USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 649 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 358 GLN :FLIP amide:sc= -3.81 F(o=-7.2!,f=-5.2) USER MOD Set 1.2: A 393 LYS NZ :NH3+ -151:sc= -1.43 (180deg=-1.44) USER MOD Set 2.1: A 326 ASN : amide:sc= -0.723 K(o=-0.83,f=-2) USER MOD Set 2.2: A 339 SER OG : rot 120:sc= -0.108 USER MOD Single : A 317 HIS : no HD1:sc= -0.435 X(o=-0.43,f=-0.23) USER MOD Single : A 350 SER OG : rot 86:sc= 0.601 USER MOD Single : A 355 LYS NZ :NH3+ 179:sc= 1.27 (180deg=1.24) USER MOD Single : A 361 SER OG : rot 180:sc= -0.426 USER MOD Single : A 363 ASN :FLIP amide:sc= -2.97! C(o=-4.5!,f=-3!) USER MOD Single : A 369 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 371 SER OG : rot -160:sc= 0.219 USER MOD Single : A 372 HIS : no HD1:sc= -0.475 K(o=-0.47,f=-1.2) USER MOD Single : A 374 GLN : amide:sc= -0.25 X(o=-0.25,f=-0.25) USER MOD Single : A 380 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 381 ASN : amide:sc= -0.366 X(o=-0.37,f=-0.47) USER MOD Single : A 384 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 385 THR OG1 : rot 180:sc= -0.206 USER MOD Single : A 387 THR OG1 : rot 37:sc= 1.1 USER MOD Single : A 391 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot 66:sc= 0.00299 USER MOD Single : A 398 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 161 N PRO A 311 4.777 9.467 4.290 1.00 23.33 N ATOM 162 CA PRO A 311 5.264 10.541 3.419 1.00 11.24 C ATOM 163 C PRO A 311 4.232 11.649 3.233 1.00 75.02 C ATOM 164 O PRO A 311 3.030 11.390 3.193 1.00 3.11 O ATOM 165 CB PRO A 311 5.528 9.828 2.091 1.00 13.14 C ATOM 166 CG PRO A 311 4.624 8.645 2.110 1.00 53.03 C ATOM 167 CD PRO A 311 4.528 8.220 3.549 1.00 40.00 C ATOM 0 HA PRO A 311 6.142 11.037 3.834 1.00 11.24 H new ATOM 0 HB2 PRO A 311 5.312 10.478 1.243 1.00 13.14 H new ATOM 0 HB3 PRO A 311 6.572 9.527 2.004 1.00 13.14 H new ATOM 0 HG2 PRO A 311 3.642 8.898 1.712 1.00 53.03 H new ATOM 0 HG3 PRO A 311 5.021 7.840 1.491 1.00 53.03 H new ATOM 0 HD2 PRO A 311 3.548 7.804 3.781 1.00 40.00 H new ATOM 0 HD3 PRO A 311 5.265 7.454 3.792 1.00 40.00 H new ATOM 175 N ARG A 312 4.711 12.884 3.120 1.00 61.33 N ATOM 176 CA ARG A 312 3.829 14.031 2.939 1.00 65.13 C ATOM 177 C ARG A 312 4.532 15.139 2.160 1.00 34.14 C ATOM 178 O ARG A 312 5.703 15.434 2.400 1.00 42.20 O ATOM 179 CB ARG A 312 3.364 14.563 4.296 1.00 62.32 C ATOM 180 CG ARG A 312 4.394 15.438 4.992 1.00 71.50 C ATOM 181 CD ARG A 312 5.640 14.647 5.359 1.00 52.51 C ATOM 182 NE ARG A 312 6.345 15.233 6.496 1.00 34.31 N ATOM 183 CZ ARG A 312 7.196 14.558 7.260 1.00 20.31 C ATOM 184 NH1 ARG A 312 7.447 13.281 7.010 1.00 13.53 N1+ ATOM 185 NH2 ARG A 312 7.799 15.162 8.276 1.00 35.04 N ATOM 0 H ARG A 312 5.704 13.116 3.151 1.00 61.33 H new ATOM 0 HA ARG A 312 2.960 13.703 2.368 1.00 65.13 H new ATOM 0 HB2 ARG A 312 2.447 15.136 4.157 1.00 62.32 H new ATOM 0 HB3 ARG A 312 3.119 13.720 4.943 1.00 62.32 H new ATOM 0 HG2 ARG A 312 4.667 16.268 4.341 1.00 71.50 H new ATOM 0 HG3 ARG A 312 3.957 15.870 5.893 1.00 71.50 H new ATOM 0 HD2 ARG A 312 5.361 13.620 5.596 1.00 52.51 H new ATOM 0 HD3 ARG A 312 6.309 14.606 4.500 1.00 52.51 H new ATOM 0 HE ARG A 312 6.174 16.214 6.715 1.00 34.31 H new ATOM 0 HH11 ARG A 312 6.986 12.814 6.229 1.00 13.53 H new ATOM 0 HH12 ARG A 312 8.101 12.765 7.599 1.00 13.53 H new ATOM 0 HH21 ARG A 312 7.609 16.145 8.470 1.00 35.04 H new ATOM 0 HH22 ARG A 312 8.453 14.643 8.863 1.00 35.04 H new ATOM 199 N ARG A 313 3.809 15.748 1.226 1.00 22.33 N ATOM 200 CA ARG A 313 4.363 16.822 0.410 1.00 23.35 C ATOM 201 C ARG A 313 4.348 18.145 1.170 1.00 52.24 C ATOM 202 O ARG A 313 3.321 18.545 1.719 1.00 13.30 O ATOM 203 CB ARG A 313 3.574 16.961 -0.893 1.00 11.12 C ATOM 204 CG ARG A 313 2.142 17.426 -0.691 1.00 71.14 C ATOM 205 CD ARG A 313 1.179 16.674 -1.597 1.00 15.11 C ATOM 206 NE ARG A 313 -0.083 17.389 -1.768 1.00 62.02 N ATOM 207 CZ ARG A 313 -0.199 18.524 -2.448 1.00 31.34 C ATOM 208 NH1 ARG A 313 0.866 19.070 -3.018 1.00 41.44 N1+ ATOM 209 NH2 ARG A 313 -1.382 19.114 -2.558 1.00 33.42 N ATOM 0 H ARG A 313 2.838 15.516 1.015 1.00 22.33 H new ATOM 0 HA ARG A 313 5.397 16.569 0.175 1.00 23.35 H new ATOM 0 HB2 ARG A 313 4.088 17.667 -1.545 1.00 11.12 H new ATOM 0 HB3 ARG A 313 3.566 16.000 -1.407 1.00 11.12 H new ATOM 0 HG2 ARG A 313 1.854 17.279 0.350 1.00 71.14 H new ATOM 0 HG3 ARG A 313 2.074 18.495 -0.893 1.00 71.14 H new ATOM 0 HD2 ARG A 313 1.643 16.520 -2.571 1.00 15.11 H new ATOM 0 HD3 ARG A 313 0.983 15.687 -1.178 1.00 15.11 H new ATOM 0 HE ARG A 313 -0.922 16.995 -1.342 1.00 62.02 H new ATOM 0 HH11 ARG A 313 1.777 18.618 -2.935 1.00 41.44 H new ATOM 0 HH12 ARG A 313 0.775 19.942 -3.540 1.00 41.44 H new ATOM 0 HH21 ARG A 313 -2.203 18.696 -2.120 1.00 33.42 H new ATOM 0 HH22 ARG A 313 -1.471 19.986 -3.080 1.00 33.42 H new ATOM 223 N ILE A 314 5.493 18.819 1.197 1.00 33.21 N ATOM 224 CA ILE A 314 5.610 20.097 1.888 1.00 40.53 C ATOM 225 C ILE A 314 5.674 21.255 0.898 1.00 21.34 C ATOM 226 O ILE A 314 6.381 21.187 -0.108 1.00 73.33 O ATOM 227 CB ILE A 314 6.859 20.137 2.789 1.00 44.43 C ATOM 228 CG1 ILE A 314 6.928 18.879 3.658 1.00 61.03 C ATOM 229 CG2 ILE A 314 6.846 21.387 3.657 1.00 71.22 C ATOM 230 CD1 ILE A 314 5.709 18.680 4.531 1.00 71.22 C ATOM 0 H ILE A 314 6.352 18.501 0.749 1.00 33.21 H new ATOM 0 HA ILE A 314 4.720 20.202 2.508 1.00 40.53 H new ATOM 0 HB ILE A 314 7.745 20.167 2.155 1.00 44.43 H new ATOM 0 HG12 ILE A 314 7.049 18.008 3.014 1.00 61.03 H new ATOM 0 HG13 ILE A 314 7.814 18.933 4.291 1.00 61.03 H new ATOM 0 HG21 ILE A 314 7.735 21.401 4.288 1.00 71.22 H new ATOM 0 HG22 ILE A 314 6.839 22.272 3.021 1.00 71.22 H new ATOM 0 HG23 ILE A 314 5.955 21.385 4.285 1.00 71.22 H new ATOM 0 HD11 ILE A 314 5.827 17.770 5.119 1.00 71.22 H new ATOM 0 HD12 ILE A 314 5.598 19.533 5.201 1.00 71.22 H new ATOM 0 HD13 ILE A 314 4.822 18.594 3.903 1.00 71.22 H new ATOM 242 N VAL A 315 4.932 22.318 1.190 1.00 31.44 N ATOM 243 CA VAL A 315 4.906 23.493 0.326 1.00 40.55 C ATOM 244 C VAL A 315 6.132 24.370 0.556 1.00 12.11 C ATOM 245 O VAL A 315 6.478 24.684 1.696 1.00 32.30 O ATOM 246 CB VAL A 315 3.636 24.332 0.559 1.00 44.24 C ATOM 247 CG1 VAL A 315 3.533 24.753 2.017 1.00 25.10 C ATOM 248 CG2 VAL A 315 3.626 25.547 -0.357 1.00 1.35 C ATOM 0 H VAL A 315 4.341 22.390 2.018 1.00 31.44 H new ATOM 0 HA VAL A 315 4.909 23.131 -0.702 1.00 40.55 H new ATOM 0 HB VAL A 315 2.767 23.718 0.321 1.00 44.24 H new ATOM 0 HG11 VAL A 315 2.629 25.345 2.162 1.00 25.10 H new ATOM 0 HG12 VAL A 315 3.491 23.866 2.650 1.00 25.10 H new ATOM 0 HG13 VAL A 315 4.405 25.350 2.286 1.00 25.10 H new ATOM 0 HG21 VAL A 315 2.722 26.129 -0.179 1.00 1.35 H new ATOM 0 HG22 VAL A 315 4.501 26.164 -0.152 1.00 1.35 H new ATOM 0 HG23 VAL A 315 3.648 25.219 -1.396 1.00 1.35 H new ATOM 258 N ILE A 316 6.783 24.764 -0.533 1.00 54.32 N ATOM 259 CA ILE A 316 7.969 25.607 -0.450 1.00 55.43 C ATOM 260 C ILE A 316 7.894 26.760 -1.444 1.00 70.43 C ATOM 261 O ILE A 316 7.259 26.650 -2.493 1.00 42.24 O ATOM 262 CB ILE A 316 9.254 24.799 -0.713 1.00 34.42 C ATOM 263 CG1 ILE A 316 9.252 23.513 0.115 1.00 73.45 C ATOM 264 CG2 ILE A 316 10.482 25.639 -0.395 1.00 33.44 C ATOM 265 CD1 ILE A 316 9.234 23.755 1.608 1.00 54.32 C ATOM 0 H ILE A 316 6.509 24.513 -1.483 1.00 54.32 H new ATOM 0 HA ILE A 316 8.002 26.006 0.564 1.00 55.43 H new ATOM 0 HB ILE A 316 9.286 24.529 -1.768 1.00 34.42 H new ATOM 0 HG12 ILE A 316 8.382 22.916 -0.158 1.00 73.45 H new ATOM 0 HG13 ILE A 316 10.134 22.926 -0.139 1.00 73.45 H new ATOM 0 HG21 ILE A 316 11.382 25.054 -0.586 1.00 33.44 H new ATOM 0 HG22 ILE A 316 10.487 26.529 -1.024 1.00 33.44 H new ATOM 0 HG23 ILE A 316 10.458 25.936 0.653 1.00 33.44 H new ATOM 0 HD11 ILE A 316 9.234 22.799 2.132 1.00 54.32 H new ATOM 0 HD12 ILE A 316 10.117 24.325 1.895 1.00 54.32 H new ATOM 0 HD13 ILE A 316 8.338 24.315 1.875 1.00 54.32 H new ATOM 277 N HIS A 317 8.549 27.868 -1.109 1.00 51.30 N ATOM 278 CA HIS A 317 8.559 29.042 -1.974 1.00 43.21 C ATOM 279 C HIS A 317 9.322 28.760 -3.264 1.00 13.34 C ATOM 280 O HIS A 317 9.920 27.696 -3.423 1.00 63.44 O ATOM 281 CB HIS A 317 9.186 30.232 -1.247 1.00 41.34 C ATOM 282 CG HIS A 317 8.619 31.554 -1.662 1.00 52.43 C ATOM 283 ND1 HIS A 317 9.313 32.741 -1.545 1.00 2.41 N ATOM 284 CD2 HIS A 317 7.418 31.874 -2.198 1.00 21.05 C ATOM 285 CE1 HIS A 317 8.562 33.732 -1.989 1.00 43.42 C ATOM 286 NE2 HIS A 317 7.407 33.233 -2.392 1.00 50.44 N ATOM 0 H HIS A 317 9.080 27.977 -0.245 1.00 51.30 H new ATOM 0 HA HIS A 317 7.527 29.284 -2.228 1.00 43.21 H new ATOM 0 HB2 HIS A 317 9.045 30.107 -0.173 1.00 41.34 H new ATOM 0 HB3 HIS A 317 10.261 30.234 -1.429 1.00 41.34 H new ATOM 0 HD2 HIS A 317 6.617 31.188 -2.430 1.00 21.05 H new ATOM 0 HE1 HIS A 317 8.844 34.774 -2.018 1.00 43.42 H new ATOM 0 HE2 HIS A 317 6.633 33.770 -2.783 1.00 50.44 H new ATOM 294 N ARG A 318 9.295 29.719 -4.184 1.00 45.32 N ATOM 295 CA ARG A 318 9.982 29.572 -5.461 1.00 11.31 C ATOM 296 C ARG A 318 11.357 28.939 -5.269 1.00 1.25 C ATOM 297 O ARG A 318 12.209 29.481 -4.566 1.00 61.32 O ATOM 298 CB ARG A 318 10.126 30.932 -6.146 1.00 33.22 C ATOM 299 CG ARG A 318 8.828 31.719 -6.217 1.00 11.42 C ATOM 300 CD ARG A 318 8.716 32.494 -7.521 1.00 63.51 C ATOM 301 NE ARG A 318 7.497 33.296 -7.578 1.00 71.10 N ATOM 302 CZ ARG A 318 7.330 34.322 -8.404 1.00 33.32 C ATOM 303 NH1 ARG A 318 8.300 34.669 -9.239 1.00 12.41 N1+ ATOM 304 NH2 ARG A 318 6.192 35.004 -8.397 1.00 25.43 N ATOM 0 H ARG A 318 8.805 30.606 -4.068 1.00 45.32 H new ATOM 0 HA ARG A 318 9.384 28.916 -6.093 1.00 11.31 H new ATOM 0 HB2 ARG A 318 10.870 31.522 -5.610 1.00 33.22 H new ATOM 0 HB3 ARG A 318 10.506 30.782 -7.157 1.00 33.22 H new ATOM 0 HG2 ARG A 318 7.983 31.037 -6.124 1.00 11.42 H new ATOM 0 HG3 ARG A 318 8.774 32.410 -5.376 1.00 11.42 H new ATOM 0 HD2 ARG A 318 9.583 33.145 -7.632 1.00 63.51 H new ATOM 0 HD3 ARG A 318 8.731 31.797 -8.359 1.00 63.51 H new ATOM 0 HE ARG A 318 6.732 33.055 -6.948 1.00 71.10 H new ATOM 0 HH11 ARG A 318 9.176 34.147 -9.248 1.00 12.41 H new ATOM 0 HH12 ARG A 318 8.170 35.458 -9.873 1.00 12.41 H new ATOM 0 HH21 ARG A 318 5.443 34.740 -7.756 1.00 25.43 H new ATOM 0 HH22 ARG A 318 6.066 35.792 -9.032 1.00 25.43 H new ATOM 376 N GLY A 324 18.375 28.217 1.250 1.00 31.44 N ATOM 377 CA GLY A 324 18.406 27.966 2.679 1.00 71.03 C ATOM 378 C GLY A 324 18.620 26.501 3.005 1.00 75.42 C ATOM 379 O GLY A 324 19.311 26.167 3.968 1.00 21.33 O ATOM 0 HA2 GLY A 324 19.203 28.556 3.131 1.00 71.03 H new ATOM 0 HA3 GLY A 324 17.469 28.301 3.124 1.00 71.03 H new ATOM 383 N PHE A 325 18.024 25.625 2.204 1.00 4.13 N ATOM 384 CA PHE A 325 18.150 24.187 2.414 1.00 14.42 C ATOM 385 C PHE A 325 19.211 23.594 1.491 1.00 41.24 C ATOM 386 O PHE A 325 19.567 24.188 0.475 1.00 35.12 O ATOM 387 CB PHE A 325 16.807 23.495 2.177 1.00 21.14 C ATOM 388 CG PHE A 325 16.207 23.795 0.833 1.00 31.11 C ATOM 389 CD1 PHE A 325 16.540 23.033 -0.275 1.00 40.52 C ATOM 390 CD2 PHE A 325 15.310 24.840 0.677 1.00 75.11 C ATOM 391 CE1 PHE A 325 15.990 23.306 -1.513 1.00 43.35 C ATOM 392 CE2 PHE A 325 14.756 25.118 -0.558 1.00 45.35 C ATOM 393 CZ PHE A 325 15.098 24.351 -1.655 1.00 14.33 C ATOM 0 H PHE A 325 17.449 25.885 1.403 1.00 4.13 H new ATOM 0 HA PHE A 325 18.458 24.022 3.446 1.00 14.42 H new ATOM 0 HB2 PHE A 325 16.940 22.418 2.274 1.00 21.14 H new ATOM 0 HB3 PHE A 325 16.107 23.801 2.955 1.00 21.14 H new ATOM 0 HD1 PHE A 325 17.238 22.216 -0.170 1.00 40.52 H new ATOM 0 HD2 PHE A 325 15.041 25.444 1.531 1.00 75.11 H new ATOM 0 HE1 PHE A 325 16.257 22.703 -2.368 1.00 43.35 H new ATOM 0 HE2 PHE A 325 14.057 25.934 -0.666 1.00 45.35 H new ATOM 0 HZ PHE A 325 14.669 24.568 -2.622 1.00 14.33 H new ATOM 403 N ASN A 326 19.712 22.418 1.855 1.00 34.25 N ATOM 404 CA ASN A 326 20.733 21.743 1.061 1.00 15.45 C ATOM 405 C ASN A 326 20.316 20.311 0.743 1.00 33.43 C ATOM 406 O ASN A 326 19.384 19.777 1.345 1.00 71.11 O ATOM 407 CB ASN A 326 22.070 21.745 1.804 1.00 1.21 C ATOM 408 CG ASN A 326 23.223 21.307 0.921 1.00 30.05 C ATOM 409 OD1 ASN A 326 23.306 21.691 -0.246 1.00 60.34 O ATOM 410 ND2 ASN A 326 24.119 20.499 1.476 1.00 72.14 N ATOM 0 H ASN A 326 19.428 21.913 2.694 1.00 34.25 H new ATOM 0 HA ASN A 326 20.846 22.286 0.123 1.00 15.45 H new ATOM 0 HB2 ASN A 326 22.269 22.746 2.186 1.00 1.21 H new ATOM 0 HB3 ASN A 326 22.004 21.082 2.667 1.00 1.21 H new ATOM 0 HD21 ASN A 326 24.917 20.171 0.931 1.00 72.14 H new ATOM 0 HD22 ASN A 326 24.010 20.206 2.447 1.00 72.14 H new ATOM 417 N ILE A 327 21.013 19.694 -0.206 1.00 51.31 N ATOM 418 CA ILE A 327 20.717 18.323 -0.602 1.00 54.35 C ATOM 419 C ILE A 327 21.979 17.467 -0.607 1.00 32.34 C ATOM 420 O ILE A 327 23.044 17.916 -1.032 1.00 43.12 O ATOM 421 CB ILE A 327 20.068 18.269 -1.998 1.00 72.32 C ATOM 422 CG1 ILE A 327 21.071 18.705 -3.068 1.00 41.43 C ATOM 423 CG2 ILE A 327 18.826 19.146 -2.039 1.00 53.13 C ATOM 424 CD1 ILE A 327 20.510 18.668 -4.472 1.00 72.34 C ATOM 0 H ILE A 327 21.787 20.122 -0.715 1.00 51.31 H new ATOM 0 HA ILE A 327 20.016 17.927 0.132 1.00 54.35 H new ATOM 0 HB ILE A 327 19.770 17.241 -2.204 1.00 72.32 H new ATOM 0 HG12 ILE A 327 21.409 19.717 -2.847 1.00 41.43 H new ATOM 0 HG13 ILE A 327 21.947 18.059 -3.018 1.00 41.43 H new ATOM 0 HG21 ILE A 327 18.379 19.097 -3.032 1.00 53.13 H new ATOM 0 HG22 ILE A 327 18.107 18.793 -1.299 1.00 53.13 H new ATOM 0 HG23 ILE A 327 19.101 20.177 -1.815 1.00 53.13 H new ATOM 0 HD11 ILE A 327 21.275 18.989 -5.178 1.00 72.34 H new ATOM 0 HD12 ILE A 327 20.198 17.652 -4.713 1.00 72.34 H new ATOM 0 HD13 ILE A 327 19.651 19.336 -4.539 1.00 72.34 H new ATOM 436 N ILE A 328 21.852 16.233 -0.133 1.00 11.01 N ATOM 437 CA ILE A 328 22.981 15.313 -0.085 1.00 13.42 C ATOM 438 C ILE A 328 22.603 13.948 -0.650 1.00 45.50 C ATOM 439 O ILE A 328 21.523 13.427 -0.373 1.00 54.24 O ATOM 440 CB ILE A 328 23.502 15.135 1.353 1.00 73.10 C ATOM 441 CG1 ILE A 328 24.867 14.443 1.343 1.00 53.12 C ATOM 442 CG2 ILE A 328 22.505 14.338 2.182 1.00 53.22 C ATOM 443 CD1 ILE A 328 25.499 14.333 2.713 1.00 32.34 C ATOM 0 H ILE A 328 20.978 15.847 0.224 1.00 11.01 H new ATOM 0 HA ILE A 328 23.770 15.750 -0.697 1.00 13.42 H new ATOM 0 HB ILE A 328 23.618 16.120 1.806 1.00 73.10 H new ATOM 0 HG12 ILE A 328 24.756 13.444 0.922 1.00 53.12 H new ATOM 0 HG13 ILE A 328 25.539 14.993 0.685 1.00 53.12 H new ATOM 0 HG21 ILE A 328 22.887 14.220 3.196 1.00 53.22 H new ATOM 0 HG22 ILE A 328 21.552 14.867 2.212 1.00 53.22 H new ATOM 0 HG23 ILE A 328 22.361 13.356 1.732 1.00 53.22 H new ATOM 0 HD11 ILE A 328 26.464 13.832 2.630 1.00 32.34 H new ATOM 0 HD12 ILE A 328 25.643 15.330 3.129 1.00 32.34 H new ATOM 0 HD13 ILE A 328 24.847 13.757 3.369 1.00 32.34 H new ATOM 455 N GLY A 329 23.502 13.371 -1.443 1.00 64.24 N ATOM 456 CA GLY A 329 23.245 12.071 -2.033 1.00 61.42 C ATOM 457 C GLY A 329 24.520 11.320 -2.360 1.00 63.14 C ATOM 458 O GLY A 329 25.568 11.574 -1.767 1.00 70.23 O ATOM 0 H GLY A 329 24.403 13.781 -1.687 1.00 64.24 H new ATOM 0 HA2 GLY A 329 22.643 11.476 -1.346 1.00 61.42 H new ATOM 0 HA3 GLY A 329 22.658 12.198 -2.943 1.00 61.42 H new ATOM 462 N GLY A 330 24.432 10.390 -3.306 1.00 41.31 N ATOM 463 CA GLY A 330 25.595 9.613 -3.694 1.00 14.33 C ATOM 464 C GLY A 330 25.697 9.432 -5.195 1.00 35.30 C ATOM 465 O GLY A 330 25.434 10.361 -5.958 1.00 4.31 O ATOM 0 H GLY A 330 23.576 10.161 -3.811 1.00 41.31 H new ATOM 0 HA2 GLY A 330 26.496 10.106 -3.329 1.00 14.33 H new ATOM 0 HA3 GLY A 330 25.551 8.635 -3.215 1.00 14.33 H new ATOM 469 N GLU A 331 26.082 8.233 -5.620 1.00 55.42 N ATOM 470 CA GLU A 331 26.221 7.935 -7.041 1.00 45.23 C ATOM 471 C GLU A 331 24.980 7.222 -7.571 1.00 61.10 C ATOM 472 O GLU A 331 24.348 6.441 -6.860 1.00 71.34 O ATOM 473 CB GLU A 331 27.461 7.073 -7.285 1.00 71.41 C ATOM 474 CG GLU A 331 27.530 5.841 -6.398 1.00 21.35 C ATOM 475 CD GLU A 331 28.500 4.799 -6.921 1.00 1.11 C ATOM 476 OE1 GLU A 331 28.282 3.599 -6.655 1.00 13.10 O ATOM 477 OE2 GLU A 331 29.478 5.184 -7.597 1.00 15.51 O1- ATOM 0 H GLU A 331 26.303 7.453 -5.001 1.00 55.42 H new ATOM 0 HA GLU A 331 26.333 8.879 -7.575 1.00 45.23 H new ATOM 0 HB2 GLU A 331 27.476 6.760 -8.329 1.00 71.41 H new ATOM 0 HB3 GLU A 331 28.352 7.679 -7.121 1.00 71.41 H new ATOM 0 HG2 GLU A 331 27.829 6.138 -5.393 1.00 21.35 H new ATOM 0 HG3 GLU A 331 26.537 5.399 -6.318 1.00 21.35 H new ATOM 484 N ASP A 332 24.637 7.498 -8.824 1.00 34.22 N ATOM 485 CA ASP A 332 23.473 6.883 -9.451 1.00 54.55 C ATOM 486 C ASP A 332 22.235 7.046 -8.575 1.00 20.51 C ATOM 487 O ASP A 332 21.353 6.188 -8.563 1.00 45.45 O ATOM 488 CB ASP A 332 23.733 5.400 -9.717 1.00 30.44 C ATOM 489 CG ASP A 332 24.967 5.172 -10.569 1.00 42.20 C ATOM 490 OD1 ASP A 332 26.006 4.760 -10.011 1.00 25.10 O ATOM 491 OD2 ASP A 332 24.893 5.405 -11.793 1.00 12.24 O1- ATOM 0 H ASP A 332 25.148 8.144 -9.426 1.00 34.22 H new ATOM 0 HA ASP A 332 23.294 7.388 -10.400 1.00 54.55 H new ATOM 0 HB2 ASP A 332 23.850 4.878 -8.767 1.00 30.44 H new ATOM 0 HB3 ASP A 332 22.866 4.966 -10.215 1.00 30.44 H new ATOM 496 N GLY A 333 22.176 8.153 -7.841 1.00 50.11 N ATOM 497 CA GLY A 333 21.043 8.407 -6.971 1.00 62.04 C ATOM 498 C GLY A 333 20.810 7.284 -5.980 1.00 1.24 C ATOM 499 O GLY A 333 19.682 6.822 -5.810 1.00 52.13 O ATOM 0 H GLY A 333 22.893 8.878 -7.834 1.00 50.11 H new ATOM 0 HA2 GLY A 333 21.207 9.338 -6.428 1.00 62.04 H new ATOM 0 HA3 GLY A 333 20.147 8.545 -7.577 1.00 62.04 H new ATOM 503 N GLU A 334 21.879 6.844 -5.324 1.00 21.13 N ATOM 504 CA GLU A 334 21.785 5.766 -4.347 1.00 54.34 C ATOM 505 C GLU A 334 20.785 6.114 -3.248 1.00 71.03 C ATOM 506 O GLU A 334 20.150 5.234 -2.669 1.00 62.04 O ATOM 507 CB GLU A 334 23.158 5.483 -3.732 1.00 4.41 C ATOM 508 CG GLU A 334 23.350 4.036 -3.311 1.00 70.23 C ATOM 509 CD GLU A 334 24.805 3.611 -3.330 1.00 13.12 C ATOM 510 OE1 GLU A 334 25.533 4.032 -4.254 1.00 51.52 O ATOM 511 OE2 GLU A 334 25.216 2.858 -2.423 1.00 64.51 O1- ATOM 0 H GLU A 334 22.820 7.217 -5.451 1.00 21.13 H new ATOM 0 HA GLU A 334 21.435 4.872 -4.863 1.00 54.34 H new ATOM 0 HB2 GLU A 334 23.931 5.748 -4.453 1.00 4.41 H new ATOM 0 HB3 GLU A 334 23.297 6.127 -2.864 1.00 4.41 H new ATOM 0 HG2 GLU A 334 22.948 3.897 -2.307 1.00 70.23 H new ATOM 0 HG3 GLU A 334 22.778 3.389 -3.976 1.00 70.23 H new ATOM 518 N GLY A 335 20.653 7.407 -2.964 1.00 12.05 N ATOM 519 CA GLY A 335 19.730 7.850 -1.935 1.00 74.04 C ATOM 520 C GLY A 335 19.939 9.302 -1.555 1.00 72.20 C ATOM 521 O GLY A 335 20.824 9.621 -0.760 1.00 1.50 O ATOM 0 H GLY A 335 21.169 8.155 -3.428 1.00 12.05 H new ATOM 0 HA2 GLY A 335 18.707 7.713 -2.285 1.00 74.04 H new ATOM 0 HA3 GLY A 335 19.850 7.225 -1.050 1.00 74.04 H new ATOM 525 N ILE A 336 19.125 10.184 -2.124 1.00 11.34 N ATOM 526 CA ILE A 336 19.226 11.610 -1.840 1.00 53.22 C ATOM 527 C ILE A 336 18.257 12.021 -0.737 1.00 70.03 C ATOM 528 O ILE A 336 17.058 11.750 -0.815 1.00 51.25 O ATOM 529 CB ILE A 336 18.944 12.456 -3.096 1.00 51.54 C ATOM 530 CG1 ILE A 336 19.195 13.937 -2.807 1.00 73.13 C ATOM 531 CG2 ILE A 336 17.515 12.238 -3.571 1.00 21.51 C ATOM 532 CD1 ILE A 336 20.604 14.385 -3.128 1.00 2.51 C ATOM 0 H ILE A 336 18.388 9.936 -2.784 1.00 11.34 H new ATOM 0 HA ILE A 336 20.248 11.794 -1.510 1.00 53.22 H new ATOM 0 HB ILE A 336 19.622 12.140 -3.889 1.00 51.54 H new ATOM 0 HG12 ILE A 336 18.491 14.536 -3.385 1.00 73.13 H new ATOM 0 HG13 ILE A 336 18.991 14.133 -1.754 1.00 73.13 H new ATOM 0 HG21 ILE A 336 17.331 12.842 -4.459 1.00 21.51 H new ATOM 0 HG22 ILE A 336 17.368 11.185 -3.812 1.00 21.51 H new ATOM 0 HG23 ILE A 336 16.821 12.530 -2.783 1.00 21.51 H new ATOM 0 HD11 ILE A 336 20.710 15.445 -2.898 1.00 2.51 H new ATOM 0 HD12 ILE A 336 21.313 13.812 -2.531 1.00 2.51 H new ATOM 0 HD13 ILE A 336 20.806 14.221 -4.187 1.00 2.51 H new ATOM 544 N PHE A 337 18.784 12.678 0.291 1.00 13.53 N ATOM 545 CA PHE A 337 17.965 13.128 1.411 1.00 44.42 C ATOM 546 C PHE A 337 18.350 14.544 1.832 1.00 3.11 C ATOM 547 O PHE A 337 19.385 15.066 1.418 1.00 23.23 O ATOM 548 CB PHE A 337 18.117 12.173 2.597 1.00 22.41 C ATOM 549 CG PHE A 337 18.127 10.724 2.202 1.00 1.43 C ATOM 550 CD1 PHE A 337 17.024 10.151 1.591 1.00 52.41 C ATOM 551 CD2 PHE A 337 19.241 9.935 2.442 1.00 30.51 C ATOM 552 CE1 PHE A 337 17.030 8.817 1.226 1.00 11.01 C ATOM 553 CE2 PHE A 337 19.253 8.601 2.079 1.00 51.44 C ATOM 554 CZ PHE A 337 18.146 8.042 1.471 1.00 72.43 C ATOM 0 H PHE A 337 19.774 12.911 0.372 1.00 13.53 H new ATOM 0 HA PHE A 337 16.924 13.134 1.088 1.00 44.42 H new ATOM 0 HB2 PHE A 337 19.043 12.404 3.123 1.00 22.41 H new ATOM 0 HB3 PHE A 337 17.300 12.345 3.298 1.00 22.41 H new ATOM 0 HD1 PHE A 337 16.149 10.753 1.397 1.00 52.41 H new ATOM 0 HD2 PHE A 337 20.109 10.367 2.918 1.00 30.51 H new ATOM 0 HE1 PHE A 337 16.163 8.382 0.750 1.00 11.01 H new ATOM 0 HE2 PHE A 337 20.127 7.997 2.271 1.00 51.44 H new ATOM 0 HZ PHE A 337 18.153 7.000 1.188 1.00 72.43 H new ATOM 564 N ILE A 338 17.509 15.158 2.656 1.00 10.45 N ATOM 565 CA ILE A 338 17.760 16.513 3.133 1.00 20.14 C ATOM 566 C ILE A 338 19.043 16.576 3.956 1.00 32.21 C ATOM 567 O ILE A 338 19.311 15.699 4.776 1.00 61.42 O ATOM 568 CB ILE A 338 16.590 17.035 3.987 1.00 33.41 C ATOM 569 CG1 ILE A 338 15.297 17.043 3.169 1.00 41.54 C ATOM 570 CG2 ILE A 338 16.899 18.429 4.513 1.00 13.13 C ATOM 571 CD1 ILE A 338 15.376 17.896 1.922 1.00 35.32 C ATOM 0 H ILE A 338 16.648 14.740 3.008 1.00 10.45 H new ATOM 0 HA ILE A 338 17.865 17.144 2.251 1.00 20.14 H new ATOM 0 HB ILE A 338 16.455 16.368 4.839 1.00 33.41 H new ATOM 0 HG12 ILE A 338 15.050 16.020 2.885 1.00 41.54 H new ATOM 0 HG13 ILE A 338 14.482 17.405 3.796 1.00 41.54 H new ATOM 0 HG21 ILE A 338 16.063 18.784 5.115 1.00 13.13 H new ATOM 0 HG22 ILE A 338 17.799 18.395 5.127 1.00 13.13 H new ATOM 0 HG23 ILE A 338 17.057 19.107 3.675 1.00 13.13 H new ATOM 0 HD11 ILE A 338 14.424 17.855 1.392 1.00 35.32 H new ATOM 0 HD12 ILE A 338 15.592 18.928 2.200 1.00 35.32 H new ATOM 0 HD13 ILE A 338 16.169 17.521 1.274 1.00 35.32 H new ATOM 583 N SER A 339 19.832 17.622 3.731 1.00 53.21 N ATOM 584 CA SER A 339 21.088 17.800 4.450 1.00 21.04 C ATOM 585 C SER A 339 20.868 18.580 5.743 1.00 3.23 C ATOM 586 O SER A 339 20.991 18.034 6.839 1.00 14.32 O ATOM 587 CB SER A 339 22.105 18.528 3.569 1.00 72.42 C ATOM 588 OG SER A 339 22.927 19.387 4.341 1.00 60.13 O ATOM 0 H SER A 339 19.624 18.359 3.057 1.00 53.21 H new ATOM 0 HA SER A 339 21.477 16.814 4.703 1.00 21.04 H new ATOM 0 HB2 SER A 339 22.725 17.800 3.046 1.00 72.42 H new ATOM 0 HB3 SER A 339 21.582 19.107 2.808 1.00 72.42 H new ATOM 0 HG SER A 339 23.864 19.115 4.247 1.00 60.13 H new ATOM 594 N PHE A 340 20.543 19.861 5.606 1.00 10.12 N ATOM 595 CA PHE A 340 20.306 20.718 6.762 1.00 0.00 C ATOM 596 C PHE A 340 19.493 21.948 6.370 1.00 71.25 C ATOM 597 O PHE A 340 19.487 22.371 5.210 1.00 73.44 O ATOM 598 CB PHE A 340 21.636 21.149 7.384 1.00 62.34 C ATOM 599 CG PHE A 340 21.482 21.846 8.705 1.00 14.15 C ATOM 600 CD1 PHE A 340 20.758 21.262 9.732 1.00 54.53 C ATOM 601 CD2 PHE A 340 22.060 23.087 8.920 1.00 10.52 C ATOM 602 CE1 PHE A 340 20.615 21.900 10.949 1.00 33.00 C ATOM 603 CE2 PHE A 340 21.920 23.731 10.135 1.00 34.23 C ATOM 604 CZ PHE A 340 21.195 23.137 11.150 1.00 34.54 C ATOM 0 H PHE A 340 20.438 20.329 4.706 1.00 10.12 H new ATOM 0 HA PHE A 340 19.737 20.147 7.496 1.00 0.00 H new ATOM 0 HB2 PHE A 340 22.267 20.270 7.517 1.00 62.34 H new ATOM 0 HB3 PHE A 340 22.154 21.812 6.691 1.00 62.34 H new ATOM 0 HD1 PHE A 340 20.300 20.296 9.579 1.00 54.53 H new ATOM 0 HD2 PHE A 340 22.626 23.556 8.129 1.00 10.52 H new ATOM 0 HE1 PHE A 340 20.050 21.432 11.742 1.00 33.00 H new ATOM 0 HE2 PHE A 340 22.377 24.697 10.291 1.00 34.23 H new ATOM 0 HZ PHE A 340 21.082 23.639 12.099 1.00 34.54 H new ATOM 629 N LEU A 342 18.661 26.105 6.714 1.00 34.54 N ATOM 630 CA LEU A 342 19.185 27.379 7.194 1.00 12.21 C ATOM 631 C LEU A 342 18.052 28.309 7.619 1.00 50.14 C ATOM 632 O LEU A 342 17.186 28.655 6.816 1.00 42.41 O ATOM 633 CB LEU A 342 20.028 28.048 6.107 1.00 15.42 C ATOM 634 CG LEU A 342 21.333 27.340 5.739 1.00 70.31 C ATOM 635 CD1 LEU A 342 21.869 27.864 4.416 1.00 73.42 C ATOM 636 CD2 LEU A 342 22.365 27.517 6.843 1.00 2.52 C ATOM 0 HA LEU A 342 19.813 27.181 8.063 1.00 12.21 H new ATOM 0 HB2 LEU A 342 19.420 28.137 5.207 1.00 15.42 H new ATOM 0 HB3 LEU A 342 20.266 29.061 6.432 1.00 15.42 H new ATOM 0 HG LEU A 342 21.128 26.275 5.628 1.00 70.31 H new ATOM 0 HD11 LEU A 342 22.798 27.349 4.170 1.00 73.42 H new ATOM 0 HD12 LEU A 342 21.136 27.685 3.630 1.00 73.42 H new ATOM 0 HD13 LEU A 342 22.058 28.934 4.498 1.00 73.42 H new ATOM 0 HD21 LEU A 342 23.287 27.007 6.564 1.00 2.52 H new ATOM 0 HD22 LEU A 342 22.567 28.579 6.986 1.00 2.52 H new ATOM 0 HD23 LEU A 342 21.982 27.092 7.771 1.00 2.52 H new ATOM 648 N ALA A 343 18.067 28.710 8.886 1.00 70.31 N ATOM 649 CA ALA A 343 17.044 29.603 9.416 1.00 42.20 C ATOM 650 C ALA A 343 16.898 30.848 8.548 1.00 72.12 C ATOM 651 O ALA A 343 17.885 31.391 8.053 1.00 64.03 O ATOM 652 CB ALA A 343 17.375 29.992 10.849 1.00 12.23 C ATOM 0 H ALA A 343 18.776 28.431 9.564 1.00 70.31 H new ATOM 0 HA ALA A 343 16.092 29.072 9.406 1.00 42.20 H new ATOM 0 HB1 ALA A 343 16.603 30.659 11.233 1.00 12.23 H new ATOM 0 HB2 ALA A 343 17.421 29.096 11.468 1.00 12.23 H new ATOM 0 HB3 ALA A 343 18.339 30.500 10.875 1.00 12.23 H new ATOM 658 N GLY A 344 15.659 31.295 8.366 1.00 73.32 N ATOM 659 CA GLY A 344 15.407 32.473 7.556 1.00 22.32 C ATOM 660 C GLY A 344 15.009 32.125 6.136 1.00 65.20 C ATOM 661 O GLY A 344 14.371 32.922 5.449 1.00 32.14 O ATOM 0 H GLY A 344 14.826 30.863 8.765 1.00 73.32 H new ATOM 0 HA2 GLY A 344 14.616 33.065 8.017 1.00 22.32 H new ATOM 0 HA3 GLY A 344 16.302 33.096 7.537 1.00 22.32 H new ATOM 665 N GLY A 345 15.387 30.930 5.692 1.00 23.12 N ATOM 666 CA GLY A 345 15.058 30.500 4.345 1.00 52.00 C ATOM 667 C GLY A 345 13.566 30.336 4.137 1.00 22.43 C ATOM 668 O GLY A 345 12.789 30.265 5.090 1.00 40.45 O ATOM 0 H GLY A 345 15.915 30.252 6.241 1.00 23.12 H new ATOM 0 HA2 GLY A 345 15.444 31.227 3.630 1.00 52.00 H new ATOM 0 HA3 GLY A 345 15.557 29.553 4.137 1.00 52.00 H new ATOM 672 N PRO A 346 13.145 30.275 2.865 1.00 53.14 N ATOM 673 CA PRO A 346 11.732 30.119 2.506 1.00 44.02 C ATOM 674 C PRO A 346 11.195 28.735 2.853 1.00 14.04 C ATOM 675 O PRO A 346 10.089 28.602 3.377 1.00 51.45 O ATOM 676 CB PRO A 346 11.727 30.330 0.990 1.00 2.12 C ATOM 677 CG PRO A 346 13.102 29.962 0.551 1.00 64.40 C ATOM 678 CD PRO A 346 14.015 30.353 1.680 1.00 75.50 C ATOM 0 HA PRO A 346 11.094 30.815 3.050 1.00 44.02 H new ATOM 0 HB2 PRO A 346 10.977 29.705 0.506 1.00 2.12 H new ATOM 0 HB3 PRO A 346 11.494 31.364 0.735 1.00 2.12 H new ATOM 0 HG2 PRO A 346 13.173 28.894 0.344 1.00 64.40 H new ATOM 0 HG3 PRO A 346 13.371 30.484 -0.367 1.00 64.40 H new ATOM 0 HD2 PRO A 346 14.866 29.677 1.761 1.00 75.50 H new ATOM 0 HD3 PRO A 346 14.417 31.357 1.542 1.00 75.50 H new ATOM 686 N ALA A 347 11.984 27.708 2.558 1.00 35.54 N ATOM 687 CA ALA A 347 11.589 26.334 2.841 1.00 74.21 C ATOM 688 C ALA A 347 11.586 26.062 4.342 1.00 62.43 C ATOM 689 O ALA A 347 10.820 25.231 4.830 1.00 51.24 O ATOM 690 CB ALA A 347 12.514 25.360 2.128 1.00 24.45 C ATOM 0 H ALA A 347 12.902 27.802 2.123 1.00 35.54 H new ATOM 0 HA ALA A 347 10.574 26.191 2.470 1.00 74.21 H new ATOM 0 HB1 ALA A 347 12.206 24.338 2.349 1.00 24.45 H new ATOM 0 HB2 ALA A 347 12.462 25.530 1.053 1.00 24.45 H new ATOM 0 HB3 ALA A 347 13.537 25.513 2.471 1.00 24.45 H new ATOM 696 N ASP A 348 12.448 26.766 5.067 1.00 14.33 N ATOM 697 CA ASP A 348 12.545 26.600 6.513 1.00 52.14 C ATOM 698 C ASP A 348 11.309 27.163 7.208 1.00 64.31 C ATOM 699 O ASP A 348 10.749 26.534 8.108 1.00 51.35 O ATOM 700 CB ASP A 348 13.803 27.290 7.044 1.00 40.52 C ATOM 701 CG ASP A 348 15.038 26.942 6.237 1.00 22.44 C ATOM 702 OD1 ASP A 348 15.892 26.190 6.752 1.00 2.53 O ATOM 703 OD2 ASP A 348 15.151 27.422 5.089 1.00 10.20 O1- ATOM 0 H ASP A 348 13.090 27.457 4.678 1.00 14.33 H new ATOM 0 HA ASP A 348 12.607 25.533 6.729 1.00 52.14 H new ATOM 0 HB2 ASP A 348 13.655 28.370 7.029 1.00 40.52 H new ATOM 0 HB3 ASP A 348 13.959 27.004 8.084 1.00 40.52 H new ATOM 708 N LEU A 349 10.889 28.350 6.787 1.00 71.31 N ATOM 709 CA LEU A 349 9.720 28.999 7.370 1.00 51.53 C ATOM 710 C LEU A 349 8.432 28.427 6.787 1.00 12.02 C ATOM 711 O LEU A 349 7.553 27.975 7.521 1.00 70.14 O ATOM 712 CB LEU A 349 9.776 30.509 7.128 1.00 24.32 C ATOM 713 CG LEU A 349 10.677 31.306 8.072 1.00 5.13 C ATOM 714 CD1 LEU A 349 11.200 32.556 7.380 1.00 0.23 C ATOM 715 CD2 LEU A 349 9.925 31.674 9.343 1.00 55.22 C ATOM 0 H LEU A 349 11.340 28.883 6.044 1.00 71.31 H new ATOM 0 HA LEU A 349 9.727 28.809 8.443 1.00 51.53 H new ATOM 0 HB2 LEU A 349 10.112 30.681 6.105 1.00 24.32 H new ATOM 0 HB3 LEU A 349 8.764 30.907 7.202 1.00 24.32 H new ATOM 0 HG LEU A 349 11.528 30.682 8.345 1.00 5.13 H new ATOM 0 HD11 LEU A 349 11.839 33.111 8.066 1.00 0.23 H new ATOM 0 HD12 LEU A 349 11.775 32.271 6.499 1.00 0.23 H new ATOM 0 HD13 LEU A 349 10.361 33.183 7.078 1.00 0.23 H new ATOM 0 HD21 LEU A 349 10.582 32.241 10.003 1.00 55.22 H new ATOM 0 HD22 LEU A 349 9.055 32.280 9.089 1.00 55.22 H new ATOM 0 HD23 LEU A 349 9.599 30.765 9.849 1.00 55.22 H new ATOM 727 N SER A 350 8.329 28.446 5.462 1.00 73.34 N ATOM 728 CA SER A 350 7.148 27.931 4.779 1.00 32.33 C ATOM 729 C SER A 350 7.015 26.425 4.986 1.00 42.41 C ATOM 730 O SER A 350 5.936 25.922 5.295 1.00 22.13 O ATOM 731 CB SER A 350 7.218 28.247 3.284 1.00 35.25 C ATOM 732 OG SER A 350 7.527 29.613 3.066 1.00 54.44 O ATOM 0 H SER A 350 9.049 28.813 4.840 1.00 73.34 H new ATOM 0 HA SER A 350 6.271 28.418 5.205 1.00 32.33 H new ATOM 0 HB2 SER A 350 7.974 27.620 2.811 1.00 35.25 H new ATOM 0 HB3 SER A 350 6.265 28.007 2.813 1.00 35.25 H new ATOM 0 HG SER A 350 8.499 29.735 3.083 1.00 54.44 H new ATOM 738 N GLY A 351 8.123 25.710 4.812 1.00 33.35 N ATOM 739 CA GLY A 351 8.110 24.269 4.983 1.00 12.41 C ATOM 740 C GLY A 351 8.655 23.840 6.331 1.00 22.05 C ATOM 741 O GLY A 351 9.436 24.563 6.950 1.00 70.33 O ATOM 0 H GLY A 351 9.029 26.103 4.556 1.00 33.35 H new ATOM 0 HA2 GLY A 351 7.089 23.903 4.874 1.00 12.41 H new ATOM 0 HA3 GLY A 351 8.701 23.807 4.192 1.00 12.41 H new ATOM 745 N GLU A 352 8.243 22.662 6.787 1.00 5.11 N ATOM 746 CA GLU A 352 8.694 22.140 8.072 1.00 73.30 C ATOM 747 C GLU A 352 9.767 21.072 7.879 1.00 52.43 C ATOM 748 O GLU A 352 10.008 20.251 8.765 1.00 30.44 O ATOM 749 CB GLU A 352 7.514 21.558 8.853 1.00 65.40 C ATOM 750 CG GLU A 352 6.767 22.588 9.683 1.00 74.50 C ATOM 751 CD GLU A 352 5.650 23.261 8.910 1.00 64.11 C ATOM 752 OE1 GLU A 352 5.448 24.479 9.099 1.00 63.12 O ATOM 753 OE2 GLU A 352 4.977 22.571 8.117 1.00 61.14 O1- ATOM 0 H GLU A 352 7.598 22.051 6.286 1.00 5.11 H new ATOM 0 HA GLU A 352 9.125 22.965 8.640 1.00 73.30 H new ATOM 0 HB2 GLU A 352 6.819 21.094 8.153 1.00 65.40 H new ATOM 0 HB3 GLU A 352 7.878 20.769 9.511 1.00 65.40 H new ATOM 0 HG2 GLU A 352 6.352 22.105 10.567 1.00 74.50 H new ATOM 0 HG3 GLU A 352 7.469 23.345 10.033 1.00 74.50 H new ATOM 760 N LEU A 353 10.407 21.089 6.715 1.00 71.34 N ATOM 761 CA LEU A 353 11.454 20.122 6.404 1.00 3.31 C ATOM 762 C LEU A 353 12.691 20.364 7.263 1.00 44.20 C ATOM 763 O LEU A 353 13.008 21.503 7.605 1.00 31.23 O ATOM 764 CB LEU A 353 11.825 20.201 4.922 1.00 32.25 C ATOM 765 CG LEU A 353 10.848 19.539 3.949 1.00 32.11 C ATOM 766 CD1 LEU A 353 11.012 20.117 2.552 1.00 53.54 C ATOM 767 CD2 LEU A 353 11.053 18.031 3.932 1.00 3.24 C ATOM 0 H LEU A 353 10.219 21.761 5.971 1.00 71.34 H new ATOM 0 HA LEU A 353 11.071 19.125 6.624 1.00 3.31 H new ATOM 0 HB2 LEU A 353 11.923 21.251 4.648 1.00 32.25 H new ATOM 0 HB3 LEU A 353 12.805 19.744 4.789 1.00 32.25 H new ATOM 0 HG LEU A 353 9.832 19.744 4.287 1.00 32.11 H new ATOM 0 HD11 LEU A 353 10.309 19.634 1.874 1.00 53.54 H new ATOM 0 HD12 LEU A 353 10.815 21.189 2.576 1.00 53.54 H new ATOM 0 HD13 LEU A 353 12.030 19.943 2.204 1.00 53.54 H new ATOM 0 HD21 LEU A 353 10.350 17.576 3.235 1.00 3.24 H new ATOM 0 HD22 LEU A 353 12.072 17.806 3.618 1.00 3.24 H new ATOM 0 HD23 LEU A 353 10.884 17.630 4.931 1.00 3.24 H new ATOM 779 N ARG A 354 13.387 19.285 7.606 1.00 42.35 N ATOM 780 CA ARG A 354 14.590 19.380 8.424 1.00 70.32 C ATOM 781 C ARG A 354 15.578 18.273 8.068 1.00 34.00 C ATOM 782 O ARG A 354 15.273 17.386 7.271 1.00 74.12 O ATOM 783 CB ARG A 354 14.230 19.298 9.909 1.00 52.13 C ATOM 784 CG ARG A 354 15.163 20.096 10.806 1.00 45.24 C ATOM 785 CD ARG A 354 14.468 20.529 12.087 1.00 4.20 C ATOM 786 NE ARG A 354 14.434 19.459 13.080 1.00 4.34 N ATOM 787 CZ ARG A 354 14.081 19.643 14.347 1.00 3.31 C ATOM 788 NH1 ARG A 354 13.734 20.850 14.773 1.00 70.32 N1+ ATOM 789 NH2 ARG A 354 14.075 18.620 15.191 1.00 4.21 N ATOM 0 H ARG A 354 13.138 18.335 7.330 1.00 42.35 H new ATOM 0 HA ARG A 354 15.061 20.342 8.223 1.00 70.32 H new ATOM 0 HB2 ARG A 354 13.210 19.658 10.048 1.00 52.13 H new ATOM 0 HB3 ARG A 354 14.245 18.254 10.221 1.00 52.13 H new ATOM 0 HG2 ARG A 354 16.038 19.493 11.051 1.00 45.24 H new ATOM 0 HG3 ARG A 354 15.521 20.975 10.270 1.00 45.24 H new ATOM 0 HD2 ARG A 354 14.983 21.394 12.504 1.00 4.20 H new ATOM 0 HD3 ARG A 354 13.450 20.844 11.858 1.00 4.20 H new ATOM 0 HE ARG A 354 14.696 18.519 12.784 1.00 4.34 H new ATOM 0 HH11 ARG A 354 13.738 21.639 14.127 1.00 70.32 H new ATOM 0 HH12 ARG A 354 13.463 20.989 15.747 1.00 70.32 H new ATOM 0 HH21 ARG A 354 14.342 17.690 14.867 1.00 4.21 H new ATOM 0 HH22 ARG A 354 13.804 18.763 16.164 1.00 4.21 H new ATOM 803 N LYS A 355 16.765 18.333 8.663 1.00 33.30 N ATOM 804 CA LYS A 355 17.799 17.336 8.410 1.00 21.22 C ATOM 805 C LYS A 355 17.331 15.947 8.832 1.00 34.13 C ATOM 806 O LYS A 355 16.699 15.785 9.875 1.00 60.32 O ATOM 807 CB LYS A 355 19.083 17.703 9.159 1.00 63.32 C ATOM 808 CG LYS A 355 20.113 16.587 9.182 1.00 32.14 C ATOM 809 CD LYS A 355 20.016 15.765 10.457 1.00 71.43 C ATOM 810 CE LYS A 355 21.392 15.371 10.971 1.00 20.31 C ATOM 811 NZ LYS A 355 21.615 13.901 10.888 1.00 41.04 N1+ ATOM 0 H LYS A 355 17.035 19.062 9.324 1.00 33.30 H new ATOM 0 HA LYS A 355 18.001 17.322 7.339 1.00 21.22 H new ATOM 0 HB2 LYS A 355 19.525 18.585 8.695 1.00 63.32 H new ATOM 0 HB3 LYS A 355 18.831 17.975 10.184 1.00 63.32 H new ATOM 0 HG2 LYS A 355 19.968 15.939 8.318 1.00 32.14 H new ATOM 0 HG3 LYS A 355 21.113 17.012 9.097 1.00 32.14 H new ATOM 0 HD2 LYS A 355 19.491 16.338 11.221 1.00 71.43 H new ATOM 0 HD3 LYS A 355 19.426 14.868 10.269 1.00 71.43 H new ATOM 0 HE2 LYS A 355 22.158 15.888 10.392 1.00 20.31 H new ATOM 0 HE3 LYS A 355 21.500 15.697 12.005 1.00 20.31 H new ATOM 0 HZ1 LYS A 355 22.570 13.675 11.232 1.00 41.04 H new ATOM 0 HZ2 LYS A 355 20.911 13.409 11.474 1.00 41.04 H new ATOM 0 HZ3 LYS A 355 21.520 13.591 9.900 1.00 41.04 H new ATOM 825 N GLY A 356 17.647 14.947 8.015 1.00 41.20 N ATOM 826 CA GLY A 356 17.252 13.585 8.322 1.00 2.44 C ATOM 827 C GLY A 356 16.118 13.098 7.441 1.00 13.01 C ATOM 828 O GLY A 356 16.004 11.903 7.169 1.00 31.51 O ATOM 0 H GLY A 356 18.170 15.056 7.146 1.00 41.20 H new ATOM 0 HA2 GLY A 356 18.111 12.925 8.201 1.00 2.44 H new ATOM 0 HA3 GLY A 356 16.948 13.525 9.367 1.00 2.44 H new ATOM 832 N ASP A 357 15.277 14.025 6.997 1.00 2.03 N ATOM 833 CA ASP A 357 14.145 13.684 6.143 1.00 31.34 C ATOM 834 C ASP A 357 14.622 13.192 4.780 1.00 35.53 C ATOM 835 O ASP A 357 15.653 13.636 4.275 1.00 32.25 O ATOM 836 CB ASP A 357 13.227 14.895 5.969 1.00 54.11 C ATOM 837 CG ASP A 357 12.536 15.288 7.260 1.00 42.24 C ATOM 838 OD1 ASP A 357 11.764 14.464 7.795 1.00 42.23 O ATOM 839 OD2 ASP A 357 12.769 16.418 7.737 1.00 21.32 O1- ATOM 0 H ASP A 357 15.357 15.018 7.214 1.00 2.03 H new ATOM 0 HA ASP A 357 13.587 12.881 6.625 1.00 31.34 H new ATOM 0 HB2 ASP A 357 13.810 15.739 5.601 1.00 54.11 H new ATOM 0 HB3 ASP A 357 12.476 14.672 5.212 1.00 54.11 H new ATOM 844 N GLN A 358 13.865 12.272 4.191 1.00 31.32 N ATOM 845 CA GLN A 358 14.212 11.718 2.887 1.00 14.41 C ATOM 846 C GLN A 358 13.302 12.277 1.798 1.00 33.14 C ATOM 847 O GLN A 358 12.119 12.526 2.033 1.00 13.50 O ATOM 848 CB GLN A 358 14.115 10.192 2.915 1.00 63.45 C ATOM 849 CG GLN A 358 12.719 9.676 3.225 1.00 21.21 C ATOM 850 CD GLN A 358 12.407 8.374 2.514 1.00 43.34 C ATOM 851 OE1 GLN A 358 11.137 8.168 2.185 1.00 0.51 O flip ATOM 852 NE2 GLN A 358 13.298 7.561 2.263 1.00 15.43 N flip ATOM 0 H GLN A 358 13.008 11.895 4.595 1.00 31.32 H new ATOM 0 HA GLN A 358 15.239 12.006 2.660 1.00 14.41 H new ATOM 0 HB2 GLN A 358 14.433 9.798 1.949 1.00 63.45 H new ATOM 0 HB3 GLN A 358 14.810 9.806 3.661 1.00 63.45 H new ATOM 0 HG2 GLN A 358 12.620 9.531 4.301 1.00 21.21 H new ATOM 0 HG3 GLN A 358 11.985 10.428 2.936 1.00 21.21 H new ATOM 0 HE21 GLN A 358 14.261 7.760 2.534 1.00 15.43 H new ATOM 0 HE22 GLN A 358 13.073 6.689 1.784 1.00 15.43 H new ATOM 861 N ILE A 359 13.861 12.472 0.609 1.00 3.42 N ATOM 862 CA ILE A 359 13.098 13.001 -0.515 1.00 53.21 C ATOM 863 C ILE A 359 12.660 11.884 -1.456 1.00 34.53 C ATOM 864 O ILE A 359 13.482 11.095 -1.927 1.00 54.41 O ATOM 865 CB ILE A 359 13.914 14.037 -1.311 1.00 64.42 C ATOM 866 CG1 ILE A 359 14.496 15.092 -0.369 1.00 65.31 C ATOM 867 CG2 ILE A 359 13.046 14.690 -2.376 1.00 45.52 C ATOM 868 CD1 ILE A 359 13.450 15.812 0.452 1.00 15.24 C ATOM 0 H ILE A 359 14.839 12.272 0.399 1.00 3.42 H new ATOM 0 HA ILE A 359 12.217 13.488 -0.097 1.00 53.21 H new ATOM 0 HB ILE A 359 14.739 13.525 -1.807 1.00 64.42 H new ATOM 0 HG12 ILE A 359 15.208 14.614 0.303 1.00 65.31 H new ATOM 0 HG13 ILE A 359 15.053 15.823 -0.955 1.00 65.31 H new ATOM 0 HG21 ILE A 359 13.637 15.420 -2.930 1.00 45.52 H new ATOM 0 HG22 ILE A 359 12.676 13.928 -3.061 1.00 45.52 H new ATOM 0 HG23 ILE A 359 12.203 15.191 -1.901 1.00 45.52 H new ATOM 0 HD11 ILE A 359 13.935 16.545 1.097 1.00 15.24 H new ATOM 0 HD12 ILE A 359 12.751 16.319 -0.213 1.00 15.24 H new ATOM 0 HD13 ILE A 359 12.909 15.091 1.065 1.00 15.24 H new ATOM 880 N LEU A 360 11.362 11.823 -1.729 1.00 42.11 N ATOM 881 CA LEU A 360 10.813 10.803 -2.616 1.00 24.30 C ATOM 882 C LEU A 360 10.573 11.369 -4.013 1.00 30.12 C ATOM 883 O LEU A 360 10.919 10.743 -5.015 1.00 64.33 O ATOM 884 CB LEU A 360 9.506 10.251 -2.045 1.00 10.42 C ATOM 885 CG LEU A 360 9.630 9.417 -0.769 1.00 64.12 C ATOM 886 CD1 LEU A 360 9.781 10.320 0.446 1.00 41.24 C ATOM 887 CD2 LEU A 360 8.424 8.503 -0.610 1.00 13.33 C ATOM 0 H LEU A 360 10.669 12.468 -1.349 1.00 42.11 H new ATOM 0 HA LEU A 360 11.539 9.993 -2.691 1.00 24.30 H new ATOM 0 HB2 LEU A 360 8.838 11.089 -1.844 1.00 10.42 H new ATOM 0 HB3 LEU A 360 9.028 9.639 -2.810 1.00 10.42 H new ATOM 0 HG LEU A 360 10.523 8.797 -0.848 1.00 64.12 H new ATOM 0 HD11 LEU A 360 9.868 9.709 1.345 1.00 41.24 H new ATOM 0 HD12 LEU A 360 10.676 10.932 0.335 1.00 41.24 H new ATOM 0 HD13 LEU A 360 8.907 10.966 0.530 1.00 41.24 H new ATOM 0 HD21 LEU A 360 8.529 7.917 0.303 1.00 13.33 H new ATOM 0 HD22 LEU A 360 7.517 9.104 -0.553 1.00 13.33 H new ATOM 0 HD23 LEU A 360 8.361 7.832 -1.466 1.00 13.33 H new ATOM 899 N SER A 361 9.979 12.556 -4.070 1.00 73.14 N ATOM 900 CA SER A 361 9.690 13.206 -5.343 1.00 44.34 C ATOM 901 C SER A 361 9.585 14.718 -5.170 1.00 14.03 C ATOM 902 O SER A 361 9.231 15.209 -4.098 1.00 33.25 O ATOM 903 CB SER A 361 8.391 12.657 -5.937 1.00 63.41 C ATOM 904 OG SER A 361 8.211 11.293 -5.597 1.00 41.10 O ATOM 0 H SER A 361 9.688 13.088 -3.249 1.00 73.14 H new ATOM 0 HA SER A 361 10.512 12.993 -6.026 1.00 44.34 H new ATOM 0 HB2 SER A 361 7.546 13.241 -5.572 1.00 63.41 H new ATOM 0 HB3 SER A 361 8.409 12.765 -7.021 1.00 63.41 H new ATOM 0 HG SER A 361 7.373 10.966 -5.987 1.00 41.10 H new ATOM 910 N VAL A 362 9.895 15.452 -6.234 1.00 44.44 N ATOM 911 CA VAL A 362 9.835 16.908 -6.202 1.00 13.10 C ATOM 912 C VAL A 362 9.032 17.452 -7.379 1.00 35.44 C ATOM 913 O VAL A 362 9.280 17.094 -8.530 1.00 52.21 O ATOM 914 CB VAL A 362 11.244 17.529 -6.226 1.00 42.40 C ATOM 915 CG1 VAL A 362 12.018 17.145 -4.974 1.00 40.30 C ATOM 916 CG2 VAL A 362 11.993 17.101 -7.479 1.00 70.40 C ATOM 0 H VAL A 362 10.190 15.062 -7.129 1.00 44.44 H new ATOM 0 HA VAL A 362 9.340 17.183 -5.270 1.00 13.10 H new ATOM 0 HB VAL A 362 11.144 18.614 -6.243 1.00 42.40 H new ATOM 0 HG11 VAL A 362 13.011 17.593 -5.009 1.00 40.30 H new ATOM 0 HG12 VAL A 362 11.487 17.506 -4.093 1.00 40.30 H new ATOM 0 HG13 VAL A 362 12.111 16.060 -4.922 1.00 40.30 H new ATOM 0 HG21 VAL A 362 12.987 17.549 -7.480 1.00 70.40 H new ATOM 0 HG22 VAL A 362 12.084 16.015 -7.495 1.00 70.40 H new ATOM 0 HG23 VAL A 362 11.445 17.432 -8.361 1.00 70.40 H new ATOM 926 N ASN A 363 8.069 18.318 -7.082 1.00 72.14 N ATOM 927 CA ASN A 363 7.229 18.911 -8.116 1.00 0.44 C ATOM 928 C ASN A 363 6.778 17.857 -9.122 1.00 33.34 C ATOM 929 O ASN A 363 6.638 18.138 -10.311 1.00 75.01 O ATOM 930 CB ASN A 363 7.985 20.030 -8.837 1.00 61.50 C ATOM 931 CG ASN A 363 9.149 19.506 -9.655 1.00 70.41 C ATOM 932 OD1 ASN A 363 10.344 19.550 -9.078 1.00 34.34 O flip ATOM 933 ND2 ASN A 363 8.976 19.068 -10.792 1.00 52.13 N flip ATOM 0 H ASN A 363 7.851 18.625 -6.134 1.00 72.14 H new ATOM 0 HA ASN A 363 6.345 19.330 -7.635 1.00 0.44 H new ATOM 0 HB2 ASN A 363 7.298 20.567 -9.491 1.00 61.50 H new ATOM 0 HB3 ASN A 363 8.353 20.747 -8.104 1.00 61.50 H new ATOM 0 HD21 ASN A 363 8.039 19.053 -11.196 1.00 52.13 H new ATOM 0 HD22 ASN A 363 9.769 18.720 -11.330 1.00 52.13 H new ATOM 940 N GLY A 364 6.552 16.640 -8.635 1.00 23.21 N ATOM 941 CA GLY A 364 6.119 15.562 -9.504 1.00 2.53 C ATOM 942 C GLY A 364 7.213 14.543 -9.753 1.00 24.34 C ATOM 943 O GLY A 364 7.140 13.412 -9.273 1.00 32.33 O ATOM 0 H GLY A 364 6.661 16.382 -7.654 1.00 23.21 H new ATOM 0 HA2 GLY A 364 5.258 15.064 -9.059 1.00 2.53 H new ATOM 0 HA3 GLY A 364 5.790 15.977 -10.457 1.00 2.53 H new ATOM 947 N VAL A 365 8.232 14.943 -10.508 1.00 54.34 N ATOM 948 CA VAL A 365 9.346 14.056 -10.820 1.00 44.21 C ATOM 949 C VAL A 365 9.877 13.376 -9.563 1.00 0.31 C ATOM 950 O VAL A 365 10.129 14.029 -8.551 1.00 64.42 O ATOM 951 CB VAL A 365 10.497 14.820 -11.502 1.00 22.21 C ATOM 952 CG1 VAL A 365 10.109 15.218 -12.918 1.00 2.33 C ATOM 953 CG2 VAL A 365 10.884 16.042 -10.683 1.00 41.10 C ATOM 0 H VAL A 365 8.309 15.875 -10.915 1.00 54.34 H new ATOM 0 HA VAL A 365 8.965 13.299 -11.505 1.00 44.21 H new ATOM 0 HB VAL A 365 11.363 14.161 -11.560 1.00 22.21 H new ATOM 0 HG11 VAL A 365 10.934 15.757 -13.384 1.00 2.33 H new ATOM 0 HG12 VAL A 365 9.886 14.323 -13.499 1.00 2.33 H new ATOM 0 HG13 VAL A 365 9.228 15.860 -12.887 1.00 2.33 H new ATOM 0 HG21 VAL A 365 11.698 16.570 -11.179 1.00 41.10 H new ATOM 0 HG22 VAL A 365 10.024 16.706 -10.591 1.00 41.10 H new ATOM 0 HG23 VAL A 365 11.207 15.727 -9.691 1.00 41.10 H new ATOM 963 N ASP A 366 10.045 12.060 -9.636 1.00 45.41 N ATOM 964 CA ASP A 366 10.547 11.290 -8.504 1.00 55.34 C ATOM 965 C ASP A 366 12.071 11.331 -8.452 1.00 23.21 C ATOM 966 O ASP A 366 12.743 11.132 -9.465 1.00 43.44 O ATOM 967 CB ASP A 366 10.067 9.841 -8.592 1.00 11.51 C ATOM 968 CG ASP A 366 10.283 9.242 -9.968 1.00 42.00 C ATOM 969 OD1 ASP A 366 9.281 8.982 -10.666 1.00 64.02 O ATOM 970 OD2 ASP A 366 11.454 9.034 -10.346 1.00 61.22 O1- ATOM 0 H ASP A 366 9.841 11.505 -10.467 1.00 45.41 H new ATOM 0 HA ASP A 366 10.158 11.739 -7.590 1.00 55.34 H new ATOM 0 HB2 ASP A 366 10.595 9.241 -7.851 1.00 11.51 H new ATOM 0 HB3 ASP A 366 9.007 9.797 -8.342 1.00 11.51 H new ATOM 975 N LEU A 367 12.611 11.592 -7.267 1.00 23.41 N ATOM 976 CA LEU A 367 14.056 11.660 -7.082 1.00 3.23 C ATOM 977 C LEU A 367 14.546 10.526 -6.188 1.00 43.21 C ATOM 978 O LEU A 367 15.505 10.687 -5.434 1.00 4.41 O ATOM 979 CB LEU A 367 14.450 13.009 -6.477 1.00 71.32 C ATOM 980 CG LEU A 367 14.718 14.139 -7.471 1.00 54.14 C ATOM 981 CD1 LEU A 367 13.595 14.229 -8.492 1.00 61.24 C ATOM 982 CD2 LEU A 367 14.885 15.463 -6.741 1.00 25.52 C ATOM 0 H LEU A 367 12.069 11.760 -6.419 1.00 23.41 H new ATOM 0 HA LEU A 367 14.527 11.556 -8.059 1.00 3.23 H new ATOM 0 HB2 LEU A 367 13.656 13.327 -5.802 1.00 71.32 H new ATOM 0 HB3 LEU A 367 15.345 12.865 -5.871 1.00 71.32 H new ATOM 0 HG LEU A 367 15.645 13.919 -8.000 1.00 54.14 H new ATOM 0 HD11 LEU A 367 13.803 15.039 -9.191 1.00 61.24 H new ATOM 0 HD12 LEU A 367 13.523 13.288 -9.038 1.00 61.24 H new ATOM 0 HD13 LEU A 367 12.653 14.425 -7.980 1.00 61.24 H new ATOM 0 HD21 LEU A 367 15.075 16.256 -7.464 1.00 25.52 H new ATOM 0 HD22 LEU A 367 13.975 15.689 -6.185 1.00 25.52 H new ATOM 0 HD23 LEU A 367 15.725 15.394 -6.050 1.00 25.52 H new ATOM 994 N ARG A 368 13.882 9.379 -6.279 1.00 1.50 N ATOM 995 CA ARG A 368 14.250 8.217 -5.479 1.00 24.01 C ATOM 996 C ARG A 368 15.591 7.647 -5.932 1.00 51.02 C ATOM 997 O ARG A 368 16.378 7.164 -5.119 1.00 12.14 O ATOM 998 CB ARG A 368 13.167 7.140 -5.577 1.00 72.51 C ATOM 999 CG ARG A 368 12.116 7.233 -4.484 1.00 14.40 C ATOM 1000 CD ARG A 368 11.510 5.872 -4.176 1.00 25.41 C ATOM 1001 NE ARG A 368 10.761 5.877 -2.923 1.00 72.33 N ATOM 1002 CZ ARG A 368 10.262 4.782 -2.360 1.00 42.12 C ATOM 1003 NH1 ARG A 368 10.433 3.600 -2.937 1.00 61.33 N1+ ATOM 1004 NH2 ARG A 368 9.592 4.867 -1.218 1.00 65.51 N ATOM 0 H ARG A 368 13.086 9.229 -6.899 1.00 1.50 H new ATOM 0 HA ARG A 368 14.343 8.537 -4.441 1.00 24.01 H new ATOM 0 HB2 ARG A 368 12.677 7.216 -6.548 1.00 72.51 H new ATOM 0 HB3 ARG A 368 13.638 6.158 -5.534 1.00 72.51 H new ATOM 0 HG2 ARG A 368 12.565 7.646 -3.580 1.00 14.40 H new ATOM 0 HG3 ARG A 368 11.329 7.922 -4.792 1.00 14.40 H new ATOM 0 HD2 ARG A 368 10.850 5.576 -4.992 1.00 25.41 H new ATOM 0 HD3 ARG A 368 12.303 5.126 -4.121 1.00 25.41 H new ATOM 0 HE ARG A 368 10.613 6.770 -2.454 1.00 72.33 H new ATOM 0 HH11 ARG A 368 10.948 3.531 -3.814 1.00 61.33 H new ATOM 0 HH12 ARG A 368 10.049 2.760 -2.503 1.00 61.33 H new ATOM 0 HH21 ARG A 368 9.459 5.774 -0.771 1.00 65.51 H new ATOM 0 HH22 ARG A 368 9.210 4.025 -0.787 1.00 65.51 H new ATOM 1018 N ASN A 369 15.844 7.708 -7.236 1.00 74.53 N ATOM 1019 CA ASN A 369 17.089 7.198 -7.797 1.00 42.03 C ATOM 1020 C ASN A 369 17.856 8.304 -8.514 1.00 1.52 C ATOM 1021 O ASN A 369 18.612 8.044 -9.450 1.00 2.15 O ATOM 1022 CB ASN A 369 16.803 6.049 -8.767 1.00 63.03 C ATOM 1023 CG ASN A 369 16.287 4.811 -8.060 1.00 51.31 C ATOM 1024 OD1 ASN A 369 17.032 4.128 -7.358 1.00 4.11 O ATOM 1025 ND2 ASN A 369 15.005 4.516 -8.244 1.00 23.10 N ATOM 0 H ASN A 369 15.203 8.105 -7.923 1.00 74.53 H new ATOM 0 HA ASN A 369 17.703 6.828 -6.976 1.00 42.03 H new ATOM 0 HB2 ASN A 369 16.070 6.374 -9.505 1.00 63.03 H new ATOM 0 HB3 ASN A 369 17.715 5.800 -9.310 1.00 63.03 H new ATOM 0 HD21 ASN A 369 14.601 3.694 -7.794 1.00 23.10 H new ATOM 0 HD22 ASN A 369 14.424 5.111 -8.835 1.00 23.10 H new ATOM 1032 N ALA A 370 17.657 9.540 -8.068 1.00 31.21 N ATOM 1033 CA ALA A 370 18.332 10.686 -8.665 1.00 64.50 C ATOM 1034 C ALA A 370 19.647 10.981 -7.952 1.00 70.32 C ATOM 1035 O ALA A 370 19.696 11.053 -6.724 1.00 51.14 O ATOM 1036 CB ALA A 370 17.425 11.908 -8.632 1.00 32.21 C ATOM 0 H ALA A 370 17.034 9.773 -7.295 1.00 31.21 H new ATOM 0 HA ALA A 370 18.559 10.443 -9.703 1.00 64.50 H new ATOM 0 HB1 ALA A 370 17.941 12.757 -9.081 1.00 32.21 H new ATOM 0 HB2 ALA A 370 16.514 11.700 -9.193 1.00 32.21 H new ATOM 0 HB3 ALA A 370 17.170 12.144 -7.599 1.00 32.21 H new ATOM 1042 N SER A 371 20.711 11.151 -8.729 1.00 31.44 N ATOM 1043 CA SER A 371 22.028 11.434 -8.171 1.00 64.13 C ATOM 1044 C SER A 371 21.996 12.697 -7.315 1.00 2.51 C ATOM 1045 O SER A 371 20.964 13.360 -7.206 1.00 64.12 O ATOM 1046 CB SER A 371 23.058 11.591 -9.293 1.00 43.24 C ATOM 1047 OG SER A 371 23.205 12.951 -9.663 1.00 14.45 O ATOM 0 H SER A 371 20.687 11.098 -9.747 1.00 31.44 H new ATOM 0 HA SER A 371 22.315 10.594 -7.538 1.00 64.13 H new ATOM 0 HB2 SER A 371 24.019 11.194 -8.967 1.00 43.24 H new ATOM 0 HB3 SER A 371 22.749 11.006 -10.159 1.00 43.24 H new ATOM 0 HG SER A 371 23.602 13.006 -10.557 1.00 14.45 H new ATOM 1053 N HIS A 372 23.133 13.023 -6.710 1.00 13.42 N ATOM 1054 CA HIS A 372 23.236 14.206 -5.863 1.00 72.30 C ATOM 1055 C HIS A 372 22.934 15.472 -6.659 1.00 51.12 C ATOM 1056 O HIS A 372 22.069 16.261 -6.281 1.00 25.34 O ATOM 1057 CB HIS A 372 24.633 14.298 -5.248 1.00 62.22 C ATOM 1058 CG HIS A 372 24.855 15.546 -4.450 1.00 12.23 C ATOM 1059 ND1 HIS A 372 26.108 16.043 -4.162 1.00 21.24 N ATOM 1060 CD2 HIS A 372 23.973 16.400 -3.879 1.00 43.11 C ATOM 1061 CE1 HIS A 372 25.988 17.148 -3.447 1.00 65.31 C ATOM 1062 NE2 HIS A 372 24.703 17.387 -3.262 1.00 11.35 N ATOM 0 H HIS A 372 23.996 12.485 -6.790 1.00 13.42 H new ATOM 0 HA HIS A 372 22.500 14.116 -5.064 1.00 72.30 H new ATOM 0 HB2 HIS A 372 24.796 13.432 -4.606 1.00 62.22 H new ATOM 0 HB3 HIS A 372 25.376 14.249 -6.044 1.00 62.22 H new ATOM 0 HD2 HIS A 372 22.896 16.320 -3.904 1.00 43.11 H new ATOM 0 HE1 HIS A 372 26.803 17.753 -3.077 1.00 65.31 H new ATOM 0 HE2 HIS A 372 24.315 18.176 -2.745 1.00 11.35 H new ATOM 1070 N GLU A 373 23.653 15.658 -7.762 1.00 22.51 N ATOM 1071 CA GLU A 373 23.461 16.829 -8.609 1.00 2.13 C ATOM 1072 C GLU A 373 22.147 16.734 -9.380 1.00 53.21 C ATOM 1073 O GLU A 373 21.481 17.741 -9.616 1.00 42.43 O ATOM 1074 CB GLU A 373 24.629 16.975 -9.587 1.00 65.41 C ATOM 1075 CG GLU A 373 24.715 15.851 -10.605 1.00 44.41 C ATOM 1076 CD GLU A 373 26.012 15.874 -11.391 1.00 74.21 C ATOM 1077 OE1 GLU A 373 26.054 15.272 -12.484 1.00 34.15 O ATOM 1078 OE2 GLU A 373 26.984 16.495 -10.913 1.00 3.22 O1- ATOM 0 H GLU A 373 24.373 15.013 -8.089 1.00 22.51 H new ATOM 0 HA GLU A 373 23.422 17.708 -7.966 1.00 2.13 H new ATOM 0 HB2 GLU A 373 24.534 17.924 -10.114 1.00 65.41 H new ATOM 0 HB3 GLU A 373 25.561 17.015 -9.023 1.00 65.41 H new ATOM 0 HG2 GLU A 373 24.622 14.894 -10.092 1.00 44.41 H new ATOM 0 HG3 GLU A 373 23.875 15.926 -11.295 1.00 44.41 H new ATOM 1085 N GLN A 374 21.784 15.516 -9.769 1.00 71.21 N ATOM 1086 CA GLN A 374 20.551 15.289 -10.514 1.00 65.41 C ATOM 1087 C GLN A 374 19.351 15.867 -9.771 1.00 42.21 C ATOM 1088 O GLN A 374 18.413 16.373 -10.386 1.00 30.25 O ATOM 1089 CB GLN A 374 20.344 13.793 -10.756 1.00 11.04 C ATOM 1090 CG GLN A 374 20.867 13.315 -12.101 1.00 24.33 C ATOM 1091 CD GLN A 374 20.194 14.009 -13.268 1.00 24.55 C ATOM 1092 OE1 GLN A 374 18.967 14.044 -13.361 1.00 13.43 O ATOM 1093 NE2 GLN A 374 20.996 14.566 -14.168 1.00 72.25 N ATOM 0 H GLN A 374 22.325 14.672 -9.581 1.00 71.21 H new ATOM 0 HA GLN A 374 20.639 15.796 -11.475 1.00 65.41 H new ATOM 0 HB2 GLN A 374 20.840 13.233 -9.963 1.00 11.04 H new ATOM 0 HB3 GLN A 374 19.280 13.566 -10.688 1.00 11.04 H new ATOM 0 HG2 GLN A 374 21.942 13.488 -12.151 1.00 24.33 H new ATOM 0 HG3 GLN A 374 20.713 12.239 -12.185 1.00 24.33 H new ATOM 0 HE21 GLN A 374 22.008 14.513 -14.051 1.00 72.25 H new ATOM 0 HE22 GLN A 374 20.600 15.047 -14.976 1.00 72.25 H new ATOM 1102 N ALA A 375 19.389 15.788 -8.445 1.00 54.24 N ATOM 1103 CA ALA A 375 18.306 16.305 -7.618 1.00 42.42 C ATOM 1104 C ALA A 375 18.238 17.826 -7.690 1.00 35.42 C ATOM 1105 O ALA A 375 17.155 18.407 -7.752 1.00 11.04 O ATOM 1106 CB ALA A 375 18.479 15.849 -6.176 1.00 54.24 C ATOM 0 H ALA A 375 20.158 15.371 -7.921 1.00 54.24 H new ATOM 0 HA ALA A 375 17.367 15.908 -8.003 1.00 42.42 H new ATOM 0 HB1 ALA A 375 17.663 16.242 -5.570 1.00 54.24 H new ATOM 0 HB2 ALA A 375 18.469 14.760 -6.135 1.00 54.24 H new ATOM 0 HB3 ALA A 375 19.429 16.218 -5.789 1.00 54.24 H new ATOM 1112 N ALA A 376 19.402 18.467 -7.679 1.00 12.04 N ATOM 1113 CA ALA A 376 19.475 19.921 -7.745 1.00 21.41 C ATOM 1114 C ALA A 376 18.816 20.447 -9.015 1.00 60.15 C ATOM 1115 O ALA A 376 18.213 21.521 -9.014 1.00 2.42 O ATOM 1116 CB ALA A 376 20.923 20.381 -7.670 1.00 73.42 C ATOM 0 H ALA A 376 20.308 18.002 -7.625 1.00 12.04 H new ATOM 0 HA ALA A 376 18.932 20.326 -6.891 1.00 21.41 H new ATOM 0 HB1 ALA A 376 20.962 21.469 -7.720 1.00 73.42 H new ATOM 0 HB2 ALA A 376 21.363 20.045 -6.731 1.00 73.42 H new ATOM 0 HB3 ALA A 376 21.483 19.959 -8.505 1.00 73.42 H new ATOM 1122 N ILE A 377 18.936 19.685 -10.097 1.00 13.30 N ATOM 1123 CA ILE A 377 18.351 20.076 -11.374 1.00 53.01 C ATOM 1124 C ILE A 377 16.843 20.267 -11.253 1.00 53.41 C ATOM 1125 O ILE A 377 16.276 21.194 -11.830 1.00 0.34 O ATOM 1126 CB ILE A 377 18.638 19.030 -12.468 1.00 1.12 C ATOM 1127 CG1 ILE A 377 19.952 19.355 -13.182 1.00 51.02 C ATOM 1128 CG2 ILE A 377 17.488 18.974 -13.462 1.00 35.03 C ATOM 1129 CD1 ILE A 377 21.087 19.685 -12.238 1.00 10.32 C ATOM 0 H ILE A 377 19.432 18.794 -10.115 1.00 13.30 H new ATOM 0 HA ILE A 377 18.813 21.022 -11.656 1.00 53.01 H new ATOM 0 HB ILE A 377 18.734 18.051 -11.998 1.00 1.12 H new ATOM 0 HG12 ILE A 377 20.240 18.505 -13.800 1.00 51.02 H new ATOM 0 HG13 ILE A 377 19.792 20.198 -13.854 1.00 51.02 H new ATOM 0 HG21 ILE A 377 17.706 18.230 -14.229 1.00 35.03 H new ATOM 0 HG22 ILE A 377 16.570 18.701 -12.942 1.00 35.03 H new ATOM 0 HG23 ILE A 377 17.363 19.951 -13.929 1.00 35.03 H new ATOM 0 HD11 ILE A 377 21.986 19.905 -12.813 1.00 10.32 H new ATOM 0 HD12 ILE A 377 20.819 20.554 -11.637 1.00 10.32 H new ATOM 0 HD13 ILE A 377 21.274 18.834 -11.583 1.00 10.32 H new ATOM 1141 N ALA A 378 16.199 19.383 -10.497 1.00 23.43 N ATOM 1142 CA ALA A 378 14.757 19.457 -10.296 1.00 51.44 C ATOM 1143 C ALA A 378 14.385 20.651 -9.424 1.00 52.25 C ATOM 1144 O ALA A 378 13.346 21.281 -9.628 1.00 11.13 O ATOM 1145 CB ALA A 378 14.245 18.166 -9.673 1.00 31.34 C ATOM 0 H ALA A 378 16.653 18.608 -10.014 1.00 23.43 H new ATOM 0 HA ALA A 378 14.285 19.591 -11.269 1.00 51.44 H new ATOM 0 HB1 ALA A 378 13.167 18.234 -9.528 1.00 31.34 H new ATOM 0 HB2 ALA A 378 14.470 17.329 -10.334 1.00 31.34 H new ATOM 0 HB3 ALA A 378 14.731 18.009 -8.710 1.00 31.34 H new ATOM 1151 N LEU A 379 15.237 20.958 -8.453 1.00 14.45 N ATOM 1152 CA LEU A 379 14.997 22.077 -7.549 1.00 25.33 C ATOM 1153 C LEU A 379 15.244 23.408 -8.252 1.00 24.21 C ATOM 1154 O LEU A 379 14.543 24.391 -8.010 1.00 40.23 O ATOM 1155 CB LEU A 379 15.895 21.965 -6.316 1.00 74.04 C ATOM 1156 CG LEU A 379 15.732 20.695 -5.480 1.00 71.11 C ATOM 1157 CD1 LEU A 379 16.830 20.601 -4.432 1.00 65.34 C ATOM 1158 CD2 LEU A 379 14.360 20.662 -4.822 1.00 64.42 C ATOM 0 H LEU A 379 16.101 20.447 -8.271 1.00 14.45 H new ATOM 0 HA LEU A 379 13.954 22.040 -7.235 1.00 25.33 H new ATOM 0 HB2 LEU A 379 16.933 22.032 -6.640 1.00 74.04 H new ATOM 0 HB3 LEU A 379 15.706 22.825 -5.674 1.00 74.04 H new ATOM 0 HG LEU A 379 15.816 19.834 -6.143 1.00 71.11 H new ATOM 0 HD11 LEU A 379 16.698 19.691 -3.847 1.00 65.34 H new ATOM 0 HD12 LEU A 379 17.802 20.577 -4.925 1.00 65.34 H new ATOM 0 HD13 LEU A 379 16.778 21.467 -3.772 1.00 65.34 H new ATOM 0 HD21 LEU A 379 14.262 19.751 -4.231 1.00 64.42 H new ATOM 0 HD22 LEU A 379 14.247 21.530 -4.172 1.00 64.42 H new ATOM 0 HD23 LEU A 379 13.587 20.681 -5.591 1.00 64.42 H new ATOM 1170 N LYS A 380 16.244 23.432 -9.127 1.00 52.32 N ATOM 1171 CA LYS A 380 16.582 24.640 -9.870 1.00 51.01 C ATOM 1172 C LYS A 380 15.435 25.056 -10.784 1.00 22.42 C ATOM 1173 O LYS A 380 15.104 26.237 -10.883 1.00 72.12 O ATOM 1174 CB LYS A 380 17.851 24.417 -10.696 1.00 71.44 C ATOM 1175 CG LYS A 380 18.175 25.566 -11.635 1.00 11.03 C ATOM 1176 CD LYS A 380 19.433 25.289 -12.441 1.00 42.12 C ATOM 1177 CE LYS A 380 19.375 25.949 -13.810 1.00 13.01 C ATOM 1178 NZ LYS A 380 19.541 27.427 -13.721 1.00 32.14 N1+ ATOM 0 H LYS A 380 16.835 22.628 -9.339 1.00 52.32 H new ATOM 0 HA LYS A 380 16.759 25.440 -9.152 1.00 51.01 H new ATOM 0 HB2 LYS A 380 18.692 24.263 -10.020 1.00 71.44 H new ATOM 0 HB3 LYS A 380 17.739 23.503 -11.279 1.00 71.44 H new ATOM 0 HG2 LYS A 380 17.337 25.731 -12.312 1.00 11.03 H new ATOM 0 HG3 LYS A 380 18.305 26.482 -11.059 1.00 11.03 H new ATOM 0 HD2 LYS A 380 20.303 25.655 -11.896 1.00 42.12 H new ATOM 0 HD3 LYS A 380 19.561 24.213 -12.560 1.00 42.12 H new ATOM 0 HE2 LYS A 380 20.156 25.534 -14.447 1.00 13.01 H new ATOM 0 HE3 LYS A 380 18.421 25.719 -14.284 1.00 13.01 H new ATOM 0 HZ1 LYS A 380 19.496 27.839 -14.675 1.00 32.14 H new ATOM 0 HZ2 LYS A 380 18.781 27.827 -13.134 1.00 32.14 H new ATOM 0 HZ3 LYS A 380 20.462 27.648 -13.292 1.00 32.14 H new ATOM 1192 N ASN A 381 14.830 24.078 -11.451 1.00 71.53 N ATOM 1193 CA ASN A 381 13.719 24.343 -12.356 1.00 61.53 C ATOM 1194 C ASN A 381 12.382 24.185 -11.638 1.00 53.30 C ATOM 1195 O ASN A 381 11.338 24.037 -12.273 1.00 24.44 O ATOM 1196 CB ASN A 381 13.778 23.400 -13.560 1.00 43.53 C ATOM 1197 CG ASN A 381 15.201 23.116 -14.002 1.00 21.05 C ATOM 1198 OD1 ASN A 381 16.060 23.997 -13.974 1.00 71.43 O ATOM 1199 ND2 ASN A 381 15.457 21.879 -14.412 1.00 43.54 N ATOM 0 H ASN A 381 15.091 23.095 -11.381 1.00 71.53 H new ATOM 0 HA ASN A 381 13.805 25.372 -12.704 1.00 61.53 H new ATOM 0 HB2 ASN A 381 13.285 22.461 -13.308 1.00 43.53 H new ATOM 0 HB3 ASN A 381 13.223 23.839 -14.389 1.00 43.53 H new ATOM 0 HD21 ASN A 381 16.396 21.628 -14.720 1.00 43.54 H new ATOM 0 HD22 ASN A 381 14.714 21.180 -14.419 1.00 43.54 H new ATOM 1206 N ALA A 382 12.423 24.216 -10.310 1.00 14.22 N ATOM 1207 CA ALA A 382 11.215 24.079 -9.505 1.00 5.40 C ATOM 1208 C ALA A 382 10.136 25.054 -9.964 1.00 61.32 C ATOM 1209 O ALA A 382 9.040 24.647 -10.347 1.00 52.51 O ATOM 1210 CB ALA A 382 11.534 24.296 -8.034 1.00 75.24 C ATOM 0 H ALA A 382 13.279 24.335 -9.769 1.00 14.22 H new ATOM 0 HA ALA A 382 10.833 23.067 -9.637 1.00 5.40 H new ATOM 0 HB1 ALA A 382 10.623 24.191 -7.445 1.00 75.24 H new ATOM 0 HB2 ALA A 382 12.265 23.556 -7.707 1.00 75.24 H new ATOM 0 HB3 ALA A 382 11.943 25.297 -7.894 1.00 75.24 H new ATOM 1216 N GLY A 383 10.454 26.345 -9.922 1.00 51.03 N ATOM 1217 CA GLY A 383 9.500 27.357 -10.335 1.00 61.22 C ATOM 1218 C GLY A 383 9.007 28.198 -9.174 1.00 61.51 C ATOM 1219 O GLY A 383 9.796 28.627 -8.333 1.00 44.22 O ATOM 0 H GLY A 383 11.355 26.707 -9.609 1.00 51.03 H new ATOM 0 HA2 GLY A 383 9.963 28.006 -11.079 1.00 61.22 H new ATOM 0 HA3 GLY A 383 8.650 26.875 -10.817 1.00 61.22 H new ATOM 1223 N GLN A 384 7.700 28.435 -9.130 1.00 54.13 N ATOM 1224 CA GLN A 384 7.105 29.232 -8.064 1.00 12.05 C ATOM 1225 C GLN A 384 6.995 28.424 -6.776 1.00 51.43 C ATOM 1226 O GLN A 384 7.123 28.965 -5.677 1.00 12.44 O ATOM 1227 CB GLN A 384 5.722 29.733 -8.485 1.00 0.14 C ATOM 1228 CG GLN A 384 4.957 30.420 -7.366 1.00 50.22 C ATOM 1229 CD GLN A 384 3.559 30.833 -7.782 1.00 33.10 C ATOM 1230 OE1 GLN A 384 3.157 30.636 -8.929 1.00 1.44 O ATOM 1231 NE2 GLN A 384 2.809 31.409 -6.850 1.00 74.34 N ATOM 0 H GLN A 384 7.034 28.087 -9.819 1.00 54.13 H new ATOM 0 HA GLN A 384 7.754 30.088 -7.880 1.00 12.05 H new ATOM 0 HB2 GLN A 384 5.834 30.428 -9.317 1.00 0.14 H new ATOM 0 HB3 GLN A 384 5.135 28.890 -8.851 1.00 0.14 H new ATOM 0 HG2 GLN A 384 4.894 29.749 -6.509 1.00 50.22 H new ATOM 0 HG3 GLN A 384 5.510 31.301 -7.041 1.00 50.22 H new ATOM 0 HE21 GLN A 384 3.182 31.553 -5.912 1.00 74.34 H new ATOM 0 HE22 GLN A 384 1.859 31.708 -7.072 1.00 74.34 H new ATOM 1240 N THR A 385 6.756 27.124 -6.917 1.00 2.34 N ATOM 1241 CA THR A 385 6.627 26.241 -5.765 1.00 2.15 C ATOM 1242 C THR A 385 6.918 24.794 -6.146 1.00 62.43 C ATOM 1243 O THR A 385 6.507 24.326 -7.208 1.00 3.14 O ATOM 1244 CB THR A 385 5.218 26.323 -5.149 1.00 3.33 C ATOM 1245 OG1 THR A 385 4.935 27.669 -4.751 1.00 13.00 O ATOM 1246 CG2 THR A 385 5.097 25.398 -3.947 1.00 52.23 C ATOM 0 H THR A 385 6.648 26.659 -7.819 1.00 2.34 H new ATOM 0 HA THR A 385 7.358 26.575 -5.028 1.00 2.15 H new ATOM 0 HB THR A 385 4.497 26.008 -5.904 1.00 3.33 H new ATOM 0 HG1 THR A 385 4.037 27.713 -4.362 1.00 13.00 H new ATOM 0 HG21 THR A 385 4.093 25.474 -3.529 1.00 52.23 H new ATOM 0 HG22 THR A 385 5.284 24.370 -4.258 1.00 52.23 H new ATOM 0 HG23 THR A 385 5.827 25.686 -3.191 1.00 52.23 H new ATOM 1254 N VAL A 386 7.631 24.089 -5.273 1.00 15.40 N ATOM 1255 CA VAL A 386 7.976 22.693 -5.517 1.00 22.21 C ATOM 1256 C VAL A 386 7.490 21.800 -4.381 1.00 3.40 C ATOM 1257 O VAL A 386 7.848 22.003 -3.220 1.00 54.32 O ATOM 1258 CB VAL A 386 9.496 22.512 -5.684 1.00 1.11 C ATOM 1259 CG1 VAL A 386 10.239 23.120 -4.505 1.00 31.41 C ATOM 1260 CG2 VAL A 386 9.843 21.039 -5.841 1.00 71.42 C ATOM 0 H VAL A 386 7.981 24.462 -4.390 1.00 15.40 H new ATOM 0 HA VAL A 386 7.479 22.401 -6.442 1.00 22.21 H new ATOM 0 HB VAL A 386 9.809 23.034 -6.588 1.00 1.11 H new ATOM 0 HG11 VAL A 386 11.312 22.982 -4.641 1.00 31.41 H new ATOM 0 HG12 VAL A 386 10.015 24.185 -4.444 1.00 31.41 H new ATOM 0 HG13 VAL A 386 9.924 22.629 -3.584 1.00 31.41 H new ATOM 0 HG21 VAL A 386 10.921 20.930 -5.958 1.00 71.42 H new ATOM 0 HG22 VAL A 386 9.517 20.492 -4.956 1.00 71.42 H new ATOM 0 HG23 VAL A 386 9.340 20.639 -6.721 1.00 71.42 H new ATOM 1270 N THR A 387 6.673 20.809 -4.723 1.00 33.22 N ATOM 1271 CA THR A 387 6.137 19.884 -3.732 1.00 41.44 C ATOM 1272 C THR A 387 7.124 18.759 -3.441 1.00 42.03 C ATOM 1273 O THR A 387 7.291 17.843 -4.247 1.00 22.24 O ATOM 1274 CB THR A 387 4.802 19.273 -4.198 1.00 55.24 C ATOM 1275 OG1 THR A 387 5.016 18.450 -5.351 1.00 41.04 O ATOM 1276 CG2 THR A 387 3.794 20.363 -4.527 1.00 53.15 C ATOM 0 H THR A 387 6.368 20.626 -5.679 1.00 33.22 H new ATOM 0 HA THR A 387 5.966 20.459 -2.822 1.00 41.44 H new ATOM 0 HB THR A 387 4.403 18.664 -3.386 1.00 55.24 H new ATOM 0 HG1 THR A 387 5.872 17.982 -5.264 1.00 41.04 H new ATOM 0 HG21 THR A 387 2.859 19.907 -4.854 1.00 53.15 H new ATOM 0 HG22 THR A 387 3.612 20.970 -3.640 1.00 53.15 H new ATOM 0 HG23 THR A 387 4.188 20.994 -5.324 1.00 53.15 H new ATOM 1284 N ILE A 388 7.773 18.832 -2.284 1.00 62.03 N ATOM 1285 CA ILE A 388 8.741 17.818 -1.886 1.00 34.34 C ATOM 1286 C ILE A 388 8.164 16.897 -0.817 1.00 20.33 C ATOM 1287 O ILE A 388 7.590 17.358 0.170 1.00 65.41 O ATOM 1288 CB ILE A 388 10.038 18.456 -1.352 1.00 21.21 C ATOM 1289 CG1 ILE A 388 10.720 19.273 -2.452 1.00 72.43 C ATOM 1290 CG2 ILE A 388 10.977 17.383 -0.822 1.00 21.25 C ATOM 1291 CD1 ILE A 388 11.410 20.518 -1.940 1.00 51.22 C ATOM 0 H ILE A 388 7.646 19.583 -1.606 1.00 62.03 H new ATOM 0 HA ILE A 388 8.972 17.236 -2.778 1.00 34.34 H new ATOM 0 HB ILE A 388 9.785 19.127 -0.531 1.00 21.21 H new ATOM 0 HG12 ILE A 388 11.452 18.644 -2.959 1.00 72.43 H new ATOM 0 HG13 ILE A 388 9.976 19.559 -3.195 1.00 72.43 H new ATOM 0 HG21 ILE A 388 11.889 17.849 -0.448 1.00 21.25 H new ATOM 0 HG22 ILE A 388 10.489 16.840 -0.012 1.00 21.25 H new ATOM 0 HG23 ILE A 388 11.227 16.689 -1.625 1.00 21.25 H new ATOM 0 HD11 ILE A 388 11.871 21.047 -2.774 1.00 51.22 H new ATOM 0 HD12 ILE A 388 10.679 21.167 -1.458 1.00 51.22 H new ATOM 0 HD13 ILE A 388 12.178 20.238 -1.219 1.00 51.22 H new ATOM 1303 N ILE A 389 8.323 15.593 -1.019 1.00 72.12 N ATOM 1304 CA ILE A 389 7.820 14.607 -0.070 1.00 73.10 C ATOM 1305 C ILE A 389 8.859 14.296 1.002 1.00 74.25 C ATOM 1306 O ILE A 389 10.012 13.993 0.694 1.00 21.12 O ATOM 1307 CB ILE A 389 7.421 13.298 -0.778 1.00 64.04 C ATOM 1308 CG1 ILE A 389 6.299 13.559 -1.785 1.00 14.22 C ATOM 1309 CG2 ILE A 389 6.992 12.254 0.243 1.00 24.01 C ATOM 1310 CD1 ILE A 389 6.799 13.952 -3.157 1.00 73.34 C ATOM 0 H ILE A 389 8.796 15.195 -1.831 1.00 72.12 H new ATOM 0 HA ILE A 389 6.937 15.041 0.399 1.00 73.10 H new ATOM 0 HB ILE A 389 8.287 12.915 -1.319 1.00 64.04 H new ATOM 0 HG12 ILE A 389 5.685 12.662 -1.874 1.00 14.22 H new ATOM 0 HG13 ILE A 389 5.654 14.350 -1.402 1.00 14.22 H new ATOM 0 HG21 ILE A 389 6.713 11.335 -0.272 1.00 24.01 H new ATOM 0 HG22 ILE A 389 7.818 12.052 0.925 1.00 24.01 H new ATOM 0 HG23 ILE A 389 6.138 12.627 0.808 1.00 24.01 H new ATOM 0 HD11 ILE A 389 5.950 14.121 -3.819 1.00 73.34 H new ATOM 0 HD12 ILE A 389 7.388 14.866 -3.082 1.00 73.34 H new ATOM 0 HD13 ILE A 389 7.420 13.152 -3.561 1.00 73.34 H new ATOM 1322 N ALA A 390 8.442 14.371 2.261 1.00 44.01 N ATOM 1323 CA ALA A 390 9.335 14.094 3.380 1.00 3.23 C ATOM 1324 C ALA A 390 8.868 12.873 4.166 1.00 33.33 C ATOM 1325 O ALA A 390 7.669 12.632 4.298 1.00 24.21 O ATOM 1326 CB ALA A 390 9.430 15.307 4.292 1.00 22.20 C ATOM 0 H ALA A 390 7.491 14.621 2.532 1.00 44.01 H new ATOM 0 HA ALA A 390 10.325 13.878 2.978 1.00 3.23 H new ATOM 0 HB1 ALA A 390 10.100 15.086 5.123 1.00 22.20 H new ATOM 0 HB2 ALA A 390 9.818 16.156 3.729 1.00 22.20 H new ATOM 0 HB3 ALA A 390 8.440 15.550 4.679 1.00 22.20 H new ATOM 1332 N GLN A 391 9.823 12.108 4.684 1.00 24.04 N ATOM 1333 CA GLN A 391 9.508 10.912 5.455 1.00 51.04 C ATOM 1334 C GLN A 391 10.604 10.617 6.474 1.00 24.21 C ATOM 1335 O GLN A 391 11.791 10.640 6.148 1.00 14.23 O ATOM 1336 CB GLN A 391 9.325 9.712 4.524 1.00 75.00 C ATOM 1337 CG GLN A 391 8.413 8.636 5.090 1.00 12.34 C ATOM 1338 CD GLN A 391 8.384 7.386 4.234 1.00 71.13 C ATOM 1339 OE1 GLN A 391 7.865 7.396 3.117 1.00 12.24 O ATOM 1340 NE2 GLN A 391 8.942 6.299 4.754 1.00 32.13 N ATOM 0 H GLN A 391 10.821 12.295 4.584 1.00 24.04 H new ATOM 0 HA GLN A 391 8.576 11.092 5.992 1.00 51.04 H new ATOM 0 HB2 GLN A 391 8.918 10.059 3.574 1.00 75.00 H new ATOM 0 HB3 GLN A 391 10.301 9.275 4.312 1.00 75.00 H new ATOM 0 HG2 GLN A 391 8.745 8.376 6.095 1.00 12.34 H new ATOM 0 HG3 GLN A 391 7.402 9.033 5.181 1.00 12.34 H new ATOM 0 HE21 GLN A 391 9.361 6.336 5.683 1.00 32.13 H new ATOM 0 HE22 GLN A 391 8.952 5.428 4.224 1.00 32.13 H new ATOM 1349 N TYR A 392 10.198 10.341 7.709 1.00 2.00 N ATOM 1350 CA TYR A 392 11.146 10.044 8.776 1.00 4.12 C ATOM 1351 C TYR A 392 12.096 8.923 8.365 1.00 31.32 C ATOM 1352 O TYR A 392 11.689 7.771 8.216 1.00 41.02 O ATOM 1353 CB TYR A 392 10.401 9.654 10.054 1.00 2.34 C ATOM 1354 CG TYR A 392 11.286 9.605 11.279 1.00 20.34 C ATOM 1355 CD1 TYR A 392 11.891 10.756 11.770 1.00 14.34 C ATOM 1356 CD2 TYR A 392 11.517 8.408 11.946 1.00 52.40 C ATOM 1357 CE1 TYR A 392 12.700 10.716 12.889 1.00 64.44 C ATOM 1358 CE2 TYR A 392 12.324 8.359 13.066 1.00 12.22 C ATOM 1359 CZ TYR A 392 12.913 9.515 13.534 1.00 44.04 C ATOM 1360 OH TYR A 392 13.719 9.470 14.649 1.00 14.22 O ATOM 0 H TYR A 392 9.219 10.317 7.995 1.00 2.00 H new ATOM 0 HA TYR A 392 11.734 10.942 8.966 1.00 4.12 H new ATOM 0 HB2 TYR A 392 9.595 10.367 10.227 1.00 2.34 H new ATOM 0 HB3 TYR A 392 9.938 8.678 9.911 1.00 2.34 H new ATOM 0 HD1 TYR A 392 11.726 11.698 11.268 1.00 14.34 H new ATOM 0 HD2 TYR A 392 11.058 7.501 11.583 1.00 52.40 H new ATOM 0 HE1 TYR A 392 13.163 11.620 13.257 1.00 64.44 H new ATOM 0 HE2 TYR A 392 12.493 7.420 13.573 1.00 12.22 H new ATOM 0 HH TYR A 392 13.764 8.550 14.983 1.00 14.22 H new ATOM 1370 N LYS A 393 13.366 9.270 8.184 1.00 43.50 N ATOM 1371 CA LYS A 393 14.377 8.295 7.793 1.00 75.02 C ATOM 1372 C LYS A 393 15.747 8.683 8.339 1.00 21.04 C ATOM 1373 O LYS A 393 16.648 9.079 7.599 1.00 23.45 O ATOM 1374 CB LYS A 393 14.439 8.178 6.268 1.00 53.43 C ATOM 1375 CG LYS A 393 13.276 7.406 5.670 1.00 34.22 C ATOM 1376 CD LYS A 393 13.238 5.974 6.176 1.00 11.43 C ATOM 1377 CE LYS A 393 12.578 5.045 5.169 1.00 61.24 C ATOM 1378 NZ LYS A 393 13.410 4.870 3.947 1.00 24.44 N1+ ATOM 0 H LYS A 393 13.719 10.220 8.302 1.00 43.50 H new ATOM 0 HA LYS A 393 14.097 7.330 8.215 1.00 75.02 H new ATOM 0 HB2 LYS A 393 14.461 9.178 5.836 1.00 53.43 H new ATOM 0 HB3 LYS A 393 15.372 7.689 5.987 1.00 53.43 H new ATOM 0 HG2 LYS A 393 12.340 7.906 5.919 1.00 34.22 H new ATOM 0 HG3 LYS A 393 13.358 7.407 4.583 1.00 34.22 H new ATOM 0 HD2 LYS A 393 14.253 5.631 6.378 1.00 11.43 H new ATOM 0 HD3 LYS A 393 12.694 5.935 7.120 1.00 11.43 H new ATOM 0 HE2 LYS A 393 12.403 4.074 5.631 1.00 61.24 H new ATOM 0 HE3 LYS A 393 11.603 5.445 4.890 1.00 61.24 H new ATOM 0 HZ1 LYS A 393 12.793 4.677 3.132 1.00 24.44 H new ATOM 0 HZ2 LYS A 393 13.955 5.738 3.771 1.00 24.44 H new ATOM 0 HZ3 LYS A 393 14.063 4.072 4.083 1.00 24.44 H new ATOM 1392 N PRO A 394 15.911 8.567 9.666 1.00 42.31 N ATOM 1393 CA PRO A 394 17.170 8.899 10.340 1.00 61.10 C ATOM 1394 C PRO A 394 18.280 7.905 10.017 1.00 41.21 C ATOM 1395 O PRO A 394 19.456 8.265 9.981 1.00 42.30 O ATOM 1396 CB PRO A 394 16.805 8.830 11.825 1.00 52.41 C ATOM 1397 CG PRO A 394 15.645 7.898 11.887 1.00 73.53 C ATOM 1398 CD PRO A 394 14.880 8.102 10.609 1.00 35.43 C ATOM 0 HA PRO A 394 17.557 9.868 10.027 1.00 61.10 H new ATOM 0 HB2 PRO A 394 17.640 8.463 12.421 1.00 52.41 H new ATOM 0 HB3 PRO A 394 16.544 9.814 12.215 1.00 52.41 H new ATOM 0 HG2 PRO A 394 15.979 6.865 11.981 1.00 73.53 H new ATOM 0 HG3 PRO A 394 15.020 8.111 12.754 1.00 73.53 H new ATOM 0 HD2 PRO A 394 14.412 7.178 10.269 1.00 35.43 H new ATOM 0 HD3 PRO A 394 14.084 8.837 10.730 1.00 35.43 H new ATOM 1406 N GLU A 395 17.898 6.654 9.783 1.00 14.25 N ATOM 1407 CA GLU A 395 18.863 5.608 9.463 1.00 61.24 C ATOM 1408 C GLU A 395 19.373 5.757 8.033 1.00 13.51 C ATOM 1409 O GLU A 395 20.555 5.551 7.760 1.00 53.42 O ATOM 1410 CB GLU A 395 18.233 4.227 9.651 1.00 45.31 C ATOM 1411 CG GLU A 395 19.230 3.152 10.049 1.00 42.34 C ATOM 1412 CD GLU A 395 19.831 2.441 8.852 1.00 3.54 C ATOM 1413 OE1 GLU A 395 19.060 2.015 7.967 1.00 45.14 O ATOM 1414 OE2 GLU A 395 21.072 2.310 8.801 1.00 11.43 O1- ATOM 0 H GLU A 395 16.928 6.340 9.809 1.00 14.25 H new ATOM 0 HA GLU A 395 19.708 5.709 10.144 1.00 61.24 H new ATOM 0 HB2 GLU A 395 17.457 4.292 10.414 1.00 45.31 H new ATOM 0 HB3 GLU A 395 17.743 3.931 8.723 1.00 45.31 H new ATOM 0 HG2 GLU A 395 20.029 3.603 10.638 1.00 42.34 H new ATOM 0 HG3 GLU A 395 18.735 2.422 10.690 1.00 42.34 H new ATOM 1421 N GLU A 396 18.471 6.115 7.124 1.00 2.44 N ATOM 1422 CA GLU A 396 18.829 6.290 5.721 1.00 54.14 C ATOM 1423 C GLU A 396 19.859 7.405 5.557 1.00 52.41 C ATOM 1424 O GLU A 396 20.865 7.238 4.868 1.00 11.52 O ATOM 1425 CB GLU A 396 17.584 6.605 4.889 1.00 12.42 C ATOM 1426 CG GLU A 396 16.489 5.559 5.014 1.00 33.21 C ATOM 1427 CD GLU A 396 16.813 4.282 4.265 1.00 11.11 C ATOM 1428 OE1 GLU A 396 17.549 3.439 4.821 1.00 41.00 O ATOM 1429 OE2 GLU A 396 16.333 4.124 3.123 1.00 41.42 O1- ATOM 0 H GLU A 396 17.488 6.289 7.334 1.00 2.44 H new ATOM 0 HA GLU A 396 19.268 5.358 5.366 1.00 54.14 H new ATOM 0 HB2 GLU A 396 17.187 7.573 5.196 1.00 12.42 H new ATOM 0 HB3 GLU A 396 17.871 6.696 3.841 1.00 12.42 H new ATOM 0 HG2 GLU A 396 16.332 5.328 6.067 1.00 33.21 H new ATOM 0 HG3 GLU A 396 15.554 5.971 4.635 1.00 33.21 H new ATOM 1436 N TYR A 397 19.599 8.540 6.196 1.00 20.30 N ATOM 1437 CA TYR A 397 20.501 9.684 6.119 1.00 75.01 C ATOM 1438 C TYR A 397 21.744 9.455 6.972 1.00 10.42 C ATOM 1439 O TYR A 397 22.829 9.942 6.652 1.00 41.34 O ATOM 1440 CB TYR A 397 19.784 10.956 6.573 1.00 75.24 C ATOM 1441 CG TYR A 397 20.686 12.167 6.642 1.00 45.10 C ATOM 1442 CD1 TYR A 397 20.776 13.053 5.576 1.00 44.40 C ATOM 1443 CD2 TYR A 397 21.449 12.425 7.774 1.00 32.42 C ATOM 1444 CE1 TYR A 397 21.599 14.161 5.635 1.00 13.04 C ATOM 1445 CE2 TYR A 397 22.274 13.531 7.842 1.00 21.33 C ATOM 1446 CZ TYR A 397 22.346 14.396 6.770 1.00 53.25 C ATOM 1447 OH TYR A 397 23.168 15.498 6.834 1.00 53.31 O ATOM 0 H TYR A 397 18.772 8.693 6.773 1.00 20.30 H new ATOM 0 HA TYR A 397 20.812 9.801 5.081 1.00 75.01 H new ATOM 0 HB2 TYR A 397 18.962 11.164 5.888 1.00 75.24 H new ATOM 0 HB3 TYR A 397 19.344 10.784 7.556 1.00 75.24 H new ATOM 0 HD1 TYR A 397 20.192 12.873 4.685 1.00 44.40 H new ATOM 0 HD2 TYR A 397 21.396 11.750 8.615 1.00 32.42 H new ATOM 0 HE1 TYR A 397 21.657 14.839 4.797 1.00 13.04 H new ATOM 0 HE2 TYR A 397 22.860 13.717 8.730 1.00 21.33 H new ATOM 0 HH TYR A 397 22.624 16.313 6.824 1.00 53.31 H new ATOM 1457 N SER A 398 21.578 8.710 8.060 1.00 61.04 N ATOM 1458 CA SER A 398 22.686 8.418 8.963 1.00 1.35 C ATOM 1459 C SER A 398 23.862 7.813 8.203 1.00 32.04 C ATOM 1460 O SER A 398 25.011 7.915 8.632 1.00 50.11 O ATOM 1461 CB SER A 398 22.232 7.462 10.068 1.00 14.33 C ATOM 1462 OG SER A 398 23.339 6.800 10.656 1.00 1.04 O ATOM 0 H SER A 398 20.687 8.298 8.338 1.00 61.04 H new ATOM 0 HA SER A 398 23.012 9.355 9.414 1.00 1.35 H new ATOM 0 HB2 SER A 398 21.688 8.017 10.832 1.00 14.33 H new ATOM 0 HB3 SER A 398 21.541 6.726 9.656 1.00 14.33 H new ATOM 0 HG SER A 398 23.023 6.196 11.360 1.00 1.04 H new ATOM 1468 N ARG A 399 23.565 7.183 7.071 1.00 63.33 N ATOM 1469 CA ARG A 399 24.596 6.560 6.250 1.00 24.30 C ATOM 1470 C ARG A 399 25.624 7.591 5.793 1.00 72.24 C ATOM 1471 O ARG A 399 26.809 7.285 5.659 1.00 44.15 O ATOM 1472 CB ARG A 399 23.967 5.878 5.034 1.00 24.15 C ATOM 1473 CG ARG A 399 23.584 6.843 3.924 1.00 54.32 C ATOM 1474 CD ARG A 399 22.686 6.178 2.893 1.00 34.13 C ATOM 1475 NE ARG A 399 23.446 5.359 1.952 1.00 61.24 N ATOM 1476 CZ ARG A 399 22.885 4.512 1.096 1.00 41.35 C ATOM 1477 NH1 ARG A 399 21.567 4.374 1.062 1.00 11.31 N1+ ATOM 1478 NH2 ARG A 399 23.644 3.802 0.271 1.00 3.10 N ATOM 0 H ARG A 399 22.619 7.091 6.702 1.00 63.33 H new ATOM 0 HA ARG A 399 25.104 5.810 6.856 1.00 24.30 H new ATOM 0 HB2 ARG A 399 24.667 5.142 4.638 1.00 24.15 H new ATOM 0 HB3 ARG A 399 23.078 5.333 5.353 1.00 24.15 H new ATOM 0 HG2 ARG A 399 23.073 7.706 4.351 1.00 54.32 H new ATOM 0 HG3 ARG A 399 24.485 7.215 3.437 1.00 54.32 H new ATOM 0 HD2 ARG A 399 21.949 5.556 3.401 1.00 34.13 H new ATOM 0 HD3 ARG A 399 22.135 6.942 2.345 1.00 34.13 H new ATOM 0 HE ARG A 399 24.463 5.442 1.952 1.00 61.24 H new ATOM 0 HH11 ARG A 399 20.981 4.919 1.694 1.00 11.31 H new ATOM 0 HH12 ARG A 399 21.139 3.723 0.404 1.00 11.31 H new ATOM 0 HH21 ARG A 399 24.658 3.906 0.294 1.00 3.10 H new ATOM 0 HH22 ARG A 399 23.213 3.152 -0.386 1.00 3.10 H new ATOM 1492 N PHE A 400 25.162 8.814 5.554 1.00 45.45 N ATOM 1493 CA PHE A 400 26.040 9.890 5.111 1.00 3.02 C ATOM 1494 C PHE A 400 26.891 10.410 6.267 1.00 32.14 C ATOM 1495 O PHE A 400 28.104 10.566 6.136 1.00 44.42 O ATOM 1496 CB PHE A 400 25.218 11.034 4.513 1.00 62.21 C ATOM 1497 CG PHE A 400 24.612 10.704 3.180 1.00 24.03 C ATOM 1498 CD1 PHE A 400 23.245 10.808 2.981 1.00 2.32 C ATOM 1499 CD2 PHE A 400 25.409 10.289 2.125 1.00 3.43 C ATOM 1500 CE1 PHE A 400 22.683 10.504 1.754 1.00 75.53 C ATOM 1501 CE2 PHE A 400 24.854 9.985 0.897 1.00 13.35 C ATOM 1502 CZ PHE A 400 23.489 10.092 0.711 1.00 64.05 C ATOM 0 H PHE A 400 24.184 9.084 5.660 1.00 45.45 H new ATOM 0 HA PHE A 400 26.705 9.490 4.345 1.00 3.02 H new ATOM 0 HB2 PHE A 400 24.422 11.301 5.209 1.00 62.21 H new ATOM 0 HB3 PHE A 400 25.856 11.911 4.406 1.00 62.21 H new ATOM 0 HD1 PHE A 400 22.611 11.130 3.793 1.00 2.32 H new ATOM 0 HD2 PHE A 400 26.476 10.202 2.264 1.00 3.43 H new ATOM 0 HE1 PHE A 400 21.616 10.589 1.612 1.00 75.53 H new ATOM 0 HE2 PHE A 400 25.487 9.664 0.083 1.00 13.35 H new ATOM 0 HZ PHE A 400 23.053 9.854 -0.248 1.00 64.05 H new ATOM 1512 N GLU A 401 26.243 10.675 7.397 1.00 2.42 N ATOM 1513 CA GLU A 401 26.940 11.178 8.575 1.00 63.41 C ATOM 1514 C GLU A 401 27.487 10.028 9.416 1.00 54.33 C ATOM 1515 O GLU A 401 26.738 9.343 10.112 1.00 13.24 O ATOM 1516 CB GLU A 401 26.001 12.041 9.420 1.00 30.12 C ATOM 1517 CG GLU A 401 26.722 13.088 10.254 1.00 73.34 C ATOM 1518 CD GLU A 401 27.242 14.241 9.418 1.00 22.14 C ATOM 1519 OE1 GLU A 401 26.554 14.632 8.452 1.00 44.41 O ATOM 1520 OE2 GLU A 401 28.338 14.753 9.730 1.00 43.43 O1- ATOM 0 H GLU A 401 25.238 10.550 7.522 1.00 2.42 H new ATOM 0 HA GLU A 401 27.778 11.788 8.237 1.00 63.41 H new ATOM 0 HB2 GLU A 401 25.289 12.540 8.762 1.00 30.12 H new ATOM 0 HB3 GLU A 401 25.425 11.395 10.082 1.00 30.12 H new ATOM 0 HG2 GLU A 401 26.042 13.473 11.014 1.00 73.34 H new ATOM 0 HG3 GLU A 401 27.555 12.619 10.778 1.00 73.34 H new ATOM 1527 N ALA A 402 28.798 9.822 9.346 1.00 74.34 N ATOM 1528 CA ALA A 402 29.446 8.757 10.101 1.00 11.33 C ATOM 1529 C ALA A 402 30.844 9.173 10.548 1.00 52.51 C ATOM 1530 O ALA A 402 31.761 9.276 9.732 1.00 24.04 O ATOM 1531 CB ALA A 402 29.511 7.485 9.269 1.00 70.13 C ATOM 0 H ALA A 402 29.432 10.379 8.774 1.00 74.34 H new ATOM 0 HA ALA A 402 28.851 8.564 10.994 1.00 11.33 H new ATOM 0 HB1 ALA A 402 29.997 6.698 9.845 1.00 70.13 H new ATOM 0 HB2 ALA A 402 28.501 7.171 9.005 1.00 70.13 H new ATOM 0 HB3 ALA A 402 30.081 7.674 8.359 1.00 70.13 H new