USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 940 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 110 THR OG1 : rot 180:sc= 0.0693 USER MOD Set 1.2: A 121 SER OG : rot 68:sc= 0.0688 USER MOD Single : A 29 THR OG1 : rot -120:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0303) USER MOD Single : A 48 GLN : amide:sc= -0.19 K(o=-0.19,f=-2.8!) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 HIS : no HE2:sc= -0.656 X(o=-0.66,f=-0.94) USER MOD Single : A 68 GLN :FLIP amide:sc= -0.123 F(o=-1.9!,f=-0.12) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.00533 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.113 X(o=-0.11,f=-0.6) USER MOD Single : A 79 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0463) USER MOD Single : A 80 SER OG : rot -150:sc= 0.0632 USER MOD Single : A 86 THR OG1 : rot 73:sc= 1.23 USER MOD Single : A 89 HIS : no HD1:sc= -0.0601 X(o=-0.06,f=-0.00061) USER MOD Single : A 93 TYR OH : rot -106:sc= 1.01 USER MOD Single : A 96 THR OG1 : rot 170:sc= 0.84 USER MOD Single : A 99 MET CE :methyl -170:sc= -0.574 (180deg=-0.68) USER MOD Single : A 104 THR OG1 : rot 83:sc= 1.3 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.358 X(o=-0.36,f=-0.27) USER MOD Single : A 130 HIS : no HE2:sc= -0.401 K(o=-0.4,f=-2.6!) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 GLN : amide:sc= -0.0289 X(o=-0.029,f=-0.04) USER MOD Single : A 142 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 144 MET CE :methyl -168:sc= -0.0248 (180deg=-0.315) USER MOD Single : A 146 TYR OH : rot 32:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 239 N ALA A 18 -8.503 4.946 -3.225 1.00 60.43 N ATOM 240 CA ALA A 18 -7.368 4.333 -3.862 1.00 24.32 C ATOM 241 C ALA A 18 -6.812 5.271 -4.903 1.00 61.13 C ATOM 242 O ALA A 18 -7.571 5.868 -5.690 1.00 72.14 O ATOM 243 CB ALA A 18 -7.763 3.007 -4.489 1.00 32.23 C ATOM 0 HA ALA A 18 -6.599 4.135 -3.115 1.00 24.32 H new ATOM 0 HB1 ALA A 18 -6.893 2.557 -4.967 1.00 32.23 H new ATOM 0 HB2 ALA A 18 -8.140 2.337 -3.716 1.00 32.23 H new ATOM 0 HB3 ALA A 18 -8.540 3.174 -5.235 1.00 32.23 H new ATOM 249 N GLY A 19 -5.527 5.439 -4.888 1.00 33.30 N ATOM 250 CA GLY A 19 -4.886 6.324 -5.788 1.00 61.13 C ATOM 251 C GLY A 19 -4.263 5.622 -6.944 1.00 61.30 C ATOM 252 O GLY A 19 -4.938 4.909 -7.684 1.00 14.43 O ATOM 0 H GLY A 19 -4.896 4.960 -4.245 1.00 33.30 H new ATOM 0 HA2 GLY A 19 -5.612 7.048 -6.157 1.00 61.13 H new ATOM 0 HA3 GLY A 19 -4.119 6.885 -5.254 1.00 61.13 H new ATOM 256 N ASP A 20 -2.988 5.779 -7.097 1.00 13.44 N ATOM 257 CA ASP A 20 -2.315 5.267 -8.261 1.00 64.43 C ATOM 258 C ASP A 20 -1.254 4.268 -7.862 1.00 2.25 C ATOM 259 O ASP A 20 -0.595 4.423 -6.825 1.00 3.24 O ATOM 260 CB ASP A 20 -1.697 6.421 -9.074 1.00 73.05 C ATOM 261 CG ASP A 20 -2.703 7.507 -9.425 1.00 73.23 C ATOM 262 OD1 ASP A 20 -3.772 7.201 -9.996 1.00 1.51 O ATOM 263 OD2 ASP A 20 -2.465 8.701 -9.099 1.00 22.15 O ATOM 0 H ASP A 20 -2.383 6.259 -6.431 1.00 13.44 H new ATOM 0 HA ASP A 20 -3.046 4.757 -8.888 1.00 64.43 H new ATOM 0 HB2 ASP A 20 -0.879 6.862 -8.504 1.00 73.05 H new ATOM 0 HB3 ASP A 20 -1.267 6.021 -9.992 1.00 73.05 H new ATOM 268 N ASP A 21 -1.114 3.225 -8.657 1.00 22.21 N ATOM 269 CA ASP A 21 -0.118 2.182 -8.415 1.00 51.12 C ATOM 270 C ASP A 21 1.305 2.703 -8.657 1.00 74.43 C ATOM 271 O ASP A 21 1.551 3.475 -9.596 1.00 20.45 O ATOM 272 CB ASP A 21 -0.379 0.916 -9.284 1.00 33.51 C ATOM 273 CG ASP A 21 -0.304 1.155 -10.798 1.00 33.12 C ATOM 274 OD1 ASP A 21 0.795 1.165 -11.364 1.00 13.32 O ATOM 275 OD2 ASP A 21 -1.346 1.338 -11.440 1.00 22.01 O ATOM 0 H ASP A 21 -1.683 3.071 -9.489 1.00 22.21 H new ATOM 0 HA ASP A 21 -0.211 1.897 -7.367 1.00 51.12 H new ATOM 0 HB2 ASP A 21 0.347 0.150 -9.014 1.00 33.51 H new ATOM 0 HB3 ASP A 21 -1.365 0.521 -9.040 1.00 33.51 H new ATOM 280 N VAL A 22 2.228 2.341 -7.775 1.00 5.14 N ATOM 281 CA VAL A 22 3.625 2.721 -7.940 1.00 21.42 C ATOM 282 C VAL A 22 4.491 1.459 -8.151 1.00 5.12 C ATOM 283 O VAL A 22 5.662 1.520 -8.577 1.00 42.22 O ATOM 284 CB VAL A 22 4.145 3.580 -6.750 1.00 61.23 C ATOM 285 CG1 VAL A 22 5.529 4.112 -7.043 1.00 12.12 C ATOM 286 CG2 VAL A 22 3.202 4.733 -6.466 1.00 32.04 C ATOM 0 H VAL A 22 2.035 1.787 -6.941 1.00 5.14 H new ATOM 0 HA VAL A 22 3.702 3.350 -8.827 1.00 21.42 H new ATOM 0 HB VAL A 22 4.191 2.939 -5.869 1.00 61.23 H new ATOM 0 HG11 VAL A 22 5.875 4.710 -6.200 1.00 12.12 H new ATOM 0 HG12 VAL A 22 6.213 3.278 -7.202 1.00 12.12 H new ATOM 0 HG13 VAL A 22 5.498 4.732 -7.939 1.00 12.12 H new ATOM 0 HG21 VAL A 22 3.585 5.319 -5.631 1.00 32.04 H new ATOM 0 HG22 VAL A 22 3.126 5.367 -7.350 1.00 32.04 H new ATOM 0 HG23 VAL A 22 2.216 4.343 -6.213 1.00 32.04 H new ATOM 296 N LEU A 23 3.903 0.311 -7.868 1.00 3.42 N ATOM 297 CA LEU A 23 4.542 -0.954 -8.170 1.00 64.04 C ATOM 298 C LEU A 23 4.368 -1.218 -9.644 1.00 4.45 C ATOM 299 O LEU A 23 3.704 -0.439 -10.322 1.00 3.32 O ATOM 300 CB LEU A 23 3.970 -2.132 -7.311 1.00 44.24 C ATOM 301 CG LEU A 23 2.421 -2.251 -7.086 1.00 31.05 C ATOM 302 CD1 LEU A 23 1.620 -2.285 -8.383 1.00 42.23 C ATOM 303 CD2 LEU A 23 2.116 -3.508 -6.293 1.00 41.33 C ATOM 0 H LEU A 23 2.985 0.230 -7.430 1.00 3.42 H new ATOM 0 HA LEU A 23 5.600 -0.892 -7.916 1.00 64.04 H new ATOM 0 HB2 LEU A 23 4.305 -3.062 -7.770 1.00 44.24 H new ATOM 0 HB3 LEU A 23 4.438 -2.075 -6.328 1.00 44.24 H new ATOM 0 HG LEU A 23 2.120 -1.356 -6.542 1.00 31.05 H new ATOM 0 HD11 LEU A 23 0.558 -2.368 -8.153 1.00 42.23 H new ATOM 0 HD12 LEU A 23 1.799 -1.368 -8.945 1.00 42.23 H new ATOM 0 HD13 LEU A 23 1.930 -3.143 -8.980 1.00 42.23 H new ATOM 0 HD21 LEU A 23 1.040 -3.588 -6.138 1.00 41.33 H new ATOM 0 HD22 LEU A 23 2.470 -4.380 -6.843 1.00 41.33 H new ATOM 0 HD23 LEU A 23 2.619 -3.460 -5.327 1.00 41.33 H new ATOM 315 N ASP A 24 4.928 -2.258 -10.158 1.00 44.01 N ATOM 316 CA ASP A 24 4.648 -2.543 -11.535 1.00 63.51 C ATOM 317 C ASP A 24 3.378 -3.349 -11.551 1.00 14.01 C ATOM 318 O ASP A 24 3.262 -4.291 -10.780 1.00 34.13 O ATOM 319 CB ASP A 24 5.768 -3.311 -12.231 1.00 51.10 C ATOM 320 CG ASP A 24 5.565 -3.360 -13.732 1.00 11.13 C ATOM 321 OD1 ASP A 24 4.721 -4.140 -14.221 1.00 14.14 O ATOM 322 OD2 ASP A 24 6.248 -2.602 -14.456 1.00 21.31 O ATOM 0 H ASP A 24 5.556 -2.903 -9.678 1.00 44.01 H new ATOM 0 HA ASP A 24 4.553 -1.607 -12.085 1.00 63.51 H new ATOM 0 HB2 ASP A 24 6.725 -2.840 -12.008 1.00 51.10 H new ATOM 0 HB3 ASP A 24 5.813 -4.326 -11.836 1.00 51.10 H new ATOM 327 N PRO A 25 2.380 -2.969 -12.364 1.00 71.12 N ATOM 328 CA PRO A 25 1.102 -3.694 -12.466 1.00 5.31 C ATOM 329 C PRO A 25 1.259 -5.213 -12.700 1.00 52.32 C ATOM 330 O PRO A 25 0.317 -5.984 -12.463 1.00 72.52 O ATOM 331 CB PRO A 25 0.418 -3.039 -13.660 1.00 71.35 C ATOM 332 CG PRO A 25 0.960 -1.655 -13.682 1.00 64.21 C ATOM 333 CD PRO A 25 2.382 -1.756 -13.212 1.00 73.53 C ATOM 0 HA PRO A 25 0.541 -3.628 -11.534 1.00 5.31 H new ATOM 0 HB2 PRO A 25 0.642 -3.568 -14.586 1.00 71.35 H new ATOM 0 HB3 PRO A 25 -0.666 -3.040 -13.547 1.00 71.35 H new ATOM 0 HG2 PRO A 25 0.911 -1.233 -14.686 1.00 64.21 H new ATOM 0 HG3 PRO A 25 0.381 -0.999 -13.032 1.00 64.21 H new ATOM 0 HD2 PRO A 25 3.075 -1.852 -14.048 1.00 73.53 H new ATOM 0 HD3 PRO A 25 2.682 -0.873 -12.648 1.00 73.53 H new ATOM 341 N ASP A 26 2.413 -5.629 -13.204 1.00 51.32 N ATOM 342 CA ASP A 26 2.699 -7.039 -13.443 1.00 41.24 C ATOM 343 C ASP A 26 3.099 -7.776 -12.148 1.00 51.03 C ATOM 344 O ASP A 26 2.956 -9.001 -12.056 1.00 41.51 O ATOM 345 CB ASP A 26 3.789 -7.186 -14.517 1.00 62.23 C ATOM 346 CG ASP A 26 4.216 -8.619 -14.766 1.00 72.31 C ATOM 347 OD1 ASP A 26 3.476 -9.376 -15.429 1.00 62.31 O ATOM 348 OD2 ASP A 26 5.324 -9.006 -14.332 1.00 30.01 O ATOM 0 H ASP A 26 3.176 -5.001 -13.458 1.00 51.32 H new ATOM 0 HA ASP A 26 1.783 -7.506 -13.804 1.00 41.24 H new ATOM 0 HB2 ASP A 26 3.425 -6.758 -15.451 1.00 62.23 H new ATOM 0 HB3 ASP A 26 4.661 -6.604 -14.218 1.00 62.23 H new ATOM 353 N GLU A 27 3.552 -7.033 -11.134 1.00 74.54 N ATOM 354 CA GLU A 27 3.970 -7.638 -9.863 1.00 62.34 C ATOM 355 C GLU A 27 2.775 -8.269 -9.142 1.00 15.02 C ATOM 356 O GLU A 27 1.638 -7.862 -9.379 1.00 33.53 O ATOM 357 CB GLU A 27 4.681 -6.627 -8.942 1.00 4.30 C ATOM 358 CG GLU A 27 6.011 -6.139 -9.474 1.00 24.32 C ATOM 359 CD GLU A 27 6.800 -5.366 -8.450 1.00 43.41 C ATOM 360 OE1 GLU A 27 7.549 -5.998 -7.660 1.00 51.04 O ATOM 361 OE2 GLU A 27 6.727 -4.112 -8.431 1.00 33.43 O ATOM 0 H GLU A 27 3.639 -6.017 -11.166 1.00 74.54 H new ATOM 0 HA GLU A 27 4.690 -8.420 -10.105 1.00 62.34 H new ATOM 0 HB2 GLU A 27 4.026 -5.769 -8.787 1.00 4.30 H new ATOM 0 HB3 GLU A 27 4.838 -7.088 -7.967 1.00 4.30 H new ATOM 0 HG2 GLU A 27 6.599 -6.993 -9.810 1.00 24.32 H new ATOM 0 HG3 GLU A 27 5.839 -5.508 -10.346 1.00 24.32 H new ATOM 368 N PRO A 28 3.016 -9.299 -8.289 1.00 4.44 N ATOM 369 CA PRO A 28 1.954 -10.013 -7.562 1.00 12.23 C ATOM 370 C PRO A 28 1.016 -9.088 -6.778 1.00 53.32 C ATOM 371 O PRO A 28 1.414 -8.424 -5.801 1.00 42.42 O ATOM 372 CB PRO A 28 2.722 -10.925 -6.604 1.00 2.13 C ATOM 373 CG PRO A 28 4.027 -11.146 -7.274 1.00 61.02 C ATOM 374 CD PRO A 28 4.350 -9.864 -7.977 1.00 50.03 C ATOM 0 HA PRO A 28 1.297 -10.541 -8.253 1.00 12.23 H new ATOM 0 HB2 PRO A 28 2.850 -10.458 -5.628 1.00 2.13 H new ATOM 0 HB3 PRO A 28 2.195 -11.865 -6.441 1.00 2.13 H new ATOM 0 HG2 PRO A 28 4.800 -11.399 -6.549 1.00 61.02 H new ATOM 0 HG3 PRO A 28 3.968 -11.974 -7.980 1.00 61.02 H new ATOM 0 HD2 PRO A 28 4.932 -9.194 -7.344 1.00 50.03 H new ATOM 0 HD3 PRO A 28 4.935 -10.037 -8.881 1.00 50.03 H new ATOM 382 N THR A 29 -0.211 -9.046 -7.202 1.00 12.11 N ATOM 383 CA THR A 29 -1.207 -8.238 -6.586 1.00 23.14 C ATOM 384 C THR A 29 -2.415 -9.081 -6.221 1.00 22.52 C ATOM 385 O THR A 29 -2.410 -10.307 -6.386 1.00 14.53 O ATOM 386 CB THR A 29 -1.648 -7.102 -7.547 1.00 11.04 C ATOM 387 OG1 THR A 29 -1.903 -7.649 -8.850 1.00 14.32 O ATOM 388 CG2 THR A 29 -0.597 -6.004 -7.643 1.00 25.21 C ATOM 0 H THR A 29 -0.549 -9.584 -8.000 1.00 12.11 H new ATOM 0 HA THR A 29 -0.783 -7.802 -5.681 1.00 23.14 H new ATOM 0 HB THR A 29 -2.557 -6.655 -7.146 1.00 11.04 H new ATOM 0 HG1 THR A 29 -1.309 -7.226 -9.504 1.00 14.32 H new ATOM 0 HG21 THR A 29 -0.943 -5.228 -8.325 1.00 25.21 H new ATOM 0 HG22 THR A 29 -0.431 -5.572 -6.656 1.00 25.21 H new ATOM 0 HG23 THR A 29 0.336 -6.425 -8.017 1.00 25.21 H new ATOM 396 N TYR A 30 -3.374 -8.434 -5.656 1.00 51.55 N ATOM 397 CA TYR A 30 -4.667 -8.952 -5.394 1.00 41.54 C ATOM 398 C TYR A 30 -5.645 -7.947 -5.915 1.00 1.24 C ATOM 399 O TYR A 30 -5.299 -6.778 -6.058 1.00 44.14 O ATOM 400 CB TYR A 30 -4.921 -9.225 -3.912 1.00 4.12 C ATOM 401 CG TYR A 30 -4.191 -10.420 -3.371 1.00 54.20 C ATOM 402 CD1 TYR A 30 -4.405 -11.678 -3.910 1.00 62.32 C ATOM 403 CD2 TYR A 30 -3.309 -10.302 -2.324 1.00 4.44 C ATOM 404 CE1 TYR A 30 -3.756 -12.783 -3.421 1.00 24.45 C ATOM 405 CE2 TYR A 30 -2.651 -11.401 -1.823 1.00 70.05 C ATOM 406 CZ TYR A 30 -2.876 -12.642 -2.373 1.00 30.22 C ATOM 407 OH TYR A 30 -2.209 -13.744 -1.872 1.00 2.42 O ATOM 0 H TYR A 30 -3.267 -7.468 -5.346 1.00 51.55 H new ATOM 0 HA TYR A 30 -4.771 -9.919 -5.886 1.00 41.54 H new ATOM 0 HB2 TYR A 30 -4.631 -8.345 -3.337 1.00 4.12 H new ATOM 0 HB3 TYR A 30 -5.991 -9.367 -3.759 1.00 4.12 H new ATOM 0 HD1 TYR A 30 -5.097 -11.791 -4.732 1.00 62.32 H new ATOM 0 HD2 TYR A 30 -3.130 -9.331 -1.887 1.00 4.44 H new ATOM 0 HE1 TYR A 30 -3.934 -13.756 -3.855 1.00 24.45 H new ATOM 0 HE2 TYR A 30 -1.960 -11.290 -1.000 1.00 70.05 H new ATOM 0 HH TYR A 30 -1.626 -13.466 -1.135 1.00 2.42 H new ATOM 417 N ASP A 31 -6.840 -8.357 -6.126 1.00 52.04 N ATOM 418 CA ASP A 31 -7.866 -7.540 -6.741 1.00 11.14 C ATOM 419 C ASP A 31 -9.043 -7.732 -5.858 1.00 41.40 C ATOM 420 O ASP A 31 -9.033 -8.679 -5.088 1.00 11.12 O ATOM 421 CB ASP A 31 -8.257 -8.095 -8.137 1.00 65.34 C ATOM 422 CG ASP A 31 -7.110 -8.285 -9.118 1.00 51.15 C ATOM 423 OD1 ASP A 31 -6.385 -9.298 -9.009 1.00 43.34 O ATOM 424 OD2 ASP A 31 -6.952 -7.456 -10.048 1.00 31.13 O ATOM 0 H ASP A 31 -7.159 -9.293 -5.876 1.00 52.04 H new ATOM 0 HA ASP A 31 -7.535 -6.508 -6.859 1.00 11.14 H new ATOM 0 HB2 ASP A 31 -8.755 -9.055 -7.999 1.00 65.34 H new ATOM 0 HB3 ASP A 31 -8.985 -7.419 -8.585 1.00 65.34 H new ATOM 429 N LEU A 32 -10.037 -6.863 -5.944 1.00 50.13 N ATOM 430 CA LEU A 32 -11.209 -6.902 -5.036 1.00 52.43 C ATOM 431 C LEU A 32 -11.780 -8.327 -4.780 1.00 4.02 C ATOM 432 O LEU A 32 -11.829 -8.756 -3.618 1.00 71.22 O ATOM 433 CB LEU A 32 -12.300 -5.904 -5.466 1.00 13.13 C ATOM 434 CG LEU A 32 -11.896 -4.424 -5.452 1.00 2.33 C ATOM 435 CD1 LEU A 32 -13.037 -3.554 -5.943 1.00 54.41 C ATOM 436 CD2 LEU A 32 -11.464 -3.991 -4.056 1.00 65.32 C ATOM 0 H LEU A 32 -10.070 -6.111 -6.633 1.00 50.13 H new ATOM 0 HA LEU A 32 -10.829 -6.580 -4.066 1.00 52.43 H new ATOM 0 HB2 LEU A 32 -12.625 -6.163 -6.474 1.00 13.13 H new ATOM 0 HB3 LEU A 32 -13.161 -6.032 -4.810 1.00 13.13 H new ATOM 0 HG LEU A 32 -11.049 -4.300 -6.127 1.00 2.33 H new ATOM 0 HD11 LEU A 32 -12.731 -2.508 -5.926 1.00 54.41 H new ATOM 0 HD12 LEU A 32 -13.299 -3.838 -6.962 1.00 54.41 H new ATOM 0 HD13 LEU A 32 -13.903 -3.689 -5.295 1.00 54.41 H new ATOM 0 HD21 LEU A 32 -11.183 -2.938 -4.072 1.00 65.32 H new ATOM 0 HD22 LEU A 32 -12.289 -4.135 -3.359 1.00 65.32 H new ATOM 0 HD23 LEU A 32 -10.611 -4.590 -3.737 1.00 65.32 H new ATOM 448 N PRO A 33 -12.169 -9.112 -5.832 1.00 64.32 N ATOM 449 CA PRO A 33 -12.661 -10.484 -5.624 1.00 4.13 C ATOM 450 C PRO A 33 -11.574 -11.399 -5.027 1.00 63.53 C ATOM 451 O PRO A 33 -11.845 -12.230 -4.171 1.00 52.41 O ATOM 452 CB PRO A 33 -13.036 -10.957 -7.038 1.00 14.22 C ATOM 453 CG PRO A 33 -12.280 -10.063 -7.962 1.00 13.24 C ATOM 454 CD PRO A 33 -12.201 -8.738 -7.271 1.00 22.35 C ATOM 0 HA PRO A 33 -13.493 -10.516 -4.920 1.00 4.13 H new ATOM 0 HB2 PRO A 33 -12.763 -12.001 -7.189 1.00 14.22 H new ATOM 0 HB3 PRO A 33 -14.110 -10.881 -7.207 1.00 14.22 H new ATOM 0 HG2 PRO A 33 -11.285 -10.459 -8.163 1.00 13.24 H new ATOM 0 HG3 PRO A 33 -12.787 -9.974 -8.923 1.00 13.24 H new ATOM 0 HD2 PRO A 33 -11.310 -8.183 -7.564 1.00 22.35 H new ATOM 0 HD3 PRO A 33 -13.060 -8.109 -7.505 1.00 22.35 H new ATOM 462 N ARG A 34 -10.337 -11.187 -5.452 1.00 53.51 N ATOM 463 CA ARG A 34 -9.217 -12.010 -5.033 1.00 2.00 C ATOM 464 C ARG A 34 -8.869 -11.755 -3.555 1.00 3.44 C ATOM 465 O ARG A 34 -8.443 -12.657 -2.847 1.00 55.22 O ATOM 466 CB ARG A 34 -7.999 -11.743 -5.910 1.00 61.42 C ATOM 467 CG ARG A 34 -7.124 -12.958 -6.114 1.00 32.21 C ATOM 468 CD ARG A 34 -7.839 -13.976 -6.990 1.00 14.02 C ATOM 469 NE ARG A 34 -7.077 -15.203 -7.139 1.00 24.10 N ATOM 470 CZ ARG A 34 -6.809 -15.826 -8.292 1.00 71.40 C ATOM 471 NH1 ARG A 34 -7.217 -15.315 -9.460 1.00 41.51 N ATOM 472 NH2 ARG A 34 -6.148 -16.974 -8.266 1.00 42.53 N ATOM 0 H ARG A 34 -10.084 -10.439 -6.097 1.00 53.51 H new ATOM 0 HA ARG A 34 -9.509 -13.054 -5.143 1.00 2.00 H new ATOM 0 HB2 ARG A 34 -8.334 -11.379 -6.881 1.00 61.42 H new ATOM 0 HB3 ARG A 34 -7.404 -10.948 -5.460 1.00 61.42 H new ATOM 0 HG2 ARG A 34 -6.183 -12.664 -6.579 1.00 32.21 H new ATOM 0 HG3 ARG A 34 -6.878 -13.405 -5.151 1.00 32.21 H new ATOM 0 HD2 ARG A 34 -8.813 -14.205 -6.557 1.00 14.02 H new ATOM 0 HD3 ARG A 34 -8.022 -13.542 -7.973 1.00 14.02 H new ATOM 0 HE ARG A 34 -6.713 -15.629 -6.287 1.00 24.10 H new ATOM 0 HH11 ARG A 34 -7.740 -14.439 -9.479 1.00 41.51 H new ATOM 0 HH12 ARG A 34 -7.005 -15.801 -10.331 1.00 41.51 H new ATOM 0 HH21 ARG A 34 -5.851 -17.371 -7.375 1.00 42.53 H new ATOM 0 HH22 ARG A 34 -5.936 -17.461 -9.137 1.00 42.53 H new ATOM 486 N VAL A 35 -9.031 -10.519 -3.104 1.00 31.40 N ATOM 487 CA VAL A 35 -8.772 -10.185 -1.703 1.00 53.33 C ATOM 488 C VAL A 35 -9.831 -10.832 -0.843 1.00 61.13 C ATOM 489 O VAL A 35 -9.538 -11.414 0.217 1.00 24.15 O ATOM 490 CB VAL A 35 -8.744 -8.649 -1.432 1.00 40.20 C ATOM 491 CG1 VAL A 35 -8.467 -8.349 0.038 1.00 61.40 C ATOM 492 CG2 VAL A 35 -7.718 -7.958 -2.299 1.00 62.45 C ATOM 0 H VAL A 35 -9.338 -9.734 -3.679 1.00 31.40 H new ATOM 0 HA VAL A 35 -7.780 -10.563 -1.456 1.00 53.33 H new ATOM 0 HB VAL A 35 -9.731 -8.262 -1.685 1.00 40.20 H new ATOM 0 HG11 VAL A 35 -8.454 -7.270 0.193 1.00 61.40 H new ATOM 0 HG12 VAL A 35 -9.248 -8.795 0.654 1.00 61.40 H new ATOM 0 HG13 VAL A 35 -7.501 -8.767 0.319 1.00 61.40 H new ATOM 0 HG21 VAL A 35 -7.723 -6.889 -2.087 1.00 62.45 H new ATOM 0 HG22 VAL A 35 -6.729 -8.365 -2.088 1.00 62.45 H new ATOM 0 HG23 VAL A 35 -7.960 -8.120 -3.349 1.00 62.45 H new ATOM 502 N ALA A 36 -11.056 -10.763 -1.332 1.00 70.41 N ATOM 503 CA ALA A 36 -12.182 -11.377 -0.685 1.00 43.24 C ATOM 504 C ALA A 36 -11.941 -12.885 -0.568 1.00 54.32 C ATOM 505 O ALA A 36 -12.232 -13.495 0.454 1.00 12.01 O ATOM 506 CB ALA A 36 -13.447 -11.078 -1.481 1.00 11.35 C ATOM 0 H ALA A 36 -11.290 -10.274 -2.196 1.00 70.41 H new ATOM 0 HA ALA A 36 -12.307 -10.972 0.319 1.00 43.24 H new ATOM 0 HB1 ALA A 36 -14.303 -11.543 -0.992 1.00 11.35 H new ATOM 0 HB2 ALA A 36 -13.599 -10.000 -1.531 1.00 11.35 H new ATOM 0 HB3 ALA A 36 -13.345 -11.477 -2.490 1.00 11.35 H new ATOM 512 N GLU A 37 -11.361 -13.449 -1.617 1.00 2.44 N ATOM 513 CA GLU A 37 -11.012 -14.862 -1.687 1.00 22.11 C ATOM 514 C GLU A 37 -9.953 -15.209 -0.636 1.00 72.32 C ATOM 515 O GLU A 37 -10.095 -16.182 0.117 1.00 53.43 O ATOM 516 CB GLU A 37 -10.395 -15.126 -3.050 1.00 65.23 C ATOM 517 CG GLU A 37 -10.147 -16.593 -3.357 1.00 61.33 C ATOM 518 CD GLU A 37 -9.412 -16.794 -4.656 1.00 40.21 C ATOM 519 OE1 GLU A 37 -8.159 -16.830 -4.645 1.00 13.15 O ATOM 520 OE2 GLU A 37 -10.074 -16.932 -5.706 1.00 44.55 O ATOM 0 H GLU A 37 -11.115 -12.929 -2.459 1.00 2.44 H new ATOM 0 HA GLU A 37 -11.909 -15.457 -1.517 1.00 22.11 H new ATOM 0 HB2 GLU A 37 -11.050 -14.713 -3.817 1.00 65.23 H new ATOM 0 HB3 GLU A 37 -9.449 -14.589 -3.116 1.00 65.23 H new ATOM 0 HG2 GLU A 37 -9.572 -17.039 -2.545 1.00 61.33 H new ATOM 0 HG3 GLU A 37 -11.101 -17.119 -3.398 1.00 61.33 H new ATOM 527 N LEU A 38 -8.931 -14.370 -0.560 1.00 22.25 N ATOM 528 CA LEU A 38 -7.794 -14.583 0.311 1.00 65.41 C ATOM 529 C LEU A 38 -8.201 -14.524 1.772 1.00 21.31 C ATOM 530 O LEU A 38 -7.840 -15.402 2.570 1.00 14.34 O ATOM 531 CB LEU A 38 -6.721 -13.530 0.046 1.00 21.45 C ATOM 532 CG LEU A 38 -5.425 -13.699 0.832 1.00 11.54 C ATOM 533 CD1 LEU A 38 -4.622 -14.884 0.318 1.00 22.23 C ATOM 534 CD2 LEU A 38 -4.608 -12.432 0.806 1.00 54.13 C ATOM 0 H LEU A 38 -8.871 -13.513 -1.110 1.00 22.25 H new ATOM 0 HA LEU A 38 -7.397 -15.576 0.099 1.00 65.41 H new ATOM 0 HB2 LEU A 38 -6.484 -13.538 -1.018 1.00 21.45 H new ATOM 0 HB3 LEU A 38 -7.137 -12.548 0.272 1.00 21.45 H new ATOM 0 HG LEU A 38 -5.687 -13.904 1.870 1.00 11.54 H new ATOM 0 HD11 LEU A 38 -3.704 -14.980 0.897 1.00 22.23 H new ATOM 0 HD12 LEU A 38 -5.212 -15.795 0.420 1.00 22.23 H new ATOM 0 HD13 LEU A 38 -4.374 -14.728 -0.732 1.00 22.23 H new ATOM 0 HD21 LEU A 38 -3.689 -12.580 1.374 1.00 54.13 H new ATOM 0 HD22 LEU A 38 -4.361 -12.180 -0.225 1.00 54.13 H new ATOM 0 HD23 LEU A 38 -5.183 -11.619 1.251 1.00 54.13 H new ATOM 546 N LEU A 39 -8.961 -13.509 2.117 1.00 5.54 N ATOM 547 CA LEU A 39 -9.375 -13.316 3.492 1.00 41.05 C ATOM 548 C LEU A 39 -10.568 -14.183 3.845 1.00 31.13 C ATOM 549 O LEU A 39 -10.847 -14.415 5.025 1.00 31.13 O ATOM 550 CB LEU A 39 -9.655 -11.839 3.777 1.00 41.30 C ATOM 551 CG LEU A 39 -8.459 -10.884 3.659 1.00 72.24 C ATOM 552 CD1 LEU A 39 -8.894 -9.449 3.914 1.00 41.33 C ATOM 553 CD2 LEU A 39 -7.352 -11.279 4.631 1.00 32.23 C ATOM 0 H LEU A 39 -9.306 -12.804 1.466 1.00 5.54 H new ATOM 0 HA LEU A 39 -8.550 -13.630 4.131 1.00 41.05 H new ATOM 0 HB2 LEU A 39 -10.432 -11.500 3.092 1.00 41.30 H new ATOM 0 HB3 LEU A 39 -10.061 -11.756 4.785 1.00 41.30 H new ATOM 0 HG LEU A 39 -8.068 -10.956 2.644 1.00 72.24 H new ATOM 0 HD11 LEU A 39 -8.033 -8.787 3.826 1.00 41.33 H new ATOM 0 HD12 LEU A 39 -9.649 -9.162 3.182 1.00 41.33 H new ATOM 0 HD13 LEU A 39 -9.313 -9.369 4.917 1.00 41.33 H new ATOM 0 HD21 LEU A 39 -6.515 -10.588 4.529 1.00 32.23 H new ATOM 0 HD22 LEU A 39 -7.733 -11.240 5.652 1.00 32.23 H new ATOM 0 HD23 LEU A 39 -7.016 -12.292 4.408 1.00 32.23 H new ATOM 565 N GLY A 40 -11.252 -14.675 2.826 1.00 61.52 N ATOM 566 CA GLY A 40 -12.413 -15.510 3.034 1.00 62.12 C ATOM 567 C GLY A 40 -13.594 -14.687 3.467 1.00 24.34 C ATOM 568 O GLY A 40 -14.466 -15.159 4.180 1.00 12.05 O ATOM 0 H GLY A 40 -11.020 -14.508 1.847 1.00 61.52 H new ATOM 0 HA2 GLY A 40 -12.653 -16.042 2.113 1.00 62.12 H new ATOM 0 HA3 GLY A 40 -12.193 -16.264 3.790 1.00 62.12 H new ATOM 572 N VAL A 41 -13.612 -13.459 3.029 1.00 42.02 N ATOM 573 CA VAL A 41 -14.640 -12.506 3.401 1.00 70.12 C ATOM 574 C VAL A 41 -15.344 -11.995 2.142 1.00 32.42 C ATOM 575 O VAL A 41 -14.860 -12.222 1.037 1.00 62.22 O ATOM 576 CB VAL A 41 -14.018 -11.289 4.166 1.00 21.35 C ATOM 577 CG1 VAL A 41 -13.306 -11.734 5.433 1.00 34.22 C ATOM 578 CG2 VAL A 41 -13.073 -10.490 3.270 1.00 10.10 C ATOM 0 H VAL A 41 -12.908 -13.080 2.396 1.00 42.02 H new ATOM 0 HA VAL A 41 -15.354 -13.008 4.054 1.00 70.12 H new ATOM 0 HB VAL A 41 -14.842 -10.636 4.454 1.00 21.35 H new ATOM 0 HG11 VAL A 41 -12.886 -10.865 5.939 1.00 34.22 H new ATOM 0 HG12 VAL A 41 -14.016 -12.231 6.094 1.00 34.22 H new ATOM 0 HG13 VAL A 41 -12.504 -12.426 5.176 1.00 34.22 H new ATOM 0 HG21 VAL A 41 -12.659 -9.653 3.832 1.00 10.10 H new ATOM 0 HG22 VAL A 41 -12.263 -11.135 2.930 1.00 10.10 H new ATOM 0 HG23 VAL A 41 -13.622 -10.112 2.408 1.00 10.10 H new ATOM 588 N PRO A 42 -16.516 -11.366 2.268 1.00 13.14 N ATOM 589 CA PRO A 42 -17.153 -10.709 1.135 1.00 31.45 C ATOM 590 C PRO A 42 -16.476 -9.352 0.833 1.00 52.30 C ATOM 591 O PRO A 42 -15.720 -8.800 1.683 1.00 24.11 O ATOM 592 CB PRO A 42 -18.593 -10.495 1.616 1.00 51.02 C ATOM 593 CG PRO A 42 -18.480 -10.393 3.095 1.00 75.41 C ATOM 594 CD PRO A 42 -17.357 -11.309 3.488 1.00 4.35 C ATOM 0 HA PRO A 42 -17.087 -11.290 0.215 1.00 31.45 H new ATOM 0 HB2 PRO A 42 -19.024 -9.590 1.188 1.00 51.02 H new ATOM 0 HB3 PRO A 42 -19.237 -11.325 1.323 1.00 51.02 H new ATOM 0 HG2 PRO A 42 -18.272 -9.368 3.401 1.00 75.41 H new ATOM 0 HG3 PRO A 42 -19.411 -10.687 3.579 1.00 75.41 H new ATOM 0 HD2 PRO A 42 -16.801 -10.920 4.341 1.00 4.35 H new ATOM 0 HD3 PRO A 42 -17.724 -12.296 3.770 1.00 4.35 H new ATOM 602 N VAL A 43 -16.764 -8.806 -0.343 1.00 73.23 N ATOM 603 CA VAL A 43 -16.211 -7.519 -0.792 1.00 4.44 C ATOM 604 C VAL A 43 -16.561 -6.407 0.209 1.00 72.33 C ATOM 605 O VAL A 43 -15.777 -5.487 0.426 1.00 5.25 O ATOM 606 CB VAL A 43 -16.688 -7.142 -2.233 1.00 15.43 C ATOM 607 CG1 VAL A 43 -16.080 -5.819 -2.700 1.00 21.02 C ATOM 608 CG2 VAL A 43 -16.331 -8.250 -3.219 1.00 62.22 C ATOM 0 H VAL A 43 -17.390 -9.241 -1.021 1.00 73.23 H new ATOM 0 HA VAL A 43 -15.127 -7.626 -0.834 1.00 4.44 H new ATOM 0 HB VAL A 43 -17.771 -7.024 -2.198 1.00 15.43 H new ATOM 0 HG11 VAL A 43 -16.434 -5.590 -3.705 1.00 21.02 H new ATOM 0 HG12 VAL A 43 -16.378 -5.021 -2.020 1.00 21.02 H new ATOM 0 HG13 VAL A 43 -14.993 -5.901 -2.709 1.00 21.02 H new ATOM 0 HG21 VAL A 43 -16.670 -7.972 -4.217 1.00 62.22 H new ATOM 0 HG22 VAL A 43 -15.251 -8.394 -3.229 1.00 62.22 H new ATOM 0 HG23 VAL A 43 -16.817 -9.177 -2.916 1.00 62.22 H new ATOM 618 N SER A 44 -17.724 -6.535 0.837 1.00 1.55 N ATOM 619 CA SER A 44 -18.183 -5.590 1.839 1.00 33.24 C ATOM 620 C SER A 44 -17.155 -5.469 2.995 1.00 20.31 C ATOM 621 O SER A 44 -16.818 -4.362 3.412 1.00 0.13 O ATOM 622 CB SER A 44 -19.560 -6.025 2.373 1.00 42.20 C ATOM 623 OG SER A 44 -20.091 -5.085 3.288 1.00 4.44 O ATOM 0 H SER A 44 -18.375 -7.301 0.663 1.00 1.55 H new ATOM 0 HA SER A 44 -18.280 -4.607 1.378 1.00 33.24 H new ATOM 0 HB2 SER A 44 -20.250 -6.150 1.539 1.00 42.20 H new ATOM 0 HB3 SER A 44 -19.470 -6.996 2.860 1.00 42.20 H new ATOM 0 HG SER A 44 -20.966 -5.394 3.604 1.00 4.44 H new ATOM 629 N LYS A 45 -16.612 -6.601 3.470 1.00 23.02 N ATOM 630 CA LYS A 45 -15.607 -6.542 4.533 1.00 72.10 C ATOM 631 C LYS A 45 -14.318 -5.952 4.026 1.00 3.22 C ATOM 632 O LYS A 45 -13.628 -5.277 4.756 1.00 41.42 O ATOM 633 CB LYS A 45 -15.369 -7.881 5.235 1.00 62.01 C ATOM 634 CG LYS A 45 -16.546 -8.326 6.099 1.00 54.22 C ATOM 635 CD LYS A 45 -16.267 -9.623 6.863 1.00 40.21 C ATOM 636 CE LYS A 45 -15.123 -9.493 7.866 1.00 12.50 C ATOM 637 NZ LYS A 45 -15.408 -8.523 8.946 1.00 53.02 N ATOM 0 H LYS A 45 -16.845 -7.539 3.145 1.00 23.02 H new ATOM 0 HA LYS A 45 -16.018 -5.881 5.296 1.00 72.10 H new ATOM 0 HB2 LYS A 45 -15.168 -8.646 4.485 1.00 62.01 H new ATOM 0 HB3 LYS A 45 -14.478 -7.804 5.858 1.00 62.01 H new ATOM 0 HG2 LYS A 45 -16.787 -7.536 6.810 1.00 54.22 H new ATOM 0 HG3 LYS A 45 -17.423 -8.464 5.466 1.00 54.22 H new ATOM 0 HD2 LYS A 45 -17.171 -9.929 7.390 1.00 40.21 H new ATOM 0 HD3 LYS A 45 -16.030 -10.413 6.151 1.00 40.21 H new ATOM 0 HE2 LYS A 45 -14.921 -10.469 8.306 1.00 12.50 H new ATOM 0 HE3 LYS A 45 -14.219 -9.187 7.340 1.00 12.50 H new ATOM 0 HZ1 LYS A 45 -14.634 -8.540 9.641 1.00 53.02 H new ATOM 0 HZ2 LYS A 45 -15.490 -7.568 8.542 1.00 53.02 H new ATOM 0 HZ3 LYS A 45 -16.300 -8.778 9.415 1.00 53.02 H new ATOM 651 N VAL A 46 -14.012 -6.193 2.758 1.00 72.14 N ATOM 652 CA VAL A 46 -12.826 -5.591 2.122 1.00 75.34 C ATOM 653 C VAL A 46 -12.962 -4.067 2.138 1.00 11.52 C ATOM 654 O VAL A 46 -12.011 -3.345 2.465 1.00 51.31 O ATOM 655 CB VAL A 46 -12.633 -6.097 0.662 1.00 63.44 C ATOM 656 CG1 VAL A 46 -11.412 -5.458 0.014 1.00 53.12 C ATOM 657 CG2 VAL A 46 -12.515 -7.616 0.634 1.00 64.22 C ATOM 0 H VAL A 46 -14.559 -6.797 2.144 1.00 72.14 H new ATOM 0 HA VAL A 46 -11.945 -5.892 2.689 1.00 75.34 H new ATOM 0 HB VAL A 46 -13.512 -5.804 0.088 1.00 63.44 H new ATOM 0 HG11 VAL A 46 -11.304 -5.831 -1.004 1.00 53.12 H new ATOM 0 HG12 VAL A 46 -11.536 -4.375 -0.007 1.00 53.12 H new ATOM 0 HG13 VAL A 46 -10.521 -5.710 0.589 1.00 53.12 H new ATOM 0 HG21 VAL A 46 -12.381 -7.952 -0.394 1.00 64.22 H new ATOM 0 HG22 VAL A 46 -11.658 -7.925 1.232 1.00 64.22 H new ATOM 0 HG23 VAL A 46 -13.422 -8.059 1.045 1.00 64.22 H new ATOM 667 N ALA A 47 -14.159 -3.597 1.844 1.00 41.41 N ATOM 668 CA ALA A 47 -14.460 -2.183 1.892 1.00 41.43 C ATOM 669 C ALA A 47 -14.292 -1.666 3.322 1.00 54.23 C ATOM 670 O ALA A 47 -13.775 -0.567 3.539 1.00 41.11 O ATOM 671 CB ALA A 47 -15.871 -1.923 1.380 1.00 43.22 C ATOM 0 H ALA A 47 -14.946 -4.184 1.566 1.00 41.41 H new ATOM 0 HA ALA A 47 -13.765 -1.647 1.246 1.00 41.43 H new ATOM 0 HB1 ALA A 47 -16.082 -0.855 1.422 1.00 43.22 H new ATOM 0 HB2 ALA A 47 -15.954 -2.269 0.350 1.00 43.22 H new ATOM 0 HB3 ALA A 47 -16.588 -2.460 2.001 1.00 43.22 H new ATOM 677 N GLN A 48 -14.673 -2.493 4.291 1.00 32.31 N ATOM 678 CA GLN A 48 -14.547 -2.152 5.707 1.00 23.24 C ATOM 679 C GLN A 48 -13.093 -2.050 6.131 1.00 4.44 C ATOM 680 O GLN A 48 -12.752 -1.199 6.927 1.00 24.14 O ATOM 681 CB GLN A 48 -15.264 -3.143 6.608 1.00 31.11 C ATOM 682 CG GLN A 48 -16.759 -3.192 6.428 1.00 23.12 C ATOM 683 CD GLN A 48 -17.407 -4.089 7.447 1.00 33.11 C ATOM 684 OE1 GLN A 48 -17.586 -5.286 7.227 1.00 4.01 O ATOM 685 NE2 GLN A 48 -17.747 -3.527 8.576 1.00 21.13 N ATOM 0 H GLN A 48 -15.076 -3.414 4.120 1.00 32.31 H new ATOM 0 HA GLN A 48 -15.023 -1.178 5.821 1.00 23.24 H new ATOM 0 HB2 GLN A 48 -14.857 -4.138 6.427 1.00 31.11 H new ATOM 0 HB3 GLN A 48 -15.045 -2.893 7.646 1.00 31.11 H new ATOM 0 HG2 GLN A 48 -17.170 -2.186 6.513 1.00 23.12 H new ATOM 0 HG3 GLN A 48 -16.994 -3.549 5.425 1.00 23.12 H new ATOM 0 HE21 GLN A 48 -17.582 -2.531 8.720 1.00 21.13 H new ATOM 0 HE22 GLN A 48 -18.178 -4.084 9.314 1.00 21.13 H new ATOM 694 N GLN A 49 -12.239 -2.905 5.565 1.00 33.30 N ATOM 695 CA GLN A 49 -10.796 -2.888 5.870 1.00 70.45 C ATOM 696 C GLN A 49 -10.255 -1.506 5.522 1.00 75.53 C ATOM 697 O GLN A 49 -9.561 -0.850 6.323 1.00 35.43 O ATOM 698 CB GLN A 49 -10.046 -3.954 5.032 1.00 54.05 C ATOM 699 CG GLN A 49 -10.635 -5.358 5.120 1.00 22.22 C ATOM 700 CD GLN A 49 -10.599 -5.942 6.510 1.00 12.15 C ATOM 701 OE1 GLN A 49 -11.500 -5.738 7.310 1.00 11.32 O ATOM 702 NE2 GLN A 49 -9.592 -6.708 6.793 1.00 33.53 N ATOM 0 H GLN A 49 -12.516 -3.620 4.892 1.00 33.30 H new ATOM 0 HA GLN A 49 -10.645 -3.112 6.926 1.00 70.45 H new ATOM 0 HB2 GLN A 49 -10.042 -3.640 3.988 1.00 54.05 H new ATOM 0 HB3 GLN A 49 -9.007 -3.989 5.358 1.00 54.05 H new ATOM 0 HG2 GLN A 49 -11.668 -5.332 4.773 1.00 22.22 H new ATOM 0 HG3 GLN A 49 -10.088 -6.015 4.444 1.00 22.22 H new ATOM 0 HE21 GLN A 49 -8.856 -6.858 6.103 1.00 33.53 H new ATOM 0 HE22 GLN A 49 -9.536 -7.160 7.705 1.00 33.53 H new ATOM 711 N LEU A 50 -10.650 -1.052 4.348 1.00 52.43 N ATOM 712 CA LEU A 50 -10.307 0.261 3.838 1.00 0.45 C ATOM 713 C LEU A 50 -10.884 1.366 4.733 1.00 25.40 C ATOM 714 O LEU A 50 -10.229 2.367 4.986 1.00 52.22 O ATOM 715 CB LEU A 50 -10.814 0.406 2.385 1.00 2.55 C ATOM 716 CG LEU A 50 -9.871 -0.036 1.243 1.00 64.53 C ATOM 717 CD1 LEU A 50 -8.624 0.825 1.215 1.00 52.44 C ATOM 718 CD2 LEU A 50 -9.500 -1.514 1.345 1.00 11.14 C ATOM 0 H LEU A 50 -11.230 -1.597 3.710 1.00 52.43 H new ATOM 0 HA LEU A 50 -9.222 0.367 3.844 1.00 0.45 H new ATOM 0 HB2 LEU A 50 -11.739 -0.164 2.295 1.00 2.55 H new ATOM 0 HB3 LEU A 50 -11.068 1.453 2.222 1.00 2.55 H new ATOM 0 HG LEU A 50 -10.413 0.099 0.307 1.00 64.53 H new ATOM 0 HD11 LEU A 50 -7.974 0.497 0.404 1.00 52.44 H new ATOM 0 HD12 LEU A 50 -8.904 1.866 1.057 1.00 52.44 H new ATOM 0 HD13 LEU A 50 -8.096 0.731 2.164 1.00 52.44 H new ATOM 0 HD21 LEU A 50 -8.836 -1.780 0.522 1.00 11.14 H new ATOM 0 HD22 LEU A 50 -8.994 -1.698 2.293 1.00 11.14 H new ATOM 0 HD23 LEU A 50 -10.404 -2.121 1.293 1.00 11.14 H new ATOM 730 N ARG A 51 -12.099 1.152 5.223 1.00 64.45 N ATOM 731 CA ARG A 51 -12.789 2.105 6.109 1.00 70.24 C ATOM 732 C ARG A 51 -12.165 2.159 7.497 1.00 3.25 C ATOM 733 O ARG A 51 -12.326 3.139 8.214 1.00 32.42 O ATOM 734 CB ARG A 51 -14.296 1.815 6.173 1.00 12.42 C ATOM 735 CG ARG A 51 -14.956 1.976 4.826 1.00 72.55 C ATOM 736 CD ARG A 51 -16.408 1.568 4.786 1.00 15.34 C ATOM 737 NE ARG A 51 -16.860 1.555 3.388 1.00 51.43 N ATOM 738 CZ ARG A 51 -18.038 1.131 2.932 1.00 10.31 C ATOM 739 NH1 ARG A 51 -19.058 0.921 3.762 1.00 71.43 N ATOM 740 NH2 ARG A 51 -18.210 0.983 1.621 1.00 42.01 N ATOM 0 H ARG A 51 -12.642 0.313 5.021 1.00 64.45 H new ATOM 0 HA ARG A 51 -12.662 3.096 5.674 1.00 70.24 H new ATOM 0 HB2 ARG A 51 -14.456 0.800 6.537 1.00 12.42 H new ATOM 0 HB3 ARG A 51 -14.765 2.488 6.890 1.00 12.42 H new ATOM 0 HG2 ARG A 51 -14.877 3.019 4.519 1.00 72.55 H new ATOM 0 HG3 ARG A 51 -14.406 1.386 4.093 1.00 72.55 H new ATOM 0 HD2 ARG A 51 -16.535 0.582 5.232 1.00 15.34 H new ATOM 0 HD3 ARG A 51 -17.011 2.263 5.371 1.00 15.34 H new ATOM 0 HE ARG A 51 -16.202 1.908 2.693 1.00 51.43 H new ATOM 0 HH11 ARG A 51 -18.944 1.085 4.762 1.00 71.43 H new ATOM 0 HH12 ARG A 51 -19.954 0.596 3.397 1.00 71.43 H new ATOM 0 HH21 ARG A 51 -17.445 1.193 0.979 1.00 42.01 H new ATOM 0 HH22 ARG A 51 -19.106 0.659 1.258 1.00 42.01 H new ATOM 754 N GLU A 52 -11.456 1.116 7.877 1.00 21.33 N ATOM 755 CA GLU A 52 -10.785 1.114 9.159 1.00 72.30 C ATOM 756 C GLU A 52 -9.432 1.792 9.030 1.00 23.25 C ATOM 757 O GLU A 52 -8.810 2.151 10.029 1.00 50.41 O ATOM 758 CB GLU A 52 -10.572 -0.324 9.649 1.00 75.12 C ATOM 759 CG GLU A 52 -11.832 -1.067 10.059 1.00 62.12 C ATOM 760 CD GLU A 52 -12.478 -0.466 11.278 1.00 30.34 C ATOM 761 OE1 GLU A 52 -11.825 -0.423 12.348 1.00 14.32 O ATOM 762 OE2 GLU A 52 -13.630 -0.018 11.202 1.00 52.13 O ATOM 0 H GLU A 52 -11.331 0.268 7.324 1.00 21.33 H new ATOM 0 HA GLU A 52 -11.407 1.652 9.875 1.00 72.30 H new ATOM 0 HB2 GLU A 52 -10.078 -0.890 8.859 1.00 75.12 H new ATOM 0 HB3 GLU A 52 -9.890 -0.303 10.499 1.00 75.12 H new ATOM 0 HG2 GLU A 52 -12.542 -1.057 9.232 1.00 62.12 H new ATOM 0 HG3 GLU A 52 -11.588 -2.111 10.257 1.00 62.12 H new ATOM 769 N GLY A 53 -8.995 1.997 7.788 1.00 40.54 N ATOM 770 CA GLY A 53 -7.682 2.552 7.543 1.00 31.14 C ATOM 771 C GLY A 53 -6.620 1.559 7.962 1.00 44.42 C ATOM 772 O GLY A 53 -5.498 1.926 8.320 1.00 52.32 O ATOM 0 H GLY A 53 -9.533 1.786 6.947 1.00 40.54 H new ATOM 0 HA2 GLY A 53 -7.571 2.793 6.486 1.00 31.14 H new ATOM 0 HA3 GLY A 53 -7.561 3.483 8.097 1.00 31.14 H new ATOM 776 N HIS A 54 -6.991 0.293 7.930 1.00 11.12 N ATOM 777 CA HIS A 54 -6.148 -0.776 8.425 1.00 3.11 C ATOM 778 C HIS A 54 -5.419 -1.426 7.252 1.00 55.31 C ATOM 779 O HIS A 54 -4.526 -2.254 7.428 1.00 20.43 O ATOM 780 CB HIS A 54 -7.040 -1.805 9.145 1.00 13.54 C ATOM 781 CG HIS A 54 -6.323 -2.740 10.079 1.00 33.33 C ATOM 782 ND1 HIS A 54 -5.515 -3.774 9.675 1.00 10.42 N ATOM 783 CD2 HIS A 54 -6.326 -2.780 11.435 1.00 3.14 C ATOM 784 CE1 HIS A 54 -5.065 -4.399 10.758 1.00 51.11 C ATOM 785 NE2 HIS A 54 -5.528 -3.832 11.862 1.00 75.42 N ATOM 0 H HIS A 54 -7.887 -0.022 7.559 1.00 11.12 H new ATOM 0 HA HIS A 54 -5.406 -0.389 9.123 1.00 3.11 H new ATOM 0 HB2 HIS A 54 -7.802 -1.268 9.710 1.00 13.54 H new ATOM 0 HB3 HIS A 54 -7.560 -2.398 8.393 1.00 13.54 H new ATOM 0 HD1 HIS A 54 -5.297 -4.020 8.709 1.00 10.42 H new ATOM 0 HD2 HIS A 54 -6.864 -2.101 12.080 1.00 3.14 H new ATOM 0 HE1 HIS A 54 -4.408 -5.256 10.740 1.00 51.11 H new ATOM 793 N LEU A 55 -5.819 -1.046 6.067 1.00 1.32 N ATOM 794 CA LEU A 55 -5.265 -1.553 4.846 1.00 53.15 C ATOM 795 C LEU A 55 -5.577 -0.518 3.787 1.00 22.14 C ATOM 796 O LEU A 55 -6.560 0.220 3.941 1.00 44.42 O ATOM 797 CB LEU A 55 -5.935 -2.902 4.508 1.00 42.50 C ATOM 798 CG LEU A 55 -5.414 -3.661 3.286 1.00 50.22 C ATOM 799 CD1 LEU A 55 -3.946 -4.025 3.456 1.00 5.45 C ATOM 800 CD2 LEU A 55 -6.245 -4.910 3.063 1.00 52.21 C ATOM 0 H LEU A 55 -6.558 -0.358 5.924 1.00 1.32 H new ATOM 0 HA LEU A 55 -4.191 -1.724 4.916 1.00 53.15 H new ATOM 0 HB2 LEU A 55 -5.837 -3.554 5.376 1.00 42.50 H new ATOM 0 HB3 LEU A 55 -7.000 -2.722 4.364 1.00 42.50 H new ATOM 0 HG LEU A 55 -5.501 -3.013 2.414 1.00 50.22 H new ATOM 0 HD11 LEU A 55 -3.600 -4.564 2.574 1.00 5.45 H new ATOM 0 HD12 LEU A 55 -3.358 -3.116 3.580 1.00 5.45 H new ATOM 0 HD13 LEU A 55 -3.827 -4.657 4.336 1.00 5.45 H new ATOM 0 HD21 LEU A 55 -5.869 -5.446 2.192 1.00 52.21 H new ATOM 0 HD22 LEU A 55 -6.179 -5.553 3.941 1.00 52.21 H new ATOM 0 HD23 LEU A 55 -7.285 -4.630 2.896 1.00 52.21 H new ATOM 812 N VAL A 56 -4.770 -0.425 2.754 1.00 13.01 N ATOM 813 CA VAL A 56 -5.015 0.555 1.730 1.00 12.44 C ATOM 814 C VAL A 56 -4.891 -0.102 0.355 1.00 24.34 C ATOM 815 O VAL A 56 -4.250 -1.153 0.219 1.00 32.24 O ATOM 816 CB VAL A 56 -4.067 1.781 1.881 1.00 14.11 C ATOM 817 CG1 VAL A 56 -2.623 1.457 1.520 1.00 72.40 C ATOM 818 CG2 VAL A 56 -4.587 2.998 1.132 1.00 50.10 C ATOM 0 H VAL A 56 -3.948 -1.011 2.605 1.00 13.01 H new ATOM 0 HA VAL A 56 -6.030 0.937 1.837 1.00 12.44 H new ATOM 0 HB VAL A 56 -4.063 2.037 2.940 1.00 14.11 H new ATOM 0 HG11 VAL A 56 -2.008 2.348 1.644 1.00 72.40 H new ATOM 0 HG12 VAL A 56 -2.253 0.667 2.174 1.00 72.40 H new ATOM 0 HG13 VAL A 56 -2.573 1.123 0.484 1.00 72.40 H new ATOM 0 HG21 VAL A 56 -3.895 3.830 1.264 1.00 50.10 H new ATOM 0 HG22 VAL A 56 -4.673 2.763 0.071 1.00 50.10 H new ATOM 0 HG23 VAL A 56 -5.566 3.275 1.523 1.00 50.10 H new ATOM 828 N ALA A 57 -5.499 0.501 -0.635 1.00 5.33 N ATOM 829 CA ALA A 57 -5.542 -0.041 -1.966 1.00 22.22 C ATOM 830 C ALA A 57 -5.123 1.014 -2.969 1.00 52.33 C ATOM 831 O ALA A 57 -5.126 2.200 -2.661 1.00 22.13 O ATOM 832 CB ALA A 57 -6.949 -0.531 -2.277 1.00 13.13 C ATOM 0 H ALA A 57 -5.984 1.393 -0.536 1.00 5.33 H new ATOM 0 HA ALA A 57 -4.851 -0.881 -2.032 1.00 22.22 H new ATOM 0 HB1 ALA A 57 -6.977 -0.941 -3.287 1.00 13.13 H new ATOM 0 HB2 ALA A 57 -7.231 -1.305 -1.563 1.00 13.13 H new ATOM 0 HB3 ALA A 57 -7.649 0.302 -2.204 1.00 13.13 H new ATOM 838 N VAL A 58 -4.768 0.568 -4.149 1.00 24.12 N ATOM 839 CA VAL A 58 -4.359 1.421 -5.255 1.00 74.20 C ATOM 840 C VAL A 58 -5.080 0.993 -6.499 1.00 71.30 C ATOM 841 O VAL A 58 -5.720 -0.051 -6.511 1.00 35.21 O ATOM 842 CB VAL A 58 -2.829 1.417 -5.516 1.00 53.22 C ATOM 843 CG1 VAL A 58 -2.114 2.149 -4.416 1.00 54.04 C ATOM 844 CG2 VAL A 58 -2.290 -0.007 -5.650 1.00 1.22 C ATOM 0 H VAL A 58 -4.753 -0.425 -4.380 1.00 24.12 H new ATOM 0 HA VAL A 58 -4.621 2.442 -4.978 1.00 74.20 H new ATOM 0 HB VAL A 58 -2.646 1.930 -6.460 1.00 53.22 H new ATOM 0 HG11 VAL A 58 -1.041 2.140 -4.610 1.00 54.04 H new ATOM 0 HG12 VAL A 58 -2.466 3.180 -4.376 1.00 54.04 H new ATOM 0 HG13 VAL A 58 -2.315 1.660 -3.463 1.00 54.04 H new ATOM 0 HG21 VAL A 58 -1.216 0.026 -5.832 1.00 1.22 H new ATOM 0 HG22 VAL A 58 -2.485 -0.558 -4.730 1.00 1.22 H new ATOM 0 HG23 VAL A 58 -2.784 -0.506 -6.484 1.00 1.22 H new ATOM 854 N ARG A 59 -5.030 1.784 -7.515 1.00 5.15 N ATOM 855 CA ARG A 59 -5.700 1.446 -8.735 1.00 72.53 C ATOM 856 C ARG A 59 -4.686 1.116 -9.795 1.00 44.02 C ATOM 857 O ARG A 59 -3.654 1.763 -9.869 1.00 0.21 O ATOM 858 CB ARG A 59 -6.541 2.610 -9.226 1.00 54.55 C ATOM 859 CG ARG A 59 -7.572 3.110 -8.241 1.00 13.34 C ATOM 860 CD ARG A 59 -8.231 4.356 -8.776 1.00 14.31 C ATOM 861 NE ARG A 59 -7.236 5.398 -9.095 1.00 74.42 N ATOM 862 CZ ARG A 59 -7.455 6.444 -9.886 1.00 14.10 C ATOM 863 NH1 ARG A 59 -8.676 6.668 -10.358 1.00 42.41 N ATOM 864 NH2 ARG A 59 -6.451 7.274 -10.209 1.00 14.02 N ATOM 0 H ARG A 59 -4.532 2.674 -7.531 1.00 5.15 H new ATOM 0 HA ARG A 59 -6.344 0.588 -8.541 1.00 72.53 H new ATOM 0 HB2 ARG A 59 -5.877 3.435 -9.485 1.00 54.55 H new ATOM 0 HB3 ARG A 59 -7.050 2.311 -10.142 1.00 54.55 H new ATOM 0 HG2 ARG A 59 -8.322 2.339 -8.063 1.00 13.34 H new ATOM 0 HG3 ARG A 59 -7.099 3.321 -7.282 1.00 13.34 H new ATOM 0 HD2 ARG A 59 -8.803 4.111 -9.671 1.00 14.31 H new ATOM 0 HD3 ARG A 59 -8.938 4.739 -8.041 1.00 14.31 H new ATOM 0 HE ARG A 59 -6.310 5.309 -8.677 1.00 74.42 H new ATOM 0 HH11 ARG A 59 -9.441 6.039 -10.113 1.00 42.41 H new ATOM 0 HH12 ARG A 59 -8.849 7.469 -10.965 1.00 42.41 H new ATOM 0 HH21 ARG A 59 -5.513 7.104 -9.847 1.00 14.02 H new ATOM 0 HH22 ARG A 59 -6.626 8.074 -10.816 1.00 14.02 H new ATOM 878 N ARG A 60 -4.971 0.095 -10.574 1.00 51.00 N ATOM 879 CA ARG A 60 -4.172 -0.259 -11.727 1.00 32.20 C ATOM 880 C ARG A 60 -5.112 -0.385 -12.913 1.00 21.50 C ATOM 881 O ARG A 60 -6.099 -1.127 -12.850 1.00 71.35 O ATOM 882 CB ARG A 60 -3.356 -1.573 -11.542 1.00 63.54 C ATOM 883 CG ARG A 60 -4.190 -2.847 -11.415 1.00 64.21 C ATOM 884 CD ARG A 60 -3.326 -4.094 -11.420 1.00 32.35 C ATOM 885 NE ARG A 60 -4.137 -5.316 -11.301 1.00 71.12 N ATOM 886 CZ ARG A 60 -3.677 -6.569 -11.423 1.00 11.54 C ATOM 887 NH1 ARG A 60 -2.415 -6.799 -11.808 1.00 23.13 N ATOM 888 NH2 ARG A 60 -4.482 -7.594 -11.157 1.00 33.20 N ATOM 0 H ARG A 60 -5.772 -0.519 -10.423 1.00 51.00 H new ATOM 0 HA ARG A 60 -3.429 0.523 -11.882 1.00 32.20 H new ATOM 0 HB2 ARG A 60 -2.680 -1.684 -12.390 1.00 63.54 H new ATOM 0 HB3 ARG A 60 -2.736 -1.474 -10.651 1.00 63.54 H new ATOM 0 HG2 ARG A 60 -4.769 -2.811 -10.492 1.00 64.21 H new ATOM 0 HG3 ARG A 60 -4.904 -2.897 -12.237 1.00 64.21 H new ATOM 0 HD2 ARG A 60 -2.745 -4.131 -12.341 1.00 32.35 H new ATOM 0 HD3 ARG A 60 -2.614 -4.047 -10.596 1.00 32.35 H new ATOM 0 HE ARG A 60 -5.132 -5.200 -11.110 1.00 71.12 H new ATOM 0 HH11 ARG A 60 -1.793 -6.016 -12.012 1.00 23.13 H new ATOM 0 HH12 ARG A 60 -2.076 -7.757 -11.897 1.00 23.13 H new ATOM 0 HH21 ARG A 60 -5.444 -7.424 -10.862 1.00 33.20 H new ATOM 0 HH22 ARG A 60 -4.138 -8.550 -11.248 1.00 33.20 H new ATOM 902 N ALA A 61 -4.881 0.426 -13.936 1.00 1.35 N ATOM 903 CA ALA A 61 -5.683 0.436 -15.175 1.00 60.23 C ATOM 904 C ALA A 61 -7.150 0.810 -14.905 1.00 23.42 C ATOM 905 O ALA A 61 -8.030 0.613 -15.757 1.00 23.25 O ATOM 906 CB ALA A 61 -5.579 -0.904 -15.906 1.00 52.21 C ATOM 0 H ALA A 61 -4.123 1.109 -13.939 1.00 1.35 H new ATOM 0 HA ALA A 61 -5.269 1.208 -15.824 1.00 60.23 H new ATOM 0 HB1 ALA A 61 -6.179 -0.870 -16.815 1.00 52.21 H new ATOM 0 HB2 ALA A 61 -4.538 -1.097 -16.165 1.00 52.21 H new ATOM 0 HB3 ALA A 61 -5.946 -1.701 -15.259 1.00 52.21 H new ATOM 912 N GLY A 62 -7.395 1.385 -13.746 1.00 52.22 N ATOM 913 CA GLY A 62 -8.729 1.763 -13.357 1.00 33.33 C ATOM 914 C GLY A 62 -9.346 0.788 -12.368 1.00 43.10 C ATOM 915 O GLY A 62 -10.420 1.040 -11.834 1.00 14.11 O ATOM 0 H GLY A 62 -6.677 1.601 -13.054 1.00 52.22 H new ATOM 0 HA2 GLY A 62 -8.706 2.759 -12.914 1.00 33.33 H new ATOM 0 HA3 GLY A 62 -9.359 1.823 -14.244 1.00 33.33 H new ATOM 919 N GLY A 63 -8.674 -0.314 -12.119 1.00 51.01 N ATOM 920 CA GLY A 63 -9.172 -1.299 -11.189 1.00 54.23 C ATOM 921 C GLY A 63 -8.589 -1.114 -9.827 1.00 74.14 C ATOM 922 O GLY A 63 -7.474 -0.648 -9.702 1.00 34.20 O ATOM 0 H GLY A 63 -7.780 -0.549 -12.549 1.00 51.01 H new ATOM 0 HA2 GLY A 63 -10.258 -1.230 -11.133 1.00 54.23 H new ATOM 0 HA3 GLY A 63 -8.934 -2.298 -11.554 1.00 54.23 H new ATOM 926 N VAL A 64 -9.311 -1.509 -8.812 1.00 73.22 N ATOM 927 CA VAL A 64 -8.859 -1.330 -7.450 1.00 63.25 C ATOM 928 C VAL A 64 -8.209 -2.616 -6.991 1.00 73.22 C ATOM 929 O VAL A 64 -8.830 -3.691 -7.009 1.00 12.44 O ATOM 930 CB VAL A 64 -10.034 -0.970 -6.496 1.00 11.34 C ATOM 931 CG1 VAL A 64 -9.536 -0.728 -5.077 1.00 13.24 C ATOM 932 CG2 VAL A 64 -10.793 0.245 -7.005 1.00 42.22 C ATOM 0 H VAL A 64 -10.221 -1.960 -8.900 1.00 73.22 H new ATOM 0 HA VAL A 64 -8.149 -0.503 -7.422 1.00 63.25 H new ATOM 0 HB VAL A 64 -10.716 -1.820 -6.477 1.00 11.34 H new ATOM 0 HG11 VAL A 64 -10.379 -0.478 -4.433 1.00 13.24 H new ATOM 0 HG12 VAL A 64 -9.049 -1.629 -4.704 1.00 13.24 H new ATOM 0 HG13 VAL A 64 -8.823 0.097 -5.077 1.00 13.24 H new ATOM 0 HG21 VAL A 64 -11.609 0.477 -6.321 1.00 42.22 H new ATOM 0 HG22 VAL A 64 -10.117 1.098 -7.065 1.00 42.22 H new ATOM 0 HG23 VAL A 64 -11.198 0.033 -7.995 1.00 42.22 H new ATOM 942 N VAL A 65 -6.966 -2.509 -6.623 1.00 44.02 N ATOM 943 CA VAL A 65 -6.158 -3.636 -6.256 1.00 52.12 C ATOM 944 C VAL A 65 -5.379 -3.368 -4.995 1.00 24.44 C ATOM 945 O VAL A 65 -5.179 -2.215 -4.594 1.00 1.42 O ATOM 946 CB VAL A 65 -5.159 -4.009 -7.383 1.00 64.30 C ATOM 947 CG1 VAL A 65 -5.887 -4.601 -8.559 1.00 44.13 C ATOM 948 CG2 VAL A 65 -4.370 -2.785 -7.830 1.00 33.54 C ATOM 0 H VAL A 65 -6.475 -1.617 -6.568 1.00 44.02 H new ATOM 0 HA VAL A 65 -6.844 -4.466 -6.089 1.00 52.12 H new ATOM 0 HB VAL A 65 -4.465 -4.750 -6.986 1.00 64.30 H new ATOM 0 HG11 VAL A 65 -5.170 -4.856 -9.340 1.00 44.13 H new ATOM 0 HG12 VAL A 65 -6.416 -5.500 -8.244 1.00 44.13 H new ATOM 0 HG13 VAL A 65 -6.602 -3.876 -8.947 1.00 44.13 H new ATOM 0 HG21 VAL A 65 -3.675 -3.069 -8.621 1.00 33.54 H new ATOM 0 HG22 VAL A 65 -5.057 -2.026 -8.205 1.00 33.54 H new ATOM 0 HG23 VAL A 65 -3.812 -2.383 -6.984 1.00 33.54 H new ATOM 958 N ILE A 66 -4.949 -4.422 -4.384 1.00 63.04 N ATOM 959 CA ILE A 66 -4.152 -4.367 -3.199 1.00 74.32 C ATOM 960 C ILE A 66 -2.915 -5.215 -3.457 1.00 33.22 C ATOM 961 O ILE A 66 -3.037 -6.331 -3.956 1.00 2.42 O ATOM 962 CB ILE A 66 -4.925 -4.914 -1.955 1.00 70.33 C ATOM 963 CG1 ILE A 66 -6.210 -4.093 -1.721 1.00 2.41 C ATOM 964 CG2 ILE A 66 -4.035 -4.889 -0.711 1.00 72.53 C ATOM 965 CD1 ILE A 66 -7.041 -4.541 -0.536 1.00 64.50 C ATOM 0 H ILE A 66 -5.146 -5.371 -4.702 1.00 63.04 H new ATOM 0 HA ILE A 66 -3.890 -3.332 -2.977 1.00 74.32 H new ATOM 0 HB ILE A 66 -5.205 -5.949 -2.150 1.00 70.33 H new ATOM 0 HG12 ILE A 66 -5.936 -3.047 -1.581 1.00 2.41 H new ATOM 0 HG13 ILE A 66 -6.826 -4.144 -2.619 1.00 2.41 H new ATOM 0 HG21 ILE A 66 -4.592 -5.274 0.143 1.00 72.53 H new ATOM 0 HG22 ILE A 66 -3.156 -5.511 -0.880 1.00 72.53 H new ATOM 0 HG23 ILE A 66 -3.722 -3.865 -0.508 1.00 72.53 H new ATOM 0 HD11 ILE A 66 -7.923 -3.907 -0.450 1.00 64.50 H new ATOM 0 HD12 ILE A 66 -7.351 -5.576 -0.679 1.00 64.50 H new ATOM 0 HD13 ILE A 66 -6.448 -4.463 0.375 1.00 64.50 H new ATOM 977 N PRO A 67 -1.713 -4.686 -3.217 1.00 62.24 N ATOM 978 CA PRO A 67 -0.480 -5.445 -3.410 1.00 41.42 C ATOM 979 C PRO A 67 -0.452 -6.706 -2.542 1.00 11.12 C ATOM 980 O PRO A 67 -0.757 -6.653 -1.356 1.00 32.43 O ATOM 981 CB PRO A 67 0.617 -4.475 -2.966 1.00 51.34 C ATOM 982 CG PRO A 67 0.000 -3.127 -3.077 1.00 35.41 C ATOM 983 CD PRO A 67 -1.447 -3.312 -2.750 1.00 54.21 C ATOM 0 HA PRO A 67 -0.367 -5.788 -4.438 1.00 41.42 H new ATOM 0 HB2 PRO A 67 0.937 -4.681 -1.945 1.00 51.34 H new ATOM 0 HB3 PRO A 67 1.500 -4.559 -3.600 1.00 51.34 H new ATOM 0 HG2 PRO A 67 0.470 -2.424 -2.389 1.00 35.41 H new ATOM 0 HG3 PRO A 67 0.125 -2.721 -4.081 1.00 35.41 H new ATOM 0 HD2 PRO A 67 -1.638 -3.203 -1.682 1.00 54.21 H new ATOM 0 HD3 PRO A 67 -2.074 -2.582 -3.262 1.00 54.21 H new ATOM 991 N GLN A 68 -0.067 -7.833 -3.142 1.00 22.10 N ATOM 992 CA GLN A 68 0.006 -9.117 -2.449 1.00 12.51 C ATOM 993 C GLN A 68 1.030 -9.082 -1.329 1.00 22.13 C ATOM 994 O GLN A 68 0.922 -9.788 -0.338 1.00 0.31 O ATOM 995 CB GLN A 68 0.309 -10.198 -3.472 1.00 32.30 C ATOM 996 CG GLN A 68 0.578 -11.584 -2.926 1.00 35.14 C ATOM 997 CD GLN A 68 0.527 -12.632 -4.010 1.00 32.43 C ATOM 998 OE1 GLN A 68 -0.354 -12.443 -4.973 1.00 12.33 O flip ATOM 999 NE2 GLN A 68 1.239 -13.629 -3.959 1.00 45.44 N flip ATOM 0 H GLN A 68 0.203 -7.880 -4.124 1.00 22.10 H new ATOM 0 HA GLN A 68 -0.950 -9.338 -1.973 1.00 12.51 H new ATOM 0 HB2 GLN A 68 -0.532 -10.260 -4.163 1.00 32.30 H new ATOM 0 HB3 GLN A 68 1.177 -9.885 -4.053 1.00 32.30 H new ATOM 0 HG2 GLN A 68 1.557 -11.603 -2.448 1.00 35.14 H new ATOM 0 HG3 GLN A 68 -0.157 -11.821 -2.157 1.00 35.14 H new ATOM 0 HE21 GLN A 68 1.909 -13.739 -3.198 1.00 45.44 H new ATOM 0 HE22 GLN A 68 1.161 -14.348 -4.678 1.00 45.44 H new ATOM 1008 N VAL A 69 1.982 -8.203 -1.484 1.00 3.24 N ATOM 1009 CA VAL A 69 3.047 -8.009 -0.528 1.00 44.33 C ATOM 1010 C VAL A 69 2.545 -7.331 0.775 1.00 55.43 C ATOM 1011 O VAL A 69 3.288 -7.174 1.724 1.00 25.21 O ATOM 1012 CB VAL A 69 4.182 -7.183 -1.159 1.00 14.12 C ATOM 1013 CG1 VAL A 69 4.743 -7.897 -2.387 1.00 4.54 C ATOM 1014 CG2 VAL A 69 3.702 -5.784 -1.526 1.00 75.50 C ATOM 0 H VAL A 69 2.044 -7.587 -2.294 1.00 3.24 H new ATOM 0 HA VAL A 69 3.426 -8.994 -0.255 1.00 44.33 H new ATOM 0 HB VAL A 69 4.978 -7.083 -0.421 1.00 14.12 H new ATOM 0 HG11 VAL A 69 5.545 -7.299 -2.821 1.00 4.54 H new ATOM 0 HG12 VAL A 69 5.135 -8.871 -2.094 1.00 4.54 H new ATOM 0 HG13 VAL A 69 3.951 -8.031 -3.124 1.00 4.54 H new ATOM 0 HG21 VAL A 69 4.524 -5.222 -1.970 1.00 75.50 H new ATOM 0 HG22 VAL A 69 2.884 -5.856 -2.242 1.00 75.50 H new ATOM 0 HG23 VAL A 69 3.355 -5.271 -0.629 1.00 75.50 H new ATOM 1024 N PHE A 70 1.275 -6.934 0.789 1.00 40.31 N ATOM 1025 CA PHE A 70 0.651 -6.355 1.974 1.00 0.14 C ATOM 1026 C PHE A 70 0.073 -7.454 2.854 1.00 35.11 C ATOM 1027 O PHE A 70 -0.436 -7.205 3.960 1.00 22.11 O ATOM 1028 CB PHE A 70 -0.437 -5.341 1.580 1.00 25.20 C ATOM 1029 CG PHE A 70 0.060 -3.925 1.405 1.00 62.24 C ATOM 1030 CD1 PHE A 70 1.199 -3.638 0.666 1.00 54.52 C ATOM 1031 CD2 PHE A 70 -0.603 -2.880 2.029 1.00 31.51 C ATOM 1032 CE1 PHE A 70 1.648 -2.338 0.550 1.00 71.11 C ATOM 1033 CE2 PHE A 70 -0.157 -1.588 1.923 1.00 62.23 C ATOM 1034 CZ PHE A 70 0.964 -1.314 1.185 1.00 32.43 C ATOM 0 H PHE A 70 0.653 -7.004 -0.016 1.00 40.31 H new ATOM 0 HA PHE A 70 1.414 -5.823 2.541 1.00 0.14 H new ATOM 0 HB2 PHE A 70 -0.900 -5.668 0.649 1.00 25.20 H new ATOM 0 HB3 PHE A 70 -1.215 -5.348 2.343 1.00 25.20 H new ATOM 0 HD1 PHE A 70 1.738 -4.437 0.178 1.00 54.52 H new ATOM 0 HD2 PHE A 70 -1.489 -3.088 2.611 1.00 31.51 H new ATOM 0 HE1 PHE A 70 2.530 -2.120 -0.034 1.00 71.11 H new ATOM 0 HE2 PHE A 70 -0.688 -0.789 2.420 1.00 62.23 H new ATOM 0 HZ PHE A 70 1.316 -0.297 1.098 1.00 32.43 H new ATOM 1044 N PHE A 71 0.163 -8.661 2.372 1.00 30.12 N ATOM 1045 CA PHE A 71 -0.323 -9.797 3.076 1.00 11.42 C ATOM 1046 C PHE A 71 0.813 -10.746 3.325 1.00 75.20 C ATOM 1047 O PHE A 71 1.758 -10.824 2.532 1.00 11.22 O ATOM 1048 CB PHE A 71 -1.432 -10.500 2.292 1.00 41.11 C ATOM 1049 CG PHE A 71 -2.660 -9.662 2.081 1.00 53.43 C ATOM 1050 CD1 PHE A 71 -3.652 -9.613 3.044 1.00 73.25 C ATOM 1051 CD2 PHE A 71 -2.826 -8.932 0.916 1.00 54.11 C ATOM 1052 CE1 PHE A 71 -4.786 -8.851 2.848 1.00 65.33 C ATOM 1053 CE2 PHE A 71 -3.955 -8.169 0.716 1.00 35.33 C ATOM 1054 CZ PHE A 71 -4.938 -8.129 1.682 1.00 52.34 C ATOM 0 H PHE A 71 0.582 -8.879 1.468 1.00 30.12 H new ATOM 0 HA PHE A 71 -0.744 -9.466 4.025 1.00 11.42 H new ATOM 0 HB2 PHE A 71 -1.040 -10.802 1.321 1.00 41.11 H new ATOM 0 HB3 PHE A 71 -1.713 -11.411 2.820 1.00 41.11 H new ATOM 0 HD1 PHE A 71 -3.538 -10.177 3.958 1.00 73.25 H new ATOM 0 HD2 PHE A 71 -2.061 -8.961 0.155 1.00 54.11 H new ATOM 0 HE1 PHE A 71 -5.554 -8.820 3.607 1.00 65.33 H new ATOM 0 HE2 PHE A 71 -4.070 -7.603 -0.196 1.00 35.33 H new ATOM 0 HZ PHE A 71 -5.825 -7.534 1.526 1.00 52.34 H new ATOM 1064 N THR A 72 0.736 -11.446 4.408 1.00 12.32 N ATOM 1065 CA THR A 72 1.735 -12.395 4.765 1.00 74.14 C ATOM 1066 C THR A 72 1.463 -13.716 4.054 1.00 13.33 C ATOM 1067 O THR A 72 0.405 -13.886 3.408 1.00 50.24 O ATOM 1068 CB THR A 72 1.736 -12.614 6.291 1.00 23.30 C ATOM 1069 OG1 THR A 72 0.411 -12.989 6.731 1.00 42.21 O ATOM 1070 CG2 THR A 72 2.173 -11.352 7.021 1.00 3.42 C ATOM 0 H THR A 72 -0.031 -11.374 5.077 1.00 12.32 H new ATOM 0 HA THR A 72 2.711 -12.016 4.462 1.00 74.14 H new ATOM 0 HB THR A 72 2.442 -13.412 6.522 1.00 23.30 H new ATOM 0 HG1 THR A 72 0.416 -13.129 7.701 1.00 42.21 H new ATOM 0 HG21 THR A 72 2.165 -11.532 8.096 1.00 3.42 H new ATOM 0 HG22 THR A 72 3.180 -11.080 6.706 1.00 3.42 H new ATOM 0 HG23 THR A 72 1.487 -10.539 6.785 1.00 3.42 H new ATOM 1078 N ASN A 73 2.369 -14.666 4.209 1.00 14.44 N ATOM 1079 CA ASN A 73 2.230 -15.994 3.598 1.00 53.15 C ATOM 1080 C ASN A 73 1.056 -16.734 4.260 1.00 21.44 C ATOM 1081 O ASN A 73 0.488 -17.670 3.704 1.00 70.04 O ATOM 1082 CB ASN A 73 3.535 -16.787 3.783 1.00 61.32 C ATOM 1083 CG ASN A 73 3.589 -18.093 2.998 1.00 25.13 C ATOM 1084 OD1 ASN A 73 3.035 -18.209 1.897 1.00 52.42 O ATOM 1085 ND2 ASN A 73 4.250 -19.078 3.551 1.00 54.22 N ATOM 0 H ASN A 73 3.221 -14.548 4.758 1.00 14.44 H new ATOM 0 HA ASN A 73 2.032 -15.892 2.531 1.00 53.15 H new ATOM 0 HB2 ASN A 73 4.374 -16.160 3.481 1.00 61.32 H new ATOM 0 HB3 ASN A 73 3.666 -17.007 4.842 1.00 61.32 H new ATOM 0 HD21 ASN A 73 4.321 -19.976 3.073 1.00 54.22 H new ATOM 0 HD22 ASN A 73 4.694 -18.947 4.460 1.00 54.22 H new ATOM 1092 N SER A 74 0.665 -16.244 5.432 1.00 34.13 N ATOM 1093 CA SER A 74 -0.436 -16.794 6.197 1.00 52.42 C ATOM 1094 C SER A 74 -1.786 -16.307 5.632 1.00 10.51 C ATOM 1095 O SER A 74 -2.858 -16.759 6.064 1.00 44.22 O ATOM 1096 CB SER A 74 -0.295 -16.330 7.640 1.00 54.10 C ATOM 1097 OG SER A 74 1.022 -16.593 8.137 1.00 2.02 O ATOM 0 H SER A 74 1.113 -15.444 5.878 1.00 34.13 H new ATOM 0 HA SER A 74 -0.411 -17.882 6.139 1.00 52.42 H new ATOM 0 HB2 SER A 74 -0.506 -15.262 7.705 1.00 54.10 H new ATOM 0 HB3 SER A 74 -1.031 -16.838 8.263 1.00 54.10 H new ATOM 0 HG SER A 74 1.089 -16.285 9.065 1.00 2.02 H new ATOM 1103 N GLY A 75 -1.729 -15.383 4.675 1.00 5.04 N ATOM 1104 CA GLY A 75 -2.934 -14.857 4.072 1.00 62.50 C ATOM 1105 C GLY A 75 -3.611 -13.847 4.967 1.00 71.11 C ATOM 1106 O GLY A 75 -4.827 -13.681 4.927 1.00 73.13 O ATOM 0 H GLY A 75 -0.862 -14.990 4.308 1.00 5.04 H new ATOM 0 HA2 GLY A 75 -2.690 -14.391 3.117 1.00 62.50 H new ATOM 0 HA3 GLY A 75 -3.622 -15.675 3.861 1.00 62.50 H new ATOM 1110 N GLN A 76 -2.823 -13.197 5.790 1.00 24.42 N ATOM 1111 CA GLN A 76 -3.312 -12.191 6.709 1.00 0.11 C ATOM 1112 C GLN A 76 -2.589 -10.894 6.461 1.00 71.44 C ATOM 1113 O GLN A 76 -1.573 -10.880 5.775 1.00 22.53 O ATOM 1114 CB GLN A 76 -3.101 -12.630 8.166 1.00 43.12 C ATOM 1115 CG GLN A 76 -3.940 -13.823 8.593 1.00 1.20 C ATOM 1116 CD GLN A 76 -5.436 -13.554 8.508 1.00 61.21 C ATOM 1117 OE1 GLN A 76 -5.894 -12.419 8.667 1.00 72.42 O ATOM 1118 NE2 GLN A 76 -6.203 -14.578 8.263 1.00 23.01 N ATOM 0 H GLN A 76 -1.816 -13.351 5.843 1.00 24.42 H new ATOM 0 HA GLN A 76 -4.381 -12.058 6.542 1.00 0.11 H new ATOM 0 HB2 GLN A 76 -2.048 -12.872 8.310 1.00 43.12 H new ATOM 0 HB3 GLN A 76 -3.327 -11.789 8.822 1.00 43.12 H new ATOM 0 HG2 GLN A 76 -3.693 -14.678 7.964 1.00 1.20 H new ATOM 0 HG3 GLN A 76 -3.682 -14.095 9.617 1.00 1.20 H new ATOM 0 HE21 GLN A 76 -5.793 -15.503 8.136 1.00 23.01 H new ATOM 0 HE22 GLN A 76 -7.213 -14.454 8.198 1.00 23.01 H new ATOM 1127 N VAL A 77 -3.101 -9.824 7.005 1.00 1.21 N ATOM 1128 CA VAL A 77 -2.484 -8.524 6.872 1.00 53.44 C ATOM 1129 C VAL A 77 -1.272 -8.474 7.804 1.00 24.33 C ATOM 1130 O VAL A 77 -1.302 -9.075 8.901 1.00 73.03 O ATOM 1131 CB VAL A 77 -3.495 -7.391 7.252 1.00 15.24 C ATOM 1132 CG1 VAL A 77 -2.890 -6.004 7.061 1.00 33.44 C ATOM 1133 CG2 VAL A 77 -4.782 -7.518 6.445 1.00 53.13 C ATOM 0 H VAL A 77 -3.960 -9.825 7.555 1.00 1.21 H new ATOM 0 HA VAL A 77 -2.177 -8.367 5.838 1.00 53.44 H new ATOM 0 HB VAL A 77 -3.729 -7.512 8.310 1.00 15.24 H new ATOM 0 HG11 VAL A 77 -3.624 -5.246 7.336 1.00 33.44 H new ATOM 0 HG12 VAL A 77 -2.008 -5.901 7.693 1.00 33.44 H new ATOM 0 HG13 VAL A 77 -2.605 -5.872 6.017 1.00 33.44 H new ATOM 0 HG21 VAL A 77 -5.469 -6.720 6.727 1.00 53.13 H new ATOM 0 HG22 VAL A 77 -4.554 -7.442 5.382 1.00 53.13 H new ATOM 0 HG23 VAL A 77 -5.245 -8.483 6.648 1.00 53.13 H new ATOM 1143 N VAL A 78 -0.198 -7.835 7.361 1.00 61.13 N ATOM 1144 CA VAL A 78 0.991 -7.668 8.190 1.00 74.41 C ATOM 1145 C VAL A 78 0.598 -6.829 9.417 1.00 53.31 C ATOM 1146 O VAL A 78 -0.027 -5.781 9.276 1.00 64.20 O ATOM 1147 CB VAL A 78 2.135 -6.952 7.420 1.00 75.43 C ATOM 1148 CG1 VAL A 78 3.423 -6.923 8.227 1.00 54.12 C ATOM 1149 CG2 VAL A 78 2.367 -7.584 6.058 1.00 4.13 C ATOM 0 H VAL A 78 -0.124 -7.423 6.431 1.00 61.13 H new ATOM 0 HA VAL A 78 1.359 -8.651 8.483 1.00 74.41 H new ATOM 0 HB VAL A 78 1.818 -5.921 7.264 1.00 75.43 H new ATOM 0 HG11 VAL A 78 4.199 -6.414 7.655 1.00 54.12 H new ATOM 0 HG12 VAL A 78 3.254 -6.391 9.163 1.00 54.12 H new ATOM 0 HG13 VAL A 78 3.741 -7.943 8.442 1.00 54.12 H new ATOM 0 HG21 VAL A 78 3.174 -7.059 5.546 1.00 4.13 H new ATOM 0 HG22 VAL A 78 2.639 -8.632 6.185 1.00 4.13 H new ATOM 0 HG23 VAL A 78 1.455 -7.515 5.465 1.00 4.13 H new ATOM 1159 N LYS A 79 0.959 -7.285 10.599 1.00 23.34 N ATOM 1160 CA LYS A 79 0.527 -6.636 11.837 1.00 54.11 C ATOM 1161 C LYS A 79 1.081 -5.215 12.026 1.00 23.24 C ATOM 1162 O LYS A 79 0.477 -4.400 12.701 1.00 75.12 O ATOM 1163 CB LYS A 79 0.795 -7.520 13.051 1.00 52.41 C ATOM 1164 CG LYS A 79 2.241 -7.854 13.248 1.00 43.31 C ATOM 1165 CD LYS A 79 2.455 -8.885 14.363 1.00 42.42 C ATOM 1166 CE LYS A 79 1.955 -8.398 15.725 1.00 70.14 C ATOM 1167 NZ LYS A 79 2.673 -7.189 16.183 1.00 33.02 N ATOM 0 H LYS A 79 1.552 -8.104 10.737 1.00 23.34 H new ATOM 0 HA LYS A 79 -0.551 -6.508 11.743 1.00 54.11 H new ATOM 0 HB2 LYS A 79 0.423 -7.018 13.944 1.00 52.41 H new ATOM 0 HB3 LYS A 79 0.229 -8.446 12.947 1.00 52.41 H new ATOM 0 HG2 LYS A 79 2.652 -8.240 12.315 1.00 43.31 H new ATOM 0 HG3 LYS A 79 2.792 -6.944 13.487 1.00 43.31 H new ATOM 0 HD2 LYS A 79 1.940 -9.809 14.101 1.00 42.42 H new ATOM 0 HD3 LYS A 79 3.517 -9.121 14.434 1.00 42.42 H new ATOM 0 HE2 LYS A 79 0.888 -8.184 15.663 1.00 70.14 H new ATOM 0 HE3 LYS A 79 2.078 -9.193 16.461 1.00 70.14 H new ATOM 0 HZ1 LYS A 79 2.387 -6.964 17.157 1.00 33.02 H new ATOM 0 HZ2 LYS A 79 3.698 -7.362 16.154 1.00 33.02 H new ATOM 0 HZ3 LYS A 79 2.439 -6.390 15.560 1.00 33.02 H new ATOM 1181 N SER A 80 2.197 -4.913 11.406 1.00 53.05 N ATOM 1182 CA SER A 80 2.791 -3.595 11.518 1.00 72.31 C ATOM 1183 C SER A 80 2.332 -2.658 10.385 1.00 63.13 C ATOM 1184 O SER A 80 2.662 -1.465 10.366 1.00 3.11 O ATOM 1185 CB SER A 80 4.301 -3.749 11.549 1.00 41.33 C ATOM 1186 OG SER A 80 4.711 -4.738 10.613 1.00 32.51 O ATOM 0 H SER A 80 2.716 -5.563 10.816 1.00 53.05 H new ATOM 0 HA SER A 80 2.456 -3.126 12.443 1.00 72.31 H new ATOM 0 HB2 SER A 80 4.776 -2.796 11.315 1.00 41.33 H new ATOM 0 HB3 SER A 80 4.625 -4.029 12.551 1.00 41.33 H new ATOM 0 HG SER A 80 5.529 -5.172 10.933 1.00 32.51 H new ATOM 1192 N LEU A 81 1.525 -3.195 9.486 1.00 1.55 N ATOM 1193 CA LEU A 81 1.042 -2.465 8.327 1.00 33.50 C ATOM 1194 C LEU A 81 0.119 -1.284 8.724 1.00 10.13 C ATOM 1195 O LEU A 81 0.345 -0.161 8.266 1.00 51.02 O ATOM 1196 CB LEU A 81 0.391 -3.447 7.346 1.00 61.44 C ATOM 1197 CG LEU A 81 -0.001 -2.970 5.954 1.00 73.15 C ATOM 1198 CD1 LEU A 81 -0.153 -4.183 5.086 1.00 55.13 C ATOM 1199 CD2 LEU A 81 -1.321 -2.211 5.966 1.00 44.22 C ATOM 0 H LEU A 81 1.185 -4.155 9.540 1.00 1.55 H new ATOM 0 HA LEU A 81 1.885 -1.997 7.819 1.00 33.50 H new ATOM 0 HB2 LEU A 81 1.075 -4.287 7.223 1.00 61.44 H new ATOM 0 HB3 LEU A 81 -0.509 -3.836 7.823 1.00 61.44 H new ATOM 0 HG LEU A 81 0.769 -2.294 5.582 1.00 73.15 H new ATOM 0 HD11 LEU A 81 -0.434 -3.877 4.079 1.00 55.13 H new ATOM 0 HD12 LEU A 81 0.792 -4.725 5.050 1.00 55.13 H new ATOM 0 HD13 LEU A 81 -0.927 -4.830 5.498 1.00 55.13 H new ATOM 0 HD21 LEU A 81 -1.564 -1.888 4.954 1.00 44.22 H new ATOM 0 HD22 LEU A 81 -2.112 -2.862 6.339 1.00 44.22 H new ATOM 0 HD23 LEU A 81 -1.233 -1.339 6.614 1.00 44.22 H new ATOM 1211 N PRO A 82 -0.932 -1.488 9.588 1.00 33.23 N ATOM 1212 CA PRO A 82 -1.776 -0.375 10.040 1.00 33.42 C ATOM 1213 C PRO A 82 -0.943 0.712 10.736 1.00 53.30 C ATOM 1214 O PRO A 82 -1.263 1.898 10.659 1.00 40.12 O ATOM 1215 CB PRO A 82 -2.761 -1.024 11.033 1.00 24.14 C ATOM 1216 CG PRO A 82 -2.178 -2.361 11.349 1.00 11.44 C ATOM 1217 CD PRO A 82 -1.415 -2.777 10.132 1.00 23.12 C ATOM 0 HA PRO A 82 -2.279 0.121 9.210 1.00 33.42 H new ATOM 0 HB2 PRO A 82 -2.868 -0.419 11.933 1.00 24.14 H new ATOM 0 HB3 PRO A 82 -3.754 -1.122 10.595 1.00 24.14 H new ATOM 0 HG2 PRO A 82 -1.524 -2.305 12.219 1.00 11.44 H new ATOM 0 HG3 PRO A 82 -2.961 -3.082 11.584 1.00 11.44 H new ATOM 0 HD2 PRO A 82 -0.590 -3.445 10.381 1.00 23.12 H new ATOM 0 HD3 PRO A 82 -2.048 -3.305 9.419 1.00 23.12 H new ATOM 1225 N GLY A 83 0.157 0.294 11.358 1.00 63.03 N ATOM 1226 CA GLY A 83 1.044 1.206 12.036 1.00 42.54 C ATOM 1227 C GLY A 83 1.706 2.173 11.074 1.00 51.11 C ATOM 1228 O GLY A 83 1.739 3.384 11.331 1.00 61.44 O ATOM 0 H GLY A 83 0.448 -0.683 11.400 1.00 63.03 H new ATOM 0 HA2 GLY A 83 0.485 1.766 12.786 1.00 42.54 H new ATOM 0 HA3 GLY A 83 1.810 0.640 12.566 1.00 42.54 H new ATOM 1232 N LEU A 84 2.183 1.658 9.937 1.00 44.43 N ATOM 1233 CA LEU A 84 2.850 2.497 8.951 1.00 23.04 C ATOM 1234 C LEU A 84 1.844 3.465 8.346 1.00 22.52 C ATOM 1235 O LEU A 84 2.135 4.641 8.146 1.00 45.25 O ATOM 1236 CB LEU A 84 3.605 1.660 7.870 1.00 43.52 C ATOM 1237 CG LEU A 84 2.777 0.902 6.814 1.00 11.15 C ATOM 1238 CD1 LEU A 84 2.458 1.785 5.608 1.00 73.12 C ATOM 1239 CD2 LEU A 84 3.473 -0.371 6.379 1.00 22.10 C ATOM 0 H LEU A 84 2.118 0.672 9.683 1.00 44.43 H new ATOM 0 HA LEU A 84 3.624 3.077 9.454 1.00 23.04 H new ATOM 0 HB2 LEU A 84 4.279 2.333 7.341 1.00 43.52 H new ATOM 0 HB3 LEU A 84 4.226 0.931 8.390 1.00 43.52 H new ATOM 0 HG LEU A 84 1.832 0.627 7.283 1.00 11.15 H new ATOM 0 HD11 LEU A 84 1.873 1.216 4.885 1.00 73.12 H new ATOM 0 HD12 LEU A 84 1.886 2.654 5.934 1.00 73.12 H new ATOM 0 HD13 LEU A 84 3.387 2.116 5.143 1.00 73.12 H new ATOM 0 HD21 LEU A 84 2.864 -0.883 5.634 1.00 22.10 H new ATOM 0 HD22 LEU A 84 4.444 -0.126 5.948 1.00 22.10 H new ATOM 0 HD23 LEU A 84 3.613 -1.022 7.242 1.00 22.10 H new ATOM 1251 N LEU A 85 0.645 2.971 8.097 1.00 40.53 N ATOM 1252 CA LEU A 85 -0.409 3.794 7.535 1.00 70.23 C ATOM 1253 C LEU A 85 -0.779 4.911 8.492 1.00 1.23 C ATOM 1254 O LEU A 85 -1.011 6.033 8.082 1.00 23.31 O ATOM 1255 CB LEU A 85 -1.648 2.962 7.207 1.00 53.11 C ATOM 1256 CG LEU A 85 -1.492 1.893 6.126 1.00 62.14 C ATOM 1257 CD1 LEU A 85 -2.783 1.120 5.975 1.00 42.34 C ATOM 1258 CD2 LEU A 85 -1.100 2.523 4.796 1.00 70.34 C ATOM 0 H LEU A 85 0.377 2.003 8.275 1.00 40.53 H new ATOM 0 HA LEU A 85 -0.031 4.227 6.609 1.00 70.23 H new ATOM 0 HB2 LEU A 85 -1.982 2.474 8.123 1.00 53.11 H new ATOM 0 HB3 LEU A 85 -2.443 3.642 6.901 1.00 53.11 H new ATOM 0 HG LEU A 85 -0.699 1.209 6.428 1.00 62.14 H new ATOM 0 HD11 LEU A 85 -2.664 0.360 5.203 1.00 42.34 H new ATOM 0 HD12 LEU A 85 -3.032 0.640 6.921 1.00 42.34 H new ATOM 0 HD13 LEU A 85 -3.585 1.802 5.692 1.00 42.34 H new ATOM 0 HD21 LEU A 85 -0.994 1.744 4.041 1.00 70.34 H new ATOM 0 HD22 LEU A 85 -1.872 3.227 4.485 1.00 70.34 H new ATOM 0 HD23 LEU A 85 -0.152 3.050 4.908 1.00 70.34 H new ATOM 1270 N THR A 86 -0.779 4.597 9.763 1.00 22.30 N ATOM 1271 CA THR A 86 -1.142 5.557 10.794 1.00 62.14 C ATOM 1272 C THR A 86 -0.101 6.703 10.908 1.00 72.05 C ATOM 1273 O THR A 86 -0.476 7.897 10.993 1.00 4.30 O ATOM 1274 CB THR A 86 -1.368 4.845 12.155 1.00 14.53 C ATOM 1275 OG1 THR A 86 -2.421 3.872 12.001 1.00 10.44 O ATOM 1276 CG2 THR A 86 -1.766 5.834 13.244 1.00 11.03 C ATOM 0 H THR A 86 -0.530 3.674 10.119 1.00 22.30 H new ATOM 0 HA THR A 86 -2.084 6.020 10.500 1.00 62.14 H new ATOM 0 HB THR A 86 -0.434 4.367 12.452 1.00 14.53 H new ATOM 0 HG1 THR A 86 -2.090 3.111 11.480 1.00 10.44 H new ATOM 0 HG21 THR A 86 -1.916 5.301 14.183 1.00 11.03 H new ATOM 0 HG22 THR A 86 -0.976 6.574 13.370 1.00 11.03 H new ATOM 0 HG23 THR A 86 -2.691 6.335 12.960 1.00 11.03 H new ATOM 1284 N ILE A 87 1.181 6.360 10.869 1.00 22.03 N ATOM 1285 CA ILE A 87 2.231 7.372 10.949 1.00 32.24 C ATOM 1286 C ILE A 87 2.238 8.252 9.679 1.00 52.04 C ATOM 1287 O ILE A 87 2.336 9.476 9.763 1.00 65.30 O ATOM 1288 CB ILE A 87 3.646 6.746 11.335 1.00 73.12 C ATOM 1289 CG1 ILE A 87 4.791 7.795 11.481 1.00 53.31 C ATOM 1290 CG2 ILE A 87 4.055 5.619 10.407 1.00 21.21 C ATOM 1291 CD1 ILE A 87 5.385 8.323 10.182 1.00 72.24 C ATOM 0 H ILE A 87 1.518 5.401 10.784 1.00 22.03 H new ATOM 0 HA ILE A 87 2.006 8.045 11.777 1.00 32.24 H new ATOM 0 HB ILE A 87 3.494 6.325 12.329 1.00 73.12 H new ATOM 0 HG12 ILE A 87 4.410 8.641 12.053 1.00 53.31 H new ATOM 0 HG13 ILE A 87 5.593 7.348 12.068 1.00 53.31 H new ATOM 0 HG21 ILE A 87 5.025 5.229 10.714 1.00 21.21 H new ATOM 0 HG22 ILE A 87 3.312 4.822 10.453 1.00 21.21 H new ATOM 0 HG23 ILE A 87 4.122 5.995 9.386 1.00 21.21 H new ATOM 0 HD11 ILE A 87 6.171 9.044 10.408 1.00 72.24 H new ATOM 0 HD12 ILE A 87 5.806 7.495 9.611 1.00 72.24 H new ATOM 0 HD13 ILE A 87 4.605 8.808 9.596 1.00 72.24 H new ATOM 1303 N LEU A 88 2.076 7.637 8.522 1.00 12.52 N ATOM 1304 CA LEU A 88 1.986 8.383 7.268 1.00 5.24 C ATOM 1305 C LEU A 88 0.721 9.235 7.194 1.00 65.51 C ATOM 1306 O LEU A 88 0.731 10.318 6.606 1.00 33.40 O ATOM 1307 CB LEU A 88 2.146 7.503 6.032 1.00 24.34 C ATOM 1308 CG LEU A 88 3.586 7.132 5.591 1.00 61.22 C ATOM 1309 CD1 LEU A 88 4.405 8.364 5.250 1.00 25.12 C ATOM 1310 CD2 LEU A 88 4.303 6.307 6.620 1.00 30.31 C ATOM 0 H LEU A 88 2.004 6.625 8.418 1.00 12.52 H new ATOM 0 HA LEU A 88 2.837 9.064 7.269 1.00 5.24 H new ATOM 0 HB2 LEU A 88 1.600 6.576 6.208 1.00 24.34 H new ATOM 0 HB3 LEU A 88 1.659 8.006 5.197 1.00 24.34 H new ATOM 0 HG LEU A 88 3.479 6.527 4.691 1.00 61.22 H new ATOM 0 HD11 LEU A 88 5.407 8.062 4.946 1.00 25.12 H new ATOM 0 HD12 LEU A 88 3.926 8.905 4.434 1.00 25.12 H new ATOM 0 HD13 LEU A 88 4.471 9.011 6.125 1.00 25.12 H new ATOM 0 HD21 LEU A 88 5.306 6.073 6.264 1.00 30.31 H new ATOM 0 HD22 LEU A 88 4.370 6.867 7.553 1.00 30.31 H new ATOM 0 HD23 LEU A 88 3.754 5.381 6.791 1.00 30.31 H new ATOM 1322 N HIS A 89 -0.368 8.732 7.771 1.00 11.14 N ATOM 1323 CA HIS A 89 -1.641 9.461 7.843 1.00 33.24 C ATOM 1324 C HIS A 89 -1.422 10.779 8.609 1.00 64.10 C ATOM 1325 O HIS A 89 -2.005 11.804 8.274 1.00 1.13 O ATOM 1326 CB HIS A 89 -2.713 8.590 8.549 1.00 72.33 C ATOM 1327 CG HIS A 89 -4.143 9.076 8.430 1.00 30.42 C ATOM 1328 ND1 HIS A 89 -5.184 8.293 7.964 1.00 4.31 N ATOM 1329 CD2 HIS A 89 -4.702 10.258 8.774 1.00 21.32 C ATOM 1330 CE1 HIS A 89 -6.309 9.008 8.041 1.00 4.33 C ATOM 1331 NE2 HIS A 89 -6.072 10.213 8.529 1.00 12.03 N ATOM 0 H HIS A 89 -0.397 7.808 8.203 1.00 11.14 H new ATOM 0 HA HIS A 89 -1.995 9.686 6.837 1.00 33.24 H new ATOM 0 HB2 HIS A 89 -2.658 7.580 8.143 1.00 72.33 H new ATOM 0 HB3 HIS A 89 -2.459 8.522 9.607 1.00 72.33 H new ATOM 0 HD2 HIS A 89 -4.168 11.106 9.177 1.00 21.32 H new ATOM 0 HE1 HIS A 89 -7.283 8.649 7.744 1.00 4.33 H new ATOM 0 HE2 HIS A 89 -6.752 10.956 8.692 1.00 12.03 H new ATOM 1339 N ASP A 90 -0.540 10.744 9.616 1.00 30.42 N ATOM 1340 CA ASP A 90 -0.192 11.957 10.390 1.00 2.12 C ATOM 1341 C ASP A 90 0.534 12.960 9.505 1.00 44.13 C ATOM 1342 O ASP A 90 0.366 14.176 9.642 1.00 33.01 O ATOM 1343 CB ASP A 90 0.699 11.600 11.593 1.00 74.23 C ATOM 1344 CG ASP A 90 1.210 12.824 12.345 1.00 44.41 C ATOM 1345 OD1 ASP A 90 0.475 13.360 13.203 1.00 64.03 O ATOM 1346 OD2 ASP A 90 2.364 13.270 12.097 1.00 31.42 O ATOM 0 H ASP A 90 -0.054 9.899 9.917 1.00 30.42 H new ATOM 0 HA ASP A 90 -1.119 12.400 10.754 1.00 2.12 H new ATOM 0 HB2 ASP A 90 0.135 10.969 12.280 1.00 74.23 H new ATOM 0 HB3 ASP A 90 1.550 11.013 11.246 1.00 74.23 H new ATOM 1351 N GLY A 91 1.270 12.444 8.547 1.00 21.01 N ATOM 1352 CA GLY A 91 2.014 13.281 7.647 1.00 14.20 C ATOM 1353 C GLY A 91 1.189 13.728 6.465 1.00 11.02 C ATOM 1354 O GLY A 91 1.617 14.566 5.694 1.00 74.25 O ATOM 0 H GLY A 91 1.366 11.443 8.374 1.00 21.01 H new ATOM 0 HA2 GLY A 91 2.377 14.156 8.185 1.00 14.20 H new ATOM 0 HA3 GLY A 91 2.890 12.739 7.291 1.00 14.20 H new ATOM 1358 N GLY A 92 0.011 13.158 6.321 1.00 1.23 N ATOM 1359 CA GLY A 92 -0.873 13.526 5.241 1.00 13.14 C ATOM 1360 C GLY A 92 -0.470 12.899 3.929 1.00 71.30 C ATOM 1361 O GLY A 92 -0.597 13.516 2.870 1.00 72.34 O ATOM 0 H GLY A 92 -0.355 12.436 6.942 1.00 1.23 H new ATOM 0 HA2 GLY A 92 -1.890 13.223 5.488 1.00 13.14 H new ATOM 0 HA3 GLY A 92 -0.881 14.611 5.135 1.00 13.14 H new ATOM 1365 N TYR A 93 0.034 11.697 3.990 1.00 14.23 N ATOM 1366 CA TYR A 93 0.441 11.004 2.796 1.00 51.14 C ATOM 1367 C TYR A 93 -0.637 10.064 2.324 1.00 15.51 C ATOM 1368 O TYR A 93 -1.233 9.332 3.119 1.00 73.41 O ATOM 1369 CB TYR A 93 1.757 10.258 3.000 1.00 3.42 C ATOM 1370 CG TYR A 93 2.950 11.169 3.169 1.00 42.41 C ATOM 1371 CD1 TYR A 93 3.672 11.601 2.065 1.00 42.44 C ATOM 1372 CD2 TYR A 93 3.356 11.595 4.423 1.00 52.50 C ATOM 1373 CE1 TYR A 93 4.765 12.426 2.205 1.00 3.13 C ATOM 1374 CE2 TYR A 93 4.445 12.421 4.572 1.00 31.00 C ATOM 1375 CZ TYR A 93 5.146 12.837 3.459 1.00 61.12 C ATOM 1376 OH TYR A 93 6.246 13.655 3.604 1.00 13.25 O ATOM 0 H TYR A 93 0.173 11.175 4.855 1.00 14.23 H new ATOM 0 HA TYR A 93 0.603 11.755 2.023 1.00 51.14 H new ATOM 0 HB2 TYR A 93 1.670 9.620 3.879 1.00 3.42 H new ATOM 0 HB3 TYR A 93 1.929 9.603 2.146 1.00 3.42 H new ATOM 0 HD1 TYR A 93 3.371 11.284 1.078 1.00 42.44 H new ATOM 0 HD2 TYR A 93 2.809 11.273 5.297 1.00 52.50 H new ATOM 0 HE1 TYR A 93 5.319 12.748 1.335 1.00 3.13 H new ATOM 0 HE2 TYR A 93 4.750 12.743 5.557 1.00 31.00 H new ATOM 0 HH TYR A 93 6.994 13.136 3.967 1.00 13.25 H new ATOM 1386 N ARG A 94 -0.918 10.124 1.045 1.00 22.20 N ATOM 1387 CA ARG A 94 -1.886 9.244 0.427 1.00 24.13 C ATOM 1388 C ARG A 94 -1.222 7.911 0.083 1.00 5.23 C ATOM 1389 O ARG A 94 0.010 7.788 0.130 1.00 4.45 O ATOM 1390 CB ARG A 94 -2.518 9.880 -0.835 1.00 71.42 C ATOM 1391 CG ARG A 94 -1.557 10.059 -2.003 1.00 62.03 C ATOM 1392 CD ARG A 94 -2.218 10.748 -3.191 1.00 44.21 C ATOM 1393 NE ARG A 94 -3.384 10.011 -3.732 1.00 13.01 N ATOM 1394 CZ ARG A 94 -3.674 9.909 -5.047 1.00 33.42 C ATOM 1395 NH1 ARG A 94 -2.763 10.234 -5.965 1.00 62.04 N ATOM 1396 NH2 ARG A 94 -4.846 9.432 -5.439 1.00 44.33 N ATOM 0 H ARG A 94 -0.483 10.784 0.401 1.00 22.20 H new ATOM 0 HA ARG A 94 -2.693 9.073 1.139 1.00 24.13 H new ATOM 0 HB2 ARG A 94 -3.353 9.259 -1.160 1.00 71.42 H new ATOM 0 HB3 ARG A 94 -2.930 10.853 -0.568 1.00 71.42 H new ATOM 0 HG2 ARG A 94 -0.697 10.645 -1.678 1.00 62.03 H new ATOM 0 HG3 ARG A 94 -1.180 9.085 -2.314 1.00 62.03 H new ATOM 0 HD2 ARG A 94 -2.537 11.746 -2.890 1.00 44.21 H new ATOM 0 HD3 ARG A 94 -1.480 10.875 -3.983 1.00 44.21 H new ATOM 0 HE ARG A 94 -4.008 9.551 -3.069 1.00 13.01 H new ATOM 0 HH11 ARG A 94 -1.841 10.562 -5.675 1.00 62.04 H new ATOM 0 HH12 ARG A 94 -2.988 10.155 -6.957 1.00 62.04 H new ATOM 0 HH21 ARG A 94 -5.535 9.139 -4.746 1.00 44.33 H new ATOM 0 HH22 ARG A 94 -5.059 9.357 -6.434 1.00 44.33 H new ATOM 1410 N ASP A 95 -2.034 6.966 -0.324 1.00 31.41 N ATOM 1411 CA ASP A 95 -1.647 5.579 -0.649 1.00 12.13 C ATOM 1412 C ASP A 95 -0.518 5.523 -1.674 1.00 21.12 C ATOM 1413 O ASP A 95 0.412 4.732 -1.541 1.00 35.31 O ATOM 1414 CB ASP A 95 -2.864 4.866 -1.242 1.00 23.01 C ATOM 1415 CG ASP A 95 -3.364 5.575 -2.482 1.00 71.13 C ATOM 1416 OD1 ASP A 95 -3.918 6.678 -2.348 1.00 55.02 O ATOM 1417 OD2 ASP A 95 -3.099 5.111 -3.594 1.00 45.24 O ATOM 0 H ASP A 95 -3.033 7.132 -0.449 1.00 31.41 H new ATOM 0 HA ASP A 95 -1.300 5.102 0.268 1.00 12.13 H new ATOM 0 HB2 ASP A 95 -2.601 3.837 -1.489 1.00 23.01 H new ATOM 0 HB3 ASP A 95 -3.660 4.822 -0.499 1.00 23.01 H new ATOM 1422 N THR A 96 -0.597 6.377 -2.660 1.00 13.35 N ATOM 1423 CA THR A 96 0.360 6.444 -3.714 1.00 14.50 C ATOM 1424 C THR A 96 1.745 6.796 -3.156 1.00 45.13 C ATOM 1425 O THR A 96 2.748 6.216 -3.550 1.00 24.32 O ATOM 1426 CB THR A 96 -0.111 7.459 -4.745 1.00 62.41 C ATOM 1427 OG1 THR A 96 -1.489 7.151 -5.073 1.00 74.20 O ATOM 1428 CG2 THR A 96 0.743 7.379 -6.000 1.00 72.51 C ATOM 0 H THR A 96 -1.350 7.059 -2.748 1.00 13.35 H new ATOM 0 HA THR A 96 0.449 5.473 -4.201 1.00 14.50 H new ATOM 0 HB THR A 96 -0.025 8.467 -4.340 1.00 62.41 H new ATOM 0 HG1 THR A 96 -1.868 7.878 -5.609 1.00 74.20 H new ATOM 0 HG21 THR A 96 0.392 8.112 -6.726 1.00 72.51 H new ATOM 0 HG22 THR A 96 1.782 7.588 -5.747 1.00 72.51 H new ATOM 0 HG23 THR A 96 0.668 6.379 -6.428 1.00 72.51 H new ATOM 1436 N GLU A 97 1.775 7.718 -2.217 1.00 1.21 N ATOM 1437 CA GLU A 97 3.005 8.112 -1.566 1.00 4.20 C ATOM 1438 C GLU A 97 3.551 6.949 -0.738 1.00 45.24 C ATOM 1439 O GLU A 97 4.748 6.726 -0.695 1.00 53.02 O ATOM 1440 CB GLU A 97 2.770 9.334 -0.687 1.00 4.43 C ATOM 1441 CG GLU A 97 2.347 10.578 -1.456 1.00 72.11 C ATOM 1442 CD GLU A 97 3.455 11.162 -2.313 1.00 34.21 C ATOM 1443 OE1 GLU A 97 3.808 10.577 -3.352 1.00 15.11 O ATOM 1444 OE2 GLU A 97 3.964 12.243 -1.975 1.00 25.44 O ATOM 0 H GLU A 97 0.948 8.214 -1.884 1.00 1.21 H new ATOM 0 HA GLU A 97 3.741 8.375 -2.326 1.00 4.20 H new ATOM 0 HB2 GLU A 97 2.003 9.097 0.050 1.00 4.43 H new ATOM 0 HB3 GLU A 97 3.684 9.554 -0.136 1.00 4.43 H new ATOM 0 HG2 GLU A 97 1.497 10.331 -2.092 1.00 72.11 H new ATOM 0 HG3 GLU A 97 2.007 11.335 -0.749 1.00 72.11 H new ATOM 1451 N ILE A 98 2.651 6.186 -0.129 1.00 64.30 N ATOM 1452 CA ILE A 98 3.033 5.031 0.694 1.00 71.15 C ATOM 1453 C ILE A 98 3.757 4.013 -0.189 1.00 51.44 C ATOM 1454 O ILE A 98 4.857 3.552 0.125 1.00 51.43 O ATOM 1455 CB ILE A 98 1.786 4.318 1.312 1.00 11.44 C ATOM 1456 CG1 ILE A 98 0.807 5.307 1.957 1.00 30.33 C ATOM 1457 CG2 ILE A 98 2.212 3.282 2.334 1.00 33.23 C ATOM 1458 CD1 ILE A 98 1.403 6.185 3.018 1.00 11.25 C ATOM 0 H ILE A 98 1.645 6.343 -0.187 1.00 64.30 H new ATOM 0 HA ILE A 98 3.668 5.395 1.501 1.00 71.15 H new ATOM 0 HB ILE A 98 1.268 3.826 0.489 1.00 11.44 H new ATOM 0 HG12 ILE A 98 0.386 5.940 1.176 1.00 30.33 H new ATOM 0 HG13 ILE A 98 -0.020 4.746 2.393 1.00 30.33 H new ATOM 0 HG21 ILE A 98 1.329 2.798 2.751 1.00 33.23 H new ATOM 0 HG22 ILE A 98 2.842 2.534 1.853 1.00 33.23 H new ATOM 0 HG23 ILE A 98 2.771 3.768 3.133 1.00 33.23 H new ATOM 0 HD11 ILE A 98 0.635 6.849 3.414 1.00 11.25 H new ATOM 0 HD12 ILE A 98 1.798 5.566 3.823 1.00 11.25 H new ATOM 0 HD13 ILE A 98 2.210 6.779 2.588 1.00 11.25 H new ATOM 1470 N MET A 99 3.151 3.740 -1.335 1.00 63.35 N ATOM 1471 CA MET A 99 3.676 2.771 -2.296 1.00 2.33 C ATOM 1472 C MET A 99 4.954 3.296 -2.935 1.00 15.45 C ATOM 1473 O MET A 99 5.784 2.519 -3.418 1.00 61.32 O ATOM 1474 CB MET A 99 2.653 2.498 -3.404 1.00 75.40 C ATOM 1475 CG MET A 99 1.287 2.047 -2.925 1.00 72.55 C ATOM 1476 SD MET A 99 1.306 0.507 -2.001 1.00 73.02 S ATOM 1477 CE MET A 99 -0.431 0.375 -1.582 1.00 34.40 C ATOM 0 H MET A 99 2.280 4.183 -1.629 1.00 63.35 H new ATOM 0 HA MET A 99 3.884 1.848 -1.755 1.00 2.33 H new ATOM 0 HB2 MET A 99 2.531 3.405 -3.996 1.00 75.40 H new ATOM 0 HB3 MET A 99 3.057 1.735 -4.070 1.00 75.40 H new ATOM 0 HG2 MET A 99 0.857 2.829 -2.299 1.00 72.55 H new ATOM 0 HG3 MET A 99 0.631 1.933 -3.788 1.00 72.55 H new ATOM 0 HE1 MET A 99 -0.571 -0.429 -0.859 1.00 34.40 H new ATOM 0 HE2 MET A 99 -0.774 1.315 -1.150 1.00 34.40 H new ATOM 0 HE3 MET A 99 -1.007 0.158 -2.482 1.00 34.40 H new ATOM 1487 N ARG A 100 5.100 4.614 -2.926 1.00 40.32 N ATOM 1488 CA ARG A 100 6.222 5.288 -3.526 1.00 11.01 C ATOM 1489 C ARG A 100 7.524 4.820 -2.907 1.00 32.24 C ATOM 1490 O ARG A 100 8.344 4.216 -3.582 1.00 15.32 O ATOM 1491 CB ARG A 100 6.020 6.790 -3.391 1.00 25.22 C ATOM 1492 CG ARG A 100 7.062 7.684 -4.012 1.00 13.03 C ATOM 1493 CD ARG A 100 6.647 9.124 -3.799 1.00 0.44 C ATOM 1494 NE ARG A 100 7.608 10.082 -4.323 1.00 2.14 N ATOM 1495 CZ ARG A 100 7.502 11.409 -4.192 1.00 52.34 C ATOM 1496 NH1 ARG A 100 6.399 11.956 -3.670 1.00 44.30 N ATOM 1497 NH2 ARG A 100 8.492 12.190 -4.607 1.00 20.04 N ATOM 0 H ARG A 100 4.427 5.246 -2.493 1.00 40.32 H new ATOM 0 HA ARG A 100 6.284 5.044 -4.587 1.00 11.01 H new ATOM 0 HB2 ARG A 100 5.054 7.042 -3.830 1.00 25.22 H new ATOM 0 HB3 ARG A 100 5.960 7.029 -2.329 1.00 25.22 H new ATOM 0 HG2 ARG A 100 8.037 7.500 -3.561 1.00 13.03 H new ATOM 0 HG3 ARG A 100 7.158 7.471 -5.077 1.00 13.03 H new ATOM 0 HD2 ARG A 100 5.681 9.291 -4.275 1.00 0.44 H new ATOM 0 HD3 ARG A 100 6.511 9.302 -2.732 1.00 0.44 H new ATOM 0 HE ARG A 100 8.418 9.717 -4.824 1.00 2.14 H new ATOM 0 HH11 ARG A 100 5.628 11.360 -3.367 1.00 44.30 H new ATOM 0 HH12 ARG A 100 6.328 12.969 -3.574 1.00 44.30 H new ATOM 0 HH21 ARG A 100 9.327 11.777 -5.023 1.00 20.04 H new ATOM 0 HH22 ARG A 100 8.418 13.203 -4.510 1.00 20.04 H new ATOM 1511 N TRP A 101 7.703 5.066 -1.638 1.00 33.04 N ATOM 1512 CA TRP A 101 8.902 4.609 -0.960 1.00 32.53 C ATOM 1513 C TRP A 101 8.954 3.082 -0.792 1.00 63.43 C ATOM 1514 O TRP A 101 10.014 2.489 -0.915 1.00 3.42 O ATOM 1515 CB TRP A 101 9.161 5.365 0.355 1.00 24.32 C ATOM 1516 CG TRP A 101 7.964 5.522 1.240 1.00 23.42 C ATOM 1517 CD1 TRP A 101 7.141 6.604 1.297 1.00 33.55 C ATOM 1518 CD2 TRP A 101 7.461 4.584 2.195 1.00 54.22 C ATOM 1519 NE1 TRP A 101 6.160 6.398 2.221 1.00 61.11 N ATOM 1520 CE2 TRP A 101 6.333 5.165 2.789 1.00 5.13 C ATOM 1521 CE3 TRP A 101 7.853 3.311 2.605 1.00 32.11 C ATOM 1522 CZ2 TRP A 101 5.596 4.520 3.767 1.00 45.31 C ATOM 1523 CZ3 TRP A 101 7.117 2.672 3.572 1.00 23.53 C ATOM 1524 CH2 TRP A 101 6.001 3.276 4.147 1.00 41.25 C ATOM 0 H TRP A 101 7.044 5.576 -1.050 1.00 33.04 H new ATOM 0 HA TRP A 101 9.732 4.858 -1.621 1.00 32.53 H new ATOM 0 HB2 TRP A 101 9.939 4.841 0.911 1.00 24.32 H new ATOM 0 HB3 TRP A 101 9.551 6.355 0.117 1.00 24.32 H new ATOM 0 HD1 TRP A 101 7.249 7.496 0.698 1.00 33.55 H new ATOM 0 HE1 TRP A 101 5.417 7.057 2.452 1.00 61.11 H new ATOM 0 HE3 TRP A 101 8.720 2.836 2.170 1.00 32.11 H new ATOM 0 HZ2 TRP A 101 4.730 4.987 4.213 1.00 45.31 H new ATOM 0 HZ3 TRP A 101 7.409 1.683 3.893 1.00 23.53 H new ATOM 0 HH2 TRP A 101 5.446 2.748 4.909 1.00 41.25 H new ATOM 1535 N LEU A 102 7.793 2.457 -0.567 1.00 3.14 N ATOM 1536 CA LEU A 102 7.706 1.001 -0.338 1.00 12.14 C ATOM 1537 C LEU A 102 8.275 0.164 -1.473 1.00 30.42 C ATOM 1538 O LEU A 102 8.986 -0.816 -1.230 1.00 52.54 O ATOM 1539 CB LEU A 102 6.255 0.575 -0.100 1.00 34.34 C ATOM 1540 CG LEU A 102 5.746 0.548 1.330 1.00 31.25 C ATOM 1541 CD1 LEU A 102 4.254 0.334 1.339 1.00 24.12 C ATOM 1542 CD2 LEU A 102 6.411 -0.572 2.100 1.00 44.52 C ATOM 0 H LEU A 102 6.893 2.936 -0.538 1.00 3.14 H new ATOM 0 HA LEU A 102 8.316 0.814 0.546 1.00 12.14 H new ATOM 0 HB2 LEU A 102 5.612 1.245 -0.671 1.00 34.34 H new ATOM 0 HB3 LEU A 102 6.127 -0.423 -0.519 1.00 34.34 H new ATOM 0 HG LEU A 102 5.983 1.502 1.801 1.00 31.25 H new ATOM 0 HD11 LEU A 102 3.895 0.316 2.368 1.00 24.12 H new ATOM 0 HD12 LEU A 102 3.767 1.146 0.799 1.00 24.12 H new ATOM 0 HD13 LEU A 102 4.020 -0.615 0.856 1.00 24.12 H new ATOM 0 HD21 LEU A 102 6.038 -0.581 3.124 1.00 44.52 H new ATOM 0 HD22 LEU A 102 6.185 -1.526 1.623 1.00 44.52 H new ATOM 0 HD23 LEU A 102 7.490 -0.417 2.108 1.00 44.52 H new ATOM 1554 N PHE A 103 8.011 0.548 -2.688 1.00 75.31 N ATOM 1555 CA PHE A 103 8.428 -0.268 -3.803 1.00 13.13 C ATOM 1556 C PHE A 103 9.721 0.187 -4.423 1.00 45.42 C ATOM 1557 O PHE A 103 10.266 -0.498 -5.286 1.00 2.13 O ATOM 1558 CB PHE A 103 7.322 -0.394 -4.839 1.00 52.33 C ATOM 1559 CG PHE A 103 6.133 -1.163 -4.338 1.00 3.24 C ATOM 1560 CD1 PHE A 103 6.094 -2.541 -4.453 1.00 55.53 C ATOM 1561 CD2 PHE A 103 5.061 -0.515 -3.758 1.00 51.25 C ATOM 1562 CE1 PHE A 103 5.003 -3.253 -4.005 1.00 53.00 C ATOM 1563 CE2 PHE A 103 3.974 -1.219 -3.306 1.00 52.33 C ATOM 1564 CZ PHE A 103 3.942 -2.586 -3.431 1.00 11.24 C ATOM 0 H PHE A 103 7.517 1.406 -2.935 1.00 75.31 H new ATOM 0 HA PHE A 103 8.626 -1.260 -3.397 1.00 13.13 H new ATOM 0 HB2 PHE A 103 7.001 0.602 -5.143 1.00 52.33 H new ATOM 0 HB3 PHE A 103 7.718 -0.886 -5.727 1.00 52.33 H new ATOM 0 HD1 PHE A 103 6.927 -3.064 -4.899 1.00 55.53 H new ATOM 0 HD2 PHE A 103 5.078 0.560 -3.659 1.00 51.25 H new ATOM 0 HE1 PHE A 103 4.979 -4.328 -4.103 1.00 53.00 H new ATOM 0 HE2 PHE A 103 3.144 -0.698 -2.852 1.00 52.33 H new ATOM 0 HZ PHE A 103 3.084 -3.140 -3.079 1.00 11.24 H new ATOM 1574 N THR A 104 10.224 1.297 -3.973 1.00 73.12 N ATOM 1575 CA THR A 104 11.450 1.822 -4.496 1.00 74.21 C ATOM 1576 C THR A 104 12.645 1.228 -3.742 1.00 13.11 C ATOM 1577 O THR A 104 12.711 1.318 -2.516 1.00 3.31 O ATOM 1578 CB THR A 104 11.467 3.369 -4.404 1.00 33.51 C ATOM 1579 OG1 THR A 104 10.377 3.896 -5.183 1.00 45.42 O ATOM 1580 CG2 THR A 104 12.776 3.947 -4.930 1.00 51.33 C ATOM 0 H THR A 104 9.799 1.862 -3.237 1.00 73.12 H new ATOM 0 HA THR A 104 11.525 1.542 -5.547 1.00 74.21 H new ATOM 0 HB THR A 104 11.367 3.650 -3.356 1.00 33.51 H new ATOM 0 HG1 THR A 104 9.555 3.876 -4.650 1.00 45.42 H new ATOM 0 HG21 THR A 104 12.752 5.034 -4.850 1.00 51.33 H new ATOM 0 HG22 THR A 104 13.608 3.558 -4.342 1.00 51.33 H new ATOM 0 HG23 THR A 104 12.906 3.663 -5.974 1.00 51.33 H new ATOM 1588 N PRO A 105 13.565 0.547 -4.455 1.00 21.01 N ATOM 1589 CA PRO A 105 14.794 0.057 -3.849 1.00 42.42 C ATOM 1590 C PRO A 105 15.626 1.247 -3.387 1.00 45.35 C ATOM 1591 O PRO A 105 15.881 2.176 -4.170 1.00 54.45 O ATOM 1592 CB PRO A 105 15.509 -0.653 -5.009 1.00 13.15 C ATOM 1593 CG PRO A 105 14.455 -0.915 -6.020 1.00 15.13 C ATOM 1594 CD PRO A 105 13.472 0.199 -5.881 1.00 13.24 C ATOM 0 HA PRO A 105 14.629 -0.592 -2.989 1.00 42.42 H new ATOM 0 HB2 PRO A 105 16.303 -0.030 -5.421 1.00 13.15 H new ATOM 0 HB3 PRO A 105 15.973 -1.581 -4.675 1.00 13.15 H new ATOM 0 HG2 PRO A 105 14.876 -0.942 -7.025 1.00 15.13 H new ATOM 0 HG3 PRO A 105 13.979 -1.880 -5.847 1.00 15.13 H new ATOM 0 HD2 PRO A 105 13.727 1.044 -6.520 1.00 13.24 H new ATOM 0 HD3 PRO A 105 12.465 -0.115 -6.155 1.00 13.24 H new ATOM 1602 N ASP A 106 16.056 1.231 -2.162 1.00 11.25 N ATOM 1603 CA ASP A 106 16.796 2.360 -1.634 1.00 54.21 C ATOM 1604 C ASP A 106 18.274 2.030 -1.524 1.00 31.22 C ATOM 1605 O ASP A 106 18.646 1.086 -0.834 1.00 74.14 O ATOM 1606 CB ASP A 106 16.243 2.792 -0.280 1.00 24.15 C ATOM 1607 CG ASP A 106 16.941 4.018 0.267 1.00 71.41 C ATOM 1608 OD1 ASP A 106 16.602 5.138 -0.131 1.00 51.24 O ATOM 1609 OD2 ASP A 106 17.830 3.882 1.103 1.00 62.02 O ATOM 0 H ASP A 106 15.915 0.462 -1.507 1.00 11.25 H new ATOM 0 HA ASP A 106 16.679 3.191 -2.329 1.00 54.21 H new ATOM 0 HB2 ASP A 106 15.177 2.997 -0.375 1.00 24.15 H new ATOM 0 HB3 ASP A 106 16.347 1.971 0.430 1.00 24.15 H new ATOM 1614 N PRO A 107 19.143 2.793 -2.213 1.00 12.34 N ATOM 1615 CA PRO A 107 20.603 2.563 -2.213 1.00 70.30 C ATOM 1616 C PRO A 107 21.236 2.675 -0.827 1.00 13.30 C ATOM 1617 O PRO A 107 22.305 2.113 -0.570 1.00 11.43 O ATOM 1618 CB PRO A 107 21.147 3.665 -3.128 1.00 15.22 C ATOM 1619 CG PRO A 107 20.071 4.692 -3.182 1.00 3.41 C ATOM 1620 CD PRO A 107 18.780 3.951 -3.057 1.00 2.02 C ATOM 0 HA PRO A 107 20.836 1.551 -2.544 1.00 70.30 H new ATOM 0 HB2 PRO A 107 22.072 4.084 -2.733 1.00 15.22 H new ATOM 0 HB3 PRO A 107 21.372 3.277 -4.122 1.00 15.22 H new ATOM 0 HG2 PRO A 107 20.184 5.416 -2.375 1.00 3.41 H new ATOM 0 HG3 PRO A 107 20.111 5.249 -4.118 1.00 3.41 H new ATOM 0 HD2 PRO A 107 18.007 4.563 -2.592 1.00 2.02 H new ATOM 0 HD3 PRO A 107 18.398 3.638 -4.029 1.00 2.02 H new ATOM 1628 N SER A 108 20.573 3.379 0.056 1.00 2.33 N ATOM 1629 CA SER A 108 21.071 3.605 1.377 1.00 62.31 C ATOM 1630 C SER A 108 20.442 2.609 2.354 1.00 24.31 C ATOM 1631 O SER A 108 20.682 2.662 3.562 1.00 72.13 O ATOM 1632 CB SER A 108 20.754 5.040 1.778 1.00 54.31 C ATOM 1633 OG SER A 108 21.186 5.937 0.752 1.00 14.25 O ATOM 0 H SER A 108 19.668 3.811 -0.129 1.00 2.33 H new ATOM 0 HA SER A 108 22.151 3.456 1.402 1.00 62.31 H new ATOM 0 HB2 SER A 108 19.683 5.152 1.944 1.00 54.31 H new ATOM 0 HB3 SER A 108 21.250 5.282 2.718 1.00 54.31 H new ATOM 0 HG SER A 108 20.978 6.858 1.014 1.00 14.25 H new ATOM 1639 N LEU A 109 19.636 1.715 1.839 1.00 4.14 N ATOM 1640 CA LEU A 109 19.010 0.710 2.639 1.00 4.33 C ATOM 1641 C LEU A 109 19.619 -0.634 2.311 1.00 52.35 C ATOM 1642 O LEU A 109 19.726 -1.016 1.143 1.00 23.11 O ATOM 1643 CB LEU A 109 17.506 0.688 2.385 1.00 64.35 C ATOM 1644 CG LEU A 109 16.682 -0.257 3.253 1.00 45.43 C ATOM 1645 CD1 LEU A 109 16.771 0.135 4.721 1.00 72.00 C ATOM 1646 CD2 LEU A 109 15.240 -0.283 2.790 1.00 30.15 C ATOM 0 H LEU A 109 19.399 1.669 0.848 1.00 4.14 H new ATOM 0 HA LEU A 109 19.172 0.934 3.693 1.00 4.33 H new ATOM 0 HB2 LEU A 109 17.122 1.699 2.522 1.00 64.35 H new ATOM 0 HB3 LEU A 109 17.340 0.423 1.341 1.00 64.35 H new ATOM 0 HG LEU A 109 17.094 -1.261 3.148 1.00 45.43 H new ATOM 0 HD11 LEU A 109 16.175 -0.555 5.319 1.00 72.00 H new ATOM 0 HD12 LEU A 109 17.810 0.092 5.047 1.00 72.00 H new ATOM 0 HD13 LEU A 109 16.392 1.149 4.851 1.00 72.00 H new ATOM 0 HD21 LEU A 109 14.667 -0.963 3.421 1.00 30.15 H new ATOM 0 HD22 LEU A 109 14.817 0.719 2.859 1.00 30.15 H new ATOM 0 HD23 LEU A 109 15.196 -0.624 1.756 1.00 30.15 H new ATOM 1658 N THR A 110 20.033 -1.328 3.322 1.00 34.23 N ATOM 1659 CA THR A 110 20.625 -2.622 3.161 1.00 11.51 C ATOM 1660 C THR A 110 19.940 -3.584 4.131 1.00 11.31 C ATOM 1661 O THR A 110 20.029 -3.427 5.350 1.00 72.25 O ATOM 1662 CB THR A 110 22.152 -2.559 3.398 1.00 52.02 C ATOM 1663 OG1 THR A 110 22.730 -1.523 2.555 1.00 64.10 O ATOM 1664 CG2 THR A 110 22.812 -3.885 3.062 1.00 64.41 C ATOM 0 H THR A 110 19.971 -1.013 4.290 1.00 34.23 H new ATOM 0 HA THR A 110 20.483 -2.979 2.141 1.00 11.51 H new ATOM 0 HB THR A 110 22.324 -2.336 4.451 1.00 52.02 H new ATOM 0 HG1 THR A 110 23.698 -1.481 2.705 1.00 64.10 H new ATOM 0 HG21 THR A 110 23.885 -3.812 3.238 1.00 64.41 H new ATOM 0 HG22 THR A 110 22.394 -4.670 3.692 1.00 64.41 H new ATOM 0 HG23 THR A 110 22.632 -4.126 2.014 1.00 64.41 H new ATOM 1672 N ILE A 111 19.225 -4.523 3.591 1.00 44.41 N ATOM 1673 CA ILE A 111 18.389 -5.412 4.363 1.00 53.53 C ATOM 1674 C ILE A 111 18.824 -6.848 4.182 1.00 15.42 C ATOM 1675 O ILE A 111 19.315 -7.227 3.129 1.00 72.14 O ATOM 1676 CB ILE A 111 16.922 -5.248 3.883 1.00 62.33 C ATOM 1677 CG1 ILE A 111 16.405 -3.836 4.129 1.00 55.10 C ATOM 1678 CG2 ILE A 111 15.973 -6.281 4.446 1.00 42.44 C ATOM 1679 CD1 ILE A 111 16.276 -3.465 5.601 1.00 53.31 C ATOM 0 H ILE A 111 19.200 -4.702 2.587 1.00 44.41 H new ATOM 0 HA ILE A 111 18.475 -5.161 5.420 1.00 53.53 H new ATOM 0 HB ILE A 111 16.950 -5.424 2.808 1.00 62.33 H new ATOM 0 HG12 ILE A 111 17.076 -3.126 3.645 1.00 55.10 H new ATOM 0 HG13 ILE A 111 15.430 -3.730 3.653 1.00 55.10 H new ATOM 0 HG21 ILE A 111 14.969 -6.099 4.064 1.00 42.44 H new ATOM 0 HG22 ILE A 111 16.300 -7.277 4.147 1.00 42.44 H new ATOM 0 HG23 ILE A 111 15.965 -6.213 5.534 1.00 42.44 H new ATOM 0 HD11 ILE A 111 15.902 -2.445 5.688 1.00 53.31 H new ATOM 0 HD12 ILE A 111 15.581 -4.149 6.089 1.00 53.31 H new ATOM 0 HD13 ILE A 111 17.252 -3.536 6.081 1.00 53.31 H new ATOM 1805 N VAL A 120 21.408 -7.390 1.470 1.00 74.31 N ATOM 1806 CA VAL A 120 21.334 -6.881 0.135 1.00 20.34 C ATOM 1807 C VAL A 120 21.087 -5.388 0.205 1.00 53.12 C ATOM 1808 O VAL A 120 20.165 -4.929 0.902 1.00 60.33 O ATOM 1809 CB VAL A 120 20.169 -7.545 -0.655 1.00 4.02 C ATOM 1810 CG1 VAL A 120 20.121 -7.052 -2.095 1.00 54.52 C ATOM 1811 CG2 VAL A 120 20.280 -9.056 -0.613 1.00 43.13 C ATOM 0 HA VAL A 120 22.270 -7.102 -0.378 1.00 20.34 H new ATOM 0 HB VAL A 120 19.237 -7.254 -0.171 1.00 4.02 H new ATOM 0 HG11 VAL A 120 19.296 -7.536 -2.618 1.00 54.52 H new ATOM 0 HG12 VAL A 120 19.974 -5.972 -2.105 1.00 54.52 H new ATOM 0 HG13 VAL A 120 21.059 -7.295 -2.594 1.00 54.52 H new ATOM 0 HG21 VAL A 120 19.455 -9.497 -1.172 1.00 43.13 H new ATOM 0 HG22 VAL A 120 21.226 -9.364 -1.059 1.00 43.13 H new ATOM 0 HG23 VAL A 120 20.239 -9.395 0.422 1.00 43.13 H new ATOM 1821 N SER A 121 21.916 -4.639 -0.455 1.00 32.23 N ATOM 1822 CA SER A 121 21.744 -3.224 -0.526 1.00 54.13 C ATOM 1823 C SER A 121 20.720 -2.959 -1.632 1.00 72.45 C ATOM 1824 O SER A 121 20.545 -3.811 -2.517 1.00 50.31 O ATOM 1825 CB SER A 121 23.097 -2.548 -0.818 1.00 70.51 C ATOM 1826 OG SER A 121 23.047 -1.148 -0.587 1.00 2.33 O ATOM 0 H SER A 121 22.730 -4.993 -0.959 1.00 32.23 H new ATOM 0 HA SER A 121 21.384 -2.810 0.416 1.00 54.13 H new ATOM 0 HB2 SER A 121 23.869 -2.993 -0.190 1.00 70.51 H new ATOM 0 HB3 SER A 121 23.381 -2.736 -1.853 1.00 70.51 H new ATOM 0 HG SER A 121 22.943 -0.978 0.373 1.00 2.33 H new ATOM 1832 N ASN A 122 20.022 -1.830 -1.557 1.00 23.54 N ATOM 1833 CA ASN A 122 18.973 -1.467 -2.508 1.00 3.40 C ATOM 1834 C ASN A 122 17.776 -2.370 -2.339 1.00 34.13 C ATOM 1835 O ASN A 122 17.097 -2.711 -3.312 1.00 3.23 O ATOM 1836 CB ASN A 122 19.444 -1.498 -3.972 1.00 0.54 C ATOM 1837 CG ASN A 122 20.463 -0.448 -4.328 1.00 21.40 C ATOM 1838 OD1 ASN A 122 21.660 -0.652 -4.158 1.00 52.52 O ATOM 1839 ND2 ASN A 122 20.014 0.659 -4.870 1.00 33.34 N ATOM 0 H ASN A 122 20.169 -1.133 -0.827 1.00 23.54 H new ATOM 0 HA ASN A 122 18.699 -0.436 -2.283 1.00 3.40 H new ATOM 0 HB2 ASN A 122 19.866 -2.481 -4.183 1.00 0.54 H new ATOM 0 HB3 ASN A 122 18.577 -1.378 -4.621 1.00 0.54 H new ATOM 0 HD21 ASN A 122 20.668 1.384 -5.165 1.00 33.34 H new ATOM 0 HD22 ASN A 122 19.011 0.795 -4.996 1.00 33.34 H new ATOM 1846 N ALA A 123 17.486 -2.748 -1.117 1.00 74.13 N ATOM 1847 CA ALA A 123 16.336 -3.549 -0.869 1.00 31.54 C ATOM 1848 C ALA A 123 15.129 -2.647 -0.850 1.00 52.20 C ATOM 1849 O ALA A 123 15.247 -1.442 -0.575 1.00 51.20 O ATOM 1850 CB ALA A 123 16.477 -4.295 0.442 1.00 25.42 C ATOM 0 H ALA A 123 18.034 -2.510 -0.290 1.00 74.13 H new ATOM 0 HA ALA A 123 16.224 -4.296 -1.655 1.00 31.54 H new ATOM 0 HB1 ALA A 123 15.588 -4.901 0.613 1.00 25.42 H new ATOM 0 HB2 ALA A 123 17.354 -4.941 0.401 1.00 25.42 H new ATOM 0 HB3 ALA A 123 16.591 -3.580 1.257 1.00 25.42 H new ATOM 1856 N ARG A 124 14.001 -3.183 -1.192 1.00 4.55 N ATOM 1857 CA ARG A 124 12.786 -2.428 -1.156 1.00 52.32 C ATOM 1858 C ARG A 124 12.256 -2.589 0.253 1.00 73.23 C ATOM 1859 O ARG A 124 12.431 -3.664 0.836 1.00 71.12 O ATOM 1860 CB ARG A 124 11.788 -3.024 -2.167 1.00 51.34 C ATOM 1861 CG ARG A 124 12.408 -3.253 -3.537 1.00 70.32 C ATOM 1862 CD ARG A 124 11.520 -4.071 -4.467 1.00 2.54 C ATOM 1863 NE ARG A 124 10.456 -3.310 -5.134 1.00 24.33 N ATOM 1864 CZ ARG A 124 9.469 -3.882 -5.869 1.00 3.11 C ATOM 1865 NH1 ARG A 124 9.211 -5.184 -5.750 1.00 4.40 N ATOM 1866 NH2 ARG A 124 8.729 -3.140 -6.696 1.00 12.34 N ATOM 0 H ARG A 124 13.894 -4.149 -1.502 1.00 4.55 H new ATOM 0 HA ARG A 124 12.939 -1.380 -1.412 1.00 52.32 H new ATOM 0 HB2 ARG A 124 11.408 -3.970 -1.782 1.00 51.34 H new ATOM 0 HB3 ARG A 124 10.934 -2.354 -2.266 1.00 51.34 H new ATOM 0 HG2 ARG A 124 12.618 -2.289 -4.000 1.00 70.32 H new ATOM 0 HG3 ARG A 124 13.364 -3.763 -3.416 1.00 70.32 H new ATOM 0 HD2 ARG A 124 12.147 -4.535 -5.229 1.00 2.54 H new ATOM 0 HD3 ARG A 124 11.064 -4.878 -3.894 1.00 2.54 H new ATOM 0 HE ARG A 124 10.459 -2.294 -5.040 1.00 24.33 H new ATOM 0 HH11 ARG A 124 9.756 -5.755 -5.104 1.00 4.40 H new ATOM 0 HH12 ARG A 124 8.468 -5.609 -6.305 1.00 4.40 H new ATOM 0 HH21 ARG A 124 8.904 -2.138 -6.778 1.00 12.34 H new ATOM 0 HH22 ARG A 124 7.988 -3.575 -7.246 1.00 12.34 H new ATOM 1880 N PRO A 125 11.669 -1.552 0.863 1.00 42.34 N ATOM 1881 CA PRO A 125 11.043 -1.672 2.196 1.00 24.20 C ATOM 1882 C PRO A 125 10.040 -2.853 2.254 1.00 62.22 C ATOM 1883 O PRO A 125 9.817 -3.449 3.307 1.00 55.32 O ATOM 1884 CB PRO A 125 10.332 -0.335 2.358 1.00 22.42 C ATOM 1885 CG PRO A 125 11.171 0.614 1.575 1.00 64.41 C ATOM 1886 CD PRO A 125 11.632 -0.158 0.367 1.00 4.14 C ATOM 0 HA PRO A 125 11.763 -1.878 2.988 1.00 24.20 H new ATOM 0 HB2 PRO A 125 9.312 -0.376 1.975 1.00 22.42 H new ATOM 0 HB3 PRO A 125 10.268 -0.041 3.406 1.00 22.42 H new ATOM 0 HG2 PRO A 125 10.599 1.495 1.283 1.00 64.41 H new ATOM 0 HG3 PRO A 125 12.019 0.965 2.163 1.00 64.41 H new ATOM 0 HD2 PRO A 125 10.945 -0.045 -0.472 1.00 4.14 H new ATOM 0 HD3 PRO A 125 12.611 0.175 0.024 1.00 4.14 H new ATOM 1894 N VAL A 126 9.472 -3.187 1.100 1.00 64.44 N ATOM 1895 CA VAL A 126 8.601 -4.350 0.958 1.00 31.03 C ATOM 1896 C VAL A 126 9.375 -5.651 1.253 1.00 72.24 C ATOM 1897 O VAL A 126 8.893 -6.513 1.986 1.00 0.32 O ATOM 1898 CB VAL A 126 7.991 -4.423 -0.464 1.00 42.12 C ATOM 1899 CG1 VAL A 126 7.177 -5.680 -0.637 1.00 14.55 C ATOM 1900 CG2 VAL A 126 7.117 -3.221 -0.719 1.00 25.50 C ATOM 0 H VAL A 126 9.602 -2.660 0.237 1.00 64.44 H new ATOM 0 HA VAL A 126 7.792 -4.242 1.681 1.00 31.03 H new ATOM 0 HB VAL A 126 8.812 -4.435 -1.181 1.00 42.12 H new ATOM 0 HG11 VAL A 126 6.760 -5.707 -1.644 1.00 14.55 H new ATOM 0 HG12 VAL A 126 7.815 -6.551 -0.485 1.00 14.55 H new ATOM 0 HG13 VAL A 126 6.367 -5.692 0.092 1.00 14.55 H new ATOM 0 HG21 VAL A 126 6.694 -3.285 -1.722 1.00 25.50 H new ATOM 0 HG22 VAL A 126 6.310 -3.196 0.014 1.00 25.50 H new ATOM 0 HG23 VAL A 126 7.713 -2.313 -0.634 1.00 25.50 H new ATOM 1910 N ASP A 127 10.602 -5.754 0.737 1.00 42.42 N ATOM 1911 CA ASP A 127 11.446 -6.950 0.984 1.00 62.23 C ATOM 1912 C ASP A 127 11.680 -7.101 2.459 1.00 63.23 C ATOM 1913 O ASP A 127 11.670 -8.213 3.004 1.00 41.21 O ATOM 1914 CB ASP A 127 12.833 -6.879 0.302 1.00 64.40 C ATOM 1915 CG ASP A 127 12.829 -7.005 -1.200 1.00 31.55 C ATOM 1916 OD1 ASP A 127 12.338 -8.045 -1.733 1.00 45.23 O ATOM 1917 OD2 ASP A 127 13.356 -6.093 -1.881 1.00 54.53 O ATOM 0 H ASP A 127 11.038 -5.041 0.152 1.00 42.42 H new ATOM 0 HA ASP A 127 10.902 -7.795 0.562 1.00 62.23 H new ATOM 0 HB2 ASP A 127 13.300 -5.931 0.568 1.00 64.40 H new ATOM 0 HB3 ASP A 127 13.461 -7.670 0.713 1.00 64.40 H new ATOM 1922 N ALA A 128 11.850 -5.966 3.098 1.00 52.44 N ATOM 1923 CA ALA A 128 12.123 -5.880 4.502 1.00 45.51 C ATOM 1924 C ALA A 128 10.937 -6.339 5.350 1.00 33.34 C ATOM 1925 O ALA A 128 11.133 -6.979 6.371 1.00 22.40 O ATOM 1926 CB ALA A 128 12.531 -4.460 4.864 1.00 62.41 C ATOM 0 H ALA A 128 11.800 -5.057 2.637 1.00 52.44 H new ATOM 0 HA ALA A 128 12.948 -6.557 4.723 1.00 45.51 H new ATOM 0 HB1 ALA A 128 12.737 -4.402 5.933 1.00 62.41 H new ATOM 0 HB2 ALA A 128 13.426 -4.185 4.306 1.00 62.41 H new ATOM 0 HB3 ALA A 128 11.722 -3.774 4.613 1.00 62.41 H new ATOM 1932 N LEU A 129 9.715 -6.048 4.927 1.00 52.54 N ATOM 1933 CA LEU A 129 8.550 -6.426 5.728 1.00 20.21 C ATOM 1934 C LEU A 129 8.356 -7.943 5.742 1.00 52.45 C ATOM 1935 O LEU A 129 8.074 -8.520 6.787 1.00 41.14 O ATOM 1936 CB LEU A 129 7.274 -5.638 5.323 1.00 1.34 C ATOM 1937 CG LEU A 129 6.678 -5.904 3.938 1.00 11.21 C ATOM 1938 CD1 LEU A 129 5.774 -7.125 3.957 1.00 63.35 C ATOM 1939 CD2 LEU A 129 5.943 -4.684 3.410 1.00 32.30 C ATOM 0 H LEU A 129 9.502 -5.563 4.055 1.00 52.54 H new ATOM 0 HA LEU A 129 8.747 -6.134 6.760 1.00 20.21 H new ATOM 0 HB2 LEU A 129 6.503 -5.846 6.065 1.00 1.34 H new ATOM 0 HB3 LEU A 129 7.502 -4.574 5.390 1.00 1.34 H new ATOM 0 HG LEU A 129 7.503 -6.111 3.257 1.00 11.21 H new ATOM 0 HD11 LEU A 129 5.365 -7.290 2.960 1.00 63.35 H new ATOM 0 HD12 LEU A 129 6.349 -7.999 4.262 1.00 63.35 H new ATOM 0 HD13 LEU A 129 4.959 -6.963 4.662 1.00 63.35 H new ATOM 0 HD21 LEU A 129 5.532 -4.905 2.425 1.00 32.30 H new ATOM 0 HD22 LEU A 129 5.133 -4.424 4.092 1.00 32.30 H new ATOM 0 HD23 LEU A 129 6.636 -3.846 3.334 1.00 32.30 H new ATOM 1951 N HIS A 130 8.598 -8.597 4.591 1.00 0.32 N ATOM 1952 CA HIS A 130 8.495 -10.059 4.501 1.00 74.14 C ATOM 1953 C HIS A 130 9.617 -10.699 5.288 1.00 30.10 C ATOM 1954 O HIS A 130 9.522 -11.839 5.733 1.00 75.21 O ATOM 1955 CB HIS A 130 8.577 -10.558 3.050 1.00 10.12 C ATOM 1956 CG HIS A 130 7.452 -10.149 2.148 1.00 11.50 C ATOM 1957 ND1 HIS A 130 6.242 -10.813 2.060 1.00 32.41 N ATOM 1958 CD2 HIS A 130 7.387 -9.145 1.254 1.00 65.01 C ATOM 1959 CE1 HIS A 130 5.507 -10.200 1.137 1.00 31.13 C ATOM 1960 NE2 HIS A 130 6.158 -9.179 0.611 1.00 42.30 N ATOM 0 H HIS A 130 8.864 -8.138 3.720 1.00 0.32 H new ATOM 0 HA HIS A 130 7.523 -10.337 4.908 1.00 74.14 H new ATOM 0 HB2 HIS A 130 9.511 -10.201 2.617 1.00 10.12 H new ATOM 0 HB3 HIS A 130 8.627 -11.647 3.064 1.00 10.12 H new ATOM 0 HD1 HIS A 130 5.963 -11.628 2.606 1.00 32.41 H new ATOM 0 HD2 HIS A 130 8.170 -8.425 1.066 1.00 65.01 H new ATOM 0 HE1 HIS A 130 4.508 -10.498 0.855 1.00 31.13 H new ATOM 1968 N ALA A 131 10.676 -9.945 5.469 1.00 72.43 N ATOM 1969 CA ALA A 131 11.840 -10.424 6.197 1.00 62.11 C ATOM 1970 C ALA A 131 11.751 -10.058 7.677 1.00 22.45 C ATOM 1971 O ALA A 131 12.704 -10.261 8.430 1.00 74.53 O ATOM 1972 CB ALA A 131 13.120 -9.867 5.582 1.00 73.44 C ATOM 0 H ALA A 131 10.761 -8.990 5.121 1.00 72.43 H new ATOM 0 HA ALA A 131 11.863 -11.511 6.121 1.00 62.11 H new ATOM 0 HB1 ALA A 131 13.982 -10.235 6.139 1.00 73.44 H new ATOM 0 HB2 ALA A 131 13.195 -10.189 4.543 1.00 73.44 H new ATOM 0 HB3 ALA A 131 13.100 -8.778 5.624 1.00 73.44 H new ATOM 1978 N HIS A 132 10.588 -9.510 8.077 1.00 10.40 N ATOM 1979 CA HIS A 132 10.314 -9.085 9.464 1.00 0.35 C ATOM 1980 C HIS A 132 11.292 -8.025 9.955 1.00 51.25 C ATOM 1981 O HIS A 132 11.510 -7.841 11.147 1.00 1.54 O ATOM 1982 CB HIS A 132 10.191 -10.272 10.431 1.00 60.43 C ATOM 1983 CG HIS A 132 8.905 -11.025 10.260 1.00 61.33 C ATOM 1984 ND1 HIS A 132 8.788 -12.209 9.585 1.00 55.23 N ATOM 1985 CD2 HIS A 132 7.656 -10.718 10.689 1.00 34.23 C ATOM 1986 CE1 HIS A 132 7.512 -12.582 9.611 1.00 2.22 C ATOM 1987 NE2 HIS A 132 6.773 -11.708 10.275 1.00 53.02 N ATOM 0 H HIS A 132 9.806 -9.348 7.442 1.00 10.40 H new ATOM 0 HA HIS A 132 9.335 -8.607 9.448 1.00 0.35 H new ATOM 0 HB2 HIS A 132 11.029 -10.951 10.275 1.00 60.43 H new ATOM 0 HB3 HIS A 132 10.262 -9.909 11.456 1.00 60.43 H new ATOM 0 HD2 HIS A 132 7.389 -9.842 11.262 1.00 34.23 H new ATOM 0 HE1 HIS A 132 7.129 -13.481 9.150 1.00 2.22 H new ATOM 0 HE2 HIS A 132 5.768 -11.752 10.447 1.00 53.02 H new ATOM 1995 N GLN A 133 11.777 -7.263 9.016 1.00 74.24 N ATOM 1996 CA GLN A 133 12.656 -6.137 9.249 1.00 0.34 C ATOM 1997 C GLN A 133 11.788 -4.886 9.284 1.00 73.20 C ATOM 1998 O GLN A 133 12.255 -3.769 9.080 1.00 62.43 O ATOM 1999 CB GLN A 133 13.677 -6.035 8.115 1.00 23.11 C ATOM 2000 CG GLN A 133 14.590 -7.242 7.982 1.00 12.24 C ATOM 2001 CD GLN A 133 15.474 -7.438 9.185 1.00 24.03 C ATOM 2002 OE1 GLN A 133 15.121 -8.135 10.129 1.00 2.11 O ATOM 2003 NE2 GLN A 133 16.609 -6.813 9.169 1.00 52.33 N ATOM 0 H GLN A 133 11.567 -7.409 8.029 1.00 74.24 H new ATOM 0 HA GLN A 133 13.199 -6.254 10.187 1.00 0.34 H new ATOM 0 HB2 GLN A 133 13.144 -5.892 7.175 1.00 23.11 H new ATOM 0 HB3 GLN A 133 14.289 -5.147 8.273 1.00 23.11 H new ATOM 0 HG2 GLN A 133 13.984 -8.136 7.832 1.00 12.24 H new ATOM 0 HG3 GLN A 133 15.212 -7.126 7.094 1.00 12.24 H new ATOM 0 HE21 GLN A 133 16.866 -6.242 8.363 1.00 52.33 H new ATOM 0 HE22 GLN A 133 17.246 -6.892 9.962 1.00 52.33 H new ATOM 2012 N ALA A 134 10.512 -5.119 9.584 1.00 54.50 N ATOM 2013 CA ALA A 134 9.450 -4.122 9.618 1.00 51.54 C ATOM 2014 C ALA A 134 9.791 -2.929 10.503 1.00 11.40 C ATOM 2015 O ALA A 134 9.328 -1.826 10.251 1.00 24.54 O ATOM 2016 CB ALA A 134 8.146 -4.769 10.052 1.00 65.54 C ATOM 0 H ALA A 134 10.177 -6.053 9.821 1.00 54.50 H new ATOM 0 HA ALA A 134 9.337 -3.730 8.607 1.00 51.54 H new ATOM 0 HB1 ALA A 134 7.357 -4.017 10.075 1.00 65.54 H new ATOM 0 HB2 ALA A 134 7.878 -5.555 9.347 1.00 65.54 H new ATOM 0 HB3 ALA A 134 8.266 -5.199 11.046 1.00 65.54 H new ATOM 2022 N ARG A 135 10.610 -3.157 11.527 1.00 74.24 N ATOM 2023 CA ARG A 135 11.058 -2.106 12.424 1.00 24.51 C ATOM 2024 C ARG A 135 11.737 -0.991 11.606 1.00 53.51 C ATOM 2025 O ARG A 135 11.484 0.204 11.815 1.00 32.45 O ATOM 2026 CB ARG A 135 12.084 -2.678 13.392 1.00 52.14 C ATOM 2027 CG ARG A 135 12.441 -1.736 14.511 1.00 2.04 C ATOM 2028 CD ARG A 135 13.707 -2.166 15.214 1.00 5.50 C ATOM 2029 NE ARG A 135 14.895 -1.940 14.369 1.00 32.20 N ATOM 2030 CZ ARG A 135 16.084 -2.530 14.510 1.00 20.21 C ATOM 2031 NH1 ARG A 135 16.253 -3.525 15.370 1.00 72.13 N ATOM 2032 NH2 ARG A 135 17.088 -2.139 13.748 1.00 5.24 N ATOM 0 H ARG A 135 10.980 -4.080 11.755 1.00 74.24 H new ATOM 0 HA ARG A 135 10.202 -1.707 12.968 1.00 24.51 H new ATOM 0 HB2 ARG A 135 11.695 -3.604 13.816 1.00 52.14 H new ATOM 0 HB3 ARG A 135 12.989 -2.935 12.841 1.00 52.14 H new ATOM 0 HG2 ARG A 135 12.568 -0.729 14.114 1.00 2.04 H new ATOM 0 HG3 ARG A 135 11.621 -1.694 15.228 1.00 2.04 H new ATOM 0 HD2 ARG A 135 13.812 -1.613 16.148 1.00 5.50 H new ATOM 0 HD3 ARG A 135 13.640 -3.222 15.475 1.00 5.50 H new ATOM 0 HE ARG A 135 14.799 -1.270 13.606 1.00 32.20 H new ATOM 0 HH11 ARG A 135 15.468 -3.850 15.935 1.00 72.13 H new ATOM 0 HH12 ARG A 135 17.168 -3.966 15.466 1.00 72.13 H new ATOM 0 HH21 ARG A 135 16.949 -1.396 13.063 1.00 5.24 H new ATOM 0 HH22 ARG A 135 18.003 -2.580 13.844 1.00 5.24 H new ATOM 2046 N GLU A 136 12.558 -1.407 10.653 1.00 10.51 N ATOM 2047 CA GLU A 136 13.284 -0.503 9.785 1.00 2.24 C ATOM 2048 C GLU A 136 12.347 0.127 8.763 1.00 30.23 C ATOM 2049 O GLU A 136 12.544 1.261 8.348 1.00 0.14 O ATOM 2050 CB GLU A 136 14.432 -1.231 9.100 1.00 5.44 C ATOM 2051 CG GLU A 136 15.466 -1.772 10.075 1.00 71.13 C ATOM 2052 CD GLU A 136 16.133 -0.678 10.885 1.00 40.21 C ATOM 2053 OE1 GLU A 136 17.115 -0.066 10.391 1.00 53.34 O ATOM 2054 OE2 GLU A 136 15.718 -0.431 12.040 1.00 44.31 O ATOM 0 H GLU A 136 12.738 -2.393 10.462 1.00 10.51 H new ATOM 0 HA GLU A 136 13.706 0.298 10.392 1.00 2.24 H new ATOM 0 HB2 GLU A 136 14.031 -2.056 8.511 1.00 5.44 H new ATOM 0 HB3 GLU A 136 14.921 -0.550 8.403 1.00 5.44 H new ATOM 0 HG2 GLU A 136 14.986 -2.479 10.752 1.00 71.13 H new ATOM 0 HG3 GLU A 136 16.226 -2.325 9.523 1.00 71.13 H new ATOM 2061 N VAL A 137 11.307 -0.608 8.381 1.00 24.11 N ATOM 2062 CA VAL A 137 10.296 -0.082 7.466 1.00 11.11 C ATOM 2063 C VAL A 137 9.588 1.091 8.136 1.00 1.34 C ATOM 2064 O VAL A 137 9.427 2.149 7.538 1.00 64.32 O ATOM 2065 CB VAL A 137 9.254 -1.167 7.051 1.00 61.31 C ATOM 2066 CG1 VAL A 137 8.196 -0.589 6.113 1.00 75.51 C ATOM 2067 CG2 VAL A 137 9.945 -2.344 6.388 1.00 4.21 C ATOM 0 H VAL A 137 11.141 -1.566 8.689 1.00 24.11 H new ATOM 0 HA VAL A 137 10.798 0.244 6.555 1.00 11.11 H new ATOM 0 HB VAL A 137 8.757 -1.511 7.958 1.00 61.31 H new ATOM 0 HG11 VAL A 137 7.485 -1.369 5.842 1.00 75.51 H new ATOM 0 HG12 VAL A 137 7.670 0.223 6.614 1.00 75.51 H new ATOM 0 HG13 VAL A 137 8.677 -0.208 5.212 1.00 75.51 H new ATOM 0 HG21 VAL A 137 9.202 -3.090 6.106 1.00 4.21 H new ATOM 0 HG22 VAL A 137 10.472 -2.002 5.497 1.00 4.21 H new ATOM 0 HG23 VAL A 137 10.658 -2.787 7.084 1.00 4.21 H new ATOM 2077 N VAL A 138 9.226 0.906 9.402 1.00 5.42 N ATOM 2078 CA VAL A 138 8.604 1.960 10.197 1.00 61.43 C ATOM 2079 C VAL A 138 9.578 3.130 10.355 1.00 20.12 C ATOM 2080 O VAL A 138 9.195 4.286 10.222 1.00 32.15 O ATOM 2081 CB VAL A 138 8.142 1.457 11.597 1.00 70.02 C ATOM 2082 CG1 VAL A 138 7.496 2.587 12.397 1.00 61.24 C ATOM 2083 CG2 VAL A 138 7.166 0.296 11.456 1.00 65.32 C ATOM 0 H VAL A 138 9.354 0.027 9.903 1.00 5.42 H new ATOM 0 HA VAL A 138 7.711 2.287 9.664 1.00 61.43 H new ATOM 0 HB VAL A 138 9.025 1.111 12.135 1.00 70.02 H new ATOM 0 HG11 VAL A 138 7.182 2.210 13.370 1.00 61.24 H new ATOM 0 HG12 VAL A 138 8.217 3.393 12.535 1.00 61.24 H new ATOM 0 HG13 VAL A 138 6.628 2.965 11.857 1.00 61.24 H new ATOM 0 HG21 VAL A 138 6.856 -0.041 12.445 1.00 65.32 H new ATOM 0 HG22 VAL A 138 6.292 0.622 10.893 1.00 65.32 H new ATOM 0 HG23 VAL A 138 7.651 -0.525 10.929 1.00 65.32 H new ATOM 2093 N ARG A 139 10.840 2.807 10.603 1.00 4.34 N ATOM 2094 CA ARG A 139 11.907 3.802 10.736 1.00 25.33 C ATOM 2095 C ARG A 139 11.988 4.659 9.465 1.00 11.10 C ATOM 2096 O ARG A 139 12.041 5.894 9.534 1.00 4.41 O ATOM 2097 CB ARG A 139 13.243 3.083 10.996 1.00 3.22 C ATOM 2098 CG ARG A 139 14.459 3.988 11.151 1.00 21.41 C ATOM 2099 CD ARG A 139 15.714 3.163 11.406 1.00 1.32 C ATOM 2100 NE ARG A 139 16.929 3.987 11.538 1.00 43.23 N ATOM 2101 CZ ARG A 139 18.182 3.573 11.232 1.00 71.14 C ATOM 2102 NH1 ARG A 139 18.409 2.309 10.850 1.00 2.24 N ATOM 2103 NH2 ARG A 139 19.206 4.408 11.362 1.00 42.52 N ATOM 0 H ARG A 139 11.159 1.845 10.719 1.00 4.34 H new ATOM 0 HA ARG A 139 11.691 4.461 11.577 1.00 25.33 H new ATOM 0 HB2 ARG A 139 13.142 2.483 11.900 1.00 3.22 H new ATOM 0 HB3 ARG A 139 13.429 2.392 10.174 1.00 3.22 H new ATOM 0 HG2 ARG A 139 14.589 4.588 10.251 1.00 21.41 H new ATOM 0 HG3 ARG A 139 14.300 4.682 11.977 1.00 21.41 H new ATOM 0 HD2 ARG A 139 15.578 2.577 12.315 1.00 1.32 H new ATOM 0 HD3 ARG A 139 15.849 2.455 10.588 1.00 1.32 H new ATOM 0 HE ARG A 139 16.818 4.940 11.886 1.00 43.23 H new ATOM 0 HH11 ARG A 139 17.634 1.648 10.787 1.00 2.24 H new ATOM 0 HH12 ARG A 139 19.356 2.008 10.622 1.00 2.24 H new ATOM 0 HH21 ARG A 139 19.049 5.360 11.692 1.00 42.52 H new ATOM 0 HH22 ARG A 139 20.150 4.097 11.132 1.00 42.52 H new ATOM 2117 N ARG A 140 11.944 4.001 8.316 1.00 24.21 N ATOM 2118 CA ARG A 140 11.961 4.680 7.029 1.00 73.14 C ATOM 2119 C ARG A 140 10.669 5.453 6.792 1.00 53.10 C ATOM 2120 O ARG A 140 10.696 6.542 6.246 1.00 11.33 O ATOM 2121 CB ARG A 140 12.238 3.698 5.888 1.00 42.23 C ATOM 2122 CG ARG A 140 13.648 3.122 5.900 1.00 22.33 C ATOM 2123 CD ARG A 140 14.683 4.213 5.672 1.00 61.43 C ATOM 2124 NE ARG A 140 16.056 3.706 5.708 1.00 11.15 N ATOM 2125 CZ ARG A 140 16.908 3.721 4.673 1.00 41.12 C ATOM 2126 NH1 ARG A 140 16.466 3.973 3.441 1.00 51.21 N ATOM 2127 NH2 ARG A 140 18.186 3.420 4.872 1.00 51.12 N ATOM 0 H ARG A 140 11.896 2.984 8.249 1.00 24.21 H new ATOM 0 HA ARG A 140 12.777 5.403 7.049 1.00 73.14 H new ATOM 0 HB2 ARG A 140 11.521 2.879 5.944 1.00 42.23 H new ATOM 0 HB3 ARG A 140 12.071 4.204 4.937 1.00 42.23 H new ATOM 0 HG2 ARG A 140 13.836 2.631 6.855 1.00 22.33 H new ATOM 0 HG3 ARG A 140 13.740 2.360 5.126 1.00 22.33 H new ATOM 0 HD2 ARG A 140 14.500 4.686 4.707 1.00 61.43 H new ATOM 0 HD3 ARG A 140 14.565 4.985 6.433 1.00 61.43 H new ATOM 0 HE ARG A 140 16.390 3.311 6.587 1.00 11.15 H new ATOM 0 HH11 ARG A 140 15.475 4.156 3.282 1.00 51.21 H new ATOM 0 HH12 ARG A 140 17.119 3.983 2.657 1.00 51.21 H new ATOM 0 HH21 ARG A 140 18.514 3.179 5.808 1.00 51.12 H new ATOM 0 HH22 ARG A 140 18.840 3.429 4.089 1.00 51.12 H new ATOM 2141 N ALA A 141 9.557 4.891 7.232 1.00 34.11 N ATOM 2142 CA ALA A 141 8.249 5.531 7.136 1.00 73.41 C ATOM 2143 C ALA A 141 8.264 6.858 7.887 1.00 64.51 C ATOM 2144 O ALA A 141 7.793 7.884 7.383 1.00 4.20 O ATOM 2145 CB ALA A 141 7.183 4.607 7.707 1.00 44.25 C ATOM 0 H ALA A 141 9.532 3.970 7.670 1.00 34.11 H new ATOM 0 HA ALA A 141 8.018 5.728 6.089 1.00 73.41 H new ATOM 0 HB1 ALA A 141 6.208 5.088 7.634 1.00 44.25 H new ATOM 0 HB2 ALA A 141 7.171 3.674 7.144 1.00 44.25 H new ATOM 0 HB3 ALA A 141 7.406 4.397 8.753 1.00 44.25 H new ATOM 2151 N GLN A 142 8.849 6.839 9.074 1.00 43.12 N ATOM 2152 CA GLN A 142 8.998 8.036 9.892 1.00 60.14 C ATOM 2153 C GLN A 142 9.908 9.035 9.203 1.00 1.21 C ATOM 2154 O GLN A 142 9.652 10.228 9.219 1.00 25.24 O ATOM 2155 CB GLN A 142 9.561 7.687 11.259 1.00 60.14 C ATOM 2156 CG GLN A 142 8.698 6.737 12.062 1.00 72.02 C ATOM 2157 CD GLN A 142 9.355 6.333 13.353 1.00 72.34 C ATOM 2158 OE1 GLN A 142 10.578 6.280 13.452 1.00 50.14 O ATOM 2159 NE2 GLN A 142 8.576 6.033 14.337 1.00 2.34 N ATOM 0 H GLN A 142 9.234 5.995 9.499 1.00 43.12 H new ATOM 0 HA GLN A 142 8.012 8.482 10.023 1.00 60.14 H new ATOM 0 HB2 GLN A 142 10.548 7.243 11.130 1.00 60.14 H new ATOM 0 HB3 GLN A 142 9.697 8.606 11.829 1.00 60.14 H new ATOM 0 HG2 GLN A 142 7.740 7.210 12.276 1.00 72.02 H new ATOM 0 HG3 GLN A 142 8.489 5.847 11.468 1.00 72.02 H new ATOM 0 HE21 GLN A 142 7.564 6.088 14.221 1.00 2.34 H new ATOM 0 HE22 GLN A 142 8.972 5.741 15.230 1.00 2.34 H new ATOM 2168 N ALA A 143 10.945 8.527 8.561 1.00 2.43 N ATOM 2169 CA ALA A 143 11.906 9.356 7.844 1.00 54.04 C ATOM 2170 C ALA A 143 11.298 9.955 6.572 1.00 54.10 C ATOM 2171 O ALA A 143 11.843 10.903 5.997 1.00 42.01 O ATOM 2172 CB ALA A 143 13.165 8.562 7.518 1.00 2.11 C ATOM 0 H ALA A 143 11.147 7.528 8.520 1.00 2.43 H new ATOM 0 HA ALA A 143 12.178 10.184 8.499 1.00 54.04 H new ATOM 0 HB1 ALA A 143 13.869 9.199 6.983 1.00 2.11 H new ATOM 0 HB2 ALA A 143 13.624 8.211 8.443 1.00 2.11 H new ATOM 0 HB3 ALA A 143 12.904 7.706 6.895 1.00 2.11 H new ATOM 2178 N MET A 144 10.198 9.391 6.112 1.00 11.15 N ATOM 2179 CA MET A 144 9.495 9.927 4.953 1.00 41.23 C ATOM 2180 C MET A 144 8.504 10.986 5.385 1.00 74.40 C ATOM 2181 O MET A 144 8.207 11.921 4.644 1.00 13.12 O ATOM 2182 CB MET A 144 8.771 8.829 4.157 1.00 44.44 C ATOM 2183 CG MET A 144 9.689 7.773 3.569 1.00 22.31 C ATOM 2184 SD MET A 144 10.991 8.468 2.515 1.00 73.54 S ATOM 2185 CE MET A 144 10.033 9.247 1.207 1.00 23.23 C ATOM 0 H MET A 144 9.768 8.561 6.521 1.00 11.15 H new ATOM 0 HA MET A 144 10.244 10.372 4.298 1.00 41.23 H new ATOM 0 HB2 MET A 144 8.047 8.341 4.810 1.00 44.44 H new ATOM 0 HB3 MET A 144 8.208 9.295 3.348 1.00 44.44 H new ATOM 0 HG2 MET A 144 10.149 7.208 4.380 1.00 22.31 H new ATOM 0 HG3 MET A 144 9.096 7.068 2.986 1.00 22.31 H new ATOM 0 HE1 MET A 144 10.695 9.525 0.387 1.00 23.23 H new ATOM 0 HE2 MET A 144 9.279 8.549 0.844 1.00 23.23 H new ATOM 0 HE3 MET A 144 9.544 10.140 1.597 1.00 23.23 H new ATOM 2195 N ALA A 145 7.992 10.844 6.581 1.00 71.30 N ATOM 2196 CA ALA A 145 7.038 11.796 7.095 1.00 21.43 C ATOM 2197 C ALA A 145 7.739 12.995 7.703 1.00 20.34 C ATOM 2198 O ALA A 145 7.356 14.144 7.457 1.00 42.13 O ATOM 2199 CB ALA A 145 6.107 11.147 8.099 1.00 54.20 C ATOM 0 H ALA A 145 8.219 10.080 7.217 1.00 71.30 H new ATOM 0 HA ALA A 145 6.435 12.148 6.258 1.00 21.43 H new ATOM 0 HB1 ALA A 145 5.399 11.888 8.470 1.00 54.20 H new ATOM 0 HB2 ALA A 145 5.563 10.334 7.618 1.00 54.20 H new ATOM 0 HB3 ALA A 145 6.689 10.752 8.932 1.00 54.20 H new ATOM 2205 N TYR A 146 8.761 12.735 8.474 1.00 24.23 N ATOM 2206 CA TYR A 146 9.492 13.780 9.130 1.00 20.21 C ATOM 2207 C TYR A 146 10.884 13.840 8.516 1.00 3.33 C ATOM 2208 O TYR A 146 11.045 14.442 7.435 1.00 37.37 O ATOM 2209 CB TYR A 146 9.590 13.483 10.642 1.00 62.24 C ATOM 2210 CG TYR A 146 8.261 13.136 11.293 1.00 2.23 C ATOM 2211 CD1 TYR A 146 7.360 14.122 11.670 1.00 24.05 C ATOM 2212 CD2 TYR A 146 7.907 11.808 11.515 1.00 14.20 C ATOM 2213 CE1 TYR A 146 6.148 13.794 12.252 1.00 11.11 C ATOM 2214 CE2 TYR A 146 6.702 11.474 12.092 1.00 63.43 C ATOM 2215 CZ TYR A 146 5.824 12.466 12.460 1.00 11.44 C ATOM 2216 OH TYR A 146 4.610 12.122 13.041 1.00 62.41 O ATOM 2217 OXT TYR A 146 11.826 13.252 9.085 1.00 37.37 O ATOM 0 H TYR A 146 9.108 11.795 8.663 1.00 24.23 H new ATOM 0 HA TYR A 146 8.985 14.736 9.001 1.00 20.21 H new ATOM 0 HB2 TYR A 146 10.284 12.657 10.795 1.00 62.24 H new ATOM 0 HB3 TYR A 146 10.013 14.352 11.146 1.00 62.24 H new ATOM 0 HD1 TYR A 146 7.608 15.160 11.507 1.00 24.05 H new ATOM 0 HD2 TYR A 146 8.592 11.023 11.229 1.00 14.20 H new ATOM 0 HE1 TYR A 146 5.458 14.572 12.543 1.00 11.11 H new ATOM 0 HE2 TYR A 146 6.448 10.437 12.255 1.00 63.43 H new ATOM 0 HH TYR A 146 3.929 12.781 12.791 1.00 62.41 H new