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 365 SER OG : rot 17:sc= 1.89 USER MOD Set 1.2: A 367 THR OG1 : rot -51:sc= 0.791 USER MOD Set 1.3: A 379 SER OG : rot -57:sc= 1.64 USER MOD Set 2.1: A 354 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 355 ASN : amide:sc= -0.824 X(o=-0.82,f=-0.63) USER MOD Set 3.1: A 333 THR OG1 : rot 100:sc= 2.35 USER MOD Set 3.2: A 336 CYS SG : rot 15:sc= 0.238 USER MOD Single : A 311 SER OG : rot 99:sc= 1.04 USER MOD Single : A 316 LYS NZ :NH3+ 156:sc= 1.15 (180deg=-0.543) USER MOD Single : A 334 LYS NZ :NH3+ 147:sc= 1.28 (180deg=0.698) USER MOD Single : A 338 MET CE :methyl 160:sc= -0.143 (180deg=-0.724) USER MOD Single : A 343 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 344 THR OG1 : rot 91:sc= 1.24 USER MOD Single : A 345 LYS NZ :NH3+ -164:sc= -0.264 (180deg=-0.792) USER MOD Single : A 349 GLN : amide:sc= 1.02 K(o=1,f=-5.6!) USER MOD Single : A 352 SER OG : rot 180:sc= 0 USER MOD Single : A 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 374 GLN : amide:sc= -1 X(o=-1,f=-0.64) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 TYR OH : rot -7:sc= 0.253 USER MOD Single : A 381 GLN : amide:sc= -0.378 K(o=-0.38,f=-2.4) USER MOD Single : A 382 THR OG1 : rot -115:sc= 0.515 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0.0302 USER MOD Single : A 387 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 390 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : B 377 ASN : amide:sc= 0.178 K(o=0.18,f=-4.9!) USER MOD Single : B 380 TYR OH : rot 180:sc= 0.752 USER MOD Single : B 381 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 26 N SER A 311 3.965 6.964 10.526 1.00 0.71 N ATOM 27 CA SER A 311 3.573 5.585 10.296 1.00 0.41 C ATOM 28 C SER A 311 4.315 4.980 9.105 1.00 0.34 C ATOM 29 O SER A 311 3.999 5.263 7.945 1.00 0.47 O ATOM 30 CB SER A 311 2.062 5.520 10.089 1.00 0.59 C ATOM 31 OG SER A 311 1.602 6.674 9.400 1.00 1.06 O ATOM 0 HA SER A 311 3.844 4.994 11.171 1.00 0.41 H new ATOM 0 HB2 SER A 311 1.805 4.625 9.522 1.00 0.59 H new ATOM 0 HB3 SER A 311 1.560 5.441 11.054 1.00 0.59 H new ATOM 0 HG SER A 311 1.492 6.465 8.449 1.00 1.06 H new ATOM 37 N PHE A 312 5.315 4.165 9.405 1.00 0.29 N ATOM 38 CA PHE A 312 6.095 3.486 8.382 1.00 0.27 C ATOM 39 C PHE A 312 6.109 1.988 8.636 1.00 0.26 C ATOM 40 O PHE A 312 6.412 1.538 9.743 1.00 0.34 O ATOM 41 CB PHE A 312 7.532 4.016 8.346 1.00 0.31 C ATOM 42 CG PHE A 312 7.680 5.343 7.657 1.00 0.34 C ATOM 43 CD1 PHE A 312 7.456 6.527 8.339 1.00 0.45 C ATOM 44 CD2 PHE A 312 8.047 5.401 6.323 1.00 0.33 C ATOM 45 CE1 PHE A 312 7.597 7.745 7.703 1.00 0.52 C ATOM 46 CE2 PHE A 312 8.189 6.617 5.682 1.00 0.38 C ATOM 47 CZ PHE A 312 7.963 7.790 6.373 1.00 0.47 C ATOM 0 H PHE A 312 5.607 3.956 10.360 1.00 0.29 H new ATOM 0 HA PHE A 312 5.627 3.683 7.418 1.00 0.27 H new ATOM 0 HB2 PHE A 312 7.900 4.106 9.368 1.00 0.31 H new ATOM 0 HB3 PHE A 312 8.165 3.285 7.843 1.00 0.31 H new ATOM 0 HD1 PHE A 312 7.168 6.498 9.379 1.00 0.45 H new ATOM 0 HD2 PHE A 312 8.224 4.486 5.778 1.00 0.33 H new ATOM 0 HE1 PHE A 312 7.421 8.662 8.246 1.00 0.52 H new ATOM 0 HE2 PHE A 312 8.477 6.649 4.641 1.00 0.38 H new ATOM 0 HZ PHE A 312 8.072 8.742 5.874 1.00 0.47 H new ATOM 57 N PHE A 313 5.774 1.220 7.614 1.00 0.24 N ATOM 58 CA PHE A 313 5.771 -0.232 7.716 1.00 0.26 C ATOM 59 C PHE A 313 6.949 -0.814 6.950 1.00 0.26 C ATOM 60 O PHE A 313 7.171 -0.469 5.791 1.00 0.26 O ATOM 61 CB PHE A 313 4.465 -0.808 7.162 1.00 0.28 C ATOM 62 CG PHE A 313 3.233 -0.346 7.888 1.00 0.30 C ATOM 63 CD1 PHE A 313 2.568 0.805 7.495 1.00 0.32 C ATOM 64 CD2 PHE A 313 2.732 -1.069 8.959 1.00 0.34 C ATOM 65 CE1 PHE A 313 1.429 1.225 8.156 1.00 0.37 C ATOM 66 CE2 PHE A 313 1.596 -0.653 9.624 1.00 0.40 C ATOM 67 CZ PHE A 313 0.944 0.495 9.221 1.00 0.41 C ATOM 0 H PHE A 313 5.499 1.578 6.699 1.00 0.24 H new ATOM 0 HA PHE A 313 5.857 -0.501 8.769 1.00 0.26 H new ATOM 0 HB2 PHE A 313 4.378 -0.535 6.110 1.00 0.28 H new ATOM 0 HB3 PHE A 313 4.513 -1.896 7.206 1.00 0.28 H new ATOM 0 HD1 PHE A 313 2.944 1.381 6.662 1.00 0.32 H new ATOM 0 HD2 PHE A 313 3.237 -1.969 9.277 1.00 0.34 H new ATOM 0 HE1 PHE A 313 0.920 2.123 7.839 1.00 0.37 H new ATOM 0 HE2 PHE A 313 1.218 -1.225 10.458 1.00 0.40 H new ATOM 0 HZ PHE A 313 0.055 0.821 9.739 1.00 0.41 H new ATOM 77 N LEU A 314 7.710 -1.680 7.599 1.00 0.36 N ATOM 78 CA LEU A 314 8.826 -2.339 6.940 1.00 0.38 C ATOM 79 C LEU A 314 8.318 -3.509 6.113 1.00 0.37 C ATOM 80 O LEU A 314 7.987 -4.568 6.649 1.00 0.50 O ATOM 81 CB LEU A 314 9.862 -2.823 7.959 1.00 0.51 C ATOM 82 CG LEU A 314 11.087 -3.517 7.355 1.00 0.57 C ATOM 83 CD1 LEU A 314 11.856 -2.565 6.451 1.00 0.54 C ATOM 84 CD2 LEU A 314 11.989 -4.060 8.453 1.00 0.72 C ATOM 0 H LEU A 314 7.577 -1.942 8.576 1.00 0.36 H new ATOM 0 HA LEU A 314 9.312 -1.617 6.284 1.00 0.38 H new ATOM 0 HB2 LEU A 314 10.199 -1.969 8.546 1.00 0.51 H new ATOM 0 HB3 LEU A 314 9.376 -3.512 8.650 1.00 0.51 H new ATOM 0 HG LEU A 314 10.740 -4.354 6.749 1.00 0.57 H new ATOM 0 HD11 LEU A 314 12.722 -3.079 6.033 1.00 0.54 H new ATOM 0 HD12 LEU A 314 11.208 -2.229 5.641 1.00 0.54 H new ATOM 0 HD13 LEU A 314 12.190 -1.704 7.030 1.00 0.54 H new ATOM 0 HD21 LEU A 314 12.854 -4.549 8.005 1.00 0.72 H new ATOM 0 HD22 LEU A 314 12.325 -3.239 9.087 1.00 0.72 H new ATOM 0 HD23 LEU A 314 11.436 -4.781 9.055 1.00 0.72 H new ATOM 96 N VAL A 315 8.235 -3.302 4.812 1.00 0.26 N ATOM 97 CA VAL A 315 7.745 -4.324 3.905 1.00 0.26 C ATOM 98 C VAL A 315 8.888 -4.893 3.079 1.00 0.24 C ATOM 99 O VAL A 315 10.001 -4.366 3.100 1.00 0.27 O ATOM 100 CB VAL A 315 6.652 -3.773 2.963 1.00 0.26 C ATOM 101 CG1 VAL A 315 5.443 -3.309 3.762 1.00 0.30 C ATOM 102 CG2 VAL A 315 7.192 -2.637 2.104 1.00 0.23 C ATOM 0 H VAL A 315 8.503 -2.429 4.357 1.00 0.26 H new ATOM 0 HA VAL A 315 7.306 -5.115 4.513 1.00 0.26 H new ATOM 0 HB VAL A 315 6.341 -4.580 2.299 1.00 0.26 H new ATOM 0 HG11 VAL A 315 4.683 -2.924 3.082 1.00 0.30 H new ATOM 0 HG12 VAL A 315 5.035 -4.149 4.324 1.00 0.30 H new ATOM 0 HG13 VAL A 315 5.744 -2.522 4.453 1.00 0.30 H new ATOM 0 HG21 VAL A 315 6.402 -2.268 1.450 1.00 0.23 H new ATOM 0 HG22 VAL A 315 7.539 -1.828 2.747 1.00 0.23 H new ATOM 0 HG23 VAL A 315 8.022 -3.001 1.499 1.00 0.23 H new ATOM 112 N LYS A 316 8.617 -5.975 2.368 1.00 0.25 N ATOM 113 CA LYS A 316 9.620 -6.602 1.522 1.00 0.28 C ATOM 114 C LYS A 316 9.076 -6.800 0.112 1.00 0.28 C ATOM 115 O LYS A 316 8.132 -7.565 -0.099 1.00 0.28 O ATOM 116 CB LYS A 316 10.060 -7.937 2.130 1.00 0.34 C ATOM 117 CG LYS A 316 10.718 -7.790 3.495 1.00 0.44 C ATOM 118 CD LYS A 316 11.042 -9.135 4.129 1.00 0.55 C ATOM 119 CE LYS A 316 12.107 -9.897 3.350 1.00 0.67 C ATOM 120 NZ LYS A 316 13.373 -9.130 3.234 1.00 1.44 N ATOM 0 H LYS A 316 7.709 -6.439 2.360 1.00 0.25 H new ATOM 0 HA LYS A 316 10.490 -5.948 1.460 1.00 0.28 H new ATOM 0 HB2 LYS A 316 9.192 -8.590 2.221 1.00 0.34 H new ATOM 0 HB3 LYS A 316 10.757 -8.426 1.449 1.00 0.34 H new ATOM 0 HG2 LYS A 316 11.635 -7.209 3.393 1.00 0.44 H new ATOM 0 HG3 LYS A 316 10.057 -7.229 4.156 1.00 0.44 H new ATOM 0 HD2 LYS A 316 11.384 -8.979 5.152 1.00 0.55 H new ATOM 0 HD3 LYS A 316 10.135 -9.737 4.184 1.00 0.55 H new ATOM 0 HE2 LYS A 316 12.305 -10.849 3.844 1.00 0.67 H new ATOM 0 HE3 LYS A 316 11.731 -10.127 2.353 1.00 0.67 H new ATOM 0 HZ1 LYS A 316 14.164 -9.787 3.080 1.00 1.44 H new ATOM 0 HZ2 LYS A 316 13.308 -8.472 2.431 1.00 1.44 H new ATOM 0 HZ3 LYS A 316 13.535 -8.593 4.110 1.00 1.44 H new ATOM 134 N GLU A 317 9.668 -6.097 -0.844 1.00 0.32 N ATOM 135 CA GLU A 317 9.207 -6.129 -2.227 1.00 0.37 C ATOM 136 C GLU A 317 9.907 -7.232 -3.008 1.00 0.45 C ATOM 137 O GLU A 317 11.136 -7.312 -3.025 1.00 0.48 O ATOM 138 CB GLU A 317 9.471 -4.788 -2.914 1.00 0.39 C ATOM 139 CG GLU A 317 8.982 -3.581 -2.133 1.00 0.41 C ATOM 140 CD GLU A 317 9.168 -2.288 -2.899 1.00 0.49 C ATOM 141 OE1 GLU A 317 10.308 -1.993 -3.309 1.00 0.70 O ATOM 142 OE2 GLU A 317 8.178 -1.556 -3.085 1.00 0.61 O ATOM 0 H GLU A 317 10.475 -5.493 -0.686 1.00 0.32 H new ATOM 0 HA GLU A 317 8.135 -6.326 -2.211 1.00 0.37 H new ATOM 0 HB2 GLU A 317 10.542 -4.685 -3.086 1.00 0.39 H new ATOM 0 HB3 GLU A 317 8.990 -4.793 -3.892 1.00 0.39 H new ATOM 0 HG2 GLU A 317 7.927 -3.710 -1.892 1.00 0.41 H new ATOM 0 HG3 GLU A 317 9.520 -3.521 -1.187 1.00 0.41 H new ATOM 275 N LEU A 325 13.501 -10.557 -1.141 1.00 0.61 N ATOM 276 CA LEU A 325 12.539 -9.472 -1.134 1.00 0.49 C ATOM 277 C LEU A 325 13.161 -8.235 -0.498 1.00 0.45 C ATOM 278 O LEU A 325 13.533 -8.247 0.679 1.00 0.55 O ATOM 279 CB LEU A 325 11.256 -9.878 -0.397 1.00 0.47 C ATOM 280 CG LEU A 325 10.380 -10.921 -1.106 1.00 0.53 C ATOM 281 CD1 LEU A 325 11.000 -12.309 -1.038 1.00 0.69 C ATOM 282 CD2 LEU A 325 8.984 -10.936 -0.507 1.00 0.56 C ATOM 0 HA LEU A 325 12.267 -9.240 -2.164 1.00 0.49 H new ATOM 0 HB2 LEU A 325 11.530 -10.268 0.583 1.00 0.47 H new ATOM 0 HB3 LEU A 325 10.658 -8.983 -0.228 1.00 0.47 H new ATOM 0 HG LEU A 325 10.311 -10.638 -2.156 1.00 0.53 H new ATOM 0 HD11 LEU A 325 10.353 -13.022 -1.550 1.00 0.69 H new ATOM 0 HD12 LEU A 325 11.978 -12.295 -1.520 1.00 0.69 H new ATOM 0 HD13 LEU A 325 11.114 -12.606 0.005 1.00 0.69 H new ATOM 0 HD21 LEU A 325 8.376 -11.680 -1.021 1.00 0.56 H new ATOM 0 HD22 LEU A 325 9.045 -11.186 0.552 1.00 0.56 H new ATOM 0 HD23 LEU A 325 8.528 -9.953 -0.622 1.00 0.56 H new ATOM 294 N VAL A 326 13.270 -7.178 -1.286 1.00 0.40 N ATOM 295 CA VAL A 326 13.943 -5.955 -0.867 1.00 0.38 C ATOM 296 C VAL A 326 13.153 -5.240 0.223 1.00 0.32 C ATOM 297 O VAL A 326 11.969 -4.953 0.051 1.00 0.29 O ATOM 298 CB VAL A 326 14.137 -4.993 -2.061 1.00 0.42 C ATOM 299 CG1 VAL A 326 14.936 -3.764 -1.649 1.00 0.45 C ATOM 300 CG2 VAL A 326 14.810 -5.706 -3.223 1.00 0.51 C ATOM 0 H VAL A 326 12.895 -7.141 -2.234 1.00 0.40 H new ATOM 0 HA VAL A 326 14.918 -6.243 -0.473 1.00 0.38 H new ATOM 0 HB VAL A 326 13.152 -4.660 -2.387 1.00 0.42 H new ATOM 0 HG11 VAL A 326 15.058 -3.104 -2.508 1.00 0.45 H new ATOM 0 HG12 VAL A 326 14.407 -3.235 -0.857 1.00 0.45 H new ATOM 0 HG13 VAL A 326 15.917 -4.072 -1.287 1.00 0.45 H new ATOM 0 HG21 VAL A 326 14.937 -5.010 -4.053 1.00 0.51 H new ATOM 0 HG22 VAL A 326 15.786 -6.076 -2.907 1.00 0.51 H new ATOM 0 HG23 VAL A 326 14.191 -6.544 -3.544 1.00 0.51 H new ATOM 310 N PRO A 327 13.795 -4.958 1.366 1.00 0.33 N ATOM 311 CA PRO A 327 13.168 -4.220 2.462 1.00 0.30 C ATOM 312 C PRO A 327 12.871 -2.779 2.067 1.00 0.25 C ATOM 313 O PRO A 327 13.736 -2.077 1.532 1.00 0.32 O ATOM 314 CB PRO A 327 14.212 -4.264 3.587 1.00 0.39 C ATOM 315 CG PRO A 327 15.185 -5.320 3.183 1.00 0.46 C ATOM 316 CD PRO A 327 15.178 -5.333 1.684 1.00 0.42 C ATOM 0 HA PRO A 327 12.210 -4.653 2.751 1.00 0.30 H new ATOM 0 HB2 PRO A 327 14.705 -3.299 3.703 1.00 0.39 H new ATOM 0 HB3 PRO A 327 13.748 -4.502 4.544 1.00 0.39 H new ATOM 0 HG2 PRO A 327 16.181 -5.101 3.567 1.00 0.46 H new ATOM 0 HG3 PRO A 327 14.896 -6.292 3.583 1.00 0.46 H new ATOM 0 HD2 PRO A 327 15.895 -4.625 1.269 1.00 0.42 H new ATOM 0 HD3 PRO A 327 15.433 -6.315 1.286 1.00 0.42 H new ATOM 324 N ARG A 328 11.647 -2.347 2.314 1.00 0.21 N ATOM 325 CA ARG A 328 11.236 -0.996 1.982 1.00 0.23 C ATOM 326 C ARG A 328 10.375 -0.429 3.106 1.00 0.20 C ATOM 327 O ARG A 328 9.750 -1.180 3.856 1.00 0.23 O ATOM 328 CB ARG A 328 10.448 -0.992 0.667 1.00 0.32 C ATOM 329 CG ARG A 328 10.514 0.329 -0.079 1.00 0.50 C ATOM 330 CD ARG A 328 11.846 0.492 -0.797 1.00 0.56 C ATOM 331 NE ARG A 328 11.943 -0.397 -1.955 1.00 0.47 N ATOM 332 CZ ARG A 328 13.034 -0.578 -2.698 1.00 0.58 C ATOM 333 NH1 ARG A 328 14.191 -0.017 -2.365 1.00 0.78 N ATOM 334 NH2 ARG A 328 12.958 -1.356 -3.768 1.00 0.65 N ATOM 0 H ARG A 328 10.918 -2.916 2.745 1.00 0.21 H new ATOM 0 HA ARG A 328 12.123 -0.375 1.861 1.00 0.23 H new ATOM 0 HB2 ARG A 328 10.830 -1.783 0.022 1.00 0.32 H new ATOM 0 HB3 ARG A 328 9.405 -1.229 0.878 1.00 0.32 H new ATOM 0 HG2 ARG A 328 9.700 0.382 -0.802 1.00 0.50 H new ATOM 0 HG3 ARG A 328 10.373 1.152 0.621 1.00 0.50 H new ATOM 0 HD2 ARG A 328 11.962 1.526 -1.120 1.00 0.56 H new ATOM 0 HD3 ARG A 328 12.662 0.281 -0.105 1.00 0.56 H new ATOM 0 HE ARG A 328 11.107 -0.921 -2.215 1.00 0.47 H new ATOM 0 HH11 ARG A 328 14.254 0.563 -1.529 1.00 0.78 H new ATOM 0 HH12 ARG A 328 15.016 -0.167 -2.946 1.00 0.78 H new ATOM 0 HH21 ARG A 328 12.075 -1.805 -4.011 1.00 0.65 H new ATOM 0 HH22 ARG A 328 13.783 -1.506 -4.349 1.00 0.65 H new ATOM 348 N LEU A 329 10.350 0.884 3.228 1.00 0.18 N ATOM 349 CA LEU A 329 9.524 1.541 4.223 1.00 0.20 C ATOM 350 C LEU A 329 8.256 2.074 3.575 1.00 0.19 C ATOM 351 O LEU A 329 8.292 3.052 2.826 1.00 0.24 O ATOM 352 CB LEU A 329 10.288 2.684 4.892 1.00 0.25 C ATOM 353 CG LEU A 329 11.522 2.264 5.689 1.00 0.31 C ATOM 354 CD1 LEU A 329 12.255 3.490 6.207 1.00 0.37 C ATOM 355 CD2 LEU A 329 11.125 1.352 6.842 1.00 0.36 C ATOM 0 H LEU A 329 10.896 1.520 2.647 1.00 0.18 H new ATOM 0 HA LEU A 329 9.258 0.810 4.987 1.00 0.20 H new ATOM 0 HB2 LEU A 329 10.596 3.393 4.123 1.00 0.25 H new ATOM 0 HB3 LEU A 329 9.607 3.213 5.559 1.00 0.25 H new ATOM 0 HG LEU A 329 12.192 1.712 5.030 1.00 0.31 H new ATOM 0 HD11 LEU A 329 13.132 3.177 6.773 1.00 0.37 H new ATOM 0 HD12 LEU A 329 12.568 4.109 5.366 1.00 0.37 H new ATOM 0 HD13 LEU A 329 11.592 4.064 6.854 1.00 0.37 H new ATOM 0 HD21 LEU A 329 12.015 1.062 7.400 1.00 0.36 H new ATOM 0 HD22 LEU A 329 10.438 1.880 7.504 1.00 0.36 H new ATOM 0 HD23 LEU A 329 10.636 0.460 6.449 1.00 0.36 H new ATOM 367 N LEU A 330 7.145 1.416 3.846 1.00 0.17 N ATOM 368 CA LEU A 330 5.869 1.835 3.303 1.00 0.17 C ATOM 369 C LEU A 330 5.267 2.909 4.198 1.00 0.18 C ATOM 370 O LEU A 330 4.742 2.615 5.275 1.00 0.24 O ATOM 371 CB LEU A 330 4.919 0.640 3.180 1.00 0.22 C ATOM 372 CG LEU A 330 3.676 0.883 2.323 1.00 0.26 C ATOM 373 CD1 LEU A 330 4.074 1.188 0.885 1.00 0.57 C ATOM 374 CD2 LEU A 330 2.751 -0.322 2.380 1.00 0.49 C ATOM 0 H LEU A 330 7.101 0.588 4.440 1.00 0.17 H new ATOM 0 HA LEU A 330 6.022 2.246 2.305 1.00 0.17 H new ATOM 0 HB2 LEU A 330 5.471 -0.201 2.761 1.00 0.22 H new ATOM 0 HB3 LEU A 330 4.600 0.345 4.180 1.00 0.22 H new ATOM 0 HG LEU A 330 3.141 1.746 2.721 1.00 0.26 H new ATOM 0 HD11 LEU A 330 3.178 1.359 0.288 1.00 0.57 H new ATOM 0 HD12 LEU A 330 4.700 2.080 0.862 1.00 0.57 H new ATOM 0 HD13 LEU A 330 4.629 0.344 0.474 1.00 0.57 H new ATOM 0 HD21 LEU A 330 1.871 -0.134 1.765 1.00 0.49 H new ATOM 0 HD22 LEU A 330 3.275 -1.201 2.005 1.00 0.49 H new ATOM 0 HD23 LEU A 330 2.443 -0.496 3.411 1.00 0.49 H new ATOM 386 N GLY A 331 5.385 4.155 3.766 1.00 0.18 N ATOM 387 CA GLY A 331 4.902 5.265 4.555 1.00 0.22 C ATOM 388 C GLY A 331 3.472 5.624 4.225 1.00 0.22 C ATOM 389 O GLY A 331 3.185 6.114 3.131 1.00 0.29 O ATOM 0 H GLY A 331 5.810 4.417 2.877 1.00 0.18 H new ATOM 0 HA2 GLY A 331 4.977 5.015 5.613 1.00 0.22 H new ATOM 0 HA3 GLY A 331 5.540 6.132 4.387 1.00 0.22 H new ATOM 393 N ILE A 332 2.580 5.371 5.167 1.00 0.22 N ATOM 394 CA ILE A 332 1.173 5.685 4.989 1.00 0.22 C ATOM 395 C ILE A 332 0.866 7.030 5.627 1.00 0.24 C ATOM 396 O ILE A 332 0.959 7.176 6.846 1.00 0.36 O ATOM 397 CB ILE A 332 0.260 4.616 5.631 1.00 0.26 C ATOM 398 CG1 ILE A 332 0.690 3.202 5.219 1.00 0.27 C ATOM 399 CG2 ILE A 332 -1.195 4.863 5.252 1.00 0.28 C ATOM 400 CD1 ILE A 332 0.593 2.935 3.733 1.00 0.27 C ATOM 0 H ILE A 332 2.807 4.947 6.067 1.00 0.22 H new ATOM 0 HA ILE A 332 0.976 5.711 3.917 1.00 0.22 H new ATOM 0 HB ILE A 332 0.357 4.695 6.714 1.00 0.26 H new ATOM 0 HG12 ILE A 332 1.719 3.039 5.540 1.00 0.27 H new ATOM 0 HG13 ILE A 332 0.072 2.477 5.749 1.00 0.27 H new ATOM 0 HG21 ILE A 332 -1.825 4.102 5.712 1.00 0.28 H new ATOM 0 HG22 ILE A 332 -1.501 5.848 5.604 1.00 0.28 H new ATOM 0 HG23 ILE A 332 -1.302 4.816 4.168 1.00 0.28 H new ATOM 0 HD11 ILE A 332 0.915 1.915 3.525 1.00 0.27 H new ATOM 0 HD12 ILE A 332 -0.439 3.064 3.407 1.00 0.27 H new ATOM 0 HD13 ILE A 332 1.233 3.634 3.195 1.00 0.27 H new ATOM 412 N THR A 333 0.529 8.013 4.814 1.00 0.22 N ATOM 413 CA THR A 333 0.194 9.326 5.325 1.00 0.23 C ATOM 414 C THR A 333 -1.301 9.583 5.168 1.00 0.23 C ATOM 415 O THR A 333 -2.045 8.688 4.764 1.00 0.28 O ATOM 416 CB THR A 333 1.007 10.428 4.616 1.00 0.26 C ATOM 417 OG1 THR A 333 0.744 10.413 3.212 1.00 0.34 O ATOM 418 CG2 THR A 333 2.499 10.244 4.854 1.00 0.38 C ATOM 0 H THR A 333 0.480 7.926 3.799 1.00 0.22 H new ATOM 0 HA THR A 333 0.451 9.353 6.384 1.00 0.23 H new ATOM 0 HB THR A 333 0.702 11.388 5.032 1.00 0.26 H new ATOM 0 HG1 THR A 333 0.102 11.120 2.992 1.00 0.34 H new ATOM 0 HG21 THR A 333 3.049 11.034 4.343 1.00 0.38 H new ATOM 0 HG22 THR A 333 2.705 10.291 5.923 1.00 0.38 H new ATOM 0 HG23 THR A 333 2.812 9.275 4.466 1.00 0.38 H new ATOM 426 N LYS A 334 -1.741 10.797 5.478 1.00 0.26 N ATOM 427 CA LYS A 334 -3.167 11.107 5.475 1.00 0.28 C ATOM 428 C LYS A 334 -3.727 11.182 4.062 1.00 0.26 C ATOM 429 O LYS A 334 -4.929 11.020 3.858 1.00 0.43 O ATOM 430 CB LYS A 334 -3.448 12.432 6.196 1.00 0.38 C ATOM 431 CG LYS A 334 -2.902 13.667 5.486 1.00 0.47 C ATOM 432 CD LYS A 334 -3.456 14.939 6.109 1.00 0.63 C ATOM 433 CE LYS A 334 -2.912 16.193 5.442 1.00 0.89 C ATOM 434 NZ LYS A 334 -3.202 16.227 3.985 1.00 1.61 N ATOM 0 H LYS A 334 -1.137 11.578 5.733 1.00 0.26 H new ATOM 0 HA LYS A 334 -3.662 10.293 6.005 1.00 0.28 H new ATOM 0 HB2 LYS A 334 -4.526 12.544 6.316 1.00 0.38 H new ATOM 0 HB3 LYS A 334 -3.019 12.384 7.197 1.00 0.38 H new ATOM 0 HG2 LYS A 334 -1.814 13.673 5.543 1.00 0.47 H new ATOM 0 HG3 LYS A 334 -3.165 13.630 4.429 1.00 0.47 H new ATOM 0 HD2 LYS A 334 -4.543 14.933 6.035 1.00 0.63 H new ATOM 0 HD3 LYS A 334 -3.209 14.958 7.170 1.00 0.63 H new ATOM 0 HE2 LYS A 334 -3.346 17.072 5.917 1.00 0.89 H new ATOM 0 HE3 LYS A 334 -1.834 16.246 5.597 1.00 0.89 H new ATOM 0 HZ1 LYS A 334 -3.347 17.212 3.683 1.00 1.61 H new ATOM 0 HZ2 LYS A 334 -2.401 15.819 3.462 1.00 1.61 H new ATOM 0 HZ3 LYS A 334 -4.061 15.675 3.789 1.00 1.61 H new ATOM 448 N GLU A 335 -2.866 11.436 3.091 1.00 0.27 N ATOM 449 CA GLU A 335 -3.332 11.681 1.741 1.00 0.33 C ATOM 450 C GLU A 335 -2.683 10.755 0.712 1.00 0.27 C ATOM 451 O GLU A 335 -3.150 10.671 -0.429 1.00 0.34 O ATOM 452 CB GLU A 335 -3.097 13.149 1.360 1.00 0.46 C ATOM 453 CG GLU A 335 -1.632 13.573 1.314 1.00 0.56 C ATOM 454 CD GLU A 335 -0.998 13.771 2.676 1.00 0.85 C ATOM 455 OE1 GLU A 335 -1.050 14.896 3.211 1.00 1.04 O ATOM 456 OE2 GLU A 335 -0.466 12.788 3.231 1.00 1.79 O ATOM 0 H GLU A 335 -1.854 11.477 3.211 1.00 0.27 H new ATOM 0 HA GLU A 335 -4.400 11.465 1.729 1.00 0.33 H new ATOM 0 HB2 GLU A 335 -3.544 13.332 0.383 1.00 0.46 H new ATOM 0 HB3 GLU A 335 -3.622 13.783 2.074 1.00 0.46 H new ATOM 0 HG2 GLU A 335 -1.065 12.819 0.768 1.00 0.56 H new ATOM 0 HG3 GLU A 335 -1.552 14.502 0.750 1.00 0.56 H new ATOM 463 N CYS A 336 -1.625 10.048 1.094 1.00 0.23 N ATOM 464 CA CYS A 336 -0.915 9.216 0.134 1.00 0.24 C ATOM 465 C CYS A 336 -0.150 8.068 0.792 1.00 0.21 C ATOM 466 O CYS A 336 -0.026 7.991 2.014 1.00 0.28 O ATOM 467 CB CYS A 336 0.039 10.081 -0.696 1.00 0.32 C ATOM 468 SG CYS A 336 1.115 11.154 0.282 1.00 1.10 S ATOM 0 H CYS A 336 -1.247 10.034 2.041 1.00 0.23 H new ATOM 0 HA CYS A 336 -1.665 8.761 -0.513 1.00 0.24 H new ATOM 0 HB2 CYS A 336 0.659 9.429 -1.312 1.00 0.32 H new ATOM 0 HB3 CYS A 336 -0.548 10.698 -1.376 1.00 0.32 H new ATOM 0 HG CYS A 336 1.095 10.772 1.524 1.00 1.10 H new ATOM 474 N VAL A 337 0.327 7.163 -0.050 1.00 0.22 N ATOM 475 CA VAL A 337 1.167 6.052 0.360 1.00 0.21 C ATOM 476 C VAL A 337 2.490 6.127 -0.393 1.00 0.19 C ATOM 477 O VAL A 337 2.528 5.953 -1.611 1.00 0.22 O ATOM 478 CB VAL A 337 0.490 4.696 0.063 1.00 0.26 C ATOM 479 CG1 VAL A 337 1.404 3.539 0.433 1.00 0.27 C ATOM 480 CG2 VAL A 337 -0.837 4.587 0.798 1.00 0.32 C ATOM 0 H VAL A 337 0.137 7.182 -1.052 1.00 0.22 H new ATOM 0 HA VAL A 337 1.332 6.123 1.435 1.00 0.21 H new ATOM 0 HB VAL A 337 0.295 4.643 -1.008 1.00 0.26 H new ATOM 0 HG11 VAL A 337 0.904 2.596 0.214 1.00 0.27 H new ATOM 0 HG12 VAL A 337 2.325 3.604 -0.146 1.00 0.27 H new ATOM 0 HG13 VAL A 337 1.639 3.587 1.496 1.00 0.27 H new ATOM 0 HG21 VAL A 337 -1.298 3.625 0.576 1.00 0.32 H new ATOM 0 HG22 VAL A 337 -0.666 4.668 1.871 1.00 0.32 H new ATOM 0 HG23 VAL A 337 -1.499 5.390 0.474 1.00 0.32 H new ATOM 490 N MET A 338 3.567 6.405 0.316 1.00 0.17 N ATOM 491 CA MET A 338 4.857 6.611 -0.327 1.00 0.17 C ATOM 492 C MET A 338 5.816 5.463 -0.036 1.00 0.16 C ATOM 493 O MET A 338 5.880 4.956 1.085 1.00 0.20 O ATOM 494 CB MET A 338 5.475 7.939 0.121 1.00 0.22 C ATOM 495 CG MET A 338 5.749 8.018 1.616 1.00 0.24 C ATOM 496 SD MET A 338 6.468 9.596 2.106 1.00 1.08 S ATOM 497 CE MET A 338 5.149 10.721 1.651 1.00 0.62 C ATOM 0 H MET A 338 3.578 6.494 1.332 1.00 0.17 H new ATOM 0 HA MET A 338 4.686 6.643 -1.403 1.00 0.17 H new ATOM 0 HB2 MET A 338 6.409 8.094 -0.418 1.00 0.22 H new ATOM 0 HB3 MET A 338 4.806 8.753 -0.159 1.00 0.22 H new ATOM 0 HG2 MET A 338 4.818 7.862 2.161 1.00 0.24 H new ATOM 0 HG3 MET A 338 6.424 7.211 1.901 1.00 0.24 H new ATOM 0 HE1 MET A 338 5.268 11.659 2.193 1.00 0.62 H new ATOM 0 HE2 MET A 338 5.189 10.913 0.579 1.00 0.62 H new ATOM 0 HE3 MET A 338 4.187 10.275 1.904 1.00 0.62 H new ATOM 507 N ARG A 339 6.553 5.050 -1.057 1.00 0.16 N ATOM 508 CA ARG A 339 7.573 4.026 -0.897 1.00 0.17 C ATOM 509 C ARG A 339 8.918 4.660 -0.590 1.00 0.16 C ATOM 510 O ARG A 339 9.594 5.173 -1.484 1.00 0.18 O ATOM 511 CB ARG A 339 7.690 3.151 -2.147 1.00 0.22 C ATOM 512 CG ARG A 339 6.530 2.193 -2.332 1.00 0.27 C ATOM 513 CD ARG A 339 6.874 1.082 -3.311 1.00 0.31 C ATOM 514 NE ARG A 339 6.927 1.533 -4.702 1.00 0.73 N ATOM 515 CZ ARG A 339 7.517 0.843 -5.682 1.00 1.03 C ATOM 516 NH1 ARG A 339 8.160 -0.288 -5.414 1.00 1.15 N ATOM 517 NH2 ARG A 339 7.450 1.279 -6.933 1.00 1.55 N ATOM 0 H ARG A 339 6.463 5.410 -2.007 1.00 0.16 H new ATOM 0 HA ARG A 339 7.273 3.393 -0.062 1.00 0.17 H new ATOM 0 HB2 ARG A 339 7.762 3.794 -3.024 1.00 0.22 H new ATOM 0 HB3 ARG A 339 8.617 2.579 -2.094 1.00 0.22 H new ATOM 0 HG2 ARG A 339 6.258 1.760 -1.370 1.00 0.27 H new ATOM 0 HG3 ARG A 339 5.659 2.740 -2.693 1.00 0.27 H new ATOM 0 HD2 ARG A 339 7.838 0.653 -3.038 1.00 0.31 H new ATOM 0 HD3 ARG A 339 6.134 0.287 -3.222 1.00 0.31 H new ATOM 0 HE ARG A 339 6.489 2.424 -4.936 1.00 0.73 H new ATOM 0 HH11 ARG A 339 8.205 -0.634 -4.456 1.00 1.15 H new ATOM 0 HH12 ARG A 339 8.608 -0.810 -6.167 1.00 1.15 H new ATOM 0 HH21 ARG A 339 6.948 2.141 -7.146 1.00 1.55 H new ATOM 0 HH22 ARG A 339 7.900 0.752 -7.681 1.00 1.55 H new ATOM 531 N VAL A 340 9.288 4.638 0.676 1.00 0.18 N ATOM 532 CA VAL A 340 10.571 5.157 1.113 1.00 0.22 C ATOM 533 C VAL A 340 11.560 4.010 1.238 1.00 0.24 C ATOM 534 O VAL A 340 11.226 2.960 1.781 1.00 0.24 O ATOM 535 CB VAL A 340 10.437 5.889 2.467 1.00 0.25 C ATOM 536 CG1 VAL A 340 11.783 6.409 2.949 1.00 0.31 C ATOM 537 CG2 VAL A 340 9.432 7.025 2.359 1.00 0.28 C ATOM 0 H VAL A 340 8.711 4.262 1.428 1.00 0.18 H new ATOM 0 HA VAL A 340 10.930 5.874 0.375 1.00 0.22 H new ATOM 0 HB VAL A 340 10.075 5.171 3.203 1.00 0.25 H new ATOM 0 HG11 VAL A 340 11.655 6.919 3.904 1.00 0.31 H new ATOM 0 HG12 VAL A 340 12.472 5.574 3.073 1.00 0.31 H new ATOM 0 HG13 VAL A 340 12.187 7.107 2.216 1.00 0.31 H new ATOM 0 HG21 VAL A 340 9.349 7.530 3.321 1.00 0.28 H new ATOM 0 HG22 VAL A 340 9.766 7.736 1.603 1.00 0.28 H new ATOM 0 HG23 VAL A 340 8.459 6.624 2.075 1.00 0.28 H new ATOM 547 N ASP A 341 12.761 4.180 0.706 1.00 0.30 N ATOM 548 CA ASP A 341 13.760 3.125 0.783 1.00 0.36 C ATOM 549 C ASP A 341 14.172 2.872 2.225 1.00 0.38 C ATOM 550 O ASP A 341 14.274 3.801 3.027 1.00 0.41 O ATOM 551 CB ASP A 341 14.993 3.435 -0.057 1.00 0.46 C ATOM 552 CG ASP A 341 15.981 2.289 -0.001 1.00 0.55 C ATOM 553 OD1 ASP A 341 15.648 1.181 -0.466 1.00 0.67 O ATOM 554 OD2 ASP A 341 17.117 2.507 0.463 1.00 0.77 O ATOM 0 H ASP A 341 13.065 5.025 0.223 1.00 0.30 H new ATOM 0 HA ASP A 341 13.296 2.226 0.377 1.00 0.36 H new ATOM 0 HB2 ASP A 341 14.699 3.618 -1.090 1.00 0.46 H new ATOM 0 HB3 ASP A 341 15.466 4.348 0.306 1.00 0.46 H new ATOM 559 N GLU A 342 14.415 1.607 2.534 1.00 0.42 N ATOM 560 CA GLU A 342 14.738 1.173 3.885 1.00 0.47 C ATOM 561 C GLU A 342 15.980 1.889 4.415 1.00 0.60 C ATOM 562 O GLU A 342 15.961 2.454 5.508 1.00 0.72 O ATOM 563 CB GLU A 342 14.945 -0.348 3.879 1.00 0.49 C ATOM 564 CG GLU A 342 15.058 -0.999 5.250 1.00 0.60 C ATOM 565 CD GLU A 342 16.416 -0.818 5.897 1.00 0.95 C ATOM 566 OE1 GLU A 342 17.431 -1.221 5.290 1.00 1.36 O ATOM 567 OE2 GLU A 342 16.467 -0.281 7.021 1.00 1.51 O ATOM 0 H GLU A 342 14.394 0.849 1.852 1.00 0.42 H new ATOM 0 HA GLU A 342 13.913 1.428 4.551 1.00 0.47 H new ATOM 0 HB2 GLU A 342 14.114 -0.808 3.345 1.00 0.49 H new ATOM 0 HB3 GLU A 342 15.850 -0.572 3.314 1.00 0.49 H new ATOM 0 HG2 GLU A 342 14.294 -0.581 5.905 1.00 0.60 H new ATOM 0 HG3 GLU A 342 14.849 -2.065 5.155 1.00 0.60 H new ATOM 574 N LYS A 343 17.046 1.887 3.630 1.00 0.69 N ATOM 575 CA LYS A 343 18.324 2.396 4.102 1.00 0.87 C ATOM 576 C LYS A 343 18.594 3.809 3.593 1.00 0.79 C ATOM 577 O LYS A 343 19.027 4.674 4.353 1.00 0.86 O ATOM 578 CB LYS A 343 19.448 1.457 3.670 1.00 1.08 C ATOM 579 CG LYS A 343 20.786 1.767 4.310 1.00 1.36 C ATOM 580 CD LYS A 343 21.815 0.712 3.958 1.00 1.63 C ATOM 581 CE LYS A 343 23.126 0.950 4.682 1.00 2.26 C ATOM 582 NZ LYS A 343 24.103 -0.137 4.420 1.00 3.06 N ATOM 0 H LYS A 343 17.052 1.541 2.670 1.00 0.69 H new ATOM 0 HA LYS A 343 18.284 2.441 5.190 1.00 0.87 H new ATOM 0 HB2 LYS A 343 19.167 0.433 3.916 1.00 1.08 H new ATOM 0 HB3 LYS A 343 19.554 1.507 2.586 1.00 1.08 H new ATOM 0 HG2 LYS A 343 21.134 2.745 3.977 1.00 1.36 H new ATOM 0 HG3 LYS A 343 20.671 1.821 5.393 1.00 1.36 H new ATOM 0 HD2 LYS A 343 21.429 -0.274 4.216 1.00 1.63 H new ATOM 0 HD3 LYS A 343 21.987 0.715 2.882 1.00 1.63 H new ATOM 0 HE2 LYS A 343 23.549 1.903 4.365 1.00 2.26 H new ATOM 0 HE3 LYS A 343 22.942 1.023 5.754 1.00 2.26 H new ATOM 0 HZ1 LYS A 343 24.987 0.060 4.931 1.00 3.06 H new ATOM 0 HZ2 LYS A 343 23.710 -1.043 4.745 1.00 3.06 H new ATOM 0 HZ3 LYS A 343 24.298 -0.190 3.400 1.00 3.06 H new ATOM 596 N THR A 344 18.327 4.044 2.315 1.00 0.73 N ATOM 597 CA THR A 344 18.626 5.330 1.700 1.00 0.72 C ATOM 598 C THR A 344 17.616 6.389 2.141 1.00 0.63 C ATOM 599 O THR A 344 17.881 7.587 2.054 1.00 0.67 O ATOM 600 CB THR A 344 18.620 5.219 0.162 1.00 0.80 C ATOM 601 OG1 THR A 344 19.121 3.936 -0.235 1.00 0.92 O ATOM 602 CG2 THR A 344 19.479 6.306 -0.467 1.00 0.92 C ATOM 0 H THR A 344 17.905 3.362 1.685 1.00 0.73 H new ATOM 0 HA THR A 344 19.621 5.630 2.028 1.00 0.72 H new ATOM 0 HB THR A 344 17.593 5.341 -0.182 1.00 0.80 H new ATOM 0 HG1 THR A 344 18.376 3.305 -0.319 1.00 0.92 H new ATOM 0 HG21 THR A 344 19.457 6.205 -1.552 1.00 0.92 H new ATOM 0 HG22 THR A 344 19.090 7.285 -0.186 1.00 0.92 H new ATOM 0 HG23 THR A 344 20.506 6.208 -0.114 1.00 0.92 H new ATOM 610 N LYS A 345 16.454 5.925 2.615 1.00 0.55 N ATOM 611 CA LYS A 345 15.393 6.803 3.119 1.00 0.52 C ATOM 612 C LYS A 345 14.867 7.728 2.018 1.00 0.53 C ATOM 613 O LYS A 345 14.299 8.785 2.298 1.00 0.61 O ATOM 614 CB LYS A 345 15.889 7.635 4.311 1.00 0.61 C ATOM 615 CG LYS A 345 16.494 6.811 5.444 1.00 0.63 C ATOM 616 CD LYS A 345 15.498 5.830 6.041 1.00 0.62 C ATOM 617 CE LYS A 345 16.102 5.087 7.224 1.00 0.71 C ATOM 618 NZ LYS A 345 15.170 4.081 7.798 1.00 1.50 N ATOM 0 H LYS A 345 16.223 4.932 2.660 1.00 0.55 H new ATOM 0 HA LYS A 345 14.574 6.166 3.453 1.00 0.52 H new ATOM 0 HB2 LYS A 345 16.635 8.347 3.957 1.00 0.61 H new ATOM 0 HB3 LYS A 345 15.055 8.216 4.705 1.00 0.61 H new ATOM 0 HG2 LYS A 345 17.359 6.264 5.070 1.00 0.63 H new ATOM 0 HG3 LYS A 345 16.853 7.481 6.225 1.00 0.63 H new ATOM 0 HD2 LYS A 345 14.604 6.365 6.362 1.00 0.62 H new ATOM 0 HD3 LYS A 345 15.186 5.115 5.280 1.00 0.62 H new ATOM 0 HE2 LYS A 345 17.019 4.590 6.907 1.00 0.71 H new ATOM 0 HE3 LYS A 345 16.379 5.804 7.997 1.00 0.71 H new ATOM 0 HZ1 LYS A 345 15.502 3.799 8.742 1.00 1.50 H new ATOM 0 HZ2 LYS A 345 14.218 4.493 7.875 1.00 1.50 H new ATOM 0 HZ3 LYS A 345 15.137 3.246 7.179 1.00 1.50 H new ATOM 632 N GLU A 346 15.035 7.312 0.770 1.00 0.53 N ATOM 633 CA GLU A 346 14.575 8.095 -0.369 1.00 0.58 C ATOM 634 C GLU A 346 13.169 7.677 -0.779 1.00 0.44 C ATOM 635 O GLU A 346 12.827 6.495 -0.727 1.00 0.42 O ATOM 636 CB GLU A 346 15.526 7.926 -1.555 1.00 0.77 C ATOM 637 CG GLU A 346 16.906 8.510 -1.318 1.00 0.95 C ATOM 638 CD GLU A 346 16.867 9.999 -1.056 1.00 1.61 C ATOM 639 OE1 GLU A 346 16.502 10.760 -1.975 1.00 1.81 O ATOM 640 OE2 GLU A 346 17.208 10.417 0.072 1.00 2.46 O ATOM 0 H GLU A 346 15.488 6.433 0.520 1.00 0.53 H new ATOM 0 HA GLU A 346 14.559 9.143 -0.071 1.00 0.58 H new ATOM 0 HB2 GLU A 346 15.624 6.864 -1.782 1.00 0.77 H new ATOM 0 HB3 GLU A 346 15.086 8.400 -2.432 1.00 0.77 H new ATOM 0 HG2 GLU A 346 17.369 8.007 -0.469 1.00 0.95 H new ATOM 0 HG3 GLU A 346 17.534 8.313 -2.187 1.00 0.95 H new ATOM 647 N VAL A 347 12.361 8.648 -1.180 1.00 0.39 N ATOM 648 CA VAL A 347 11.009 8.375 -1.646 1.00 0.33 C ATOM 649 C VAL A 347 11.032 8.014 -3.126 1.00 0.31 C ATOM 650 O VAL A 347 11.236 8.874 -3.985 1.00 0.42 O ATOM 651 CB VAL A 347 10.068 9.579 -1.425 1.00 0.41 C ATOM 652 CG1 VAL A 347 8.647 9.241 -1.854 1.00 0.54 C ATOM 653 CG2 VAL A 347 10.097 10.024 0.031 1.00 0.58 C ATOM 0 H VAL A 347 12.619 9.635 -1.192 1.00 0.39 H new ATOM 0 HA VAL A 347 10.626 7.537 -1.063 1.00 0.33 H new ATOM 0 HB VAL A 347 10.423 10.404 -2.043 1.00 0.41 H new ATOM 0 HG11 VAL A 347 8.002 10.104 -1.689 1.00 0.54 H new ATOM 0 HG12 VAL A 347 8.639 8.979 -2.912 1.00 0.54 H new ATOM 0 HG13 VAL A 347 8.281 8.398 -1.268 1.00 0.54 H new ATOM 0 HG21 VAL A 347 9.427 10.873 0.165 1.00 0.58 H new ATOM 0 HG22 VAL A 347 9.773 9.202 0.669 1.00 0.58 H new ATOM 0 HG23 VAL A 347 11.112 10.316 0.302 1.00 0.58 H new ATOM 663 N ILE A 348 10.835 6.738 -3.414 1.00 0.25 N ATOM 664 CA ILE A 348 10.910 6.237 -4.779 1.00 0.26 C ATOM 665 C ILE A 348 9.635 6.565 -5.555 1.00 0.26 C ATOM 666 O ILE A 348 9.688 7.111 -6.657 1.00 0.35 O ATOM 667 CB ILE A 348 11.144 4.711 -4.793 1.00 0.27 C ATOM 668 CG1 ILE A 348 12.408 4.366 -3.996 1.00 0.29 C ATOM 669 CG2 ILE A 348 11.254 4.196 -6.224 1.00 0.32 C ATOM 670 CD1 ILE A 348 12.651 2.880 -3.852 1.00 0.31 C ATOM 0 H ILE A 348 10.621 6.025 -2.717 1.00 0.25 H new ATOM 0 HA ILE A 348 11.753 6.730 -5.262 1.00 0.26 H new ATOM 0 HB ILE A 348 10.290 4.223 -4.323 1.00 0.27 H new ATOM 0 HG12 ILE A 348 13.270 4.820 -4.485 1.00 0.29 H new ATOM 0 HG13 ILE A 348 12.333 4.811 -3.004 1.00 0.29 H new ATOM 0 HG21 ILE A 348 11.419 3.119 -6.211 1.00 0.32 H new ATOM 0 HG22 ILE A 348 10.332 4.416 -6.762 1.00 0.32 H new ATOM 0 HG23 ILE A 348 12.090 4.685 -6.723 1.00 0.32 H new ATOM 0 HD11 ILE A 348 13.562 2.714 -3.277 1.00 0.31 H new ATOM 0 HD12 ILE A 348 11.808 2.422 -3.336 1.00 0.31 H new ATOM 0 HD13 ILE A 348 12.759 2.432 -4.840 1.00 0.31 H new ATOM 682 N GLN A 349 8.493 6.241 -4.967 1.00 0.23 N ATOM 683 CA GLN A 349 7.210 6.458 -5.620 1.00 0.23 C ATOM 684 C GLN A 349 6.129 6.722 -4.582 1.00 0.22 C ATOM 685 O GLN A 349 6.109 6.087 -3.526 1.00 0.29 O ATOM 686 CB GLN A 349 6.840 5.242 -6.474 1.00 0.28 C ATOM 687 CG GLN A 349 5.496 5.366 -7.179 1.00 0.40 C ATOM 688 CD GLN A 349 5.174 4.154 -8.032 1.00 0.86 C ATOM 689 OE1 GLN A 349 5.601 3.043 -7.730 1.00 1.65 O ATOM 690 NE2 GLN A 349 4.418 4.360 -9.098 1.00 0.81 N ATOM 0 H GLN A 349 8.428 5.826 -4.037 1.00 0.23 H new ATOM 0 HA GLN A 349 7.290 7.330 -6.269 1.00 0.23 H new ATOM 0 HB2 GLN A 349 7.618 5.086 -7.222 1.00 0.28 H new ATOM 0 HB3 GLN A 349 6.825 4.356 -5.839 1.00 0.28 H new ATOM 0 HG2 GLN A 349 4.711 5.502 -6.436 1.00 0.40 H new ATOM 0 HG3 GLN A 349 5.499 6.257 -7.806 1.00 0.40 H new ATOM 0 HE21 GLN A 349 4.084 5.300 -9.313 1.00 0.81 H new ATOM 0 HE22 GLN A 349 4.169 3.579 -9.705 1.00 0.81 H new ATOM 699 N GLU A 350 5.248 7.662 -4.880 1.00 0.23 N ATOM 700 CA GLU A 350 4.150 7.999 -3.991 1.00 0.25 C ATOM 701 C GLU A 350 2.816 7.761 -4.689 1.00 0.26 C ATOM 702 O GLU A 350 2.618 8.195 -5.822 1.00 0.36 O ATOM 703 CB GLU A 350 4.250 9.463 -3.560 1.00 0.30 C ATOM 704 CG GLU A 350 3.081 9.934 -2.712 1.00 0.36 C ATOM 705 CD GLU A 350 3.074 11.433 -2.515 1.00 0.45 C ATOM 706 OE1 GLU A 350 2.673 12.159 -3.451 1.00 0.60 O ATOM 707 OE2 GLU A 350 3.455 11.897 -1.423 1.00 0.65 O ATOM 0 H GLU A 350 5.273 8.210 -5.740 1.00 0.23 H new ATOM 0 HA GLU A 350 4.210 7.362 -3.109 1.00 0.25 H new ATOM 0 HB2 GLU A 350 5.174 9.605 -2.999 1.00 0.30 H new ATOM 0 HB3 GLU A 350 4.318 10.090 -4.449 1.00 0.30 H new ATOM 0 HG2 GLU A 350 2.147 9.629 -3.185 1.00 0.36 H new ATOM 0 HG3 GLU A 350 3.121 9.443 -1.739 1.00 0.36 H new ATOM 714 N TRP A 351 1.916 7.062 -4.018 1.00 0.23 N ATOM 715 CA TRP A 351 0.569 6.872 -4.527 1.00 0.26 C ATOM 716 C TRP A 351 -0.414 7.678 -3.696 1.00 0.25 C ATOM 717 O TRP A 351 -0.520 7.476 -2.493 1.00 0.52 O ATOM 718 CB TRP A 351 0.159 5.402 -4.466 1.00 0.30 C ATOM 719 CG TRP A 351 1.063 4.477 -5.214 1.00 0.30 C ATOM 720 CD1 TRP A 351 1.241 4.416 -6.562 1.00 0.38 C ATOM 721 CD2 TRP A 351 1.890 3.456 -4.653 1.00 0.30 C ATOM 722 NE1 TRP A 351 2.132 3.421 -6.875 1.00 0.41 N ATOM 723 CE2 TRP A 351 2.545 2.817 -5.721 1.00 0.34 C ATOM 724 CE3 TRP A 351 2.141 3.020 -3.350 1.00 0.35 C ATOM 725 CZ2 TRP A 351 3.434 1.769 -5.528 1.00 0.38 C ATOM 726 CZ3 TRP A 351 3.024 1.977 -3.160 1.00 0.40 C ATOM 727 CH2 TRP A 351 3.661 1.362 -4.245 1.00 0.39 C ATOM 0 H TRP A 351 2.095 6.616 -3.118 1.00 0.23 H new ATOM 0 HA TRP A 351 0.556 7.205 -5.565 1.00 0.26 H new ATOM 0 HB2 TRP A 351 0.124 5.090 -3.422 1.00 0.30 H new ATOM 0 HB3 TRP A 351 -0.851 5.303 -4.863 1.00 0.30 H new ATOM 0 HD1 TRP A 351 0.752 5.057 -7.280 1.00 0.38 H new ATOM 0 HE1 TRP A 351 2.437 3.172 -7.816 1.00 0.41 H new ATOM 0 HE3 TRP A 351 1.654 3.490 -2.508 1.00 0.35 H new ATOM 0 HZ2 TRP A 351 3.928 1.293 -6.362 1.00 0.38 H new ATOM 0 HZ3 TRP A 351 3.227 1.629 -2.158 1.00 0.40 H new ATOM 0 HH2 TRP A 351 4.347 0.548 -4.063 1.00 0.39 H new ATOM 738 N SER A 352 -1.131 8.583 -4.327 1.00 0.31 N ATOM 739 CA SER A 352 -2.172 9.318 -3.635 1.00 0.30 C ATOM 740 C SER A 352 -3.360 8.397 -3.379 1.00 0.26 C ATOM 741 O SER A 352 -3.659 7.528 -4.197 1.00 0.28 O ATOM 742 CB SER A 352 -2.590 10.532 -4.462 1.00 0.35 C ATOM 743 OG SER A 352 -1.472 11.362 -4.733 1.00 1.27 O ATOM 0 H SER A 352 -1.015 8.827 -5.310 1.00 0.31 H new ATOM 0 HA SER A 352 -1.795 9.674 -2.676 1.00 0.30 H new ATOM 0 HB2 SER A 352 -3.041 10.203 -5.398 1.00 0.35 H new ATOM 0 HB3 SER A 352 -3.350 11.100 -3.925 1.00 0.35 H new ATOM 0 HG SER A 352 -1.759 12.133 -5.265 1.00 1.27 H new ATOM 749 N LEU A 353 -4.029 8.578 -2.242 1.00 0.25 N ATOM 750 CA LEU A 353 -5.154 7.716 -1.870 1.00 0.24 C ATOM 751 C LEU A 353 -6.290 7.827 -2.885 1.00 0.23 C ATOM 752 O LEU A 353 -7.140 6.946 -2.984 1.00 0.23 O ATOM 753 CB LEU A 353 -5.667 8.069 -0.469 1.00 0.25 C ATOM 754 CG LEU A 353 -4.641 7.930 0.659 1.00 0.26 C ATOM 755 CD1 LEU A 353 -5.277 8.248 2.001 1.00 0.31 C ATOM 756 CD2 LEU A 353 -4.042 6.534 0.677 1.00 0.26 C ATOM 0 H LEU A 353 -3.815 9.309 -1.564 1.00 0.25 H new ATOM 0 HA LEU A 353 -4.795 6.687 -1.865 1.00 0.24 H new ATOM 0 HB2 LEU A 353 -6.031 9.096 -0.482 1.00 0.25 H new ATOM 0 HB3 LEU A 353 -6.521 7.431 -0.242 1.00 0.25 H new ATOM 0 HG LEU A 353 -3.839 8.645 0.476 1.00 0.26 H new ATOM 0 HD11 LEU A 353 -4.533 8.144 2.790 1.00 0.31 H new ATOM 0 HD12 LEU A 353 -5.655 9.270 1.991 1.00 0.31 H new ATOM 0 HD13 LEU A 353 -6.101 7.558 2.186 1.00 0.31 H new ATOM 0 HD21 LEU A 353 -3.316 6.460 1.487 1.00 0.26 H new ATOM 0 HD22 LEU A 353 -4.833 5.800 0.831 1.00 0.26 H new ATOM 0 HD23 LEU A 353 -3.546 6.339 -0.274 1.00 0.26 H new ATOM 768 N THR A 354 -6.280 8.914 -3.641 1.00 0.26 N ATOM 769 CA THR A 354 -7.280 9.158 -4.667 1.00 0.28 C ATOM 770 C THR A 354 -6.994 8.339 -5.927 1.00 0.28 C ATOM 771 O THR A 354 -7.822 8.263 -6.836 1.00 0.35 O ATOM 772 CB THR A 354 -7.304 10.653 -5.045 1.00 0.36 C ATOM 773 OG1 THR A 354 -6.052 11.020 -5.643 1.00 0.44 O ATOM 774 CG2 THR A 354 -7.541 11.532 -3.823 1.00 0.42 C ATOM 0 H THR A 354 -5.579 9.651 -3.560 1.00 0.26 H new ATOM 0 HA THR A 354 -8.246 8.859 -4.259 1.00 0.28 H new ATOM 0 HB THR A 354 -8.122 10.806 -5.749 1.00 0.36 H new ATOM 0 HG1 THR A 354 -6.070 11.970 -5.884 1.00 0.44 H new ATOM 0 HG21 THR A 354 -7.552 12.579 -4.125 1.00 0.42 H new ATOM 0 HG22 THR A 354 -8.498 11.275 -3.370 1.00 0.42 H new ATOM 0 HG23 THR A 354 -6.742 11.372 -3.099 1.00 0.42 H new ATOM 782 N ASN A 355 -5.811 7.738 -5.980 1.00 0.26 N ATOM 783 CA ASN A 355 -5.384 6.997 -7.160 1.00 0.30 C ATOM 784 C ASN A 355 -5.425 5.500 -6.889 1.00 0.28 C ATOM 785 O ASN A 355 -4.962 4.695 -7.696 1.00 0.33 O ATOM 786 CB ASN A 355 -3.966 7.410 -7.573 1.00 0.37 C ATOM 787 CG ASN A 355 -3.825 8.905 -7.807 1.00 0.49 C ATOM 788 OD1 ASN A 355 -4.791 9.595 -8.139 1.00 0.83 O ATOM 789 ND2 ASN A 355 -2.615 9.420 -7.646 1.00 0.66 N ATOM 0 H ASN A 355 -5.131 7.749 -5.220 1.00 0.26 H new ATOM 0 HA ASN A 355 -6.070 7.230 -7.975 1.00 0.30 H new ATOM 0 HB2 ASN A 355 -3.264 7.102 -6.798 1.00 0.37 H new ATOM 0 HB3 ASN A 355 -3.690 6.878 -8.483 1.00 0.37 H new ATOM 0 HD21 ASN A 355 -2.461 10.417 -7.797 1.00 0.66 H new ATOM 0 HD22 ASN A 355 -1.838 8.820 -7.371 1.00 0.66 H new ATOM 796 N ILE A 356 -5.981 5.138 -5.743 1.00 0.26 N ATOM 797 CA ILE A 356 -6.098 3.743 -5.357 1.00 0.28 C ATOM 798 C ILE A 356 -7.428 3.180 -5.848 1.00 0.28 C ATOM 799 O ILE A 356 -8.434 3.887 -5.871 1.00 0.38 O ATOM 800 CB ILE A 356 -5.980 3.576 -3.822 1.00 0.31 C ATOM 801 CG1 ILE A 356 -4.619 4.089 -3.340 1.00 0.33 C ATOM 802 CG2 ILE A 356 -6.172 2.121 -3.418 1.00 0.36 C ATOM 803 CD1 ILE A 356 -4.410 3.960 -1.846 1.00 0.38 C ATOM 0 H ILE A 356 -6.360 5.796 -5.062 1.00 0.26 H new ATOM 0 HA ILE A 356 -5.280 3.190 -5.819 1.00 0.28 H new ATOM 0 HB ILE A 356 -6.767 4.165 -3.350 1.00 0.31 H new ATOM 0 HG12 ILE A 356 -3.831 3.540 -3.856 1.00 0.33 H new ATOM 0 HG13 ILE A 356 -4.516 5.137 -3.623 1.00 0.33 H new ATOM 0 HG21 ILE A 356 -6.085 2.029 -2.335 1.00 0.36 H new ATOM 0 HG22 ILE A 356 -7.160 1.783 -3.732 1.00 0.36 H new ATOM 0 HG23 ILE A 356 -5.409 1.507 -3.897 1.00 0.36 H new ATOM 0 HD11 ILE A 356 -3.425 4.344 -1.582 1.00 0.38 H new ATOM 0 HD12 ILE A 356 -5.175 4.532 -1.321 1.00 0.38 H new ATOM 0 HD13 ILE A 356 -4.480 2.911 -1.558 1.00 0.38 H new ATOM 815 N LYS A 357 -7.422 1.925 -6.272 1.00 0.26 N ATOM 816 CA LYS A 357 -8.632 1.281 -6.761 1.00 0.30 C ATOM 817 C LYS A 357 -9.161 0.280 -5.734 1.00 0.31 C ATOM 818 O LYS A 357 -10.332 0.319 -5.355 1.00 0.45 O ATOM 819 CB LYS A 357 -8.342 0.582 -8.092 1.00 0.35 C ATOM 820 CG LYS A 357 -9.525 -0.175 -8.673 1.00 0.46 C ATOM 821 CD LYS A 357 -9.148 -0.859 -9.976 1.00 0.60 C ATOM 822 CE LYS A 357 -10.265 -1.751 -10.486 1.00 0.79 C ATOM 823 NZ LYS A 357 -9.881 -2.452 -11.739 1.00 1.75 N ATOM 0 H LYS A 357 -6.592 1.332 -6.287 1.00 0.26 H new ATOM 0 HA LYS A 357 -9.398 2.040 -6.918 1.00 0.30 H new ATOM 0 HB2 LYS A 357 -8.012 1.327 -8.816 1.00 0.35 H new ATOM 0 HB3 LYS A 357 -7.515 -0.114 -7.951 1.00 0.35 H new ATOM 0 HG2 LYS A 357 -9.873 -0.918 -7.956 1.00 0.46 H new ATOM 0 HG3 LYS A 357 -10.352 0.513 -8.846 1.00 0.46 H new ATOM 0 HD2 LYS A 357 -8.912 -0.105 -10.728 1.00 0.60 H new ATOM 0 HD3 LYS A 357 -8.247 -1.454 -9.827 1.00 0.60 H new ATOM 0 HE2 LYS A 357 -10.522 -2.485 -9.722 1.00 0.79 H new ATOM 0 HE3 LYS A 357 -11.157 -1.151 -10.664 1.00 0.79 H new ATOM 0 HZ1 LYS A 357 -10.669 -3.052 -12.057 1.00 1.75 H new ATOM 0 HZ2 LYS A 357 -9.660 -1.751 -12.475 1.00 1.75 H new ATOM 0 HZ3 LYS A 357 -9.044 -3.044 -11.563 1.00 1.75 H new ATOM 837 N ARG A 358 -8.284 -0.614 -5.290 1.00 0.26 N ATOM 838 CA ARG A 358 -8.646 -1.651 -4.329 1.00 0.29 C ATOM 839 C ARG A 358 -7.385 -2.240 -3.711 1.00 0.28 C ATOM 840 O ARG A 358 -6.325 -2.237 -4.338 1.00 0.35 O ATOM 841 CB ARG A 358 -9.468 -2.752 -5.016 1.00 0.34 C ATOM 842 CG ARG A 358 -8.794 -3.337 -6.244 1.00 0.37 C ATOM 843 CD ARG A 358 -9.785 -4.048 -7.150 1.00 0.54 C ATOM 844 NE ARG A 358 -10.551 -5.077 -6.448 1.00 0.83 N ATOM 845 CZ ARG A 358 -10.896 -6.245 -6.988 1.00 1.19 C ATOM 846 NH1 ARG A 358 -10.494 -6.562 -8.212 1.00 1.46 N ATOM 847 NH2 ARG A 358 -11.640 -7.098 -6.293 1.00 1.75 N ATOM 0 H ARG A 358 -7.308 -0.641 -5.584 1.00 0.26 H new ATOM 0 HA ARG A 358 -9.255 -1.209 -3.541 1.00 0.29 H new ATOM 0 HB2 ARG A 358 -9.658 -3.552 -4.300 1.00 0.34 H new ATOM 0 HB3 ARG A 358 -10.437 -2.344 -5.303 1.00 0.34 H new ATOM 0 HG2 ARG A 358 -8.300 -2.541 -6.801 1.00 0.37 H new ATOM 0 HG3 ARG A 358 -8.019 -4.038 -5.934 1.00 0.37 H new ATOM 0 HD2 ARG A 358 -10.472 -3.316 -7.576 1.00 0.54 H new ATOM 0 HD3 ARG A 358 -9.248 -4.504 -7.982 1.00 0.54 H new ATOM 0 HE ARG A 358 -10.838 -4.889 -5.487 1.00 0.83 H new ATOM 0 HH11 ARG A 358 -9.918 -5.910 -8.744 1.00 1.46 H new ATOM 0 HH12 ARG A 358 -10.761 -7.458 -8.621 1.00 1.46 H new ATOM 0 HH21 ARG A 358 -11.945 -6.858 -5.350 1.00 1.75 H new ATOM 0 HH22 ARG A 358 -11.906 -7.993 -6.703 1.00 1.75 H new ATOM 861 N TRP A 359 -7.487 -2.719 -2.484 1.00 0.25 N ATOM 862 CA TRP A 359 -6.348 -3.342 -1.830 1.00 0.27 C ATOM 863 C TRP A 359 -6.734 -4.674 -1.206 1.00 0.28 C ATOM 864 O TRP A 359 -7.905 -4.923 -0.918 1.00 0.36 O ATOM 865 CB TRP A 359 -5.736 -2.410 -0.775 1.00 0.28 C ATOM 866 CG TRP A 359 -6.691 -1.958 0.290 1.00 0.27 C ATOM 867 CD1 TRP A 359 -7.074 -2.654 1.399 1.00 0.36 C ATOM 868 CD2 TRP A 359 -7.365 -0.697 0.357 1.00 0.25 C ATOM 869 NE1 TRP A 359 -7.949 -1.907 2.149 1.00 0.35 N ATOM 870 CE2 TRP A 359 -8.144 -0.700 1.529 1.00 0.29 C ATOM 871 CE3 TRP A 359 -7.386 0.435 -0.462 1.00 0.32 C ATOM 872 CZ2 TRP A 359 -8.936 0.383 1.900 1.00 0.33 C ATOM 873 CZ3 TRP A 359 -8.172 1.509 -0.092 1.00 0.40 C ATOM 874 CH2 TRP A 359 -8.937 1.477 1.080 1.00 0.39 C ATOM 0 H TRP A 359 -8.339 -2.690 -1.924 1.00 0.25 H new ATOM 0 HA TRP A 359 -5.594 -3.531 -2.594 1.00 0.27 H new ATOM 0 HB2 TRP A 359 -4.898 -2.921 -0.300 1.00 0.28 H new ATOM 0 HB3 TRP A 359 -5.330 -1.532 -1.277 1.00 0.28 H new ATOM 0 HD1 TRP A 359 -6.738 -3.649 1.651 1.00 0.36 H new ATOM 0 HE1 TRP A 359 -8.383 -2.202 3.024 1.00 0.35 H new ATOM 0 HE3 TRP A 359 -6.799 0.470 -1.368 1.00 0.32 H new ATOM 0 HZ2 TRP A 359 -9.528 0.360 2.803 1.00 0.33 H new ATOM 0 HZ3 TRP A 359 -8.197 2.389 -0.718 1.00 0.40 H new ATOM 0 HH2 TRP A 359 -9.540 2.334 1.342 1.00 0.39 H new ATOM 885 N ALA A 360 -5.738 -5.527 -1.022 1.00 0.25 N ATOM 886 CA ALA A 360 -5.926 -6.828 -0.409 1.00 0.27 C ATOM 887 C ALA A 360 -5.079 -6.947 0.845 1.00 0.25 C ATOM 888 O ALA A 360 -3.849 -6.999 0.780 1.00 0.31 O ATOM 889 CB ALA A 360 -5.588 -7.935 -1.396 1.00 0.31 C ATOM 0 H ALA A 360 -4.775 -5.334 -1.295 1.00 0.25 H new ATOM 0 HA ALA A 360 -6.974 -6.933 -0.126 1.00 0.27 H new ATOM 0 HB1 ALA A 360 -5.735 -8.904 -0.920 1.00 0.31 H new ATOM 0 HB2 ALA A 360 -6.238 -7.857 -2.267 1.00 0.31 H new ATOM 0 HB3 ALA A 360 -4.549 -7.838 -1.709 1.00 0.31 H new ATOM 895 N ALA A 361 -5.747 -6.977 1.987 1.00 0.26 N ATOM 896 CA ALA A 361 -5.067 -7.056 3.266 1.00 0.27 C ATOM 897 C ALA A 361 -4.871 -8.503 3.689 1.00 0.25 C ATOM 898 O ALA A 361 -5.834 -9.222 3.952 1.00 0.38 O ATOM 899 CB ALA A 361 -5.852 -6.296 4.324 1.00 0.35 C ATOM 0 H ALA A 361 -6.764 -6.948 2.052 1.00 0.26 H new ATOM 0 HA ALA A 361 -4.083 -6.599 3.160 1.00 0.27 H new ATOM 0 HB1 ALA A 361 -5.332 -6.362 5.280 1.00 0.35 H new ATOM 0 HB2 ALA A 361 -5.940 -5.250 4.030 1.00 0.35 H new ATOM 0 HB3 ALA A 361 -6.847 -6.731 4.421 1.00 0.35 H new ATOM 905 N SER A 362 -3.624 -8.935 3.724 1.00 0.32 N ATOM 906 CA SER A 362 -3.293 -10.268 4.189 1.00 0.40 C ATOM 907 C SER A 362 -2.150 -10.186 5.194 1.00 0.42 C ATOM 908 O SER A 362 -1.277 -9.328 5.073 1.00 0.44 O ATOM 909 CB SER A 362 -2.909 -11.157 3.006 1.00 0.47 C ATOM 910 OG SER A 362 -3.910 -11.126 2.003 1.00 1.00 O ATOM 0 H SER A 362 -2.820 -8.378 3.434 1.00 0.32 H new ATOM 0 HA SER A 362 -4.162 -10.708 4.678 1.00 0.40 H new ATOM 0 HB2 SER A 362 -1.960 -10.823 2.588 1.00 0.47 H new ATOM 0 HB3 SER A 362 -2.763 -12.182 3.348 1.00 0.47 H new ATOM 0 HG SER A 362 -3.642 -11.701 1.256 1.00 1.00 H new ATOM 916 N PRO A 363 -2.137 -11.075 6.198 1.00 0.46 N ATOM 917 CA PRO A 363 -1.129 -11.051 7.268 1.00 0.48 C ATOM 918 C PRO A 363 0.239 -11.560 6.816 1.00 0.45 C ATOM 919 O PRO A 363 1.147 -11.731 7.629 1.00 0.66 O ATOM 920 CB PRO A 363 -1.721 -11.987 8.321 1.00 0.58 C ATOM 921 CG PRO A 363 -2.549 -12.949 7.542 1.00 0.60 C ATOM 922 CD PRO A 363 -3.110 -12.170 6.383 1.00 0.53 C ATOM 0 HA PRO A 363 -0.942 -10.037 7.621 1.00 0.48 H new ATOM 0 HB2 PRO A 363 -0.939 -12.499 8.881 1.00 0.58 H new ATOM 0 HB3 PRO A 363 -2.325 -11.439 9.045 1.00 0.58 H new ATOM 0 HG2 PRO A 363 -1.947 -13.788 7.193 1.00 0.60 H new ATOM 0 HG3 PRO A 363 -3.348 -13.363 8.157 1.00 0.60 H new ATOM 0 HD2 PRO A 363 -3.194 -12.787 5.488 1.00 0.53 H new ATOM 0 HD3 PRO A 363 -4.107 -11.788 6.602 1.00 0.53 H new ATOM 930 N LYS A 364 0.384 -11.809 5.522 1.00 0.44 N ATOM 931 CA LYS A 364 1.643 -12.303 4.984 1.00 0.44 C ATOM 932 C LYS A 364 2.093 -11.462 3.790 1.00 0.37 C ATOM 933 O LYS A 364 3.260 -11.494 3.394 1.00 0.40 O ATOM 934 CB LYS A 364 1.499 -13.772 4.586 1.00 0.56 C ATOM 935 CG LYS A 364 2.813 -14.444 4.228 1.00 0.72 C ATOM 936 CD LYS A 364 2.644 -15.948 4.108 1.00 0.98 C ATOM 937 CE LYS A 364 3.962 -16.634 3.792 1.00 1.26 C ATOM 938 NZ LYS A 364 3.854 -18.109 3.923 1.00 2.08 N ATOM 0 H LYS A 364 -0.352 -11.678 4.828 1.00 0.44 H new ATOM 0 HA LYS A 364 2.407 -12.221 5.757 1.00 0.44 H new ATOM 0 HB2 LYS A 364 1.035 -14.317 5.408 1.00 0.56 H new ATOM 0 HB3 LYS A 364 0.822 -13.843 3.735 1.00 0.56 H new ATOM 0 HG2 LYS A 364 3.186 -14.041 3.287 1.00 0.72 H new ATOM 0 HG3 LYS A 364 3.559 -14.219 4.990 1.00 0.72 H new ATOM 0 HD2 LYS A 364 2.240 -16.345 5.039 1.00 0.98 H new ATOM 0 HD3 LYS A 364 1.919 -16.172 3.325 1.00 0.98 H new ATOM 0 HE2 LYS A 364 4.272 -16.380 2.778 1.00 1.26 H new ATOM 0 HE3 LYS A 364 4.736 -16.264 4.464 1.00 1.26 H new ATOM 0 HZ1 LYS A 364 4.771 -18.545 3.700 1.00 2.08 H new ATOM 0 HZ2 LYS A 364 3.582 -18.352 4.897 1.00 2.08 H new ATOM 0 HZ3 LYS A 364 3.132 -18.464 3.264 1.00 2.08 H new ATOM 952 N SER A 365 1.167 -10.698 3.230 1.00 0.35 N ATOM 953 CA SER A 365 1.467 -9.846 2.096 1.00 0.34 C ATOM 954 C SER A 365 0.336 -8.848 1.884 1.00 0.32 C ATOM 955 O SER A 365 -0.835 -9.181 2.053 1.00 0.52 O ATOM 956 CB SER A 365 1.679 -10.683 0.826 1.00 0.40 C ATOM 957 OG SER A 365 2.209 -9.892 -0.227 1.00 1.32 O ATOM 0 H SER A 365 0.198 -10.653 3.546 1.00 0.35 H new ATOM 0 HA SER A 365 2.389 -9.303 2.305 1.00 0.34 H new ATOM 0 HB2 SER A 365 2.357 -11.509 1.041 1.00 0.40 H new ATOM 0 HB3 SER A 365 0.731 -11.121 0.514 1.00 0.40 H new ATOM 0 HG SER A 365 2.579 -9.062 0.141 1.00 1.32 H new ATOM 963 N PHE A 366 0.694 -7.625 1.542 1.00 0.19 N ATOM 964 CA PHE A 366 -0.289 -6.600 1.251 1.00 0.16 C ATOM 965 C PHE A 366 -0.292 -6.318 -0.246 1.00 0.16 C ATOM 966 O PHE A 366 0.749 -6.009 -0.825 1.00 0.28 O ATOM 967 CB PHE A 366 0.024 -5.328 2.042 1.00 0.19 C ATOM 968 CG PHE A 366 -1.005 -4.247 1.888 1.00 0.20 C ATOM 969 CD1 PHE A 366 -2.282 -4.411 2.397 1.00 0.23 C ATOM 970 CD2 PHE A 366 -0.691 -3.064 1.242 1.00 0.25 C ATOM 971 CE1 PHE A 366 -3.228 -3.416 2.263 1.00 0.28 C ATOM 972 CE2 PHE A 366 -1.633 -2.066 1.105 1.00 0.29 C ATOM 973 CZ PHE A 366 -2.903 -2.242 1.616 1.00 0.30 C ATOM 0 H PHE A 366 1.663 -7.317 1.459 1.00 0.19 H new ATOM 0 HA PHE A 366 -1.278 -6.947 1.549 1.00 0.16 H new ATOM 0 HB2 PHE A 366 0.115 -5.582 3.098 1.00 0.19 H new ATOM 0 HB3 PHE A 366 0.992 -4.942 1.723 1.00 0.19 H new ATOM 0 HD1 PHE A 366 -2.541 -5.328 2.905 1.00 0.23 H new ATOM 0 HD2 PHE A 366 0.302 -2.921 0.841 1.00 0.25 H new ATOM 0 HE1 PHE A 366 -4.221 -3.556 2.664 1.00 0.28 H new ATOM 0 HE2 PHE A 366 -1.377 -1.147 0.598 1.00 0.29 H new ATOM 0 HZ PHE A 366 -3.642 -1.461 1.509 1.00 0.30 H new ATOM 983 N THR A 367 -1.454 -6.454 -0.865 1.00 0.17 N ATOM 984 CA THR A 367 -1.579 -6.272 -2.302 1.00 0.19 C ATOM 985 C THR A 367 -2.357 -4.997 -2.627 1.00 0.19 C ATOM 986 O THR A 367 -3.467 -4.800 -2.149 1.00 0.27 O ATOM 987 CB THR A 367 -2.288 -7.481 -2.947 1.00 0.26 C ATOM 988 OG1 THR A 367 -1.645 -8.701 -2.545 1.00 0.34 O ATOM 989 CG2 THR A 367 -2.280 -7.375 -4.466 1.00 0.32 C ATOM 0 H THR A 367 -2.327 -6.691 -0.393 1.00 0.17 H new ATOM 0 HA THR A 367 -0.572 -6.187 -2.710 1.00 0.19 H new ATOM 0 HB THR A 367 -3.324 -7.485 -2.607 1.00 0.26 H new ATOM 0 HG1 THR A 367 -0.680 -8.627 -2.696 1.00 0.34 H new ATOM 0 HG21 THR A 367 -2.786 -8.240 -4.894 1.00 0.32 H new ATOM 0 HG22 THR A 367 -2.797 -6.465 -4.770 1.00 0.32 H new ATOM 0 HG23 THR A 367 -1.251 -7.344 -4.823 1.00 0.32 H new ATOM 997 N LEU A 368 -1.755 -4.129 -3.423 1.00 0.20 N ATOM 998 CA LEU A 368 -2.413 -2.910 -3.874 1.00 0.22 C ATOM 999 C LEU A 368 -2.747 -2.987 -5.357 1.00 0.23 C ATOM 1000 O LEU A 368 -1.986 -3.551 -6.143 1.00 0.33 O ATOM 1001 CB LEU A 368 -1.520 -1.695 -3.610 1.00 0.24 C ATOM 1002 CG LEU A 368 -1.506 -1.193 -2.168 1.00 0.25 C ATOM 1003 CD1 LEU A 368 -0.400 -0.169 -1.971 1.00 0.29 C ATOM 1004 CD2 LEU A 368 -2.854 -0.585 -1.812 1.00 0.25 C ATOM 0 H LEU A 368 -0.804 -4.246 -3.773 1.00 0.20 H new ATOM 0 HA LEU A 368 -3.342 -2.803 -3.313 1.00 0.22 H new ATOM 0 HB2 LEU A 368 -0.499 -1.946 -3.899 1.00 0.24 H new ATOM 0 HB3 LEU A 368 -1.844 -0.880 -4.257 1.00 0.24 H new ATOM 0 HG LEU A 368 -1.315 -2.039 -1.508 1.00 0.25 H new ATOM 0 HD11 LEU A 368 -0.405 0.178 -0.938 1.00 0.29 H new ATOM 0 HD12 LEU A 368 0.564 -0.626 -2.196 1.00 0.29 H new ATOM 0 HD13 LEU A 368 -0.564 0.677 -2.638 1.00 0.29 H new ATOM 0 HD21 LEU A 368 -2.832 -0.230 -0.782 1.00 0.25 H new ATOM 0 HD22 LEU A 368 -3.064 0.251 -2.479 1.00 0.25 H new ATOM 0 HD23 LEU A 368 -3.633 -1.339 -1.920 1.00 0.25 H new ATOM 1016 N ASP A 369 -3.898 -2.441 -5.721 1.00 0.21 N ATOM 1017 CA ASP A 369 -4.294 -2.317 -7.118 1.00 0.24 C ATOM 1018 C ASP A 369 -4.672 -0.876 -7.417 1.00 0.21 C ATOM 1019 O ASP A 369 -5.478 -0.274 -6.700 1.00 0.22 O ATOM 1020 CB ASP A 369 -5.471 -3.241 -7.440 1.00 0.31 C ATOM 1021 CG ASP A 369 -5.985 -3.061 -8.858 1.00 0.99 C ATOM 1022 OD1 ASP A 369 -5.176 -2.737 -9.753 1.00 1.52 O ATOM 1023 OD2 ASP A 369 -7.197 -3.242 -9.091 1.00 1.47 O ATOM 0 H ASP A 369 -4.582 -2.073 -5.060 1.00 0.21 H new ATOM 0 HA ASP A 369 -3.450 -2.611 -7.742 1.00 0.24 H new ATOM 0 HB2 ASP A 369 -5.164 -4.277 -7.298 1.00 0.31 H new ATOM 0 HB3 ASP A 369 -6.281 -3.049 -6.737 1.00 0.31 H new ATOM 1028 N PHE A 370 -4.084 -0.320 -8.464 1.00 0.25 N ATOM 1029 CA PHE A 370 -4.304 1.076 -8.804 1.00 0.26 C ATOM 1030 C PHE A 370 -5.008 1.204 -10.146 1.00 0.31 C ATOM 1031 O PHE A 370 -5.223 2.310 -10.639 1.00 0.35 O ATOM 1032 CB PHE A 370 -2.973 1.827 -8.817 1.00 0.31 C ATOM 1033 CG PHE A 370 -2.229 1.715 -7.519 1.00 0.32 C ATOM 1034 CD1 PHE A 370 -2.584 2.498 -6.433 1.00 0.35 C ATOM 1035 CD2 PHE A 370 -1.186 0.815 -7.379 1.00 0.37 C ATOM 1036 CE1 PHE A 370 -1.913 2.387 -5.233 1.00 0.41 C ATOM 1037 CE2 PHE A 370 -0.509 0.701 -6.181 1.00 0.42 C ATOM 1038 CZ PHE A 370 -0.874 1.486 -5.107 1.00 0.44 C ATOM 0 H PHE A 370 -3.451 -0.814 -9.093 1.00 0.25 H new ATOM 0 HA PHE A 370 -4.949 1.520 -8.046 1.00 0.26 H new ATOM 0 HB2 PHE A 370 -2.350 1.438 -9.622 1.00 0.31 H new ATOM 0 HB3 PHE A 370 -3.157 2.879 -9.035 1.00 0.31 H new ATOM 0 HD1 PHE A 370 -3.396 3.204 -6.527 1.00 0.35 H new ATOM 0 HD2 PHE A 370 -0.899 0.196 -8.216 1.00 0.37 H new ATOM 0 HE1 PHE A 370 -2.200 3.003 -4.394 1.00 0.41 H new ATOM 0 HE2 PHE A 370 0.305 -0.002 -6.085 1.00 0.42 H new ATOM 0 HZ PHE A 370 -0.348 1.396 -4.168 1.00 0.44 H new ATOM 1048 N GLY A 371 -5.357 0.062 -10.731 1.00 0.40 N ATOM 1049 CA GLY A 371 -6.130 0.045 -11.962 1.00 0.50 C ATOM 1050 C GLY A 371 -5.466 0.774 -13.116 1.00 0.49 C ATOM 1051 O GLY A 371 -4.567 0.240 -13.769 1.00 0.58 O ATOM 0 H GLY A 371 -5.116 -0.861 -10.371 1.00 0.40 H new ATOM 0 HA2 GLY A 371 -6.308 -0.990 -12.253 1.00 0.50 H new ATOM 0 HA3 GLY A 371 -7.105 0.495 -11.774 1.00 0.50 H new ATOM 1055 N ASP A 372 -5.906 2.004 -13.358 1.00 0.49 N ATOM 1056 CA ASP A 372 -5.460 2.778 -14.513 1.00 0.56 C ATOM 1057 C ASP A 372 -4.253 3.649 -14.161 1.00 0.55 C ATOM 1058 O ASP A 372 -3.773 4.436 -14.976 1.00 0.72 O ATOM 1059 CB ASP A 372 -6.617 3.647 -15.030 1.00 0.71 C ATOM 1060 CG ASP A 372 -6.295 4.357 -16.333 1.00 1.57 C ATOM 1061 OD1 ASP A 372 -6.156 3.675 -17.372 1.00 1.89 O ATOM 1062 OD2 ASP A 372 -6.169 5.601 -16.322 1.00 2.38 O ATOM 0 H ASP A 372 -6.577 2.491 -12.764 1.00 0.49 H new ATOM 0 HA ASP A 372 -5.152 2.086 -15.297 1.00 0.56 H new ATOM 0 HB2 ASP A 372 -7.498 3.021 -15.173 1.00 0.71 H new ATOM 0 HB3 ASP A 372 -6.872 4.389 -14.273 1.00 0.71 H new ATOM 1067 N TYR A 373 -3.740 3.492 -12.951 1.00 0.52 N ATOM 1068 CA TYR A 373 -2.602 4.286 -12.515 1.00 0.51 C ATOM 1069 C TYR A 373 -1.294 3.633 -12.954 1.00 0.52 C ATOM 1070 O TYR A 373 -0.363 4.317 -13.379 1.00 0.60 O ATOM 1071 CB TYR A 373 -2.626 4.469 -10.997 1.00 0.50 C ATOM 1072 CG TYR A 373 -1.531 5.369 -10.472 1.00 0.51 C ATOM 1073 CD1 TYR A 373 -1.661 6.751 -10.517 1.00 0.56 C ATOM 1074 CD2 TYR A 373 -0.369 4.837 -9.927 1.00 0.56 C ATOM 1075 CE1 TYR A 373 -0.665 7.576 -10.032 1.00 0.64 C ATOM 1076 CE2 TYR A 373 0.630 5.656 -9.443 1.00 0.64 C ATOM 1077 CZ TYR A 373 0.478 7.023 -9.498 1.00 0.67 C ATOM 1078 OH TYR A 373 1.470 7.841 -9.005 1.00 0.79 O ATOM 0 H TYR A 373 -4.089 2.829 -12.259 1.00 0.52 H new ATOM 0 HA TYR A 373 -2.670 5.269 -12.981 1.00 0.51 H new ATOM 0 HB2 TYR A 373 -3.592 4.881 -10.706 1.00 0.50 H new ATOM 0 HB3 TYR A 373 -2.539 3.492 -10.522 1.00 0.50 H new ATOM 0 HD1 TYR A 373 -2.555 7.187 -10.938 1.00 0.56 H new ATOM 0 HD2 TYR A 373 -0.246 3.765 -9.882 1.00 0.56 H new ATOM 0 HE1 TYR A 373 -0.782 8.649 -10.071 1.00 0.64 H new ATOM 0 HE2 TYR A 373 1.527 5.227 -9.023 1.00 0.64 H new ATOM 0 HH TYR A 373 2.207 7.292 -8.664 1.00 0.79 H new ATOM 1088 N GLN A 374 -1.233 2.312 -12.861 1.00 0.53 N ATOM 1089 CA GLN A 374 -0.066 1.567 -13.316 1.00 0.59 C ATOM 1090 C GLN A 374 -0.435 0.110 -13.558 1.00 0.60 C ATOM 1091 O GLN A 374 -1.401 -0.397 -12.981 1.00 0.59 O ATOM 1092 CB GLN A 374 1.089 1.668 -12.310 1.00 0.63 C ATOM 1093 CG GLN A 374 0.775 1.102 -10.934 1.00 0.59 C ATOM 1094 CD GLN A 374 1.966 1.155 -9.993 1.00 0.69 C ATOM 1095 OE1 GLN A 374 1.807 1.285 -8.784 1.00 1.09 O ATOM 1096 NE2 GLN A 374 3.170 1.047 -10.537 1.00 0.85 N ATOM 0 H GLN A 374 -1.978 1.733 -12.474 1.00 0.53 H new ATOM 0 HA GLN A 374 0.271 2.008 -14.254 1.00 0.59 H new ATOM 0 HB2 GLN A 374 1.955 1.145 -12.716 1.00 0.63 H new ATOM 0 HB3 GLN A 374 1.371 2.715 -12.203 1.00 0.63 H new ATOM 0 HG2 GLN A 374 -0.053 1.659 -10.497 1.00 0.59 H new ATOM 0 HG3 GLN A 374 0.445 0.068 -11.037 1.00 0.59 H new ATOM 0 HE21 GLN A 374 3.266 0.940 -11.547 1.00 0.85 H new ATOM 0 HE22 GLN A 374 4.001 1.071 -9.946 1.00 0.85 H new ATOM 1105 N ASP A 375 0.331 -0.553 -14.408 1.00 0.74 N ATOM 1106 CA ASP A 375 0.058 -1.940 -14.765 1.00 0.78 C ATOM 1107 C ASP A 375 0.623 -2.896 -13.724 1.00 0.64 C ATOM 1108 O ASP A 375 1.756 -2.735 -13.264 1.00 0.73 O ATOM 1109 CB ASP A 375 0.638 -2.267 -16.144 1.00 1.06 C ATOM 1110 CG ASP A 375 0.541 -3.744 -16.478 1.00 1.71 C ATOM 1111 OD1 ASP A 375 -0.571 -4.222 -16.788 1.00 2.21 O ATOM 1112 OD2 ASP A 375 1.581 -4.438 -16.433 1.00 2.30 O ATOM 0 H ASP A 375 1.150 -0.154 -14.866 1.00 0.74 H new ATOM 0 HA ASP A 375 -1.024 -2.067 -14.798 1.00 0.78 H new ATOM 0 HB2 ASP A 375 0.110 -1.690 -16.903 1.00 1.06 H new ATOM 0 HB3 ASP A 375 1.683 -1.958 -16.178 1.00 1.06 H new ATOM 1117 N GLY A 376 -0.179 -3.886 -13.357 1.00 0.57 N ATOM 1118 CA GLY A 376 0.248 -4.881 -12.399 1.00 0.53 C ATOM 1119 C GLY A 376 -0.126 -4.502 -10.984 1.00 0.52 C ATOM 1120 O GLY A 376 -0.299 -3.320 -10.677 1.00 0.70 O ATOM 0 H GLY A 376 -1.127 -4.016 -13.711 1.00 0.57 H new ATOM 0 HA2 GLY A 376 -0.203 -5.841 -12.648 1.00 0.53 H new ATOM 0 HA3 GLY A 376 1.328 -5.009 -12.467 1.00 0.53 H new ATOM 1124 N TYR A 377 -0.260 -5.495 -10.118 1.00 0.46 N ATOM 1125 CA TYR A 377 -0.587 -5.235 -8.727 1.00 0.46 C ATOM 1126 C TYR A 377 0.683 -4.942 -7.944 1.00 0.37 C ATOM 1127 O TYR A 377 1.787 -5.021 -8.481 1.00 0.38 O ATOM 1128 CB TYR A 377 -1.311 -6.432 -8.101 1.00 0.53 C ATOM 1129 CG TYR A 377 -2.587 -6.828 -8.809 1.00 0.63 C ATOM 1130 CD1 TYR A 377 -3.698 -5.997 -8.796 1.00 0.83 C ATOM 1131 CD2 TYR A 377 -2.683 -8.042 -9.477 1.00 0.64 C ATOM 1132 CE1 TYR A 377 -4.868 -6.364 -9.432 1.00 0.97 C ATOM 1133 CE2 TYR A 377 -3.848 -8.414 -10.118 1.00 0.76 C ATOM 1134 CZ TYR A 377 -4.939 -7.572 -10.091 1.00 0.91 C ATOM 1135 OH TYR A 377 -6.105 -7.940 -10.725 1.00 1.06 O ATOM 0 H TYR A 377 -0.148 -6.481 -10.353 1.00 0.46 H new ATOM 0 HA TYR A 377 -1.250 -4.370 -8.688 1.00 0.46 H new ATOM 0 HB2 TYR A 377 -0.634 -7.287 -8.092 1.00 0.53 H new ATOM 0 HB3 TYR A 377 -1.543 -6.198 -7.062 1.00 0.53 H new ATOM 0 HD1 TYR A 377 -3.647 -5.049 -8.281 1.00 0.83 H new ATOM 0 HD2 TYR A 377 -1.832 -8.706 -9.495 1.00 0.64 H new ATOM 0 HE1 TYR A 377 -5.724 -5.706 -9.413 1.00 0.97 H new ATOM 0 HE2 TYR A 377 -3.904 -9.359 -10.638 1.00 0.76 H new ATOM 0 HH TYR A 377 -5.987 -8.819 -11.142 1.00 1.06 H new ATOM 1145 N TYR A 378 0.527 -4.618 -6.679 1.00 0.32 N ATOM 1146 CA TYR A 378 1.663 -4.359 -5.815 1.00 0.29 C ATOM 1147 C TYR A 378 1.540 -5.182 -4.541 1.00 0.24 C ATOM 1148 O TYR A 378 0.832 -4.798 -3.615 1.00 0.26 O ATOM 1149 CB TYR A 378 1.746 -2.860 -5.496 1.00 0.31 C ATOM 1150 CG TYR A 378 2.842 -2.493 -4.521 1.00 0.32 C ATOM 1151 CD1 TYR A 378 4.180 -2.655 -4.852 1.00 0.36 C ATOM 1152 CD2 TYR A 378 2.534 -1.977 -3.268 1.00 0.37 C ATOM 1153 CE1 TYR A 378 5.180 -2.317 -3.962 1.00 0.41 C ATOM 1154 CE2 TYR A 378 3.528 -1.636 -2.372 1.00 0.40 C ATOM 1155 CZ TYR A 378 4.849 -1.809 -2.723 1.00 0.41 C ATOM 1156 OH TYR A 378 5.843 -1.473 -1.832 1.00 0.47 O ATOM 0 H TYR A 378 -0.380 -4.527 -6.222 1.00 0.32 H new ATOM 0 HA TYR A 378 2.581 -4.651 -6.325 1.00 0.29 H new ATOM 0 HB2 TYR A 378 1.902 -2.311 -6.424 1.00 0.31 H new ATOM 0 HB3 TYR A 378 0.789 -2.533 -5.089 1.00 0.31 H new ATOM 0 HD1 TYR A 378 4.443 -3.052 -5.821 1.00 0.36 H new ATOM 0 HD2 TYR A 378 1.499 -1.840 -2.990 1.00 0.37 H new ATOM 0 HE1 TYR A 378 6.217 -2.450 -4.235 1.00 0.41 H new ATOM 0 HE2 TYR A 378 3.271 -1.236 -1.402 1.00 0.40 H new ATOM 0 HH TYR A 378 6.711 -1.759 -2.187 1.00 0.47 H new ATOM 1166 N SER A 379 2.195 -6.330 -4.515 1.00 0.26 N ATOM 1167 CA SER A 379 2.132 -7.207 -3.360 1.00 0.27 C ATOM 1168 C SER A 379 3.494 -7.286 -2.683 1.00 0.24 C ATOM 1169 O SER A 379 4.478 -7.716 -3.286 1.00 0.29 O ATOM 1170 CB SER A 379 1.669 -8.607 -3.780 1.00 0.36 C ATOM 1171 OG SER A 379 1.099 -9.316 -2.687 1.00 1.06 O ATOM 0 H SER A 379 2.775 -6.676 -5.279 1.00 0.26 H new ATOM 0 HA SER A 379 1.412 -6.798 -2.652 1.00 0.27 H new ATOM 0 HB2 SER A 379 0.937 -8.524 -4.583 1.00 0.36 H new ATOM 0 HB3 SER A 379 2.515 -9.168 -4.177 1.00 0.36 H new ATOM 0 HG SER A 379 1.750 -9.370 -1.957 1.00 1.06 H new ATOM 1177 N VAL A 380 3.546 -6.860 -1.434 1.00 0.22 N ATOM 1178 CA VAL A 380 4.777 -6.908 -0.660 1.00 0.24 C ATOM 1179 C VAL A 380 4.609 -7.790 0.561 1.00 0.23 C ATOM 1180 O VAL A 380 3.509 -7.907 1.101 1.00 0.30 O ATOM 1181 CB VAL A 380 5.223 -5.505 -0.207 1.00 0.27 C ATOM 1182 CG1 VAL A 380 5.691 -4.695 -1.396 1.00 0.33 C ATOM 1183 CG2 VAL A 380 4.094 -4.786 0.520 1.00 0.29 C ATOM 0 H VAL A 380 2.747 -6.475 -0.930 1.00 0.22 H new ATOM 0 HA VAL A 380 5.544 -7.324 -1.313 1.00 0.24 H new ATOM 0 HB VAL A 380 6.055 -5.616 0.488 1.00 0.27 H new ATOM 0 HG11 VAL A 380 6.003 -3.706 -1.062 1.00 0.33 H new ATOM 0 HG12 VAL A 380 6.532 -5.200 -1.872 1.00 0.33 H new ATOM 0 HG13 VAL A 380 4.875 -4.595 -2.112 1.00 0.33 H new ATOM 0 HG21 VAL A 380 4.433 -3.797 0.830 1.00 0.29 H new ATOM 0 HG22 VAL A 380 3.238 -4.684 -0.148 1.00 0.29 H new ATOM 0 HG23 VAL A 380 3.802 -5.362 1.398 1.00 0.29 H new ATOM 1193 N GLN A 381 5.691 -8.419 0.985 1.00 0.22 N ATOM 1194 CA GLN A 381 5.660 -9.258 2.171 1.00 0.24 C ATOM 1195 C GLN A 381 5.601 -8.386 3.416 1.00 0.24 C ATOM 1196 O GLN A 381 6.450 -7.517 3.618 1.00 0.32 O ATOM 1197 CB GLN A 381 6.885 -10.171 2.224 1.00 0.34 C ATOM 1198 CG GLN A 381 6.944 -11.039 3.471 1.00 0.43 C ATOM 1199 CD GLN A 381 8.164 -11.936 3.497 1.00 0.72 C ATOM 1200 OE1 GLN A 381 9.206 -11.605 2.933 1.00 1.47 O ATOM 1201 NE2 GLN A 381 8.048 -13.073 4.160 1.00 0.94 N ATOM 0 H GLN A 381 6.601 -8.365 0.527 1.00 0.22 H new ATOM 0 HA GLN A 381 4.770 -9.886 2.129 1.00 0.24 H new ATOM 0 HB2 GLN A 381 6.887 -10.814 1.344 1.00 0.34 H new ATOM 0 HB3 GLN A 381 7.786 -9.559 2.174 1.00 0.34 H new ATOM 0 HG2 GLN A 381 6.948 -10.400 4.354 1.00 0.43 H new ATOM 0 HG3 GLN A 381 6.045 -11.653 3.525 1.00 0.43 H new ATOM 0 HE21 GLN A 381 7.166 -13.311 4.614 1.00 0.94 H new ATOM 0 HE22 GLN A 381 8.840 -13.713 4.218 1.00 0.94 H new ATOM 1210 N THR A 382 4.585 -8.609 4.229 1.00 0.21 N ATOM 1211 CA THR A 382 4.404 -7.848 5.448 1.00 0.26 C ATOM 1212 C THR A 382 3.435 -8.563 6.377 1.00 0.25 C ATOM 1213 O THR A 382 2.395 -9.064 5.946 1.00 0.30 O ATOM 1214 CB THR A 382 3.890 -6.415 5.162 1.00 0.30 C ATOM 1215 OG1 THR A 382 3.549 -5.756 6.388 1.00 0.42 O ATOM 1216 CG2 THR A 382 2.678 -6.433 4.244 1.00 0.28 C ATOM 0 H THR A 382 3.869 -9.316 4.064 1.00 0.21 H new ATOM 0 HA THR A 382 5.379 -7.767 5.928 1.00 0.26 H new ATOM 0 HB THR A 382 4.692 -5.871 4.664 1.00 0.30 H new ATOM 0 HG1 THR A 382 2.586 -5.578 6.407 1.00 0.42 H new ATOM 0 HG21 THR A 382 2.343 -5.412 4.064 1.00 0.28 H new ATOM 0 HG22 THR A 382 2.946 -6.899 3.296 1.00 0.28 H new ATOM 0 HG23 THR A 382 1.875 -7.001 4.713 1.00 0.28 H new ATOM 1224 N THR A 383 3.795 -8.626 7.645 1.00 0.31 N ATOM 1225 CA THR A 383 2.933 -9.206 8.654 1.00 0.37 C ATOM 1226 C THR A 383 1.998 -8.144 9.219 1.00 0.36 C ATOM 1227 O THR A 383 1.161 -8.418 10.079 1.00 0.46 O ATOM 1228 CB THR A 383 3.771 -9.828 9.783 1.00 0.50 C ATOM 1229 OG1 THR A 383 4.828 -8.929 10.154 1.00 0.55 O ATOM 1230 CG2 THR A 383 4.361 -11.160 9.347 1.00 0.55 C ATOM 0 H THR A 383 4.686 -8.279 8.001 1.00 0.31 H new ATOM 0 HA THR A 383 2.336 -9.992 8.191 1.00 0.37 H new ATOM 0 HB THR A 383 3.121 -10.002 10.640 1.00 0.50 H new ATOM 0 HG1 THR A 383 5.359 -9.328 10.875 1.00 0.55 H new ATOM 0 HG21 THR A 383 4.950 -11.581 10.162 1.00 0.55 H new ATOM 0 HG22 THR A 383 3.556 -11.847 9.088 1.00 0.55 H new ATOM 0 HG23 THR A 383 5.001 -11.007 8.478 1.00 0.55 H new ATOM 1238 N GLU A 384 2.139 -6.928 8.704 1.00 0.31 N ATOM 1239 CA GLU A 384 1.353 -5.793 9.157 1.00 0.35 C ATOM 1240 C GLU A 384 0.384 -5.351 8.064 1.00 0.28 C ATOM 1241 O GLU A 384 -0.133 -4.235 8.092 1.00 0.27 O ATOM 1242 CB GLU A 384 2.286 -4.638 9.535 1.00 0.46 C ATOM 1243 CG GLU A 384 3.300 -5.004 10.607 1.00 0.57 C ATOM 1244 CD GLU A 384 4.311 -3.906 10.867 1.00 0.90 C ATOM 1245 OE1 GLU A 384 4.025 -3.017 11.701 1.00 1.39 O ATOM 1246 OE2 GLU A 384 5.383 -3.912 10.228 1.00 0.95 O ATOM 0 H GLU A 384 2.802 -6.704 7.961 1.00 0.31 H new ATOM 0 HA GLU A 384 0.775 -6.087 10.033 1.00 0.35 H new ATOM 0 HB2 GLU A 384 2.816 -4.303 8.644 1.00 0.46 H new ATOM 0 HB3 GLU A 384 1.687 -3.797 9.884 1.00 0.46 H new ATOM 0 HG2 GLU A 384 2.774 -5.232 11.534 1.00 0.57 H new ATOM 0 HG3 GLU A 384 3.826 -5.911 10.307 1.00 0.57 H new ATOM 1253 N GLY A 385 0.130 -6.252 7.112 1.00 0.27 N ATOM 1254 CA GLY A 385 -0.735 -5.946 5.981 1.00 0.27 C ATOM 1255 C GLY A 385 -2.112 -5.467 6.397 1.00 0.26 C ATOM 1256 O GLY A 385 -2.670 -4.552 5.786 1.00 0.27 O ATOM 0 H GLY A 385 0.513 -7.197 7.106 1.00 0.27 H new ATOM 0 HA2 GLY A 385 -0.261 -5.181 5.366 1.00 0.27 H new ATOM 0 HA3 GLY A 385 -0.839 -6.836 5.360 1.00 0.27 H new ATOM 1260 N GLU A 386 -2.657 -6.078 7.442 1.00 0.30 N ATOM 1261 CA GLU A 386 -3.962 -5.690 7.965 1.00 0.35 C ATOM 1262 C GLU A 386 -3.918 -4.256 8.483 1.00 0.31 C ATOM 1263 O GLU A 386 -4.830 -3.463 8.243 1.00 0.36 O ATOM 1264 CB GLU A 386 -4.377 -6.640 9.091 1.00 0.44 C ATOM 1265 CG GLU A 386 -5.717 -6.299 9.721 1.00 0.53 C ATOM 1266 CD GLU A 386 -6.006 -7.143 10.942 1.00 1.40 C ATOM 1267 OE1 GLU A 386 -5.576 -6.763 12.050 1.00 2.28 O ATOM 1268 OE2 GLU A 386 -6.671 -8.193 10.799 1.00 1.77 O ATOM 0 H GLU A 386 -2.214 -6.847 7.946 1.00 0.30 H new ATOM 0 HA GLU A 386 -4.695 -5.750 7.160 1.00 0.35 H new ATOM 0 HB2 GLU A 386 -4.419 -7.656 8.699 1.00 0.44 H new ATOM 0 HB3 GLU A 386 -3.609 -6.628 9.865 1.00 0.44 H new ATOM 0 HG2 GLU A 386 -5.728 -5.245 9.999 1.00 0.53 H new ATOM 0 HG3 GLU A 386 -6.509 -6.443 8.986 1.00 0.53 H new ATOM 1275 N GLN A 387 -2.831 -3.931 9.173 1.00 0.29 N ATOM 1276 CA GLN A 387 -2.656 -2.612 9.764 1.00 0.30 C ATOM 1277 C GLN A 387 -2.542 -1.555 8.676 1.00 0.27 C ATOM 1278 O GLN A 387 -3.100 -0.466 8.796 1.00 0.31 O ATOM 1279 CB GLN A 387 -1.404 -2.584 10.635 1.00 0.35 C ATOM 1280 CG GLN A 387 -1.340 -3.701 11.662 1.00 0.45 C ATOM 1281 CD GLN A 387 -0.072 -3.647 12.484 1.00 1.13 C ATOM 1282 OE1 GLN A 387 0.474 -2.573 12.733 1.00 2.27 O ATOM 1283 NE2 GLN A 387 0.415 -4.802 12.907 1.00 0.83 N ATOM 0 H GLN A 387 -2.053 -4.569 9.337 1.00 0.29 H new ATOM 0 HA GLN A 387 -3.527 -2.395 10.382 1.00 0.30 H new ATOM 0 HB2 GLN A 387 -0.526 -2.645 9.992 1.00 0.35 H new ATOM 0 HB3 GLN A 387 -1.355 -1.626 11.152 1.00 0.35 H new ATOM 0 HG2 GLN A 387 -2.203 -3.634 12.324 1.00 0.45 H new ATOM 0 HG3 GLN A 387 -1.401 -4.664 11.154 1.00 0.45 H new ATOM 0 HE21 GLN A 387 -0.066 -5.672 12.680 1.00 0.83 H new ATOM 0 HE22 GLN A 387 1.272 -4.822 13.460 1.00 0.83 H new ATOM 1292 N ILE A 388 -1.814 -1.891 7.614 1.00 0.24 N ATOM 1293 CA ILE A 388 -1.630 -0.989 6.485 1.00 0.23 C ATOM 1294 C ILE A 388 -2.974 -0.637 5.857 1.00 0.22 C ATOM 1295 O ILE A 388 -3.313 0.537 5.708 1.00 0.22 O ATOM 1296 CB ILE A 388 -0.719 -1.612 5.404 1.00 0.23 C ATOM 1297 CG1 ILE A 388 0.623 -2.027 6.011 1.00 0.27 C ATOM 1298 CG2 ILE A 388 -0.504 -0.628 4.261 1.00 0.24 C ATOM 1299 CD1 ILE A 388 1.532 -2.753 5.042 1.00 0.29 C ATOM 0 H ILE A 388 -1.340 -2.788 7.514 1.00 0.24 H new ATOM 0 HA ILE A 388 -1.153 -0.087 6.869 1.00 0.23 H new ATOM 0 HB ILE A 388 -1.209 -2.502 5.008 1.00 0.23 H new ATOM 0 HG12 ILE A 388 1.135 -1.138 6.379 1.00 0.27 H new ATOM 0 HG13 ILE A 388 0.439 -2.669 6.873 1.00 0.27 H new ATOM 0 HG21 ILE A 388 0.140 -1.081 3.507 1.00 0.24 H new ATOM 0 HG22 ILE A 388 -1.465 -0.375 3.813 1.00 0.24 H new ATOM 0 HG23 ILE A 388 -0.033 0.277 4.644 1.00 0.24 H new ATOM 0 HD11 ILE A 388 2.463 -3.015 5.544 1.00 0.29 H new ATOM 0 HD12 ILE A 388 1.040 -3.661 4.692 1.00 0.29 H new ATOM 0 HD13 ILE A 388 1.748 -2.106 4.191 1.00 0.29 H new ATOM 1311 N ALA A 389 -3.740 -1.667 5.514 1.00 0.22 N ATOM 1312 CA ALA A 389 -5.049 -1.482 4.898 1.00 0.24 C ATOM 1313 C ALA A 389 -5.975 -0.682 5.804 1.00 0.22 C ATOM 1314 O ALA A 389 -6.686 0.217 5.350 1.00 0.23 O ATOM 1315 CB ALA A 389 -5.673 -2.831 4.584 1.00 0.28 C ATOM 0 H ALA A 389 -3.476 -2.642 5.653 1.00 0.22 H new ATOM 0 HA ALA A 389 -4.910 -0.923 3.972 1.00 0.24 H new ATOM 0 HB1 ALA A 389 -6.650 -2.682 4.124 1.00 0.28 H new ATOM 0 HB2 ALA A 389 -5.028 -3.379 3.897 1.00 0.28 H new ATOM 0 HB3 ALA A 389 -5.789 -3.402 5.505 1.00 0.28 H new ATOM 1321 N GLN A 390 -5.942 -1.004 7.090 1.00 0.22 N ATOM 1322 CA GLN A 390 -6.808 -0.359 8.067 1.00 0.25 C ATOM 1323 C GLN A 390 -6.386 1.094 8.283 1.00 0.21 C ATOM 1324 O GLN A 390 -7.195 1.938 8.669 1.00 0.23 O ATOM 1325 CB GLN A 390 -6.767 -1.136 9.384 1.00 0.34 C ATOM 1326 CG GLN A 390 -7.908 -0.807 10.331 1.00 0.50 C ATOM 1327 CD GLN A 390 -7.927 -1.715 11.545 1.00 1.15 C ATOM 1328 OE1 GLN A 390 -7.478 -2.861 11.486 1.00 1.99 O ATOM 1329 NE2 GLN A 390 -8.459 -1.221 12.651 1.00 1.61 N ATOM 0 H GLN A 390 -5.321 -1.712 7.482 1.00 0.22 H new ATOM 0 HA GLN A 390 -7.831 -0.359 7.690 1.00 0.25 H new ATOM 0 HB2 GLN A 390 -6.787 -2.204 9.165 1.00 0.34 H new ATOM 0 HB3 GLN A 390 -5.821 -0.931 9.886 1.00 0.34 H new ATOM 0 HG2 GLN A 390 -7.820 0.230 10.656 1.00 0.50 H new ATOM 0 HG3 GLN A 390 -8.855 -0.895 9.799 1.00 0.50 H new ATOM 0 HE21 GLN A 390 -8.820 -0.267 12.661 1.00 1.61 H new ATOM 0 HE22 GLN A 390 -8.508 -1.794 13.494 1.00 1.61 H new ATOM 1338 N LEU A 391 -5.119 1.384 8.022 1.00 0.21 N ATOM 1339 CA LEU A 391 -4.605 2.737 8.161 1.00 0.22 C ATOM 1340 C LEU A 391 -4.992 3.571 6.943 1.00 0.20 C ATOM 1341 O LEU A 391 -5.400 4.725 7.075 1.00 0.22 O ATOM 1342 CB LEU A 391 -3.084 2.718 8.342 1.00 0.26 C ATOM 1343 CG LEU A 391 -2.459 4.052 8.753 1.00 0.27 C ATOM 1344 CD1 LEU A 391 -3.055 4.542 10.063 1.00 0.60 C ATOM 1345 CD2 LEU A 391 -0.952 3.913 8.880 1.00 0.63 C ATOM 0 H LEU A 391 -4.429 0.699 7.713 1.00 0.21 H new ATOM 0 HA LEU A 391 -5.046 3.191 9.048 1.00 0.22 H new ATOM 0 HB2 LEU A 391 -2.833 1.971 9.095 1.00 0.26 H new ATOM 0 HB3 LEU A 391 -2.627 2.394 7.407 1.00 0.26 H new ATOM 0 HG LEU A 391 -2.678 4.787 7.978 1.00 0.27 H new ATOM 0 HD11 LEU A 391 -2.597 5.492 10.338 1.00 0.60 H new ATOM 0 HD12 LEU A 391 -4.130 4.678 9.945 1.00 0.60 H new ATOM 0 HD13 LEU A 391 -2.866 3.808 10.846 1.00 0.60 H new ATOM 0 HD21 LEU A 391 -0.522 4.871 9.173 1.00 0.63 H new ATOM 0 HD22 LEU A 391 -0.718 3.164 9.636 1.00 0.63 H new ATOM 0 HD23 LEU A 391 -0.533 3.605 7.922 1.00 0.63 H new ATOM 1357 N ILE A 392 -4.880 2.969 5.760 1.00 0.18 N ATOM 1358 CA ILE A 392 -5.291 3.627 4.524 1.00 0.17 C ATOM 1359 C ILE A 392 -6.777 3.968 4.583 1.00 0.17 C ATOM 1360 O ILE A 392 -7.173 5.112 4.353 1.00 0.19 O ATOM 1361 CB ILE A 392 -5.018 2.741 3.285 1.00 0.17 C ATOM 1362 CG1 ILE A 392 -3.524 2.421 3.177 1.00 0.19 C ATOM 1363 CG2 ILE A 392 -5.508 3.429 2.014 1.00 0.19 C ATOM 1364 CD1 ILE A 392 -3.182 1.491 2.034 1.00 0.21 C ATOM 0 H ILE A 392 -4.508 2.028 5.633 1.00 0.18 H new ATOM 0 HA ILE A 392 -4.703 4.539 4.427 1.00 0.17 H new ATOM 0 HB ILE A 392 -5.566 1.806 3.403 1.00 0.17 H new ATOM 0 HG12 ILE A 392 -2.970 3.352 3.054 1.00 0.19 H new ATOM 0 HG13 ILE A 392 -3.189 1.972 4.112 1.00 0.19 H new ATOM 0 HG21 ILE A 392 -5.307 2.790 1.154 1.00 0.19 H new ATOM 0 HG22 ILE A 392 -6.580 3.610 2.089 1.00 0.19 H new ATOM 0 HG23 ILE A 392 -4.987 4.379 1.890 1.00 0.19 H new ATOM 0 HD11 ILE A 392 -2.107 1.310 2.021 1.00 0.21 H new ATOM 0 HD12 ILE A 392 -3.707 0.545 2.165 1.00 0.21 H new ATOM 0 HD13 ILE A 392 -3.485 1.947 1.091 1.00 0.21 H new ATOM 1376 N ALA A 393 -7.592 2.973 4.921 1.00 0.18 N ATOM 1377 CA ALA A 393 -9.031 3.171 5.047 1.00 0.21 C ATOM 1378 C ALA A 393 -9.344 4.147 6.177 1.00 0.23 C ATOM 1379 O ALA A 393 -10.337 4.869 6.128 1.00 0.29 O ATOM 1380 CB ALA A 393 -9.736 1.840 5.275 1.00 0.24 C ATOM 0 H ALA A 393 -7.279 2.021 5.113 1.00 0.18 H new ATOM 0 HA ALA A 393 -9.401 3.599 4.115 1.00 0.21 H new ATOM 0 HB1 ALA A 393 -10.809 2.008 5.367 1.00 0.24 H new ATOM 0 HB2 ALA A 393 -9.543 1.177 4.432 1.00 0.24 H new ATOM 0 HB3 ALA A 393 -9.361 1.382 6.190 1.00 0.24 H new ATOM 1386 N GLY A 394 -8.476 4.171 7.185 1.00 0.23 N ATOM 1387 CA GLY A 394 -8.649 5.078 8.304 1.00 0.27 C ATOM 1388 C GLY A 394 -8.570 6.533 7.888 1.00 0.28 C ATOM 1389 O GLY A 394 -9.453 7.328 8.221 1.00 0.35 O ATOM 0 H GLY A 394 -7.651 3.574 7.245 1.00 0.23 H new ATOM 0 HA2 GLY A 394 -9.614 4.890 8.775 1.00 0.27 H new ATOM 0 HA3 GLY A 394 -7.884 4.876 9.054 1.00 0.27 H new ATOM 1393 N TYR A 395 -7.519 6.883 7.153 1.00 0.27 N ATOM 1394 CA TYR A 395 -7.341 8.250 6.677 1.00 0.30 C ATOM 1395 C TYR A 395 -8.370 8.590 5.609 1.00 0.30 C ATOM 1396 O TYR A 395 -8.922 9.689 5.593 1.00 0.36 O ATOM 1397 CB TYR A 395 -5.927 8.459 6.134 1.00 0.31 C ATOM 1398 CG TYR A 395 -4.867 8.450 7.210 1.00 0.37 C ATOM 1399 CD1 TYR A 395 -4.980 9.279 8.317 1.00 0.48 C ATOM 1400 CD2 TYR A 395 -3.760 7.617 7.123 1.00 0.41 C ATOM 1401 CE1 TYR A 395 -4.020 9.280 9.307 1.00 0.58 C ATOM 1402 CE2 TYR A 395 -2.794 7.611 8.111 1.00 0.51 C ATOM 1403 CZ TYR A 395 -2.930 8.446 9.201 1.00 0.58 C ATOM 1404 OH TYR A 395 -1.978 8.441 10.193 1.00 0.70 O ATOM 0 H TYR A 395 -6.778 6.239 6.874 1.00 0.27 H new ATOM 0 HA TYR A 395 -7.488 8.920 7.525 1.00 0.30 H new ATOM 0 HB2 TYR A 395 -5.705 7.677 5.408 1.00 0.31 H new ATOM 0 HB3 TYR A 395 -5.886 9.409 5.601 1.00 0.31 H new ATOM 0 HD1 TYR A 395 -5.834 9.934 8.405 1.00 0.48 H new ATOM 0 HD2 TYR A 395 -3.652 6.964 6.270 1.00 0.41 H new ATOM 0 HE1 TYR A 395 -4.123 9.932 10.162 1.00 0.58 H new ATOM 0 HE2 TYR A 395 -1.938 6.957 8.031 1.00 0.51 H new ATOM 0 HH TYR A 395 -1.275 7.797 9.968 1.00 0.70 H new ATOM 1414 N ILE A 396 -8.634 7.636 4.729 1.00 0.27 N ATOM 1415 CA ILE A 396 -9.647 7.795 3.693 1.00 0.31 C ATOM 1416 C ILE A 396 -11.010 8.111 4.308 1.00 0.37 C ATOM 1417 O ILE A 396 -11.750 8.953 3.799 1.00 0.45 O ATOM 1418 CB ILE A 396 -9.720 6.523 2.815 1.00 0.33 C ATOM 1419 CG1 ILE A 396 -8.606 6.559 1.765 1.00 0.34 C ATOM 1420 CG2 ILE A 396 -11.085 6.362 2.159 1.00 0.38 C ATOM 1421 CD1 ILE A 396 -8.363 5.228 1.093 1.00 0.42 C ATOM 0 H ILE A 396 -8.156 6.735 4.711 1.00 0.27 H new ATOM 0 HA ILE A 396 -9.364 8.636 3.060 1.00 0.31 H new ATOM 0 HB ILE A 396 -9.577 5.655 3.459 1.00 0.33 H new ATOM 0 HG12 ILE A 396 -8.858 7.299 1.005 1.00 0.34 H new ATOM 0 HG13 ILE A 396 -7.682 6.891 2.239 1.00 0.34 H new ATOM 0 HG21 ILE A 396 -11.092 5.457 1.552 1.00 0.38 H new ATOM 0 HG22 ILE A 396 -11.853 6.289 2.929 1.00 0.38 H new ATOM 0 HG23 ILE A 396 -11.288 7.225 1.525 1.00 0.38 H new ATOM 0 HD11 ILE A 396 -7.561 5.330 0.362 1.00 0.42 H new ATOM 0 HD12 ILE A 396 -8.079 4.489 1.842 1.00 0.42 H new ATOM 0 HD13 ILE A 396 -9.273 4.903 0.589 1.00 0.42 H new ATOM 1433 N ASP A 397 -11.305 7.464 5.429 1.00 0.38 N ATOM 1434 CA ASP A 397 -12.554 7.681 6.157 1.00 0.47 C ATOM 1435 C ASP A 397 -12.669 9.131 6.636 1.00 0.51 C ATOM 1436 O ASP A 397 -13.765 9.631 6.897 1.00 0.63 O ATOM 1437 CB ASP A 397 -12.618 6.722 7.351 1.00 0.52 C ATOM 1438 CG ASP A 397 -13.877 6.878 8.172 1.00 0.69 C ATOM 1439 OD1 ASP A 397 -14.950 6.433 7.714 1.00 0.73 O ATOM 1440 OD2 ASP A 397 -13.803 7.456 9.274 1.00 0.99 O ATOM 0 H ASP A 397 -10.688 6.775 5.860 1.00 0.38 H new ATOM 0 HA ASP A 397 -13.389 7.485 5.485 1.00 0.47 H new ATOM 0 HB2 ASP A 397 -12.553 5.696 6.989 1.00 0.52 H new ATOM 0 HB3 ASP A 397 -11.752 6.890 7.991 1.00 0.52 H new ATOM 1445 N ILE A 398 -11.529 9.799 6.740 1.00 0.47 N ATOM 1446 CA ILE A 398 -11.485 11.187 7.181 1.00 0.53 C ATOM 1447 C ILE A 398 -11.595 12.138 5.990 1.00 0.55 C ATOM 1448 O ILE A 398 -12.130 13.240 6.109 1.00 0.65 O ATOM 1449 CB ILE A 398 -10.174 11.490 7.945 1.00 0.54 C ATOM 1450 CG1 ILE A 398 -9.953 10.460 9.053 1.00 0.57 C ATOM 1451 CG2 ILE A 398 -10.205 12.897 8.531 1.00 0.62 C ATOM 1452 CD1 ILE A 398 -8.628 10.607 9.771 1.00 0.81 C ATOM 0 H ILE A 398 -10.616 9.399 6.523 1.00 0.47 H new ATOM 0 HA ILE A 398 -12.332 11.340 7.850 1.00 0.53 H new ATOM 0 HB ILE A 398 -9.345 11.429 7.240 1.00 0.54 H new ATOM 0 HG12 ILE A 398 -10.761 10.544 9.780 1.00 0.57 H new ATOM 0 HG13 ILE A 398 -10.014 9.460 8.624 1.00 0.57 H new ATOM 0 HG21 ILE A 398 -9.274 13.090 9.064 1.00 0.62 H new ATOM 0 HG22 ILE A 398 -10.320 13.624 7.727 1.00 0.62 H new ATOM 0 HG23 ILE A 398 -11.043 12.985 9.222 1.00 0.62 H new ATOM 0 HD11 ILE A 398 -8.545 9.841 10.542 1.00 0.81 H new ATOM 0 HD12 ILE A 398 -7.813 10.493 9.057 1.00 0.81 H new ATOM 0 HD13 ILE A 398 -8.571 11.593 10.232 1.00 0.81 H new ATOM 1464 N ILE A 399 -11.103 11.697 4.837 1.00 0.50 N ATOM 1465 CA ILE A 399 -11.030 12.559 3.666 1.00 0.52 C ATOM 1466 C ILE A 399 -12.411 12.849 3.083 1.00 0.59 C ATOM 1467 O ILE A 399 -12.813 14.009 2.988 1.00 0.72 O ATOM 1468 CB ILE A 399 -10.139 11.963 2.556 1.00 0.47 C ATOM 1469 CG1 ILE A 399 -8.745 11.638 3.099 1.00 0.47 C ATOM 1470 CG2 ILE A 399 -10.039 12.938 1.385 1.00 0.50 C ATOM 1471 CD1 ILE A 399 -7.843 10.971 2.085 1.00 0.48 C ATOM 0 H ILE A 399 -10.750 10.751 4.690 1.00 0.50 H new ATOM 0 HA ILE A 399 -10.585 13.490 4.017 1.00 0.52 H new ATOM 0 HB ILE A 399 -10.594 11.036 2.206 1.00 0.47 H new ATOM 0 HG12 ILE A 399 -8.274 12.559 3.442 1.00 0.47 H new ATOM 0 HG13 ILE A 399 -8.845 10.988 3.968 1.00 0.47 H new ATOM 0 HG21 ILE A 399 -9.408 12.508 0.607 1.00 0.50 H new ATOM 0 HG22 ILE A 399 -11.034 13.126 0.982 1.00 0.50 H new ATOM 0 HG23 ILE A 399 -9.603 13.876 1.729 1.00 0.50 H new ATOM 0 HD11 ILE A 399 -6.872 10.770 2.538 1.00 0.48 H new ATOM 0 HD12 ILE A 399 -8.293 10.033 1.759 1.00 0.48 H new ATOM 0 HD13 ILE A 399 -7.713 11.629 1.226 1.00 0.48 H new ATOM 1603 N TRP B 374 -10.291 -8.133 -0.402 1.00 1.08 N ATOM 1604 CA TRP B 374 -10.375 -6.998 -1.311 1.00 0.61 C ATOM 1605 C TRP B 374 -11.280 -5.907 -0.766 1.00 0.55 C ATOM 1606 O TRP B 374 -12.481 -6.109 -0.567 1.00 0.90 O ATOM 1607 CB TRP B 374 -10.853 -7.453 -2.689 1.00 0.88 C ATOM 1608 CG TRP B 374 -9.872 -8.353 -3.379 1.00 0.97 C ATOM 1609 CD1 TRP B 374 -9.879 -9.718 -3.395 1.00 1.38 C ATOM 1610 CD2 TRP B 374 -8.732 -7.946 -4.145 1.00 0.81 C ATOM 1611 NE1 TRP B 374 -8.814 -10.184 -4.127 1.00 1.42 N ATOM 1612 CE2 TRP B 374 -8.096 -9.116 -4.600 1.00 1.02 C ATOM 1613 CE3 TRP B 374 -8.190 -6.705 -4.494 1.00 0.85 C ATOM 1614 CZ2 TRP B 374 -6.944 -9.081 -5.385 1.00 0.98 C ATOM 1615 CZ3 TRP B 374 -7.049 -6.671 -5.272 1.00 0.97 C ATOM 1616 CH2 TRP B 374 -6.436 -7.851 -5.710 1.00 0.88 C ATOM 0 HA TRP B 374 -9.374 -6.576 -1.406 1.00 0.61 H new ATOM 0 HB2 TRP B 374 -11.805 -7.974 -2.584 1.00 0.88 H new ATOM 0 HB3 TRP B 374 -11.036 -6.577 -3.312 1.00 0.88 H new ATOM 0 HD1 TRP B 374 -10.613 -10.340 -2.905 1.00 1.38 H new ATOM 0 HE1 TRP B 374 -8.593 -11.166 -4.292 1.00 1.42 H new ATOM 0 HE3 TRP B 374 -8.655 -5.789 -4.161 1.00 0.85 H new ATOM 0 HZ2 TRP B 374 -6.470 -9.990 -5.724 1.00 0.98 H new ATOM 0 HZ3 TRP B 374 -6.622 -5.718 -5.547 1.00 0.97 H new ATOM 0 HH2 TRP B 374 -5.544 -7.790 -6.316 1.00 0.88 H new ATOM 1627 N VAL B 375 -10.682 -4.752 -0.528 1.00 0.40 N ATOM 1628 CA VAL B 375 -11.396 -3.588 -0.029 1.00 0.38 C ATOM 1629 C VAL B 375 -11.234 -2.436 -1.015 1.00 0.44 C ATOM 1630 O VAL B 375 -10.115 -1.999 -1.283 1.00 0.53 O ATOM 1631 CB VAL B 375 -10.863 -3.145 1.358 1.00 0.48 C ATOM 1632 CG1 VAL B 375 -11.716 -2.019 1.935 1.00 0.84 C ATOM 1633 CG2 VAL B 375 -10.805 -4.326 2.325 1.00 1.07 C ATOM 0 H VAL B 375 -9.685 -4.594 -0.676 1.00 0.40 H new ATOM 0 HA VAL B 375 -12.447 -3.857 0.077 1.00 0.38 H new ATOM 0 HB VAL B 375 -9.849 -2.769 1.221 1.00 0.48 H new ATOM 0 HG11 VAL B 375 -11.322 -1.726 2.908 1.00 0.84 H new ATOM 0 HG12 VAL B 375 -11.692 -1.163 1.261 1.00 0.84 H new ATOM 0 HG13 VAL B 375 -12.744 -2.363 2.049 1.00 0.84 H new ATOM 0 HG21 VAL B 375 -10.428 -3.988 3.290 1.00 1.07 H new ATOM 0 HG22 VAL B 375 -11.804 -4.742 2.452 1.00 1.07 H new ATOM 0 HG23 VAL B 375 -10.141 -5.092 1.924 1.00 1.07 H new ATOM 1643 N GLU B 376 -12.338 -1.971 -1.581 1.00 0.51 N ATOM 1644 CA GLU B 376 -12.296 -0.869 -2.521 1.00 0.63 C ATOM 1645 C GLU B 376 -12.574 0.455 -1.828 1.00 0.52 C ATOM 1646 O GLU B 376 -13.372 0.534 -0.889 1.00 0.61 O ATOM 1647 CB GLU B 376 -13.283 -1.083 -3.675 1.00 0.86 C ATOM 1648 CG GLU B 376 -14.731 -1.281 -3.253 1.00 1.43 C ATOM 1649 CD GLU B 376 -15.032 -2.701 -2.823 1.00 1.69 C ATOM 1650 OE1 GLU B 376 -14.820 -3.025 -1.637 1.00 2.06 O ATOM 1651 OE2 GLU B 376 -15.479 -3.502 -3.665 1.00 2.28 O ATOM 0 H GLU B 376 -13.272 -2.342 -1.404 1.00 0.51 H new ATOM 0 HA GLU B 376 -11.289 -0.835 -2.936 1.00 0.63 H new ATOM 0 HB2 GLU B 376 -13.229 -0.224 -4.343 1.00 0.86 H new ATOM 0 HB3 GLU B 376 -12.965 -1.954 -4.249 1.00 0.86 H new ATOM 0 HG2 GLU B 376 -14.961 -0.602 -2.432 1.00 1.43 H new ATOM 0 HG3 GLU B 376 -15.386 -1.012 -4.082 1.00 1.43 H new ATOM 1658 N ASN B 377 -11.894 1.487 -2.297 1.00 0.54 N ATOM 1659 CA ASN B 377 -12.046 2.829 -1.761 1.00 0.58 C ATOM 1660 C ASN B 377 -12.996 3.644 -2.625 1.00 0.50 C ATOM 1661 O ASN B 377 -13.153 3.378 -3.814 1.00 0.65 O ATOM 1662 CB ASN B 377 -10.686 3.520 -1.676 1.00 0.83 C ATOM 1663 CG ASN B 377 -9.908 3.426 -2.970 1.00 0.88 C ATOM 1664 OD1 ASN B 377 -9.255 2.422 -3.233 1.00 1.83 O ATOM 1665 ND2 ASN B 377 -9.954 4.474 -3.776 1.00 1.23 N ATOM 0 H ASN B 377 -11.221 1.418 -3.060 1.00 0.54 H new ATOM 0 HA ASN B 377 -12.467 2.756 -0.758 1.00 0.58 H new ATOM 0 HB2 ASN B 377 -10.830 4.569 -1.418 1.00 0.83 H new ATOM 0 HB3 ASN B 377 -10.103 3.071 -0.872 1.00 0.83 H new ATOM 0 HD21 ASN B 377 -9.434 4.466 -4.653 1.00 1.23 H new ATOM 0 HD22 ASN B 377 -10.510 5.290 -3.520 1.00 1.23 H new ATOM 1672 N GLU B 378 -13.622 4.640 -2.021 1.00 0.43 N ATOM 1673 CA GLU B 378 -14.648 5.421 -2.694 1.00 0.51 C ATOM 1674 C GLU B 378 -14.109 6.722 -3.265 1.00 0.44 C ATOM 1675 O GLU B 378 -14.868 7.603 -3.663 1.00 0.53 O ATOM 1676 CB GLU B 378 -15.790 5.693 -1.717 1.00 0.71 C ATOM 1677 CG GLU B 378 -16.580 4.453 -1.326 1.00 0.87 C ATOM 1678 CD GLU B 378 -17.662 4.754 -0.319 1.00 1.05 C ATOM 1679 OE1 GLU B 378 -18.782 5.109 -0.736 1.00 1.39 O ATOM 1680 OE2 GLU B 378 -17.398 4.641 0.891 1.00 1.88 O ATOM 0 H GLU B 378 -13.437 4.929 -1.060 1.00 0.43 H new ATOM 0 HA GLU B 378 -15.012 4.841 -3.542 1.00 0.51 H new ATOM 0 HB2 GLU B 378 -15.382 6.150 -0.816 1.00 0.71 H new ATOM 0 HB3 GLU B 378 -16.470 6.419 -2.163 1.00 0.71 H new ATOM 0 HG2 GLU B 378 -17.029 4.015 -2.218 1.00 0.87 H new ATOM 0 HG3 GLU B 378 -15.900 3.708 -0.913 1.00 0.87 H new ATOM 1687 N ILE B 379 -12.802 6.826 -3.322 1.00 0.36 N ATOM 1688 CA ILE B 379 -12.160 7.963 -3.974 1.00 0.38 C ATOM 1689 C ILE B 379 -11.206 7.510 -5.070 1.00 0.48 C ATOM 1690 O ILE B 379 -10.008 7.768 -5.012 1.00 1.17 O ATOM 1691 CB ILE B 379 -11.397 8.885 -2.994 1.00 0.38 C ATOM 1692 CG1 ILE B 379 -10.399 8.095 -2.132 1.00 0.37 C ATOM 1693 CG2 ILE B 379 -12.367 9.659 -2.103 1.00 0.43 C ATOM 1694 CD1 ILE B 379 -9.844 8.899 -0.969 1.00 0.44 C ATOM 0 H ILE B 379 -12.156 6.142 -2.928 1.00 0.36 H new ATOM 0 HA ILE B 379 -12.977 8.540 -4.407 1.00 0.38 H new ATOM 0 HB ILE B 379 -10.832 9.597 -3.596 1.00 0.38 H new ATOM 0 HG12 ILE B 379 -10.890 7.202 -1.746 1.00 0.37 H new ATOM 0 HG13 ILE B 379 -9.574 7.759 -2.760 1.00 0.37 H new ATOM 0 HG21 ILE B 379 -11.805 10.300 -1.424 1.00 0.43 H new ATOM 0 HG22 ILE B 379 -13.020 10.273 -2.723 1.00 0.43 H new ATOM 0 HG23 ILE B 379 -12.969 8.958 -1.526 1.00 0.43 H new ATOM 0 HD11 ILE B 379 -9.146 8.283 -0.401 1.00 0.44 H new ATOM 0 HD12 ILE B 379 -9.325 9.779 -1.350 1.00 0.44 H new ATOM 0 HD13 ILE B 379 -10.662 9.213 -0.320 1.00 0.44 H new ATOM 1706 N TYR B 380 -11.737 6.823 -6.061 1.00 0.45 N ATOM 1707 CA TYR B 380 -10.945 6.456 -7.220 1.00 0.42 C ATOM 1708 C TYR B 380 -11.316 7.369 -8.379 1.00 0.46 C ATOM 1709 O TYR B 380 -12.408 7.264 -8.941 1.00 0.58 O ATOM 1710 CB TYR B 380 -11.160 4.984 -7.590 1.00 0.48 C ATOM 1711 CG TYR B 380 -10.357 4.533 -8.795 1.00 0.45 C ATOM 1712 CD1 TYR B 380 -8.968 4.608 -8.802 1.00 0.49 C ATOM 1713 CD2 TYR B 380 -10.990 4.024 -9.921 1.00 0.54 C ATOM 1714 CE1 TYR B 380 -8.236 4.191 -9.898 1.00 0.51 C ATOM 1715 CE2 TYR B 380 -10.264 3.606 -11.019 1.00 0.54 C ATOM 1716 CZ TYR B 380 -8.889 3.691 -11.004 1.00 0.47 C ATOM 1717 OH TYR B 380 -8.167 3.271 -12.098 1.00 0.52 O ATOM 0 H TYR B 380 -12.707 6.509 -6.089 1.00 0.45 H new ATOM 0 HA TYR B 380 -9.887 6.578 -6.987 1.00 0.42 H new ATOM 0 HB2 TYR B 380 -10.896 4.362 -6.735 1.00 0.48 H new ATOM 0 HB3 TYR B 380 -12.219 4.820 -7.788 1.00 0.48 H new ATOM 0 HD1 TYR B 380 -8.453 4.999 -7.937 1.00 0.49 H new ATOM 0 HD2 TYR B 380 -12.068 3.954 -9.939 1.00 0.54 H new ATOM 0 HE1 TYR B 380 -7.158 4.257 -9.888 1.00 0.51 H new ATOM 0 HE2 TYR B 380 -10.773 3.214 -11.887 1.00 0.54 H new ATOM 0 HH TYR B 380 -8.780 2.946 -12.790 1.00 0.52 H new ATOM 1727 N TYR B 381 -10.421 8.286 -8.698 1.00 0.55 N ATOM 1728 CA TYR B 381 -10.663 9.283 -9.713 1.00 0.70 C ATOM 1729 C TYR B 381 -10.468 8.702 -11.108 1.00 0.79 C ATOM 1730 O TYR B 381 -11.445 8.168 -11.670 1.00 1.31 O ATOM 1731 CB TYR B 381 -9.717 10.458 -9.480 1.00 1.01 C ATOM 1732 CG TYR B 381 -10.155 11.412 -8.381 1.00 1.28 C ATOM 1733 CD1 TYR B 381 -10.740 10.930 -7.217 1.00 1.73 C ATOM 1734 CD2 TYR B 381 -9.991 12.789 -8.507 1.00 1.66 C ATOM 1735 CE1 TYR B 381 -11.146 11.788 -6.212 1.00 2.35 C ATOM 1736 CE2 TYR B 381 -10.395 13.651 -7.506 1.00 2.20 C ATOM 1737 CZ TYR B 381 -10.939 13.175 -6.374 1.00 2.50 C ATOM 1738 OH TYR B 381 -11.376 14.004 -5.363 1.00 3.20 O ATOM 1739 OXT TYR B 381 -9.345 8.788 -11.640 1.00 1.47 O ATOM 0 H TYR B 381 -9.504 8.357 -8.256 1.00 0.55 H new ATOM 0 HA TYR B 381 -11.696 9.624 -9.646 1.00 0.70 H new ATOM 0 HB2 TYR B 381 -8.729 10.069 -9.234 1.00 1.01 H new ATOM 0 HB3 TYR B 381 -9.617 11.017 -10.410 1.00 1.01 H new ATOM 0 HD1 TYR B 381 -10.880 9.866 -7.095 1.00 1.73 H new ATOM 0 HD2 TYR B 381 -9.540 13.190 -9.403 1.00 1.66 H new ATOM 0 HE1 TYR B 381 -11.614 11.404 -5.318 1.00 2.35 H new ATOM 0 HE2 TYR B 381 -10.272 14.716 -7.635 1.00 2.20 H new ATOM 0 HH TYR B 381 -11.174 14.935 -5.593 1.00 3.20 H new