USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=20 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 USER MOD Set 1.2: A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc=-0.00176 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+ 156:sc= -1.47 (180deg=-2.44!) USER MOD Single : A 48 GLN : amide:sc= -0.524 K(o=-0.52,f=-1.4) USER MOD Single : A 49 GLN : amide:sc= -1.41! X(o=-1.4!,f=-1) USER MOD Single : A 54 HIS : no HE2:sc= 0.864 K(o=0.86,f=-3.7!) USER MOD Single : A 68 GLN :FLIP amide:sc= -0.0771 F(o=-1.4!,f=-0.077) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0358 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 63:sc= 1.28 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 93 TYR OH : rot -108:sc= 0.944 USER MOD Single : A 96 THR OG1 : rot 161:sc= 0.641 USER MOD Single : A 99 MET CE :methyl 159:sc= -0.937 (180deg=-1.45) USER MOD Single : A 104 THR OG1 : rot 83:sc= 1.25 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc=-0.00113 K(o=-0.0011,f=-0.78) USER MOD Single : A 130 HIS : no HE2:sc= -0.0255 X(o=-0.026,f=-0.4) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 GLN : amide:sc= -0.361 K(o=-0.36,f=-4.2!) USER MOD Single : A 142 GLN : amide:sc= -0.82 K(o=-0.82,f=-2.9!) USER MOD Single : A 144 MET CE :methyl -164:sc= -0.202 (180deg=-0.593) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 239 N ALA A 18 -7.856 5.917 -3.053 1.00 31.01 N ATOM 240 CA ALA A 18 -6.981 5.188 -3.946 1.00 54.51 C ATOM 241 C ALA A 18 -6.591 6.067 -5.126 1.00 4.14 C ATOM 242 O ALA A 18 -7.471 6.626 -5.803 1.00 41.33 O ATOM 243 CB ALA A 18 -7.679 3.928 -4.440 1.00 2.41 C ATOM 0 HA ALA A 18 -6.078 4.904 -3.406 1.00 54.51 H new ATOM 0 HB1 ALA A 18 -7.015 3.384 -5.112 1.00 2.41 H new ATOM 0 HB2 ALA A 18 -7.933 3.295 -3.589 1.00 2.41 H new ATOM 0 HB3 ALA A 18 -8.590 4.202 -4.973 1.00 2.41 H new ATOM 249 N GLY A 19 -5.304 6.213 -5.352 1.00 0.44 N ATOM 250 CA GLY A 19 -4.825 7.000 -6.444 1.00 44.44 C ATOM 251 C GLY A 19 -4.048 6.180 -7.443 1.00 61.41 C ATOM 252 O GLY A 19 -4.637 5.467 -8.258 1.00 34.14 O ATOM 0 H GLY A 19 -4.572 5.789 -4.783 1.00 0.44 H new ATOM 0 HA2 GLY A 19 -5.669 7.474 -6.945 1.00 44.44 H new ATOM 0 HA3 GLY A 19 -4.191 7.800 -6.062 1.00 44.44 H new ATOM 256 N ASP A 20 -2.736 6.225 -7.367 1.00 55.30 N ATOM 257 CA ASP A 20 -1.895 5.562 -8.363 1.00 20.11 C ATOM 258 C ASP A 20 -1.189 4.361 -7.802 1.00 25.21 C ATOM 259 O ASP A 20 -0.641 4.408 -6.704 1.00 52.11 O ATOM 260 CB ASP A 20 -0.848 6.513 -8.959 1.00 60.44 C ATOM 261 CG ASP A 20 -1.410 7.587 -9.848 1.00 50.23 C ATOM 262 OD1 ASP A 20 -1.856 8.635 -9.331 1.00 3.53 O ATOM 263 OD2 ASP A 20 -1.392 7.425 -11.094 1.00 52.30 O ATOM 0 H ASP A 20 -2.221 6.710 -6.632 1.00 55.30 H new ATOM 0 HA ASP A 20 -2.577 5.239 -9.150 1.00 20.11 H new ATOM 0 HB2 ASP A 20 -0.300 6.985 -8.144 1.00 60.44 H new ATOM 0 HB3 ASP A 20 -0.128 5.927 -9.530 1.00 60.44 H new ATOM 268 N ASP A 21 -1.212 3.293 -8.568 1.00 62.44 N ATOM 269 CA ASP A 21 -0.506 2.055 -8.237 1.00 31.21 C ATOM 270 C ASP A 21 0.978 2.215 -8.549 1.00 35.13 C ATOM 271 O ASP A 21 1.351 2.912 -9.510 1.00 12.23 O ATOM 272 CB ASP A 21 -1.110 0.896 -9.029 1.00 1.40 C ATOM 273 CG ASP A 21 -0.403 -0.441 -8.855 1.00 23.51 C ATOM 274 OD1 ASP A 21 0.252 -0.667 -7.804 1.00 45.03 O ATOM 275 OD2 ASP A 21 -0.471 -1.260 -9.803 1.00 62.30 O ATOM 0 H ASP A 21 -1.724 3.250 -9.449 1.00 62.44 H new ATOM 0 HA ASP A 21 -0.613 1.839 -7.174 1.00 31.21 H new ATOM 0 HB2 ASP A 21 -2.153 0.779 -8.734 1.00 1.40 H new ATOM 0 HB3 ASP A 21 -1.105 1.157 -10.087 1.00 1.40 H new ATOM 280 N VAL A 22 1.810 1.576 -7.765 1.00 15.24 N ATOM 281 CA VAL A 22 3.244 1.725 -7.869 1.00 14.25 C ATOM 282 C VAL A 22 3.917 0.404 -8.319 1.00 25.43 C ATOM 283 O VAL A 22 5.078 0.401 -8.780 1.00 23.34 O ATOM 284 CB VAL A 22 3.843 2.231 -6.508 1.00 21.23 C ATOM 285 CG1 VAL A 22 5.346 2.454 -6.592 1.00 44.04 C ATOM 286 CG2 VAL A 22 3.153 3.518 -6.069 1.00 65.44 C ATOM 0 H VAL A 22 1.512 0.933 -7.031 1.00 15.24 H new ATOM 0 HA VAL A 22 3.452 2.473 -8.634 1.00 14.25 H new ATOM 0 HB VAL A 22 3.663 1.451 -5.768 1.00 21.23 H new ATOM 0 HG11 VAL A 22 5.716 2.803 -5.628 1.00 44.04 H new ATOM 0 HG12 VAL A 22 5.839 1.517 -6.852 1.00 44.04 H new ATOM 0 HG13 VAL A 22 5.561 3.201 -7.356 1.00 44.04 H new ATOM 0 HG21 VAL A 22 3.579 3.856 -5.124 1.00 65.44 H new ATOM 0 HG22 VAL A 22 3.299 4.286 -6.828 1.00 65.44 H new ATOM 0 HG23 VAL A 22 2.087 3.333 -5.940 1.00 65.44 H new ATOM 296 N LEU A 23 3.211 -0.708 -8.234 1.00 31.31 N ATOM 297 CA LEU A 23 3.813 -1.966 -8.642 1.00 5.33 C ATOM 298 C LEU A 23 3.557 -2.253 -10.108 1.00 51.25 C ATOM 299 O LEU A 23 2.992 -1.418 -10.821 1.00 34.34 O ATOM 300 CB LEU A 23 3.442 -3.162 -7.710 1.00 21.21 C ATOM 301 CG LEU A 23 1.957 -3.446 -7.375 1.00 71.54 C ATOM 302 CD1 LEU A 23 1.139 -3.834 -8.599 1.00 70.33 C ATOM 303 CD2 LEU A 23 1.873 -4.543 -6.339 1.00 12.54 C ATOM 0 H LEU A 23 2.250 -0.769 -7.897 1.00 31.31 H new ATOM 0 HA LEU A 23 4.890 -1.848 -8.525 1.00 5.33 H new ATOM 0 HB2 LEU A 23 3.852 -4.065 -8.162 1.00 21.21 H new ATOM 0 HB3 LEU A 23 3.965 -3.013 -6.766 1.00 21.21 H new ATOM 0 HG LEU A 23 1.532 -2.520 -6.986 1.00 71.54 H new ATOM 0 HD11 LEU A 23 0.107 -4.021 -8.303 1.00 70.33 H new ATOM 0 HD12 LEU A 23 1.166 -3.023 -9.327 1.00 70.33 H new ATOM 0 HD13 LEU A 23 1.557 -4.736 -9.045 1.00 70.33 H new ATOM 0 HD21 LEU A 23 0.827 -4.742 -6.104 1.00 12.54 H new ATOM 0 HD22 LEU A 23 2.336 -5.449 -6.730 1.00 12.54 H new ATOM 0 HD23 LEU A 23 2.395 -4.230 -5.435 1.00 12.54 H new ATOM 315 N ASP A 24 4.057 -3.341 -10.595 1.00 42.03 N ATOM 316 CA ASP A 24 3.739 -3.746 -11.947 1.00 35.15 C ATOM 317 C ASP A 24 2.769 -4.899 -11.844 1.00 14.33 C ATOM 318 O ASP A 24 2.954 -5.747 -10.989 1.00 72.44 O ATOM 319 CB ASP A 24 4.995 -4.160 -12.727 1.00 51.23 C ATOM 320 CG ASP A 24 4.716 -4.440 -14.191 1.00 71.13 C ATOM 321 OD1 ASP A 24 4.613 -3.460 -14.988 1.00 31.25 O ATOM 322 OD2 ASP A 24 4.621 -5.624 -14.578 1.00 73.41 O ATOM 0 H ASP A 24 4.683 -3.969 -10.091 1.00 42.03 H new ATOM 0 HA ASP A 24 3.301 -2.912 -12.495 1.00 35.15 H new ATOM 0 HB2 ASP A 24 5.741 -3.369 -12.650 1.00 51.23 H new ATOM 0 HB3 ASP A 24 5.425 -5.050 -12.268 1.00 51.23 H new ATOM 327 N PRO A 25 1.701 -4.944 -12.667 1.00 31.41 N ATOM 328 CA PRO A 25 0.697 -6.028 -12.618 1.00 44.45 C ATOM 329 C PRO A 25 1.291 -7.454 -12.718 1.00 74.10 C ATOM 330 O PRO A 25 0.637 -8.437 -12.337 1.00 54.33 O ATOM 331 CB PRO A 25 -0.229 -5.724 -13.795 1.00 72.15 C ATOM 332 CG PRO A 25 -0.091 -4.257 -13.999 1.00 60.43 C ATOM 333 CD PRO A 25 1.342 -3.931 -13.682 1.00 63.42 C ATOM 0 HA PRO A 25 0.189 -6.040 -11.654 1.00 44.45 H new ATOM 0 HB2 PRO A 25 0.064 -6.279 -14.686 1.00 72.15 H new ATOM 0 HB3 PRO A 25 -1.260 -6.000 -13.572 1.00 72.15 H new ATOM 0 HG2 PRO A 25 -0.337 -3.980 -15.024 1.00 60.43 H new ATOM 0 HG3 PRO A 25 -0.770 -3.706 -13.348 1.00 60.43 H new ATOM 0 HD2 PRO A 25 1.977 -4.003 -14.565 1.00 63.42 H new ATOM 0 HD3 PRO A 25 1.449 -2.918 -13.295 1.00 63.42 H new ATOM 341 N ASP A 26 2.508 -7.576 -13.252 1.00 25.13 N ATOM 342 CA ASP A 26 3.174 -8.878 -13.320 1.00 72.21 C ATOM 343 C ASP A 26 3.638 -9.317 -11.922 1.00 23.05 C ATOM 344 O ASP A 26 3.764 -10.519 -11.641 1.00 52.53 O ATOM 345 CB ASP A 26 4.350 -8.859 -14.298 1.00 63.13 C ATOM 346 CG ASP A 26 4.989 -10.224 -14.492 1.00 4.25 C ATOM 347 OD1 ASP A 26 4.499 -11.012 -15.356 1.00 42.41 O ATOM 348 OD2 ASP A 26 5.978 -10.539 -13.812 1.00 34.50 O ATOM 0 H ASP A 26 3.046 -6.801 -13.639 1.00 25.13 H new ATOM 0 HA ASP A 26 2.450 -9.603 -13.692 1.00 72.21 H new ATOM 0 HB2 ASP A 26 4.006 -8.486 -15.263 1.00 63.13 H new ATOM 0 HB3 ASP A 26 5.104 -8.160 -13.936 1.00 63.13 H new ATOM 353 N GLU A 27 3.849 -8.350 -11.039 1.00 74.34 N ATOM 354 CA GLU A 27 4.232 -8.632 -9.664 1.00 1.30 C ATOM 355 C GLU A 27 2.988 -9.116 -8.910 1.00 63.21 C ATOM 356 O GLU A 27 1.866 -8.766 -9.291 1.00 53.12 O ATOM 357 CB GLU A 27 4.820 -7.377 -8.975 1.00 73.21 C ATOM 358 CG GLU A 27 6.072 -6.824 -9.640 1.00 22.51 C ATOM 359 CD GLU A 27 6.691 -5.666 -8.873 1.00 63.23 C ATOM 360 OE1 GLU A 27 6.191 -4.523 -8.988 1.00 21.34 O ATOM 361 OE2 GLU A 27 7.724 -5.886 -8.160 1.00 34.03 O ATOM 0 H GLU A 27 3.760 -7.357 -11.254 1.00 74.34 H new ATOM 0 HA GLU A 27 5.006 -9.399 -9.655 1.00 1.30 H new ATOM 0 HB2 GLU A 27 4.059 -6.597 -8.956 1.00 73.21 H new ATOM 0 HB3 GLU A 27 5.052 -7.621 -7.938 1.00 73.21 H new ATOM 0 HG2 GLU A 27 6.808 -7.622 -9.737 1.00 22.51 H new ATOM 0 HG3 GLU A 27 5.825 -6.493 -10.649 1.00 22.51 H new ATOM 368 N PRO A 28 3.149 -9.944 -7.858 1.00 40.41 N ATOM 369 CA PRO A 28 2.018 -10.482 -7.093 1.00 72.50 C ATOM 370 C PRO A 28 1.092 -9.381 -6.524 1.00 74.34 C ATOM 371 O PRO A 28 1.478 -8.594 -5.633 1.00 42.04 O ATOM 372 CB PRO A 28 2.686 -11.282 -5.958 1.00 15.34 C ATOM 373 CG PRO A 28 4.096 -10.801 -5.922 1.00 13.41 C ATOM 374 CD PRO A 28 4.436 -10.437 -7.331 1.00 32.31 C ATOM 0 HA PRO A 28 1.364 -11.086 -7.723 1.00 72.50 H new ATOM 0 HB2 PRO A 28 2.186 -11.108 -5.005 1.00 15.34 H new ATOM 0 HB3 PRO A 28 2.640 -12.354 -6.151 1.00 15.34 H new ATOM 0 HG2 PRO A 28 4.199 -9.941 -5.260 1.00 13.41 H new ATOM 0 HG3 PRO A 28 4.764 -11.576 -5.546 1.00 13.41 H new ATOM 0 HD2 PRO A 28 5.212 -9.672 -7.376 1.00 32.31 H new ATOM 0 HD3 PRO A 28 4.802 -11.296 -7.894 1.00 32.31 H new ATOM 382 N THR A 29 -0.111 -9.316 -7.050 1.00 51.01 N ATOM 383 CA THR A 29 -1.088 -8.349 -6.624 1.00 34.31 C ATOM 384 C THR A 29 -2.379 -9.098 -6.195 1.00 13.10 C ATOM 385 O THR A 29 -2.485 -10.310 -6.384 1.00 0.23 O ATOM 386 CB THR A 29 -1.436 -7.391 -7.798 1.00 61.33 C ATOM 387 OG1 THR A 29 -0.271 -7.128 -8.592 1.00 20.52 O ATOM 388 CG2 THR A 29 -1.943 -6.058 -7.273 1.00 43.40 C ATOM 0 H THR A 29 -0.437 -9.938 -7.790 1.00 51.01 H new ATOM 0 HA THR A 29 -0.684 -7.772 -5.792 1.00 34.31 H new ATOM 0 HB THR A 29 -2.206 -7.878 -8.397 1.00 61.33 H new ATOM 0 HG1 THR A 29 -0.506 -6.525 -9.328 1.00 20.52 H new ATOM 0 HG21 THR A 29 -2.180 -5.403 -8.111 1.00 43.40 H new ATOM 0 HG22 THR A 29 -2.839 -6.220 -6.674 1.00 43.40 H new ATOM 0 HG23 THR A 29 -1.174 -5.593 -6.656 1.00 43.40 H new ATOM 396 N TYR A 30 -3.289 -8.393 -5.581 1.00 62.31 N ATOM 397 CA TYR A 30 -4.606 -8.860 -5.244 1.00 74.44 C ATOM 398 C TYR A 30 -5.569 -7.848 -5.750 1.00 23.22 C ATOM 399 O TYR A 30 -5.197 -6.714 -5.967 1.00 74.33 O ATOM 400 CB TYR A 30 -4.833 -9.113 -3.747 1.00 64.30 C ATOM 401 CG TYR A 30 -4.260 -10.411 -3.238 1.00 63.01 C ATOM 402 CD1 TYR A 30 -4.536 -11.610 -3.884 1.00 70.03 C ATOM 403 CD2 TYR A 30 -3.474 -10.447 -2.106 1.00 74.03 C ATOM 404 CE1 TYR A 30 -4.033 -12.801 -3.422 1.00 73.23 C ATOM 405 CE2 TYR A 30 -2.964 -11.637 -1.631 1.00 61.41 C ATOM 406 CZ TYR A 30 -3.248 -12.815 -2.297 1.00 73.22 C ATOM 407 OH TYR A 30 -2.727 -14.002 -1.844 1.00 52.10 O ATOM 0 H TYR A 30 -3.124 -7.430 -5.288 1.00 62.31 H new ATOM 0 HA TYR A 30 -4.746 -9.836 -5.708 1.00 74.44 H new ATOM 0 HB2 TYR A 30 -4.394 -8.291 -3.182 1.00 64.30 H new ATOM 0 HB3 TYR A 30 -5.905 -9.101 -3.548 1.00 64.30 H new ATOM 0 HD1 TYR A 30 -5.158 -11.605 -4.767 1.00 70.03 H new ATOM 0 HD2 TYR A 30 -3.254 -9.528 -1.583 1.00 74.03 H new ATOM 0 HE1 TYR A 30 -4.254 -13.722 -3.941 1.00 73.23 H new ATOM 0 HE2 TYR A 30 -2.347 -11.649 -0.745 1.00 61.41 H new ATOM 0 HH TYR A 30 -2.193 -13.839 -1.038 1.00 52.10 H new ATOM 417 N ASP A 31 -6.773 -8.228 -5.892 1.00 74.01 N ATOM 418 CA ASP A 31 -7.783 -7.405 -6.508 1.00 53.01 C ATOM 419 C ASP A 31 -8.976 -7.529 -5.596 1.00 3.34 C ATOM 420 O ASP A 31 -8.955 -8.403 -4.723 1.00 4.01 O ATOM 421 CB ASP A 31 -8.100 -7.989 -7.907 1.00 14.15 C ATOM 422 CG ASP A 31 -8.934 -7.086 -8.796 1.00 33.54 C ATOM 423 OD1 ASP A 31 -10.114 -6.886 -8.522 1.00 75.23 O ATOM 424 OD2 ASP A 31 -8.420 -6.599 -9.815 1.00 61.43 O ATOM 0 H ASP A 31 -7.114 -9.138 -5.583 1.00 74.01 H new ATOM 0 HA ASP A 31 -7.485 -6.365 -6.639 1.00 53.01 H new ATOM 0 HB2 ASP A 31 -7.161 -8.210 -8.415 1.00 14.15 H new ATOM 0 HB3 ASP A 31 -8.624 -8.936 -7.780 1.00 14.15 H new ATOM 429 N LEU A 32 -9.984 -6.709 -5.775 1.00 25.35 N ATOM 430 CA LEU A 32 -11.132 -6.646 -4.855 1.00 0.30 C ATOM 431 C LEU A 32 -11.772 -8.034 -4.589 1.00 14.13 C ATOM 432 O LEU A 32 -11.814 -8.472 -3.428 1.00 3.11 O ATOM 433 CB LEU A 32 -12.168 -5.596 -5.309 1.00 22.12 C ATOM 434 CG LEU A 32 -11.666 -4.147 -5.395 1.00 54.14 C ATOM 435 CD1 LEU A 32 -12.757 -3.240 -5.929 1.00 21.53 C ATOM 436 CD2 LEU A 32 -11.193 -3.653 -4.032 1.00 52.22 C ATOM 0 H LEU A 32 -10.047 -6.059 -6.559 1.00 25.35 H new ATOM 0 HA LEU A 32 -10.741 -6.315 -3.893 1.00 0.30 H new ATOM 0 HB2 LEU A 32 -12.545 -5.887 -6.289 1.00 22.12 H new ATOM 0 HB3 LEU A 32 -13.012 -5.627 -4.620 1.00 22.12 H new ATOM 0 HG LEU A 32 -10.820 -4.123 -6.082 1.00 54.14 H new ATOM 0 HD11 LEU A 32 -12.385 -2.217 -5.984 1.00 21.53 H new ATOM 0 HD12 LEU A 32 -13.052 -3.573 -6.924 1.00 21.53 H new ATOM 0 HD13 LEU A 32 -13.619 -3.277 -5.263 1.00 21.53 H new ATOM 0 HD21 LEU A 32 -10.842 -2.625 -4.119 1.00 52.22 H new ATOM 0 HD22 LEU A 32 -12.020 -3.696 -3.323 1.00 52.22 H new ATOM 0 HD23 LEU A 32 -10.379 -4.285 -3.678 1.00 52.22 H new ATOM 448 N PRO A 33 -12.235 -8.783 -5.640 1.00 64.15 N ATOM 449 CA PRO A 33 -12.777 -10.124 -5.448 1.00 42.43 C ATOM 450 C PRO A 33 -11.726 -11.086 -4.890 1.00 73.44 C ATOM 451 O PRO A 33 -12.045 -11.961 -4.129 1.00 33.32 O ATOM 452 CB PRO A 33 -13.208 -10.563 -6.858 1.00 75.44 C ATOM 453 CG PRO A 33 -12.457 -9.676 -7.780 1.00 3.30 C ATOM 454 CD PRO A 33 -12.321 -8.376 -7.064 1.00 51.43 C ATOM 0 HA PRO A 33 -13.596 -10.129 -4.729 1.00 42.43 H new ATOM 0 HB2 PRO A 33 -12.969 -11.611 -7.036 1.00 75.44 H new ATOM 0 HB3 PRO A 33 -14.284 -10.454 -6.994 1.00 75.44 H new ATOM 0 HG2 PRO A 33 -11.480 -10.096 -8.019 1.00 3.30 H new ATOM 0 HG3 PRO A 33 -12.989 -9.550 -8.723 1.00 3.30 H new ATOM 0 HD2 PRO A 33 -11.432 -7.832 -7.382 1.00 51.43 H new ATOM 0 HD3 PRO A 33 -13.176 -7.724 -7.246 1.00 51.43 H new ATOM 462 N ARG A 34 -10.463 -10.867 -5.247 1.00 72.54 N ATOM 463 CA ARG A 34 -9.360 -11.735 -4.811 1.00 71.12 C ATOM 464 C ARG A 34 -9.055 -11.585 -3.331 1.00 72.22 C ATOM 465 O ARG A 34 -8.716 -12.550 -2.677 1.00 52.22 O ATOM 466 CB ARG A 34 -8.093 -11.518 -5.647 1.00 53.10 C ATOM 467 CG ARG A 34 -7.984 -12.356 -6.920 1.00 31.54 C ATOM 468 CD ARG A 34 -9.231 -12.268 -7.776 1.00 23.11 C ATOM 469 NE ARG A 34 -9.056 -12.909 -9.068 1.00 11.55 N ATOM 470 CZ ARG A 34 -9.605 -14.067 -9.450 1.00 31.01 C ATOM 471 NH1 ARG A 34 -10.171 -14.886 -8.563 1.00 2.12 N ATOM 472 NH2 ARG A 34 -9.506 -14.435 -10.711 1.00 52.22 N ATOM 0 H ARG A 34 -10.171 -10.091 -5.841 1.00 72.54 H new ATOM 0 HA ARG A 34 -9.700 -12.757 -4.974 1.00 71.12 H new ATOM 0 HB2 ARG A 34 -8.038 -10.465 -5.922 1.00 53.10 H new ATOM 0 HB3 ARG A 34 -7.227 -11.729 -5.020 1.00 53.10 H new ATOM 0 HG2 ARG A 34 -7.124 -12.021 -7.500 1.00 31.54 H new ATOM 0 HG3 ARG A 34 -7.803 -13.397 -6.652 1.00 31.54 H new ATOM 0 HD2 ARG A 34 -10.064 -12.735 -7.251 1.00 23.11 H new ATOM 0 HD3 ARG A 34 -9.495 -11.221 -7.925 1.00 23.11 H new ATOM 0 HE ARG A 34 -8.460 -12.433 -9.745 1.00 11.55 H new ATOM 0 HH11 ARG A 34 -10.190 -14.633 -7.575 1.00 2.12 H new ATOM 0 HH12 ARG A 34 -10.585 -15.765 -8.872 1.00 2.12 H new ATOM 0 HH21 ARG A 34 -9.016 -13.840 -11.379 1.00 52.22 H new ATOM 0 HH22 ARG A 34 -9.919 -15.315 -11.019 1.00 52.22 H new ATOM 486 N VAL A 35 -9.156 -10.378 -2.805 1.00 75.25 N ATOM 487 CA VAL A 35 -8.923 -10.176 -1.375 1.00 34.14 C ATOM 488 C VAL A 35 -10.054 -10.809 -0.592 1.00 33.33 C ATOM 489 O VAL A 35 -9.832 -11.499 0.415 1.00 44.12 O ATOM 490 CB VAL A 35 -8.750 -8.680 -0.976 1.00 70.35 C ATOM 491 CG1 VAL A 35 -8.505 -8.533 0.522 1.00 52.22 C ATOM 492 CG2 VAL A 35 -7.615 -8.043 -1.748 1.00 11.02 C ATOM 0 H VAL A 35 -9.392 -9.535 -3.328 1.00 75.25 H new ATOM 0 HA VAL A 35 -7.976 -10.657 -1.132 1.00 34.14 H new ATOM 0 HB VAL A 35 -9.678 -8.166 -1.227 1.00 70.35 H new ATOM 0 HG11 VAL A 35 -8.388 -7.478 0.770 1.00 52.22 H new ATOM 0 HG12 VAL A 35 -9.352 -8.943 1.071 1.00 52.22 H new ATOM 0 HG13 VAL A 35 -7.599 -9.073 0.797 1.00 52.22 H new ATOM 0 HG21 VAL A 35 -7.514 -6.999 -1.452 1.00 11.02 H new ATOM 0 HG22 VAL A 35 -6.687 -8.572 -1.533 1.00 11.02 H new ATOM 0 HG23 VAL A 35 -7.825 -8.098 -2.816 1.00 11.02 H new ATOM 502 N ALA A 36 -11.252 -10.612 -1.097 1.00 73.15 N ATOM 503 CA ALA A 36 -12.437 -11.195 -0.523 1.00 3.31 C ATOM 504 C ALA A 36 -12.325 -12.722 -0.565 1.00 44.03 C ATOM 505 O ALA A 36 -12.671 -13.418 0.389 1.00 1.41 O ATOM 506 CB ALA A 36 -13.656 -10.719 -1.297 1.00 21.02 C ATOM 0 H ALA A 36 -11.429 -10.039 -1.922 1.00 73.15 H new ATOM 0 HA ALA A 36 -12.542 -10.885 0.517 1.00 3.31 H new ATOM 0 HB1 ALA A 36 -14.555 -11.158 -0.865 1.00 21.02 H new ATOM 0 HB2 ALA A 36 -13.721 -9.632 -1.242 1.00 21.02 H new ATOM 0 HB3 ALA A 36 -13.567 -11.025 -2.339 1.00 21.02 H new ATOM 512 N GLU A 37 -11.793 -13.204 -1.664 1.00 73.40 N ATOM 513 CA GLU A 37 -11.571 -14.608 -1.927 1.00 25.04 C ATOM 514 C GLU A 37 -10.541 -15.176 -0.955 1.00 53.41 C ATOM 515 O GLU A 37 -10.765 -16.218 -0.342 1.00 14.14 O ATOM 516 CB GLU A 37 -11.045 -14.713 -3.350 1.00 24.15 C ATOM 517 CG GLU A 37 -10.972 -16.104 -3.934 1.00 41.14 C ATOM 518 CD GLU A 37 -10.683 -16.083 -5.420 1.00 13.42 C ATOM 519 OE1 GLU A 37 -9.880 -15.250 -5.890 1.00 23.13 O ATOM 520 OE2 GLU A 37 -11.296 -16.889 -6.159 1.00 61.22 O ATOM 0 H GLU A 37 -11.490 -12.604 -2.431 1.00 73.40 H new ATOM 0 HA GLU A 37 -12.495 -15.173 -1.803 1.00 25.04 H new ATOM 0 HB2 GLU A 37 -11.678 -14.104 -3.995 1.00 24.15 H new ATOM 0 HB3 GLU A 37 -10.047 -14.277 -3.379 1.00 24.15 H new ATOM 0 HG2 GLU A 37 -10.195 -16.671 -3.422 1.00 41.14 H new ATOM 0 HG3 GLU A 37 -11.915 -16.622 -3.756 1.00 41.14 H new ATOM 527 N LEU A 38 -9.457 -14.439 -0.780 1.00 31.52 N ATOM 528 CA LEU A 38 -8.340 -14.839 0.058 1.00 44.55 C ATOM 529 C LEU A 38 -8.738 -14.916 1.520 1.00 45.33 C ATOM 530 O LEU A 38 -8.501 -15.915 2.181 1.00 21.23 O ATOM 531 CB LEU A 38 -7.190 -13.830 -0.089 1.00 52.41 C ATOM 532 CG LEU A 38 -5.931 -14.108 0.737 1.00 14.34 C ATOM 533 CD1 LEU A 38 -5.173 -15.317 0.210 1.00 73.10 C ATOM 534 CD2 LEU A 38 -5.043 -12.883 0.790 1.00 41.22 C ATOM 0 H LEU A 38 -9.327 -13.530 -1.224 1.00 31.52 H new ATOM 0 HA LEU A 38 -8.022 -15.829 -0.269 1.00 44.55 H new ATOM 0 HB2 LEU A 38 -6.906 -13.786 -1.140 1.00 52.41 H new ATOM 0 HB3 LEU A 38 -7.565 -12.843 0.181 1.00 52.41 H new ATOM 0 HG LEU A 38 -6.245 -14.342 1.754 1.00 14.34 H new ATOM 0 HD11 LEU A 38 -4.286 -15.484 0.820 1.00 73.10 H new ATOM 0 HD12 LEU A 38 -5.815 -16.197 0.254 1.00 73.10 H new ATOM 0 HD13 LEU A 38 -4.874 -15.137 -0.823 1.00 73.10 H new ATOM 0 HD21 LEU A 38 -4.155 -13.103 1.382 1.00 41.22 H new ATOM 0 HD22 LEU A 38 -4.746 -12.605 -0.221 1.00 41.22 H new ATOM 0 HD23 LEU A 38 -5.589 -12.058 1.248 1.00 41.22 H new ATOM 546 N LEU A 39 -9.362 -13.867 2.010 1.00 0.22 N ATOM 547 CA LEU A 39 -9.696 -13.778 3.422 1.00 11.14 C ATOM 548 C LEU A 39 -11.005 -14.475 3.756 1.00 53.21 C ATOM 549 O LEU A 39 -11.346 -14.643 4.936 1.00 12.42 O ATOM 550 CB LEU A 39 -9.722 -12.318 3.880 1.00 71.53 C ATOM 551 CG LEU A 39 -8.408 -11.536 3.733 1.00 62.11 C ATOM 552 CD1 LEU A 39 -8.586 -10.107 4.204 1.00 54.12 C ATOM 553 CD2 LEU A 39 -7.278 -12.209 4.502 1.00 23.22 C ATOM 0 H LEU A 39 -9.650 -13.062 1.454 1.00 0.22 H new ATOM 0 HA LEU A 39 -8.913 -14.303 3.969 1.00 11.14 H new ATOM 0 HB2 LEU A 39 -10.496 -11.796 3.317 1.00 71.53 H new ATOM 0 HB3 LEU A 39 -10.020 -12.293 4.928 1.00 71.53 H new ATOM 0 HG LEU A 39 -8.140 -11.527 2.677 1.00 62.11 H new ATOM 0 HD11 LEU A 39 -7.645 -9.567 4.093 1.00 54.12 H new ATOM 0 HD12 LEU A 39 -9.356 -9.620 3.606 1.00 54.12 H new ATOM 0 HD13 LEU A 39 -8.884 -10.104 5.252 1.00 54.12 H new ATOM 0 HD21 LEU A 39 -6.361 -11.633 4.379 1.00 23.22 H new ATOM 0 HD22 LEU A 39 -7.537 -12.258 5.560 1.00 23.22 H new ATOM 0 HD23 LEU A 39 -7.127 -13.218 4.118 1.00 23.22 H new ATOM 565 N GLY A 40 -11.733 -14.876 2.723 1.00 54.12 N ATOM 566 CA GLY A 40 -13.003 -15.558 2.905 1.00 55.33 C ATOM 567 C GLY A 40 -14.062 -14.629 3.455 1.00 63.22 C ATOM 568 O GLY A 40 -14.976 -15.055 4.178 1.00 23.23 O ATOM 0 H GLY A 40 -11.463 -14.740 1.749 1.00 54.12 H new ATOM 0 HA2 GLY A 40 -13.337 -15.967 1.951 1.00 55.33 H new ATOM 0 HA3 GLY A 40 -12.870 -16.401 3.584 1.00 55.33 H new ATOM 572 N VAL A 41 -13.929 -13.368 3.133 1.00 64.15 N ATOM 573 CA VAL A 41 -14.838 -12.340 3.604 1.00 74.22 C ATOM 574 C VAL A 41 -15.445 -11.642 2.398 1.00 13.33 C ATOM 575 O VAL A 41 -14.916 -11.765 1.309 1.00 45.31 O ATOM 576 CB VAL A 41 -14.107 -11.290 4.521 1.00 42.53 C ATOM 577 CG1 VAL A 41 -13.437 -11.962 5.706 1.00 55.53 C ATOM 578 CG2 VAL A 41 -13.099 -10.451 3.735 1.00 22.12 C ATOM 0 H VAL A 41 -13.183 -13.017 2.532 1.00 64.15 H new ATOM 0 HA VAL A 41 -15.616 -12.810 4.206 1.00 74.22 H new ATOM 0 HB VAL A 41 -14.873 -10.614 4.902 1.00 42.53 H new ATOM 0 HG11 VAL A 41 -12.941 -11.209 6.319 1.00 55.53 H new ATOM 0 HG12 VAL A 41 -14.188 -12.479 6.303 1.00 55.53 H new ATOM 0 HG13 VAL A 41 -12.700 -12.681 5.348 1.00 55.53 H new ATOM 0 HG21 VAL A 41 -12.617 -9.739 4.405 1.00 22.12 H new ATOM 0 HG22 VAL A 41 -12.345 -11.105 3.297 1.00 22.12 H new ATOM 0 HG23 VAL A 41 -13.616 -9.910 2.942 1.00 22.12 H new ATOM 588 N PRO A 42 -16.576 -10.952 2.542 1.00 30.43 N ATOM 589 CA PRO A 42 -17.156 -10.200 1.438 1.00 45.31 C ATOM 590 C PRO A 42 -16.383 -8.901 1.185 1.00 43.42 C ATOM 591 O PRO A 42 -15.674 -8.398 2.079 1.00 2.42 O ATOM 592 CB PRO A 42 -18.574 -9.884 1.927 1.00 24.34 C ATOM 593 CG PRO A 42 -18.470 -9.879 3.409 1.00 12.31 C ATOM 594 CD PRO A 42 -17.407 -10.885 3.758 1.00 75.21 C ATOM 0 HA PRO A 42 -17.133 -10.753 0.499 1.00 45.31 H new ATOM 0 HB2 PRO A 42 -18.917 -8.920 1.551 1.00 24.34 H new ATOM 0 HB3 PRO A 42 -19.288 -10.633 1.583 1.00 24.34 H new ATOM 0 HG2 PRO A 42 -18.204 -8.888 3.777 1.00 12.31 H new ATOM 0 HG3 PRO A 42 -19.423 -10.144 3.867 1.00 12.31 H new ATOM 0 HD2 PRO A 42 -16.825 -10.569 4.624 1.00 75.21 H new ATOM 0 HD3 PRO A 42 -17.839 -11.856 4.002 1.00 75.21 H new ATOM 602 N VAL A 43 -16.544 -8.351 -0.009 1.00 4.05 N ATOM 603 CA VAL A 43 -15.896 -7.100 -0.414 1.00 72.44 C ATOM 604 C VAL A 43 -16.276 -5.961 0.551 1.00 51.24 C ATOM 605 O VAL A 43 -15.473 -5.077 0.829 1.00 11.12 O ATOM 606 CB VAL A 43 -16.248 -6.709 -1.882 1.00 50.21 C ATOM 607 CG1 VAL A 43 -15.527 -5.431 -2.308 1.00 11.30 C ATOM 608 CG2 VAL A 43 -15.909 -7.846 -2.838 1.00 33.03 C ATOM 0 H VAL A 43 -17.132 -8.760 -0.735 1.00 4.05 H new ATOM 0 HA VAL A 43 -14.819 -7.261 -0.368 1.00 72.44 H new ATOM 0 HB VAL A 43 -17.321 -6.522 -1.923 1.00 50.21 H new ATOM 0 HG11 VAL A 43 -15.795 -5.188 -3.336 1.00 11.30 H new ATOM 0 HG12 VAL A 43 -15.821 -4.611 -1.652 1.00 11.30 H new ATOM 0 HG13 VAL A 43 -14.450 -5.581 -2.240 1.00 11.30 H new ATOM 0 HG21 VAL A 43 -16.162 -7.553 -3.857 1.00 33.03 H new ATOM 0 HG22 VAL A 43 -14.843 -8.066 -2.778 1.00 33.03 H new ATOM 0 HG23 VAL A 43 -16.479 -8.734 -2.564 1.00 33.03 H new ATOM 618 N SER A 44 -17.496 -6.020 1.077 1.00 45.25 N ATOM 619 CA SER A 44 -17.967 -5.045 2.050 1.00 13.34 C ATOM 620 C SER A 44 -17.027 -5.013 3.287 1.00 32.42 C ATOM 621 O SER A 44 -16.664 -3.941 3.768 1.00 2.24 O ATOM 622 CB SER A 44 -19.422 -5.371 2.463 1.00 64.45 C ATOM 623 OG SER A 44 -19.971 -4.389 3.349 1.00 10.33 O ATOM 0 H SER A 44 -18.180 -6.740 0.842 1.00 45.25 H new ATOM 0 HA SER A 44 -17.953 -4.054 1.595 1.00 13.34 H new ATOM 0 HB2 SER A 44 -20.044 -5.439 1.570 1.00 64.45 H new ATOM 0 HB3 SER A 44 -19.450 -6.348 2.946 1.00 64.45 H new ATOM 0 HG SER A 44 -20.891 -4.636 3.581 1.00 10.33 H new ATOM 629 N LYS A 45 -16.606 -6.188 3.768 1.00 44.04 N ATOM 630 CA LYS A 45 -15.696 -6.248 4.901 1.00 53.35 C ATOM 631 C LYS A 45 -14.305 -5.753 4.501 1.00 44.02 C ATOM 632 O LYS A 45 -13.587 -5.153 5.309 1.00 32.25 O ATOM 633 CB LYS A 45 -15.658 -7.640 5.538 1.00 33.14 C ATOM 634 CG LYS A 45 -14.818 -7.706 6.807 1.00 70.34 C ATOM 635 CD LYS A 45 -15.084 -8.961 7.641 1.00 10.02 C ATOM 636 CE LYS A 45 -16.375 -8.867 8.496 1.00 12.12 C ATOM 637 NZ LYS A 45 -17.637 -8.794 7.707 1.00 73.42 N ATOM 0 H LYS A 45 -16.880 -7.095 3.392 1.00 44.04 H new ATOM 0 HA LYS A 45 -16.076 -5.577 5.671 1.00 53.35 H new ATOM 0 HB2 LYS A 45 -16.676 -7.953 5.769 1.00 33.14 H new ATOM 0 HB3 LYS A 45 -15.263 -8.352 4.813 1.00 33.14 H new ATOM 0 HG2 LYS A 45 -13.762 -7.673 6.538 1.00 70.34 H new ATOM 0 HG3 LYS A 45 -15.020 -6.824 7.415 1.00 70.34 H new ATOM 0 HD2 LYS A 45 -15.159 -9.822 6.976 1.00 10.02 H new ATOM 0 HD3 LYS A 45 -14.233 -9.139 8.299 1.00 10.02 H new ATOM 0 HE2 LYS A 45 -16.423 -9.734 9.154 1.00 12.12 H new ATOM 0 HE3 LYS A 45 -16.309 -7.986 9.134 1.00 12.12 H new ATOM 0 HZ1 LYS A 45 -18.430 -9.135 8.287 1.00 73.42 H new ATOM 0 HZ2 LYS A 45 -17.814 -7.809 7.425 1.00 73.42 H new ATOM 0 HZ3 LYS A 45 -17.550 -9.387 6.857 1.00 73.42 H new ATOM 651 N VAL A 46 -13.941 -5.995 3.246 1.00 30.52 N ATOM 652 CA VAL A 46 -12.680 -5.496 2.694 1.00 71.22 C ATOM 653 C VAL A 46 -12.693 -3.970 2.718 1.00 72.14 C ATOM 654 O VAL A 46 -11.734 -3.344 3.143 1.00 14.31 O ATOM 655 CB VAL A 46 -12.426 -6.010 1.243 1.00 72.22 C ATOM 656 CG1 VAL A 46 -11.116 -5.461 0.682 1.00 31.23 C ATOM 657 CG2 VAL A 46 -12.416 -7.532 1.207 1.00 50.02 C ATOM 0 H VAL A 46 -14.502 -6.535 2.587 1.00 30.52 H new ATOM 0 HA VAL A 46 -11.866 -5.875 3.312 1.00 71.22 H new ATOM 0 HB VAL A 46 -13.241 -5.649 0.616 1.00 72.22 H new ATOM 0 HG11 VAL A 46 -10.968 -5.837 -0.330 1.00 31.23 H new ATOM 0 HG12 VAL A 46 -11.157 -4.372 0.662 1.00 31.23 H new ATOM 0 HG13 VAL A 46 -10.287 -5.781 1.313 1.00 31.23 H new ATOM 0 HG21 VAL A 46 -12.237 -7.871 0.186 1.00 50.02 H new ATOM 0 HG22 VAL A 46 -11.625 -7.906 1.857 1.00 50.02 H new ATOM 0 HG23 VAL A 46 -13.378 -7.910 1.552 1.00 50.02 H new ATOM 667 N ALA A 47 -13.811 -3.388 2.319 1.00 21.51 N ATOM 668 CA ALA A 47 -13.984 -1.945 2.349 1.00 34.21 C ATOM 669 C ALA A 47 -13.822 -1.422 3.773 1.00 20.51 C ATOM 670 O ALA A 47 -13.245 -0.371 3.992 1.00 24.12 O ATOM 671 CB ALA A 47 -15.344 -1.554 1.787 1.00 52.21 C ATOM 0 H ALA A 47 -14.621 -3.899 1.967 1.00 21.51 H new ATOM 0 HA ALA A 47 -13.215 -1.492 1.723 1.00 34.21 H new ATOM 0 HB1 ALA A 47 -15.453 -0.470 1.819 1.00 52.21 H new ATOM 0 HB2 ALA A 47 -15.424 -1.897 0.755 1.00 52.21 H new ATOM 0 HB3 ALA A 47 -16.131 -2.015 2.384 1.00 52.21 H new ATOM 677 N GLN A 48 -14.299 -2.187 4.735 1.00 65.20 N ATOM 678 CA GLN A 48 -14.192 -1.809 6.129 1.00 35.35 C ATOM 679 C GLN A 48 -12.767 -1.866 6.641 1.00 4.20 C ATOM 680 O GLN A 48 -12.344 -0.975 7.359 1.00 4.13 O ATOM 681 CB GLN A 48 -15.139 -2.608 7.016 1.00 73.35 C ATOM 682 CG GLN A 48 -16.589 -2.316 6.712 1.00 64.43 C ATOM 683 CD GLN A 48 -16.919 -0.837 6.847 1.00 41.50 C ATOM 684 OE1 GLN A 48 -16.341 -0.113 7.661 1.00 33.24 O ATOM 685 NE2 GLN A 48 -17.813 -0.374 6.044 1.00 55.43 N ATOM 0 H GLN A 48 -14.767 -3.079 4.575 1.00 65.20 H new ATOM 0 HA GLN A 48 -14.503 -0.766 6.183 1.00 35.35 H new ATOM 0 HB2 GLN A 48 -14.949 -3.673 6.881 1.00 73.35 H new ATOM 0 HB3 GLN A 48 -14.935 -2.378 8.062 1.00 73.35 H new ATOM 0 HG2 GLN A 48 -16.820 -2.647 5.699 1.00 64.43 H new ATOM 0 HG3 GLN A 48 -17.223 -2.891 7.387 1.00 64.43 H new ATOM 0 HE21 GLN A 48 -18.275 -0.997 5.381 1.00 55.43 H new ATOM 0 HE22 GLN A 48 -18.059 0.615 6.071 1.00 55.43 H new ATOM 694 N GLN A 49 -12.009 -2.884 6.247 1.00 73.24 N ATOM 695 CA GLN A 49 -10.613 -2.965 6.679 1.00 4.32 C ATOM 696 C GLN A 49 -9.802 -1.854 6.021 1.00 20.02 C ATOM 697 O GLN A 49 -8.897 -1.276 6.631 1.00 1.33 O ATOM 698 CB GLN A 49 -10.001 -4.363 6.461 1.00 61.31 C ATOM 699 CG GLN A 49 -9.895 -4.812 5.023 1.00 71.21 C ATOM 700 CD GLN A 49 -9.512 -6.271 4.878 1.00 12.11 C ATOM 701 OE1 GLN A 49 -8.869 -6.654 3.926 1.00 24.43 O ATOM 702 NE2 GLN A 49 -9.939 -7.102 5.802 1.00 32.11 N ATOM 0 H GLN A 49 -12.323 -3.646 5.646 1.00 73.24 H new ATOM 0 HA GLN A 49 -10.582 -2.812 7.758 1.00 4.32 H new ATOM 0 HB2 GLN A 49 -9.004 -4.376 6.901 1.00 61.31 H new ATOM 0 HB3 GLN A 49 -10.600 -5.091 7.007 1.00 61.31 H new ATOM 0 HG2 GLN A 49 -10.850 -4.643 4.525 1.00 71.21 H new ATOM 0 HG3 GLN A 49 -9.155 -4.197 4.511 1.00 71.21 H new ATOM 0 HE21 GLN A 49 -10.479 -6.751 6.593 1.00 32.11 H new ATOM 0 HE22 GLN A 49 -9.731 -8.098 5.728 1.00 32.11 H new ATOM 711 N LEU A 50 -10.176 -1.514 4.796 1.00 41.22 N ATOM 712 CA LEU A 50 -9.575 -0.398 4.098 1.00 51.34 C ATOM 713 C LEU A 50 -9.865 0.895 4.879 1.00 51.41 C ATOM 714 O LEU A 50 -9.005 1.747 5.025 1.00 60.31 O ATOM 715 CB LEU A 50 -10.130 -0.287 2.660 1.00 25.14 C ATOM 716 CG LEU A 50 -9.845 -1.447 1.690 1.00 55.22 C ATOM 717 CD1 LEU A 50 -10.508 -1.188 0.346 1.00 65.13 C ATOM 718 CD2 LEU A 50 -8.355 -1.658 1.499 1.00 33.45 C ATOM 0 H LEU A 50 -10.898 -2.002 4.266 1.00 41.22 H new ATOM 0 HA LEU A 50 -8.499 -0.556 4.031 1.00 51.34 H new ATOM 0 HB2 LEU A 50 -11.211 -0.164 2.727 1.00 25.14 H new ATOM 0 HB3 LEU A 50 -9.732 0.626 2.217 1.00 25.14 H new ATOM 0 HG LEU A 50 -10.262 -2.354 2.128 1.00 55.22 H new ATOM 0 HD11 LEU A 50 -10.297 -2.017 -0.329 1.00 65.13 H new ATOM 0 HD12 LEU A 50 -11.585 -1.097 0.483 1.00 65.13 H new ATOM 0 HD13 LEU A 50 -10.117 -0.264 -0.081 1.00 65.13 H new ATOM 0 HD21 LEU A 50 -8.190 -2.485 0.808 1.00 33.45 H new ATOM 0 HD22 LEU A 50 -7.908 -0.751 1.092 1.00 33.45 H new ATOM 0 HD23 LEU A 50 -7.894 -1.890 2.459 1.00 33.45 H new ATOM 730 N ARG A 51 -11.079 1.000 5.405 1.00 12.11 N ATOM 731 CA ARG A 51 -11.519 2.156 6.200 1.00 61.14 C ATOM 732 C ARG A 51 -10.853 2.223 7.576 1.00 41.32 C ATOM 733 O ARG A 51 -10.831 3.284 8.197 1.00 72.12 O ATOM 734 CB ARG A 51 -13.040 2.193 6.370 1.00 55.03 C ATOM 735 CG ARG A 51 -13.822 2.401 5.091 1.00 4.42 C ATOM 736 CD ARG A 51 -15.307 2.469 5.383 1.00 11.34 C ATOM 737 NE ARG A 51 -16.116 2.608 4.170 1.00 1.24 N ATOM 738 CZ ARG A 51 -16.832 3.694 3.841 1.00 1.01 C ATOM 739 NH1 ARG A 51 -16.751 4.811 4.573 1.00 25.34 N ATOM 740 NH2 ARG A 51 -17.615 3.667 2.772 1.00 63.32 N ATOM 0 H ARG A 51 -11.797 0.284 5.295 1.00 12.11 H new ATOM 0 HA ARG A 51 -11.204 3.029 5.629 1.00 61.14 H new ATOM 0 HB2 ARG A 51 -13.362 1.257 6.827 1.00 55.03 H new ATOM 0 HB3 ARG A 51 -13.293 2.992 7.067 1.00 55.03 H new ATOM 0 HG2 ARG A 51 -13.498 3.322 4.605 1.00 4.42 H new ATOM 0 HG3 ARG A 51 -13.619 1.586 4.397 1.00 4.42 H new ATOM 0 HD2 ARG A 51 -15.610 1.567 5.915 1.00 11.34 H new ATOM 0 HD3 ARG A 51 -15.505 3.312 6.045 1.00 11.34 H new ATOM 0 HE ARG A 51 -16.137 1.818 3.525 1.00 1.24 H new ATOM 0 HH11 ARG A 51 -16.141 4.842 5.390 1.00 25.34 H new ATOM 0 HH12 ARG A 51 -17.299 5.631 4.314 1.00 25.34 H new ATOM 0 HH21 ARG A 51 -17.672 2.823 2.203 1.00 63.32 H new ATOM 0 HH22 ARG A 51 -18.161 4.491 2.519 1.00 63.32 H new ATOM 754 N GLU A 52 -10.346 1.095 8.068 1.00 3.52 N ATOM 755 CA GLU A 52 -9.704 1.063 9.387 1.00 62.33 C ATOM 756 C GLU A 52 -8.306 1.663 9.318 1.00 71.31 C ATOM 757 O GLU A 52 -7.689 1.947 10.359 1.00 35.21 O ATOM 758 CB GLU A 52 -9.517 -0.380 9.886 1.00 4.10 C ATOM 759 CG GLU A 52 -10.756 -1.213 10.132 1.00 24.33 C ATOM 760 CD GLU A 52 -10.381 -2.611 10.610 1.00 45.14 C ATOM 761 OE1 GLU A 52 -10.156 -2.800 11.826 1.00 15.43 O ATOM 762 OE2 GLU A 52 -10.263 -3.545 9.782 1.00 34.51 O ATOM 0 H GLU A 52 -10.365 0.198 7.582 1.00 3.52 H new ATOM 0 HA GLU A 52 -10.354 1.627 10.056 1.00 62.33 H new ATOM 0 HB2 GLU A 52 -8.899 -0.907 9.159 1.00 4.10 H new ATOM 0 HB3 GLU A 52 -8.951 -0.341 10.817 1.00 4.10 H new ATOM 0 HG2 GLU A 52 -11.386 -0.726 10.876 1.00 24.33 H new ATOM 0 HG3 GLU A 52 -11.342 -1.282 9.215 1.00 24.33 H new ATOM 769 N GLY A 53 -7.809 1.871 8.103 1.00 60.01 N ATOM 770 CA GLY A 53 -6.416 2.224 7.935 1.00 3.12 C ATOM 771 C GLY A 53 -5.583 0.995 8.232 1.00 54.23 C ATOM 772 O GLY A 53 -4.471 1.067 8.764 1.00 64.53 O ATOM 0 H GLY A 53 -8.344 1.801 7.238 1.00 60.01 H new ATOM 0 HA2 GLY A 53 -6.231 2.573 6.919 1.00 3.12 H new ATOM 0 HA3 GLY A 53 -6.146 3.039 8.606 1.00 3.12 H new ATOM 776 N HIS A 54 -6.187 -0.131 7.939 1.00 42.15 N ATOM 777 CA HIS A 54 -5.650 -1.450 8.181 1.00 11.35 C ATOM 778 C HIS A 54 -5.011 -1.957 6.898 1.00 34.11 C ATOM 779 O HIS A 54 -4.005 -2.659 6.921 1.00 2.14 O ATOM 780 CB HIS A 54 -6.850 -2.324 8.633 1.00 71.10 C ATOM 781 CG HIS A 54 -6.658 -3.791 8.904 1.00 2.44 C ATOM 782 ND1 HIS A 54 -7.701 -4.602 9.307 1.00 22.34 N ATOM 783 CD2 HIS A 54 -5.575 -4.600 8.808 1.00 71.14 C ATOM 784 CE1 HIS A 54 -7.243 -5.834 9.438 1.00 15.31 C ATOM 785 NE2 HIS A 54 -5.950 -5.901 9.147 1.00 21.33 N ATOM 0 H HIS A 54 -7.110 -0.155 7.505 1.00 42.15 H new ATOM 0 HA HIS A 54 -4.877 -1.468 8.949 1.00 11.35 H new ATOM 0 HB2 HIS A 54 -7.251 -1.877 9.543 1.00 71.10 H new ATOM 0 HB3 HIS A 54 -7.621 -2.235 7.868 1.00 71.10 H new ATOM 0 HD1 HIS A 54 -8.661 -4.301 9.475 1.00 22.34 H new ATOM 0 HD2 HIS A 54 -4.583 -4.289 8.516 1.00 71.14 H new ATOM 0 HE1 HIS A 54 -7.844 -6.678 9.743 1.00 15.31 H new ATOM 793 N LEU A 55 -5.577 -1.547 5.785 1.00 73.21 N ATOM 794 CA LEU A 55 -5.111 -1.947 4.490 1.00 25.23 C ATOM 795 C LEU A 55 -5.482 -0.836 3.518 1.00 4.21 C ATOM 796 O LEU A 55 -6.422 -0.090 3.788 1.00 64.25 O ATOM 797 CB LEU A 55 -5.807 -3.263 4.102 1.00 32.41 C ATOM 798 CG LEU A 55 -5.345 -3.948 2.815 1.00 42.54 C ATOM 799 CD1 LEU A 55 -3.887 -4.377 2.930 1.00 13.23 C ATOM 800 CD2 LEU A 55 -6.236 -5.141 2.521 1.00 45.13 C ATOM 0 H LEU A 55 -6.381 -0.920 5.761 1.00 73.21 H new ATOM 0 HA LEU A 55 -4.033 -2.109 4.477 1.00 25.23 H new ATOM 0 HB2 LEU A 55 -5.679 -3.967 4.924 1.00 32.41 H new ATOM 0 HB3 LEU A 55 -6.876 -3.066 4.015 1.00 32.41 H new ATOM 0 HG LEU A 55 -5.422 -3.241 1.989 1.00 42.54 H new ATOM 0 HD11 LEU A 55 -3.576 -4.862 2.005 1.00 13.23 H new ATOM 0 HD12 LEU A 55 -3.263 -3.501 3.107 1.00 13.23 H new ATOM 0 HD13 LEU A 55 -3.777 -5.075 3.760 1.00 13.23 H new ATOM 0 HD21 LEU A 55 -5.903 -5.626 1.603 1.00 45.13 H new ATOM 0 HD22 LEU A 55 -6.179 -5.850 3.347 1.00 45.13 H new ATOM 0 HD23 LEU A 55 -7.266 -4.805 2.401 1.00 45.13 H new ATOM 812 N VAL A 56 -4.737 -0.687 2.434 1.00 1.25 N ATOM 813 CA VAL A 56 -5.047 0.322 1.424 1.00 13.45 C ATOM 814 C VAL A 56 -5.066 -0.299 0.044 1.00 13.41 C ATOM 815 O VAL A 56 -4.510 -1.383 -0.161 1.00 4.15 O ATOM 816 CB VAL A 56 -4.074 1.537 1.433 1.00 1.40 C ATOM 817 CG1 VAL A 56 -4.282 2.394 2.667 1.00 5.53 C ATOM 818 CG2 VAL A 56 -2.626 1.076 1.350 1.00 13.04 C ATOM 0 H VAL A 56 -3.912 -1.251 2.228 1.00 1.25 H new ATOM 0 HA VAL A 56 -6.034 0.706 1.681 1.00 13.45 H new ATOM 0 HB VAL A 56 -4.295 2.142 0.554 1.00 1.40 H new ATOM 0 HG11 VAL A 56 -3.589 3.235 2.647 1.00 5.53 H new ATOM 0 HG12 VAL A 56 -5.306 2.768 2.682 1.00 5.53 H new ATOM 0 HG13 VAL A 56 -4.101 1.796 3.560 1.00 5.53 H new ATOM 0 HG21 VAL A 56 -1.967 1.944 1.358 1.00 13.04 H new ATOM 0 HG22 VAL A 56 -2.397 0.439 2.204 1.00 13.04 H new ATOM 0 HG23 VAL A 56 -2.475 0.514 0.428 1.00 13.04 H new ATOM 828 N ALA A 57 -5.684 0.384 -0.883 1.00 15.22 N ATOM 829 CA ALA A 57 -5.810 -0.086 -2.235 1.00 41.42 C ATOM 830 C ALA A 57 -5.385 1.014 -3.185 1.00 11.41 C ATOM 831 O ALA A 57 -5.459 2.188 -2.841 1.00 75.22 O ATOM 832 CB ALA A 57 -7.250 -0.492 -2.508 1.00 50.01 C ATOM 0 H ALA A 57 -6.118 1.292 -0.718 1.00 15.22 H new ATOM 0 HA ALA A 57 -5.170 -0.956 -2.383 1.00 41.42 H new ATOM 0 HB1 ALA A 57 -7.339 -0.847 -3.535 1.00 50.01 H new ATOM 0 HB2 ALA A 57 -7.540 -1.288 -1.822 1.00 50.01 H new ATOM 0 HB3 ALA A 57 -7.904 0.368 -2.364 1.00 50.01 H new ATOM 838 N VAL A 58 -4.941 0.630 -4.352 1.00 1.23 N ATOM 839 CA VAL A 58 -4.493 1.555 -5.385 1.00 4.45 C ATOM 840 C VAL A 58 -5.163 1.242 -6.705 1.00 34.13 C ATOM 841 O VAL A 58 -5.780 0.185 -6.858 1.00 53.52 O ATOM 842 CB VAL A 58 -2.955 1.563 -5.561 1.00 24.22 C ATOM 843 CG1 VAL A 58 -2.291 2.300 -4.416 1.00 61.33 C ATOM 844 CG2 VAL A 58 -2.415 0.136 -5.651 1.00 2.24 C ATOM 0 H VAL A 58 -4.875 -0.350 -4.626 1.00 1.23 H new ATOM 0 HA VAL A 58 -4.783 2.552 -5.054 1.00 4.45 H new ATOM 0 HB VAL A 58 -2.723 2.082 -6.491 1.00 24.22 H new ATOM 0 HG11 VAL A 58 -1.210 2.295 -4.558 1.00 61.33 H new ATOM 0 HG12 VAL A 58 -2.648 3.329 -4.390 1.00 61.33 H new ATOM 0 HG13 VAL A 58 -2.536 1.807 -3.475 1.00 61.33 H new ATOM 0 HG21 VAL A 58 -1.332 0.164 -5.774 1.00 2.24 H new ATOM 0 HG22 VAL A 58 -2.662 -0.405 -4.738 1.00 2.24 H new ATOM 0 HG23 VAL A 58 -2.865 -0.370 -6.505 1.00 2.24 H new ATOM 854 N ARG A 59 -5.069 2.152 -7.646 1.00 63.44 N ATOM 855 CA ARG A 59 -5.714 1.982 -8.930 1.00 52.35 C ATOM 856 C ARG A 59 -4.679 1.927 -10.047 1.00 53.44 C ATOM 857 O ARG A 59 -3.748 2.737 -10.074 1.00 3.10 O ATOM 858 CB ARG A 59 -6.643 3.160 -9.232 1.00 51.23 C ATOM 859 CG ARG A 59 -7.734 3.444 -8.223 1.00 55.13 C ATOM 860 CD ARG A 59 -8.495 4.691 -8.642 1.00 21.01 C ATOM 861 NE ARG A 59 -9.570 5.058 -7.719 1.00 64.32 N ATOM 862 CZ ARG A 59 -10.387 6.110 -7.885 1.00 60.34 C ATOM 863 NH1 ARG A 59 -10.247 6.914 -8.957 1.00 42.42 N ATOM 864 NH2 ARG A 59 -11.336 6.364 -6.980 1.00 42.54 N ATOM 0 H ARG A 59 -4.549 3.024 -7.547 1.00 63.44 H new ATOM 0 HA ARG A 59 -6.280 1.052 -8.883 1.00 52.35 H new ATOM 0 HB2 ARG A 59 -6.032 4.057 -9.334 1.00 51.23 H new ATOM 0 HB3 ARG A 59 -7.113 2.983 -10.200 1.00 51.23 H new ATOM 0 HG2 ARG A 59 -8.414 2.595 -8.157 1.00 55.13 H new ATOM 0 HG3 ARG A 59 -7.301 3.584 -7.232 1.00 55.13 H new ATOM 0 HD2 ARG A 59 -7.796 5.524 -8.722 1.00 21.01 H new ATOM 0 HD3 ARG A 59 -8.917 4.533 -9.634 1.00 21.01 H new ATOM 0 HE ARG A 59 -9.708 4.475 -6.894 1.00 64.32 H new ATOM 0 HH11 ARG A 59 -9.519 6.724 -9.645 1.00 42.42 H new ATOM 0 HH12 ARG A 59 -10.869 7.713 -9.080 1.00 42.42 H new ATOM 0 HH21 ARG A 59 -11.439 5.759 -6.165 1.00 42.54 H new ATOM 0 HH22 ARG A 59 -11.958 7.163 -7.104 1.00 42.54 H new ATOM 878 N ARG A 60 -4.838 0.980 -10.953 1.00 64.43 N ATOM 879 CA ARG A 60 -4.039 0.940 -12.171 1.00 2.33 C ATOM 880 C ARG A 60 -4.953 0.533 -13.315 1.00 54.44 C ATOM 881 O ARG A 60 -5.721 -0.441 -13.183 1.00 64.44 O ATOM 882 CB ARG A 60 -2.775 0.023 -12.084 1.00 63.52 C ATOM 883 CG ARG A 60 -2.966 -1.478 -12.316 1.00 3.44 C ATOM 884 CD ARG A 60 -3.804 -2.141 -11.264 1.00 64.52 C ATOM 885 NE ARG A 60 -3.896 -3.589 -11.486 1.00 65.53 N ATOM 886 CZ ARG A 60 -5.007 -4.253 -11.839 1.00 52.23 C ATOM 887 NH1 ARG A 60 -6.106 -3.597 -12.211 1.00 75.10 N ATOM 888 NH2 ARG A 60 -4.995 -5.573 -11.861 1.00 4.14 N ATOM 0 H ARG A 60 -5.516 0.223 -10.870 1.00 64.43 H new ATOM 0 HA ARG A 60 -3.628 1.936 -12.338 1.00 2.33 H new ATOM 0 HB2 ARG A 60 -2.048 0.385 -12.811 1.00 63.52 H new ATOM 0 HB3 ARG A 60 -2.332 0.156 -11.097 1.00 63.52 H new ATOM 0 HG2 ARG A 60 -3.430 -1.631 -13.290 1.00 3.44 H new ATOM 0 HG3 ARG A 60 -1.989 -1.960 -12.349 1.00 3.44 H new ATOM 0 HD2 ARG A 60 -3.375 -1.949 -10.281 1.00 64.52 H new ATOM 0 HD3 ARG A 60 -4.804 -1.707 -11.266 1.00 64.52 H new ATOM 0 HE ARG A 60 -3.044 -4.136 -11.361 1.00 65.53 H new ATOM 0 HH11 ARG A 60 -6.109 -2.577 -12.230 1.00 75.10 H new ATOM 0 HH12 ARG A 60 -6.944 -4.115 -12.477 1.00 75.10 H new ATOM 0 HH21 ARG A 60 -4.146 -6.080 -11.611 1.00 4.14 H new ATOM 0 HH22 ARG A 60 -5.835 -6.086 -12.128 1.00 4.14 H new ATOM 902 N ALA A 61 -4.948 1.331 -14.376 1.00 62.20 N ATOM 903 CA ALA A 61 -5.792 1.152 -15.568 1.00 30.44 C ATOM 904 C ALA A 61 -7.287 1.144 -15.215 1.00 14.31 C ATOM 905 O ALA A 61 -8.116 0.663 -15.986 1.00 63.02 O ATOM 906 CB ALA A 61 -5.404 -0.105 -16.333 1.00 63.11 C ATOM 0 H ALA A 61 -4.340 2.148 -14.440 1.00 62.20 H new ATOM 0 HA ALA A 61 -5.617 2.010 -16.217 1.00 30.44 H new ATOM 0 HB1 ALA A 61 -6.045 -0.211 -17.208 1.00 63.11 H new ATOM 0 HB2 ALA A 61 -4.364 -0.031 -16.651 1.00 63.11 H new ATOM 0 HB3 ALA A 61 -5.525 -0.975 -15.688 1.00 63.11 H new ATOM 912 N GLY A 62 -7.625 1.714 -14.070 1.00 61.44 N ATOM 913 CA GLY A 62 -9.002 1.753 -13.625 1.00 2.50 C ATOM 914 C GLY A 62 -9.352 0.600 -12.706 1.00 61.34 C ATOM 915 O GLY A 62 -10.488 0.492 -12.230 1.00 71.20 O ATOM 0 H GLY A 62 -6.961 2.156 -13.434 1.00 61.44 H new ATOM 0 HA2 GLY A 62 -9.186 2.694 -13.107 1.00 2.50 H new ATOM 0 HA3 GLY A 62 -9.661 1.733 -14.493 1.00 2.50 H new ATOM 919 N GLY A 63 -8.398 -0.261 -12.459 1.00 63.31 N ATOM 920 CA GLY A 63 -8.624 -1.373 -11.582 1.00 23.23 C ATOM 921 C GLY A 63 -8.104 -1.089 -10.209 1.00 61.15 C ATOM 922 O GLY A 63 -6.996 -0.566 -10.066 1.00 4.33 O ATOM 0 H GLY A 63 -7.459 -0.211 -12.854 1.00 63.31 H new ATOM 0 HA2 GLY A 63 -9.691 -1.590 -11.533 1.00 23.23 H new ATOM 0 HA3 GLY A 63 -8.136 -2.261 -11.983 1.00 23.23 H new ATOM 926 N VAL A 64 -8.882 -1.425 -9.214 1.00 12.42 N ATOM 927 CA VAL A 64 -8.516 -1.204 -7.833 1.00 60.04 C ATOM 928 C VAL A 64 -7.942 -2.491 -7.290 1.00 61.32 C ATOM 929 O VAL A 64 -8.609 -3.534 -7.299 1.00 64.50 O ATOM 930 CB VAL A 64 -9.746 -0.803 -6.982 1.00 45.50 C ATOM 931 CG1 VAL A 64 -9.343 -0.460 -5.552 1.00 65.15 C ATOM 932 CG2 VAL A 64 -10.481 0.352 -7.616 1.00 55.40 C ATOM 0 H VAL A 64 -9.795 -1.863 -9.336 1.00 12.42 H new ATOM 0 HA VAL A 64 -7.790 -0.392 -7.783 1.00 60.04 H new ATOM 0 HB VAL A 64 -10.417 -1.661 -6.945 1.00 45.50 H new ATOM 0 HG11 VAL A 64 -10.229 -0.183 -4.981 1.00 65.15 H new ATOM 0 HG12 VAL A 64 -8.870 -1.326 -5.090 1.00 65.15 H new ATOM 0 HG13 VAL A 64 -8.642 0.375 -5.562 1.00 65.15 H new ATOM 0 HG21 VAL A 64 -11.341 0.617 -7.002 1.00 55.40 H new ATOM 0 HG22 VAL A 64 -9.813 1.210 -7.694 1.00 55.40 H new ATOM 0 HG23 VAL A 64 -10.821 0.065 -8.611 1.00 55.40 H new ATOM 942 N VAL A 65 -6.724 -2.423 -6.845 1.00 60.03 N ATOM 943 CA VAL A 65 -5.997 -3.575 -6.381 1.00 53.53 C ATOM 944 C VAL A 65 -5.281 -3.302 -5.091 1.00 3.14 C ATOM 945 O VAL A 65 -5.070 -2.149 -4.702 1.00 1.24 O ATOM 946 CB VAL A 65 -4.973 -4.064 -7.425 1.00 51.10 C ATOM 947 CG1 VAL A 65 -5.678 -4.683 -8.611 1.00 3.34 C ATOM 948 CG2 VAL A 65 -4.071 -2.924 -7.875 1.00 64.51 C ATOM 0 H VAL A 65 -6.195 -1.553 -6.792 1.00 60.03 H new ATOM 0 HA VAL A 65 -6.742 -4.354 -6.217 1.00 53.53 H new ATOM 0 HB VAL A 65 -4.349 -4.826 -6.958 1.00 51.10 H new ATOM 0 HG11 VAL A 65 -4.939 -5.022 -9.337 1.00 3.34 H new ATOM 0 HG12 VAL A 65 -6.275 -5.532 -8.277 1.00 3.34 H new ATOM 0 HG13 VAL A 65 -6.329 -3.942 -9.075 1.00 3.34 H new ATOM 0 HG21 VAL A 65 -3.357 -3.294 -8.611 1.00 64.51 H new ATOM 0 HG22 VAL A 65 -4.677 -2.135 -8.321 1.00 64.51 H new ATOM 0 HG23 VAL A 65 -3.532 -2.525 -7.015 1.00 64.51 H new ATOM 958 N ILE A 66 -4.930 -4.364 -4.438 1.00 43.24 N ATOM 959 CA ILE A 66 -4.205 -4.336 -3.207 1.00 21.20 C ATOM 960 C ILE A 66 -2.965 -5.195 -3.419 1.00 3.03 C ATOM 961 O ILE A 66 -3.090 -6.352 -3.800 1.00 12.30 O ATOM 962 CB ILE A 66 -5.021 -4.931 -1.991 1.00 42.40 C ATOM 963 CG1 ILE A 66 -6.315 -4.132 -1.658 1.00 33.15 C ATOM 964 CG2 ILE A 66 -4.141 -5.021 -0.753 1.00 73.14 C ATOM 965 CD1 ILE A 66 -7.469 -4.300 -2.637 1.00 41.23 C ATOM 0 H ILE A 66 -5.148 -5.308 -4.758 1.00 43.24 H new ATOM 0 HA ILE A 66 -3.979 -3.299 -2.957 1.00 21.20 H new ATOM 0 HB ILE A 66 -5.337 -5.927 -2.301 1.00 42.40 H new ATOM 0 HG12 ILE A 66 -6.658 -4.430 -0.667 1.00 33.15 H new ATOM 0 HG13 ILE A 66 -6.061 -3.073 -1.603 1.00 33.15 H new ATOM 0 HG21 ILE A 66 -4.718 -5.433 0.075 1.00 73.14 H new ATOM 0 HG22 ILE A 66 -3.289 -5.669 -0.959 1.00 73.14 H new ATOM 0 HG23 ILE A 66 -3.784 -4.026 -0.487 1.00 73.14 H new ATOM 0 HD11 ILE A 66 -8.317 -3.699 -2.307 1.00 41.23 H new ATOM 0 HD12 ILE A 66 -7.156 -3.972 -3.628 1.00 41.23 H new ATOM 0 HD13 ILE A 66 -7.762 -5.349 -2.678 1.00 41.23 H new ATOM 977 N PRO A 67 -1.767 -4.639 -3.264 1.00 30.31 N ATOM 978 CA PRO A 67 -0.523 -5.400 -3.410 1.00 15.34 C ATOM 979 C PRO A 67 -0.485 -6.657 -2.515 1.00 1.03 C ATOM 980 O PRO A 67 -0.629 -6.570 -1.302 1.00 3.15 O ATOM 981 CB PRO A 67 0.544 -4.402 -2.968 1.00 20.23 C ATOM 982 CG PRO A 67 -0.050 -3.074 -3.265 1.00 4.25 C ATOM 983 CD PRO A 67 -1.510 -3.216 -2.972 1.00 65.02 C ATOM 0 HA PRO A 67 -0.392 -5.776 -4.425 1.00 15.34 H new ATOM 0 HB2 PRO A 67 0.772 -4.507 -1.907 1.00 20.23 H new ATOM 0 HB3 PRO A 67 1.477 -4.551 -3.511 1.00 20.23 H new ATOM 0 HG2 PRO A 67 0.400 -2.296 -2.649 1.00 4.25 H new ATOM 0 HG3 PRO A 67 0.116 -2.793 -4.305 1.00 4.25 H new ATOM 0 HD2 PRO A 67 -1.740 -2.968 -1.936 1.00 65.02 H new ATOM 0 HD3 PRO A 67 -2.114 -2.559 -3.599 1.00 65.02 H new ATOM 991 N GLN A 68 -0.260 -7.820 -3.133 1.00 64.55 N ATOM 992 CA GLN A 68 -0.211 -9.112 -2.437 1.00 44.32 C ATOM 993 C GLN A 68 0.961 -9.166 -1.469 1.00 75.54 C ATOM 994 O GLN A 68 0.950 -9.890 -0.476 1.00 31.14 O ATOM 995 CB GLN A 68 -0.134 -10.212 -3.475 1.00 4.43 C ATOM 996 CG GLN A 68 0.091 -11.612 -2.959 1.00 30.45 C ATOM 997 CD GLN A 68 -0.032 -12.639 -4.056 1.00 62.12 C ATOM 998 OE1 GLN A 68 -0.887 -12.381 -5.027 1.00 33.24 O flip ATOM 999 NE2 GLN A 68 0.626 -13.667 -4.027 1.00 44.03 N flip ATOM 0 H GLN A 68 -0.105 -7.893 -4.139 1.00 64.55 H new ATOM 0 HA GLN A 68 -1.112 -9.247 -1.839 1.00 44.32 H new ATOM 0 HB2 GLN A 68 -1.061 -10.205 -4.049 1.00 4.43 H new ATOM 0 HB3 GLN A 68 0.672 -9.971 -4.168 1.00 4.43 H new ATOM 0 HG2 GLN A 68 1.081 -11.679 -2.508 1.00 30.45 H new ATOM 0 HG3 GLN A 68 -0.632 -11.831 -2.173 1.00 30.45 H new ATOM 0 HE21 GLN A 68 1.278 -13.834 -3.261 1.00 44.03 H new ATOM 0 HE22 GLN A 68 0.524 -14.359 -4.769 1.00 44.03 H new ATOM 1008 N VAL A 69 1.950 -8.378 -1.773 1.00 64.11 N ATOM 1009 CA VAL A 69 3.139 -8.236 -0.959 1.00 23.31 C ATOM 1010 C VAL A 69 2.834 -7.575 0.419 1.00 43.40 C ATOM 1011 O VAL A 69 3.669 -7.605 1.319 1.00 2.22 O ATOM 1012 CB VAL A 69 4.230 -7.451 -1.728 1.00 14.34 C ATOM 1013 CG1 VAL A 69 4.742 -8.280 -2.896 1.00 74.33 C ATOM 1014 CG2 VAL A 69 3.669 -6.133 -2.251 1.00 10.14 C ATOM 0 H VAL A 69 1.960 -7.799 -2.613 1.00 64.11 H new ATOM 0 HA VAL A 69 3.515 -9.238 -0.749 1.00 23.31 H new ATOM 0 HB VAL A 69 5.051 -7.242 -1.043 1.00 14.34 H new ATOM 0 HG11 VAL A 69 5.509 -7.720 -3.431 1.00 74.33 H new ATOM 0 HG12 VAL A 69 5.167 -9.212 -2.522 1.00 74.33 H new ATOM 0 HG13 VAL A 69 3.917 -8.503 -3.573 1.00 74.33 H new ATOM 0 HG21 VAL A 69 4.449 -5.594 -2.789 1.00 10.14 H new ATOM 0 HG22 VAL A 69 2.836 -6.334 -2.925 1.00 10.14 H new ATOM 0 HG23 VAL A 69 3.321 -5.528 -1.414 1.00 10.14 H new ATOM 1024 N PHE A 70 1.618 -7.008 0.563 1.00 44.22 N ATOM 1025 CA PHE A 70 1.145 -6.431 1.839 1.00 64.21 C ATOM 1026 C PHE A 70 0.685 -7.538 2.782 1.00 43.34 C ATOM 1027 O PHE A 70 0.425 -7.317 3.974 1.00 60.35 O ATOM 1028 CB PHE A 70 -0.017 -5.455 1.596 1.00 44.33 C ATOM 1029 CG PHE A 70 0.373 -4.031 1.287 1.00 42.05 C ATOM 1030 CD1 PHE A 70 1.451 -3.722 0.473 1.00 33.24 C ATOM 1031 CD2 PHE A 70 -0.360 -2.998 1.832 1.00 32.40 C ATOM 1032 CE1 PHE A 70 1.780 -2.400 0.219 1.00 61.30 C ATOM 1033 CE2 PHE A 70 -0.040 -1.684 1.586 1.00 55.10 C ATOM 1034 CZ PHE A 70 1.027 -1.382 0.784 1.00 11.24 C ATOM 0 H PHE A 70 0.940 -6.937 -0.196 1.00 44.22 H new ATOM 0 HA PHE A 70 1.975 -5.890 2.293 1.00 64.21 H new ATOM 0 HB2 PHE A 70 -0.618 -5.834 0.769 1.00 44.33 H new ATOM 0 HB3 PHE A 70 -0.655 -5.453 2.480 1.00 44.33 H new ATOM 0 HD1 PHE A 70 2.038 -4.515 0.034 1.00 33.24 H new ATOM 0 HD2 PHE A 70 -1.204 -3.226 2.466 1.00 32.40 H new ATOM 0 HE1 PHE A 70 2.620 -2.163 -0.417 1.00 61.30 H new ATOM 0 HE2 PHE A 70 -0.629 -0.892 2.024 1.00 55.10 H new ATOM 0 HZ PHE A 70 1.283 -0.351 0.591 1.00 11.24 H new ATOM 1044 N PHE A 71 0.570 -8.715 2.234 1.00 60.04 N ATOM 1045 CA PHE A 71 0.189 -9.874 2.969 1.00 3.35 C ATOM 1046 C PHE A 71 1.412 -10.729 3.135 1.00 40.12 C ATOM 1047 O PHE A 71 2.297 -10.714 2.277 1.00 24.24 O ATOM 1048 CB PHE A 71 -0.891 -10.673 2.220 1.00 74.31 C ATOM 1049 CG PHE A 71 -2.205 -9.956 2.054 1.00 13.35 C ATOM 1050 CD1 PHE A 71 -2.399 -9.055 1.018 1.00 52.30 C ATOM 1051 CD2 PHE A 71 -3.251 -10.198 2.928 1.00 24.43 C ATOM 1052 CE1 PHE A 71 -3.606 -8.405 0.865 1.00 55.14 C ATOM 1053 CE2 PHE A 71 -4.462 -9.552 2.776 1.00 75.23 C ATOM 1054 CZ PHE A 71 -4.641 -8.657 1.743 1.00 60.20 C ATOM 0 H PHE A 71 0.743 -8.892 1.245 1.00 60.04 H new ATOM 0 HA PHE A 71 -0.222 -9.576 3.934 1.00 3.35 H new ATOM 0 HB2 PHE A 71 -0.510 -10.936 1.233 1.00 74.31 H new ATOM 0 HB3 PHE A 71 -1.068 -11.607 2.753 1.00 74.31 H new ATOM 0 HD1 PHE A 71 -1.596 -8.860 0.323 1.00 52.30 H new ATOM 0 HD2 PHE A 71 -3.118 -10.900 3.738 1.00 24.43 H new ATOM 0 HE1 PHE A 71 -3.741 -7.699 0.059 1.00 55.14 H new ATOM 0 HE2 PHE A 71 -5.269 -9.748 3.467 1.00 75.23 H new ATOM 0 HZ PHE A 71 -5.589 -8.154 1.621 1.00 60.20 H new ATOM 1064 N THR A 72 1.473 -11.456 4.209 1.00 41.22 N ATOM 1065 CA THR A 72 2.569 -12.343 4.473 1.00 31.33 C ATOM 1066 C THR A 72 2.432 -13.593 3.609 1.00 53.01 C ATOM 1067 O THR A 72 1.429 -13.759 2.886 1.00 43.11 O ATOM 1068 CB THR A 72 2.589 -12.752 5.963 1.00 75.24 C ATOM 1069 OG1 THR A 72 1.308 -13.307 6.334 1.00 74.13 O ATOM 1070 CG2 THR A 72 2.905 -11.556 6.854 1.00 32.54 C ATOM 0 H THR A 72 0.757 -11.451 4.935 1.00 41.22 H new ATOM 0 HA THR A 72 3.500 -11.828 4.236 1.00 31.33 H new ATOM 0 HB THR A 72 3.369 -13.501 6.101 1.00 75.24 H new ATOM 0 HG1 THR A 72 1.325 -13.566 7.279 1.00 74.13 H new ATOM 0 HG21 THR A 72 2.913 -11.872 7.897 1.00 32.54 H new ATOM 0 HG22 THR A 72 3.883 -11.153 6.589 1.00 32.54 H new ATOM 0 HG23 THR A 72 2.146 -10.787 6.713 1.00 32.54 H new ATOM 1078 N ASN A 73 3.418 -14.470 3.674 1.00 52.12 N ATOM 1079 CA ASN A 73 3.375 -15.745 2.948 1.00 44.42 C ATOM 1080 C ASN A 73 2.191 -16.607 3.456 1.00 35.54 C ATOM 1081 O ASN A 73 1.662 -17.448 2.736 1.00 12.21 O ATOM 1082 CB ASN A 73 4.720 -16.486 3.116 1.00 54.15 C ATOM 1083 CG ASN A 73 4.831 -17.778 2.310 1.00 34.32 C ATOM 1084 OD1 ASN A 73 4.225 -17.934 1.255 1.00 23.23 O ATOM 1085 ND2 ASN A 73 5.612 -18.710 2.794 1.00 12.13 N ATOM 0 H ASN A 73 4.266 -14.329 4.223 1.00 52.12 H new ATOM 0 HA ASN A 73 3.220 -15.554 1.886 1.00 44.42 H new ATOM 0 HB2 ASN A 73 5.529 -15.817 2.822 1.00 54.15 H new ATOM 0 HB3 ASN A 73 4.865 -16.716 4.171 1.00 54.15 H new ATOM 0 HD21 ASN A 73 5.727 -19.590 2.292 1.00 12.13 H new ATOM 0 HD22 ASN A 73 6.105 -18.556 3.673 1.00 12.13 H new ATOM 1092 N SER A 74 1.752 -16.323 4.682 1.00 51.31 N ATOM 1093 CA SER A 74 0.644 -17.028 5.313 1.00 11.22 C ATOM 1094 C SER A 74 -0.734 -16.449 4.899 1.00 34.15 C ATOM 1095 O SER A 74 -1.783 -16.917 5.375 1.00 65.33 O ATOM 1096 CB SER A 74 0.813 -16.945 6.829 1.00 1.43 C ATOM 1097 OG SER A 74 2.102 -17.410 7.209 1.00 54.53 O ATOM 0 H SER A 74 2.159 -15.593 5.266 1.00 51.31 H new ATOM 0 HA SER A 74 0.664 -18.066 4.980 1.00 11.22 H new ATOM 0 HB2 SER A 74 0.678 -15.916 7.161 1.00 1.43 H new ATOM 0 HB3 SER A 74 0.044 -17.542 7.320 1.00 1.43 H new ATOM 0 HG SER A 74 2.198 -17.350 8.182 1.00 54.53 H new ATOM 1103 N GLY A 75 -0.731 -15.434 4.036 1.00 75.50 N ATOM 1104 CA GLY A 75 -1.974 -14.829 3.572 1.00 61.51 C ATOM 1105 C GLY A 75 -2.637 -13.969 4.630 1.00 51.44 C ATOM 1106 O GLY A 75 -3.862 -13.825 4.657 1.00 22.34 O ATOM 0 H GLY A 75 0.115 -15.017 3.647 1.00 75.50 H new ATOM 0 HA2 GLY A 75 -1.770 -14.221 2.691 1.00 61.51 H new ATOM 0 HA3 GLY A 75 -2.663 -15.615 3.264 1.00 61.51 H new ATOM 1110 N GLN A 76 -1.841 -13.429 5.516 1.00 61.21 N ATOM 1111 CA GLN A 76 -2.343 -12.552 6.553 1.00 62.12 C ATOM 1112 C GLN A 76 -1.799 -11.175 6.321 1.00 50.21 C ATOM 1113 O GLN A 76 -0.735 -11.033 5.725 1.00 4.22 O ATOM 1114 CB GLN A 76 -1.892 -13.027 7.929 1.00 41.41 C ATOM 1115 CG GLN A 76 -2.406 -14.390 8.336 1.00 41.30 C ATOM 1116 CD GLN A 76 -1.848 -14.819 9.671 1.00 53.10 C ATOM 1117 OE1 GLN A 76 -0.797 -15.457 9.738 1.00 42.41 O ATOM 1118 NE2 GLN A 76 -2.512 -14.466 10.737 1.00 71.51 N ATOM 0 H GLN A 76 -0.833 -13.580 5.543 1.00 61.21 H new ATOM 0 HA GLN A 76 -3.432 -12.554 6.518 1.00 62.12 H new ATOM 0 HB2 GLN A 76 -0.802 -13.045 7.951 1.00 41.41 H new ATOM 0 HB3 GLN A 76 -2.214 -12.297 8.672 1.00 41.41 H new ATOM 0 HG2 GLN A 76 -3.495 -14.369 8.386 1.00 41.30 H new ATOM 0 HG3 GLN A 76 -2.136 -15.123 7.576 1.00 41.30 H new ATOM 0 HE21 GLN A 76 -3.380 -13.938 10.646 1.00 71.51 H new ATOM 0 HE22 GLN A 76 -2.163 -14.718 11.662 1.00 71.51 H new ATOM 1127 N VAL A 77 -2.510 -10.174 6.762 1.00 61.13 N ATOM 1128 CA VAL A 77 -2.027 -8.815 6.668 1.00 2.30 C ATOM 1129 C VAL A 77 -0.882 -8.657 7.661 1.00 3.33 C ATOM 1130 O VAL A 77 -0.961 -9.178 8.789 1.00 64.20 O ATOM 1131 CB VAL A 77 -3.158 -7.780 6.977 1.00 65.30 C ATOM 1132 CG1 VAL A 77 -2.634 -6.355 6.936 1.00 1.51 C ATOM 1133 CG2 VAL A 77 -4.292 -7.927 5.984 1.00 15.41 C ATOM 0 H VAL A 77 -3.430 -10.270 7.192 1.00 61.13 H new ATOM 0 HA VAL A 77 -1.687 -8.621 5.651 1.00 2.30 H new ATOM 0 HB VAL A 77 -3.523 -7.985 7.983 1.00 65.30 H new ATOM 0 HG11 VAL A 77 -3.446 -5.662 7.155 1.00 1.51 H new ATOM 0 HG12 VAL A 77 -1.845 -6.236 7.679 1.00 1.51 H new ATOM 0 HG13 VAL A 77 -2.234 -6.143 5.945 1.00 1.51 H new ATOM 0 HG21 VAL A 77 -5.072 -7.200 6.212 1.00 15.41 H new ATOM 0 HG22 VAL A 77 -3.917 -7.753 4.975 1.00 15.41 H new ATOM 0 HG23 VAL A 77 -4.704 -8.934 6.049 1.00 15.41 H new ATOM 1143 N VAL A 78 0.191 -8.022 7.230 1.00 34.35 N ATOM 1144 CA VAL A 78 1.338 -7.780 8.090 1.00 14.34 C ATOM 1145 C VAL A 78 0.897 -6.948 9.304 1.00 65.23 C ATOM 1146 O VAL A 78 0.157 -5.987 9.157 1.00 32.41 O ATOM 1147 CB VAL A 78 2.478 -7.049 7.314 1.00 64.54 C ATOM 1148 CG1 VAL A 78 3.698 -6.800 8.196 1.00 62.44 C ATOM 1149 CG2 VAL A 78 2.877 -7.851 6.087 1.00 74.24 C ATOM 0 H VAL A 78 0.294 -7.661 6.282 1.00 34.35 H new ATOM 0 HA VAL A 78 1.731 -8.739 8.429 1.00 14.34 H new ATOM 0 HB VAL A 78 2.092 -6.079 7.002 1.00 64.54 H new ATOM 0 HG11 VAL A 78 4.467 -6.289 7.617 1.00 62.44 H new ATOM 0 HG12 VAL A 78 3.412 -6.180 9.046 1.00 62.44 H new ATOM 0 HG13 VAL A 78 4.087 -7.752 8.556 1.00 62.44 H new ATOM 0 HG21 VAL A 78 3.673 -7.330 5.555 1.00 74.24 H new ATOM 0 HG22 VAL A 78 3.230 -8.835 6.395 1.00 74.24 H new ATOM 0 HG23 VAL A 78 2.015 -7.964 5.430 1.00 74.24 H new ATOM 1159 N LYS A 79 1.338 -7.327 10.487 1.00 3.44 N ATOM 1160 CA LYS A 79 0.936 -6.649 11.726 1.00 62.32 C ATOM 1161 C LYS A 79 1.302 -5.160 11.736 1.00 64.33 C ATOM 1162 O LYS A 79 0.580 -4.327 12.305 1.00 61.30 O ATOM 1163 CB LYS A 79 1.500 -7.365 12.944 1.00 63.21 C ATOM 1164 CG LYS A 79 2.995 -7.516 12.911 1.00 33.22 C ATOM 1165 CD LYS A 79 3.529 -8.303 14.104 1.00 62.20 C ATOM 1166 CE LYS A 79 2.907 -9.693 14.183 1.00 61.34 C ATOM 1167 NZ LYS A 79 3.482 -10.506 15.268 1.00 51.42 N ATOM 0 H LYS A 79 1.981 -8.106 10.628 1.00 3.44 H new ATOM 0 HA LYS A 79 -0.152 -6.697 11.771 1.00 62.32 H new ATOM 0 HB2 LYS A 79 1.218 -6.815 13.842 1.00 63.21 H new ATOM 0 HB3 LYS A 79 1.044 -8.352 13.019 1.00 63.21 H new ATOM 0 HG2 LYS A 79 3.286 -8.019 11.989 1.00 33.22 H new ATOM 0 HG3 LYS A 79 3.456 -6.529 12.895 1.00 33.22 H new ATOM 0 HD2 LYS A 79 4.613 -8.392 14.026 1.00 62.20 H new ATOM 0 HD3 LYS A 79 3.320 -7.757 15.024 1.00 62.20 H new ATOM 0 HE2 LYS A 79 1.832 -9.599 14.335 1.00 61.34 H new ATOM 0 HE3 LYS A 79 3.051 -10.207 13.233 1.00 61.34 H new ATOM 0 HZ1 LYS A 79 3.027 -11.441 15.280 1.00 51.42 H new ATOM 0 HZ2 LYS A 79 4.504 -10.621 15.112 1.00 51.42 H new ATOM 0 HZ3 LYS A 79 3.322 -10.031 16.179 1.00 51.42 H new ATOM 1181 N SER A 80 2.385 -4.828 11.075 1.00 14.20 N ATOM 1182 CA SER A 80 2.841 -3.465 10.997 1.00 43.44 C ATOM 1183 C SER A 80 2.231 -2.728 9.796 1.00 45.11 C ATOM 1184 O SER A 80 2.542 -1.559 9.565 1.00 32.10 O ATOM 1185 CB SER A 80 4.361 -3.441 10.922 1.00 64.13 C ATOM 1186 OG SER A 80 4.927 -4.128 12.030 1.00 72.23 O ATOM 0 H SER A 80 2.973 -5.496 10.577 1.00 14.20 H new ATOM 0 HA SER A 80 2.512 -2.943 11.896 1.00 43.44 H new ATOM 0 HB2 SER A 80 4.692 -3.904 9.992 1.00 64.13 H new ATOM 0 HB3 SER A 80 4.714 -2.410 10.908 1.00 64.13 H new ATOM 0 HG SER A 80 5.905 -4.104 11.965 1.00 72.23 H new ATOM 1192 N LEU A 81 1.344 -3.400 9.050 1.00 2.14 N ATOM 1193 CA LEU A 81 0.702 -2.780 7.898 1.00 61.12 C ATOM 1194 C LEU A 81 -0.157 -1.583 8.354 1.00 72.40 C ATOM 1195 O LEU A 81 0.054 -0.465 7.878 1.00 60.30 O ATOM 1196 CB LEU A 81 -0.138 -3.786 7.115 1.00 73.14 C ATOM 1197 CG LEU A 81 -0.167 -3.605 5.604 1.00 55.31 C ATOM 1198 CD1 LEU A 81 -0.655 -2.230 5.184 1.00 73.13 C ATOM 1199 CD2 LEU A 81 1.178 -3.948 4.987 1.00 12.45 C ATOM 0 H LEU A 81 1.061 -4.364 9.226 1.00 2.14 H new ATOM 0 HA LEU A 81 1.482 -2.419 7.227 1.00 61.12 H new ATOM 0 HB2 LEU A 81 0.235 -4.787 7.333 1.00 73.14 H new ATOM 0 HB3 LEU A 81 -1.162 -3.739 7.485 1.00 73.14 H new ATOM 0 HG LEU A 81 -0.901 -4.311 5.214 1.00 55.31 H new ATOM 0 HD11 LEU A 81 -0.654 -2.160 4.096 1.00 73.13 H new ATOM 0 HD12 LEU A 81 -1.667 -2.074 5.557 1.00 73.13 H new ATOM 0 HD13 LEU A 81 0.005 -1.468 5.597 1.00 73.13 H new ATOM 0 HD21 LEU A 81 1.129 -3.810 3.907 1.00 12.45 H new ATOM 0 HD22 LEU A 81 1.946 -3.295 5.402 1.00 12.45 H new ATOM 0 HD23 LEU A 81 1.426 -4.986 5.209 1.00 12.45 H new ATOM 1211 N PRO A 82 -1.117 -1.761 9.333 1.00 51.13 N ATOM 1212 CA PRO A 82 -1.914 -0.640 9.821 1.00 32.01 C ATOM 1213 C PRO A 82 -1.025 0.399 10.486 1.00 64.12 C ATOM 1214 O PRO A 82 -1.293 1.587 10.422 1.00 21.44 O ATOM 1215 CB PRO A 82 -2.850 -1.270 10.861 1.00 32.41 C ATOM 1216 CG PRO A 82 -2.870 -2.714 10.528 1.00 35.51 C ATOM 1217 CD PRO A 82 -1.507 -3.023 10.019 1.00 54.31 C ATOM 0 HA PRO A 82 -2.449 -0.131 9.019 1.00 32.01 H new ATOM 0 HB2 PRO A 82 -2.485 -1.103 11.874 1.00 32.41 H new ATOM 0 HB3 PRO A 82 -3.849 -0.838 10.807 1.00 32.41 H new ATOM 0 HG2 PRO A 82 -3.107 -3.316 11.405 1.00 35.51 H new ATOM 0 HG3 PRO A 82 -3.629 -2.933 9.777 1.00 35.51 H new ATOM 0 HD2 PRO A 82 -0.820 -3.273 10.828 1.00 54.31 H new ATOM 0 HD3 PRO A 82 -1.514 -3.871 9.334 1.00 54.31 H new ATOM 1225 N GLY A 83 0.066 -0.071 11.079 1.00 21.33 N ATOM 1226 CA GLY A 83 0.985 0.801 11.773 1.00 2.33 C ATOM 1227 C GLY A 83 1.658 1.785 10.838 1.00 73.40 C ATOM 1228 O GLY A 83 1.703 2.986 11.132 1.00 63.12 O ATOM 0 H GLY A 83 0.330 -1.056 11.089 1.00 21.33 H new ATOM 0 HA2 GLY A 83 0.449 1.348 12.548 1.00 2.33 H new ATOM 0 HA3 GLY A 83 1.745 0.201 12.274 1.00 2.33 H new ATOM 1232 N LEU A 84 2.123 1.294 9.687 1.00 11.54 N ATOM 1233 CA LEU A 84 2.796 2.141 8.705 1.00 43.21 C ATOM 1234 C LEU A 84 1.802 3.126 8.105 1.00 1.22 C ATOM 1235 O LEU A 84 2.116 4.297 7.890 1.00 34.42 O ATOM 1236 CB LEU A 84 3.524 1.300 7.615 1.00 13.43 C ATOM 1237 CG LEU A 84 2.666 0.556 6.568 1.00 31.20 C ATOM 1238 CD1 LEU A 84 2.393 1.427 5.343 1.00 12.00 C ATOM 1239 CD2 LEU A 84 3.315 -0.751 6.168 1.00 54.35 C ATOM 0 H LEU A 84 2.045 0.314 9.414 1.00 11.54 H new ATOM 0 HA LEU A 84 3.574 2.711 9.213 1.00 43.21 H new ATOM 0 HB2 LEU A 84 4.200 1.966 7.078 1.00 13.43 H new ATOM 0 HB3 LEU A 84 4.142 0.561 8.124 1.00 13.43 H new ATOM 0 HG LEU A 84 1.705 0.332 7.031 1.00 31.20 H new ATOM 0 HD11 LEU A 84 1.787 0.870 4.628 1.00 12.00 H new ATOM 0 HD12 LEU A 84 1.859 2.327 5.648 1.00 12.00 H new ATOM 0 HD13 LEU A 84 3.338 1.706 4.877 1.00 12.00 H new ATOM 0 HD21 LEU A 84 2.692 -1.256 5.430 1.00 54.35 H new ATOM 0 HD22 LEU A 84 4.297 -0.553 5.739 1.00 54.35 H new ATOM 0 HD23 LEU A 84 3.424 -1.387 7.047 1.00 54.35 H new ATOM 1251 N LEU A 85 0.599 2.645 7.850 1.00 13.34 N ATOM 1252 CA LEU A 85 -0.444 3.477 7.303 1.00 51.10 C ATOM 1253 C LEU A 85 -0.787 4.587 8.267 1.00 3.14 C ATOM 1254 O LEU A 85 -0.826 5.739 7.890 1.00 51.43 O ATOM 1255 CB LEU A 85 -1.687 2.652 6.980 1.00 13.24 C ATOM 1256 CG LEU A 85 -1.516 1.574 5.911 1.00 73.41 C ATOM 1257 CD1 LEU A 85 -2.796 0.785 5.754 1.00 53.33 C ATOM 1258 CD2 LEU A 85 -1.106 2.190 4.581 1.00 74.14 C ATOM 0 H LEU A 85 0.324 1.677 8.016 1.00 13.34 H new ATOM 0 HA LEU A 85 -0.078 3.917 6.375 1.00 51.10 H new ATOM 0 HB2 LEU A 85 -2.030 2.174 7.898 1.00 13.24 H new ATOM 0 HB3 LEU A 85 -2.477 3.332 6.659 1.00 13.24 H new ATOM 0 HG LEU A 85 -0.723 0.897 6.231 1.00 73.41 H new ATOM 0 HD11 LEU A 85 -2.661 0.020 4.989 1.00 53.33 H new ATOM 0 HD12 LEU A 85 -3.049 0.310 6.702 1.00 53.33 H new ATOM 0 HD13 LEU A 85 -3.603 1.455 5.458 1.00 53.33 H new ATOM 0 HD21 LEU A 85 -0.990 1.403 3.836 1.00 74.14 H new ATOM 0 HD22 LEU A 85 -1.874 2.891 4.253 1.00 74.14 H new ATOM 0 HD23 LEU A 85 -0.160 2.718 4.701 1.00 74.14 H new ATOM 1270 N THR A 86 -0.951 4.230 9.519 1.00 51.15 N ATOM 1271 CA THR A 86 -1.341 5.178 10.560 1.00 52.12 C ATOM 1272 C THR A 86 -0.312 6.323 10.736 1.00 2.14 C ATOM 1273 O THR A 86 -0.703 7.505 10.853 1.00 13.13 O ATOM 1274 CB THR A 86 -1.602 4.449 11.904 1.00 51.22 C ATOM 1275 OG1 THR A 86 -2.618 3.458 11.696 1.00 44.14 O ATOM 1276 CG2 THR A 86 -2.068 5.414 12.991 1.00 3.41 C ATOM 0 H THR A 86 -0.820 3.276 9.854 1.00 51.15 H new ATOM 0 HA THR A 86 -2.272 5.642 10.233 1.00 52.12 H new ATOM 0 HB THR A 86 -0.668 3.995 12.235 1.00 51.22 H new ATOM 0 HG1 THR A 86 -2.295 2.787 11.059 1.00 44.14 H new ATOM 0 HG21 THR A 86 -2.240 4.864 13.916 1.00 3.41 H new ATOM 0 HG22 THR A 86 -1.303 6.173 13.156 1.00 3.41 H new ATOM 0 HG23 THR A 86 -2.994 5.895 12.678 1.00 3.41 H new ATOM 1284 N ILE A 87 0.980 5.986 10.695 1.00 25.41 N ATOM 1285 CA ILE A 87 2.020 6.981 10.875 1.00 50.44 C ATOM 1286 C ILE A 87 2.030 7.987 9.700 1.00 12.30 C ATOM 1287 O ILE A 87 2.026 9.200 9.918 1.00 54.20 O ATOM 1288 CB ILE A 87 3.446 6.323 11.237 1.00 33.43 C ATOM 1289 CG1 ILE A 87 4.593 7.338 11.457 1.00 5.54 C ATOM 1290 CG2 ILE A 87 3.880 5.250 10.264 1.00 12.14 C ATOM 1291 CD1 ILE A 87 5.238 7.878 10.204 1.00 23.15 C ATOM 0 H ILE A 87 1.321 5.037 10.540 1.00 25.41 H new ATOM 0 HA ILE A 87 1.786 7.576 11.758 1.00 50.44 H new ATOM 0 HB ILE A 87 3.255 5.852 12.201 1.00 33.43 H new ATOM 0 HG12 ILE A 87 4.205 8.177 12.035 1.00 5.54 H new ATOM 0 HG13 ILE A 87 5.363 6.862 12.064 1.00 5.54 H new ATOM 0 HG21 ILE A 87 4.848 4.852 10.569 1.00 12.14 H new ATOM 0 HG22 ILE A 87 3.143 4.447 10.256 1.00 12.14 H new ATOM 0 HG23 ILE A 87 3.963 5.677 9.265 1.00 12.14 H new ATOM 0 HD11 ILE A 87 6.027 8.579 10.474 1.00 23.15 H new ATOM 0 HD12 ILE A 87 5.664 7.055 9.631 1.00 23.15 H new ATOM 0 HD13 ILE A 87 4.489 8.390 9.601 1.00 23.15 H new ATOM 1303 N LEU A 88 1.988 7.483 8.476 1.00 52.51 N ATOM 1304 CA LEU A 88 1.922 8.343 7.282 1.00 50.33 C ATOM 1305 C LEU A 88 0.598 9.094 7.161 1.00 74.13 C ATOM 1306 O LEU A 88 0.569 10.238 6.696 1.00 51.21 O ATOM 1307 CB LEU A 88 2.192 7.576 5.992 1.00 50.10 C ATOM 1308 CG LEU A 88 3.649 7.234 5.634 1.00 55.32 C ATOM 1309 CD1 LEU A 88 4.505 8.482 5.508 1.00 52.20 C ATOM 1310 CD2 LEU A 88 4.251 6.273 6.613 1.00 43.31 C ATOM 0 H LEU A 88 1.998 6.483 8.273 1.00 52.51 H new ATOM 0 HA LEU A 88 2.717 9.076 7.423 1.00 50.33 H new ATOM 0 HB2 LEU A 88 1.634 6.641 6.039 1.00 50.10 H new ATOM 0 HB3 LEU A 88 1.775 8.155 5.168 1.00 50.10 H new ATOM 0 HG LEU A 88 3.626 6.746 4.660 1.00 55.32 H new ATOM 0 HD11 LEU A 88 5.526 8.198 5.254 1.00 52.20 H new ATOM 0 HD12 LEU A 88 4.101 9.123 4.724 1.00 52.20 H new ATOM 0 HD13 LEU A 88 4.503 9.022 6.455 1.00 52.20 H new ATOM 0 HD21 LEU A 88 5.280 6.057 6.325 1.00 43.31 H new ATOM 0 HD22 LEU A 88 4.238 6.713 7.610 1.00 43.31 H new ATOM 0 HD23 LEU A 88 3.674 5.348 6.617 1.00 43.31 H new ATOM 1322 N HIS A 89 -0.483 8.445 7.566 1.00 62.02 N ATOM 1323 CA HIS A 89 -1.841 8.999 7.481 1.00 61.31 C ATOM 1324 C HIS A 89 -1.935 10.290 8.275 1.00 62.12 C ATOM 1325 O HIS A 89 -2.494 11.281 7.795 1.00 70.24 O ATOM 1326 CB HIS A 89 -2.865 7.961 7.994 1.00 54.24 C ATOM 1327 CG HIS A 89 -4.311 8.366 7.932 1.00 60.33 C ATOM 1328 ND1 HIS A 89 -5.086 8.588 9.043 1.00 72.13 N ATOM 1329 CD2 HIS A 89 -5.133 8.529 6.867 1.00 2.32 C ATOM 1330 CE1 HIS A 89 -6.322 8.867 8.641 1.00 1.24 C ATOM 1331 NE2 HIS A 89 -6.412 8.846 7.320 1.00 2.02 N ATOM 0 H HIS A 89 -0.450 7.508 7.968 1.00 62.02 H new ATOM 0 HA HIS A 89 -2.069 9.226 6.440 1.00 61.31 H new ATOM 0 HB2 HIS A 89 -2.741 7.044 7.417 1.00 54.24 H new ATOM 0 HB3 HIS A 89 -2.621 7.722 9.029 1.00 54.24 H new ATOM 0 HD2 HIS A 89 -4.843 8.429 5.832 1.00 2.32 H new ATOM 0 HE1 HIS A 89 -7.146 9.083 9.305 1.00 1.24 H new ATOM 0 HE2 HIS A 89 -7.242 9.024 6.754 1.00 2.02 H new ATOM 1339 N ASP A 90 -1.339 10.293 9.460 1.00 22.12 N ATOM 1340 CA ASP A 90 -1.323 11.487 10.310 1.00 32.23 C ATOM 1341 C ASP A 90 -0.499 12.594 9.663 1.00 0.03 C ATOM 1342 O ASP A 90 -0.802 13.782 9.800 1.00 3.21 O ATOM 1343 CB ASP A 90 -0.764 11.162 11.695 1.00 61.40 C ATOM 1344 CG ASP A 90 -0.659 12.384 12.586 1.00 44.41 C ATOM 1345 OD1 ASP A 90 -1.669 12.794 13.194 1.00 53.40 O ATOM 1346 OD2 ASP A 90 0.444 12.956 12.711 1.00 13.44 O ATOM 0 H ASP A 90 -0.860 9.486 9.858 1.00 22.12 H new ATOM 0 HA ASP A 90 -2.351 11.832 10.423 1.00 32.23 H new ATOM 0 HB2 ASP A 90 -1.403 10.421 12.175 1.00 61.40 H new ATOM 0 HB3 ASP A 90 0.222 10.710 11.587 1.00 61.40 H new ATOM 1351 N GLY A 91 0.499 12.192 8.899 1.00 43.35 N ATOM 1352 CA GLY A 91 1.349 13.138 8.215 1.00 43.43 C ATOM 1353 C GLY A 91 0.715 13.678 6.938 1.00 64.30 C ATOM 1354 O GLY A 91 1.234 14.611 6.334 1.00 14.25 O ATOM 0 H GLY A 91 0.738 11.214 8.739 1.00 43.35 H new ATOM 0 HA2 GLY A 91 1.574 13.969 8.884 1.00 43.43 H new ATOM 0 HA3 GLY A 91 2.297 12.659 7.971 1.00 43.43 H new ATOM 1358 N GLY A 92 -0.398 13.085 6.533 1.00 24.40 N ATOM 1359 CA GLY A 92 -1.123 13.541 5.358 1.00 23.04 C ATOM 1360 C GLY A 92 -0.551 13.008 4.062 1.00 2.50 C ATOM 1361 O GLY A 92 -0.744 13.605 2.993 1.00 52.11 O ATOM 0 H GLY A 92 -0.820 12.284 7.003 1.00 24.40 H new ATOM 0 HA2 GLY A 92 -2.166 13.235 5.441 1.00 23.04 H new ATOM 0 HA3 GLY A 92 -1.112 14.631 5.332 1.00 23.04 H new ATOM 1365 N TYR A 93 0.135 11.893 4.134 1.00 43.23 N ATOM 1366 CA TYR A 93 0.742 11.313 2.954 1.00 71.13 C ATOM 1367 C TYR A 93 -0.204 10.368 2.267 1.00 24.05 C ATOM 1368 O TYR A 93 -0.840 9.538 2.913 1.00 63.44 O ATOM 1369 CB TYR A 93 2.072 10.651 3.285 1.00 4.43 C ATOM 1370 CG TYR A 93 3.114 11.661 3.674 1.00 2.13 C ATOM 1371 CD1 TYR A 93 3.893 12.262 2.709 1.00 32.35 C ATOM 1372 CD2 TYR A 93 3.299 12.037 4.998 1.00 44.51 C ATOM 1373 CE1 TYR A 93 4.832 13.207 3.039 1.00 23.13 C ATOM 1374 CE2 TYR A 93 4.242 12.984 5.339 1.00 4.25 C ATOM 1375 CZ TYR A 93 5.004 13.567 4.353 1.00 73.52 C ATOM 1376 OH TYR A 93 5.949 14.511 4.681 1.00 34.42 O ATOM 0 H TYR A 93 0.288 11.367 4.995 1.00 43.23 H new ATOM 0 HA TYR A 93 0.955 12.120 2.253 1.00 71.13 H new ATOM 0 HB2 TYR A 93 1.932 9.940 4.100 1.00 4.43 H new ATOM 0 HB3 TYR A 93 2.420 10.083 2.423 1.00 4.43 H new ATOM 0 HD1 TYR A 93 3.762 11.984 1.674 1.00 32.35 H new ATOM 0 HD2 TYR A 93 2.697 11.582 5.771 1.00 44.51 H new ATOM 0 HE1 TYR A 93 5.433 13.666 2.268 1.00 23.13 H new ATOM 0 HE2 TYR A 93 4.381 13.266 6.372 1.00 4.25 H new ATOM 0 HH TYR A 93 6.707 14.075 5.124 1.00 34.42 H new ATOM 1386 N ARG A 94 -0.311 10.511 0.967 1.00 74.33 N ATOM 1387 CA ARG A 94 -1.260 9.735 0.201 1.00 11.33 C ATOM 1388 C ARG A 94 -0.780 8.315 -0.072 1.00 62.21 C ATOM 1389 O ARG A 94 0.400 7.990 0.085 1.00 61.12 O ATOM 1390 CB ARG A 94 -1.634 10.426 -1.122 1.00 14.24 C ATOM 1391 CG ARG A 94 -0.523 10.497 -2.153 1.00 10.42 C ATOM 1392 CD ARG A 94 -1.038 11.089 -3.450 1.00 14.51 C ATOM 1393 NE ARG A 94 -1.471 12.478 -3.286 1.00 63.55 N ATOM 1394 CZ ARG A 94 -2.508 13.042 -3.917 1.00 20.30 C ATOM 1395 NH1 ARG A 94 -3.307 12.316 -4.690 1.00 5.31 N ATOM 1396 NH2 ARG A 94 -2.758 14.325 -3.741 1.00 41.41 N ATOM 0 H ARG A 94 0.250 11.160 0.415 1.00 74.33 H new ATOM 0 HA ARG A 94 -2.152 9.669 0.824 1.00 11.33 H new ATOM 0 HB2 ARG A 94 -2.481 9.899 -1.561 1.00 14.24 H new ATOM 0 HB3 ARG A 94 -1.968 11.440 -0.902 1.00 14.24 H new ATOM 0 HG2 ARG A 94 0.298 11.104 -1.770 1.00 10.42 H new ATOM 0 HG3 ARG A 94 -0.124 9.499 -2.335 1.00 10.42 H new ATOM 0 HD2 ARG A 94 -0.255 11.040 -4.207 1.00 14.51 H new ATOM 0 HD3 ARG A 94 -1.872 10.490 -3.816 1.00 14.51 H new ATOM 0 HE ARG A 94 -0.940 13.062 -2.640 1.00 63.55 H new ATOM 0 HH11 ARG A 94 -3.134 11.318 -4.808 1.00 5.31 H new ATOM 0 HH12 ARG A 94 -4.094 12.757 -5.166 1.00 5.31 H new ATOM 0 HH21 ARG A 94 -2.163 14.881 -3.127 1.00 41.41 H new ATOM 0 HH22 ARG A 94 -3.547 14.761 -4.219 1.00 41.41 H new ATOM 1410 N ASP A 95 -1.706 7.530 -0.580 1.00 43.21 N ATOM 1411 CA ASP A 95 -1.561 6.101 -0.897 1.00 52.11 C ATOM 1412 C ASP A 95 -0.376 5.838 -1.814 1.00 12.42 C ATOM 1413 O ASP A 95 0.443 4.940 -1.555 1.00 24.24 O ATOM 1414 CB ASP A 95 -2.857 5.626 -1.600 1.00 12.44 C ATOM 1415 CG ASP A 95 -3.133 6.397 -2.902 1.00 3.24 C ATOM 1416 OD1 ASP A 95 -3.422 7.629 -2.839 1.00 23.55 O ATOM 1417 OD2 ASP A 95 -2.996 5.823 -3.987 1.00 3.21 O ATOM 0 H ASP A 95 -2.639 7.880 -0.800 1.00 43.21 H new ATOM 0 HA ASP A 95 -1.388 5.558 0.032 1.00 52.11 H new ATOM 0 HB2 ASP A 95 -2.778 4.562 -1.821 1.00 12.44 H new ATOM 0 HB3 ASP A 95 -3.701 5.749 -0.922 1.00 12.44 H new ATOM 1422 N THR A 96 -0.260 6.648 -2.831 1.00 42.05 N ATOM 1423 CA THR A 96 0.765 6.534 -3.796 1.00 25.30 C ATOM 1424 C THR A 96 2.133 6.784 -3.148 1.00 40.31 C ATOM 1425 O THR A 96 3.086 6.073 -3.419 1.00 43.41 O ATOM 1426 CB THR A 96 0.487 7.485 -4.964 1.00 21.35 C ATOM 1427 OG1 THR A 96 -0.905 7.325 -5.364 1.00 44.42 O ATOM 1428 CG2 THR A 96 1.389 7.156 -6.140 1.00 52.13 C ATOM 0 H THR A 96 -0.901 7.423 -3.003 1.00 42.05 H new ATOM 0 HA THR A 96 0.783 5.521 -4.198 1.00 25.30 H new ATOM 0 HB THR A 96 0.682 8.512 -4.654 1.00 21.35 H new ATOM 0 HG1 THR A 96 -1.189 8.108 -5.881 1.00 44.42 H new ATOM 0 HG21 THR A 96 1.179 7.840 -6.962 1.00 52.13 H new ATOM 0 HG22 THR A 96 2.432 7.259 -5.839 1.00 52.13 H new ATOM 0 HG23 THR A 96 1.205 6.132 -6.465 1.00 52.13 H new ATOM 1436 N GLU A 97 2.198 7.771 -2.247 1.00 32.41 N ATOM 1437 CA GLU A 97 3.444 8.093 -1.558 1.00 24.11 C ATOM 1438 C GLU A 97 3.878 6.963 -0.653 1.00 41.01 C ATOM 1439 O GLU A 97 5.065 6.671 -0.569 1.00 64.22 O ATOM 1440 CB GLU A 97 3.355 9.395 -0.755 1.00 22.03 C ATOM 1441 CG GLU A 97 3.249 10.636 -1.603 1.00 51.14 C ATOM 1442 CD GLU A 97 4.412 10.783 -2.558 1.00 63.31 C ATOM 1443 OE1 GLU A 97 5.554 11.011 -2.109 1.00 14.30 O ATOM 1444 OE2 GLU A 97 4.190 10.696 -3.778 1.00 11.31 O ATOM 0 H GLU A 97 1.405 8.355 -1.982 1.00 32.41 H new ATOM 0 HA GLU A 97 4.192 8.235 -2.338 1.00 24.11 H new ATOM 0 HB2 GLU A 97 2.489 9.344 -0.095 1.00 22.03 H new ATOM 0 HB3 GLU A 97 4.236 9.477 -0.118 1.00 22.03 H new ATOM 0 HG2 GLU A 97 2.318 10.607 -2.170 1.00 51.14 H new ATOM 0 HG3 GLU A 97 3.201 11.512 -0.956 1.00 51.14 H new ATOM 1451 N ILE A 98 2.912 6.292 -0.012 1.00 2.53 N ATOM 1452 CA ILE A 98 3.244 5.207 0.913 1.00 63.22 C ATOM 1453 C ILE A 98 3.966 4.122 0.139 1.00 35.11 C ATOM 1454 O ILE A 98 5.053 3.681 0.504 1.00 13.43 O ATOM 1455 CB ILE A 98 1.979 4.524 1.528 1.00 23.00 C ATOM 1456 CG1 ILE A 98 0.915 5.523 1.990 1.00 31.12 C ATOM 1457 CG2 ILE A 98 2.376 3.633 2.685 1.00 71.42 C ATOM 1458 CD1 ILE A 98 1.403 6.584 2.933 1.00 54.14 C ATOM 0 H ILE A 98 1.914 6.478 -0.115 1.00 2.53 H new ATOM 0 HA ILE A 98 3.841 5.646 1.712 1.00 63.22 H new ATOM 0 HB ILE A 98 1.533 3.930 0.730 1.00 23.00 H new ATOM 0 HG12 ILE A 98 0.489 6.008 1.112 1.00 31.12 H new ATOM 0 HG13 ILE A 98 0.108 4.973 2.474 1.00 31.12 H new ATOM 0 HG21 ILE A 98 1.486 3.163 3.104 1.00 71.42 H new ATOM 0 HG22 ILE A 98 3.061 2.862 2.332 1.00 71.42 H new ATOM 0 HG23 ILE A 98 2.867 4.231 3.453 1.00 71.42 H new ATOM 0 HD11 ILE A 98 0.576 7.241 3.201 1.00 54.14 H new ATOM 0 HD12 ILE A 98 1.801 6.116 3.833 1.00 54.14 H new ATOM 0 HD13 ILE A 98 2.187 7.167 2.450 1.00 54.14 H new ATOM 1470 N MET A 99 3.376 3.756 -0.980 1.00 75.44 N ATOM 1471 CA MET A 99 3.914 2.718 -1.816 1.00 5.12 C ATOM 1472 C MET A 99 5.127 3.179 -2.601 1.00 22.42 C ATOM 1473 O MET A 99 5.902 2.361 -3.074 1.00 4.45 O ATOM 1474 CB MET A 99 2.847 2.144 -2.732 1.00 53.32 C ATOM 1475 CG MET A 99 1.675 1.575 -1.971 1.00 3.40 C ATOM 1476 SD MET A 99 0.502 0.720 -3.013 1.00 12.00 S ATOM 1477 CE MET A 99 -0.776 0.382 -1.814 1.00 2.24 C ATOM 0 H MET A 99 2.513 4.172 -1.330 1.00 75.44 H new ATOM 0 HA MET A 99 4.254 1.922 -1.154 1.00 5.12 H new ATOM 0 HB2 MET A 99 2.494 2.924 -3.406 1.00 53.32 H new ATOM 0 HB3 MET A 99 3.287 1.363 -3.352 1.00 53.32 H new ATOM 0 HG2 MET A 99 2.044 0.886 -1.211 1.00 3.40 H new ATOM 0 HG3 MET A 99 1.164 2.383 -1.448 1.00 3.40 H new ATOM 0 HE1 MET A 99 -1.719 0.199 -2.329 1.00 2.24 H new ATOM 0 HE2 MET A 99 -0.504 -0.498 -1.231 1.00 2.24 H new ATOM 0 HE3 MET A 99 -0.886 1.238 -1.148 1.00 2.24 H new ATOM 1487 N ARG A 100 5.301 4.487 -2.708 1.00 51.53 N ATOM 1488 CA ARG A 100 6.399 5.075 -3.460 1.00 75.42 C ATOM 1489 C ARG A 100 7.725 4.604 -2.881 1.00 24.40 C ATOM 1490 O ARG A 100 8.450 3.858 -3.530 1.00 31.21 O ATOM 1491 CB ARG A 100 6.289 6.604 -3.433 1.00 11.34 C ATOM 1492 CG ARG A 100 7.300 7.362 -4.270 1.00 62.15 C ATOM 1493 CD ARG A 100 7.048 8.854 -4.146 1.00 62.35 C ATOM 1494 NE ARG A 100 7.967 9.660 -4.947 1.00 61.10 N ATOM 1495 CZ ARG A 100 8.245 10.949 -4.712 1.00 41.13 C ATOM 1496 NH1 ARG A 100 7.625 11.611 -3.731 1.00 11.25 N ATOM 1497 NH2 ARG A 100 9.109 11.591 -5.483 1.00 64.22 N ATOM 0 H ARG A 100 4.683 5.173 -2.275 1.00 51.53 H new ATOM 0 HA ARG A 100 6.348 4.753 -4.500 1.00 75.42 H new ATOM 0 HB2 ARG A 100 5.290 6.882 -3.768 1.00 11.34 H new ATOM 0 HB3 ARG A 100 6.382 6.936 -2.399 1.00 11.34 H new ATOM 0 HG2 ARG A 100 8.311 7.125 -3.940 1.00 62.15 H new ATOM 0 HG3 ARG A 100 7.226 7.056 -5.314 1.00 62.15 H new ATOM 0 HD2 ARG A 100 6.024 9.070 -4.452 1.00 62.35 H new ATOM 0 HD3 ARG A 100 7.136 9.145 -3.099 1.00 62.35 H new ATOM 0 HE ARG A 100 8.428 9.211 -5.738 1.00 61.10 H new ATOM 0 HH11 ARG A 100 6.933 11.135 -3.153 1.00 11.25 H new ATOM 0 HH12 ARG A 100 7.844 12.592 -3.560 1.00 11.25 H new ATOM 0 HH21 ARG A 100 9.563 11.104 -6.256 1.00 64.22 H new ATOM 0 HH22 ARG A 100 9.321 12.573 -5.304 1.00 64.22 H new ATOM 1511 N TRP A 101 8.012 4.985 -1.651 1.00 23.00 N ATOM 1512 CA TRP A 101 9.236 4.539 -0.999 1.00 60.43 C ATOM 1513 C TRP A 101 9.223 3.056 -0.678 1.00 3.43 C ATOM 1514 O TRP A 101 10.253 2.417 -0.709 1.00 23.31 O ATOM 1515 CB TRP A 101 9.623 5.391 0.212 1.00 1.10 C ATOM 1516 CG TRP A 101 8.506 5.720 1.141 1.00 24.54 C ATOM 1517 CD1 TRP A 101 7.800 6.863 1.137 1.00 41.35 C ATOM 1518 CD2 TRP A 101 7.965 4.925 2.203 1.00 64.24 C ATOM 1519 NE1 TRP A 101 6.872 6.853 2.125 1.00 72.23 N ATOM 1520 CE2 TRP A 101 6.942 5.681 2.792 1.00 31.51 C ATOM 1521 CE3 TRP A 101 8.241 3.660 2.717 1.00 55.41 C ATOM 1522 CZ2 TRP A 101 6.199 5.228 3.852 1.00 54.42 C ATOM 1523 CZ3 TRP A 101 7.493 3.203 3.776 1.00 0.14 C ATOM 1524 CH2 TRP A 101 6.482 3.984 4.338 1.00 53.23 C ATOM 0 H TRP A 101 7.423 5.596 -1.085 1.00 23.00 H new ATOM 0 HA TRP A 101 10.026 4.691 -1.735 1.00 60.43 H new ATOM 0 HB2 TRP A 101 10.397 4.867 0.772 1.00 1.10 H new ATOM 0 HB3 TRP A 101 10.063 6.322 -0.145 1.00 1.10 H new ATOM 0 HD1 TRP A 101 7.951 7.677 0.443 1.00 41.35 H new ATOM 0 HE1 TRP A 101 6.223 7.612 2.332 1.00 72.23 H new ATOM 0 HE3 TRP A 101 9.026 3.051 2.293 1.00 55.41 H new ATOM 0 HZ2 TRP A 101 5.418 5.834 4.287 1.00 54.42 H new ATOM 0 HZ3 TRP A 101 7.691 2.221 4.181 1.00 0.14 H new ATOM 0 HH2 TRP A 101 5.914 3.598 5.171 1.00 53.23 H new ATOM 1535 N LEU A 102 8.046 2.525 -0.379 1.00 60.01 N ATOM 1536 CA LEU A 102 7.892 1.106 -0.069 1.00 14.44 C ATOM 1537 C LEU A 102 8.364 0.201 -1.214 1.00 23.24 C ATOM 1538 O LEU A 102 9.016 -0.836 -0.982 1.00 30.11 O ATOM 1539 CB LEU A 102 6.434 0.792 0.270 1.00 25.21 C ATOM 1540 CG LEU A 102 5.981 0.929 1.718 1.00 22.44 C ATOM 1541 CD1 LEU A 102 4.500 0.632 1.827 1.00 1.53 C ATOM 1542 CD2 LEU A 102 6.751 -0.015 2.600 1.00 62.35 C ATOM 0 H LEU A 102 7.177 3.058 -0.344 1.00 60.01 H new ATOM 0 HA LEU A 102 8.525 0.900 0.794 1.00 14.44 H new ATOM 0 HB2 LEU A 102 5.805 1.442 -0.338 1.00 25.21 H new ATOM 0 HB3 LEU A 102 6.233 -0.232 -0.045 1.00 25.21 H new ATOM 0 HG LEU A 102 6.170 1.952 2.045 1.00 22.44 H new ATOM 0 HD11 LEU A 102 4.184 0.732 2.865 1.00 1.53 H new ATOM 0 HD12 LEU A 102 3.942 1.335 1.209 1.00 1.53 H new ATOM 0 HD13 LEU A 102 4.307 -0.385 1.486 1.00 1.53 H new ATOM 0 HD21 LEU A 102 6.416 0.095 3.631 1.00 62.35 H new ATOM 0 HD22 LEU A 102 6.582 -1.040 2.271 1.00 62.35 H new ATOM 0 HD23 LEU A 102 7.815 0.215 2.538 1.00 62.35 H new ATOM 1554 N PHE A 103 8.054 0.580 -2.433 1.00 11.25 N ATOM 1555 CA PHE A 103 8.436 -0.214 -3.583 1.00 14.05 C ATOM 1556 C PHE A 103 9.767 0.217 -4.164 1.00 4.13 C ATOM 1557 O PHE A 103 10.344 -0.497 -4.996 1.00 54.41 O ATOM 1558 CB PHE A 103 7.339 -0.231 -4.652 1.00 75.32 C ATOM 1559 CG PHE A 103 6.139 -1.076 -4.291 1.00 4.04 C ATOM 1560 CD1 PHE A 103 5.175 -0.617 -3.410 1.00 2.01 C ATOM 1561 CD2 PHE A 103 5.975 -2.329 -4.852 1.00 32.43 C ATOM 1562 CE1 PHE A 103 4.077 -1.390 -3.093 1.00 64.34 C ATOM 1563 CE2 PHE A 103 4.881 -3.106 -4.538 1.00 21.04 C ATOM 1564 CZ PHE A 103 3.931 -2.635 -3.659 1.00 4.12 C ATOM 0 H PHE A 103 7.539 1.432 -2.656 1.00 11.25 H new ATOM 0 HA PHE A 103 8.562 -1.236 -3.225 1.00 14.05 H new ATOM 0 HB2 PHE A 103 7.008 0.792 -4.834 1.00 75.32 H new ATOM 0 HB3 PHE A 103 7.762 -0.600 -5.586 1.00 75.32 H new ATOM 0 HD1 PHE A 103 5.284 0.361 -2.964 1.00 2.01 H new ATOM 0 HD2 PHE A 103 6.714 -2.704 -5.545 1.00 32.43 H new ATOM 0 HE1 PHE A 103 3.334 -1.019 -2.402 1.00 64.34 H new ATOM 0 HE2 PHE A 103 4.769 -4.084 -4.981 1.00 21.04 H new ATOM 0 HZ PHE A 103 3.072 -3.243 -3.414 1.00 4.12 H new ATOM 1574 N THR A 104 10.262 1.347 -3.730 1.00 62.14 N ATOM 1575 CA THR A 104 11.539 1.828 -4.183 1.00 21.45 C ATOM 1576 C THR A 104 12.650 1.234 -3.315 1.00 22.11 C ATOM 1577 O THR A 104 12.574 1.283 -2.092 1.00 2.44 O ATOM 1578 CB THR A 104 11.605 3.383 -4.163 1.00 43.42 C ATOM 1579 OG1 THR A 104 10.583 3.910 -5.031 1.00 4.22 O ATOM 1580 CG2 THR A 104 12.958 3.895 -4.639 1.00 71.33 C ATOM 0 H THR A 104 9.795 1.955 -3.058 1.00 62.14 H new ATOM 0 HA THR A 104 11.677 1.509 -5.216 1.00 21.45 H new ATOM 0 HB THR A 104 11.454 3.712 -3.135 1.00 43.42 H new ATOM 0 HG1 THR A 104 9.731 3.946 -4.549 1.00 4.22 H new ATOM 0 HG21 THR A 104 12.965 4.985 -4.611 1.00 71.33 H new ATOM 0 HG22 THR A 104 13.742 3.510 -3.987 1.00 71.33 H new ATOM 0 HG23 THR A 104 13.136 3.557 -5.660 1.00 71.33 H new ATOM 1588 N PRO A 105 13.638 0.580 -3.938 1.00 2.33 N ATOM 1589 CA PRO A 105 14.800 0.059 -3.233 1.00 11.20 C ATOM 1590 C PRO A 105 15.506 1.169 -2.465 1.00 3.13 C ATOM 1591 O PRO A 105 15.784 2.243 -3.023 1.00 24.55 O ATOM 1592 CB PRO A 105 15.695 -0.434 -4.369 1.00 74.20 C ATOM 1593 CG PRO A 105 14.764 -0.750 -5.471 1.00 2.02 C ATOM 1594 CD PRO A 105 13.688 0.276 -5.380 1.00 51.44 C ATOM 0 HA PRO A 105 14.547 -0.711 -2.504 1.00 11.20 H new ATOM 0 HB2 PRO A 105 16.415 0.329 -4.665 1.00 74.20 H new ATOM 0 HB3 PRO A 105 16.267 -1.312 -4.070 1.00 74.20 H new ATOM 0 HG2 PRO A 105 15.268 -0.707 -6.437 1.00 2.02 H new ATOM 0 HG3 PRO A 105 14.358 -1.756 -5.367 1.00 2.02 H new ATOM 0 HD2 PRO A 105 13.924 1.161 -5.971 1.00 51.44 H new ATOM 0 HD3 PRO A 105 12.735 -0.106 -5.745 1.00 51.44 H new ATOM 1602 N ASP A 106 15.777 0.939 -1.211 1.00 25.23 N ATOM 1603 CA ASP A 106 16.448 1.931 -0.408 1.00 4.41 C ATOM 1604 C ASP A 106 17.944 1.699 -0.506 1.00 72.52 C ATOM 1605 O ASP A 106 18.426 0.596 -0.201 1.00 13.33 O ATOM 1606 CB ASP A 106 15.999 1.873 1.053 1.00 11.33 C ATOM 1607 CG ASP A 106 16.546 3.033 1.874 1.00 74.32 C ATOM 1608 OD1 ASP A 106 17.693 2.957 2.353 1.00 64.24 O ATOM 1609 OD2 ASP A 106 15.817 4.042 2.057 1.00 54.53 O ATOM 0 H ASP A 106 15.545 0.075 -0.720 1.00 25.23 H new ATOM 0 HA ASP A 106 16.192 2.921 -0.784 1.00 4.41 H new ATOM 0 HB2 ASP A 106 14.910 1.882 1.096 1.00 11.33 H new ATOM 0 HB3 ASP A 106 16.328 0.932 1.494 1.00 11.33 H new ATOM 1614 N PRO A 107 18.706 2.724 -0.934 1.00 44.42 N ATOM 1615 CA PRO A 107 20.153 2.611 -1.144 1.00 71.43 C ATOM 1616 C PRO A 107 20.924 2.236 0.114 1.00 43.24 C ATOM 1617 O PRO A 107 22.019 1.668 0.031 1.00 2.24 O ATOM 1618 CB PRO A 107 20.588 4.011 -1.585 1.00 3.20 C ATOM 1619 CG PRO A 107 19.346 4.742 -1.944 1.00 12.43 C ATOM 1620 CD PRO A 107 18.206 4.074 -1.244 1.00 10.10 C ATOM 0 HA PRO A 107 20.361 1.821 -1.866 1.00 71.43 H new ATOM 0 HB2 PRO A 107 21.122 4.522 -0.784 1.00 3.20 H new ATOM 0 HB3 PRO A 107 21.267 3.957 -2.436 1.00 3.20 H new ATOM 0 HG2 PRO A 107 19.418 5.788 -1.645 1.00 12.43 H new ATOM 0 HG3 PRO A 107 19.193 4.729 -3.023 1.00 12.43 H new ATOM 0 HD2 PRO A 107 17.926 4.612 -0.338 1.00 10.10 H new ATOM 0 HD3 PRO A 107 17.320 4.034 -1.877 1.00 10.10 H new ATOM 1628 N SER A 108 20.362 2.538 1.258 1.00 51.40 N ATOM 1629 CA SER A 108 21.036 2.319 2.514 1.00 60.23 C ATOM 1630 C SER A 108 20.497 1.071 3.228 1.00 53.22 C ATOM 1631 O SER A 108 20.944 0.731 4.333 1.00 72.14 O ATOM 1632 CB SER A 108 20.849 3.556 3.394 1.00 12.34 C ATOM 1633 OG SER A 108 21.219 4.741 2.690 1.00 1.52 O ATOM 0 H SER A 108 19.429 2.941 1.345 1.00 51.40 H new ATOM 0 HA SER A 108 22.096 2.152 2.323 1.00 60.23 H new ATOM 0 HB2 SER A 108 19.809 3.627 3.713 1.00 12.34 H new ATOM 0 HB3 SER A 108 21.453 3.460 4.296 1.00 12.34 H new ATOM 0 HG SER A 108 21.090 5.520 3.270 1.00 1.52 H new ATOM 1639 N LEU A 109 19.587 0.363 2.587 1.00 35.13 N ATOM 1640 CA LEU A 109 18.974 -0.773 3.220 1.00 20.43 C ATOM 1641 C LEU A 109 19.580 -2.066 2.719 1.00 32.25 C ATOM 1642 O LEU A 109 19.615 -2.341 1.510 1.00 21.15 O ATOM 1643 CB LEU A 109 17.471 -0.784 2.966 1.00 3.13 C ATOM 1644 CG LEU A 109 16.671 -1.870 3.685 1.00 14.35 C ATOM 1645 CD1 LEU A 109 16.627 -1.613 5.184 1.00 54.51 C ATOM 1646 CD2 LEU A 109 15.276 -1.974 3.114 1.00 30.42 C ATOM 0 H LEU A 109 19.263 0.556 1.639 1.00 35.13 H new ATOM 0 HA LEU A 109 19.156 -0.691 4.292 1.00 20.43 H new ATOM 0 HB2 LEU A 109 17.068 0.186 3.256 1.00 3.13 H new ATOM 0 HB3 LEU A 109 17.306 -0.891 1.894 1.00 3.13 H new ATOM 0 HG LEU A 109 17.175 -2.823 3.524 1.00 14.35 H new ATOM 0 HD11 LEU A 109 16.052 -2.400 5.671 1.00 54.51 H new ATOM 0 HD12 LEU A 109 17.642 -1.606 5.582 1.00 54.51 H new ATOM 0 HD13 LEU A 109 16.156 -0.649 5.374 1.00 54.51 H new ATOM 0 HD21 LEU A 109 14.724 -2.753 3.640 1.00 30.42 H new ATOM 0 HD22 LEU A 109 14.762 -1.021 3.234 1.00 30.42 H new ATOM 0 HD23 LEU A 109 15.334 -2.224 2.055 1.00 30.42 H new ATOM 1658 N THR A 110 20.064 -2.839 3.639 1.00 5.55 N ATOM 1659 CA THR A 110 20.627 -4.127 3.359 1.00 25.52 C ATOM 1660 C THR A 110 20.013 -5.128 4.333 1.00 75.23 C ATOM 1661 O THR A 110 20.280 -5.091 5.537 1.00 72.23 O ATOM 1662 CB THR A 110 22.160 -4.108 3.517 1.00 45.34 C ATOM 1663 OG1 THR A 110 22.720 -3.051 2.706 1.00 63.21 O ATOM 1664 CG2 THR A 110 22.762 -5.434 3.084 1.00 14.14 C ATOM 0 H THR A 110 20.080 -2.589 4.628 1.00 5.55 H new ATOM 0 HA THR A 110 20.408 -4.407 2.329 1.00 25.52 H new ATOM 0 HB THR A 110 22.394 -3.938 4.568 1.00 45.34 H new ATOM 0 HG1 THR A 110 23.694 -3.040 2.810 1.00 63.21 H new ATOM 0 HG21 THR A 110 23.845 -5.398 3.204 1.00 14.14 H new ATOM 0 HG22 THR A 110 22.355 -6.237 3.699 1.00 14.14 H new ATOM 0 HG23 THR A 110 22.519 -5.620 2.038 1.00 14.14 H new ATOM 1672 N ILE A 111 19.198 -6.003 3.829 1.00 42.32 N ATOM 1673 CA ILE A 111 18.458 -6.925 4.674 1.00 44.04 C ATOM 1674 C ILE A 111 18.466 -8.311 4.124 1.00 63.32 C ATOM 1675 O ILE A 111 18.669 -8.514 2.937 1.00 42.13 O ATOM 1676 CB ILE A 111 16.969 -6.524 4.803 1.00 21.33 C ATOM 1677 CG1 ILE A 111 16.363 -6.294 3.407 1.00 44.15 C ATOM 1678 CG2 ILE A 111 16.778 -5.325 5.719 1.00 15.15 C ATOM 1679 CD1 ILE A 111 14.879 -6.083 3.400 1.00 63.40 C ATOM 0 H ILE A 111 19.019 -6.108 2.830 1.00 42.32 H new ATOM 0 HA ILE A 111 18.958 -6.885 5.642 1.00 44.04 H new ATOM 0 HB ILE A 111 16.432 -7.347 5.274 1.00 21.33 H new ATOM 0 HG12 ILE A 111 16.843 -5.426 2.955 1.00 44.15 H new ATOM 0 HG13 ILE A 111 16.598 -7.152 2.777 1.00 44.15 H new ATOM 0 HG21 ILE A 111 15.718 -5.079 5.780 1.00 15.15 H new ATOM 0 HG22 ILE A 111 17.153 -5.564 6.714 1.00 15.15 H new ATOM 0 HG23 ILE A 111 17.326 -4.471 5.320 1.00 15.15 H new ATOM 0 HD11 ILE A 111 14.538 -5.929 2.376 1.00 63.40 H new ATOM 0 HD12 ILE A 111 14.385 -6.960 3.819 1.00 63.40 H new ATOM 0 HD13 ILE A 111 14.633 -5.207 4.000 1.00 63.40 H new ATOM 1805 N VAL A 120 20.445 -8.756 0.971 1.00 14.52 N ATOM 1806 CA VAL A 120 20.211 -8.064 -0.257 1.00 71.23 C ATOM 1807 C VAL A 120 20.374 -6.579 -0.001 1.00 61.13 C ATOM 1808 O VAL A 120 19.707 -6.009 0.880 1.00 63.21 O ATOM 1809 CB VAL A 120 18.779 -8.348 -0.800 1.00 24.02 C ATOM 1810 CG1 VAL A 120 18.540 -7.644 -2.134 1.00 53.23 C ATOM 1811 CG2 VAL A 120 18.538 -9.847 -0.937 1.00 14.21 C ATOM 0 HA VAL A 120 20.925 -8.409 -1.005 1.00 71.23 H new ATOM 0 HB VAL A 120 18.068 -7.948 -0.077 1.00 24.02 H new ATOM 0 HG11 VAL A 120 17.532 -7.863 -2.485 1.00 53.23 H new ATOM 0 HG12 VAL A 120 18.653 -6.568 -2.003 1.00 53.23 H new ATOM 0 HG13 VAL A 120 19.265 -7.998 -2.867 1.00 53.23 H new ATOM 0 HG21 VAL A 120 17.532 -10.020 -1.318 1.00 14.21 H new ATOM 0 HG22 VAL A 120 19.266 -10.271 -1.629 1.00 14.21 H new ATOM 0 HG23 VAL A 120 18.644 -10.323 0.038 1.00 14.21 H new ATOM 1821 N SER A 121 21.283 -5.982 -0.702 1.00 64.31 N ATOM 1822 CA SER A 121 21.526 -4.575 -0.593 1.00 71.32 C ATOM 1823 C SER A 121 20.631 -3.879 -1.615 1.00 71.43 C ATOM 1824 O SER A 121 20.310 -4.483 -2.658 1.00 42.14 O ATOM 1825 CB SER A 121 23.014 -4.305 -0.875 1.00 44.03 C ATOM 1826 OG SER A 121 23.396 -2.958 -0.598 1.00 14.33 O ATOM 0 H SER A 121 21.885 -6.459 -1.373 1.00 64.31 H new ATOM 0 HA SER A 121 21.299 -4.198 0.404 1.00 71.32 H new ATOM 0 HB2 SER A 121 23.621 -4.981 -0.273 1.00 44.03 H new ATOM 0 HB3 SER A 121 23.227 -4.530 -1.920 1.00 44.03 H new ATOM 0 HG SER A 121 24.349 -2.842 -0.792 1.00 14.33 H new ATOM 1832 N ASN A 122 20.190 -2.653 -1.296 1.00 23.42 N ATOM 1833 CA ASN A 122 19.313 -1.851 -2.172 1.00 53.21 C ATOM 1834 C ASN A 122 17.963 -2.581 -2.268 1.00 53.24 C ATOM 1835 O ASN A 122 17.384 -2.748 -3.340 1.00 65.20 O ATOM 1836 CB ASN A 122 19.950 -1.664 -3.589 1.00 23.34 C ATOM 1837 CG ASN A 122 19.284 -0.574 -4.434 1.00 32.34 C ATOM 1838 OD1 ASN A 122 18.865 0.470 -3.921 1.00 35.14 O ATOM 1839 ND2 ASN A 122 19.167 -0.806 -5.723 1.00 53.14 N ATOM 0 H ASN A 122 20.430 -2.186 -0.422 1.00 23.42 H new ATOM 0 HA ASN A 122 19.176 -0.853 -1.756 1.00 53.21 H new ATOM 0 HB2 ASN A 122 21.007 -1.423 -3.472 1.00 23.34 H new ATOM 0 HB3 ASN A 122 19.896 -2.610 -4.128 1.00 23.34 H new ATOM 0 HD21 ASN A 122 18.721 -0.116 -6.327 1.00 53.14 H new ATOM 0 HD22 ASN A 122 19.522 -1.676 -6.119 1.00 53.14 H new ATOM 1846 N ALA A 123 17.484 -3.030 -1.129 1.00 44.41 N ATOM 1847 CA ALA A 123 16.243 -3.775 -1.058 1.00 44.35 C ATOM 1848 C ALA A 123 15.063 -2.827 -0.884 1.00 41.33 C ATOM 1849 O ALA A 123 15.238 -1.681 -0.474 1.00 73.11 O ATOM 1850 CB ALA A 123 16.301 -4.779 0.076 1.00 71.11 C ATOM 0 H ALA A 123 17.941 -2.891 -0.228 1.00 44.41 H new ATOM 0 HA ALA A 123 16.105 -4.319 -1.992 1.00 44.35 H new ATOM 0 HB1 ALA A 123 15.363 -5.333 0.120 1.00 71.11 H new ATOM 0 HB2 ALA A 123 17.125 -5.473 -0.094 1.00 71.11 H new ATOM 0 HB3 ALA A 123 16.457 -4.255 1.019 1.00 71.11 H new ATOM 1856 N ARG A 124 13.875 -3.301 -1.190 1.00 44.41 N ATOM 1857 CA ARG A 124 12.696 -2.470 -1.109 1.00 22.52 C ATOM 1858 C ARG A 124 11.983 -2.721 0.233 1.00 52.43 C ATOM 1859 O ARG A 124 11.814 -3.877 0.642 1.00 54.40 O ATOM 1860 CB ARG A 124 11.776 -2.730 -2.331 1.00 41.30 C ATOM 1861 CG ARG A 124 11.000 -4.045 -2.314 1.00 21.22 C ATOM 1862 CD ARG A 124 10.625 -4.510 -3.718 1.00 45.51 C ATOM 1863 NE ARG A 124 10.118 -3.431 -4.586 1.00 1.44 N ATOM 1864 CZ ARG A 124 9.403 -3.624 -5.712 1.00 53.52 C ATOM 1865 NH1 ARG A 124 8.833 -4.804 -5.961 1.00 75.34 N ATOM 1866 NH2 ARG A 124 9.217 -2.612 -6.544 1.00 70.24 N ATOM 0 H ARG A 124 13.701 -4.258 -1.497 1.00 44.41 H new ATOM 0 HA ARG A 124 12.975 -1.417 -1.141 1.00 22.52 H new ATOM 0 HB2 ARG A 124 11.062 -1.910 -2.404 1.00 41.30 H new ATOM 0 HB3 ARG A 124 12.387 -2.703 -3.233 1.00 41.30 H new ATOM 0 HG2 ARG A 124 11.600 -4.813 -1.827 1.00 21.22 H new ATOM 0 HG3 ARG A 124 10.095 -3.923 -1.719 1.00 21.22 H new ATOM 0 HD2 ARG A 124 11.500 -4.961 -4.187 1.00 45.51 H new ATOM 0 HD3 ARG A 124 9.867 -5.289 -3.642 1.00 45.51 H new ATOM 0 HE ARG A 124 10.323 -2.469 -4.315 1.00 1.44 H new ATOM 0 HH11 ARG A 124 8.936 -5.571 -5.296 1.00 75.34 H new ATOM 0 HH12 ARG A 124 8.294 -4.940 -6.816 1.00 75.34 H new ATOM 0 HH21 ARG A 124 9.613 -1.697 -6.330 1.00 70.24 H new ATOM 0 HH22 ARG A 124 8.677 -2.747 -7.399 1.00 70.24 H new ATOM 1880 N PRO A 125 11.607 -1.645 0.953 1.00 65.01 N ATOM 1881 CA PRO A 125 10.943 -1.722 2.273 1.00 21.41 C ATOM 1882 C PRO A 125 9.715 -2.667 2.350 1.00 24.41 C ATOM 1883 O PRO A 125 9.437 -3.220 3.414 1.00 52.44 O ATOM 1884 CB PRO A 125 10.534 -0.281 2.541 1.00 43.21 C ATOM 1885 CG PRO A 125 11.554 0.526 1.832 1.00 44.55 C ATOM 1886 CD PRO A 125 11.860 -0.231 0.572 1.00 2.53 C ATOM 0 HA PRO A 125 11.620 -2.153 3.010 1.00 21.41 H new ATOM 0 HB2 PRO A 125 9.532 -0.075 2.165 1.00 43.21 H new ATOM 0 HB3 PRO A 125 10.525 -0.062 3.609 1.00 43.21 H new ATOM 0 HG2 PRO A 125 11.178 1.525 1.608 1.00 44.55 H new ATOM 0 HG3 PRO A 125 12.449 0.651 2.442 1.00 44.55 H new ATOM 0 HD2 PRO A 125 11.220 0.084 -0.252 1.00 2.53 H new ATOM 0 HD3 PRO A 125 12.891 -0.079 0.252 1.00 2.53 H new ATOM 1894 N VAL A 126 8.983 -2.856 1.244 1.00 75.53 N ATOM 1895 CA VAL A 126 7.846 -3.808 1.254 1.00 62.24 C ATOM 1896 C VAL A 126 8.339 -5.214 1.554 1.00 61.44 C ATOM 1897 O VAL A 126 7.764 -5.931 2.371 1.00 12.14 O ATOM 1898 CB VAL A 126 7.057 -3.862 -0.084 1.00 2.14 C ATOM 1899 CG1 VAL A 126 5.966 -4.905 -0.007 1.00 15.13 C ATOM 1900 CG2 VAL A 126 6.437 -2.545 -0.403 1.00 24.32 C ATOM 0 H VAL A 126 9.143 -2.383 0.354 1.00 75.53 H new ATOM 0 HA VAL A 126 7.172 -3.441 2.028 1.00 62.24 H new ATOM 0 HB VAL A 126 7.767 -4.119 -0.870 1.00 2.14 H new ATOM 0 HG11 VAL A 126 5.421 -4.932 -0.951 1.00 15.13 H new ATOM 0 HG12 VAL A 126 6.410 -5.882 0.184 1.00 15.13 H new ATOM 0 HG13 VAL A 126 5.279 -4.654 0.801 1.00 15.13 H new ATOM 0 HG21 VAL A 126 5.893 -2.618 -1.345 1.00 24.32 H new ATOM 0 HG22 VAL A 126 5.748 -2.265 0.394 1.00 24.32 H new ATOM 0 HG23 VAL A 126 7.216 -1.788 -0.492 1.00 24.32 H new ATOM 1910 N ASP A 127 9.440 -5.569 0.937 1.00 41.24 N ATOM 1911 CA ASP A 127 9.985 -6.902 1.077 1.00 52.54 C ATOM 1912 C ASP A 127 10.470 -7.071 2.508 1.00 31.01 C ATOM 1913 O ASP A 127 10.322 -8.130 3.111 1.00 41.14 O ATOM 1914 CB ASP A 127 11.125 -7.114 0.078 1.00 5.44 C ATOM 1915 CG ASP A 127 11.550 -8.557 -0.032 1.00 10.11 C ATOM 1916 OD1 ASP A 127 12.256 -9.041 0.833 1.00 32.34 O ATOM 1917 OD2 ASP A 127 11.180 -9.226 -1.030 1.00 11.12 O ATOM 0 H ASP A 127 9.980 -4.952 0.330 1.00 41.24 H new ATOM 0 HA ASP A 127 9.221 -7.649 0.864 1.00 52.54 H new ATOM 0 HB2 ASP A 127 10.812 -6.757 -0.903 1.00 5.44 H new ATOM 0 HB3 ASP A 127 11.981 -6.510 0.379 1.00 5.44 H new ATOM 1922 N ALA A 128 10.957 -5.968 3.063 1.00 62.41 N ATOM 1923 CA ALA A 128 11.425 -5.905 4.435 1.00 10.02 C ATOM 1924 C ALA A 128 10.291 -6.190 5.426 1.00 12.22 C ATOM 1925 O ALA A 128 10.423 -7.039 6.296 1.00 44.50 O ATOM 1926 CB ALA A 128 12.041 -4.541 4.718 1.00 43.32 C ATOM 0 H ALA A 128 11.037 -5.082 2.563 1.00 62.41 H new ATOM 0 HA ALA A 128 12.185 -6.675 4.566 1.00 10.02 H new ATOM 0 HB1 ALA A 128 12.388 -4.506 5.751 1.00 43.32 H new ATOM 0 HB2 ALA A 128 12.883 -4.376 4.046 1.00 43.32 H new ATOM 0 HB3 ALA A 128 11.293 -3.764 4.560 1.00 43.32 H new ATOM 1932 N LEU A 129 9.161 -5.510 5.272 1.00 12.14 N ATOM 1933 CA LEU A 129 8.024 -5.701 6.187 1.00 51.13 C ATOM 1934 C LEU A 129 7.450 -7.111 6.058 1.00 32.41 C ATOM 1935 O LEU A 129 7.053 -7.727 7.046 1.00 20.15 O ATOM 1936 CB LEU A 129 6.957 -4.592 5.995 1.00 71.32 C ATOM 1937 CG LEU A 129 6.279 -4.503 4.624 1.00 74.40 C ATOM 1938 CD1 LEU A 129 5.107 -5.460 4.513 1.00 62.42 C ATOM 1939 CD2 LEU A 129 5.865 -3.087 4.300 1.00 43.43 C ATOM 0 H LEU A 129 9.000 -4.826 4.532 1.00 12.14 H new ATOM 0 HA LEU A 129 8.384 -5.605 7.211 1.00 51.13 H new ATOM 0 HB2 LEU A 129 6.181 -4.736 6.747 1.00 71.32 H new ATOM 0 HB3 LEU A 129 7.428 -3.631 6.202 1.00 71.32 H new ATOM 0 HG LEU A 129 7.017 -4.807 3.882 1.00 74.40 H new ATOM 0 HD11 LEU A 129 4.653 -5.367 3.526 1.00 62.42 H new ATOM 0 HD12 LEU A 129 5.457 -6.482 4.656 1.00 62.42 H new ATOM 0 HD13 LEU A 129 4.367 -5.220 5.277 1.00 62.42 H new ATOM 0 HD21 LEU A 129 5.388 -3.063 3.320 1.00 43.43 H new ATOM 0 HD22 LEU A 129 5.163 -2.731 5.055 1.00 43.43 H new ATOM 0 HD23 LEU A 129 6.745 -2.444 4.291 1.00 43.43 H new ATOM 1951 N HIS A 130 7.491 -7.630 4.842 1.00 43.24 N ATOM 1952 CA HIS A 130 7.029 -8.980 4.527 1.00 62.14 C ATOM 1953 C HIS A 130 7.979 -10.003 5.175 1.00 71.45 C ATOM 1954 O HIS A 130 7.608 -11.148 5.463 1.00 2.51 O ATOM 1955 CB HIS A 130 7.005 -9.138 2.991 1.00 52.04 C ATOM 1956 CG HIS A 130 6.459 -10.434 2.474 1.00 30.30 C ATOM 1957 ND1 HIS A 130 5.189 -10.583 1.971 1.00 22.20 N ATOM 1958 CD2 HIS A 130 7.054 -11.641 2.342 1.00 55.21 C ATOM 1959 CE1 HIS A 130 5.056 -11.844 1.557 1.00 31.20 C ATOM 1960 NE2 HIS A 130 6.161 -12.530 1.760 1.00 75.32 N ATOM 0 H HIS A 130 7.850 -7.123 4.033 1.00 43.24 H new ATOM 0 HA HIS A 130 6.026 -9.151 4.918 1.00 62.14 H new ATOM 0 HB2 HIS A 130 6.414 -8.324 2.571 1.00 52.04 H new ATOM 0 HB3 HIS A 130 8.022 -9.020 2.617 1.00 52.04 H new ATOM 0 HD1 HIS A 130 4.474 -9.857 1.923 1.00 22.20 H new ATOM 0 HD2 HIS A 130 8.064 -11.876 2.642 1.00 55.21 H new ATOM 0 HE1 HIS A 130 4.159 -12.249 1.113 1.00 31.20 H new ATOM 1968 N ALA A 131 9.192 -9.552 5.422 1.00 13.34 N ATOM 1969 CA ALA A 131 10.225 -10.370 6.043 1.00 43.14 C ATOM 1970 C ALA A 131 10.295 -10.115 7.536 1.00 74.41 C ATOM 1971 O ALA A 131 11.214 -10.598 8.212 1.00 34.44 O ATOM 1972 CB ALA A 131 11.583 -10.093 5.416 1.00 31.12 C ATOM 0 H ALA A 131 9.495 -8.604 5.198 1.00 13.34 H new ATOM 0 HA ALA A 131 9.962 -11.414 5.876 1.00 43.14 H new ATOM 0 HB1 ALA A 131 12.339 -10.715 5.895 1.00 31.12 H new ATOM 0 HB2 ALA A 131 11.546 -10.323 4.351 1.00 31.12 H new ATOM 0 HB3 ALA A 131 11.839 -9.042 5.551 1.00 31.12 H new ATOM 1978 N HIS A 132 9.335 -9.343 8.045 1.00 45.15 N ATOM 1979 CA HIS A 132 9.252 -8.989 9.464 1.00 40.14 C ATOM 1980 C HIS A 132 10.429 -8.099 9.900 1.00 75.41 C ATOM 1981 O HIS A 132 10.818 -8.075 11.054 1.00 20.41 O ATOM 1982 CB HIS A 132 9.090 -10.241 10.362 1.00 43.13 C ATOM 1983 CG HIS A 132 7.749 -10.926 10.222 1.00 62.15 C ATOM 1984 ND1 HIS A 132 7.546 -12.138 9.579 1.00 60.10 N ATOM 1985 CD2 HIS A 132 6.531 -10.545 10.686 1.00 51.32 C ATOM 1986 CE1 HIS A 132 6.247 -12.443 9.671 1.00 0.14 C ATOM 1987 NE2 HIS A 132 5.581 -11.505 10.338 1.00 43.43 N ATOM 0 H HIS A 132 8.586 -8.942 7.480 1.00 45.15 H new ATOM 0 HA HIS A 132 8.348 -8.395 9.597 1.00 40.14 H new ATOM 0 HB2 HIS A 132 9.878 -10.954 10.120 1.00 43.13 H new ATOM 0 HB3 HIS A 132 9.232 -9.950 11.403 1.00 43.13 H new ATOM 0 HD2 HIS A 132 6.329 -9.639 11.239 1.00 51.32 H new ATOM 0 HE1 HIS A 132 5.798 -13.334 9.258 1.00 0.14 H new ATOM 0 HE2 HIS A 132 4.584 -11.491 10.551 1.00 43.43 H new ATOM 1995 N GLN A 133 10.934 -7.322 8.955 1.00 15.12 N ATOM 1996 CA GLN A 133 11.991 -6.320 9.177 1.00 32.54 C ATOM 1997 C GLN A 133 11.302 -4.946 9.247 1.00 15.23 C ATOM 1998 O GLN A 133 11.909 -3.889 9.036 1.00 55.35 O ATOM 1999 CB GLN A 133 12.985 -6.335 7.990 1.00 63.43 C ATOM 2000 CG GLN A 133 13.683 -7.676 7.734 1.00 54.43 C ATOM 2001 CD GLN A 133 14.724 -8.037 8.777 1.00 64.50 C ATOM 2002 OE1 GLN A 133 14.635 -7.642 9.929 1.00 73.23 O ATOM 2003 NE2 GLN A 133 15.688 -8.819 8.388 1.00 3.13 N ATOM 0 H GLN A 133 10.620 -7.363 7.985 1.00 15.12 H new ATOM 0 HA GLN A 133 12.541 -6.534 10.093 1.00 32.54 H new ATOM 0 HB2 GLN A 133 12.450 -6.045 7.086 1.00 63.43 H new ATOM 0 HB3 GLN A 133 13.747 -5.576 8.167 1.00 63.43 H new ATOM 0 HG2 GLN A 133 12.931 -8.464 7.697 1.00 54.43 H new ATOM 0 HG3 GLN A 133 14.160 -7.645 6.754 1.00 54.43 H new ATOM 0 HE21 GLN A 133 15.732 -9.130 7.418 1.00 3.13 H new ATOM 0 HE22 GLN A 133 16.400 -9.121 9.053 1.00 3.13 H new ATOM 2012 N ALA A 134 10.019 -5.006 9.573 1.00 75.41 N ATOM 2013 CA ALA A 134 9.094 -3.879 9.573 1.00 12.12 C ATOM 2014 C ALA A 134 9.541 -2.687 10.426 1.00 74.14 C ATOM 2015 O ALA A 134 9.227 -1.551 10.092 1.00 24.41 O ATOM 2016 CB ALA A 134 7.720 -4.350 9.997 1.00 65.51 C ATOM 0 H ALA A 134 9.574 -5.879 9.857 1.00 75.41 H new ATOM 0 HA ALA A 134 9.072 -3.504 8.550 1.00 12.12 H new ATOM 0 HB1 ALA A 134 7.030 -3.506 9.996 1.00 65.51 H new ATOM 0 HB2 ALA A 134 7.365 -5.110 9.301 1.00 65.51 H new ATOM 0 HB3 ALA A 134 7.774 -4.774 11.000 1.00 65.51 H new ATOM 2022 N ARG A 135 10.284 -2.936 11.495 1.00 32.23 N ATOM 2023 CA ARG A 135 10.761 -1.856 12.383 1.00 25.13 C ATOM 2024 C ARG A 135 11.566 -0.814 11.614 1.00 42.01 C ATOM 2025 O ARG A 135 11.374 0.403 11.790 1.00 4.23 O ATOM 2026 CB ARG A 135 11.609 -2.422 13.502 1.00 0.13 C ATOM 2027 CG ARG A 135 10.844 -3.261 14.498 1.00 25.35 C ATOM 2028 CD ARG A 135 11.801 -4.018 15.385 1.00 22.34 C ATOM 2029 NE ARG A 135 12.664 -4.906 14.587 1.00 45.21 N ATOM 2030 CZ ARG A 135 13.880 -5.334 14.942 1.00 54.23 C ATOM 2031 NH1 ARG A 135 14.376 -5.038 16.136 1.00 2.04 N ATOM 2032 NH2 ARG A 135 14.592 -6.062 14.102 1.00 30.10 N ATOM 0 H ARG A 135 10.576 -3.872 11.778 1.00 32.23 H new ATOM 0 HA ARG A 135 9.881 -1.371 12.804 1.00 25.13 H new ATOM 0 HB2 ARG A 135 12.404 -3.029 13.068 1.00 0.13 H new ATOM 0 HB3 ARG A 135 12.089 -1.598 14.031 1.00 0.13 H new ATOM 0 HG2 ARG A 135 10.202 -2.623 15.105 1.00 25.35 H new ATOM 0 HG3 ARG A 135 10.194 -3.960 13.972 1.00 25.35 H new ATOM 0 HD2 ARG A 135 12.416 -3.315 15.947 1.00 22.34 H new ATOM 0 HD3 ARG A 135 11.242 -4.605 16.113 1.00 22.34 H new ATOM 0 HE ARG A 135 12.303 -5.221 13.687 1.00 45.21 H new ATOM 0 HH11 ARG A 135 13.829 -4.480 16.791 1.00 2.04 H new ATOM 0 HH12 ARG A 135 15.304 -5.369 16.399 1.00 2.04 H new ATOM 0 HH21 ARG A 135 14.214 -6.297 13.184 1.00 30.10 H new ATOM 0 HH22 ARG A 135 15.520 -6.389 14.371 1.00 30.10 H new ATOM 2046 N GLU A 136 12.426 -1.287 10.744 1.00 73.24 N ATOM 2047 CA GLU A 136 13.269 -0.426 9.946 1.00 24.32 C ATOM 2048 C GLU A 136 12.456 0.268 8.851 1.00 41.01 C ATOM 2049 O GLU A 136 12.780 1.377 8.424 1.00 21.00 O ATOM 2050 CB GLU A 136 14.447 -1.222 9.405 1.00 13.13 C ATOM 2051 CG GLU A 136 15.312 -1.766 10.534 1.00 73.43 C ATOM 2052 CD GLU A 136 16.420 -2.665 10.076 1.00 35.33 C ATOM 2053 OE1 GLU A 136 17.475 -2.164 9.639 1.00 12.15 O ATOM 2054 OE2 GLU A 136 16.281 -3.895 10.185 1.00 43.24 O ATOM 0 H GLU A 136 12.562 -2.282 10.568 1.00 73.24 H new ATOM 0 HA GLU A 136 13.676 0.371 10.568 1.00 24.32 H new ATOM 0 HB2 GLU A 136 14.081 -2.047 8.794 1.00 13.13 H new ATOM 0 HB3 GLU A 136 15.050 -0.587 8.755 1.00 13.13 H new ATOM 0 HG2 GLU A 136 15.742 -0.929 11.084 1.00 73.43 H new ATOM 0 HG3 GLU A 136 14.678 -2.314 11.231 1.00 73.43 H new ATOM 2061 N VAL A 137 11.367 -0.365 8.451 1.00 5.22 N ATOM 2062 CA VAL A 137 10.445 0.216 7.481 1.00 51.32 C ATOM 2063 C VAL A 137 9.735 1.400 8.131 1.00 64.33 C ATOM 2064 O VAL A 137 9.588 2.465 7.529 1.00 40.32 O ATOM 2065 CB VAL A 137 9.396 -0.822 6.993 1.00 2.12 C ATOM 2066 CG1 VAL A 137 8.422 -0.205 5.998 1.00 71.50 C ATOM 2067 CG2 VAL A 137 10.086 -2.021 6.378 1.00 75.24 C ATOM 0 H VAL A 137 11.095 -1.290 8.784 1.00 5.22 H new ATOM 0 HA VAL A 137 11.015 0.541 6.610 1.00 51.32 H new ATOM 0 HB VAL A 137 8.824 -1.149 7.861 1.00 2.12 H new ATOM 0 HG11 VAL A 137 7.703 -0.959 5.678 1.00 71.50 H new ATOM 0 HG12 VAL A 137 7.894 0.623 6.471 1.00 71.50 H new ATOM 0 HG13 VAL A 137 8.971 0.163 5.132 1.00 71.50 H new ATOM 0 HG21 VAL A 137 9.338 -2.738 6.041 1.00 75.24 H new ATOM 0 HG22 VAL A 137 10.687 -1.698 5.528 1.00 75.24 H new ATOM 0 HG23 VAL A 137 10.730 -2.491 7.121 1.00 75.24 H new ATOM 2077 N VAL A 138 9.342 1.208 9.385 1.00 43.31 N ATOM 2078 CA VAL A 138 8.720 2.254 10.183 1.00 51.52 C ATOM 2079 C VAL A 138 9.676 3.442 10.322 1.00 25.52 C ATOM 2080 O VAL A 138 9.270 4.582 10.201 1.00 73.13 O ATOM 2081 CB VAL A 138 8.287 1.738 11.591 1.00 31.31 C ATOM 2082 CG1 VAL A 138 7.695 2.865 12.439 1.00 13.00 C ATOM 2083 CG2 VAL A 138 7.275 0.609 11.459 1.00 64.34 C ATOM 0 H VAL A 138 9.447 0.320 9.876 1.00 43.31 H new ATOM 0 HA VAL A 138 7.816 2.573 9.664 1.00 51.52 H new ATOM 0 HB VAL A 138 9.180 1.363 12.092 1.00 31.31 H new ATOM 0 HG11 VAL A 138 7.403 2.473 13.413 1.00 13.00 H new ATOM 0 HG12 VAL A 138 8.440 3.650 12.572 1.00 13.00 H new ATOM 0 HG13 VAL A 138 6.819 3.277 11.937 1.00 13.00 H new ATOM 0 HG21 VAL A 138 6.985 0.262 12.451 1.00 64.34 H new ATOM 0 HG22 VAL A 138 6.394 0.970 10.929 1.00 64.34 H new ATOM 0 HG23 VAL A 138 7.720 -0.216 10.902 1.00 64.34 H new ATOM 2093 N ARG A 139 10.951 3.149 10.548 1.00 62.23 N ATOM 2094 CA ARG A 139 11.982 4.183 10.680 1.00 24.10 C ATOM 2095 C ARG A 139 12.079 5.009 9.375 1.00 21.01 C ATOM 2096 O ARG A 139 12.200 6.235 9.400 1.00 53.13 O ATOM 2097 CB ARG A 139 13.330 3.530 10.998 1.00 11.33 C ATOM 2098 CG ARG A 139 14.438 4.505 11.353 1.00 53.32 C ATOM 2099 CD ARG A 139 15.747 3.773 11.577 1.00 22.12 C ATOM 2100 NE ARG A 139 16.804 4.654 12.086 1.00 3.13 N ATOM 2101 CZ ARG A 139 18.056 4.272 12.356 1.00 74.41 C ATOM 2102 NH1 ARG A 139 18.468 3.051 12.032 1.00 22.23 N ATOM 2103 NH2 ARG A 139 18.903 5.133 12.911 1.00 34.43 N ATOM 0 H ARG A 139 11.302 2.196 10.645 1.00 62.23 H new ATOM 0 HA ARG A 139 11.713 4.855 11.495 1.00 24.10 H new ATOM 0 HB2 ARG A 139 13.196 2.836 11.828 1.00 11.33 H new ATOM 0 HB3 ARG A 139 13.645 2.941 10.137 1.00 11.33 H new ATOM 0 HG2 ARG A 139 14.557 5.235 10.552 1.00 53.32 H new ATOM 0 HG3 ARG A 139 14.167 5.059 12.252 1.00 53.32 H new ATOM 0 HD2 ARG A 139 15.587 2.958 12.282 1.00 22.12 H new ATOM 0 HD3 ARG A 139 16.073 3.324 10.639 1.00 22.12 H new ATOM 0 HE ARG A 139 16.565 5.633 12.246 1.00 3.13 H new ATOM 0 HH11 ARG A 139 17.828 2.401 11.575 1.00 22.23 H new ATOM 0 HH12 ARG A 139 19.424 2.764 12.240 1.00 22.23 H new ATOM 0 HH21 ARG A 139 18.597 6.081 13.129 1.00 34.43 H new ATOM 0 HH22 ARG A 139 19.859 4.846 13.119 1.00 34.43 H new ATOM 2117 N ARG A 140 11.982 4.316 8.248 1.00 54.42 N ATOM 2118 CA ARG A 140 12.020 4.934 6.920 1.00 64.21 C ATOM 2119 C ARG A 140 10.764 5.833 6.760 1.00 72.50 C ATOM 2120 O ARG A 140 10.828 6.967 6.244 1.00 64.42 O ATOM 2121 CB ARG A 140 12.023 3.804 5.867 1.00 25.30 C ATOM 2122 CG ARG A 140 12.956 3.991 4.668 1.00 62.24 C ATOM 2123 CD ARG A 140 12.589 5.168 3.789 1.00 63.11 C ATOM 2124 NE ARG A 140 13.465 5.235 2.613 1.00 74.44 N ATOM 2125 CZ ARG A 140 13.288 6.003 1.539 1.00 32.11 C ATOM 2126 NH1 ARG A 140 12.314 6.902 1.499 1.00 5.13 N ATOM 2127 NH2 ARG A 140 14.140 5.896 0.522 1.00 2.41 N ATOM 0 H ARG A 140 11.874 3.302 8.225 1.00 54.42 H new ATOM 0 HA ARG A 140 12.911 5.548 6.790 1.00 64.21 H new ATOM 0 HB2 ARG A 140 12.291 2.873 6.366 1.00 25.30 H new ATOM 0 HB3 ARG A 140 11.006 3.683 5.493 1.00 25.30 H new ATOM 0 HG2 ARG A 140 13.976 4.123 5.030 1.00 62.24 H new ATOM 0 HG3 ARG A 140 12.946 3.082 4.066 1.00 62.24 H new ATOM 0 HD2 ARG A 140 11.551 5.079 3.470 1.00 63.11 H new ATOM 0 HD3 ARG A 140 12.669 6.093 4.360 1.00 63.11 H new ATOM 0 HE ARG A 140 14.290 4.635 2.619 1.00 74.44 H new ATOM 0 HH11 ARG A 140 11.689 7.012 2.297 1.00 5.13 H new ATOM 0 HH12 ARG A 140 12.190 7.483 0.670 1.00 5.13 H new ATOM 0 HH21 ARG A 140 14.914 5.233 0.573 1.00 2.41 H new ATOM 0 HH22 ARG A 140 14.019 6.477 -0.308 1.00 2.41 H new ATOM 2141 N ALA A 141 9.646 5.319 7.239 1.00 72.42 N ATOM 2142 CA ALA A 141 8.365 6.014 7.231 1.00 65.42 C ATOM 2143 C ALA A 141 8.441 7.290 8.072 1.00 73.22 C ATOM 2144 O ALA A 141 7.971 8.354 7.650 1.00 50.25 O ATOM 2145 CB ALA A 141 7.292 5.093 7.774 1.00 54.13 C ATOM 0 H ALA A 141 9.599 4.388 7.654 1.00 72.42 H new ATOM 0 HA ALA A 141 8.118 6.295 6.207 1.00 65.42 H new ATOM 0 HB1 ALA A 141 6.332 5.610 7.769 1.00 54.13 H new ATOM 0 HB2 ALA A 141 7.227 4.202 7.150 1.00 54.13 H new ATOM 0 HB3 ALA A 141 7.543 4.803 8.794 1.00 54.13 H new ATOM 2151 N GLN A 142 9.037 7.173 9.257 1.00 32.52 N ATOM 2152 CA GLN A 142 9.266 8.307 10.165 1.00 32.13 C ATOM 2153 C GLN A 142 10.079 9.390 9.473 1.00 1.32 C ATOM 2154 O GLN A 142 9.860 10.585 9.692 1.00 32.22 O ATOM 2155 CB GLN A 142 10.038 7.858 11.407 1.00 35.03 C ATOM 2156 CG GLN A 142 9.323 6.860 12.297 1.00 72.42 C ATOM 2157 CD GLN A 142 10.225 6.355 13.406 1.00 24.01 C ATOM 2158 OE1 GLN A 142 11.446 6.269 13.246 1.00 0.13 O ATOM 2159 NE2 GLN A 142 9.650 6.007 14.522 1.00 73.32 N ATOM 0 H GLN A 142 9.379 6.284 9.621 1.00 32.52 H new ATOM 0 HA GLN A 142 8.290 8.697 10.453 1.00 32.13 H new ATOM 0 HB2 GLN A 142 10.983 7.420 11.087 1.00 35.03 H new ATOM 0 HB3 GLN A 142 10.280 8.739 12.001 1.00 35.03 H new ATOM 0 HG2 GLN A 142 8.439 7.327 12.731 1.00 72.42 H new ATOM 0 HG3 GLN A 142 8.977 6.018 11.697 1.00 72.42 H new ATOM 0 HE21 GLN A 142 8.638 6.090 14.622 1.00 73.32 H new ATOM 0 HE22 GLN A 142 10.211 5.651 15.296 1.00 73.32 H new ATOM 2168 N ALA A 143 11.015 8.967 8.638 1.00 60.41 N ATOM 2169 CA ALA A 143 11.862 9.880 7.903 1.00 33.44 C ATOM 2170 C ALA A 143 11.048 10.705 6.903 1.00 65.31 C ATOM 2171 O ALA A 143 11.346 11.863 6.654 1.00 4.42 O ATOM 2172 CB ALA A 143 12.995 9.131 7.218 1.00 33.12 C ATOM 0 H ALA A 143 11.205 7.982 8.454 1.00 60.41 H new ATOM 0 HA ALA A 143 12.306 10.577 8.613 1.00 33.44 H new ATOM 0 HB1 ALA A 143 13.620 9.837 6.671 1.00 33.12 H new ATOM 0 HB2 ALA A 143 13.598 8.618 7.968 1.00 33.12 H new ATOM 0 HB3 ALA A 143 12.581 8.400 6.524 1.00 33.12 H new ATOM 2178 N MET A 144 10.020 10.109 6.329 1.00 32.21 N ATOM 2179 CA MET A 144 9.147 10.869 5.439 1.00 13.15 C ATOM 2180 C MET A 144 8.112 11.708 6.202 1.00 64.20 C ATOM 2181 O MET A 144 7.921 12.895 5.903 1.00 74.21 O ATOM 2182 CB MET A 144 8.472 9.993 4.350 1.00 20.50 C ATOM 2183 CG MET A 144 7.313 10.709 3.640 1.00 1.43 C ATOM 2184 SD MET A 144 6.752 9.951 2.107 1.00 53.42 S ATOM 2185 CE MET A 144 8.194 10.207 1.064 1.00 72.41 C ATOM 0 H MET A 144 9.769 9.128 6.454 1.00 32.21 H new ATOM 0 HA MET A 144 9.806 11.563 4.917 1.00 13.15 H new ATOM 0 HB2 MET A 144 9.219 9.701 3.612 1.00 20.50 H new ATOM 0 HB3 MET A 144 8.100 9.076 4.807 1.00 20.50 H new ATOM 0 HG2 MET A 144 6.469 10.764 4.327 1.00 1.43 H new ATOM 0 HG3 MET A 144 7.618 11.733 3.427 1.00 1.43 H new ATOM 0 HE1 MET A 144 7.919 10.058 0.020 1.00 72.41 H new ATOM 0 HE2 MET A 144 8.566 11.223 1.200 1.00 72.41 H new ATOM 0 HE3 MET A 144 8.973 9.496 1.339 1.00 72.41 H new ATOM 2195 N ALA A 145 7.474 11.121 7.192 1.00 13.23 N ATOM 2196 CA ALA A 145 6.384 11.797 7.890 1.00 64.34 C ATOM 2197 C ALA A 145 6.831 12.968 8.748 1.00 74.12 C ATOM 2198 O ALA A 145 6.104 13.965 8.869 1.00 52.10 O ATOM 2199 CB ALA A 145 5.572 10.838 8.706 1.00 14.34 C ATOM 0 H ALA A 145 7.684 10.184 7.535 1.00 13.23 H new ATOM 0 HA ALA A 145 5.759 12.213 7.099 1.00 64.34 H new ATOM 0 HB1 ALA A 145 4.771 11.378 9.211 1.00 14.34 H new ATOM 0 HB2 ALA A 145 5.143 10.078 8.053 1.00 14.34 H new ATOM 0 HB3 ALA A 145 6.211 10.360 9.448 1.00 14.34 H new ATOM 2205 N TYR A 146 7.988 12.860 9.341 1.00 41.05 N ATOM 2206 CA TYR A 146 8.476 13.909 10.195 1.00 70.55 C ATOM 2207 C TYR A 146 9.538 14.694 9.462 1.00 40.23 C ATOM 2208 O TYR A 146 10.738 14.381 9.607 1.00 38.67 O ATOM 2209 CB TYR A 146 9.032 13.334 11.505 1.00 23.20 C ATOM 2210 CG TYR A 146 8.026 12.549 12.330 1.00 13.33 C ATOM 2211 CD1 TYR A 146 7.847 11.185 12.132 1.00 53.11 C ATOM 2212 CD2 TYR A 146 7.264 13.170 13.305 1.00 10.15 C ATOM 2213 CE1 TYR A 146 6.938 10.467 12.876 1.00 5.03 C ATOM 2214 CE2 TYR A 146 6.351 12.458 14.057 1.00 41.14 C ATOM 2215 CZ TYR A 146 6.193 11.106 13.839 1.00 54.14 C ATOM 2216 OH TYR A 146 5.278 10.392 14.585 1.00 34.13 O ATOM 2217 OXT TYR A 146 9.183 15.602 8.683 1.00 38.67 O ATOM 0 H TYR A 146 8.611 12.057 9.249 1.00 41.05 H new ATOM 0 HA TYR A 146 7.651 14.573 10.452 1.00 70.55 H new ATOM 0 HB2 TYR A 146 9.876 12.685 11.272 1.00 23.20 H new ATOM 0 HB3 TYR A 146 9.418 14.154 12.111 1.00 23.20 H new ATOM 0 HD1 TYR A 146 8.433 10.678 11.379 1.00 53.11 H new ATOM 0 HD2 TYR A 146 7.386 14.229 13.480 1.00 10.15 H new ATOM 0 HE1 TYR A 146 6.811 9.408 12.704 1.00 5.03 H new ATOM 0 HE2 TYR A 146 5.763 12.958 14.813 1.00 41.14 H new ATOM 0 HH TYR A 146 4.836 10.992 15.222 1.00 34.13 H new