOM 0 H GLU A 342 14.390 1.199 1.477 1.00 0.42 H new ATOM 0 HA GLU A 342 14.951 2.365 4.078 1.00 0.47 H new ATOM 0 HB2 GLU A 342 13.798 0.179 3.731 1.00 0.49 H new ATOM 0 HB3 GLU A 342 15.249 -0.456 2.982 1.00 0.49 H new ATOM 0 HG2 GLU A 342 15.150 -1.230 5.261 1.00 0.60 H new ATOM 0 HG3 GLU A 342 16.492 -0.114 5.104 1.00 0.60 H new ATOM 574 N LYS A 343 17.266 1.854 1.950 1.00 0.69 N ATOM 575 CA LYS A 343 18.682 1.957 1.650 1.00 0.87 C ATOM 576 C LYS A 343 19.150 3.412 1.726 1.00 0.79 C ATOM 577 O LYS A 343 20.026 3.755 2.523 1.00 0.86 O ATOM 578 CB LYS A 343 18.932 1.374 0.255 1.00 1.08 C ATOM 579 CG LYS A 343 20.389 1.296 -0.157 1.00 1.36 C ATOM 580 CD LYS A 343 20.530 0.570 -1.484 1.00 1.63 C ATOM 581 CE LYS A 343 21.982 0.408 -1.895 1.00 2.26 C ATOM 582 NZ LYS A 343 22.114 -0.409 -3.129 1.00 3.06 N ATOM 0 H LYS A 343 16.666 1.843 1.125 1.00 0.69 H new ATOM 0 HA LYS A 343 19.254 1.394 2.388 1.00 0.87 H new ATOM 0 HB2 LYS A 343 18.505 0.372 0.215 1.00 1.08 H new ATOM 0 HB3 LYS A 343 18.395 1.979 -0.476 1.00 1.08 H new ATOM 0 HG2 LYS A 343 20.804 2.301 -0.240 1.00 1.36 H new ATOM 0 HG3 LYS A 343 20.963 0.777 0.611 1.00 1.36 H new ATOM 0 HD2 LYS A 343 20.063 -0.412 -1.411 1.00 1.63 H new ATOM 0 HD3 LYS A 343 19.994 1.121 -2.257 1.00 1.63 H new ATOM 0 HE2 LYS A 343 22.426 1.390 -2.059 1.00 2.26 H new ATOM 0 HE3 LYS A 343 22.540 -0.063 -1.085 1.00 2.26 H new ATOM 0 HZ1 LYS A 343 23.119 -0.499 -3.380 1.00 3.06 H new ATOM 0 HZ2 LYS A 343 21.713 -1.354 -2.964 1.00 3.06 H new ATOM 0 HZ3 LYS A 343 21.603 0.053 -3.908 1.00 3.06 H new ATOM 596 N THR A 344 18.558 4.265 0.901 1.00 0.73 N ATOM 597 CA THR A 344 18.960 5.665 0.823 1.00 0.72 C ATOM 598 C THR A 344 18.082 6.573 1.691 1.00 0.63 C ATOM 599 O THR A 344 18.441 7.722 1.951 1.00 0.67 O ATOM 600 CB THR A 344 18.899 6.163 -0.630 1.00 0.80 C ATOM 601 OG1 THR A 344 19.302 5.113 -1.520 1.00 0.92 O ATOM 602 CG2 THR A 344 19.805 7.368 -0.827 1.00 0.92 C ATOM 0 H THR A 344 17.795 4.012 0.274 1.00 0.73 H new ATOM 0 HA THR A 344 19.982 5.715 1.198 1.00 0.72 H new ATOM 0 HB THR A 344 17.873 6.458 -0.848 1.00 0.80 H new ATOM 0 HG1 THR A 344 18.581 4.454 -1.596 1.00 0.92 H new ATOM 0 HG21 THR A 344 19.745 7.703 -1.863 1.00 0.92 H new ATOM 0 HG22 THR A 344 19.487 8.174 -0.166 1.00 0.92 H new ATOM 0 HG23 THR A 344 20.833 7.092 -0.594 1.00 0.92 H new ATOM 610 N LYS A 345 16.933 6.052 2.126 1.00 0.55 N ATOM 611 CA LYS A 345 15.955 6.822 2.909 1.00 0.52 C ATOM 612 C LYS A 345 15.290 7.909 2.059 1.00 0.53 C ATOM 613 O LYS A 345 14.821 8.920 2.581 1.00 0.61 O ATOM 614 CB LYS A 345 16.600 7.448 4.154 1.00 0.61 C ATOM 615 CG LYS A 345 17.080 6.438 5.185 1.00 0.63 C ATOM 616 CD LYS A 345 15.930 5.652 5.794 1.00 0.62 C ATOM 617 CE LYS A 345 16.402 4.821 6.977 1.00 0.71 C ATOM 618 NZ LYS A 345 15.300 4.039 7.591 1.00 1.50 N ATOM 0 H LYS A 345 16.652 5.088 1.948 1.00 0.55 H new ATOM 0 HA LYS A 345 15.187 6.121 3.235 1.00 0.52 H new ATOM 0 HB2 LYS A 345 17.446 8.061 3.842 1.00 0.61 H new ATOM 0 HB3 LYS A 345 15.879 8.116 4.625 1.00 0.61 H new ATOM 0 HG2 LYS A 345 17.782 5.748 4.717 1.00 0.63 H new ATOM 0 HG3 LYS A 345 17.622 6.957 5.975 1.00 0.63 H new ATOM 0 HD2 LYS A 345 15.147 6.338 6.117 1.00 0.62 H new ATOM 0 HD3 LYS A 345 15.491 5.000 5.039 1.00 0.62 H new ATOM 0 HE2 LYS A 345 17.189 4.141 6.650 1.00 0.71 H new ATOM 0 HE3 LYS A 345 16.841 5.478 7.728 1.00 0.71 H new ATOM 0 HZ1 LYS A 345 15.591 3.709 8.533 1.00 1.50 H new ATOM 0 HZ2 LYS A 345 14.456 4.640 7.680 1.00 1.50 H new ATOM 0 HZ3 LYS A 345 15.080 3.219 6.990 1.00 1.50 H new ATOM 632 N GLU A 346 15.241 7.691 0.750 1.00 0.53 N ATOM 633 CA GLU A 346 14.571 8.622 -0.156 1.00 0.58 C ATOM 634 C GLU A 346 13.206 8.076 -0.551 1.00 0.44 C ATOM 635 O GLU A 346 12.945 6.884 -0.407 1.00 0.42 O ATOM 636 CB GLU A 346 15.405 8.861 -1.419 1.00 0.77 C ATOM 637 CG GLU A 346 16.754 9.507 -1.162 1.00 0.95 C ATOM 638 CD GLU A 346 17.468 9.877 -2.447 1.00 1.61 C ATOM 639 OE1 GLU A 346 18.128 8.999 -3.039 1.00 2.46 O ATOM 640 OE2 GLU A 346 17.377 11.047 -2.873 1.00 1.81 O ATOM 0 H GLU A 346 15.656 6.880 0.291 1.00 0.53 H new ATOM 0 HA GLU A 346 14.451 9.570 0.368 1.00 0.58 H new ATOM 0 HB2 GLU A 346 15.562 7.907 -1.923 1.00 0.77 H new ATOM 0 HB3 GLU A 346 14.837 9.493 -2.102 1.00 0.77 H new ATOM 0 HG2 GLU A 346 16.616 10.402 -0.555 1.00 0.95 H new ATOM 0 HG3 GLU A 346 17.378 8.824 -0.586 1.00 0.95 H new ATOM 647 N VAL A 347 12.339 8.943 -1.052 1.00 0.39 N ATOM 648 CA VAL A 347 11.030 8.517 -1.523 1.00 0.33 C ATOM 649 C VAL A 347 11.120 8.119 -2.990 1.00 0.31 C ATOM 650 O VAL A 347 11.437 8.944 -3.850 1.00 0.42 O ATOM 651 CB VAL A 347 9.970 9.628 -1.352 1.00 0.41 C ATOM 652 CG1 VAL A 347 8.595 9.133 -1.780 1.00 0.54 C ATOM 653 CG2 VAL A 347 9.939 10.120 0.089 1.00 0.58 C ATOM 0 H VAL A 347 12.518 9.943 -1.143 1.00 0.39 H new ATOM 0 HA VAL A 347 10.720 7.663 -0.921 1.00 0.33 H new ATOM 0 HB VAL A 347 10.245 10.464 -1.995 1.00 0.41 H new ATOM 0 HG11 VAL A 347 7.864 9.932 -1.651 1.00 0.54 H new ATOM 0 HG12 VAL A 347 8.626 8.835 -2.828 1.00 0.54 H new ATOM 0 HG13 VAL A 347 8.309 8.278 -1.168 1.00 0.54 H new ATOM 0 HG21 VAL A 347 9.187 10.902 0.190 1.00 0.58 H new ATOM 0 HG22 VAL A 347 9.692 9.291 0.751 1.00 0.58 H new ATOM 0 HG23 VAL A 347 10.917 10.520 0.358 1.00 0.58 H new ATOM 663 N ILE A 348 10.864 6.851 -3.271 1.00 0.25 N ATOM 664 CA ILE A 348 10.983 6.334 -4.626 1.00 0.26 C ATOM 665 C ILE A 348 9.739 6.657 -5.443 1.00 0.26 C ATOM 666 O ILE A 348 9.824 7.269 -6.508 1.00 0.35 O ATOM 667 CB ILE A 348 11.205 4.806 -4.626 1.00 0.27 C ATOM 668 CG1 ILE A 348 12.442 4.449 -3.798 1.00 0.29 C ATOM 669 CG2 ILE A 348 11.348 4.287 -6.054 1.00 0.32 C ATOM 670 CD1 ILE A 348 12.676 2.960 -3.669 1.00 0.31 C ATOM 0 H ILE A 348 10.572 6.161 -2.579 1.00 0.25 H new ATOM 0 HA ILE A 348 11.848 6.818 -5.079 1.00 0.26 H new ATOM 0 HB ILE A 348 10.336 4.329 -4.173 1.00 0.27 H new ATOM 0 HG12 ILE A 348 13.319 4.908 -4.254 1.00 0.29 H new ATOM 0 HG13 ILE A 348 12.339 4.880 -2.802 1.00 0.29 H new ATOM 0 HG21 ILE A 348 11.504 3.208 -6.035 1.00 0.32 H new ATOM 0 HG22 ILE A 348 10.442 4.513 -6.616 1.00 0.32 H new ATOM 0 HG23 ILE A 348 12.201 4.769 -6.532 1.00 0.32 H new ATOM 0 HD11 ILE A 348 13.569 2.783 -3.070 1.00 0.31 H new ATOM 0 HD12 ILE A 348 11.816 2.497 -3.185 1.00 0.31 H new ATOM 0 HD13 ILE A 348 12.812 2.526 -4.660 1.00 0.31 H new ATOM 682 N GLN A 349 8.588 6.256 -4.927 1.00 0.23 N ATOM 683 CA GLN A 349 7.335 6.396 -5.650 1.00 0.23 C ATOM 684 C GLN A 349 6.205 6.697 -4.673 1.00 0.22 C ATOM 685 O GLN A 349 6.093 6.051 -3.632 1.00 0.29 O ATOM 686 CB GLN A 349 7.056 5.106 -6.421 1.00 0.28 C ATOM 687 CG GLN A 349 5.855 5.164 -7.347 1.00 0.40 C ATOM 688 CD GLN A 349 5.679 3.869 -8.112 1.00 0.86 C ATOM 689 OE1 GLN A 349 6.042 2.802 -7.623 1.00 1.65 O ATOM 690 NE2 GLN A 349 5.124 3.945 -9.311 1.00 0.81 N ATOM 0 H GLN A 349 8.496 5.829 -4.005 1.00 0.23 H new ATOM 0 HA GLN A 349 7.404 7.223 -6.356 1.00 0.23 H new ATOM 0 HB2 GLN A 349 7.938 4.853 -7.009 1.00 0.28 H new ATOM 0 HB3 GLN A 349 6.907 4.297 -5.706 1.00 0.28 H new ATOM 0 HG2 GLN A 349 4.956 5.369 -6.766 1.00 0.40 H new ATOM 0 HG3 GLN A 349 5.976 5.989 -8.049 1.00 0.40 H new ATOM 0 HE21 GLN A 349 4.836 4.850 -9.683 1.00 0.81 H new ATOM 0 HE22 GLN A 349 4.985 3.099 -9.863 1.00 0.81 H new ATOM 699 N GLU A 350 5.386 7.683 -5.001 1.00 0.23 N ATOM 700 CA GLU A 350 4.317 8.119 -4.116 1.00 0.25 C ATOM 701 C GLU A 350 2.959 8.018 -4.810 1.00 0.26 C ATOM 702 O GLU A 350 2.782 8.503 -5.930 1.00 0.36 O ATOM 703 CB GLU A 350 4.575 9.559 -3.669 1.00 0.30 C ATOM 704 CG GLU A 350 3.594 10.068 -2.631 1.00 0.36 C ATOM 705 CD GLU A 350 3.798 11.534 -2.319 1.00 0.45 C ATOM 706 OE1 GLU A 350 4.665 11.856 -1.481 1.00 0.65 O ATOM 707 OE2 GLU A 350 3.094 12.374 -2.919 1.00 0.60 O ATOM 0 H GLU A 350 5.442 8.199 -5.879 1.00 0.23 H new ATOM 0 HA GLU A 350 4.300 7.467 -3.243 1.00 0.25 H new ATOM 0 HB2 GLU A 350 5.585 9.627 -3.264 1.00 0.30 H new ATOM 0 HB3 GLU A 350 4.536 10.212 -4.541 1.00 0.30 H new ATOM 0 HG2 GLU A 350 2.576 9.913 -2.989 1.00 0.36 H new ATOM 0 HG3 GLU A 350 3.702 9.486 -1.716 1.00 0.36 H new ATOM 714 N TRP A 351 2.005 7.378 -4.150 1.00 0.23 N ATOM 715 CA TRP A 351 0.662 7.239 -4.693 1.00 0.26 C ATOM 716 C TRP A 351 -0.347 8.011 -3.859 1.00 0.25 C ATOM 717 O TRP A 351 -0.455 7.797 -2.655 1.00 0.52 O ATOM 718 CB TRP A 351 0.239 5.774 -4.741 1.00 0.30 C ATOM 719 CG TRP A 351 1.087 4.915 -5.624 1.00 0.30 C ATOM 720 CD1 TRP A 351 1.265 5.041 -6.970 1.00 0.38 C ATOM 721 CD2 TRP A 351 1.849 3.774 -5.223 1.00 0.30 C ATOM 722 NE1 TRP A 351 2.096 4.049 -7.430 1.00 0.41 N ATOM 723 CE2 TRP A 351 2.467 3.257 -6.375 1.00 0.34 C ATOM 724 CE3 TRP A 351 2.069 3.141 -3.997 1.00 0.35 C ATOM 725 CZ2 TRP A 351 3.289 2.136 -6.338 1.00 0.38 C ATOM 726 CZ3 TRP A 351 2.885 2.029 -3.962 1.00 0.40 C ATOM 727 CH2 TRP A 351 3.485 1.536 -5.125 1.00 0.39 C ATOM 0 H TRP A 351 2.137 6.946 -3.236 1.00 0.23 H new ATOM 0 HA TRP A 351 0.683 7.644 -5.705 1.00 0.26 H new ATOM 0 HB2 TRP A 351 0.262 5.368 -3.730 1.00 0.30 H new ATOM 0 HB3 TRP A 351 -0.794 5.718 -5.084 1.00 0.30 H new ATOM 0 HD1 TRP A 351 0.818 5.809 -7.584 1.00 0.38 H new ATOM 0 HE1 TRP A 351 2.389 3.922 -8.399 1.00 0.41 H new ATOM 0 HE3 TRP A 351 1.609 3.515 -3.094 1.00 0.35 H new ATOM 0 HZ2 TRP A 351 3.755 1.754 -7.234 1.00 0.38 H new ATOM 0 HZ3 TRP A 351 3.063 1.531 -3.020 1.00 0.40 H new ATOM 0 HH2 TRP A 351 4.117 0.662 -5.064 1.00 0.39 H new ATOM 738 N SER A 352 -1.078 8.908 -4.496 1.00 0.31 N ATOM 739 CA SER A 352 -2.187 9.583 -3.844 1.00 0.30 C ATOM 740 C SER A 352 -3.275 8.566 -3.513 1.00 0.26 C ATOM 741 O SER A 352 -3.505 7.629 -4.281 1.00 0.28 O ATOM 742 CB SER A 352 -2.743 10.689 -4.751 1.00 0.35 C ATOM 743 OG SER A 352 -3.900 11.292 -4.190 1.00 1.27 O ATOM 0 H SER A 352 -0.924 9.186 -5.465 1.00 0.31 H new ATOM 0 HA SER A 352 -1.837 10.044 -2.920 1.00 0.30 H new ATOM 0 HB2 SER A 352 -1.978 11.448 -4.911 1.00 0.35 H new ATOM 0 HB3 SER A 352 -2.987 10.271 -5.728 1.00 0.35 H new ATOM 0 HG SER A 352 -4.671 11.123 -4.771 1.00 1.27 H new ATOM 749 N LEU A 353 -3.940 8.744 -2.374 1.00 0.25 N ATOM 750 CA LEU A 353 -5.008 7.833 -1.961 1.00 0.24 C ATOM 751 C LEU A 353 -6.149 7.853 -2.975 1.00 0.23 C ATOM 752 O LEU A 353 -6.921 6.903 -3.082 1.00 0.23 O ATOM 753 CB LEU A 353 -5.538 8.215 -0.574 1.00 0.25 C ATOM 754 CG LEU A 353 -4.510 8.166 0.560 1.00 0.26 C ATOM 755 CD1 LEU A 353 -5.162 8.542 1.881 1.00 0.31 C ATOM 756 CD2 LEU A 353 -3.877 6.786 0.653 1.00 0.26 C ATOM 0 H LEU A 353 -3.760 9.507 -1.722 1.00 0.25 H new ATOM 0 HA LEU A 353 -4.594 6.826 -1.913 1.00 0.24 H new ATOM 0 HB2 LEU A 353 -5.948 9.224 -0.626 1.00 0.25 H new ATOM 0 HB3 LEU A 353 -6.363 7.548 -0.323 1.00 0.25 H new ATOM 0 HG LEU A 353 -3.723 8.888 0.342 1.00 0.26 H new ATOM 0 HD11 LEU A 353 -4.419 8.503 2.678 1.00 0.31 H new ATOM 0 HD12 LEU A 353 -5.567 9.551 1.812 1.00 0.31 H new ATOM 0 HD13 LEU A 353 -5.968 7.842 2.101 1.00 0.31 H new ATOM 0 HD21 LEU A 353 -3.150 6.773 1.465 1.00 0.26 H new ATOM 0 HD22 LEU A 353 -4.651 6.043 0.847 1.00 0.26 H new ATOM 0 HD23 LEU A 353 -3.376 6.551 -0.286 1.00 0.26 H new ATOM 768 N THR A 354 -6.225 8.939 -3.727 1.00 0.26 N ATOM 769 CA THR A 354 -7.250 9.114 -4.744 1.00 0.28 C ATOM 770 C THR A 354 -6.952 8.267 -5.985 1.00 0.28 C ATOM 771 O THR A 354 -7.778 8.162 -6.895 1.00 0.35 O ATOM 772 CB THR A 354 -7.339 10.595 -5.165 1.00 0.36 C ATOM 773 OG1 THR A 354 -6.120 10.988 -5.815 1.00 0.44 O ATOM 774 CG2 THR A 354 -7.560 11.502 -3.963 1.00 0.42 C ATOM 0 H THR A 354 -5.578 9.724 -3.650 1.00 0.26 H new ATOM 0 HA THR A 354 -8.197 8.791 -4.312 1.00 0.28 H new ATOM 0 HB THR A 354 -8.186 10.696 -5.844 1.00 0.36 H new ATOM 0 HG1 THR A 354 -6.181 11.929 -6.082 1.00 0.44 H new ATOM 0 HG21 THR A 354 -7.618 12.539 -4.295 1.00 0.42 H new ATOM 0 HG22 THR A 354 -8.491 11.227 -3.466 1.00 0.42 H new ATOM 0 HG23 THR A 354 -6.730 11.390 -3.265 1.00 0.42 H new ATOM 782 N ASN A 355 -5.761 7.676 -6.027 1.00 0.26 N ATOM 783 CA ASN A 355 -5.332 6.897 -7.183 1.00 0.30 C ATOM 784 C ASN A 355 -5.433 5.406 -6.897 1.00 0.28 C ATOM 785 O ASN A 355 -5.038 4.578 -7.713 1.00 0.33 O ATOM 786 CB ASN A 355 -3.894 7.262 -7.577 1.00 0.37 C ATOM 787 CG ASN A 355 -3.761 8.712 -8.005 1.00 0.49 C ATOM 788 OD1 ASN A 355 -4.706 9.308 -8.519 1.00 0.83 O ATOM 789 ND2 ASN A 355 -2.586 9.290 -7.810 1.00 0.66 N ATOM 0 H ASN A 355 -5.076 7.722 -5.273 1.00 0.26 H new ATOM 0 HA ASN A 355 -5.994 7.136 -8.015 1.00 0.30 H new ATOM 0 HB2 ASN A 355 -3.230 7.073 -6.734 1.00 0.37 H new ATOM 0 HB3 ASN A 355 -3.568 6.615 -8.391 1.00 0.37 H new ATOM 0 HD21 ASN A 355 -2.442 10.261 -8.089 1.00 0.66 H new ATOM 0 HD22 ASN A 355 -1.824 8.765 -7.381 1.00 0.66 H new ATOM 796 N ILE A 356 -5.974 5.075 -5.735 1.00 0.26 N ATOM 797 CA ILE A 356 -6.137 3.687 -5.335 1.00 0.28 C ATOM 798 C ILE A 356 -7.497 3.167 -5.791 1.00 0.28 C ATOM 799 O ILE A 356 -8.474 3.914 -5.809 1.00 0.38 O ATOM 800 CB ILE A 356 -6.003 3.534 -3.801 1.00 0.31 C ATOM 801 CG1 ILE A 356 -4.655 4.091 -3.328 1.00 0.33 C ATOM 802 CG2 ILE A 356 -6.150 2.076 -3.390 1.00 0.36 C ATOM 803 CD1 ILE A 356 -4.454 4.014 -1.829 1.00 0.38 C ATOM 0 H ILE A 356 -6.309 5.752 -5.050 1.00 0.26 H new ATOM 0 HA ILE A 356 -5.350 3.101 -5.809 1.00 0.28 H new ATOM 0 HB ILE A 356 -6.802 4.104 -3.327 1.00 0.31 H new ATOM 0 HG12 ILE A 356 -3.853 3.543 -3.821 1.00 0.33 H new ATOM 0 HG13 ILE A 356 -4.571 5.131 -3.643 1.00 0.33 H new ATOM 0 HG21 ILE A 356 -6.052 1.991 -2.308 1.00 0.36 H new ATOM 0 HG22 ILE A 356 -7.130 1.709 -3.696 1.00 0.36 H new ATOM 0 HG23 ILE A 356 -5.373 1.482 -3.872 1.00 0.36 H new ATOM 0 HD11 ILE A 356 -3.479 4.426 -1.571 1.00 0.38 H new ATOM 0 HD12 ILE A 356 -5.234 4.586 -1.327 1.00 0.38 H new ATOM 0 HD13 ILE A 356 -4.504 2.974 -1.508 1.00 0.38 H new ATOM 815 N LYS A 357 -7.553 1.903 -6.189 1.00 0.26 N ATOM 816 CA LYS A 357 -8.806 1.289 -6.606 1.00 0.30 C ATOM 817 C LYS A 357 -9.298 0.308 -5.544 1.00 0.31 C ATOM 818 O LYS A 357 -10.467 0.329 -5.147 1.00 0.45 O ATOM 819 CB LYS A 357 -8.619 0.563 -7.941 1.00 0.35 C ATOM 820 CG LYS A 357 -9.881 -0.112 -8.454 1.00 0.46 C ATOM 821 CD LYS A 357 -9.605 -0.930 -9.704 1.00 0.60 C ATOM 822 CE LYS A 357 -10.863 -1.615 -10.216 1.00 0.79 C ATOM 823 NZ LYS A 357 -11.878 -0.639 -10.693 1.00 1.75 N ATOM 0 H LYS A 357 -6.744 1.283 -6.232 1.00 0.26 H new ATOM 0 HA LYS A 357 -9.552 2.074 -6.730 1.00 0.30 H new ATOM 0 HB2 LYS A 357 -8.271 1.278 -8.687 1.00 0.35 H new ATOM 0 HB3 LYS A 357 -7.836 -0.187 -7.829 1.00 0.35 H new ATOM 0 HG2 LYS A 357 -10.291 -0.758 -7.678 1.00 0.46 H new ATOM 0 HG3 LYS A 357 -10.636 0.643 -8.671 1.00 0.46 H new ATOM 0 HD2 LYS A 357 -9.201 -0.282 -10.482 1.00 0.60 H new ATOM 0 HD3 LYS A 357 -8.844 -1.680 -9.488 1.00 0.60 H new ATOM 0 HE2 LYS A 357 -10.601 -2.291 -11.030 1.00 0.79 H new ATOM 0 HE3 LYS A 357 -11.293 -2.224 -9.421 1.00 0.79 H new ATOM 0 HZ1 LYS A 357 -12.650 -1.146 -11.171 1.00 1.75 H new ATOM 0 HZ2 LYS A 357 -12.260 -0.111 -9.882 1.00 1.75 H new ATOM 0 HZ3 LYS A 357 -11.435 0.024 -11.360 1.00 1.75 H new ATOM 837 N ARG A 358 -8.389 -0.549 -5.097 1.00 0.26 N ATOM 838 CA ARG A 358 -8.697 -1.585 -4.120 1.00 0.29 C ATOM 839 C ARG A 358 -7.407 -2.130 -3.527 1.00 0.28 C ATOM 840 O ARG A 358 -6.338 -1.969 -4.113 1.00 0.35 O ATOM 841 CB ARG A 358 -9.483 -2.724 -4.779 1.00 0.34 C ATOM 842 CG ARG A 358 -8.850 -3.232 -6.063 1.00 0.37 C ATOM 843 CD ARG A 358 -9.624 -4.397 -6.654 1.00 0.54 C ATOM 844 NE ARG A 358 -11.002 -4.039 -6.989 1.00 0.83 N ATOM 845 CZ ARG A 358 -11.691 -4.592 -7.984 1.00 1.19 C ATOM 846 NH1 ARG A 358 -11.126 -5.509 -8.757 1.00 1.46 N ATOM 847 NH2 ARG A 358 -12.945 -4.227 -8.199 1.00 1.75 N ATOM 0 H ARG A 358 -7.416 -0.545 -5.402 1.00 0.26 H new ATOM 0 HA ARG A 358 -9.307 -1.150 -3.328 1.00 0.29 H new ATOM 0 HB2 ARG A 358 -9.570 -3.551 -4.074 1.00 0.34 H new ATOM 0 HB3 ARG A 358 -10.495 -2.380 -4.993 1.00 0.34 H new ATOM 0 HG2 ARG A 358 -8.803 -2.421 -6.790 1.00 0.37 H new ATOM 0 HG3 ARG A 358 -7.824 -3.541 -5.864 1.00 0.37 H new ATOM 0 HD2 ARG A 358 -9.115 -4.750 -7.551 1.00 0.54 H new ATOM 0 HD3 ARG A 358 -9.629 -5.224 -5.944 1.00 0.54 H new ATOM 0 HE ARG A 358 -11.462 -3.323 -6.427 1.00 0.83 H new ATOM 0 HH11 ARG A 358 -10.161 -5.792 -8.590 1.00 1.46 H new ATOM 0 HH12 ARG A 358 -11.657 -5.931 -9.519 1.00 1.46 H new ATOM 0 HH21 ARG A 358 -13.381 -3.523 -7.603 1.00 1.75 H new ATOM 0 HH22 ARG A 358 -13.476 -4.649 -8.961 1.00 1.75 H new ATOM 861 N TRP A 359 -7.497 -2.760 -2.367 1.00 0.25 N ATOM 862 CA TRP A 359 -6.336 -3.401 -1.776 1.00 0.27 C ATOM 863 C TRP A 359 -6.731 -4.676 -1.042 1.00 0.28 C ATOM 864 O TRP A 359 -7.871 -4.824 -0.591 1.00 0.36 O ATOM 865 CB TRP A 359 -5.578 -2.441 -0.845 1.00 0.28 C ATOM 866 CG TRP A 359 -6.390 -1.873 0.283 1.00 0.27 C ATOM 867 CD1 TRP A 359 -6.492 -2.372 1.546 1.00 0.36 C ATOM 868 CD2 TRP A 359 -7.195 -0.688 0.255 1.00 0.25 C ATOM 869 NE1 TRP A 359 -7.312 -1.573 2.305 1.00 0.35 N ATOM 870 CE2 TRP A 359 -7.758 -0.536 1.535 1.00 0.29 C ATOM 871 CE3 TRP A 359 -7.498 0.257 -0.725 1.00 0.32 C ATOM 872 CZ2 TRP A 359 -8.605 0.519 1.860 1.00 0.33 C ATOM 873 CZ3 TRP A 359 -8.337 1.305 -0.403 1.00 0.40 C ATOM 874 CH2 TRP A 359 -8.882 1.428 0.880 1.00 0.39 C ATOM 0 H TRP A 359 -8.355 -2.841 -1.821 1.00 0.25 H new ATOM 0 HA TRP A 359 -5.661 -3.674 -2.587 1.00 0.27 H new ATOM 0 HB2 TRP A 359 -4.721 -2.968 -0.426 1.00 0.28 H new ATOM 0 HB3 TRP A 359 -5.185 -1.617 -1.440 1.00 0.28 H new ATOM 0 HD1 TRP A 359 -6.000 -3.266 1.899 1.00 0.36 H new ATOM 0 HE1 TRP A 359 -7.550 -1.729 3.285 1.00 0.35 H new ATOM 0 HE3 TRP A 359 -7.083 0.170 -1.719 1.00 0.32 H new ATOM 0 HZ2 TRP A 359 -9.027 0.615 2.849 1.00 0.33 H new ATOM 0 HZ3 TRP A 359 -8.577 2.043 -1.154 1.00 0.40 H new ATOM 0 HH2 TRP A 359 -9.535 2.259 1.099 1.00 0.39 H new ATOM 885 N ALA A 360 -5.788 -5.601 -0.957 1.00 0.25 N ATOM 886 CA ALA A 360 -6.007 -6.868 -0.283 1.00 0.27 C ATOM 887 C ALA A 360 -5.069 -7.000 0.905 1.00 0.25 C ATOM 888 O ALA A 360 -3.848 -6.885 0.764 1.00 0.31 O ATOM 889 CB ALA A 360 -5.808 -8.027 -1.248 1.00 0.31 C ATOM 0 H ALA A 360 -4.854 -5.494 -1.352 1.00 0.25 H new ATOM 0 HA ALA A 360 -7.035 -6.895 0.079 1.00 0.27 H new ATOM 0 HB1 ALA A 360 -5.976 -8.969 -0.725 1.00 0.31 H new ATOM 0 HB2 ALA A 360 -6.515 -7.939 -2.073 1.00 0.31 H new ATOM 0 HB3 ALA A 360 -4.790 -8.005 -1.638 1.00 0.31 H new ATOM 895 N ALA A 361 -5.645 -7.228 2.072 1.00 0.26 N ATOM 896 CA ALA A 361 -4.880 -7.346 3.299 1.00 0.27 C ATOM 897 C ALA A 361 -4.789 -8.799 3.740 1.00 0.25 C ATOM 898 O ALA A 361 -5.808 -9.466 3.925 1.00 0.38 O ATOM 899 CB ALA A 361 -5.521 -6.503 4.387 1.00 0.35 C ATOM 0 H ALA A 361 -6.652 -7.336 2.195 1.00 0.26 H new ATOM 0 HA ALA A 361 -3.868 -6.984 3.116 1.00 0.27 H new ATOM 0 HB1 ALA A 361 -4.943 -6.595 5.307 1.00 0.35 H new ATOM 0 HB2 ALA A 361 -5.541 -5.459 4.074 1.00 0.35 H new ATOM 0 HB3 ALA A 361 -6.540 -6.849 4.563 1.00 0.35 H new ATOM 905 N SER A 362 -3.572 -9.295 3.889 1.00 0.32 N ATOM 906 CA SER A 362 -3.350 -10.654 4.352 1.00 0.40 C ATOM 907 C SER A 362 -2.160 -10.696 5.309 1.00 0.42 C ATOM 908 O SER A 362 -1.256 -9.863 5.217 1.00 0.44 O ATOM 909 CB SER A 362 -3.113 -11.580 3.155 1.00 0.47 C ATOM 910 OG SER A 362 -4.210 -11.536 2.255 1.00 1.00 O ATOM 0 H SER A 362 -2.718 -8.773 3.695 1.00 0.32 H new ATOM 0 HA SER A 362 -4.234 -10.998 4.888 1.00 0.40 H new ATOM 0 HB2 SER A 362 -2.201 -11.285 2.637 1.00 0.47 H new ATOM 0 HB3 SER A 362 -2.965 -12.602 3.504 1.00 0.47 H new ATOM 0 HG SER A 362 -4.036 -12.133 1.498 1.00 1.00 H new ATOM 916 N PRO A 363 -2.148 -11.657 6.249 1.00 0.46 N ATOM 917 CA PRO A 363 -1.071 -11.788 7.241 1.00 0.48 C ATOM 918 C PRO A 363 0.266 -12.218 6.632 1.00 0.45 C ATOM 919 O PRO A 363 1.298 -12.208 7.309 1.00 0.66 O ATOM 920 CB PRO A 363 -1.591 -12.867 8.196 1.00 0.58 C ATOM 921 CG PRO A 363 -2.566 -13.651 7.390 1.00 0.60 C ATOM 922 CD PRO A 363 -3.198 -12.676 6.439 1.00 0.53 C ATOM 0 HA PRO A 363 -0.859 -10.832 7.720 1.00 0.48 H new ATOM 0 HB2 PRO A 363 -0.780 -13.498 8.559 1.00 0.58 H new ATOM 0 HB3 PRO A 363 -2.067 -12.425 9.071 1.00 0.58 H new ATOM 0 HG2 PRO A 363 -2.067 -14.455 6.849 1.00 0.60 H new ATOM 0 HG3 PRO A 363 -3.317 -14.115 8.030 1.00 0.60 H new ATOM 0 HD2 PRO A 363 -3.471 -13.152 5.497 1.00 0.53 H new ATOM 0 HD3 PRO A 363 -4.108 -12.243 6.853 1.00 0.53 H new ATOM 930 N LYS A 364 0.248 -12.604 5.363 1.00 0.44 N ATOM 931 CA LYS A 364 1.475 -12.981 4.671 1.00 0.44 C ATOM 932 C LYS A 364 1.975 -11.842 3.788 1.00 0.37 C ATOM 933 O LYS A 364 3.179 -11.608 3.678 1.00 0.40 O ATOM 934 CB LYS A 364 1.243 -14.224 3.805 1.00 0.56 C ATOM 935 CG LYS A 364 2.436 -14.588 2.931 1.00 0.72 C ATOM 936 CD LYS A 364 2.063 -15.604 1.865 1.00 0.98 C ATOM 937 CE LYS A 364 3.196 -15.801 0.869 1.00 1.26 C ATOM 938 NZ LYS A 364 2.792 -16.680 -0.262 1.00 2.08 N ATOM 0 H LYS A 364 -0.597 -12.664 4.794 1.00 0.44 H new ATOM 0 HA LYS A 364 2.227 -13.201 5.428 1.00 0.44 H new ATOM 0 HB2 LYS A 364 1.006 -15.069 4.452 1.00 0.56 H new ATOM 0 HB3 LYS A 364 0.374 -14.056 3.168 1.00 0.56 H new ATOM 0 HG2 LYS A 364 2.826 -13.688 2.455 1.00 0.72 H new ATOM 0 HG3 LYS A 364 3.234 -14.991 3.554 1.00 0.72 H new ATOM 0 HD2 LYS A 364 1.820 -16.556 2.336 1.00 0.98 H new ATOM 0 HD3 LYS A 364 1.168 -15.271 1.340 1.00 0.98 H new ATOM 0 HE2 LYS A 364 3.512 -14.832 0.482 1.00 1.26 H new ATOM 0 HE3 LYS A 364 4.056 -16.236 1.378 1.00 1.26 H new ATOM 0 HZ1 LYS A 364 3.591 -16.790 -0.919 1.00 2.08 H new ATOM 0 HZ2 LYS A 364 2.515 -17.613 0.105 1.00 2.08 H new ATOM 0 HZ3 LYS A 364 1.988 -16.252 -0.764 1.00 2.08 H new ATOM 952 N SER A 365 1.051 -11.118 3.175 1.00 0.35 N ATOM 953 CA SER A 365 1.411 -10.081 2.225 1.00 0.34 C ATOM 954 C SER A 365 0.285 -9.065 2.072 1.00 0.32 C ATOM 955 O SER A 365 -0.880 -9.363 2.332 1.00 0.52 O ATOM 956 CB SER A 365 1.736 -10.700 0.860 1.00 0.40 C ATOM 957 OG SER A 365 2.820 -11.609 0.950 1.00 1.32 O ATOM 0 H SER A 365 0.048 -11.231 3.319 1.00 0.35 H new ATOM 0 HA SER A 365 2.293 -9.567 2.607 1.00 0.34 H new ATOM 0 HB2 SER A 365 0.857 -11.216 0.474 1.00 0.40 H new ATOM 0 HB3 SER A 365 1.979 -9.910 0.149 1.00 0.40 H new ATOM 0 HG SER A 365 3.003 -11.989 0.065 1.00 1.32 H new ATOM 963 N PHE A 366 0.653 -7.868 1.657 1.00 0.19 N ATOM 964 CA PHE A 366 -0.305 -6.819 1.374 1.00 0.16 C ATOM 965 C PHE A 366 -0.195 -6.442 -0.097 1.00 0.16 C ATOM 966 O PHE A 366 0.910 -6.335 -0.629 1.00 0.28 O ATOM 967 CB PHE A 366 -0.031 -5.606 2.268 1.00 0.19 C ATOM 968 CG PHE A 366 -0.991 -4.470 2.070 1.00 0.20 C ATOM 969 CD1 PHE A 366 -2.296 -4.565 2.519 1.00 0.23 C ATOM 970 CD2 PHE A 366 -0.585 -3.307 1.439 1.00 0.25 C ATOM 971 CE1 PHE A 366 -3.181 -3.521 2.342 1.00 0.28 C ATOM 972 CE2 PHE A 366 -1.465 -2.260 1.258 1.00 0.29 C ATOM 973 CZ PHE A 366 -2.765 -2.366 1.711 1.00 0.30 C ATOM 0 H PHE A 366 1.625 -7.596 1.507 1.00 0.19 H new ATOM 0 HA PHE A 366 -1.316 -7.169 1.581 1.00 0.16 H new ATOM 0 HB2 PHE A 366 -0.068 -5.921 3.311 1.00 0.19 H new ATOM 0 HB3 PHE A 366 0.981 -5.249 2.078 1.00 0.19 H new ATOM 0 HD1 PHE A 366 -2.626 -5.467 3.014 1.00 0.23 H new ATOM 0 HD2 PHE A 366 0.431 -3.218 1.085 1.00 0.25 H new ATOM 0 HE1 PHE A 366 -4.197 -3.608 2.697 1.00 0.28 H new ATOM 0 HE2 PHE A 366 -1.137 -1.358 0.762 1.00 0.29 H new ATOM 0 HZ PHE A 366 -3.455 -1.547 1.572 1.00 0.30 H new ATOM 983 N THR A 367 -1.324 -6.280 -0.765 1.00 0.17 N ATOM 984 CA THR A 367 -1.309 -5.970 -2.184 1.00 0.19 C ATOM 985 C THR A 367 -2.223 -4.794 -2.517 1.00 0.19 C ATOM 986 O THR A 367 -3.416 -4.812 -2.217 1.00 0.27 O ATOM 987 CB THR A 367 -1.715 -7.195 -3.028 1.00 0.26 C ATOM 988 OG1 THR A 367 -0.884 -8.314 -2.687 1.00 0.34 O ATOM 989 CG2 THR A 367 -1.580 -6.902 -4.514 1.00 0.32 C ATOM 0 H THR A 367 -2.254 -6.357 -0.353 1.00 0.17 H new ATOM 0 HA THR A 367 -0.285 -5.691 -2.432 1.00 0.19 H new ATOM 0 HB THR A 367 -2.758 -7.427 -2.813 1.00 0.26 H new ATOM 0 HG1 THR A 367 -0.205 -8.441 -3.382 1.00 0.34 H new ATOM 0 HG21 THR A 367 -1.872 -7.782 -5.086 1.00 0.32 H new ATOM 0 HG22 THR A 367 -2.226 -6.065 -4.780 1.00 0.32 H new ATOM 0 HG23 THR A 367 -0.545 -6.648 -4.742 1.00 0.32 H new ATOM 997 N LEU A 368 -1.640 -3.773 -3.131 1.00 0.20 N ATOM 998 CA LEU A 368 -2.388 -2.614 -3.595 1.00 0.22 C ATOM 999 C LEU A 368 -2.717 -2.750 -5.076 1.00 0.23 C ATOM 1000 O LEU A 368 -1.924 -3.296 -5.848 1.00 0.33 O ATOM 1001 CB LEU A 368 -1.581 -1.330 -3.372 1.00 0.24 C ATOM 1002 CG LEU A 368 -1.499 -0.839 -1.925 1.00 0.25 C ATOM 1003 CD1 LEU A 368 -0.499 0.300 -1.807 1.00 0.29 C ATOM 1004 CD2 LEU A 368 -2.868 -0.387 -1.444 1.00 0.25 C ATOM 0 H LEU A 368 -0.639 -3.725 -3.321 1.00 0.20 H new ATOM 0 HA LEU A 368 -3.315 -2.560 -3.024 1.00 0.22 H new ATOM 0 HB2 LEU A 368 -0.567 -1.492 -3.739 1.00 0.24 H new ATOM 0 HB3 LEU A 368 -2.018 -0.538 -3.980 1.00 0.24 H new ATOM 0 HG LEU A 368 -1.162 -1.664 -1.298 1.00 0.25 H new ATOM 0 HD11 LEU A 368 -0.453 0.638 -0.772 1.00 0.29 H new ATOM 0 HD12 LEU A 368 0.486 -0.047 -2.120 1.00 0.29 H new ATOM 0 HD13 LEU A 368 -0.812 1.127 -2.445 1.00 0.29 H new ATOM 0 HD21 LEU A 368 -2.795 -0.040 -0.413 1.00 0.25 H new ATOM 0 HD22 LEU A 368 -3.226 0.426 -2.076 1.00 0.25 H new ATOM 0 HD23 LEU A 368 -3.566 -1.222 -1.497 1.00 0.25 H new ATOM 1016 N ASP A 369 -3.894 -2.275 -5.456 1.00 0.21 N ATOM 1017 CA ASP A 369 -4.285 -2.202 -6.858 1.00 0.24 C ATOM 1018 C ASP A 369 -4.775 -0.798 -7.183 1.00 0.21 C ATOM 1019 O ASP A 369 -5.621 -0.240 -6.476 1.00 0.22 O ATOM 1020 CB ASP A 369 -5.375 -3.225 -7.186 1.00 0.31 C ATOM 1021 CG ASP A 369 -5.933 -3.042 -8.587 1.00 0.99 C ATOM 1022 OD1 ASP A 369 -5.137 -2.932 -9.538 1.00 1.52 O ATOM 1023 OD2 ASP A 369 -7.174 -3.022 -8.743 1.00 1.47 O ATOM 0 H ASP A 369 -4.602 -1.931 -4.807 1.00 0.21 H new ATOM 0 HA ASP A 369 -3.412 -2.434 -7.467 1.00 0.24 H new ATOM 0 HB2 ASP A 369 -4.967 -4.231 -7.088 1.00 0.31 H new ATOM 0 HB3 ASP A 369 -6.184 -3.137 -6.461 1.00 0.31 H new ATOM 1028 N PHE A 370 -4.229 -0.227 -8.241 1.00 0.25 N ATOM 1029 CA PHE A 370 -4.553 1.135 -8.630 1.00 0.26 C ATOM 1030 C PHE A 370 -5.352 1.143 -9.926 1.00 0.31 C ATOM 1031 O PHE A 370 -5.616 2.200 -10.503 1.00 0.35 O ATOM 1032 CB PHE A 370 -3.266 1.950 -8.775 1.00 0.31 C ATOM 1033 CG PHE A 370 -2.421 1.917 -7.535 1.00 0.32 C ATOM 1034 CD1 PHE A 370 -2.689 2.767 -6.476 1.00 0.35 C ATOM 1035 CD2 PHE A 370 -1.372 1.020 -7.420 1.00 0.37 C ATOM 1036 CE1 PHE A 370 -1.929 2.723 -5.325 1.00 0.41 C ATOM 1037 CE2 PHE A 370 -0.606 0.972 -6.272 1.00 0.42 C ATOM 1038 CZ PHE A 370 -0.886 1.825 -5.223 1.00 0.44 C ATOM 0 H PHE A 370 -3.554 -0.689 -8.851 1.00 0.25 H new ATOM 0 HA PHE A 370 -5.169 1.591 -7.855 1.00 0.26 H new ATOM 0 HB2 PHE A 370 -2.688 1.564 -9.615 1.00 0.31 H new ATOM 0 HB3 PHE A 370 -3.519 2.984 -9.011 1.00 0.31 H new ATOM 0 HD1 PHE A 370 -3.503 3.473 -6.551 1.00 0.35 H new ATOM 0 HD2 PHE A 370 -1.150 0.350 -8.238 1.00 0.37 H new ATOM 0 HE1 PHE A 370 -2.150 3.390 -4.505 1.00 0.41 H new ATOM 0 HE2 PHE A 370 0.210 0.269 -6.195 1.00 0.42 H new ATOM 0 HZ PHE A 370 -0.289 1.790 -4.323 1.00 0.44 H new ATOM 1048 N GLY A 371 -5.724 -0.048 -10.378 1.00 0.40 N ATOM 1049 CA GLY A 371 -6.583 -0.181 -11.534 1.00 0.50 C ATOM 1050 C GLY A 371 -5.953 0.330 -12.815 1.00 0.49 C ATOM 1051 O GLY A 371 -5.091 -0.324 -13.403 1.00 0.58 O ATOM 0 H GLY A 371 -5.441 -0.933 -9.957 1.00 0.40 H new ATOM 0 HA2 GLY A 371 -6.848 -1.231 -11.662 1.00 0.50 H new ATOM 0 HA3 GLY A 371 -7.511 0.362 -11.352 1.00 0.50 H new ATOM 1055 N ASP A 372 -6.376 1.509 -13.238 1.00 0.49 N ATOM 1056 CA ASP A 372 -5.964 2.062 -14.521 1.00 0.56 C ATOM 1057 C ASP A 372 -4.861 3.090 -14.335 1.00 0.55 C ATOM 1058 O ASP A 372 -4.483 3.791 -15.278 1.00 0.72 O ATOM 1059 CB ASP A 372 -7.157 2.705 -15.229 1.00 0.71 C ATOM 1060 CG ASP A 372 -8.369 1.802 -15.252 1.00 1.57 C ATOM 1061 OD1 ASP A 372 -8.371 0.825 -16.031 1.00 1.89 O ATOM 1062 OD2 ASP A 372 -9.334 2.068 -14.504 1.00 2.38 O ATOM 0 H ASP A 372 -7.010 2.107 -12.708 1.00 0.49 H new ATOM 0 HA ASP A 372 -5.581 1.247 -15.135 1.00 0.56 H new ATOM 0 HB2 ASP A 372 -7.413 3.639 -14.729 1.00 0.71 H new ATOM 0 HB3 ASP A 372 -6.876 2.958 -16.251 1.00 0.71 H new ATOM 1067 N TYR A 373 -4.338 3.172 -13.121 1.00 0.52 N ATOM 1068 CA TYR A 373 -3.279 4.121 -12.821 1.00 0.51 C ATOM 1069 C TYR A 373 -1.920 3.518 -13.161 1.00 0.52 C ATOM 1070 O TYR A 373 -0.987 4.235 -13.522 1.00 0.60 O ATOM 1071 CB TYR A 373 -3.326 4.538 -11.345 1.00 0.50 C ATOM 1072 CG TYR A 373 -2.254 5.536 -10.962 1.00 0.51 C ATOM 1073 CD1 TYR A 373 -2.376 6.882 -11.290 1.00 0.56 C ATOM 1074 CD2 TYR A 373 -1.114 5.130 -10.280 1.00 0.56 C ATOM 1075 CE1 TYR A 373 -1.392 7.792 -10.952 1.00 0.64 C ATOM 1076 CE2 TYR A 373 -0.129 6.035 -9.936 1.00 0.64 C ATOM 1077 CZ TYR A 373 -0.271 7.363 -10.274 1.00 0.67 C ATOM 1078 OH TYR A 373 0.719 8.262 -9.942 1.00 0.79 O ATOM 0 H TYR A 373 -4.629 2.595 -12.331 1.00 0.52 H new ATOM 0 HA TYR A 373 -3.430 5.011 -13.431 1.00 0.51 H new ATOM 0 HB2 TYR A 373 -4.304 4.967 -11.129 1.00 0.50 H new ATOM 0 HB3 TYR A 373 -3.223 3.650 -10.722 1.00 0.50 H new ATOM 0 HD1 TYR A 373 -3.255 7.222 -11.818 1.00 0.56 H new ATOM 0 HD2 TYR A 373 -0.996 4.090 -10.014 1.00 0.56 H new ATOM 0 HE1 TYR A 373 -1.501 8.833 -11.218 1.00 0.64 H new ATOM 0 HE2 TYR A 373 0.750 5.703 -9.404 1.00 0.64 H new ATOM 0 HH TYR A 373 1.438 7.796 -9.466 1.00 0.79 H new ATOM 1088 N GLN A 374 -1.813 2.200 -13.057 1.00 0.53 N ATOM 1089 CA GLN A 374 -0.580 1.511 -13.407 1.00 0.59 C ATOM 1090 C GLN A 374 -0.859 0.057 -13.766 1.00 0.60 C ATOM 1091 O GLN A 374 -1.900 -0.495 -13.404 1.00 0.59 O ATOM 1092 CB GLN A 374 0.437 1.581 -12.261 1.00 0.63 C ATOM 1093 CG GLN A 374 0.000 0.864 -10.993 1.00 0.59 C ATOM 1094 CD GLN A 374 1.112 0.759 -9.965 1.00 0.69 C ATOM 1095 OE1 GLN A 374 1.169 -0.195 -9.191 1.00 1.09 O ATOM 1096 NE2 GLN A 374 2.007 1.735 -9.946 1.00 0.85 N ATOM 0 H GLN A 374 -2.563 1.589 -12.734 1.00 0.53 H new ATOM 0 HA GLN A 374 -0.156 2.014 -14.276 1.00 0.59 H new ATOM 0 HB2 GLN A 374 1.380 1.152 -12.601 1.00 0.63 H new ATOM 0 HB3 GLN A 374 0.630 2.628 -12.025 1.00 0.63 H new ATOM 0 HG2 GLN A 374 -0.846 1.394 -10.554 1.00 0.59 H new ATOM 0 HG3 GLN A 374 -0.349 -0.137 -11.248 1.00 0.59 H new ATOM 0 HE21 GLN A 374 1.929 2.511 -10.603 1.00 0.85 H new ATOM 0 HE22 GLN A 374 2.774 1.710 -9.275 1.00 0.85 H new ATOM 1105 N ASP A 375 0.069 -0.547 -14.495 1.00 0.74 N ATOM 1106 CA ASP A 375 -0.026 -1.961 -14.834 1.00 0.78 C ATOM 1107 C ASP A 375 0.573 -2.803 -13.718 1.00 0.64 C ATOM 1108 O ASP A 375 1.552 -2.401 -13.080 1.00 0.73 O ATOM 1109 CB ASP A 375 0.688 -2.267 -16.159 1.00 1.06 C ATOM 1110 CG ASP A 375 2.188 -2.040 -16.101 1.00 1.71 C ATOM 1111 OD1 ASP A 375 2.922 -2.959 -15.685 1.00 2.30 O ATOM 1112 OD2 ASP A 375 2.644 -0.945 -16.493 1.00 2.21 O ATOM 0 H ASP A 375 0.897 -0.080 -14.864 1.00 0.74 H new ATOM 0 HA ASP A 375 -1.081 -2.209 -14.952 1.00 0.78 H new ATOM 0 HB2 ASP A 375 0.495 -3.303 -16.436 1.00 1.06 H new ATOM 0 HB3 ASP A 375 0.263 -1.642 -16.945 1.00 1.06 H new ATOM 1117 N GLY A 376 -0.014 -3.965 -13.483 1.00 0.57 N ATOM 1118 CA GLY A 376 0.448 -4.824 -12.416 1.00 0.53 C ATOM 1119 C GLY A 376 -0.139 -4.423 -11.082 1.00 0.52 C ATOM 1120 O GLY A 376 -0.995 -3.541 -11.018 1.00 0.70 O ATOM 0 H GLY A 376 -0.805 -4.329 -14.014 1.00 0.57 H new ATOM 0 HA2 GLY A 376 0.178 -5.857 -12.637 1.00 0.53 H new ATOM 0 HA3 GLY A 376 1.536 -4.784 -12.362 1.00 0.53 H new ATOM 1124 N TYR A 377 0.304 -5.070 -10.019 1.00 0.46 N ATOM 1125 CA TYR A 377 -0.154 -4.742 -8.681 1.00 0.46 C ATOM 1126 C TYR A 377 1.032 -4.371 -7.805 1.00 0.37 C ATOM 1127 O TYR A 377 2.172 -4.319 -8.277 1.00 0.38 O ATOM 1128 CB TYR A 377 -0.903 -5.923 -8.055 1.00 0.53 C ATOM 1129 CG TYR A 377 -2.066 -6.422 -8.878 1.00 0.63 C ATOM 1130 CD1 TYR A 377 -3.254 -5.704 -8.949 1.00 0.83 C ATOM 1131 CD2 TYR A 377 -1.979 -7.617 -9.578 1.00 0.64 C ATOM 1132 CE1 TYR A 377 -4.320 -6.164 -9.699 1.00 0.97 C ATOM 1133 CE2 TYR A 377 -3.038 -8.081 -10.329 1.00 0.76 C ATOM 1134 CZ TYR A 377 -4.207 -7.353 -10.387 1.00 0.91 C ATOM 1135 OH TYR A 377 -5.265 -7.820 -11.136 1.00 1.06 O ATOM 0 H TYR A 377 0.984 -5.829 -10.057 1.00 0.46 H new ATOM 0 HA TYR A 377 -0.837 -3.895 -8.752 1.00 0.46 H new ATOM 0 HB2 TYR A 377 -0.202 -6.743 -7.901 1.00 0.53 H new ATOM 0 HB3 TYR A 377 -1.268 -5.627 -7.071 1.00 0.53 H new ATOM 0 HD1 TYR A 377 -3.346 -4.773 -8.410 1.00 0.83 H new ATOM 0 HD2 TYR A 377 -1.067 -8.193 -9.534 1.00 0.64 H new ATOM 0 HE1 TYR A 377 -5.237 -5.595 -9.746 1.00 0.97 H new ATOM 0 HE2 TYR A 377 -2.952 -9.012 -10.870 1.00 0.76 H new ATOM 0 HH TYR A 377 -5.018 -8.670 -11.557 1.00 1.06 H new ATOM 1145 N TYR A 378 0.767 -4.111 -6.540 1.00 0.32 N ATOM 1146 CA TYR A 378 1.825 -3.845 -5.585 1.00 0.29 C ATOM 1147 C TYR A 378 1.748 -4.843 -4.435 1.00 0.24 C ATOM 1148 O TYR A 378 1.005 -4.643 -3.477 1.00 0.26 O ATOM 1149 CB TYR A 378 1.729 -2.407 -5.066 1.00 0.31 C ATOM 1150 CG TYR A 378 2.808 -2.041 -4.073 1.00 0.32 C ATOM 1151 CD1 TYR A 378 4.149 -2.246 -4.370 1.00 0.36 C ATOM 1152 CD2 TYR A 378 2.485 -1.490 -2.841 1.00 0.37 C ATOM 1153 CE1 TYR A 378 5.136 -1.913 -3.465 1.00 0.41 C ATOM 1154 CE2 TYR A 378 3.465 -1.153 -1.932 1.00 0.40 C ATOM 1155 CZ TYR A 378 4.789 -1.368 -2.246 1.00 0.41 C ATOM 1156 OH TYR A 378 5.772 -1.031 -1.344 1.00 0.47 O ATOM 0 H TYR A 378 -0.174 -4.078 -6.149 1.00 0.32 H new ATOM 0 HA TYR A 378 2.788 -3.960 -6.082 1.00 0.29 H new ATOM 0 HB2 TYR A 378 1.780 -1.722 -5.912 1.00 0.31 H new ATOM 0 HB3 TYR A 378 0.755 -2.264 -4.598 1.00 0.31 H new ATOM 0 HD1 TYR A 378 4.423 -2.672 -5.324 1.00 0.36 H new ATOM 0 HD2 TYR A 378 1.448 -1.322 -2.590 1.00 0.37 H new ATOM 0 HE1 TYR A 378 6.175 -2.078 -3.710 1.00 0.41 H new ATOM 0 HE2 TYR A 378 3.196 -0.723 -0.979 1.00 0.40 H new ATOM 0 HH TYR A 378 6.652 -1.195 -1.743 1.00 0.47 H new ATOM 1166 N SER A 379 2.492 -5.933 -4.557 1.00 0.26 N ATOM 1167 CA SER A 379 2.476 -6.987 -3.553 1.00 0.27 C ATOM 1168 C SER A 379 3.737 -6.940 -2.699 1.00 0.24 C ATOM 1169 O SER A 379 4.852 -7.079 -3.207 1.00 0.29 O ATOM 1170 CB SER A 379 2.355 -8.355 -4.228 1.00 0.36 C ATOM 1171 OG SER A 379 1.184 -8.428 -5.027 1.00 1.06 O ATOM 0 H SER A 379 3.116 -6.111 -5.344 1.00 0.26 H new ATOM 0 HA SER A 379 1.614 -6.829 -2.905 1.00 0.27 H new ATOM 0 HB2 SER A 379 3.233 -8.538 -4.847 1.00 0.36 H new ATOM 0 HB3 SER A 379 2.331 -9.138 -3.470 1.00 0.36 H new ATOM 0 HG SER A 379 1.130 -9.311 -5.449 1.00 1.06 H new ATOM 1177 N VAL A 380 3.553 -6.738 -1.406 1.00 0.22 N ATOM 1178 CA VAL A 380 4.664 -6.718 -0.470 1.00 0.24 C ATOM 1179 C VAL A 380 4.460 -7.747 0.630 1.00 0.23 C ATOM 1180 O VAL A 380 3.371 -7.861 1.194 1.00 0.30 O ATOM 1181 CB VAL A 380 4.860 -5.326 0.168 1.00 0.27 C ATOM 1182 CG1 VAL A 380 5.394 -4.347 -0.857 1.00 0.33 C ATOM 1183 CG2 VAL A 380 3.562 -4.806 0.768 1.00 0.29 C ATOM 0 H VAL A 380 2.640 -6.585 -0.978 1.00 0.22 H new ATOM 0 HA VAL A 380 5.559 -6.963 -1.041 1.00 0.24 H new ATOM 0 HB VAL A 380 5.587 -5.426 0.974 1.00 0.27 H new ATOM 0 HG11 VAL A 380 5.527 -3.370 -0.392 1.00 0.33 H new ATOM 0 HG12 VAL A 380 6.353 -4.703 -1.235 1.00 0.33 H new ATOM 0 HG13 VAL A 380 4.687 -4.263 -1.683 1.00 0.33 H new ATOM 0 HG21 VAL A 380 3.733 -3.824 1.209 1.00 0.29 H new ATOM 0 HG22 VAL A 380 2.806 -4.726 -0.013 1.00 0.29 H new ATOM 0 HG23 VAL A 380 3.216 -5.495 1.538 1.00 0.29 H new ATOM 1193 N GLN A 381 5.506 -8.503 0.917 1.00 0.22 N ATOM 1194 CA GLN A 381 5.469 -9.462 2.005 1.00 0.24 C ATOM 1195 C GLN A 381 5.563 -8.724 3.327 1.00 0.24 C ATOM 1196 O GLN A 381 6.540 -8.022 3.587 1.00 0.32 O ATOM 1197 CB GLN A 381 6.610 -10.470 1.876 1.00 0.34 C ATOM 1198 CG GLN A 381 6.653 -11.492 3.002 1.00 0.43 C ATOM 1199 CD GLN A 381 7.782 -12.491 2.842 1.00 0.72 C ATOM 1200 OE1 GLN A 381 8.829 -12.182 2.274 1.00 1.47 O ATOM 1201 NE2 GLN A 381 7.584 -13.692 3.352 1.00 0.94 N ATOM 0 H GLN A 381 6.391 -8.470 0.411 1.00 0.22 H new ATOM 0 HA GLN A 381 4.529 -10.012 1.963 1.00 0.24 H new ATOM 0 HB2 GLN A 381 6.514 -10.994 0.925 1.00 0.34 H new ATOM 0 HB3 GLN A 381 7.557 -9.932 1.849 1.00 0.34 H new ATOM 0 HG2 GLN A 381 6.765 -10.973 3.954 1.00 0.43 H new ATOM 0 HG3 GLN A 381 5.703 -12.026 3.039 1.00 0.43 H new ATOM 0 HE21 GLN A 381 6.702 -13.910 3.816 1.00 0.94 H new ATOM 0 HE22 GLN A 381 8.313 -14.402 3.283 1.00 0.94 H new ATOM 1210 N THR A 382 4.538 -8.861 4.143 1.00 0.21 N ATOM 1211 CA THR A 382 4.496 -8.185 5.421 1.00 0.26 C ATOM 1212 C THR A 382 3.503 -8.862 6.348 1.00 0.25 C ATOM 1213 O THR A 382 2.431 -9.300 5.926 1.00 0.30 O ATOM 1214 CB THR A 382 4.134 -6.690 5.268 1.00 0.30 C ATOM 1215 OG1 THR A 382 4.031 -6.071 6.559 1.00 0.42 O ATOM 1216 CG2 THR A 382 2.825 -6.512 4.510 1.00 0.28 C ATOM 0 H THR A 382 3.721 -9.437 3.942 1.00 0.21 H new ATOM 0 HA THR A 382 5.495 -8.247 5.853 1.00 0.26 H new ATOM 0 HB THR A 382 4.930 -6.212 4.697 1.00 0.30 H new ATOM 0 HG1 THR A 382 3.803 -5.124 6.451 1.00 0.42 H new ATOM 0 HG21 THR A 382 2.599 -5.450 4.419 1.00 0.28 H new ATOM 0 HG22 THR A 382 2.918 -6.949 3.516 1.00 0.28 H new ATOM 0 HG23 THR A 382 2.020 -7.009 5.052 1.00 0.28 H new ATOM 1224 N THR A 383 3.873 -8.954 7.609 1.00 0.31 N ATOM 1225 CA THR A 383 3.027 -9.566 8.607 1.00 0.37 C ATOM 1226 C THR A 383 2.103 -8.534 9.245 1.00 0.36 C ATOM 1227 O THR A 383 1.275 -8.867 10.091 1.00 0.46 O ATOM 1228 CB THR A 383 3.883 -10.252 9.683 1.00 0.50 C ATOM 1229 OG1 THR A 383 4.983 -9.403 10.041 1.00 0.55 O ATOM 1230 CG2 THR A 383 4.413 -11.583 9.175 1.00 0.55 C ATOM 0 H THR A 383 4.763 -8.608 7.967 1.00 0.31 H new ATOM 0 HA THR A 383 2.410 -10.318 8.115 1.00 0.37 H new ATOM 0 HB THR A 383 3.260 -10.433 10.559 1.00 0.50 H new ATOM 0 HG1 THR A 383 5.526 -9.843 10.728 1.00 0.55 H new ATOM 0 HG21 THR A 383 5.017 -12.054 9.951 1.00 0.55 H new ATOM 0 HG22 THR A 383 3.577 -12.234 8.920 1.00 0.55 H new ATOM 0 HG23 THR A 383 5.026 -11.416 8.289 1.00 0.55 H new ATOM 1238 N GLU A 384 2.241 -7.282 8.818 1.00 0.31 N ATOM 1239 CA GLU A 384 1.433 -6.192 9.351 1.00 0.35 C ATOM 1240 C GLU A 384 0.530 -5.612 8.269 1.00 0.28 C ATOM 1241 O GLU A 384 -0.008 -4.514 8.420 1.00 0.27 O ATOM 1242 CB GLU A 384 2.334 -5.095 9.920 1.00 0.46 C ATOM 1243 CG GLU A 384 3.220 -5.572 11.057 1.00 0.57 C ATOM 1244 CD GLU A 384 4.104 -4.479 11.617 1.00 0.90 C ATOM 1245 OE1 GLU A 384 3.669 -3.781 12.557 1.00 1.39 O ATOM 1246 OE2 GLU A 384 5.243 -4.321 11.131 1.00 0.95 O ATOM 0 H GLU A 384 2.908 -6.997 8.101 1.00 0.31 H new ATOM 0 HA GLU A 384 0.807 -6.590 10.150 1.00 0.35 H new ATOM 0 HB2 GLU A 384 2.962 -4.700 9.121 1.00 0.46 H new ATOM 0 HB3 GLU A 384 1.713 -4.272 10.274 1.00 0.46 H new ATOM 0 HG2 GLU A 384 2.594 -5.970 11.856 1.00 0.57 H new ATOM 0 HG3 GLU A 384 3.845 -6.392 10.704 1.00 0.57 H new ATOM 1253 N GLY A 385 0.353 -6.369 7.189 1.00 0.27 N ATOM 1254 CA GLY A 385 -0.456 -5.912 6.067 1.00 0.27 C ATOM 1255 C GLY A 385 -1.878 -5.565 6.466 1.00 0.26 C ATOM 1256 O GLY A 385 -2.495 -4.672 5.883 1.00 0.27 O ATOM 0 H GLY A 385 0.758 -7.297 7.069 1.00 0.27 H new ATOM 0 HA2 GLY A 385 0.014 -5.036 5.620 1.00 0.27 H new ATOM 0 HA3 GLY A 385 -0.478 -6.688 5.302 1.00 0.27 H new ATOM 1260 N GLU A 386 -2.389 -6.265 7.471 1.00 0.30 N ATOM 1261 CA GLU A 386 -3.732 -6.023 7.977 1.00 0.35 C ATOM 1262 C GLU A 386 -3.842 -4.607 8.539 1.00 0.31 C ATOM 1263 O GLU A 386 -4.832 -3.903 8.313 1.00 0.36 O ATOM 1264 CB GLU A 386 -4.063 -7.041 9.068 1.00 0.44 C ATOM 1265 CG GLU A 386 -5.544 -7.151 9.380 1.00 0.53 C ATOM 1266 CD GLU A 386 -6.333 -7.715 8.218 1.00 1.40 C ATOM 1267 OE1 GLU A 386 -6.264 -8.942 7.994 1.00 2.28 O ATOM 1268 OE2 GLU A 386 -7.020 -6.937 7.521 1.00 1.77 O ATOM 0 H GLU A 386 -1.888 -7.011 7.954 1.00 0.30 H new ATOM 0 HA GLU A 386 -4.441 -6.129 7.156 1.00 0.35 H new ATOM 0 HB2 GLU A 386 -3.693 -8.020 8.762 1.00 0.44 H new ATOM 0 HB3 GLU A 386 -3.529 -6.769 9.979 1.00 0.44 H new ATOM 0 HG2 GLU A 386 -5.683 -7.787 10.254 1.00 0.53 H new ATOM 0 HG3 GLU A 386 -5.933 -6.166 9.637 1.00 0.53 H new ATOM 1275 N GLN A 387 -2.803 -4.191 9.257 1.00 0.29 N ATOM 1276 CA GLN A 387 -2.769 -2.871 9.873 1.00 0.30 C ATOM 1277 C GLN A 387 -2.632 -1.792 8.810 1.00 0.27 C ATOM 1278 O GLN A 387 -3.220 -0.717 8.926 1.00 0.31 O ATOM 1279 CB GLN A 387 -1.617 -2.763 10.880 1.00 0.35 C ATOM 1280 CG GLN A 387 -1.850 -3.518 12.183 1.00 0.45 C ATOM 1281 CD GLN A 387 -1.768 -5.024 12.031 1.00 1.13 C ATOM 1282 OE1 GLN A 387 -2.764 -5.694 11.757 1.00 2.27 O ATOM 1283 NE2 GLN A 387 -0.581 -5.569 12.228 1.00 0.83 N ATOM 0 H GLN A 387 -1.969 -4.754 9.426 1.00 0.29 H new ATOM 0 HA GLN A 387 -3.708 -2.726 10.407 1.00 0.30 H new ATOM 0 HB2 GLN A 387 -0.706 -3.139 10.414 1.00 0.35 H new ATOM 0 HB3 GLN A 387 -1.447 -1.711 11.109 1.00 0.35 H new ATOM 0 HG2 GLN A 387 -1.113 -3.194 12.918 1.00 0.45 H new ATOM 0 HG3 GLN A 387 -2.831 -3.253 12.577 1.00 0.45 H new ATOM 0 HE21 GLN A 387 0.220 -4.979 12.453 1.00 0.83 H new ATOM 0 HE22 GLN A 387 -0.465 -6.580 12.155 1.00 0.83 H new ATOM 1292 N ILE A 388 -1.860 -2.092 7.771 1.00 0.24 N ATOM 1293 CA ILE A 388 -1.670 -1.166 6.661 1.00 0.23 C ATOM 1294 C ILE A 388 -3.005 -0.865 5.990 1.00 0.22 C ATOM 1295 O ILE A 388 -3.350 0.293 5.751 1.00 0.22 O ATOM 1296 CB ILE A 388 -0.696 -1.738 5.608 1.00 0.23 C ATOM 1297 CG1 ILE A 388 0.630 -2.132 6.264 1.00 0.27 C ATOM 1298 CG2 ILE A 388 -0.460 -0.724 4.494 1.00 0.24 C ATOM 1299 CD1 ILE A 388 1.603 -2.800 5.317 1.00 0.29 C ATOM 0 H ILE A 388 -1.354 -2.972 7.675 1.00 0.24 H new ATOM 0 HA ILE A 388 -1.244 -0.250 7.070 1.00 0.23 H new ATOM 0 HB ILE A 388 -1.144 -2.631 5.172 1.00 0.23 H new ATOM 0 HG12 ILE A 388 1.098 -1.240 6.682 1.00 0.27 H new ATOM 0 HG13 ILE A 388 0.427 -2.805 7.097 1.00 0.27 H new ATOM 0 HG21 ILE A 388 0.229 -1.143 3.760 1.00 0.24 H new ATOM 0 HG22 ILE A 388 -1.408 -0.489 4.009 1.00 0.24 H new ATOM 0 HG23 ILE A 388 -0.032 0.186 4.915 1.00 0.24 H new ATOM 0 HD11 ILE A 388 2.519 -3.050 5.853 1.00 0.29 H new ATOM 0 HD12 ILE A 388 1.156 -3.711 4.918 1.00 0.29 H new ATOM 0 HD13 ILE A 388 1.837 -2.121 4.497 1.00 0.29 H new ATOM 1311 N ALA A 389 -3.762 -1.920 5.716 1.00 0.22 N ATOM 1312 CA ALA A 389 -5.056 -1.789 5.061 1.00 0.24 C ATOM 1313 C ALA A 389 -6.022 -0.963 5.898 1.00 0.22 C ATOM 1314 O ALA A 389 -6.738 -0.106 5.375 1.00 0.23 O ATOM 1315 CB ALA A 389 -5.648 -3.159 4.796 1.00 0.28 C ATOM 0 H ALA A 389 -3.500 -2.880 5.939 1.00 0.22 H new ATOM 0 HA ALA A 389 -4.899 -1.272 4.115 1.00 0.24 H new ATOM 0 HB1 ALA A 389 -6.615 -3.049 4.306 1.00 0.28 H new ATOM 0 HB2 ALA A 389 -4.977 -3.727 4.151 1.00 0.28 H new ATOM 0 HB3 ALA A 389 -5.778 -3.688 5.740 1.00 0.28 H new ATOM 1321 N GLN A 390 -6.037 -1.232 7.196 1.00 0.22 N ATOM 1322 CA GLN A 390 -6.918 -0.527 8.117 1.00 0.25 C ATOM 1323 C GLN A 390 -6.524 0.944 8.207 1.00 0.21 C ATOM 1324 O GLN A 390 -7.374 1.822 8.352 1.00 0.23 O ATOM 1325 CB GLN A 390 -6.859 -1.178 9.501 1.00 0.34 C ATOM 1326 CG GLN A 390 -7.842 -0.591 10.502 1.00 0.50 C ATOM 1327 CD GLN A 390 -7.758 -1.265 11.858 1.00 1.15 C ATOM 1328 OE1 GLN A 390 -7.419 -2.442 11.960 1.00 1.99 O ATOM 1329 NE2 GLN A 390 -8.072 -0.527 12.908 1.00 1.61 N ATOM 0 H GLN A 390 -5.446 -1.937 7.637 1.00 0.22 H new ATOM 0 HA GLN A 390 -7.940 -0.589 7.742 1.00 0.25 H new ATOM 0 HB2 GLN A 390 -7.055 -2.245 9.398 1.00 0.34 H new ATOM 0 HB3 GLN A 390 -5.848 -1.076 9.897 1.00 0.34 H new ATOM 0 HG2 GLN A 390 -7.647 0.475 10.617 1.00 0.50 H new ATOM 0 HG3 GLN A 390 -8.855 -0.689 10.113 1.00 0.50 H new ATOM 0 HE21 GLN A 390 -8.349 0.447 12.783 1.00 1.61 H new ATOM 0 HE22 GLN A 390 -8.038 -0.931 13.844 1.00 1.61 H new ATOM 1338 N LEU A 391 -5.229 1.205 8.090 1.00 0.21 N ATOM 1339 CA LEU A 391 -4.709 2.558 8.191 1.00 0.22 C ATOM 1340 C LEU A 391 -5.102 3.387 6.969 1.00 0.20 C ATOM 1341 O LEU A 391 -5.543 4.529 7.104 1.00 0.22 O ATOM 1342 CB LEU A 391 -3.189 2.530 8.347 1.00 0.26 C ATOM 1343 CG LEU A 391 -2.548 3.884 8.640 1.00 0.27 C ATOM 1344 CD1 LEU A 391 -3.049 4.439 9.964 1.00 0.60 C ATOM 1345 CD2 LEU A 391 -1.035 3.764 8.648 1.00 0.63 C ATOM 0 H LEU A 391 -4.518 0.493 7.924 1.00 0.21 H new ATOM 0 HA LEU A 391 -5.146 3.026 9.073 1.00 0.22 H new ATOM 0 HB2 LEU A 391 -2.934 1.842 9.153 1.00 0.26 H new ATOM 0 HB3 LEU A 391 -2.752 2.128 7.433 1.00 0.26 H new ATOM 0 HG LEU A 391 -2.834 4.578 7.850 1.00 0.27 H new ATOM 0 HD11 LEU A 391 -2.580 5.404 10.155 1.00 0.60 H new ATOM 0 HD12 LEU A 391 -4.131 4.563 9.920 1.00 0.60 H new ATOM 0 HD13 LEU A 391 -2.795 3.748 10.768 1.00 0.60 H new ATOM 0 HD21 LEU A 391 -0.594 4.738 8.858 1.00 0.63 H new ATOM 0 HD22 LEU A 391 -0.730 3.054 9.417 1.00 0.63 H new ATOM 0 HD23 LEU A 391 -0.693 3.413 7.674 1.00 0.63 H new ATOM 1357 N ILE A 392 -4.952 2.805 5.779 1.00 0.18 N ATOM 1358 CA ILE A 392 -5.322 3.492 4.543 1.00 0.17 C ATOM 1359 C ILE A 392 -6.800 3.864 4.565 1.00 0.17 C ATOM 1360 O ILE A 392 -7.168 5.008 4.297 1.00 0.19 O ATOM 1361 CB ILE A 392 -5.035 2.633 3.289 1.00 0.17 C ATOM 1362 CG1 ILE A 392 -3.551 2.266 3.228 1.00 0.19 C ATOM 1363 CG2 ILE A 392 -5.455 3.376 2.021 1.00 0.19 C ATOM 1364 CD1 ILE A 392 -3.193 1.364 2.066 1.00 0.21 C ATOM 0 H ILE A 392 -4.579 1.865 5.646 1.00 0.18 H new ATOM 0 HA ILE A 392 -4.710 4.392 4.486 1.00 0.17 H new ATOM 0 HB ILE A 392 -5.619 1.715 3.356 1.00 0.17 H new ATOM 0 HG12 ILE A 392 -2.962 3.181 3.161 1.00 0.19 H new ATOM 0 HG13 ILE A 392 -3.269 1.773 4.159 1.00 0.19 H new ATOM 0 HG21 ILE A 392 -5.245 2.756 1.150 1.00 0.19 H new ATOM 0 HG22 ILE A 392 -6.522 3.593 2.063 1.00 0.19 H new ATOM 0 HG23 ILE A 392 -4.897 4.309 1.945 1.00 0.19 H new ATOM 0 HD11 ILE A 392 -2.125 1.147 2.089 1.00 0.21 H new ATOM 0 HD12 ILE A 392 -3.754 0.433 2.142 1.00 0.21 H new ATOM 0 HD13 ILE A 392 -3.442 1.862 1.129 1.00 0.21 H new ATOM 1376 N ALA A 393 -7.640 2.893 4.914 1.00 0.18 N ATOM 1377 CA ALA A 393 -9.077 3.119 5.001 1.00 0.21 C ATOM 1378 C ALA A 393 -9.396 4.169 6.066 1.00 0.23 C ATOM 1379 O ALA A 393 -10.389 4.889 5.964 1.00 0.29 O ATOM 1380 CB ALA A 393 -9.803 1.811 5.294 1.00 0.24 C ATOM 0 H ALA A 393 -7.349 1.942 5.141 1.00 0.18 H new ATOM 0 HA ALA A 393 -9.426 3.497 4.040 1.00 0.21 H new ATOM 0 HB1 ALA A 393 -10.875 1.996 5.356 1.00 0.24 H new ATOM 0 HB2 ALA A 393 -9.604 1.097 4.495 1.00 0.24 H new ATOM 0 HB3 ALA A 393 -9.450 1.403 6.241 1.00 0.24 H new ATOM 1386 N GLY A 394 -8.532 4.257 7.076 1.00 0.23 N ATOM 1387 CA GLY A 394 -8.704 5.238 8.131 1.00 0.27 C ATOM 1388 C GLY A 394 -8.503 6.660 7.641 1.00 0.28 C ATOM 1389 O GLY A 394 -9.323 7.538 7.917 1.00 0.35 O ATOM 0 H GLY A 394 -7.711 3.661 7.181 1.00 0.23 H new ATOM 0 HA2 GLY A 394 -9.704 5.141 8.554 1.00 0.27 H new ATOM 0 HA3 GLY A 394 -7.997 5.031 8.934 1.00 0.27 H new ATOM 1393 N TYR A 395 -7.411 6.894 6.915 1.00 0.27 N ATOM 1394 CA TYR A 395 -7.143 8.214 6.348 1.00 0.30 C ATOM 1395 C TYR A 395 -8.222 8.582 5.341 1.00 0.30 C ATOM 1396 O TYR A 395 -8.702 9.715 5.305 1.00 0.36 O ATOM 1397 CB TYR A 395 -5.784 8.253 5.651 1.00 0.31 C ATOM 1398 CG TYR A 395 -4.597 8.069 6.566 1.00 0.37 C ATOM 1399 CD1 TYR A 395 -4.402 8.891 7.671 1.00 0.48 C ATOM 1400 CD2 TYR A 395 -3.654 7.087 6.307 1.00 0.41 C ATOM 1401 CE1 TYR A 395 -3.301 8.730 8.493 1.00 0.58 C ATOM 1402 CE2 TYR A 395 -2.553 6.925 7.119 1.00 0.51 C ATOM 1403 CZ TYR A 395 -2.379 7.746 8.208 1.00 0.58 C ATOM 1404 OH TYR A 395 -1.269 7.584 9.004 1.00 0.70 O ATOM 0 H TYR A 395 -6.702 6.191 6.707 1.00 0.27 H new ATOM 0 HA TYR A 395 -7.139 8.930 7.170 1.00 0.30 H new ATOM 0 HB2 TYR A 395 -5.761 7.475 4.888 1.00 0.31 H new ATOM 0 HB3 TYR A 395 -5.683 9.208 5.136 1.00 0.31 H new ATOM 0 HD1 TYR A 395 -5.121 9.667 7.891 1.00 0.48 H new ATOM 0 HD2 TYR A 395 -3.785 6.438 5.454 1.00 0.41 H new ATOM 0 HE1 TYR A 395 -3.165 9.371 9.352 1.00 0.58 H new ATOM 0 HE2 TYR A 395 -1.828 6.155 6.901 1.00 0.51 H new ATOM 0 HH TYR A 395 -0.487 7.404 8.442 1.00 0.70 H new ATOM 1414 N ILE A 396 -8.597 7.604 4.532 1.00 0.27 N ATOM 1415 CA ILE A 396 -9.633 7.775 3.525 1.00 0.31 C ATOM 1416 C ILE A 396 -10.952 8.217 4.159 1.00 0.37 C ATOM 1417 O ILE A 396 -11.663 9.059 3.607 1.00 0.45 O ATOM 1418 CB ILE A 396 -9.817 6.466 2.727 1.00 0.33 C ATOM 1419 CG1 ILE A 396 -8.672 6.314 1.722 1.00 0.34 C ATOM 1420 CG2 ILE A 396 -11.169 6.419 2.027 1.00 0.38 C ATOM 1421 CD1 ILE A 396 -8.555 4.925 1.141 1.00 0.42 C ATOM 0 H ILE A 396 -8.192 6.668 4.555 1.00 0.27 H new ATOM 0 HA ILE A 396 -9.319 8.561 2.839 1.00 0.31 H new ATOM 0 HB ILE A 396 -9.793 5.629 3.425 1.00 0.33 H new ATOM 0 HG12 ILE A 396 -8.816 7.027 0.910 1.00 0.34 H new ATOM 0 HG13 ILE A 396 -7.734 6.574 2.212 1.00 0.34 H new ATOM 0 HG21 ILE A 396 -11.261 5.483 1.476 1.00 0.38 H new ATOM 0 HG22 ILE A 396 -11.965 6.483 2.769 1.00 0.38 H new ATOM 0 HG23 ILE A 396 -11.250 7.257 1.335 1.00 0.38 H new ATOM 0 HD11 ILE A 396 -7.723 4.894 0.438 1.00 0.42 H new ATOM 0 HD12 ILE A 396 -8.379 4.209 1.943 1.00 0.42 H new ATOM 0 HD13 ILE A 396 -9.478 4.669 0.622 1.00 0.42 H new ATOM 1433 N ASP A 397 -11.251 7.671 5.331 1.00 0.38 N ATOM 1434 CA ASP A 397 -12.453 8.044 6.071 1.00 0.47 C ATOM 1435 C ASP A 397 -12.449 9.535 6.406 1.00 0.51 C ATOM 1436 O ASP A 397 -13.500 10.173 6.467 1.00 0.63 O ATOM 1437 CB ASP A 397 -12.560 7.225 7.358 1.00 0.52 C ATOM 1438 CG ASP A 397 -13.732 7.645 8.219 1.00 0.69 C ATOM 1439 OD1 ASP A 397 -14.859 7.160 7.972 1.00 0.73 O ATOM 1440 OD2 ASP A 397 -13.531 8.460 9.142 1.00 0.99 O ATOM 0 H ASP A 397 -10.676 6.966 5.792 1.00 0.38 H new ATOM 0 HA ASP A 397 -13.316 7.833 5.439 1.00 0.47 H new ATOM 0 HB2 ASP A 397 -12.659 6.169 7.105 1.00 0.52 H new ATOM 0 HB3 ASP A 397 -11.638 7.331 7.929 1.00 0.52 H new ATOM 1445 N ILE A 398 -11.259 10.087 6.606 1.00 0.47 N ATOM 1446 CA ILE A 398 -11.110 11.501 6.925 1.00 0.53 C ATOM 1447 C ILE A 398 -11.390 12.360 5.691 1.00 0.55 C ATOM 1448 O ILE A 398 -11.943 13.456 5.791 1.00 0.65 O ATOM 1449 CB ILE A 398 -9.690 11.814 7.447 1.00 0.54 C ATOM 1450 CG1 ILE A 398 -9.340 10.898 8.624 1.00 0.57 C ATOM 1451 CG2 ILE A 398 -9.586 13.275 7.863 1.00 0.62 C ATOM 1452 CD1 ILE A 398 -7.923 11.070 9.131 1.00 0.81 C ATOM 0 H ILE A 398 -10.379 9.574 6.553 1.00 0.47 H new ATOM 0 HA ILE A 398 -11.831 11.736 7.708 1.00 0.53 H new ATOM 0 HB ILE A 398 -8.978 11.632 6.642 1.00 0.54 H new ATOM 0 HG12 ILE A 398 -10.035 11.091 9.442 1.00 0.57 H new ATOM 0 HG13 ILE A 398 -9.484 9.861 8.321 1.00 0.57 H new ATOM 0 HG21 ILE A 398 -8.579 13.479 8.228 1.00 0.62 H new ATOM 0 HG22 ILE A 398 -9.797 13.913 7.005 1.00 0.62 H new ATOM 0 HG23 ILE A 398 -10.307 13.480 8.654 1.00 0.62 H new ATOM 0 HD11 ILE A 398 -7.749 10.389 9.964 1.00 0.81 H new ATOM 0 HD12 ILE A 398 -7.220 10.848 8.328 1.00 0.81 H new ATOM 0 HD13 ILE A 398 -7.779 12.097 9.466 1.00 0.81 H new ATOM 1464 N ILE A 399 -11.010 11.846 4.529 1.00 0.50 N ATOM 1465 CA ILE A 399 -11.202 12.561 3.273 1.00 0.52 C ATOM 1466 C ILE A 399 -12.667 12.512 2.841 1.00 0.59 C ATOM 1467 O ILE A 399 -13.193 13.470 2.273 1.00 0.72 O ATOM 1468 CB ILE A 399 -10.315 11.975 2.152 1.00 0.47 C ATOM 1469 CG1 ILE A 399 -8.852 11.926 2.602 1.00 0.47 C ATOM 1470 CG2 ILE A 399 -10.451 12.800 0.878 1.00 0.50 C ATOM 1471 CD1 ILE A 399 -7.925 11.281 1.594 1.00 0.48 C ATOM 0 H ILE A 399 -10.565 10.933 4.429 1.00 0.50 H new ATOM 0 HA ILE A 399 -10.911 13.598 3.442 1.00 0.52 H new ATOM 0 HB ILE A 399 -10.649 10.959 1.942 1.00 0.47 H new ATOM 0 HG12 ILE A 399 -8.508 12.941 2.800 1.00 0.47 H new ATOM 0 HG13 ILE A 399 -8.789 11.379 3.542 1.00 0.47 H new ATOM 0 HG21 ILE A 399 -9.819 12.373 0.099 1.00 0.50 H new ATOM 0 HG22 ILE A 399 -11.490 12.792 0.548 1.00 0.50 H new ATOM 0 HG23 ILE A 399 -10.141 13.826 1.074 1.00 0.50 H new ATOM 0 HD11 ILE A 399 -6.907 11.283 1.983 1.00 0.48 H new ATOM 0 HD12 ILE A 399 -8.242 10.254 1.413 1.00 0.48 H new ATOM 0 HD13 ILE A 399 -7.957 11.841 0.659 1.00 0.48 H new ATOM 1603 N TRP B 374 -11.121 -8.332 -1.257 1.00 1.08 N ATOM 1604 CA TRP B 374 -10.678 -7.007 -1.645 1.00 0.61 C ATOM 1605 C TRP B 374 -11.546 -5.949 -0.986 1.00 0.55 C ATOM 1606 O TRP B 374 -12.776 -6.021 -1.031 1.00 0.90 O ATOM 1607 CB TRP B 374 -10.732 -6.836 -3.165 1.00 0.88 C ATOM 1608 CG TRP B 374 -9.754 -7.689 -3.920 1.00 0.97 C ATOM 1609 CD1 TRP B 374 -9.939 -8.981 -4.328 1.00 1.38 C ATOM 1610 CD2 TRP B 374 -8.447 -7.309 -4.378 1.00 0.81 C ATOM 1611 NE1 TRP B 374 -8.830 -9.425 -5.006 1.00 1.42 N ATOM 1612 CE2 TRP B 374 -7.902 -8.421 -5.049 1.00 1.02 C ATOM 1613 CE3 TRP B 374 -7.682 -6.140 -4.286 1.00 0.85 C ATOM 1614 CZ2 TRP B 374 -6.636 -8.396 -5.622 1.00 0.98 C ATOM 1615 CZ3 TRP B 374 -6.426 -6.119 -4.859 1.00 0.97 C ATOM 1616 CH2 TRP B 374 -5.915 -7.241 -5.520 1.00 0.88 C ATOM 0 HA TRP B 374 -9.646 -6.888 -1.315 1.00 0.61 H new ATOM 0 HB2 TRP B 374 -11.740 -7.069 -3.509 1.00 0.88 H new ATOM 0 HB3 TRP B 374 -10.546 -5.790 -3.408 1.00 0.88 H new ATOM 0 HD1 TRP B 374 -10.827 -9.567 -4.144 1.00 1.38 H new ATOM 0 HE1 TRP B 374 -8.717 -10.354 -5.412 1.00 1.42 H new ATOM 0 HE3 TRP B 374 -8.068 -5.270 -3.776 1.00 0.85 H new ATOM 0 HZ2 TRP B 374 -6.236 -9.261 -6.131 1.00 0.98 H new ATOM 0 HZ3 TRP B 374 -5.828 -5.222 -4.796 1.00 0.97 H new ATOM 0 HH2 TRP B 374 -4.929 -7.193 -5.959 1.00 0.88 H new ATOM 1627 N VAL B 375 -10.904 -4.972 -0.378 1.00 0.40 N ATOM 1628 CA VAL B 375 -11.614 -3.848 0.208 1.00 0.38 C ATOM 1629 C VAL B 375 -11.338 -2.602 -0.625 1.00 0.44 C ATOM 1630 O VAL B 375 -10.184 -2.236 -0.860 1.00 0.53 O ATOM 1631 CB VAL B 375 -11.284 -3.625 1.718 1.00 0.48 C ATOM 1632 CG1 VAL B 375 -9.797 -3.390 1.981 1.00 0.84 C ATOM 1633 CG2 VAL B 375 -12.105 -2.468 2.283 1.00 1.07 C ATOM 0 H VAL B 375 -9.890 -4.932 -0.276 1.00 0.40 H new ATOM 0 HA VAL B 375 -12.680 -4.074 0.187 1.00 0.38 H new ATOM 0 HB VAL B 375 -11.553 -4.549 2.229 1.00 0.48 H new ATOM 0 HG11 VAL B 375 -9.635 -3.242 3.049 1.00 0.84 H new ATOM 0 HG12 VAL B 375 -9.227 -4.256 1.644 1.00 0.84 H new ATOM 0 HG13 VAL B 375 -9.467 -2.504 1.438 1.00 0.84 H new ATOM 0 HG21 VAL B 375 -11.861 -2.329 3.336 1.00 1.07 H new ATOM 0 HG22 VAL B 375 -11.874 -1.556 1.733 1.00 1.07 H new ATOM 0 HG23 VAL B 375 -13.167 -2.693 2.184 1.00 1.07 H new ATOM 1643 N GLU B 376 -12.403 -1.988 -1.119 1.00 0.51 N ATOM 1644 CA GLU B 376 -12.283 -0.945 -2.118 1.00 0.63 C ATOM 1645 C GLU B 376 -12.616 0.425 -1.552 1.00 0.52 C ATOM 1646 O GLU B 376 -13.463 0.563 -0.667 1.00 0.61 O ATOM 1647 CB GLU B 376 -13.198 -1.268 -3.298 1.00 0.86 C ATOM 1648 CG GLU B 376 -12.899 -2.612 -3.942 1.00 1.43 C ATOM 1649 CD GLU B 376 -13.834 -2.930 -5.083 1.00 1.69 C ATOM 1650 OE1 GLU B 376 -13.533 -2.540 -6.229 1.00 2.28 O ATOM 1651 OE2 GLU B 376 -14.871 -3.580 -4.841 1.00 2.06 O ATOM 0 H GLU B 376 -13.362 -2.197 -0.841 1.00 0.51 H new ATOM 0 HA GLU B 376 -11.246 -0.911 -2.451 1.00 0.63 H new ATOM 0 HB2 GLU B 376 -14.234 -1.258 -2.959 1.00 0.86 H new ATOM 0 HB3 GLU B 376 -13.101 -0.484 -4.049 1.00 0.86 H new ATOM 0 HG2 GLU B 376 -11.872 -2.615 -4.307 1.00 1.43 H new ATOM 0 HG3 GLU B 376 -12.972 -3.396 -3.188 1.00 1.43 H new ATOM 1658 N ASN B 377 -11.925 1.427 -2.067 1.00 0.54 N ATOM 1659 CA ASN B 377 -12.139 2.806 -1.666 1.00 0.58 C ATOM 1660 C ASN B 377 -13.078 3.513 -2.633 1.00 0.50 C ATOM 1661 O ASN B 377 -13.198 3.122 -3.795 1.00 0.65 O ATOM 1662 CB ASN B 377 -10.805 3.545 -1.613 1.00 0.83 C ATOM 1663 CG ASN B 377 -10.022 3.409 -2.905 1.00 0.88 C ATOM 1664 OD1 ASN B 377 -9.282 2.448 -3.089 1.00 1.83 O ATOM 1665 ND2 ASN B 377 -10.170 4.364 -3.810 1.00 1.23 N ATOM 0 H ASN B 377 -11.200 1.307 -2.775 1.00 0.54 H new ATOM 0 HA ASN B 377 -12.596 2.807 -0.676 1.00 0.58 H new ATOM 0 HB2 ASN B 377 -10.984 4.601 -1.408 1.00 0.83 H new ATOM 0 HB3 ASN B 377 -10.209 3.157 -0.787 1.00 0.83 H new ATOM 0 HD21 ASN B 377 -9.660 4.314 -4.692 1.00 1.23 H new ATOM 0 HD22 ASN B 377 -10.794 5.150 -3.625 1.00 1.23 H new ATOM 1672 N GLU B 378 -13.733 4.559 -2.151 1.00 0.43 N ATOM 1673 CA GLU B 378 -14.670 5.312 -2.968 1.00 0.51 C ATOM 1674 C GLU B 378 -14.109 6.675 -3.355 1.00 0.44 C ATOM 1675 O GLU B 378 -14.858 7.610 -3.635 1.00 0.53 O ATOM 1676 CB GLU B 378 -16.006 5.481 -2.235 1.00 0.71 C ATOM 1677 CG GLU B 378 -16.658 4.170 -1.816 1.00 0.87 C ATOM 1678 CD GLU B 378 -18.024 4.378 -1.203 1.00 1.05 C ATOM 1679 OE1 GLU B 378 -18.954 4.785 -1.930 1.00 1.39 O ATOM 1680 OE2 GLU B 378 -18.168 4.154 0.017 1.00 1.88 O ATOM 0 H GLU B 378 -13.632 4.905 -1.197 1.00 0.43 H new ATOM 0 HA GLU B 378 -14.835 4.745 -3.884 1.00 0.51 H new ATOM 0 HB2 GLU B 378 -15.846 6.094 -1.348 1.00 0.71 H new ATOM 0 HB3 GLU B 378 -16.695 6.027 -2.880 1.00 0.71 H new ATOM 0 HG2 GLU B 378 -16.748 3.518 -2.685 1.00 0.87 H new ATOM 0 HG3 GLU B 378 -16.015 3.660 -1.099 1.00 0.87 H new ATOM 1687 N ILE B 379 -12.792 6.777 -3.392 1.00 0.36 N ATOM 1688 CA ILE B 379 -12.145 7.980 -3.906 1.00 0.38 C ATOM 1689 C ILE B 379 -11.255 7.648 -5.096 1.00 0.48 C ATOM 1690 O ILE B 379 -10.202 8.249 -5.288 1.00 1.17 O ATOM 1691 CB ILE B 379 -11.314 8.737 -2.842 1.00 0.38 C ATOM 1692 CG1 ILE B 379 -10.234 7.837 -2.211 1.00 0.37 C ATOM 1693 CG2 ILE B 379 -12.228 9.316 -1.759 1.00 0.43 C ATOM 1694 CD1 ILE B 379 -9.405 8.528 -1.135 1.00 0.44 C ATOM 0 H ILE B 379 -12.150 6.050 -3.076 1.00 0.36 H new ATOM 0 HA ILE B 379 -12.955 8.641 -4.214 1.00 0.38 H new ATOM 0 HB ILE B 379 -10.803 9.556 -3.348 1.00 0.38 H new ATOM 0 HG12 ILE B 379 -10.714 6.959 -1.778 1.00 0.37 H new ATOM 0 HG13 ILE B 379 -9.567 7.481 -2.997 1.00 0.37 H new ATOM 0 HG21 ILE B 379 -11.626 9.845 -1.020 1.00 0.43 H new ATOM 0 HG22 ILE B 379 -12.936 10.009 -2.213 1.00 0.43 H new ATOM 0 HG23 ILE B 379 -12.773 8.507 -1.272 1.00 0.43 H new ATOM 0 HD11 ILE B 379 -8.667 7.830 -0.740 1.00 0.44 H new ATOM 0 HD12 ILE B 379 -8.895 9.389 -1.566 1.00 0.44 H new ATOM 0 HD13 ILE B 379 -10.059 8.860 -0.329 1.00 0.44 H new ATOM 1706 N TYR B 380 -11.700 6.700 -5.903 1.00 0.45 N ATOM 1707 CA TYR B 380 -10.983 6.342 -7.120 1.00 0.42 C ATOM 1708 C TYR B 380 -11.470 7.226 -8.263 1.00 0.46 C ATOM 1709 O TYR B 380 -12.582 7.053 -8.765 1.00 0.58 O ATOM 1710 CB TYR B 380 -11.188 4.853 -7.451 1.00 0.48 C ATOM 1711 CG TYR B 380 -10.440 4.376 -8.682 1.00 0.45 C ATOM 1712 CD1 TYR B 380 -9.072 4.579 -8.818 1.00 0.49 C ATOM 1713 CD2 TYR B 380 -11.106 3.704 -9.701 1.00 0.54 C ATOM 1714 CE1 TYR B 380 -8.391 4.130 -9.933 1.00 0.51 C ATOM 1715 CE2 TYR B 380 -10.432 3.253 -10.819 1.00 0.54 C ATOM 1716 CZ TYR B 380 -9.076 3.468 -10.931 1.00 0.47 C ATOM 1717 OH TYR B 380 -8.401 3.012 -12.042 1.00 0.52 O ATOM 0 H TYR B 380 -12.552 6.164 -5.740 1.00 0.45 H new ATOM 0 HA TYR B 380 -9.915 6.503 -6.974 1.00 0.42 H new ATOM 0 HB2 TYR B 380 -10.873 4.256 -6.595 1.00 0.48 H new ATOM 0 HB3 TYR B 380 -12.253 4.668 -7.593 1.00 0.48 H new ATOM 0 HD1 TYR B 380 -8.532 5.097 -8.039 1.00 0.49 H new ATOM 0 HD2 TYR B 380 -12.169 3.532 -9.617 1.00 0.54 H new ATOM 0 HE1 TYR B 380 -7.328 4.296 -10.023 1.00 0.51 H new ATOM 0 HE2 TYR B 380 -10.966 2.734 -11.602 1.00 0.54 H new ATOM 0 HH TYR B 380 -9.046 2.757 -12.735 1.00 0.52 H new ATOM 1727 N TYR B 381 -10.651 8.196 -8.637 1.00 0.55 N ATOM 1728 CA TYR B 381 -11.024 9.191 -9.618 1.00 0.70 C ATOM 1729 C TYR B 381 -10.836 8.662 -11.036 1.00 0.79 C ATOM 1730 O TYR B 381 -9.802 8.973 -11.661 1.00 1.31 O ATOM 1731 CB TYR B 381 -10.166 10.438 -9.394 1.00 1.01 C ATOM 1732 CG TYR B 381 -10.538 11.254 -8.168 1.00 1.28 C ATOM 1733 CD1 TYR B 381 -10.985 10.645 -7.000 1.00 1.73 C ATOM 1734 CD2 TYR B 381 -10.437 12.639 -8.178 1.00 1.66 C ATOM 1735 CE1 TYR B 381 -11.319 11.386 -5.885 1.00 2.35 C ATOM 1736 CE2 TYR B 381 -10.768 13.387 -7.064 1.00 2.20 C ATOM 1737 CZ TYR B 381 -11.210 12.756 -5.921 1.00 2.50 C ATOM 1738 OH TYR B 381 -11.536 13.495 -4.809 1.00 3.20 O ATOM 1739 OXT TYR B 381 -11.720 7.928 -11.526 1.00 1.47 O ATOM 0 H TYR B 381 -9.708 8.312 -8.266 1.00 0.55 H new ATOM 0 HA TYR B 381 -12.079 9.437 -9.500 1.00 0.70 H new ATOM 0 HB2 TYR B 381 -9.123 10.134 -9.308 1.00 1.01 H new ATOM 0 HB3 TYR B 381 -10.240 11.076 -10.274 1.00 1.01 H new ATOM 0 HD1 TYR B 381 -11.073 9.569 -6.965 1.00 1.73 H new ATOM 0 HD2 TYR B 381 -10.094 13.140 -9.071 1.00 1.66 H new ATOM 0 HE1 TYR B 381 -11.664 10.892 -4.989 1.00 2.35 H new ATOM 0 HE2 TYR B 381 -10.681 14.463 -7.089 1.00 2.20 H new ATOM 0 HH TYR B 381 -11.403 14.447 -4.999 1.00 3.20 H new