USER MOD reduce.3.24.130724 H: found=0, std=0, add=729, rem=0, adj=26 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 311 SER OG : rot 35:sc= 0.152 USER MOD Set 1.2: A 395 TYR OH : rot -179:sc= 0.00351 USER MOD Set 2.1: A 364 LYS NZ :NH3+ -163:sc= 0.379 (180deg=-0.78) USER MOD Set 2.2: A 365 SER OG : rot -167:sc= 0.634 USER MOD Set 3.1: A 352 SER OG : rot 23:sc= 0.113 USER MOD Set 3.2: A 354 THR OG1 : rot 131:sc= 1.76 USER MOD Set 3.3: A 355 ASN :FLIP amide:sc= -0.6 F(o=-0.1!,f=1.7) USER MOD Set 3.4: B 381 TYR OH : rot -72:sc= 0.401 USER MOD Set 4.1: A 333 THR OG1 : rot -70:sc= 3.06 USER MOD Set 4.2: A 336 CYS SG : rot -12:sc= 1.01 USER MOD Set 4.3: A 338 MET CE :methyl 134:sc= -0.371 (180deg=-1.01) USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 LYS NZ :NH3+ 128:sc= 1.28 (180deg=0.357) USER MOD Single : A 343 LYS NZ :NH3+ -161:sc= -0.154 (180deg=-0.589) USER MOD Single : A 344 THR OG1 : rot 75:sc= 0.773 USER MOD Single : A 345 LYS NZ :NH3+ -173:sc= 0.0449 (180deg=-0.0516) USER MOD Single : A 349 GLN : amide:sc= 0.507 K(o=0.51,f=-4.2!) USER MOD Single : A 357 LYS NZ :NH3+ 165:sc= -0.0449 (180deg=-0.299) USER MOD Single : A 362 SER OG : rot 180:sc= 0 USER MOD Single : A 367 THR OG1 : rot 180:sc= 0 USER MOD Single : A 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 374 GLN :FLIP amide:sc= 0 F(o=-0.7,f=0) USER MOD Single : A 377 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 TYR OH : rot 25:sc= 1.17 USER MOD Single : A 379 SER OG : rot 180:sc= 0 USER MOD Single : A 381 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 382 THR OG1 : rot 180:sc= 0.64 USER MOD Single : A 383 THR OG1 : rot 180:sc= 0.028 USER MOD Single : A 387 GLN : amide:sc=-0.00153 X(o=-0.0015,f=0) USER MOD Single : A 390 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 377 ASN : amide:sc= -3.96! C(o=-4!,f=-11!) USER MOD Single : B 380 TYR OH : rot 42:sc= 1.6 USER MOD ----------------------------------------------------------------- ATOM 26 N SER A 311 3.512 7.374 9.665 1.00 0.71 N ATOM 27 CA SER A 311 3.381 5.927 9.719 1.00 0.41 C ATOM 28 C SER A 311 4.269 5.237 8.683 1.00 0.34 C ATOM 29 O SER A 311 4.032 5.342 7.479 1.00 0.47 O ATOM 30 CB SER A 311 1.918 5.549 9.491 1.00 0.59 C ATOM 31 OG SER A 311 1.056 6.342 10.297 1.00 1.06 O ATOM 0 HA SER A 311 3.707 5.589 10.703 1.00 0.41 H new ATOM 0 HB2 SER A 311 1.664 5.683 8.440 1.00 0.59 H new ATOM 0 HB3 SER A 311 1.771 4.494 9.723 1.00 0.59 H new ATOM 0 HG SER A 311 1.429 7.244 10.385 1.00 1.06 H new ATOM 37 N PHE A 312 5.293 4.540 9.160 1.00 0.29 N ATOM 38 CA PHE A 312 6.158 3.752 8.290 1.00 0.27 C ATOM 39 C PHE A 312 5.986 2.267 8.564 1.00 0.26 C ATOM 40 O PHE A 312 6.120 1.815 9.702 1.00 0.34 O ATOM 41 CB PHE A 312 7.628 4.133 8.477 1.00 0.31 C ATOM 42 CG PHE A 312 8.048 5.355 7.713 1.00 0.34 C ATOM 43 CD1 PHE A 312 8.017 5.361 6.329 1.00 0.33 C ATOM 44 CD2 PHE A 312 8.483 6.489 8.375 1.00 0.45 C ATOM 45 CE1 PHE A 312 8.410 6.477 5.618 1.00 0.38 C ATOM 46 CE2 PHE A 312 8.882 7.608 7.670 1.00 0.52 C ATOM 47 CZ PHE A 312 8.845 7.603 6.290 1.00 0.47 C ATOM 0 H PHE A 312 5.545 4.504 10.148 1.00 0.29 H new ATOM 0 HA PHE A 312 5.867 3.967 7.262 1.00 0.27 H new ATOM 0 HB2 PHE A 312 7.817 4.298 9.538 1.00 0.31 H new ATOM 0 HB3 PHE A 312 8.251 3.294 8.169 1.00 0.31 H new ATOM 0 HD1 PHE A 312 7.681 4.482 5.799 1.00 0.33 H new ATOM 0 HD2 PHE A 312 8.511 6.500 9.455 1.00 0.45 H new ATOM 0 HE1 PHE A 312 8.377 6.470 4.539 1.00 0.38 H new ATOM 0 HE2 PHE A 312 9.223 8.486 8.198 1.00 0.52 H new ATOM 0 HZ PHE A 312 9.155 8.477 5.737 1.00 0.47 H new ATOM 57 N PHE A 313 5.677 1.513 7.523 1.00 0.24 N ATOM 58 CA PHE A 313 5.576 0.066 7.631 1.00 0.26 C ATOM 59 C PHE A 313 6.745 -0.597 6.923 1.00 0.26 C ATOM 60 O PHE A 313 7.023 -0.304 5.760 1.00 0.26 O ATOM 61 CB PHE A 313 4.258 -0.432 7.034 1.00 0.28 C ATOM 62 CG PHE A 313 3.046 -0.044 7.830 1.00 0.30 C ATOM 63 CD1 PHE A 313 2.574 -0.871 8.835 1.00 0.34 C ATOM 64 CD2 PHE A 313 2.380 1.141 7.571 1.00 0.32 C ATOM 65 CE1 PHE A 313 1.457 -0.522 9.568 1.00 0.40 C ATOM 66 CE2 PHE A 313 1.263 1.495 8.301 1.00 0.37 C ATOM 67 CZ PHE A 313 0.801 0.663 9.301 1.00 0.41 C ATOM 0 H PHE A 313 5.491 1.880 6.590 1.00 0.24 H new ATOM 0 HA PHE A 313 5.601 -0.199 8.688 1.00 0.26 H new ATOM 0 HB2 PHE A 313 4.157 -0.039 6.022 1.00 0.28 H new ATOM 0 HB3 PHE A 313 4.295 -1.518 6.952 1.00 0.28 H new ATOM 0 HD1 PHE A 313 3.085 -1.799 9.048 1.00 0.34 H new ATOM 0 HD2 PHE A 313 2.738 1.796 6.790 1.00 0.32 H new ATOM 0 HE1 PHE A 313 1.097 -1.175 10.349 1.00 0.40 H new ATOM 0 HE2 PHE A 313 0.751 2.422 8.090 1.00 0.37 H new ATOM 0 HZ PHE A 313 -0.072 0.939 9.874 1.00 0.41 H new ATOM 77 N LEU A 314 7.441 -1.473 7.626 1.00 0.36 N ATOM 78 CA LEU A 314 8.547 -2.206 7.038 1.00 0.38 C ATOM 79 C LEU A 314 8.019 -3.391 6.240 1.00 0.37 C ATOM 80 O LEU A 314 7.657 -4.427 6.804 1.00 0.50 O ATOM 81 CB LEU A 314 9.518 -2.685 8.121 1.00 0.51 C ATOM 82 CG LEU A 314 10.761 -3.411 7.603 1.00 0.57 C ATOM 83 CD1 LEU A 314 11.611 -2.479 6.751 1.00 0.54 C ATOM 84 CD2 LEU A 314 11.574 -3.966 8.761 1.00 0.72 C ATOM 0 H LEU A 314 7.259 -1.694 8.605 1.00 0.36 H new ATOM 0 HA LEU A 314 9.088 -1.538 6.367 1.00 0.38 H new ATOM 0 HB2 LEU A 314 9.837 -1.824 8.708 1.00 0.51 H new ATOM 0 HB3 LEU A 314 8.983 -3.351 8.798 1.00 0.51 H new ATOM 0 HG LEU A 314 10.437 -4.244 6.979 1.00 0.57 H new ATOM 0 HD11 LEU A 314 12.490 -3.014 6.392 1.00 0.54 H new ATOM 0 HD12 LEU A 314 11.026 -2.130 5.900 1.00 0.54 H new ATOM 0 HD13 LEU A 314 11.926 -1.624 7.350 1.00 0.54 H new ATOM 0 HD21 LEU A 314 12.454 -4.479 8.374 1.00 0.72 H new ATOM 0 HD22 LEU A 314 11.887 -3.149 9.411 1.00 0.72 H new ATOM 0 HD23 LEU A 314 10.965 -4.669 9.329 1.00 0.72 H new ATOM 96 N VAL A 315 7.939 -3.215 4.934 1.00 0.26 N ATOM 97 CA VAL A 315 7.452 -4.258 4.048 1.00 0.26 C ATOM 98 C VAL A 315 8.584 -4.778 3.178 1.00 0.24 C ATOM 99 O VAL A 315 9.686 -4.227 3.188 1.00 0.27 O ATOM 100 CB VAL A 315 6.304 -3.755 3.144 1.00 0.26 C ATOM 101 CG1 VAL A 315 5.102 -3.343 3.979 1.00 0.30 C ATOM 102 CG2 VAL A 315 6.767 -2.598 2.269 1.00 0.23 C ATOM 0 H VAL A 315 8.207 -2.353 4.460 1.00 0.26 H new ATOM 0 HA VAL A 315 7.066 -5.061 4.675 1.00 0.26 H new ATOM 0 HB VAL A 315 6.005 -4.576 2.492 1.00 0.26 H new ATOM 0 HG11 VAL A 315 4.306 -2.992 3.322 1.00 0.30 H new ATOM 0 HG12 VAL A 315 4.748 -4.199 4.554 1.00 0.30 H new ATOM 0 HG13 VAL A 315 5.390 -2.542 4.660 1.00 0.30 H new ATOM 0 HG21 VAL A 315 5.941 -2.262 1.642 1.00 0.23 H new ATOM 0 HG22 VAL A 315 7.101 -1.775 2.901 1.00 0.23 H new ATOM 0 HG23 VAL A 315 7.591 -2.927 1.637 1.00 0.23 H new ATOM 112 N LYS A 316 8.323 -5.846 2.444 1.00 0.25 N ATOM 113 CA LYS A 316 9.315 -6.399 1.537 1.00 0.28 C ATOM 114 C LYS A 316 8.742 -6.520 0.130 1.00 0.28 C ATOM 115 O LYS A 316 7.801 -7.282 -0.102 1.00 0.28 O ATOM 116 CB LYS A 316 9.794 -7.764 2.034 1.00 0.34 C ATOM 117 CG LYS A 316 10.428 -7.721 3.416 1.00 0.44 C ATOM 118 CD LYS A 316 11.018 -9.065 3.802 1.00 0.55 C ATOM 119 CE LYS A 316 12.175 -9.444 2.892 1.00 0.67 C ATOM 120 NZ LYS A 316 12.727 -10.783 3.214 1.00 1.44 N ATOM 0 H LYS A 316 7.435 -6.347 2.458 1.00 0.25 H new ATOM 0 HA LYS A 316 10.169 -5.722 1.508 1.00 0.28 H new ATOM 0 HB2 LYS A 316 8.948 -8.452 2.053 1.00 0.34 H new ATOM 0 HB3 LYS A 316 10.517 -8.167 1.324 1.00 0.34 H new ATOM 0 HG2 LYS A 316 11.209 -6.961 3.435 1.00 0.44 H new ATOM 0 HG3 LYS A 316 9.679 -7.427 4.151 1.00 0.44 H new ATOM 0 HD2 LYS A 316 11.362 -9.030 4.836 1.00 0.55 H new ATOM 0 HD3 LYS A 316 10.245 -9.832 3.749 1.00 0.55 H new ATOM 0 HE2 LYS A 316 11.839 -9.431 1.855 1.00 0.67 H new ATOM 0 HE3 LYS A 316 12.964 -8.697 2.980 1.00 0.67 H new ATOM 0 HZ1 LYS A 316 13.513 -10.999 2.568 1.00 1.44 H new ATOM 0 HZ2 LYS A 316 13.073 -10.789 4.195 1.00 1.44 H new ATOM 0 HZ3 LYS A 316 11.982 -11.501 3.105 1.00 1.44 H new ATOM 134 N GLU A 317 9.310 -5.763 -0.799 1.00 0.32 N ATOM 135 CA GLU A 317 8.841 -5.753 -2.178 1.00 0.37 C ATOM 136 C GLU A 317 9.289 -7.005 -2.914 1.00 0.45 C ATOM 137 O GLU A 317 10.484 -7.305 -2.982 1.00 0.48 O ATOM 138 CB GLU A 317 9.357 -4.519 -2.921 1.00 0.39 C ATOM 139 CG GLU A 317 8.962 -3.200 -2.281 1.00 0.41 C ATOM 140 CD GLU A 317 9.432 -2.004 -3.083 1.00 0.49 C ATOM 141 OE1 GLU A 317 10.629 -1.950 -3.435 1.00 0.70 O ATOM 142 OE2 GLU A 317 8.604 -1.115 -3.378 1.00 0.61 O ATOM 0 H GLU A 317 10.101 -5.144 -0.621 1.00 0.32 H new ATOM 0 HA GLU A 317 7.752 -5.725 -2.152 1.00 0.37 H new ATOM 0 HB2 GLU A 317 10.444 -4.571 -2.979 1.00 0.39 H new ATOM 0 HB3 GLU A 317 8.982 -4.541 -3.944 1.00 0.39 H new ATOM 0 HG2 GLU A 317 7.878 -3.160 -2.177 1.00 0.41 H new ATOM 0 HG3 GLU A 317 9.381 -3.147 -1.276 1.00 0.41 H new ATOM 275 N LEU A 325 13.242 -10.501 -1.544 1.00 0.61 N ATOM 276 CA LEU A 325 12.364 -9.355 -1.377 1.00 0.49 C ATOM 277 C LEU A 325 13.145 -8.182 -0.801 1.00 0.45 C ATOM 278 O LEU A 325 14.037 -8.369 0.028 1.00 0.55 O ATOM 279 CB LEU A 325 11.176 -9.695 -0.473 1.00 0.47 C ATOM 280 CG LEU A 325 10.241 -10.796 -0.988 1.00 0.53 C ATOM 281 CD1 LEU A 325 10.818 -12.176 -0.714 1.00 0.69 C ATOM 282 CD2 LEU A 325 8.869 -10.661 -0.356 1.00 0.56 C ATOM 0 HA LEU A 325 11.973 -9.080 -2.356 1.00 0.49 H new ATOM 0 HB2 LEU A 325 11.560 -9.996 0.502 1.00 0.47 H new ATOM 0 HB3 LEU A 325 10.590 -8.789 -0.319 1.00 0.47 H new ATOM 0 HG LEU A 325 10.143 -10.680 -2.067 1.00 0.53 H new ATOM 0 HD11 LEU A 325 10.134 -12.937 -1.090 1.00 0.69 H new ATOM 0 HD12 LEU A 325 11.781 -12.274 -1.215 1.00 0.69 H new ATOM 0 HD13 LEU A 325 10.953 -12.307 0.360 1.00 0.69 H new ATOM 0 HD21 LEU A 325 8.216 -11.449 -0.731 1.00 0.56 H new ATOM 0 HD22 LEU A 325 8.957 -10.748 0.727 1.00 0.56 H new ATOM 0 HD23 LEU A 325 8.446 -9.689 -0.609 1.00 0.56 H new ATOM 294 N VAL A 326 12.817 -6.982 -1.246 1.00 0.40 N ATOM 295 CA VAL A 326 13.546 -5.786 -0.841 1.00 0.38 C ATOM 296 C VAL A 326 12.844 -5.076 0.313 1.00 0.32 C ATOM 297 O VAL A 326 11.650 -4.790 0.232 1.00 0.29 O ATOM 298 CB VAL A 326 13.696 -4.801 -2.018 1.00 0.42 C ATOM 299 CG1 VAL A 326 14.575 -3.619 -1.632 1.00 0.45 C ATOM 300 CG2 VAL A 326 14.255 -5.509 -3.241 1.00 0.51 C ATOM 0 H VAL A 326 12.047 -6.806 -1.891 1.00 0.40 H new ATOM 0 HA VAL A 326 14.534 -6.111 -0.515 1.00 0.38 H new ATOM 0 HB VAL A 326 12.706 -4.418 -2.265 1.00 0.42 H new ATOM 0 HG11 VAL A 326 14.664 -2.940 -2.480 1.00 0.45 H new ATOM 0 HG12 VAL A 326 14.126 -3.092 -0.790 1.00 0.45 H new ATOM 0 HG13 VAL A 326 15.564 -3.978 -1.349 1.00 0.45 H new ATOM 0 HG21 VAL A 326 14.353 -4.797 -4.060 1.00 0.51 H new ATOM 0 HG22 VAL A 326 15.233 -5.927 -3.004 1.00 0.51 H new ATOM 0 HG23 VAL A 326 13.580 -6.312 -3.537 1.00 0.51 H new ATOM 310 N PRO A 327 13.574 -4.799 1.409 1.00 0.33 N ATOM 311 CA PRO A 327 13.043 -4.034 2.540 1.00 0.30 C ATOM 312 C PRO A 327 12.640 -2.625 2.118 1.00 0.25 C ATOM 313 O PRO A 327 13.455 -1.862 1.590 1.00 0.32 O ATOM 314 CB PRO A 327 14.209 -3.985 3.535 1.00 0.39 C ATOM 315 CG PRO A 327 15.122 -5.088 3.121 1.00 0.46 C ATOM 316 CD PRO A 327 14.969 -5.210 1.633 1.00 0.42 C ATOM 0 HA PRO A 327 12.145 -4.488 2.958 1.00 0.30 H new ATOM 0 HB2 PRO A 327 14.716 -3.021 3.501 1.00 0.39 H new ATOM 0 HB3 PRO A 327 13.860 -4.126 4.558 1.00 0.39 H new ATOM 0 HG2 PRO A 327 16.154 -4.863 3.391 1.00 0.46 H new ATOM 0 HG3 PRO A 327 14.858 -6.021 3.619 1.00 0.46 H new ATOM 0 HD2 PRO A 327 15.670 -4.566 1.101 1.00 0.42 H new ATOM 0 HD3 PRO A 327 15.149 -6.229 1.291 1.00 0.42 H new ATOM 324 N ARG A 328 11.382 -2.291 2.332 1.00 0.21 N ATOM 325 CA ARG A 328 10.857 -1.008 1.911 1.00 0.23 C ATOM 326 C ARG A 328 10.103 -0.340 3.053 1.00 0.20 C ATOM 327 O ARG A 328 9.358 -0.994 3.783 1.00 0.23 O ATOM 328 CB ARG A 328 9.927 -1.205 0.710 1.00 0.32 C ATOM 329 CG ARG A 328 9.503 0.089 0.033 1.00 0.50 C ATOM 330 CD ARG A 328 10.693 0.801 -0.587 1.00 0.56 C ATOM 331 NE ARG A 328 11.360 -0.020 -1.595 1.00 0.47 N ATOM 332 CZ ARG A 328 12.657 0.050 -1.875 1.00 0.58 C ATOM 333 NH1 ARG A 328 13.433 0.901 -1.220 1.00 0.78 N ATOM 334 NH2 ARG A 328 13.173 -0.732 -2.814 1.00 0.65 N ATOM 0 H ARG A 328 10.703 -2.894 2.797 1.00 0.21 H new ATOM 0 HA ARG A 328 11.687 -0.363 1.623 1.00 0.23 H new ATOM 0 HB2 ARG A 328 10.427 -1.839 -0.023 1.00 0.32 H new ATOM 0 HB3 ARG A 328 9.036 -1.739 1.038 1.00 0.32 H new ATOM 0 HG2 ARG A 328 8.763 -0.126 -0.738 1.00 0.50 H new ATOM 0 HG3 ARG A 328 9.024 0.743 0.761 1.00 0.50 H new ATOM 0 HD2 ARG A 328 10.360 1.734 -1.042 1.00 0.56 H new ATOM 0 HD3 ARG A 328 11.405 1.064 0.195 1.00 0.56 H new ATOM 0 HE ARG A 328 10.794 -0.689 -2.117 1.00 0.47 H new ATOM 0 HH11 ARG A 328 13.035 1.504 -0.500 1.00 0.78 H new ATOM 0 HH12 ARG A 328 14.428 0.954 -1.436 1.00 0.78 H new ATOM 0 HH21 ARG A 328 12.574 -1.385 -3.319 1.00 0.65 H new ATOM 0 HH22 ARG A 328 14.168 -0.680 -3.031 1.00 0.65 H new ATOM 348 N LEU A 329 10.311 0.957 3.211 1.00 0.18 N ATOM 349 CA LEU A 329 9.569 1.733 4.189 1.00 0.20 C ATOM 350 C LEU A 329 8.292 2.260 3.555 1.00 0.19 C ATOM 351 O LEU A 329 8.315 3.235 2.802 1.00 0.24 O ATOM 352 CB LEU A 329 10.417 2.896 4.714 1.00 0.25 C ATOM 353 CG LEU A 329 11.627 2.494 5.557 1.00 0.31 C ATOM 354 CD1 LEU A 329 12.495 3.708 5.849 1.00 0.37 C ATOM 355 CD2 LEU A 329 11.171 1.840 6.853 1.00 0.36 C ATOM 0 H LEU A 329 10.990 1.495 2.672 1.00 0.18 H new ATOM 0 HA LEU A 329 9.316 1.089 5.031 1.00 0.20 H new ATOM 0 HB2 LEU A 329 10.766 3.482 3.864 1.00 0.25 H new ATOM 0 HB3 LEU A 329 9.780 3.548 5.311 1.00 0.25 H new ATOM 0 HG LEU A 329 12.221 1.773 4.995 1.00 0.31 H new ATOM 0 HD11 LEU A 329 13.353 3.406 6.450 1.00 0.37 H new ATOM 0 HD12 LEU A 329 12.843 4.140 4.911 1.00 0.37 H new ATOM 0 HD13 LEU A 329 11.912 4.449 6.396 1.00 0.37 H new ATOM 0 HD21 LEU A 329 12.042 1.558 7.445 1.00 0.36 H new ATOM 0 HD22 LEU A 329 10.559 2.542 7.419 1.00 0.36 H new ATOM 0 HD23 LEU A 329 10.584 0.950 6.625 1.00 0.36 H new ATOM 367 N LEU A 330 7.189 1.586 3.828 1.00 0.17 N ATOM 368 CA LEU A 330 5.907 1.971 3.272 1.00 0.17 C ATOM 369 C LEU A 330 5.288 3.073 4.120 1.00 0.18 C ATOM 370 O LEU A 330 4.789 2.823 5.219 1.00 0.24 O ATOM 371 CB LEU A 330 4.974 0.758 3.204 1.00 0.22 C ATOM 372 CG LEU A 330 3.714 0.952 2.359 1.00 0.26 C ATOM 373 CD1 LEU A 330 4.082 1.203 0.905 1.00 0.57 C ATOM 374 CD2 LEU A 330 2.804 -0.260 2.478 1.00 0.49 C ATOM 0 H LEU A 330 7.157 0.766 4.434 1.00 0.17 H new ATOM 0 HA LEU A 330 6.055 2.348 2.260 1.00 0.17 H new ATOM 0 HB2 LEU A 330 5.533 -0.088 2.805 1.00 0.22 H new ATOM 0 HB3 LEU A 330 4.675 0.493 4.218 1.00 0.22 H new ATOM 0 HG LEU A 330 3.177 1.824 2.733 1.00 0.26 H new ATOM 0 HD11 LEU A 330 3.174 1.339 0.318 1.00 0.57 H new ATOM 0 HD12 LEU A 330 4.697 2.100 0.835 1.00 0.57 H new ATOM 0 HD13 LEU A 330 4.640 0.350 0.518 1.00 0.57 H new ATOM 0 HD21 LEU A 330 1.912 -0.106 1.871 1.00 0.49 H new ATOM 0 HD22 LEU A 330 3.332 -1.147 2.129 1.00 0.49 H new ATOM 0 HD23 LEU A 330 2.515 -0.397 3.520 1.00 0.49 H new ATOM 386 N GLY A 331 5.353 4.293 3.617 1.00 0.18 N ATOM 387 CA GLY A 331 4.842 5.427 4.350 1.00 0.22 C ATOM 388 C GLY A 331 3.383 5.686 4.055 1.00 0.22 C ATOM 389 O GLY A 331 3.034 6.145 2.966 1.00 0.29 O ATOM 0 H GLY A 331 5.754 4.519 2.707 1.00 0.18 H new ATOM 0 HA2 GLY A 331 4.970 5.254 5.419 1.00 0.22 H new ATOM 0 HA3 GLY A 331 5.425 6.313 4.098 1.00 0.22 H new ATOM 393 N ILE A 332 2.531 5.384 5.020 1.00 0.22 N ATOM 394 CA ILE A 332 1.101 5.600 4.874 1.00 0.22 C ATOM 395 C ILE A 332 0.713 6.925 5.513 1.00 0.24 C ATOM 396 O ILE A 332 0.749 7.067 6.736 1.00 0.36 O ATOM 397 CB ILE A 332 0.280 4.465 5.529 1.00 0.26 C ATOM 398 CG1 ILE A 332 0.736 3.096 5.015 1.00 0.27 C ATOM 399 CG2 ILE A 332 -1.209 4.663 5.269 1.00 0.28 C ATOM 400 CD1 ILE A 332 0.551 2.904 3.526 1.00 0.27 C ATOM 0 H ILE A 332 2.807 4.986 5.918 1.00 0.22 H new ATOM 0 HA ILE A 332 0.877 5.613 3.807 1.00 0.22 H new ATOM 0 HB ILE A 332 0.451 4.500 6.605 1.00 0.26 H new ATOM 0 HG12 ILE A 332 1.789 2.960 5.260 1.00 0.27 H new ATOM 0 HG13 ILE A 332 0.183 2.319 5.542 1.00 0.27 H new ATOM 0 HG21 ILE A 332 -1.771 3.855 5.737 1.00 0.28 H new ATOM 0 HG22 ILE A 332 -1.528 5.617 5.688 1.00 0.28 H new ATOM 0 HG23 ILE A 332 -1.395 4.659 4.195 1.00 0.28 H new ATOM 0 HD11 ILE A 332 0.897 1.910 3.241 1.00 0.27 H new ATOM 0 HD12 ILE A 332 -0.505 3.006 3.274 1.00 0.27 H new ATOM 0 HD13 ILE A 332 1.127 3.657 2.988 1.00 0.27 H new ATOM 412 N THR A 333 0.367 7.900 4.690 1.00 0.22 N ATOM 413 CA THR A 333 -0.010 9.205 5.196 1.00 0.23 C ATOM 414 C THR A 333 -1.492 9.461 4.965 1.00 0.23 C ATOM 415 O THR A 333 -2.184 8.650 4.347 1.00 0.28 O ATOM 416 CB THR A 333 0.807 10.336 4.539 1.00 0.26 C ATOM 417 OG1 THR A 333 0.463 10.449 3.156 1.00 0.34 O ATOM 418 CG2 THR A 333 2.300 10.076 4.669 1.00 0.38 C ATOM 0 H THR A 333 0.340 7.812 3.674 1.00 0.22 H new ATOM 0 HA THR A 333 0.202 9.203 6.265 1.00 0.23 H new ATOM 0 HB THR A 333 0.569 11.267 5.053 1.00 0.26 H new ATOM 0 HG1 THR A 333 0.804 9.670 2.669 1.00 0.34 H new ATOM 0 HG21 THR A 333 2.853 10.888 4.198 1.00 0.38 H new ATOM 0 HG22 THR A 333 2.569 10.018 5.724 1.00 0.38 H new ATOM 0 HG23 THR A 333 2.549 9.135 4.179 1.00 0.38 H new ATOM 426 N LYS A 334 -1.961 10.600 5.450 1.00 0.26 N ATOM 427 CA LYS A 334 -3.362 10.985 5.341 1.00 0.28 C ATOM 428 C LYS A 334 -3.775 11.270 3.899 1.00 0.26 C ATOM 429 O LYS A 334 -4.959 11.460 3.617 1.00 0.43 O ATOM 430 CB LYS A 334 -3.617 12.227 6.200 1.00 0.38 C ATOM 431 CG LYS A 334 -2.763 13.425 5.807 1.00 0.47 C ATOM 432 CD LYS A 334 -3.054 14.632 6.683 1.00 0.63 C ATOM 433 CE LYS A 334 -2.190 15.828 6.302 1.00 0.89 C ATOM 434 NZ LYS A 334 -2.447 16.291 4.912 1.00 1.61 N ATOM 0 H LYS A 334 -1.380 11.286 5.932 1.00 0.26 H new ATOM 0 HA LYS A 334 -3.962 10.146 5.694 1.00 0.28 H new ATOM 0 HB2 LYS A 334 -4.669 12.501 6.125 1.00 0.38 H new ATOM 0 HB3 LYS A 334 -3.426 11.982 7.245 1.00 0.38 H new ATOM 0 HG2 LYS A 334 -1.708 13.162 5.887 1.00 0.47 H new ATOM 0 HG3 LYS A 334 -2.950 13.679 4.764 1.00 0.47 H new ATOM 0 HD2 LYS A 334 -4.107 14.901 6.594 1.00 0.63 H new ATOM 0 HD3 LYS A 334 -2.878 14.374 7.727 1.00 0.63 H new ATOM 0 HE2 LYS A 334 -2.380 16.647 6.996 1.00 0.89 H new ATOM 0 HE3 LYS A 334 -1.138 15.561 6.405 1.00 0.89 H new ATOM 0 HZ1 LYS A 334 -2.642 17.313 4.917 1.00 1.61 H new ATOM 0 HZ2 LYS A 334 -1.612 16.101 4.323 1.00 1.61 H new ATOM 0 HZ3 LYS A 334 -3.268 15.784 4.523 1.00 1.61 H new ATOM 448 N GLU A 335 -2.814 11.299 2.986 1.00 0.27 N ATOM 449 CA GLU A 335 -3.105 11.685 1.615 1.00 0.33 C ATOM 450 C GLU A 335 -2.408 10.794 0.588 1.00 0.27 C ATOM 451 O GLU A 335 -2.883 10.664 -0.540 1.00 0.34 O ATOM 452 CB GLU A 335 -2.706 13.145 1.406 1.00 0.46 C ATOM 453 CG GLU A 335 -1.244 13.422 1.708 1.00 0.56 C ATOM 454 CD GLU A 335 -0.962 14.894 1.896 1.00 0.85 C ATOM 455 OE1 GLU A 335 -0.939 15.627 0.885 1.00 1.04 O ATOM 456 OE2 GLU A 335 -0.762 15.326 3.048 1.00 1.79 O ATOM 0 H GLU A 335 -1.838 11.063 3.167 1.00 0.27 H new ATOM 0 HA GLU A 335 -4.176 11.560 1.458 1.00 0.33 H new ATOM 0 HB2 GLU A 335 -2.915 13.427 0.374 1.00 0.46 H new ATOM 0 HB3 GLU A 335 -3.326 13.777 2.041 1.00 0.46 H new ATOM 0 HG2 GLU A 335 -0.954 12.882 2.609 1.00 0.56 H new ATOM 0 HG3 GLU A 335 -0.629 13.038 0.894 1.00 0.56 H new ATOM 463 N CYS A 336 -1.296 10.171 0.963 1.00 0.23 N ATOM 464 CA CYS A 336 -0.524 9.399 0.001 1.00 0.24 C ATOM 465 C CYS A 336 0.202 8.212 0.637 1.00 0.21 C ATOM 466 O CYS A 336 0.477 8.189 1.837 1.00 0.28 O ATOM 467 CB CYS A 336 0.485 10.310 -0.701 1.00 0.32 C ATOM 468 SG CYS A 336 1.545 11.250 0.423 1.00 1.10 S ATOM 0 H CYS A 336 -0.915 10.185 1.909 1.00 0.23 H new ATOM 0 HA CYS A 336 -1.230 8.990 -0.722 1.00 0.24 H new ATOM 0 HB2 CYS A 336 1.114 9.703 -1.352 1.00 0.32 H new ATOM 0 HB3 CYS A 336 -0.056 11.008 -1.340 1.00 0.32 H new ATOM 0 HG CYS A 336 1.080 11.161 1.634 1.00 1.10 H new ATOM 474 N VAL A 337 0.491 7.227 -0.199 1.00 0.22 N ATOM 475 CA VAL A 337 1.297 6.076 0.172 1.00 0.21 C ATOM 476 C VAL A 337 2.640 6.157 -0.546 1.00 0.19 C ATOM 477 O VAL A 337 2.701 6.085 -1.776 1.00 0.22 O ATOM 478 CB VAL A 337 0.593 4.754 -0.206 1.00 0.26 C ATOM 479 CG1 VAL A 337 1.473 3.555 0.106 1.00 0.27 C ATOM 480 CG2 VAL A 337 -0.743 4.635 0.511 1.00 0.32 C ATOM 0 H VAL A 337 0.168 7.205 -1.166 1.00 0.22 H new ATOM 0 HA VAL A 337 1.441 6.088 1.252 1.00 0.21 H new ATOM 0 HB VAL A 337 0.411 4.767 -1.281 1.00 0.26 H new ATOM 0 HG11 VAL A 337 0.951 2.639 -0.171 1.00 0.27 H new ATOM 0 HG12 VAL A 337 2.402 3.628 -0.460 1.00 0.27 H new ATOM 0 HG13 VAL A 337 1.698 3.537 1.172 1.00 0.27 H new ATOM 0 HG21 VAL A 337 -1.224 3.697 0.232 1.00 0.32 H new ATOM 0 HG22 VAL A 337 -0.580 4.653 1.589 1.00 0.32 H new ATOM 0 HG23 VAL A 337 -1.384 5.470 0.227 1.00 0.32 H new ATOM 490 N MET A 338 3.707 6.326 0.213 1.00 0.17 N ATOM 491 CA MET A 338 5.024 6.535 -0.371 1.00 0.17 C ATOM 492 C MET A 338 5.932 5.330 -0.152 1.00 0.16 C ATOM 493 O MET A 338 5.918 4.710 0.912 1.00 0.20 O ATOM 494 CB MET A 338 5.672 7.793 0.219 1.00 0.22 C ATOM 495 CG MET A 338 5.901 7.717 1.721 1.00 0.24 C ATOM 496 SD MET A 338 6.535 9.256 2.413 1.00 1.08 S ATOM 497 CE MET A 338 5.176 10.363 2.053 1.00 0.62 C ATOM 0 H MET A 338 3.690 6.323 1.233 1.00 0.17 H new ATOM 0 HA MET A 338 4.893 6.666 -1.445 1.00 0.17 H new ATOM 0 HB2 MET A 338 6.627 7.965 -0.277 1.00 0.22 H new ATOM 0 HB3 MET A 338 5.040 8.653 0.000 1.00 0.22 H new ATOM 0 HG2 MET A 338 4.963 7.462 2.214 1.00 0.24 H new ATOM 0 HG3 MET A 338 6.603 6.911 1.936 1.00 0.24 H new ATOM 0 HE1 MET A 338 4.949 10.959 2.937 1.00 0.62 H new ATOM 0 HE2 MET A 338 5.452 11.023 1.231 1.00 0.62 H new ATOM 0 HE3 MET A 338 4.298 9.782 1.772 1.00 0.62 H new ATOM 507 N ARG A 339 6.709 4.997 -1.172 1.00 0.16 N ATOM 508 CA ARG A 339 7.706 3.943 -1.062 1.00 0.17 C ATOM 509 C ARG A 339 9.066 4.545 -0.736 1.00 0.16 C ATOM 510 O ARG A 339 9.750 5.068 -1.617 1.00 0.18 O ATOM 511 CB ARG A 339 7.800 3.126 -2.357 1.00 0.22 C ATOM 512 CG ARG A 339 6.534 2.358 -2.694 1.00 0.27 C ATOM 513 CD ARG A 339 6.779 1.332 -3.792 1.00 0.31 C ATOM 514 NE ARG A 339 7.109 1.943 -5.081 1.00 0.73 N ATOM 515 CZ ARG A 339 8.123 1.546 -5.853 1.00 1.03 C ATOM 516 NH1 ARG A 339 8.922 0.556 -5.459 1.00 1.15 N ATOM 517 NH2 ARG A 339 8.325 2.125 -7.030 1.00 1.55 N ATOM 0 H ARG A 339 6.668 5.443 -2.088 1.00 0.16 H new ATOM 0 HA ARG A 339 7.399 3.274 -0.258 1.00 0.17 H new ATOM 0 HB2 ARG A 339 8.036 3.798 -3.182 1.00 0.22 H new ATOM 0 HB3 ARG A 339 8.628 2.422 -2.272 1.00 0.22 H new ATOM 0 HG2 ARG A 339 6.164 1.855 -1.801 1.00 0.27 H new ATOM 0 HG3 ARG A 339 5.758 3.055 -3.012 1.00 0.27 H new ATOM 0 HD2 ARG A 339 7.592 0.672 -3.490 1.00 0.31 H new ATOM 0 HD3 ARG A 339 5.890 0.711 -3.907 1.00 0.31 H new ATOM 0 HE ARG A 339 6.531 2.717 -5.408 1.00 0.73 H new ATOM 0 HH11 ARG A 339 8.761 0.096 -4.563 1.00 1.15 H new ATOM 0 HH12 ARG A 339 9.695 0.257 -6.054 1.00 1.15 H new ATOM 0 HH21 ARG A 339 7.706 2.872 -7.344 1.00 1.55 H new ATOM 0 HH22 ARG A 339 9.099 1.823 -7.621 1.00 1.55 H new ATOM 531 N VAL A 340 9.441 4.491 0.531 1.00 0.18 N ATOM 532 CA VAL A 340 10.705 5.054 0.982 1.00 0.22 C ATOM 533 C VAL A 340 11.770 3.967 1.082 1.00 0.24 C ATOM 534 O VAL A 340 11.508 2.870 1.576 1.00 0.24 O ATOM 535 CB VAL A 340 10.543 5.756 2.349 1.00 0.25 C ATOM 536 CG1 VAL A 340 11.860 6.346 2.824 1.00 0.31 C ATOM 537 CG2 VAL A 340 9.476 6.836 2.266 1.00 0.28 C ATOM 0 H VAL A 340 8.885 4.061 1.270 1.00 0.18 H new ATOM 0 HA VAL A 340 11.021 5.795 0.247 1.00 0.22 H new ATOM 0 HB VAL A 340 10.229 5.008 3.077 1.00 0.25 H new ATOM 0 HG11 VAL A 340 11.714 6.833 3.788 1.00 0.31 H new ATOM 0 HG12 VAL A 340 12.599 5.551 2.927 1.00 0.31 H new ATOM 0 HG13 VAL A 340 12.214 7.078 2.098 1.00 0.31 H new ATOM 0 HG21 VAL A 340 9.373 7.321 3.237 1.00 0.28 H new ATOM 0 HG22 VAL A 340 9.764 7.576 1.519 1.00 0.28 H new ATOM 0 HG23 VAL A 340 8.524 6.386 1.983 1.00 0.28 H new ATOM 547 N ASP A 341 12.964 4.261 0.586 1.00 0.30 N ATOM 548 CA ASP A 341 14.069 3.315 0.645 1.00 0.36 C ATOM 549 C ASP A 341 14.542 3.144 2.082 1.00 0.38 C ATOM 550 O ASP A 341 14.646 4.117 2.827 1.00 0.41 O ATOM 551 CB ASP A 341 15.228 3.776 -0.242 1.00 0.46 C ATOM 552 CG ASP A 341 16.336 2.744 -0.320 1.00 0.55 C ATOM 553 OD1 ASP A 341 16.081 1.621 -0.803 1.00 0.67 O ATOM 554 OD2 ASP A 341 17.475 3.059 0.086 1.00 0.77 O ATOM 0 H ASP A 341 13.192 5.148 0.138 1.00 0.30 H new ATOM 0 HA ASP A 341 13.715 2.353 0.274 1.00 0.36 H new ATOM 0 HB2 ASP A 341 14.855 3.983 -1.245 1.00 0.46 H new ATOM 0 HB3 ASP A 341 15.631 4.711 0.147 1.00 0.46 H new ATOM 559 N GLU A 342 14.828 1.910 2.463 1.00 0.42 N ATOM 560 CA GLU A 342 15.189 1.595 3.836 1.00 0.47 C ATOM 561 C GLU A 342 16.581 2.140 4.154 1.00 0.60 C ATOM 562 O GLU A 342 16.828 2.648 5.247 1.00 0.72 O ATOM 563 CB GLU A 342 15.141 0.074 4.041 1.00 0.49 C ATOM 564 CG GLU A 342 14.797 -0.372 5.458 1.00 0.60 C ATOM 565 CD GLU A 342 15.826 0.042 6.488 1.00 0.95 C ATOM 566 OE1 GLU A 342 16.867 -0.637 6.596 1.00 1.51 O ATOM 567 OE2 GLU A 342 15.597 1.047 7.195 1.00 1.36 O ATOM 0 H GLU A 342 14.817 1.105 1.837 1.00 0.42 H new ATOM 0 HA GLU A 342 14.478 2.065 4.515 1.00 0.47 H new ATOM 0 HB2 GLU A 342 14.407 -0.348 3.355 1.00 0.49 H new ATOM 0 HB3 GLU A 342 16.109 -0.345 3.769 1.00 0.49 H new ATOM 0 HG2 GLU A 342 13.829 0.044 5.736 1.00 0.60 H new ATOM 0 HG3 GLU A 342 14.695 -1.457 5.474 1.00 0.60 H new ATOM 574 N LYS A 343 17.481 2.061 3.186 1.00 0.69 N ATOM 575 CA LYS A 343 18.864 2.449 3.414 1.00 0.87 C ATOM 576 C LYS A 343 19.084 3.944 3.169 1.00 0.79 C ATOM 577 O LYS A 343 19.585 4.656 4.039 1.00 0.86 O ATOM 578 CB LYS A 343 19.797 1.627 2.522 1.00 1.08 C ATOM 579 CG LYS A 343 21.268 1.883 2.799 1.00 1.36 C ATOM 580 CD LYS A 343 22.168 1.094 1.866 1.00 1.63 C ATOM 581 CE LYS A 343 23.633 1.430 2.101 1.00 2.26 C ATOM 582 NZ LYS A 343 23.894 2.887 1.958 1.00 3.06 N ATOM 0 H LYS A 343 17.280 1.734 2.241 1.00 0.69 H new ATOM 0 HA LYS A 343 19.094 2.248 4.460 1.00 0.87 H new ATOM 0 HB2 LYS A 343 19.586 0.567 2.665 1.00 1.08 H new ATOM 0 HB3 LYS A 343 19.585 1.856 1.477 1.00 1.08 H new ATOM 0 HG2 LYS A 343 21.477 2.947 2.691 1.00 1.36 H new ATOM 0 HG3 LYS A 343 21.494 1.617 3.832 1.00 1.36 H new ATOM 0 HD2 LYS A 343 22.008 0.027 2.018 1.00 1.63 H new ATOM 0 HD3 LYS A 343 21.904 1.311 0.831 1.00 1.63 H new ATOM 0 HE2 LYS A 343 23.925 1.104 3.099 1.00 2.26 H new ATOM 0 HE3 LYS A 343 24.251 0.879 1.392 1.00 2.26 H new ATOM 0 HZ1 LYS A 343 24.910 3.044 1.803 1.00 3.06 H new ATOM 0 HZ2 LYS A 343 23.359 3.258 1.147 1.00 3.06 H new ATOM 0 HZ3 LYS A 343 23.595 3.380 2.824 1.00 3.06 H new ATOM 596 N THR A 344 18.696 4.418 1.994 1.00 0.73 N ATOM 597 CA THR A 344 18.973 5.793 1.598 1.00 0.72 C ATOM 598 C THR A 344 17.880 6.749 2.091 1.00 0.63 C ATOM 599 O THR A 344 18.065 7.969 2.096 1.00 0.67 O ATOM 600 CB THR A 344 19.101 5.896 0.067 1.00 0.80 C ATOM 601 OG1 THR A 344 19.720 4.703 -0.444 1.00 0.92 O ATOM 602 CG2 THR A 344 19.937 7.104 -0.323 1.00 0.92 C ATOM 0 H THR A 344 18.189 3.872 1.298 1.00 0.73 H new ATOM 0 HA THR A 344 19.916 6.084 2.060 1.00 0.72 H new ATOM 0 HB THR A 344 18.104 6.009 -0.358 1.00 0.80 H new ATOM 0 HG1 THR A 344 19.071 3.968 -0.435 1.00 0.92 H new ATOM 0 HG21 THR A 344 20.015 7.158 -1.409 1.00 0.92 H new ATOM 0 HG22 THR A 344 19.463 8.011 0.052 1.00 0.92 H new ATOM 0 HG23 THR A 344 20.934 7.011 0.108 1.00 0.92 H new ATOM 610 N LYS A 345 16.747 6.174 2.507 1.00 0.55 N ATOM 611 CA LYS A 345 15.617 6.935 3.058 1.00 0.52 C ATOM 612 C LYS A 345 14.984 7.859 2.012 1.00 0.53 C ATOM 613 O LYS A 345 14.287 8.815 2.361 1.00 0.61 O ATOM 614 CB LYS A 345 16.050 7.756 4.281 1.00 0.61 C ATOM 615 CG LYS A 345 16.692 6.938 5.393 1.00 0.63 C ATOM 616 CD LYS A 345 15.762 5.860 5.928 1.00 0.62 C ATOM 617 CE LYS A 345 16.407 5.111 7.084 1.00 0.71 C ATOM 618 NZ LYS A 345 15.583 3.964 7.546 1.00 1.50 N ATOM 0 H LYS A 345 16.586 5.167 2.472 1.00 0.55 H new ATOM 0 HA LYS A 345 14.867 6.206 3.365 1.00 0.52 H new ATOM 0 HB2 LYS A 345 16.754 8.523 3.958 1.00 0.61 H new ATOM 0 HB3 LYS A 345 15.179 8.273 4.683 1.00 0.61 H new ATOM 0 HG2 LYS A 345 17.605 6.474 5.019 1.00 0.63 H new ATOM 0 HG3 LYS A 345 16.982 7.601 6.208 1.00 0.63 H new ATOM 0 HD2 LYS A 345 14.827 6.312 6.259 1.00 0.62 H new ATOM 0 HD3 LYS A 345 15.513 5.160 5.130 1.00 0.62 H new ATOM 0 HE2 LYS A 345 17.388 4.749 6.777 1.00 0.71 H new ATOM 0 HE3 LYS A 345 16.566 5.798 7.915 1.00 0.71 H new ATOM 0 HZ1 LYS A 345 16.003 3.559 8.407 1.00 1.50 H new ATOM 0 HZ2 LYS A 345 14.618 4.291 7.753 1.00 1.50 H new ATOM 0 HZ3 LYS A 345 15.551 3.238 6.802 1.00 1.50 H new ATOM 632 N GLU A 346 15.206 7.560 0.736 1.00 0.53 N ATOM 633 CA GLU A 346 14.644 8.367 -0.345 1.00 0.58 C ATOM 634 C GLU A 346 13.253 7.877 -0.720 1.00 0.44 C ATOM 635 O GLU A 346 12.938 6.699 -0.562 1.00 0.42 O ATOM 636 CB GLU A 346 15.537 8.315 -1.585 1.00 0.77 C ATOM 637 CG GLU A 346 16.947 8.817 -1.352 1.00 0.95 C ATOM 638 CD GLU A 346 17.749 8.869 -2.634 1.00 1.61 C ATOM 639 OE1 GLU A 346 18.194 7.805 -3.109 1.00 2.46 O ATOM 640 OE2 GLU A 346 17.927 9.977 -3.182 1.00 1.81 O ATOM 0 H GLU A 346 15.769 6.768 0.424 1.00 0.53 H new ATOM 0 HA GLU A 346 14.582 9.394 0.014 1.00 0.58 H new ATOM 0 HB2 GLU A 346 15.583 7.287 -1.944 1.00 0.77 H new ATOM 0 HB3 GLU A 346 15.078 8.908 -2.376 1.00 0.77 H new ATOM 0 HG2 GLU A 346 16.909 9.812 -0.908 1.00 0.95 H new ATOM 0 HG3 GLU A 346 17.450 8.167 -0.636 1.00 0.95 H new ATOM 647 N VAL A 347 12.430 8.781 -1.227 1.00 0.39 N ATOM 648 CA VAL A 347 11.100 8.425 -1.691 1.00 0.33 C ATOM 649 C VAL A 347 11.161 8.032 -3.164 1.00 0.31 C ATOM 650 O VAL A 347 11.432 8.865 -4.030 1.00 0.42 O ATOM 651 CB VAL A 347 10.098 9.586 -1.508 1.00 0.41 C ATOM 652 CG1 VAL A 347 8.700 9.168 -1.942 1.00 0.54 C ATOM 653 CG2 VAL A 347 10.091 10.064 -0.062 1.00 0.58 C ATOM 0 H VAL A 347 12.661 9.769 -1.328 1.00 0.39 H new ATOM 0 HA VAL A 347 10.751 7.584 -1.091 1.00 0.33 H new ATOM 0 HB VAL A 347 10.416 10.413 -2.142 1.00 0.41 H new ATOM 0 HG11 VAL A 347 8.012 10.002 -1.804 1.00 0.54 H new ATOM 0 HG12 VAL A 347 8.716 8.881 -2.993 1.00 0.54 H new ATOM 0 HG13 VAL A 347 8.370 8.322 -1.340 1.00 0.54 H new ATOM 0 HG21 VAL A 347 9.379 10.882 0.047 1.00 0.58 H new ATOM 0 HG22 VAL A 347 9.801 9.241 0.592 1.00 0.58 H new ATOM 0 HG23 VAL A 347 11.087 10.411 0.211 1.00 0.58 H new ATOM 663 N ILE A 348 10.932 6.758 -3.441 1.00 0.25 N ATOM 664 CA ILE A 348 11.016 6.244 -4.802 1.00 0.26 C ATOM 665 C ILE A 348 9.774 6.617 -5.599 1.00 0.26 C ATOM 666 O ILE A 348 9.863 7.047 -6.749 1.00 0.35 O ATOM 667 CB ILE A 348 11.182 4.710 -4.813 1.00 0.27 C ATOM 668 CG1 ILE A 348 12.410 4.305 -3.997 1.00 0.29 C ATOM 669 CG2 ILE A 348 11.295 4.193 -6.242 1.00 0.32 C ATOM 670 CD1 ILE A 348 12.615 2.809 -3.917 1.00 0.31 C ATOM 0 H ILE A 348 10.686 6.058 -2.741 1.00 0.25 H new ATOM 0 HA ILE A 348 11.893 6.698 -5.264 1.00 0.26 H new ATOM 0 HB ILE A 348 10.299 4.262 -4.357 1.00 0.27 H new ATOM 0 HG12 ILE A 348 13.296 4.762 -4.438 1.00 0.29 H new ATOM 0 HG13 ILE A 348 12.314 4.705 -2.988 1.00 0.29 H new ATOM 0 HG21 ILE A 348 11.411 3.109 -6.229 1.00 0.32 H new ATOM 0 HG22 ILE A 348 10.393 4.454 -6.796 1.00 0.32 H new ATOM 0 HG23 ILE A 348 12.161 4.645 -6.725 1.00 0.32 H new ATOM 0 HD11 ILE A 348 13.504 2.595 -3.323 1.00 0.31 H new ATOM 0 HD12 ILE A 348 11.746 2.347 -3.449 1.00 0.31 H new ATOM 0 HD13 ILE A 348 12.743 2.405 -4.921 1.00 0.31 H new ATOM 682 N GLN A 349 8.619 6.464 -4.973 1.00 0.23 N ATOM 683 CA GLN A 349 7.349 6.712 -5.635 1.00 0.23 C ATOM 684 C GLN A 349 6.272 6.978 -4.593 1.00 0.22 C ATOM 685 O GLN A 349 6.288 6.376 -3.517 1.00 0.29 O ATOM 686 CB GLN A 349 6.982 5.508 -6.505 1.00 0.28 C ATOM 687 CG GLN A 349 5.715 5.679 -7.321 1.00 0.40 C ATOM 688 CD GLN A 349 5.520 4.547 -8.307 1.00 0.86 C ATOM 689 OE1 GLN A 349 5.964 3.422 -8.070 1.00 1.65 O ATOM 690 NE2 GLN A 349 4.846 4.830 -9.409 1.00 0.81 N ATOM 0 H GLN A 349 8.535 6.167 -4.001 1.00 0.23 H new ATOM 0 HA GLN A 349 7.432 7.590 -6.276 1.00 0.23 H new ATOM 0 HB2 GLN A 349 7.810 5.301 -7.183 1.00 0.28 H new ATOM 0 HB3 GLN A 349 6.870 4.634 -5.863 1.00 0.28 H new ATOM 0 HG2 GLN A 349 4.856 5.729 -6.652 1.00 0.40 H new ATOM 0 HG3 GLN A 349 5.755 6.626 -7.859 1.00 0.40 H new ATOM 0 HE21 GLN A 349 4.496 5.776 -9.564 1.00 0.81 H new ATOM 0 HE22 GLN A 349 4.676 4.103 -10.104 1.00 0.81 H new ATOM 699 N GLU A 350 5.349 7.874 -4.906 1.00 0.23 N ATOM 700 CA GLU A 350 4.330 8.288 -3.953 1.00 0.25 C ATOM 701 C GLU A 350 2.952 8.289 -4.610 1.00 0.26 C ATOM 702 O GLU A 350 2.702 9.044 -5.551 1.00 0.36 O ATOM 703 CB GLU A 350 4.669 9.683 -3.423 1.00 0.30 C ATOM 704 CG GLU A 350 3.763 10.159 -2.301 1.00 0.36 C ATOM 705 CD GLU A 350 4.081 11.576 -1.874 1.00 0.45 C ATOM 706 OE1 GLU A 350 5.013 11.760 -1.062 1.00 0.65 O ATOM 707 OE2 GLU A 350 3.401 12.511 -2.341 1.00 0.60 O ATOM 0 H GLU A 350 5.284 8.330 -5.816 1.00 0.23 H new ATOM 0 HA GLU A 350 4.309 7.582 -3.122 1.00 0.25 H new ATOM 0 HB2 GLU A 350 5.700 9.684 -3.068 1.00 0.30 H new ATOM 0 HB3 GLU A 350 4.614 10.395 -4.246 1.00 0.30 H new ATOM 0 HG2 GLU A 350 2.724 10.103 -2.626 1.00 0.36 H new ATOM 0 HG3 GLU A 350 3.865 9.492 -1.445 1.00 0.36 H new ATOM 714 N TRP A 351 2.063 7.437 -4.117 1.00 0.23 N ATOM 715 CA TRP A 351 0.719 7.329 -4.668 1.00 0.26 C ATOM 716 C TRP A 351 -0.289 8.025 -3.767 1.00 0.25 C ATOM 717 O TRP A 351 -0.411 7.682 -2.597 1.00 0.52 O ATOM 718 CB TRP A 351 0.303 5.865 -4.802 1.00 0.30 C ATOM 719 CG TRP A 351 1.231 5.031 -5.623 1.00 0.30 C ATOM 720 CD1 TRP A 351 1.517 5.184 -6.946 1.00 0.38 C ATOM 721 CD2 TRP A 351 1.972 3.891 -5.178 1.00 0.30 C ATOM 722 NE1 TRP A 351 2.393 4.210 -7.353 1.00 0.41 N ATOM 723 CE2 TRP A 351 2.689 3.404 -6.286 1.00 0.34 C ATOM 724 CE3 TRP A 351 2.099 3.236 -3.948 1.00 0.35 C ATOM 725 CZ2 TRP A 351 3.520 2.292 -6.202 1.00 0.38 C ATOM 726 CZ3 TRP A 351 2.926 2.132 -3.869 1.00 0.40 C ATOM 727 CH2 TRP A 351 3.626 1.670 -4.990 1.00 0.39 C ATOM 0 H TRP A 351 2.249 6.809 -3.335 1.00 0.23 H new ATOM 0 HA TRP A 351 0.733 7.803 -5.650 1.00 0.26 H new ATOM 0 HB2 TRP A 351 0.228 5.429 -3.806 1.00 0.30 H new ATOM 0 HB3 TRP A 351 -0.692 5.822 -5.245 1.00 0.30 H new ATOM 0 HD1 TRP A 351 1.113 5.959 -7.581 1.00 0.38 H new ATOM 0 HE1 TRP A 351 2.764 4.103 -8.297 1.00 0.41 H new ATOM 0 HE3 TRP A 351 1.562 3.586 -3.079 1.00 0.35 H new ATOM 0 HZ2 TRP A 351 4.062 1.933 -7.064 1.00 0.38 H new ATOM 0 HZ3 TRP A 351 3.034 1.617 -2.926 1.00 0.40 H new ATOM 0 HH2 TRP A 351 4.263 0.803 -4.895 1.00 0.39 H new ATOM 738 N SER A 352 -1.014 8.991 -4.304 1.00 0.31 N ATOM 739 CA SER A 352 -2.093 9.614 -3.554 1.00 0.30 C ATOM 740 C SER A 352 -3.203 8.589 -3.321 1.00 0.26 C ATOM 741 O SER A 352 -3.438 7.728 -4.172 1.00 0.28 O ATOM 742 CB SER A 352 -2.634 10.834 -4.306 1.00 0.35 C ATOM 743 OG SER A 352 -3.577 11.547 -3.525 1.00 1.27 O ATOM 0 H SER A 352 -0.878 9.358 -5.246 1.00 0.31 H new ATOM 0 HA SER A 352 -1.713 9.955 -2.591 1.00 0.30 H new ATOM 0 HB2 SER A 352 -1.809 11.493 -4.574 1.00 0.35 H new ATOM 0 HB3 SER A 352 -3.100 10.512 -5.237 1.00 0.35 H new ATOM 0 HG SER A 352 -3.432 11.349 -2.576 1.00 1.27 H new ATOM 749 N LEU A 353 -3.876 8.681 -2.176 1.00 0.25 N ATOM 750 CA LEU A 353 -4.916 7.717 -1.803 1.00 0.24 C ATOM 751 C LEU A 353 -6.034 7.672 -2.840 1.00 0.23 C ATOM 752 O LEU A 353 -6.734 6.670 -2.973 1.00 0.23 O ATOM 753 CB LEU A 353 -5.502 8.060 -0.431 1.00 0.25 C ATOM 754 CG LEU A 353 -4.520 7.987 0.741 1.00 0.26 C ATOM 755 CD1 LEU A 353 -5.220 8.345 2.041 1.00 0.31 C ATOM 756 CD2 LEU A 353 -3.898 6.601 0.837 1.00 0.26 C ATOM 0 H LEU A 353 -3.721 9.416 -1.486 1.00 0.25 H new ATOM 0 HA LEU A 353 -4.447 6.734 -1.759 1.00 0.24 H new ATOM 0 HB2 LEU A 353 -5.916 9.067 -0.473 1.00 0.25 H new ATOM 0 HB3 LEU A 353 -6.332 7.383 -0.230 1.00 0.25 H new ATOM 0 HG LEU A 353 -3.722 8.708 0.565 1.00 0.26 H new ATOM 0 HD11 LEU A 353 -4.509 8.288 2.865 1.00 0.31 H new ATOM 0 HD12 LEU A 353 -5.617 9.358 1.973 1.00 0.31 H new ATOM 0 HD13 LEU A 353 -6.037 7.646 2.219 1.00 0.31 H new ATOM 0 HD21 LEU A 353 -3.203 6.571 1.677 1.00 0.26 H new ATOM 0 HD22 LEU A 353 -4.683 5.860 0.989 1.00 0.26 H new ATOM 0 HD23 LEU A 353 -3.362 6.378 -0.086 1.00 0.26 H new ATOM 768 N THR A 354 -6.185 8.758 -3.581 1.00 0.26 N ATOM 769 CA THR A 354 -7.201 8.855 -4.617 1.00 0.28 C ATOM 770 C THR A 354 -6.917 7.893 -5.782 1.00 0.28 C ATOM 771 O THR A 354 -7.809 7.579 -6.568 1.00 0.35 O ATOM 772 CB THR A 354 -7.264 10.286 -5.174 1.00 0.36 C ATOM 773 OG1 THR A 354 -5.983 10.643 -5.708 1.00 0.44 O ATOM 774 CG2 THR A 354 -7.645 11.300 -4.108 1.00 0.42 C ATOM 0 H THR A 354 -5.609 9.594 -3.482 1.00 0.26 H new ATOM 0 HA THR A 354 -8.152 8.586 -4.157 1.00 0.28 H new ATOM 0 HB THR A 354 -8.031 10.303 -5.949 1.00 0.36 H new ATOM 0 HG1 THR A 354 -6.095 11.011 -6.609 1.00 0.44 H new ATOM 0 HG21 THR A 354 -7.677 12.297 -4.549 1.00 0.42 H new ATOM 0 HG22 THR A 354 -8.626 11.051 -3.703 1.00 0.42 H new ATOM 0 HG23 THR A 354 -6.906 11.281 -3.307 1.00 0.42 H new ATOM 782 N ASN A 355 -5.673 7.425 -5.885 1.00 0.26 N ATOM 783 CA ASN A 355 -5.257 6.592 -7.015 1.00 0.30 C ATOM 784 C ASN A 355 -5.394 5.112 -6.705 1.00 0.28 C ATOM 785 O ASN A 355 -5.123 4.265 -7.555 1.00 0.33 O ATOM 786 CB ASN A 355 -3.809 6.891 -7.408 1.00 0.37 C ATOM 787 CG ASN A 355 -3.647 8.260 -8.028 1.00 0.49 C ATOM 788 OD1 ASN A 355 -3.339 9.248 -7.208 1.00 0.83 O flip ATOM 789 ND2 ASN A 355 -3.792 8.427 -9.234 1.00 0.66 N flip ATOM 0 H ASN A 355 -4.937 7.607 -5.202 1.00 0.26 H new ATOM 0 HA ASN A 355 -5.919 6.835 -7.846 1.00 0.30 H new ATOM 0 HB2 ASN A 355 -3.174 6.818 -6.525 1.00 0.37 H new ATOM 0 HB3 ASN A 355 -3.464 6.134 -8.112 1.00 0.37 H new ATOM 0 HD21 ASN A 355 -4.030 7.637 -9.833 1.00 0.66 H new ATOM 0 HD22 ASN A 355 -3.675 9.356 -9.638 1.00 0.66 H new ATOM 796 N ILE A 356 -5.809 4.801 -5.493 1.00 0.26 N ATOM 797 CA ILE A 356 -5.973 3.417 -5.091 1.00 0.28 C ATOM 798 C ILE A 356 -7.363 2.925 -5.477 1.00 0.28 C ATOM 799 O ILE A 356 -8.354 3.605 -5.231 1.00 0.38 O ATOM 800 CB ILE A 356 -5.772 3.243 -3.573 1.00 0.31 C ATOM 801 CG1 ILE A 356 -4.406 3.798 -3.152 1.00 0.33 C ATOM 802 CG2 ILE A 356 -5.891 1.776 -3.192 1.00 0.36 C ATOM 803 CD1 ILE A 356 -4.151 3.724 -1.661 1.00 0.38 C ATOM 0 H ILE A 356 -6.038 5.485 -4.771 1.00 0.26 H new ATOM 0 HA ILE A 356 -5.214 2.829 -5.607 1.00 0.28 H new ATOM 0 HB ILE A 356 -6.548 3.801 -3.050 1.00 0.31 H new ATOM 0 HG12 ILE A 356 -3.624 3.246 -3.673 1.00 0.33 H new ATOM 0 HG13 ILE A 356 -4.331 4.837 -3.473 1.00 0.33 H new ATOM 0 HG21 ILE A 356 -5.747 1.666 -2.117 1.00 0.36 H new ATOM 0 HG22 ILE A 356 -6.880 1.408 -3.465 1.00 0.36 H new ATOM 0 HG23 ILE A 356 -5.131 1.200 -3.720 1.00 0.36 H new ATOM 0 HD11 ILE A 356 -3.166 4.135 -1.440 1.00 0.38 H new ATOM 0 HD12 ILE A 356 -4.911 4.300 -1.133 1.00 0.38 H new ATOM 0 HD13 ILE A 356 -4.192 2.684 -1.336 1.00 0.38 H new ATOM 815 N LYS A 357 -7.435 1.761 -6.098 1.00 0.26 N ATOM 816 CA LYS A 357 -8.719 1.194 -6.482 1.00 0.30 C ATOM 817 C LYS A 357 -9.188 0.189 -5.436 1.00 0.31 C ATOM 818 O LYS A 357 -10.292 0.294 -4.902 1.00 0.45 O ATOM 819 CB LYS A 357 -8.615 0.520 -7.852 1.00 0.35 C ATOM 820 CG LYS A 357 -9.934 -0.047 -8.348 1.00 0.46 C ATOM 821 CD LYS A 357 -9.782 -0.726 -9.697 1.00 0.60 C ATOM 822 CE LYS A 357 -11.110 -1.265 -10.202 1.00 0.79 C ATOM 823 NZ LYS A 357 -12.114 -0.185 -10.393 1.00 1.75 N ATOM 0 H LYS A 357 -6.626 1.192 -6.347 1.00 0.26 H new ATOM 0 HA LYS A 357 -9.449 2.001 -6.544 1.00 0.30 H new ATOM 0 HB2 LYS A 357 -8.244 1.244 -8.577 1.00 0.35 H new ATOM 0 HB3 LYS A 357 -7.880 -0.283 -7.798 1.00 0.35 H new ATOM 0 HG2 LYS A 357 -10.318 -0.763 -7.622 1.00 0.46 H new ATOM 0 HG3 LYS A 357 -10.669 0.755 -8.425 1.00 0.46 H new ATOM 0 HD2 LYS A 357 -9.378 -0.017 -10.419 1.00 0.60 H new ATOM 0 HD3 LYS A 357 -9.064 -1.542 -9.616 1.00 0.60 H new ATOM 0 HE2 LYS A 357 -10.954 -1.786 -11.147 1.00 0.79 H new ATOM 0 HE3 LYS A 357 -11.496 -1.998 -9.494 1.00 0.79 H new ATOM 0 HZ1 LYS A 357 -12.904 -0.543 -10.967 1.00 1.75 H new ATOM 0 HZ2 LYS A 357 -12.472 0.124 -9.467 1.00 1.75 H new ATOM 0 HZ3 LYS A 357 -11.670 0.620 -10.879 1.00 1.75 H new ATOM 837 N ARG A 358 -8.333 -0.776 -5.144 1.00 0.26 N ATOM 838 CA ARG A 358 -8.645 -1.823 -4.182 1.00 0.29 C ATOM 839 C ARG A 358 -7.367 -2.358 -3.565 1.00 0.28 C ATOM 840 O ARG A 358 -6.310 -2.333 -4.198 1.00 0.35 O ATOM 841 CB ARG A 358 -9.421 -2.960 -4.856 1.00 0.34 C ATOM 842 CG ARG A 358 -8.843 -3.391 -6.191 1.00 0.37 C ATOM 843 CD ARG A 358 -9.708 -4.449 -6.852 1.00 0.54 C ATOM 844 NE ARG A 358 -11.089 -3.996 -7.032 1.00 0.83 N ATOM 845 CZ ARG A 358 -11.844 -4.315 -8.081 1.00 1.19 C ATOM 846 NH1 ARG A 358 -11.327 -5.013 -9.085 1.00 1.46 N ATOM 847 NH2 ARG A 358 -13.107 -3.911 -8.137 1.00 1.75 N ATOM 0 H ARG A 358 -7.407 -0.857 -5.564 1.00 0.26 H new ATOM 0 HA ARG A 358 -9.269 -1.398 -3.396 1.00 0.29 H new ATOM 0 HB2 ARG A 358 -9.442 -3.819 -4.186 1.00 0.34 H new ATOM 0 HB3 ARG A 358 -10.454 -2.645 -5.003 1.00 0.34 H new ATOM 0 HG2 ARG A 358 -8.757 -2.526 -6.849 1.00 0.37 H new ATOM 0 HG3 ARG A 358 -7.836 -3.781 -6.044 1.00 0.37 H new ATOM 0 HD2 ARG A 358 -9.283 -4.711 -7.821 1.00 0.54 H new ATOM 0 HD3 ARG A 358 -9.700 -5.355 -6.245 1.00 0.54 H new ATOM 0 HE ARG A 358 -11.497 -3.401 -6.311 1.00 0.83 H new ATOM 0 HH11 ARG A 358 -10.350 -5.305 -9.053 1.00 1.46 H new ATOM 0 HH12 ARG A 358 -11.906 -5.257 -9.888 1.00 1.46 H new ATOM 0 HH21 ARG A 358 -13.499 -3.356 -7.376 1.00 1.75 H new ATOM 0 HH22 ARG A 358 -13.685 -4.155 -8.941 1.00 1.75 H new ATOM 861 N TRP A 359 -7.456 -2.821 -2.333 1.00 0.25 N ATOM 862 CA TRP A 359 -6.308 -3.408 -1.670 1.00 0.27 C ATOM 863 C TRP A 359 -6.682 -4.731 -1.019 1.00 0.28 C ATOM 864 O TRP A 359 -7.840 -4.955 -0.658 1.00 0.36 O ATOM 865 CB TRP A 359 -5.709 -2.442 -0.638 1.00 0.28 C ATOM 866 CG TRP A 359 -6.663 -1.990 0.430 1.00 0.27 C ATOM 867 CD1 TRP A 359 -6.967 -2.644 1.589 1.00 0.36 C ATOM 868 CD2 TRP A 359 -7.418 -0.773 0.445 1.00 0.25 C ATOM 869 NE1 TRP A 359 -7.866 -1.909 2.323 1.00 0.35 N ATOM 870 CE2 TRP A 359 -8.160 -0.758 1.642 1.00 0.29 C ATOM 871 CE3 TRP A 359 -7.543 0.304 -0.436 1.00 0.32 C ATOM 872 CZ2 TRP A 359 -9.010 0.291 1.977 1.00 0.33 C ATOM 873 CZ3 TRP A 359 -8.388 1.345 -0.101 1.00 0.40 C ATOM 874 CH2 TRP A 359 -9.111 1.332 1.097 1.00 0.39 C ATOM 0 H TRP A 359 -8.308 -2.802 -1.773 1.00 0.25 H new ATOM 0 HA TRP A 359 -5.547 -3.601 -2.426 1.00 0.27 H new ATOM 0 HB2 TRP A 359 -4.855 -2.925 -0.162 1.00 0.28 H new ATOM 0 HB3 TRP A 359 -5.329 -1.564 -1.161 1.00 0.28 H new ATOM 0 HD1 TRP A 359 -6.560 -3.600 1.886 1.00 0.36 H new ATOM 0 HE1 TRP A 359 -8.252 -2.177 3.228 1.00 0.35 H new ATOM 0 HE3 TRP A 359 -6.989 0.323 -1.363 1.00 0.32 H new ATOM 0 HZ2 TRP A 359 -9.571 0.283 2.900 1.00 0.33 H new ATOM 0 HZ3 TRP A 359 -8.492 2.182 -0.775 1.00 0.40 H new ATOM 0 HH2 TRP A 359 -9.762 2.161 1.331 1.00 0.39 H new ATOM 885 N ALA A 360 -5.700 -5.608 -0.896 1.00 0.25 N ATOM 886 CA ALA A 360 -5.904 -6.906 -0.283 1.00 0.27 C ATOM 887 C ALA A 360 -5.056 -7.037 0.967 1.00 0.25 C ATOM 888 O ALA A 360 -3.824 -7.055 0.901 1.00 0.31 O ATOM 889 CB ALA A 360 -5.593 -8.021 -1.270 1.00 0.31 C ATOM 0 H ALA A 360 -4.746 -5.441 -1.216 1.00 0.25 H new ATOM 0 HA ALA A 360 -6.952 -6.994 0.003 1.00 0.27 H new ATOM 0 HB1 ALA A 360 -5.752 -8.987 -0.790 1.00 0.31 H new ATOM 0 HB2 ALA A 360 -6.249 -7.934 -2.136 1.00 0.31 H new ATOM 0 HB3 ALA A 360 -4.555 -7.943 -1.592 1.00 0.31 H new ATOM 895 N ALA A 361 -5.727 -7.107 2.104 1.00 0.26 N ATOM 896 CA ALA A 361 -5.057 -7.199 3.385 1.00 0.27 C ATOM 897 C ALA A 361 -4.923 -8.650 3.827 1.00 0.25 C ATOM 898 O ALA A 361 -5.876 -9.249 4.328 1.00 0.38 O ATOM 899 CB ALA A 361 -5.813 -6.393 4.430 1.00 0.35 C ATOM 0 H ALA A 361 -6.745 -7.102 2.163 1.00 0.26 H new ATOM 0 HA ALA A 361 -4.054 -6.785 3.278 1.00 0.27 H new ATOM 0 HB1 ALA A 361 -5.301 -6.469 5.389 1.00 0.35 H new ATOM 0 HB2 ALA A 361 -5.855 -5.348 4.123 1.00 0.35 H new ATOM 0 HB3 ALA A 361 -6.826 -6.783 4.528 1.00 0.35 H new ATOM 905 N SER A 362 -3.747 -9.215 3.621 1.00 0.32 N ATOM 906 CA SER A 362 -3.470 -10.573 4.054 1.00 0.40 C ATOM 907 C SER A 362 -2.388 -10.558 5.136 1.00 0.42 C ATOM 908 O SER A 362 -1.575 -9.635 5.189 1.00 0.44 O ATOM 909 CB SER A 362 -3.026 -11.424 2.861 1.00 0.47 C ATOM 910 OG SER A 362 -3.938 -11.308 1.779 1.00 1.00 O ATOM 0 H SER A 362 -2.966 -8.753 3.155 1.00 0.32 H new ATOM 0 HA SER A 362 -4.377 -11.011 4.471 1.00 0.40 H new ATOM 0 HB2 SER A 362 -2.033 -11.112 2.538 1.00 0.47 H new ATOM 0 HB3 SER A 362 -2.949 -12.468 3.165 1.00 0.47 H new ATOM 0 HG SER A 362 -3.629 -11.860 1.030 1.00 1.00 H new ATOM 916 N PRO A 363 -2.370 -11.570 6.019 1.00 0.46 N ATOM 917 CA PRO A 363 -1.397 -11.646 7.118 1.00 0.48 C ATOM 918 C PRO A 363 0.022 -11.973 6.650 1.00 0.45 C ATOM 919 O PRO A 363 0.958 -11.986 7.450 1.00 0.66 O ATOM 920 CB PRO A 363 -1.939 -12.781 7.991 1.00 0.58 C ATOM 921 CG PRO A 363 -2.720 -13.639 7.057 1.00 0.60 C ATOM 922 CD PRO A 363 -3.308 -12.710 6.031 1.00 0.53 C ATOM 0 HA PRO A 363 -1.303 -10.689 7.630 1.00 0.48 H new ATOM 0 HB2 PRO A 363 -1.130 -13.341 8.459 1.00 0.58 H new ATOM 0 HB3 PRO A 363 -2.567 -12.397 8.794 1.00 0.58 H new ATOM 0 HG2 PRO A 363 -2.080 -14.385 6.586 1.00 0.60 H new ATOM 0 HG3 PRO A 363 -3.504 -14.180 7.588 1.00 0.60 H new ATOM 0 HD2 PRO A 363 -3.375 -13.184 5.052 1.00 0.53 H new ATOM 0 HD3 PRO A 363 -4.316 -12.397 6.304 1.00 0.53 H new ATOM 930 N LYS A 364 0.178 -12.253 5.362 1.00 0.44 N ATOM 931 CA LYS A 364 1.490 -12.573 4.811 1.00 0.44 C ATOM 932 C LYS A 364 1.900 -11.579 3.727 1.00 0.37 C ATOM 933 O LYS A 364 3.066 -11.206 3.631 1.00 0.40 O ATOM 934 CB LYS A 364 1.496 -13.995 4.239 1.00 0.56 C ATOM 935 CG LYS A 364 2.706 -14.298 3.368 1.00 0.72 C ATOM 936 CD LYS A 364 2.625 -15.686 2.762 1.00 0.98 C ATOM 937 CE LYS A 364 3.257 -15.717 1.381 1.00 1.26 C ATOM 938 NZ LYS A 364 2.523 -14.843 0.425 1.00 2.08 N ATOM 0 H LYS A 364 -0.583 -12.265 4.682 1.00 0.44 H new ATOM 0 HA LYS A 364 2.213 -12.507 5.624 1.00 0.44 H new ATOM 0 HB2 LYS A 364 1.464 -14.709 5.062 1.00 0.56 H new ATOM 0 HB3 LYS A 364 0.590 -14.145 3.652 1.00 0.56 H new ATOM 0 HG2 LYS A 364 2.777 -13.557 2.572 1.00 0.72 H new ATOM 0 HG3 LYS A 364 3.614 -14.213 3.964 1.00 0.72 H new ATOM 0 HD2 LYS A 364 3.130 -16.400 3.413 1.00 0.98 H new ATOM 0 HD3 LYS A 364 1.582 -15.997 2.695 1.00 0.98 H new ATOM 0 HE2 LYS A 364 4.296 -15.393 1.448 1.00 1.26 H new ATOM 0 HE3 LYS A 364 3.266 -16.741 1.007 1.00 1.26 H new ATOM 0 HZ1 LYS A 364 2.785 -15.097 -0.549 1.00 2.08 H new ATOM 0 HZ2 LYS A 364 1.499 -14.972 0.553 1.00 2.08 H new ATOM 0 HZ3 LYS A 364 2.772 -13.849 0.602 1.00 2.08 H new ATOM 952 N SER A 365 0.944 -11.132 2.931 1.00 0.35 N ATOM 953 CA SER A 365 1.246 -10.232 1.830 1.00 0.34 C ATOM 954 C SER A 365 0.158 -9.175 1.679 1.00 0.32 C ATOM 955 O SER A 365 -1.029 -9.463 1.823 1.00 0.52 O ATOM 956 CB SER A 365 1.402 -11.020 0.522 1.00 0.40 C ATOM 957 OG SER A 365 2.459 -11.969 0.603 1.00 1.32 O ATOM 0 H SER A 365 -0.042 -11.375 3.025 1.00 0.35 H new ATOM 0 HA SER A 365 2.187 -9.728 2.052 1.00 0.34 H new ATOM 0 HB2 SER A 365 0.468 -11.534 0.293 1.00 0.40 H new ATOM 0 HB3 SER A 365 1.595 -10.329 -0.298 1.00 0.40 H new ATOM 0 HG SER A 365 2.667 -12.304 -0.294 1.00 1.32 H new ATOM 963 N PHE A 366 0.574 -7.953 1.402 1.00 0.19 N ATOM 964 CA PHE A 366 -0.354 -6.861 1.172 1.00 0.16 C ATOM 965 C PHE A 366 -0.352 -6.510 -0.310 1.00 0.16 C ATOM 966 O PHE A 366 0.709 -6.364 -0.919 1.00 0.28 O ATOM 967 CB PHE A 366 0.037 -5.646 2.020 1.00 0.19 C ATOM 968 CG PHE A 366 -0.932 -4.503 1.929 1.00 0.20 C ATOM 969 CD1 PHE A 366 -2.179 -4.587 2.527 1.00 0.23 C ATOM 970 CD2 PHE A 366 -0.592 -3.344 1.253 1.00 0.25 C ATOM 971 CE1 PHE A 366 -3.070 -3.535 2.449 1.00 0.28 C ATOM 972 CE2 PHE A 366 -1.479 -2.290 1.173 1.00 0.29 C ATOM 973 CZ PHE A 366 -2.720 -2.384 1.771 1.00 0.30 C ATOM 0 H PHE A 366 1.557 -7.690 1.330 1.00 0.19 H new ATOM 0 HA PHE A 366 -1.359 -7.165 1.465 1.00 0.16 H new ATOM 0 HB2 PHE A 366 0.122 -5.955 3.062 1.00 0.19 H new ATOM 0 HB3 PHE A 366 1.022 -5.300 1.708 1.00 0.19 H new ATOM 0 HD1 PHE A 366 -2.457 -5.484 3.060 1.00 0.23 H new ATOM 0 HD2 PHE A 366 0.377 -3.264 0.783 1.00 0.25 H new ATOM 0 HE1 PHE A 366 -4.040 -3.612 2.918 1.00 0.28 H new ATOM 0 HE2 PHE A 366 -1.202 -1.391 0.642 1.00 0.29 H new ATOM 0 HZ PHE A 366 -3.415 -1.560 1.709 1.00 0.30 H new ATOM 983 N THR A 367 -1.534 -6.401 -0.894 1.00 0.17 N ATOM 984 CA THR A 367 -1.652 -6.169 -2.325 1.00 0.19 C ATOM 985 C THR A 367 -2.358 -4.848 -2.616 1.00 0.19 C ATOM 986 O THR A 367 -3.431 -4.580 -2.080 1.00 0.27 O ATOM 987 CB THR A 367 -2.430 -7.317 -2.993 1.00 0.26 C ATOM 988 OG1 THR A 367 -1.948 -8.575 -2.503 1.00 0.34 O ATOM 989 CG2 THR A 367 -2.281 -7.268 -4.509 1.00 0.32 C ATOM 0 H THR A 367 -2.424 -6.469 -0.401 1.00 0.17 H new ATOM 0 HA THR A 367 -0.643 -6.124 -2.734 1.00 0.19 H new ATOM 0 HB THR A 367 -3.486 -7.205 -2.747 1.00 0.26 H new ATOM 0 HG1 THR A 367 -2.446 -9.304 -2.928 1.00 0.34 H new ATOM 0 HG21 THR A 367 -2.840 -8.090 -4.956 1.00 0.32 H new ATOM 0 HG22 THR A 367 -2.668 -6.320 -4.882 1.00 0.32 H new ATOM 0 HG23 THR A 367 -1.228 -7.359 -4.774 1.00 0.32 H new ATOM 997 N LEU A 368 -1.747 -4.028 -3.458 1.00 0.20 N ATOM 998 CA LEU A 368 -2.357 -2.778 -3.891 1.00 0.22 C ATOM 999 C LEU A 368 -2.697 -2.826 -5.376 1.00 0.23 C ATOM 1000 O LEU A 368 -1.900 -3.298 -6.189 1.00 0.33 O ATOM 1001 CB LEU A 368 -1.421 -1.596 -3.616 1.00 0.24 C ATOM 1002 CG LEU A 368 -1.326 -1.159 -2.155 1.00 0.25 C ATOM 1003 CD1 LEU A 368 -0.251 -0.097 -1.984 1.00 0.29 C ATOM 1004 CD2 LEU A 368 -2.669 -0.633 -1.669 1.00 0.25 C ATOM 0 H LEU A 368 -0.825 -4.206 -3.857 1.00 0.20 H new ATOM 0 HA LEU A 368 -3.277 -2.643 -3.323 1.00 0.22 H new ATOM 0 HB2 LEU A 368 -0.422 -1.857 -3.965 1.00 0.24 H new ATOM 0 HB3 LEU A 368 -1.754 -0.745 -4.211 1.00 0.24 H new ATOM 0 HG LEU A 368 -1.054 -2.027 -1.554 1.00 0.25 H new ATOM 0 HD11 LEU A 368 -0.198 0.202 -0.937 1.00 0.29 H new ATOM 0 HD12 LEU A 368 0.712 -0.501 -2.295 1.00 0.29 H new ATOM 0 HD13 LEU A 368 -0.496 0.770 -2.597 1.00 0.29 H new ATOM 0 HD21 LEU A 368 -2.584 -0.326 -0.627 1.00 0.25 H new ATOM 0 HD22 LEU A 368 -2.966 0.222 -2.276 1.00 0.25 H new ATOM 0 HD23 LEU A 368 -3.420 -1.418 -1.756 1.00 0.25 H new ATOM 1016 N ASP A 369 -3.892 -2.356 -5.713 1.00 0.21 N ATOM 1017 CA ASP A 369 -4.310 -2.224 -7.106 1.00 0.24 C ATOM 1018 C ASP A 369 -4.688 -0.780 -7.398 1.00 0.21 C ATOM 1019 O ASP A 369 -5.435 -0.157 -6.636 1.00 0.22 O ATOM 1020 CB ASP A 369 -5.489 -3.149 -7.416 1.00 0.31 C ATOM 1021 CG ASP A 369 -6.064 -2.923 -8.806 1.00 0.99 C ATOM 1022 OD1 ASP A 369 -5.294 -2.566 -9.722 1.00 1.52 O ATOM 1023 OD2 ASP A 369 -7.286 -3.104 -8.992 1.00 1.47 O ATOM 0 H ASP A 369 -4.594 -2.058 -5.036 1.00 0.21 H new ATOM 0 HA ASP A 369 -3.475 -2.514 -7.744 1.00 0.24 H new ATOM 0 HB2 ASP A 369 -5.165 -4.186 -7.326 1.00 0.31 H new ATOM 0 HB3 ASP A 369 -6.272 -2.994 -6.674 1.00 0.31 H new ATOM 1028 N PHE A 370 -4.176 -0.254 -8.499 1.00 0.25 N ATOM 1029 CA PHE A 370 -4.387 1.140 -8.851 1.00 0.26 C ATOM 1030 C PHE A 370 -5.191 1.261 -10.141 1.00 0.31 C ATOM 1031 O PHE A 370 -5.364 2.356 -10.678 1.00 0.35 O ATOM 1032 CB PHE A 370 -3.039 1.852 -8.993 1.00 0.31 C ATOM 1033 CG PHE A 370 -2.194 1.769 -7.753 1.00 0.32 C ATOM 1034 CD1 PHE A 370 -2.396 2.646 -6.702 1.00 0.35 C ATOM 1035 CD2 PHE A 370 -1.204 0.805 -7.637 1.00 0.37 C ATOM 1036 CE1 PHE A 370 -1.627 2.566 -5.557 1.00 0.41 C ATOM 1037 CE2 PHE A 370 -0.431 0.721 -6.497 1.00 0.42 C ATOM 1038 CZ PHE A 370 -0.644 1.601 -5.455 1.00 0.44 C ATOM 0 H PHE A 370 -3.608 -0.775 -9.167 1.00 0.25 H new ATOM 0 HA PHE A 370 -4.958 1.615 -8.053 1.00 0.26 H new ATOM 0 HB2 PHE A 370 -2.491 1.416 -9.828 1.00 0.31 H new ATOM 0 HB3 PHE A 370 -3.213 2.900 -9.238 1.00 0.31 H new ATOM 0 HD1 PHE A 370 -3.164 3.402 -6.778 1.00 0.35 H new ATOM 0 HD2 PHE A 370 -1.036 0.112 -8.448 1.00 0.37 H new ATOM 0 HE1 PHE A 370 -1.794 3.256 -4.744 1.00 0.41 H new ATOM 0 HE2 PHE A 370 0.339 -0.032 -6.420 1.00 0.42 H new ATOM 0 HZ PHE A 370 -0.042 1.535 -4.561 1.00 0.44 H new ATOM 1048 N GLY A 371 -5.677 0.130 -10.636 1.00 0.40 N ATOM 1049 CA GLY A 371 -6.506 0.131 -11.827 1.00 0.50 C ATOM 1050 C GLY A 371 -5.769 0.621 -13.057 1.00 0.49 C ATOM 1051 O GLY A 371 -4.750 0.052 -13.449 1.00 0.58 O ATOM 0 H GLY A 371 -5.511 -0.792 -10.232 1.00 0.40 H new ATOM 0 HA2 GLY A 371 -6.874 -0.879 -12.008 1.00 0.50 H new ATOM 0 HA3 GLY A 371 -7.378 0.762 -11.656 1.00 0.50 H new ATOM 1055 N ASP A 372 -6.270 1.698 -13.651 1.00 0.49 N ATOM 1056 CA ASP A 372 -5.702 2.232 -14.884 1.00 0.56 C ATOM 1057 C ASP A 372 -4.664 3.308 -14.594 1.00 0.55 C ATOM 1058 O ASP A 372 -4.340 4.124 -15.458 1.00 0.72 O ATOM 1059 CB ASP A 372 -6.806 2.800 -15.780 1.00 0.71 C ATOM 1060 CG ASP A 372 -7.714 1.723 -16.334 1.00 1.57 C ATOM 1061 OD1 ASP A 372 -7.340 1.079 -17.337 1.00 1.89 O ATOM 1062 OD2 ASP A 372 -8.803 1.506 -15.763 1.00 2.38 O ATOM 0 H ASP A 372 -7.071 2.220 -13.297 1.00 0.49 H new ATOM 0 HA ASP A 372 -5.207 1.411 -15.404 1.00 0.56 H new ATOM 0 HB2 ASP A 372 -7.400 3.514 -15.210 1.00 0.71 H new ATOM 0 HB3 ASP A 372 -6.353 3.349 -16.606 1.00 0.71 H new ATOM 1067 N TYR A 373 -4.128 3.293 -13.381 1.00 0.52 N ATOM 1068 CA TYR A 373 -3.096 4.244 -12.994 1.00 0.51 C ATOM 1069 C TYR A 373 -1.722 3.716 -13.386 1.00 0.52 C ATOM 1070 O TYR A 373 -0.895 4.450 -13.920 1.00 0.60 O ATOM 1071 CB TYR A 373 -3.155 4.512 -11.489 1.00 0.50 C ATOM 1072 CG TYR A 373 -2.070 5.438 -10.988 1.00 0.51 C ATOM 1073 CD1 TYR A 373 -2.120 6.801 -11.247 1.00 0.56 C ATOM 1074 CD2 TYR A 373 -1.000 4.952 -10.249 1.00 0.56 C ATOM 1075 CE1 TYR A 373 -1.135 7.653 -10.785 1.00 0.64 C ATOM 1076 CE2 TYR A 373 -0.012 5.797 -9.784 1.00 0.64 C ATOM 1077 CZ TYR A 373 -0.083 7.146 -10.055 1.00 0.67 C ATOM 1078 OH TYR A 373 0.896 7.992 -9.587 1.00 0.79 O ATOM 0 H TYR A 373 -4.391 2.633 -12.649 1.00 0.52 H new ATOM 0 HA TYR A 373 -3.272 5.183 -13.519 1.00 0.51 H new ATOM 0 HB2 TYR A 373 -4.127 4.941 -11.244 1.00 0.50 H new ATOM 0 HB3 TYR A 373 -3.083 3.563 -10.958 1.00 0.50 H new ATOM 0 HD1 TYR A 373 -2.943 7.202 -11.820 1.00 0.56 H new ATOM 0 HD2 TYR A 373 -0.939 3.895 -10.034 1.00 0.56 H new ATOM 0 HE1 TYR A 373 -1.190 8.711 -10.995 1.00 0.64 H new ATOM 0 HE2 TYR A 373 0.813 5.402 -9.210 1.00 0.64 H new ATOM 0 HH TYR A 373 1.565 7.476 -9.090 1.00 0.79 H new ATOM 1088 N GLN A 374 -1.488 2.437 -13.130 1.00 0.53 N ATOM 1089 CA GLN A 374 -0.234 1.802 -13.507 1.00 0.59 C ATOM 1090 C GLN A 374 -0.463 0.329 -13.810 1.00 0.60 C ATOM 1091 O GLN A 374 -1.442 -0.261 -13.350 1.00 0.59 O ATOM 1092 CB GLN A 374 0.824 1.963 -12.408 1.00 0.63 C ATOM 1093 CG GLN A 374 0.485 1.271 -11.095 1.00 0.59 C ATOM 1094 CD GLN A 374 1.646 1.282 -10.114 1.00 0.69 C ATOM 1095 OE1 GLN A 374 2.483 2.306 -10.193 1.00 1.09 O flip ATOM 1096 NE2 GLN A 374 1.798 0.374 -9.298 1.00 0.85 N flip ATOM 0 H GLN A 374 -2.151 1.818 -12.662 1.00 0.53 H new ATOM 0 HA GLN A 374 0.139 2.296 -14.404 1.00 0.59 H new ATOM 0 HB2 GLN A 374 1.773 1.572 -12.775 1.00 0.63 H new ATOM 0 HB3 GLN A 374 0.971 3.026 -12.216 1.00 0.63 H new ATOM 0 HG2 GLN A 374 -0.375 1.763 -10.640 1.00 0.59 H new ATOM 0 HG3 GLN A 374 0.193 0.240 -11.296 1.00 0.59 H new ATOM 0 HE21 GLN A 374 1.133 -0.399 -9.266 1.00 0.85 H new ATOM 0 HE22 GLN A 374 2.589 0.394 -8.654 1.00 0.85 H new ATOM 1105 N ASP A 375 0.436 -0.255 -14.588 1.00 0.74 N ATOM 1106 CA ASP A 375 0.318 -1.655 -14.975 1.00 0.78 C ATOM 1107 C ASP A 375 0.836 -2.566 -13.869 1.00 0.64 C ATOM 1108 O ASP A 375 1.806 -2.238 -13.178 1.00 0.73 O ATOM 1109 CB ASP A 375 1.081 -1.924 -16.276 1.00 1.06 C ATOM 1110 CG ASP A 375 2.570 -1.678 -16.149 1.00 1.71 C ATOM 1111 OD1 ASP A 375 3.011 -0.530 -16.358 1.00 2.21 O ATOM 1112 OD2 ASP A 375 3.309 -2.632 -15.829 1.00 2.30 O ATOM 0 H ASP A 375 1.257 0.219 -14.965 1.00 0.74 H new ATOM 0 HA ASP A 375 -0.738 -1.870 -15.138 1.00 0.78 H new ATOM 0 HB2 ASP A 375 0.914 -2.957 -16.582 1.00 1.06 H new ATOM 0 HB3 ASP A 375 0.679 -1.288 -17.065 1.00 1.06 H new ATOM 1117 N GLY A 376 0.177 -3.705 -13.701 1.00 0.57 N ATOM 1118 CA GLY A 376 0.566 -4.656 -12.680 1.00 0.53 C ATOM 1119 C GLY A 376 0.049 -4.266 -11.310 1.00 0.52 C ATOM 1120 O GLY A 376 -0.449 -3.155 -11.120 1.00 0.70 O ATOM 0 H GLY A 376 -0.628 -3.988 -14.260 1.00 0.57 H new ATOM 0 HA2 GLY A 376 0.187 -5.644 -12.942 1.00 0.53 H new ATOM 0 HA3 GLY A 376 1.653 -4.730 -12.649 1.00 0.53 H new ATOM 1124 N TYR A 377 0.158 -5.176 -10.357 1.00 0.46 N ATOM 1125 CA TYR A 377 -0.236 -4.893 -8.987 1.00 0.46 C ATOM 1126 C TYR A 377 0.997 -4.596 -8.148 1.00 0.37 C ATOM 1127 O TYR A 377 2.123 -4.653 -8.643 1.00 0.38 O ATOM 1128 CB TYR A 377 -0.999 -6.075 -8.378 1.00 0.53 C ATOM 1129 CG TYR A 377 -2.296 -6.406 -9.080 1.00 0.63 C ATOM 1130 CD1 TYR A 377 -3.308 -5.463 -9.189 1.00 0.83 C ATOM 1131 CD2 TYR A 377 -2.513 -7.667 -9.618 1.00 0.64 C ATOM 1132 CE1 TYR A 377 -4.501 -5.767 -9.818 1.00 0.97 C ATOM 1133 CE2 TYR A 377 -3.702 -7.978 -10.251 1.00 0.76 C ATOM 1134 CZ TYR A 377 -4.693 -7.024 -10.347 1.00 0.91 C ATOM 1135 OH TYR A 377 -5.883 -7.332 -10.968 1.00 1.06 O ATOM 0 H TYR A 377 0.517 -6.119 -10.507 1.00 0.46 H new ATOM 0 HA TYR A 377 -0.895 -4.024 -8.994 1.00 0.46 H new ATOM 0 HB2 TYR A 377 -0.356 -6.955 -8.394 1.00 0.53 H new ATOM 0 HB3 TYR A 377 -1.212 -5.855 -7.332 1.00 0.53 H new ATOM 0 HD1 TYR A 377 -3.161 -4.476 -8.776 1.00 0.83 H new ATOM 0 HD2 TYR A 377 -1.740 -8.418 -9.541 1.00 0.64 H new ATOM 0 HE1 TYR A 377 -5.279 -5.022 -9.894 1.00 0.97 H new ATOM 0 HE2 TYR A 377 -3.854 -8.963 -10.668 1.00 0.76 H new ATOM 0 HH TYR A 377 -5.856 -8.258 -11.287 1.00 1.06 H new ATOM 1145 N TYR A 378 0.784 -4.278 -6.884 1.00 0.32 N ATOM 1146 CA TYR A 378 1.885 -4.050 -5.968 1.00 0.29 C ATOM 1147 C TYR A 378 1.779 -5.007 -4.788 1.00 0.24 C ATOM 1148 O TYR A 378 0.920 -4.849 -3.920 1.00 0.26 O ATOM 1149 CB TYR A 378 1.891 -2.593 -5.491 1.00 0.31 C ATOM 1150 CG TYR A 378 3.051 -2.250 -4.584 1.00 0.32 C ATOM 1151 CD1 TYR A 378 4.358 -2.538 -4.956 1.00 0.36 C ATOM 1152 CD2 TYR A 378 2.839 -1.634 -3.357 1.00 0.37 C ATOM 1153 CE1 TYR A 378 5.420 -2.225 -4.132 1.00 0.41 C ATOM 1154 CE2 TYR A 378 3.895 -1.317 -2.528 1.00 0.40 C ATOM 1155 CZ TYR A 378 5.184 -1.614 -2.918 1.00 0.41 C ATOM 1156 OH TYR A 378 6.239 -1.299 -2.092 1.00 0.47 O ATOM 0 H TYR A 378 -0.142 -4.172 -6.469 1.00 0.32 H new ATOM 0 HA TYR A 378 2.825 -4.238 -6.486 1.00 0.29 H new ATOM 0 HB2 TYR A 378 1.916 -1.936 -6.361 1.00 0.31 H new ATOM 0 HB3 TYR A 378 0.958 -2.389 -4.965 1.00 0.31 H new ATOM 0 HD1 TYR A 378 4.546 -3.015 -5.906 1.00 0.36 H new ATOM 0 HD2 TYR A 378 1.831 -1.400 -3.047 1.00 0.37 H new ATOM 0 HE1 TYR A 378 6.430 -2.457 -4.436 1.00 0.41 H new ATOM 0 HE2 TYR A 378 3.713 -0.838 -1.577 1.00 0.40 H new ATOM 0 HH TYR A 378 7.052 -1.186 -2.628 1.00 0.47 H new ATOM 1166 N SER A 379 2.633 -6.020 -4.789 1.00 0.26 N ATOM 1167 CA SER A 379 2.614 -7.042 -3.758 1.00 0.27 C ATOM 1168 C SER A 379 3.841 -6.931 -2.856 1.00 0.24 C ATOM 1169 O SER A 379 4.984 -7.003 -3.320 1.00 0.29 O ATOM 1170 CB SER A 379 2.551 -8.432 -4.403 1.00 0.36 C ATOM 1171 OG SER A 379 2.559 -9.461 -3.426 1.00 1.06 O ATOM 0 H SER A 379 3.352 -6.155 -5.499 1.00 0.26 H new ATOM 0 HA SER A 379 1.728 -6.894 -3.141 1.00 0.27 H new ATOM 0 HB2 SER A 379 1.649 -8.512 -5.009 1.00 0.36 H new ATOM 0 HB3 SER A 379 3.399 -8.561 -5.075 1.00 0.36 H new ATOM 0 HG SER A 379 2.516 -10.334 -3.870 1.00 1.06 H new ATOM 1177 N VAL A 380 3.594 -6.738 -1.567 1.00 0.22 N ATOM 1178 CA VAL A 380 4.659 -6.710 -0.577 1.00 0.24 C ATOM 1179 C VAL A 380 4.396 -7.747 0.504 1.00 0.23 C ATOM 1180 O VAL A 380 3.249 -7.978 0.884 1.00 0.30 O ATOM 1181 CB VAL A 380 4.809 -5.322 0.080 1.00 0.27 C ATOM 1182 CG1 VAL A 380 5.368 -4.321 -0.914 1.00 0.33 C ATOM 1183 CG2 VAL A 380 3.480 -4.833 0.637 1.00 0.29 C ATOM 0 H VAL A 380 2.660 -6.598 -1.183 1.00 0.22 H new ATOM 0 HA VAL A 380 5.587 -6.938 -1.101 1.00 0.24 H new ATOM 0 HB VAL A 380 5.509 -5.417 0.910 1.00 0.27 H new ATOM 0 HG11 VAL A 380 5.467 -3.348 -0.434 1.00 0.33 H new ATOM 0 HG12 VAL A 380 6.346 -4.657 -1.258 1.00 0.33 H new ATOM 0 HG13 VAL A 380 4.693 -4.238 -1.766 1.00 0.33 H new ATOM 0 HG21 VAL A 380 3.616 -3.853 1.094 1.00 0.29 H new ATOM 0 HG22 VAL A 380 2.752 -4.759 -0.171 1.00 0.29 H new ATOM 0 HG23 VAL A 380 3.119 -5.536 1.387 1.00 0.29 H new ATOM 1193 N GLN A 381 5.449 -8.383 0.985 1.00 0.22 N ATOM 1194 CA GLN A 381 5.308 -9.363 2.048 1.00 0.24 C ATOM 1195 C GLN A 381 5.416 -8.669 3.400 1.00 0.24 C ATOM 1196 O GLN A 381 6.351 -7.900 3.635 1.00 0.32 O ATOM 1197 CB GLN A 381 6.373 -10.452 1.924 1.00 0.34 C ATOM 1198 CG GLN A 381 6.161 -11.613 2.880 1.00 0.43 C ATOM 1199 CD GLN A 381 7.245 -12.665 2.786 1.00 0.72 C ATOM 1200 OE1 GLN A 381 7.844 -12.879 1.732 1.00 1.47 O ATOM 1201 NE2 GLN A 381 7.506 -13.331 3.892 1.00 0.94 N ATOM 0 H GLN A 381 6.405 -8.240 0.660 1.00 0.22 H new ATOM 0 HA GLN A 381 4.329 -9.836 1.964 1.00 0.24 H new ATOM 0 HB2 GLN A 381 6.379 -10.829 0.901 1.00 0.34 H new ATOM 0 HB3 GLN A 381 7.354 -10.014 2.108 1.00 0.34 H new ATOM 0 HG2 GLN A 381 6.120 -11.233 3.901 1.00 0.43 H new ATOM 0 HG3 GLN A 381 5.196 -12.075 2.673 1.00 0.43 H new ATOM 0 HE21 GLN A 381 6.988 -13.125 4.746 1.00 0.94 H new ATOM 0 HE22 GLN A 381 8.226 -14.053 3.895 1.00 0.94 H new ATOM 1210 N THR A 382 4.456 -8.932 4.274 1.00 0.21 N ATOM 1211 CA THR A 382 4.409 -8.296 5.579 1.00 0.26 C ATOM 1212 C THR A 382 3.343 -8.941 6.456 1.00 0.25 C ATOM 1213 O THR A 382 2.289 -9.357 5.974 1.00 0.30 O ATOM 1214 CB THR A 382 4.123 -6.780 5.471 1.00 0.30 C ATOM 1215 OG1 THR A 382 3.945 -6.223 6.778 1.00 0.42 O ATOM 1216 CG2 THR A 382 2.883 -6.507 4.628 1.00 0.28 C ATOM 0 H THR A 382 3.694 -9.587 4.099 1.00 0.21 H new ATOM 0 HA THR A 382 5.391 -8.433 6.032 1.00 0.26 H new ATOM 0 HB THR A 382 4.978 -6.312 4.983 1.00 0.30 H new ATOM 0 HG1 THR A 382 3.766 -5.262 6.703 1.00 0.42 H new ATOM 0 HG21 THR A 382 2.710 -5.432 4.572 1.00 0.28 H new ATOM 0 HG22 THR A 382 3.031 -6.903 3.623 1.00 0.28 H new ATOM 0 HG23 THR A 382 2.019 -6.990 5.085 1.00 0.28 H new ATOM 1224 N THR A 383 3.622 -9.017 7.748 1.00 0.31 N ATOM 1225 CA THR A 383 2.667 -9.543 8.708 1.00 0.37 C ATOM 1226 C THR A 383 1.783 -8.421 9.249 1.00 0.36 C ATOM 1227 O THR A 383 0.929 -8.639 10.113 1.00 0.46 O ATOM 1228 CB THR A 383 3.389 -10.240 9.875 1.00 0.50 C ATOM 1229 OG1 THR A 383 4.471 -9.418 10.339 1.00 0.55 O ATOM 1230 CG2 THR A 383 3.923 -11.600 9.452 1.00 0.55 C ATOM 0 H THR A 383 4.508 -8.719 8.157 1.00 0.31 H new ATOM 0 HA THR A 383 2.044 -10.275 8.194 1.00 0.37 H new ATOM 0 HB THR A 383 2.671 -10.388 10.681 1.00 0.50 H new ATOM 0 HG1 THR A 383 4.926 -9.865 11.083 1.00 0.55 H new ATOM 0 HG21 THR A 383 4.428 -12.071 10.295 1.00 0.55 H new ATOM 0 HG22 THR A 383 3.096 -12.231 9.127 1.00 0.55 H new ATOM 0 HG23 THR A 383 4.628 -11.475 8.630 1.00 0.55 H new ATOM 1238 N GLU A 384 1.991 -7.218 8.725 1.00 0.31 N ATOM 1239 CA GLU A 384 1.247 -6.043 9.160 1.00 0.35 C ATOM 1240 C GLU A 384 0.254 -5.611 8.087 1.00 0.28 C ATOM 1241 O GLU A 384 -0.258 -4.492 8.121 1.00 0.27 O ATOM 1242 CB GLU A 384 2.213 -4.898 9.467 1.00 0.46 C ATOM 1243 CG GLU A 384 3.260 -5.256 10.506 1.00 0.57 C ATOM 1244 CD GLU A 384 4.268 -4.150 10.727 1.00 0.90 C ATOM 1245 OE1 GLU A 384 5.208 -4.027 9.913 1.00 0.95 O ATOM 1246 OE2 GLU A 384 4.134 -3.407 11.722 1.00 1.39 O ATOM 0 H GLU A 384 2.675 -7.031 7.992 1.00 0.31 H new ATOM 0 HA GLU A 384 0.693 -6.298 10.064 1.00 0.35 H new ATOM 0 HB2 GLU A 384 2.713 -4.598 8.546 1.00 0.46 H new ATOM 0 HB3 GLU A 384 1.644 -4.036 9.817 1.00 0.46 H new ATOM 0 HG2 GLU A 384 2.765 -5.485 11.450 1.00 0.57 H new ATOM 0 HG3 GLU A 384 3.782 -6.160 10.193 1.00 0.57 H new ATOM 1253 N GLY A 385 -0.026 -6.519 7.152 1.00 0.27 N ATOM 1254 CA GLY A 385 -0.912 -6.220 6.037 1.00 0.27 C ATOM 1255 C GLY A 385 -2.256 -5.659 6.468 1.00 0.26 C ATOM 1256 O GLY A 385 -2.765 -4.718 5.857 1.00 0.27 O ATOM 0 H GLY A 385 0.350 -7.467 7.148 1.00 0.27 H new ATOM 0 HA2 GLY A 385 -0.423 -5.504 5.376 1.00 0.27 H new ATOM 0 HA3 GLY A 385 -1.075 -7.129 5.458 1.00 0.27 H new ATOM 1260 N GLU A 386 -2.823 -6.222 7.530 1.00 0.30 N ATOM 1261 CA GLU A 386 -4.110 -5.765 8.044 1.00 0.35 C ATOM 1262 C GLU A 386 -4.014 -4.323 8.531 1.00 0.31 C ATOM 1263 O GLU A 386 -4.874 -3.496 8.234 1.00 0.36 O ATOM 1264 CB GLU A 386 -4.575 -6.661 9.191 1.00 0.44 C ATOM 1265 CG GLU A 386 -5.913 -6.249 9.783 1.00 0.53 C ATOM 1266 CD GLU A 386 -6.249 -7.013 11.043 1.00 1.40 C ATOM 1267 OE1 GLU A 386 -6.704 -8.170 10.940 1.00 1.77 O ATOM 1268 OE2 GLU A 386 -6.061 -6.465 12.147 1.00 2.28 O ATOM 0 H GLU A 386 -2.412 -6.996 8.052 1.00 0.30 H new ATOM 0 HA GLU A 386 -4.835 -5.817 7.232 1.00 0.35 H new ATOM 0 HB2 GLU A 386 -4.647 -7.688 8.832 1.00 0.44 H new ATOM 0 HB3 GLU A 386 -3.821 -6.650 9.978 1.00 0.44 H new ATOM 0 HG2 GLU A 386 -5.896 -5.182 10.003 1.00 0.53 H new ATOM 0 HG3 GLU A 386 -6.698 -6.410 9.044 1.00 0.53 H new ATOM 1275 N GLN A 387 -2.946 -4.031 9.260 1.00 0.29 N ATOM 1276 CA GLN A 387 -2.756 -2.719 9.860 1.00 0.30 C ATOM 1277 C GLN A 387 -2.563 -1.655 8.788 1.00 0.27 C ATOM 1278 O GLN A 387 -3.057 -0.536 8.918 1.00 0.31 O ATOM 1279 CB GLN A 387 -1.560 -2.740 10.812 1.00 0.35 C ATOM 1280 CG GLN A 387 -1.718 -3.734 11.952 1.00 0.45 C ATOM 1281 CD GLN A 387 -0.554 -3.709 12.920 1.00 1.13 C ATOM 1282 OE1 GLN A 387 -0.557 -2.956 13.894 1.00 2.27 O ATOM 1283 NE2 GLN A 387 0.448 -4.535 12.665 1.00 0.83 N ATOM 0 H GLN A 387 -2.193 -4.691 9.451 1.00 0.29 H new ATOM 0 HA GLN A 387 -3.652 -2.470 10.428 1.00 0.30 H new ATOM 0 HB2 GLN A 387 -0.660 -2.984 10.248 1.00 0.35 H new ATOM 0 HB3 GLN A 387 -1.416 -1.742 11.226 1.00 0.35 H new ATOM 0 HG2 GLN A 387 -2.639 -3.516 12.493 1.00 0.45 H new ATOM 0 HG3 GLN A 387 -1.820 -4.738 11.540 1.00 0.45 H new ATOM 0 HE21 GLN A 387 0.412 -5.143 11.847 1.00 0.83 H new ATOM 0 HE22 GLN A 387 1.256 -4.563 13.287 1.00 0.83 H new ATOM 1292 N ILE A 388 -1.861 -2.018 7.721 1.00 0.24 N ATOM 1293 CA ILE A 388 -1.657 -1.112 6.598 1.00 0.23 C ATOM 1294 C ILE A 388 -2.997 -0.741 5.972 1.00 0.22 C ATOM 1295 O ILE A 388 -3.314 0.437 5.802 1.00 0.22 O ATOM 1296 CB ILE A 388 -0.752 -1.741 5.517 1.00 0.23 C ATOM 1297 CG1 ILE A 388 0.576 -2.197 6.126 1.00 0.27 C ATOM 1298 CG2 ILE A 388 -0.504 -0.747 4.390 1.00 0.24 C ATOM 1299 CD1 ILE A 388 1.476 -2.921 5.149 1.00 0.29 C ATOM 0 H ILE A 388 -1.424 -2.933 7.610 1.00 0.24 H new ATOM 0 HA ILE A 388 -1.166 -0.219 6.984 1.00 0.23 H new ATOM 0 HB ILE A 388 -1.261 -2.613 5.107 1.00 0.23 H new ATOM 0 HG12 ILE A 388 1.104 -1.327 6.517 1.00 0.27 H new ATOM 0 HG13 ILE A 388 0.371 -2.853 6.972 1.00 0.27 H new ATOM 0 HG21 ILE A 388 0.136 -1.205 3.635 1.00 0.24 H new ATOM 0 HG22 ILE A 388 -1.455 -0.465 3.937 1.00 0.24 H new ATOM 0 HG23 ILE A 388 -0.015 0.142 4.790 1.00 0.24 H new ATOM 0 HD11 ILE A 388 2.398 -3.214 5.652 1.00 0.29 H new ATOM 0 HD12 ILE A 388 0.968 -3.810 4.776 1.00 0.29 H new ATOM 0 HD13 ILE A 388 1.712 -2.261 4.314 1.00 0.29 H new ATOM 1311 N ALA A 389 -3.786 -1.762 5.656 1.00 0.22 N ATOM 1312 CA ALA A 389 -5.100 -1.570 5.056 1.00 0.24 C ATOM 1313 C ALA A 389 -6.013 -0.770 5.980 1.00 0.22 C ATOM 1314 O ALA A 389 -6.705 0.152 5.543 1.00 0.23 O ATOM 1315 CB ALA A 389 -5.726 -2.915 4.742 1.00 0.28 C ATOM 0 H ALA A 389 -3.535 -2.739 5.807 1.00 0.22 H new ATOM 0 HA ALA A 389 -4.975 -1.006 4.132 1.00 0.24 H new ATOM 0 HB1 ALA A 389 -6.708 -2.764 4.294 1.00 0.28 H new ATOM 0 HB2 ALA A 389 -5.089 -3.459 4.045 1.00 0.28 H new ATOM 0 HB3 ALA A 389 -5.832 -3.491 5.662 1.00 0.28 H new ATOM 1321 N GLN A 390 -5.997 -1.131 7.258 1.00 0.22 N ATOM 1322 CA GLN A 390 -6.798 -0.451 8.269 1.00 0.25 C ATOM 1323 C GLN A 390 -6.453 1.032 8.326 1.00 0.21 C ATOM 1324 O GLN A 390 -7.336 1.883 8.442 1.00 0.23 O ATOM 1325 CB GLN A 390 -6.558 -1.089 9.638 1.00 0.34 C ATOM 1326 CG GLN A 390 -7.316 -0.418 10.772 1.00 0.50 C ATOM 1327 CD GLN A 390 -6.968 -0.999 12.126 1.00 1.15 C ATOM 1328 OE1 GLN A 390 -6.050 -0.533 12.799 1.00 1.99 O ATOM 1329 NE2 GLN A 390 -7.698 -2.021 12.535 1.00 1.61 N ATOM 0 H GLN A 390 -5.432 -1.899 7.621 1.00 0.22 H new ATOM 0 HA GLN A 390 -7.849 -0.552 7.999 1.00 0.25 H new ATOM 0 HB2 GLN A 390 -6.845 -2.140 9.594 1.00 0.34 H new ATOM 0 HB3 GLN A 390 -5.491 -1.059 9.860 1.00 0.34 H new ATOM 0 HG2 GLN A 390 -7.095 0.649 10.771 1.00 0.50 H new ATOM 0 HG3 GLN A 390 -8.387 -0.522 10.600 1.00 0.50 H new ATOM 0 HE21 GLN A 390 -8.451 -2.378 11.947 1.00 1.61 H new ATOM 0 HE22 GLN A 390 -7.509 -2.453 13.439 1.00 1.61 H new ATOM 1338 N LEU A 391 -5.166 1.331 8.231 1.00 0.21 N ATOM 1339 CA LEU A 391 -4.690 2.699 8.330 1.00 0.22 C ATOM 1340 C LEU A 391 -5.078 3.501 7.089 1.00 0.20 C ATOM 1341 O LEU A 391 -5.495 4.654 7.198 1.00 0.22 O ATOM 1342 CB LEU A 391 -3.176 2.718 8.531 1.00 0.26 C ATOM 1343 CG LEU A 391 -2.592 4.072 8.923 1.00 0.27 C ATOM 1344 CD1 LEU A 391 -3.179 4.548 10.245 1.00 0.60 C ATOM 1345 CD2 LEU A 391 -1.079 3.986 9.009 1.00 0.63 C ATOM 0 H LEU A 391 -4.431 0.639 8.085 1.00 0.21 H new ATOM 0 HA LEU A 391 -5.162 3.166 9.194 1.00 0.22 H new ATOM 0 HB2 LEU A 391 -2.918 1.992 9.302 1.00 0.26 H new ATOM 0 HB3 LEU A 391 -2.698 2.387 7.609 1.00 0.26 H new ATOM 0 HG LEU A 391 -2.855 4.799 8.154 1.00 0.27 H new ATOM 0 HD11 LEU A 391 -2.750 5.515 10.507 1.00 0.60 H new ATOM 0 HD12 LEU A 391 -4.260 4.645 10.149 1.00 0.60 H new ATOM 0 HD13 LEU A 391 -2.948 3.825 11.027 1.00 0.60 H new ATOM 0 HD21 LEU A 391 -0.675 4.959 9.289 1.00 0.63 H new ATOM 0 HD22 LEU A 391 -0.799 3.246 9.759 1.00 0.63 H new ATOM 0 HD23 LEU A 391 -0.676 3.691 8.040 1.00 0.63 H new ATOM 1357 N ILE A 392 -4.953 2.885 5.913 1.00 0.18 N ATOM 1358 CA ILE A 392 -5.351 3.536 4.666 1.00 0.17 C ATOM 1359 C ILE A 392 -6.831 3.896 4.712 1.00 0.17 C ATOM 1360 O ILE A 392 -7.210 5.038 4.452 1.00 0.19 O ATOM 1361 CB ILE A 392 -5.082 2.647 3.427 1.00 0.17 C ATOM 1362 CG1 ILE A 392 -3.587 2.337 3.308 1.00 0.19 C ATOM 1363 CG2 ILE A 392 -5.587 3.330 2.156 1.00 0.19 C ATOM 1364 CD1 ILE A 392 -3.245 1.408 2.161 1.00 0.21 C ATOM 0 H ILE A 392 -4.582 1.942 5.799 1.00 0.18 H new ATOM 0 HA ILE A 392 -4.746 4.438 4.570 1.00 0.17 H new ATOM 0 HB ILE A 392 -5.623 1.709 3.552 1.00 0.17 H new ATOM 0 HG12 ILE A 392 -3.041 3.272 3.182 1.00 0.19 H new ATOM 0 HG13 ILE A 392 -3.243 1.890 4.241 1.00 0.19 H new ATOM 0 HG21 ILE A 392 -5.389 2.690 1.296 1.00 0.19 H new ATOM 0 HG22 ILE A 392 -6.660 3.505 2.239 1.00 0.19 H new ATOM 0 HG23 ILE A 392 -5.073 4.282 2.026 1.00 0.19 H new ATOM 0 HD11 ILE A 392 -2.169 1.235 2.141 1.00 0.21 H new ATOM 0 HD12 ILE A 392 -3.763 0.458 2.295 1.00 0.21 H new ATOM 0 HD13 ILE A 392 -3.557 1.861 1.220 1.00 0.21 H new ATOM 1376 N ALA A 393 -7.661 2.921 5.073 1.00 0.18 N ATOM 1377 CA ALA A 393 -9.096 3.140 5.195 1.00 0.21 C ATOM 1378 C ALA A 393 -9.394 4.196 6.258 1.00 0.23 C ATOM 1379 O ALA A 393 -10.375 4.934 6.158 1.00 0.29 O ATOM 1380 CB ALA A 393 -9.807 1.835 5.526 1.00 0.24 C ATOM 0 H ALA A 393 -7.361 1.970 5.286 1.00 0.18 H new ATOM 0 HA ALA A 393 -9.469 3.505 4.238 1.00 0.21 H new ATOM 0 HB1 ALA A 393 -10.878 2.016 5.614 1.00 0.24 H new ATOM 0 HB2 ALA A 393 -9.625 1.110 4.732 1.00 0.24 H new ATOM 0 HB3 ALA A 393 -9.427 1.443 6.469 1.00 0.24 H new ATOM 1386 N GLY A 394 -8.530 4.266 7.265 1.00 0.23 N ATOM 1387 CA GLY A 394 -8.685 5.249 8.320 1.00 0.27 C ATOM 1388 C GLY A 394 -8.417 6.664 7.841 1.00 0.28 C ATOM 1389 O GLY A 394 -9.142 7.591 8.201 1.00 0.35 O ATOM 0 H GLY A 394 -7.720 3.655 7.369 1.00 0.23 H new ATOM 0 HA2 GLY A 394 -9.697 5.190 8.721 1.00 0.27 H new ATOM 0 HA3 GLY A 394 -8.004 5.011 9.137 1.00 0.27 H new ATOM 1393 N TYR A 395 -7.373 6.836 7.039 1.00 0.27 N ATOM 1394 CA TYR A 395 -7.058 8.146 6.475 1.00 0.30 C ATOM 1395 C TYR A 395 -8.062 8.515 5.392 1.00 0.30 C ATOM 1396 O TYR A 395 -8.481 9.667 5.282 1.00 0.36 O ATOM 1397 CB TYR A 395 -5.635 8.173 5.912 1.00 0.31 C ATOM 1398 CG TYR A 395 -4.562 8.160 6.977 1.00 0.37 C ATOM 1399 CD1 TYR A 395 -4.607 9.052 8.041 1.00 0.48 C ATOM 1400 CD2 TYR A 395 -3.504 7.262 6.922 1.00 0.41 C ATOM 1401 CE1 TYR A 395 -3.632 9.052 9.016 1.00 0.58 C ATOM 1402 CE2 TYR A 395 -2.524 7.256 7.896 1.00 0.51 C ATOM 1403 CZ TYR A 395 -2.593 8.152 8.940 1.00 0.58 C ATOM 1404 OH TYR A 395 -1.620 8.144 9.918 1.00 0.70 O ATOM 0 H TYR A 395 -6.733 6.091 6.765 1.00 0.27 H new ATOM 0 HA TYR A 395 -7.121 8.882 7.276 1.00 0.30 H new ATOM 0 HB2 TYR A 395 -5.496 7.313 5.257 1.00 0.31 H new ATOM 0 HB3 TYR A 395 -5.514 9.064 5.297 1.00 0.31 H new ATOM 0 HD1 TYR A 395 -5.421 9.759 8.106 1.00 0.48 H new ATOM 0 HD2 TYR A 395 -3.446 6.558 6.105 1.00 0.41 H new ATOM 0 HE1 TYR A 395 -3.683 9.754 9.835 1.00 0.58 H new ATOM 0 HE2 TYR A 395 -1.707 6.552 7.839 1.00 0.51 H new ATOM 0 HH TYR A 395 -0.951 7.459 9.708 1.00 0.70 H new ATOM 1414 N ILE A 396 -8.455 7.521 4.607 1.00 0.27 N ATOM 1415 CA ILE A 396 -9.484 7.696 3.591 1.00 0.31 C ATOM 1416 C ILE A 396 -10.792 8.158 4.228 1.00 0.37 C ATOM 1417 O ILE A 396 -11.490 9.016 3.687 1.00 0.45 O ATOM 1418 CB ILE A 396 -9.700 6.381 2.808 1.00 0.33 C ATOM 1419 CG1 ILE A 396 -8.556 6.171 1.814 1.00 0.34 C ATOM 1420 CG2 ILE A 396 -11.049 6.364 2.101 1.00 0.38 C ATOM 1421 CD1 ILE A 396 -8.621 4.853 1.078 1.00 0.42 C ATOM 0 H ILE A 396 -8.073 6.577 4.656 1.00 0.27 H new ATOM 0 HA ILE A 396 -9.151 8.463 2.892 1.00 0.31 H new ATOM 0 HB ILE A 396 -9.702 5.556 3.521 1.00 0.33 H new ATOM 0 HG12 ILE A 396 -8.565 6.983 1.087 1.00 0.34 H new ATOM 0 HG13 ILE A 396 -7.608 6.232 2.348 1.00 0.34 H new ATOM 0 HG21 ILE A 396 -11.165 5.424 1.561 1.00 0.38 H new ATOM 0 HG22 ILE A 396 -11.847 6.461 2.837 1.00 0.38 H new ATOM 0 HG23 ILE A 396 -11.102 7.195 1.398 1.00 0.38 H new ATOM 0 HD11 ILE A 396 -7.777 4.777 0.392 1.00 0.42 H new ATOM 0 HD12 ILE A 396 -8.580 4.033 1.795 1.00 0.42 H new ATOM 0 HD13 ILE A 396 -9.553 4.796 0.515 1.00 0.42 H new ATOM 1433 N ASP A 397 -11.098 7.603 5.396 1.00 0.38 N ATOM 1434 CA ASP A 397 -12.299 7.968 6.141 1.00 0.47 C ATOM 1435 C ASP A 397 -12.302 9.451 6.499 1.00 0.51 C ATOM 1436 O ASP A 397 -13.356 10.082 6.545 1.00 0.63 O ATOM 1437 CB ASP A 397 -12.405 7.123 7.410 1.00 0.52 C ATOM 1438 CG ASP A 397 -13.541 7.559 8.311 1.00 0.69 C ATOM 1439 OD1 ASP A 397 -14.710 7.287 7.968 1.00 0.73 O ATOM 1440 OD2 ASP A 397 -13.270 8.182 9.358 1.00 0.99 O ATOM 0 H ASP A 397 -10.525 6.892 5.851 1.00 0.38 H new ATOM 0 HA ASP A 397 -13.162 7.774 5.504 1.00 0.47 H new ATOM 0 HB2 ASP A 397 -12.546 6.078 7.135 1.00 0.52 H new ATOM 0 HB3 ASP A 397 -11.466 7.183 7.961 1.00 0.52 H new ATOM 1445 N ILE A 398 -11.118 10.003 6.739 1.00 0.47 N ATOM 1446 CA ILE A 398 -10.987 11.417 7.072 1.00 0.53 C ATOM 1447 C ILE A 398 -11.320 12.288 5.863 1.00 0.55 C ATOM 1448 O ILE A 398 -11.951 13.337 5.993 1.00 0.65 O ATOM 1449 CB ILE A 398 -9.563 11.751 7.570 1.00 0.54 C ATOM 1450 CG1 ILE A 398 -9.226 10.918 8.811 1.00 0.57 C ATOM 1451 CG2 ILE A 398 -9.429 13.238 7.877 1.00 0.62 C ATOM 1452 CD1 ILE A 398 -7.843 11.186 9.368 1.00 0.81 C ATOM 0 H ILE A 398 -10.235 9.493 6.709 1.00 0.47 H new ATOM 0 HA ILE A 398 -11.693 11.627 7.875 1.00 0.53 H new ATOM 0 HB ILE A 398 -8.857 11.503 6.777 1.00 0.54 H new ATOM 0 HG12 ILE A 398 -9.965 11.121 9.586 1.00 0.57 H new ATOM 0 HG13 ILE A 398 -9.309 9.860 8.561 1.00 0.57 H new ATOM 0 HG21 ILE A 398 -8.418 13.448 8.226 1.00 0.62 H new ATOM 0 HG22 ILE A 398 -9.629 13.815 6.974 1.00 0.62 H new ATOM 0 HG23 ILE A 398 -10.145 13.516 8.651 1.00 0.62 H new ATOM 0 HD11 ILE A 398 -7.676 10.560 10.245 1.00 0.81 H new ATOM 0 HD12 ILE A 398 -7.094 10.955 8.610 1.00 0.81 H new ATOM 0 HD13 ILE A 398 -7.762 12.236 9.651 1.00 0.81 H new ATOM 1464 N ILE A 399 -10.899 11.839 4.686 1.00 0.50 N ATOM 1465 CA ILE A 399 -11.165 12.566 3.451 1.00 0.52 C ATOM 1466 C ILE A 399 -12.641 12.449 3.076 1.00 0.59 C ATOM 1467 O ILE A 399 -13.219 13.356 2.476 1.00 0.72 O ATOM 1468 CB ILE A 399 -10.295 12.047 2.284 1.00 0.47 C ATOM 1469 CG1 ILE A 399 -8.822 11.987 2.704 1.00 0.47 C ATOM 1470 CG2 ILE A 399 -10.460 12.940 1.059 1.00 0.50 C ATOM 1471 CD1 ILE A 399 -7.907 11.403 1.648 1.00 0.48 C ATOM 0 H ILE A 399 -10.372 10.975 4.561 1.00 0.50 H new ATOM 0 HA ILE A 399 -10.912 13.611 3.627 1.00 0.52 H new ATOM 0 HB ILE A 399 -10.625 11.041 2.026 1.00 0.47 H new ATOM 0 HG12 ILE A 399 -8.483 12.994 2.949 1.00 0.47 H new ATOM 0 HG13 ILE A 399 -8.737 11.392 3.614 1.00 0.47 H new ATOM 0 HG21 ILE A 399 -9.841 12.561 0.246 1.00 0.50 H new ATOM 0 HG22 ILE A 399 -11.505 12.942 0.748 1.00 0.50 H new ATOM 0 HG23 ILE A 399 -10.153 13.956 1.306 1.00 0.50 H new ATOM 0 HD11 ILE A 399 -6.882 11.394 2.019 1.00 0.48 H new ATOM 0 HD12 ILE A 399 -8.219 10.384 1.419 1.00 0.48 H new ATOM 0 HD13 ILE A 399 -7.960 12.010 0.744 1.00 0.48 H new ATOM 1603 N TRP B 374 -10.549 -8.247 0.283 1.00 1.08 N ATOM 1604 CA TRP B 374 -10.575 -7.232 -0.757 1.00 0.61 C ATOM 1605 C TRP B 374 -11.418 -6.052 -0.320 1.00 0.55 C ATOM 1606 O TRP B 374 -12.636 -6.156 -0.180 1.00 0.90 O ATOM 1607 CB TRP B 374 -11.107 -7.807 -2.072 1.00 0.88 C ATOM 1608 CG TRP B 374 -10.161 -8.769 -2.723 1.00 0.97 C ATOM 1609 CD1 TRP B 374 -10.140 -10.126 -2.578 1.00 1.38 C ATOM 1610 CD2 TRP B 374 -9.087 -8.443 -3.616 1.00 0.81 C ATOM 1611 NE1 TRP B 374 -9.127 -10.665 -3.331 1.00 1.42 N ATOM 1612 CE2 TRP B 374 -8.465 -9.653 -3.977 1.00 1.02 C ATOM 1613 CE3 TRP B 374 -8.594 -7.247 -4.149 1.00 0.85 C ATOM 1614 CZ2 TRP B 374 -7.375 -9.700 -4.844 1.00 0.98 C ATOM 1615 CZ3 TRP B 374 -7.513 -7.295 -5.008 1.00 0.97 C ATOM 1616 CH2 TRP B 374 -6.915 -8.515 -5.349 1.00 0.88 C ATOM 0 HA TRP B 374 -9.553 -6.892 -0.924 1.00 0.61 H new ATOM 0 HB2 TRP B 374 -12.055 -8.311 -1.883 1.00 0.88 H new ATOM 0 HB3 TRP B 374 -11.314 -6.988 -2.761 1.00 0.88 H new ATOM 0 HD1 TRP B 374 -10.821 -10.693 -1.961 1.00 1.38 H new ATOM 0 HE1 TRP B 374 -8.903 -11.658 -3.399 1.00 1.42 H new ATOM 0 HE3 TRP B 374 -9.051 -6.302 -3.893 1.00 0.85 H new ATOM 0 HZ2 TRP B 374 -6.910 -10.638 -5.108 1.00 0.98 H new ATOM 0 HZ3 TRP B 374 -7.123 -6.377 -5.423 1.00 0.97 H new ATOM 0 HH2 TRP B 374 -6.073 -8.520 -6.025 1.00 0.88 H new ATOM 1627 N VAL B 375 -10.756 -4.937 -0.088 1.00 0.40 N ATOM 1628 CA VAL B 375 -11.428 -3.722 0.332 1.00 0.38 C ATOM 1629 C VAL B 375 -11.295 -2.678 -0.766 1.00 0.44 C ATOM 1630 O VAL B 375 -10.190 -2.411 -1.245 1.00 0.53 O ATOM 1631 CB VAL B 375 -10.851 -3.170 1.657 1.00 0.48 C ATOM 1632 CG1 VAL B 375 -11.672 -1.979 2.145 1.00 0.84 C ATOM 1633 CG2 VAL B 375 -10.800 -4.258 2.727 1.00 1.07 C ATOM 0 H VAL B 375 -9.745 -4.846 -0.184 1.00 0.40 H new ATOM 0 HA VAL B 375 -12.478 -3.956 0.508 1.00 0.38 H new ATOM 0 HB VAL B 375 -9.832 -2.834 1.467 1.00 0.48 H new ATOM 0 HG11 VAL B 375 -11.251 -1.605 3.078 1.00 0.84 H new ATOM 0 HG12 VAL B 375 -11.649 -1.189 1.394 1.00 0.84 H new ATOM 0 HG13 VAL B 375 -12.703 -2.292 2.312 1.00 0.84 H new ATOM 0 HG21 VAL B 375 -10.390 -3.843 3.648 1.00 1.07 H new ATOM 0 HG22 VAL B 375 -11.807 -4.632 2.914 1.00 1.07 H new ATOM 0 HG23 VAL B 375 -10.166 -5.076 2.384 1.00 1.07 H new ATOM 1643 N GLU B 376 -12.413 -2.109 -1.189 1.00 0.51 N ATOM 1644 CA GLU B 376 -12.409 -1.209 -2.324 1.00 0.63 C ATOM 1645 C GLU B 376 -12.485 0.247 -1.884 1.00 0.52 C ATOM 1646 O GLU B 376 -13.183 0.596 -0.932 1.00 0.61 O ATOM 1647 CB GLU B 376 -13.551 -1.564 -3.280 1.00 0.86 C ATOM 1648 CG GLU B 376 -13.490 -0.850 -4.622 1.00 1.43 C ATOM 1649 CD GLU B 376 -14.505 -1.388 -5.606 1.00 1.69 C ATOM 1650 OE1 GLU B 376 -14.218 -2.414 -6.255 1.00 2.06 O ATOM 1651 OE2 GLU B 376 -15.594 -0.785 -5.735 1.00 2.28 O ATOM 0 H GLU B 376 -13.329 -2.255 -0.764 1.00 0.51 H new ATOM 0 HA GLU B 376 -11.464 -1.331 -2.854 1.00 0.63 H new ATOM 0 HB2 GLU B 376 -13.542 -2.640 -3.454 1.00 0.86 H new ATOM 0 HB3 GLU B 376 -14.499 -1.326 -2.798 1.00 0.86 H new ATOM 0 HG2 GLU B 376 -13.662 0.216 -4.472 1.00 1.43 H new ATOM 0 HG3 GLU B 376 -12.490 -0.955 -5.042 1.00 1.43 H new ATOM 1658 N ASN B 377 -11.755 1.081 -2.601 1.00 0.54 N ATOM 1659 CA ASN B 377 -11.625 2.498 -2.267 1.00 0.58 C ATOM 1660 C ASN B 377 -12.723 3.316 -2.940 1.00 0.50 C ATOM 1661 O ASN B 377 -13.048 3.093 -4.108 1.00 0.65 O ATOM 1662 CB ASN B 377 -10.238 3.009 -2.679 1.00 0.83 C ATOM 1663 CG ASN B 377 -10.015 4.476 -2.395 1.00 0.88 C ATOM 1664 OD1 ASN B 377 -10.597 5.044 -1.474 1.00 1.83 O ATOM 1665 ND2 ASN B 377 -9.166 5.093 -3.203 1.00 1.23 N ATOM 0 H ASN B 377 -11.234 0.801 -3.432 1.00 0.54 H new ATOM 0 HA ASN B 377 -11.734 2.613 -1.189 1.00 0.58 H new ATOM 0 HB2 ASN B 377 -9.478 2.428 -2.156 1.00 0.83 H new ATOM 0 HB3 ASN B 377 -10.098 2.830 -3.745 1.00 0.83 H new ATOM 0 HD21 ASN B 377 -8.970 6.086 -3.075 1.00 1.23 H new ATOM 0 HD22 ASN B 377 -8.708 4.575 -3.953 1.00 1.23 H new ATOM 1672 N GLU B 378 -13.297 4.263 -2.203 1.00 0.43 N ATOM 1673 CA GLU B 378 -14.414 5.037 -2.714 1.00 0.51 C ATOM 1674 C GLU B 378 -13.973 6.403 -3.202 1.00 0.44 C ATOM 1675 O GLU B 378 -14.803 7.263 -3.492 1.00 0.53 O ATOM 1676 CB GLU B 378 -15.504 5.204 -1.649 1.00 0.71 C ATOM 1677 CG GLU B 378 -15.942 3.907 -0.987 1.00 0.87 C ATOM 1678 CD GLU B 378 -17.031 4.128 0.044 1.00 1.05 C ATOM 1679 OE1 GLU B 378 -16.747 4.734 1.099 1.00 1.39 O ATOM 1680 OE2 GLU B 378 -18.183 3.711 -0.199 1.00 1.88 O ATOM 0 H GLU B 378 -13.006 4.509 -1.257 1.00 0.43 H new ATOM 0 HA GLU B 378 -14.821 4.481 -3.559 1.00 0.51 H new ATOM 0 HB2 GLU B 378 -15.141 5.886 -0.880 1.00 0.71 H new ATOM 0 HB3 GLU B 378 -16.373 5.675 -2.108 1.00 0.71 H new ATOM 0 HG2 GLU B 378 -16.301 3.216 -1.749 1.00 0.87 H new ATOM 0 HG3 GLU B 378 -15.082 3.437 -0.510 1.00 0.87 H new ATOM 1687 N ILE B 379 -12.675 6.603 -3.305 1.00 0.36 N ATOM 1688 CA ILE B 379 -12.165 7.864 -3.841 1.00 0.38 C ATOM 1689 C ILE B 379 -11.230 7.640 -5.020 1.00 0.48 C ATOM 1690 O ILE B 379 -10.385 8.485 -5.318 1.00 1.17 O ATOM 1691 CB ILE B 379 -11.439 8.744 -2.791 1.00 0.38 C ATOM 1692 CG1 ILE B 379 -10.330 7.960 -2.072 1.00 0.37 C ATOM 1693 CG2 ILE B 379 -12.428 9.317 -1.773 1.00 0.43 C ATOM 1694 CD1 ILE B 379 -9.504 8.783 -1.088 1.00 0.44 C ATOM 0 H ILE B 379 -11.960 5.928 -3.033 1.00 0.36 H new ATOM 0 HA ILE B 379 -13.056 8.401 -4.167 1.00 0.38 H new ATOM 0 HB ILE B 379 -10.977 9.572 -3.328 1.00 0.38 H new ATOM 0 HG12 ILE B 379 -10.782 7.125 -1.537 1.00 0.37 H new ATOM 0 HG13 ILE B 379 -9.661 7.534 -2.820 1.00 0.37 H new ATOM 0 HG21 ILE B 379 -11.891 9.930 -1.049 1.00 0.43 H new ATOM 0 HG22 ILE B 379 -13.167 9.929 -2.289 1.00 0.43 H new ATOM 0 HG23 ILE B 379 -12.931 8.500 -1.255 1.00 0.43 H new ATOM 0 HD11 ILE B 379 -8.747 8.148 -0.629 1.00 0.44 H new ATOM 0 HD12 ILE B 379 -9.018 9.603 -1.617 1.00 0.44 H new ATOM 0 HD13 ILE B 379 -10.157 9.187 -0.314 1.00 0.44 H new ATOM 1706 N TYR B 380 -11.393 6.521 -5.706 1.00 0.45 N ATOM 1707 CA TYR B 380 -10.626 6.275 -6.918 1.00 0.42 C ATOM 1708 C TYR B 380 -11.208 7.101 -8.059 1.00 0.46 C ATOM 1709 O TYR B 380 -12.220 6.728 -8.657 1.00 0.58 O ATOM 1710 CB TYR B 380 -10.614 4.788 -7.281 1.00 0.48 C ATOM 1711 CG TYR B 380 -9.773 4.482 -8.501 1.00 0.45 C ATOM 1712 CD1 TYR B 380 -8.402 4.708 -8.502 1.00 0.49 C ATOM 1713 CD2 TYR B 380 -10.352 3.955 -9.645 1.00 0.54 C ATOM 1714 CE1 TYR B 380 -7.635 4.420 -9.614 1.00 0.51 C ATOM 1715 CE2 TYR B 380 -9.592 3.664 -10.758 1.00 0.54 C ATOM 1716 CZ TYR B 380 -8.221 3.941 -10.739 1.00 0.47 C ATOM 1717 OH TYR B 380 -7.482 3.609 -11.850 1.00 0.52 O ATOM 0 H TYR B 380 -12.041 5.776 -5.450 1.00 0.45 H new ATOM 0 HA TYR B 380 -9.593 6.574 -6.743 1.00 0.42 H new ATOM 0 HB2 TYR B 380 -10.236 4.216 -6.434 1.00 0.48 H new ATOM 0 HB3 TYR B 380 -11.637 4.455 -7.459 1.00 0.48 H new ATOM 0 HD1 TYR B 380 -7.929 5.115 -7.620 1.00 0.49 H new ATOM 0 HD2 TYR B 380 -11.416 3.769 -9.665 1.00 0.54 H new ATOM 0 HE1 TYR B 380 -6.567 4.577 -9.587 1.00 0.51 H new ATOM 0 HE2 TYR B 380 -10.050 3.228 -11.634 1.00 0.54 H new ATOM 0 HH TYR B 380 -6.667 3.140 -11.573 1.00 0.52 H new ATOM 1727 N TYR B 381 -10.589 8.242 -8.323 1.00 0.55 N ATOM 1728 CA TYR B 381 -11.077 9.169 -9.313 1.00 0.70 C ATOM 1729 C TYR B 381 -10.778 8.692 -10.745 1.00 0.79 C ATOM 1730 O TYR B 381 -9.783 9.133 -11.352 1.00 1.31 O ATOM 1731 CB TYR B 381 -10.506 10.579 -9.021 1.00 1.01 C ATOM 1732 CG TYR B 381 -8.986 10.718 -8.918 1.00 1.28 C ATOM 1733 CD1 TYR B 381 -8.177 9.630 -9.220 1.00 1.73 C ATOM 1734 CD2 TYR B 381 -8.361 11.894 -8.507 1.00 1.66 C ATOM 1735 CE1 TYR B 381 -6.802 9.706 -9.120 1.00 2.35 C ATOM 1736 CE2 TYR B 381 -6.988 11.975 -8.398 1.00 2.20 C ATOM 1737 CZ TYR B 381 -6.227 11.062 -8.754 1.00 2.50 C ATOM 1738 OH TYR B 381 -4.844 10.957 -8.579 1.00 3.20 O ATOM 1739 OXT TYR B 381 -11.561 7.867 -11.263 1.00 1.47 O ATOM 0 H TYR B 381 -9.736 8.544 -7.853 1.00 0.55 H new ATOM 0 HA TYR B 381 -12.164 9.221 -9.246 1.00 0.70 H new ATOM 0 HB2 TYR B 381 -10.853 11.251 -9.806 1.00 1.01 H new ATOM 0 HB3 TYR B 381 -10.940 10.930 -8.085 1.00 1.01 H new ATOM 0 HD1 TYR B 381 -8.633 8.705 -9.540 1.00 1.73 H new ATOM 0 HD2 TYR B 381 -8.963 12.759 -8.269 1.00 1.66 H new ATOM 0 HE1 TYR B 381 -6.170 8.847 -9.293 1.00 2.35 H new ATOM 0 HE2 TYR B 381 -6.556 12.874 -7.984 1.00 2.20 H new ATOM 0 HH TYR B 381 -4.655 10.480 -7.744 1.00 3.20 H new