USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 940 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 110 THR OG1 : rot 180:sc= 1.03 USER MOD Set 1.2: A 121 SER OG : rot 59:sc= 1.21 USER MOD Set 2.1: A 30 TYR OH : rot 102:sc= 0.0142 USER MOD Set 2.2: A 68 GLN : amide:sc= -0.0201 K(o=-0.0059,f=-1.3) USER MOD Set 3.1: A 49 GLN : amide:sc= -0.576 K(o=-0.05,f=-2) USER MOD Set 3.2: A 54 HIS : no HE2:sc= 0.525 K(o=-0.05,f=-4.7!) USER MOD Single : A 29 THR OG1 : rot -80:sc= 0.201 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN :FLIP amide:sc= -0.0999 F(o=-0.72,f=-0.1) USER MOD Single : A 72 THR OG1 : rot -61:sc= 0.891 USER MOD Single : A 73 ASN : amide:sc= -0.13 X(o=-0.13,f=-0.0068) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0.644 K(o=0.64,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 139:sc= -0.426 (180deg=-2.18!) USER MOD Single : A 80 SER OG : rot -39:sc= 0.356 USER MOD Single : A 86 THR OG1 : rot 57:sc= 1.22 USER MOD Single : A 89 HIS :FLIP no HE2:sc= -0.563 F(o=-1.6,f=-0.56) USER MOD Single : A 93 TYR OH : rot 100:sc= 1.31 USER MOD Single : A 96 THR OG1 : rot -78:sc= 1.21 USER MOD Single : A 99 MET CE :methyl 154:sc= -0.471 (180deg=-1.24) USER MOD Single : A 104 THR OG1 : rot 84:sc= 1.23 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.0417 K(o=-0.042,f=-1.8!) USER MOD Single : A 130 HIS : no HE2:sc= -0.524 K(o=-0.52,f=-2.4!) USER MOD Single : A 132 HIS : no HD1:sc= -0.322 X(o=-0.32,f=-0.34) USER MOD Single : A 133 GLN : amide:sc= -0.0629 K(o=-0.063,f=-1.1) USER MOD Single : A 142 GLN : amide:sc= -1.58! C(o=-1.6!,f=-4.1!) USER MOD Single : A 144 MET CE :methyl -166:sc= -0.0356 (180deg=-0.284) USER MOD Single : A 146 TYR OH : rot 27:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 239 N ALA A 18 -7.758 5.385 -3.962 1.00 42.42 N ATOM 240 CA ALA A 18 -6.697 4.759 -4.715 1.00 64.13 C ATOM 241 C ALA A 18 -6.318 5.634 -5.896 1.00 3.03 C ATOM 242 O ALA A 18 -7.194 6.076 -6.664 1.00 52.32 O ATOM 243 CB ALA A 18 -7.131 3.383 -5.181 1.00 53.24 C ATOM 0 HA ALA A 18 -5.822 4.643 -4.075 1.00 64.13 H new ATOM 0 HB1 ALA A 18 -6.324 2.919 -5.748 1.00 53.24 H new ATOM 0 HB2 ALA A 18 -7.369 2.764 -4.316 1.00 53.24 H new ATOM 0 HB3 ALA A 18 -8.013 3.475 -5.815 1.00 53.24 H new ATOM 249 N GLY A 19 -5.056 5.919 -6.029 1.00 63.42 N ATOM 250 CA GLY A 19 -4.602 6.758 -7.090 1.00 4.20 C ATOM 251 C GLY A 19 -3.718 6.039 -8.064 1.00 45.43 C ATOM 252 O GLY A 19 -4.171 5.131 -8.772 1.00 55.12 O ATOM 0 H GLY A 19 -4.321 5.578 -5.409 1.00 63.42 H new ATOM 0 HA2 GLY A 19 -5.464 7.164 -7.620 1.00 4.20 H new ATOM 0 HA3 GLY A 19 -4.059 7.605 -6.670 1.00 4.20 H new ATOM 256 N ASP A 20 -2.459 6.409 -8.085 1.00 61.12 N ATOM 257 CA ASP A 20 -1.524 5.886 -9.056 1.00 42.30 C ATOM 258 C ASP A 20 -0.763 4.712 -8.489 1.00 21.25 C ATOM 259 O ASP A 20 -0.218 4.788 -7.379 1.00 61.31 O ATOM 260 CB ASP A 20 -0.569 6.997 -9.517 1.00 15.14 C ATOM 261 CG ASP A 20 0.482 6.541 -10.509 1.00 63.41 C ATOM 262 OD1 ASP A 20 0.137 5.892 -11.516 1.00 73.31 O ATOM 263 OD2 ASP A 20 1.679 6.897 -10.329 1.00 41.31 O ATOM 0 H ASP A 20 -2.054 7.079 -7.432 1.00 61.12 H new ATOM 0 HA ASP A 20 -2.080 5.529 -9.923 1.00 42.30 H new ATOM 0 HB2 ASP A 20 -1.153 7.799 -9.967 1.00 15.14 H new ATOM 0 HB3 ASP A 20 -0.070 7.417 -8.644 1.00 15.14 H new ATOM 268 N ASP A 21 -0.772 3.628 -9.228 1.00 22.12 N ATOM 269 CA ASP A 21 -0.078 2.401 -8.850 1.00 5.23 C ATOM 270 C ASP A 21 1.424 2.566 -8.936 1.00 33.43 C ATOM 271 O ASP A 21 1.947 3.185 -9.873 1.00 31.42 O ATOM 272 CB ASP A 21 -0.570 1.218 -9.696 1.00 73.14 C ATOM 273 CG ASP A 21 0.264 -0.031 -9.551 1.00 30.25 C ATOM 274 OD1 ASP A 21 0.655 -0.372 -8.419 1.00 33.41 O ATOM 275 OD2 ASP A 21 0.587 -0.643 -10.591 1.00 3.20 O ATOM 0 H ASP A 21 -1.264 3.564 -10.119 1.00 22.12 H new ATOM 0 HA ASP A 21 -0.314 2.186 -7.808 1.00 5.23 H new ATOM 0 HB2 ASP A 21 -1.599 0.989 -9.418 1.00 73.14 H new ATOM 0 HB3 ASP A 21 -0.581 1.515 -10.745 1.00 73.14 H new ATOM 280 N VAL A 22 2.101 2.024 -7.958 1.00 34.33 N ATOM 281 CA VAL A 22 3.534 2.146 -7.831 1.00 23.34 C ATOM 282 C VAL A 22 4.218 0.883 -8.393 1.00 13.43 C ATOM 283 O VAL A 22 5.439 0.849 -8.617 1.00 44.05 O ATOM 284 CB VAL A 22 3.926 2.414 -6.339 1.00 70.20 C ATOM 285 CG1 VAL A 22 5.428 2.623 -6.165 1.00 34.55 C ATOM 286 CG2 VAL A 22 3.168 3.632 -5.813 1.00 53.14 C ATOM 0 H VAL A 22 1.668 1.476 -7.214 1.00 34.33 H new ATOM 0 HA VAL A 22 3.882 2.999 -8.414 1.00 23.34 H new ATOM 0 HB VAL A 22 3.650 1.529 -5.765 1.00 70.20 H new ATOM 0 HG11 VAL A 22 5.651 2.805 -5.114 1.00 34.55 H new ATOM 0 HG12 VAL A 22 5.960 1.733 -6.500 1.00 34.55 H new ATOM 0 HG13 VAL A 22 5.747 3.481 -6.757 1.00 34.55 H new ATOM 0 HG21 VAL A 22 3.445 3.813 -4.775 1.00 53.14 H new ATOM 0 HG22 VAL A 22 3.421 4.506 -6.414 1.00 53.14 H new ATOM 0 HG23 VAL A 22 2.095 3.448 -5.875 1.00 53.14 H new ATOM 296 N LEU A 23 3.426 -0.128 -8.651 1.00 23.12 N ATOM 297 CA LEU A 23 3.894 -1.354 -9.258 1.00 14.21 C ATOM 298 C LEU A 23 3.815 -1.234 -10.776 1.00 63.14 C ATOM 299 O LEU A 23 3.663 -0.131 -11.342 1.00 43.23 O ATOM 300 CB LEU A 23 2.998 -2.531 -8.825 1.00 14.30 C ATOM 301 CG LEU A 23 3.158 -3.076 -7.411 1.00 33.43 C ATOM 302 CD1 LEU A 23 2.018 -4.021 -7.115 1.00 70.15 C ATOM 303 CD2 LEU A 23 4.457 -3.840 -7.312 1.00 61.44 C ATOM 0 H LEU A 23 2.427 -0.125 -8.444 1.00 23.12 H new ATOM 0 HA LEU A 23 4.922 -1.529 -8.941 1.00 14.21 H new ATOM 0 HB2 LEU A 23 1.960 -2.222 -8.947 1.00 14.30 H new ATOM 0 HB3 LEU A 23 3.169 -3.353 -9.520 1.00 14.30 H new ATOM 0 HG LEU A 23 3.158 -2.250 -6.700 1.00 33.43 H new ATOM 0 HD11 LEU A 23 2.125 -4.415 -6.105 1.00 70.15 H new ATOM 0 HD12 LEU A 23 1.072 -3.486 -7.197 1.00 70.15 H new ATOM 0 HD13 LEU A 23 2.033 -4.844 -7.829 1.00 70.15 H new ATOM 0 HD21 LEU A 23 4.573 -4.231 -6.301 1.00 61.44 H new ATOM 0 HD22 LEU A 23 4.448 -4.667 -8.022 1.00 61.44 H new ATOM 0 HD23 LEU A 23 5.289 -3.174 -7.542 1.00 61.44 H new ATOM 315 N ASP A 24 4.010 -2.331 -11.426 1.00 4.31 N ATOM 316 CA ASP A 24 3.751 -2.440 -12.823 1.00 43.35 C ATOM 317 C ASP A 24 2.476 -3.246 -12.945 1.00 5.55 C ATOM 318 O ASP A 24 2.318 -4.214 -12.203 1.00 35.51 O ATOM 319 CB ASP A 24 4.906 -3.130 -13.547 1.00 1.44 C ATOM 320 CG ASP A 24 4.634 -3.306 -15.013 1.00 50.01 C ATOM 321 OD1 ASP A 24 4.741 -2.312 -15.774 1.00 71.41 O ATOM 322 OD2 ASP A 24 4.322 -4.439 -15.441 1.00 42.44 O ATOM 0 H ASP A 24 4.358 -3.189 -10.997 1.00 4.31 H new ATOM 0 HA ASP A 24 3.648 -1.458 -13.284 1.00 43.35 H new ATOM 0 HB2 ASP A 24 5.816 -2.544 -13.416 1.00 1.44 H new ATOM 0 HB3 ASP A 24 5.086 -4.105 -13.093 1.00 1.44 H new ATOM 327 N PRO A 25 1.542 -2.878 -13.845 1.00 72.15 N ATOM 328 CA PRO A 25 0.242 -3.564 -13.980 1.00 14.51 C ATOM 329 C PRO A 25 0.324 -5.095 -14.112 1.00 15.10 C ATOM 330 O PRO A 25 -0.605 -5.795 -13.724 1.00 43.10 O ATOM 331 CB PRO A 25 -0.343 -2.959 -15.251 1.00 52.31 C ATOM 332 CG PRO A 25 0.244 -1.600 -15.313 1.00 72.43 C ATOM 333 CD PRO A 25 1.639 -1.734 -14.779 1.00 40.42 C ATOM 0 HA PRO A 25 -0.356 -3.419 -13.080 1.00 14.51 H new ATOM 0 HB2 PRO A 25 -0.078 -3.547 -16.130 1.00 52.31 H new ATOM 0 HB3 PRO A 25 -1.432 -2.921 -15.209 1.00 52.31 H new ATOM 0 HG2 PRO A 25 0.251 -1.223 -16.336 1.00 72.43 H new ATOM 0 HG3 PRO A 25 -0.337 -0.895 -14.718 1.00 72.43 H new ATOM 0 HD2 PRO A 25 2.357 -1.926 -15.576 1.00 40.42 H new ATOM 0 HD3 PRO A 25 1.963 -0.826 -14.270 1.00 40.42 H new ATOM 341 N ASP A 26 1.437 -5.612 -14.613 1.00 1.42 N ATOM 342 CA ASP A 26 1.568 -7.055 -14.817 1.00 74.12 C ATOM 343 C ASP A 26 2.098 -7.777 -13.558 1.00 63.54 C ATOM 344 O ASP A 26 2.180 -9.009 -13.519 1.00 44.12 O ATOM 345 CB ASP A 26 2.450 -7.355 -16.047 1.00 24.24 C ATOM 346 CG ASP A 26 2.542 -8.837 -16.385 1.00 53.54 C ATOM 347 OD1 ASP A 26 1.527 -9.433 -16.823 1.00 73.44 O ATOM 348 OD2 ASP A 26 3.633 -9.436 -16.226 1.00 45.11 O ATOM 0 H ASP A 26 2.255 -5.066 -14.884 1.00 1.42 H new ATOM 0 HA ASP A 26 0.569 -7.448 -15.007 1.00 74.12 H new ATOM 0 HB2 ASP A 26 2.052 -6.819 -16.908 1.00 24.24 H new ATOM 0 HB3 ASP A 26 3.453 -6.969 -15.867 1.00 24.24 H new ATOM 353 N GLU A 27 2.431 -7.028 -12.520 1.00 43.44 N ATOM 354 CA GLU A 27 2.926 -7.647 -11.302 1.00 13.40 C ATOM 355 C GLU A 27 1.791 -8.310 -10.527 1.00 52.45 C ATOM 356 O GLU A 27 0.632 -7.844 -10.582 1.00 4.34 O ATOM 357 CB GLU A 27 3.693 -6.654 -10.420 1.00 61.24 C ATOM 358 CG GLU A 27 4.977 -6.155 -11.050 1.00 50.52 C ATOM 359 CD GLU A 27 5.901 -7.287 -11.443 1.00 12.04 C ATOM 360 OE1 GLU A 27 6.619 -7.830 -10.572 1.00 20.14 O ATOM 361 OE2 GLU A 27 5.925 -7.663 -12.634 1.00 64.51 O ATOM 0 H GLU A 27 2.370 -6.010 -12.494 1.00 43.44 H new ATOM 0 HA GLU A 27 3.634 -8.421 -11.599 1.00 13.40 H new ATOM 0 HB2 GLU A 27 3.050 -5.802 -10.201 1.00 61.24 H new ATOM 0 HB3 GLU A 27 3.926 -7.130 -9.468 1.00 61.24 H new ATOM 0 HG2 GLU A 27 4.739 -5.560 -11.932 1.00 50.52 H new ATOM 0 HG3 GLU A 27 5.491 -5.496 -10.350 1.00 50.52 H new ATOM 368 N PRO A 28 2.086 -9.446 -9.855 1.00 31.44 N ATOM 369 CA PRO A 28 1.104 -10.184 -9.056 1.00 51.35 C ATOM 370 C PRO A 28 0.439 -9.283 -8.010 1.00 24.13 C ATOM 371 O PRO A 28 1.112 -8.645 -7.173 1.00 74.14 O ATOM 372 CB PRO A 28 1.932 -11.305 -8.394 1.00 43.15 C ATOM 373 CG PRO A 28 3.354 -10.895 -8.560 1.00 4.23 C ATOM 374 CD PRO A 28 3.402 -10.107 -9.830 1.00 10.13 C ATOM 0 HA PRO A 28 0.282 -10.572 -9.658 1.00 51.35 H new ATOM 0 HB2 PRO A 28 1.675 -11.414 -7.340 1.00 43.15 H new ATOM 0 HB3 PRO A 28 1.742 -12.267 -8.870 1.00 43.15 H new ATOM 0 HG2 PRO A 28 3.690 -10.295 -7.714 1.00 4.23 H new ATOM 0 HG3 PRO A 28 4.009 -11.765 -8.614 1.00 4.23 H new ATOM 0 HD2 PRO A 28 4.218 -9.384 -9.827 1.00 10.13 H new ATOM 0 HD3 PRO A 28 3.549 -10.749 -10.699 1.00 10.13 H new ATOM 382 N THR A 29 -0.858 -9.225 -8.063 1.00 3.20 N ATOM 383 CA THR A 29 -1.622 -8.342 -7.238 1.00 25.53 C ATOM 384 C THR A 29 -2.908 -9.007 -6.729 1.00 23.12 C ATOM 385 O THR A 29 -3.273 -10.093 -7.154 1.00 24.53 O ATOM 386 CB THR A 29 -1.958 -7.054 -8.028 1.00 14.22 C ATOM 387 OG1 THR A 29 -2.229 -7.395 -9.401 1.00 13.30 O ATOM 388 CG2 THR A 29 -0.821 -6.034 -7.963 1.00 53.40 C ATOM 0 H THR A 29 -1.422 -9.799 -8.690 1.00 3.20 H new ATOM 0 HA THR A 29 -1.020 -8.089 -6.365 1.00 25.53 H new ATOM 0 HB THR A 29 -2.837 -6.597 -7.573 1.00 14.22 H new ATOM 0 HG1 THR A 29 -1.383 -7.526 -9.879 1.00 13.30 H new ATOM 0 HG21 THR A 29 -1.097 -5.145 -8.530 1.00 53.40 H new ATOM 0 HG22 THR A 29 -0.637 -5.759 -6.924 1.00 53.40 H new ATOM 0 HG23 THR A 29 0.083 -6.469 -8.388 1.00 53.40 H new ATOM 396 N TYR A 30 -3.535 -8.361 -5.807 1.00 50.34 N ATOM 397 CA TYR A 30 -4.784 -8.751 -5.224 1.00 4.22 C ATOM 398 C TYR A 30 -5.856 -7.805 -5.670 1.00 21.42 C ATOM 399 O TYR A 30 -5.570 -6.679 -6.071 1.00 13.42 O ATOM 400 CB TYR A 30 -4.735 -8.703 -3.699 1.00 51.21 C ATOM 401 CG TYR A 30 -4.023 -9.841 -3.045 1.00 65.20 C ATOM 402 CD1 TYR A 30 -4.487 -11.129 -3.197 1.00 33.31 C ATOM 403 CD2 TYR A 30 -2.930 -9.630 -2.239 1.00 61.22 C ATOM 404 CE1 TYR A 30 -3.881 -12.185 -2.571 1.00 72.31 C ATOM 405 CE2 TYR A 30 -2.305 -10.678 -1.605 1.00 2.54 C ATOM 406 CZ TYR A 30 -2.786 -11.959 -1.769 1.00 53.53 C ATOM 407 OH TYR A 30 -2.172 -13.018 -1.129 1.00 75.34 O ATOM 0 H TYR A 30 -3.172 -7.493 -5.413 1.00 50.34 H new ATOM 0 HA TYR A 30 -4.990 -9.772 -5.545 1.00 4.22 H new ATOM 0 HB2 TYR A 30 -4.253 -7.773 -3.397 1.00 51.21 H new ATOM 0 HB3 TYR A 30 -5.757 -8.670 -3.320 1.00 51.21 H new ATOM 0 HD1 TYR A 30 -5.348 -11.310 -3.824 1.00 33.31 H new ATOM 0 HD2 TYR A 30 -2.556 -8.626 -2.102 1.00 61.22 H new ATOM 0 HE1 TYR A 30 -4.259 -13.188 -2.706 1.00 72.31 H new ATOM 0 HE2 TYR A 30 -1.442 -10.498 -0.982 1.00 2.54 H new ATOM 0 HH TYR A 30 -1.351 -13.258 -1.608 1.00 75.34 H new ATOM 417 N ASP A 31 -7.058 -8.243 -5.556 1.00 35.14 N ATOM 418 CA ASP A 31 -8.232 -7.474 -5.891 1.00 3.31 C ATOM 419 C ASP A 31 -9.164 -7.743 -4.732 1.00 32.43 C ATOM 420 O ASP A 31 -8.954 -8.741 -4.024 1.00 23.33 O ATOM 421 CB ASP A 31 -8.854 -8.005 -7.198 1.00 13.13 C ATOM 422 CG ASP A 31 -9.912 -7.092 -7.818 1.00 5.32 C ATOM 423 OD1 ASP A 31 -10.669 -6.424 -7.095 1.00 22.24 O ATOM 424 OD2 ASP A 31 -10.021 -7.062 -9.056 1.00 41.55 O ATOM 0 H ASP A 31 -7.273 -9.180 -5.215 1.00 35.14 H new ATOM 0 HA ASP A 31 -8.025 -6.415 -6.043 1.00 3.31 H new ATOM 0 HB2 ASP A 31 -8.058 -8.163 -7.926 1.00 13.13 H new ATOM 0 HB3 ASP A 31 -9.303 -8.978 -7.001 1.00 13.13 H new ATOM 429 N LEU A 32 -10.159 -6.916 -4.533 1.00 33.10 N ATOM 430 CA LEU A 32 -11.034 -7.003 -3.359 1.00 22.10 C ATOM 431 C LEU A 32 -11.677 -8.397 -3.161 1.00 4.04 C ATOM 432 O LEU A 32 -11.553 -8.959 -2.083 1.00 42.33 O ATOM 433 CB LEU A 32 -12.084 -5.865 -3.284 1.00 55.50 C ATOM 434 CG LEU A 32 -11.568 -4.427 -3.025 1.00 72.25 C ATOM 435 CD1 LEU A 32 -10.764 -3.871 -4.196 1.00 33.31 C ATOM 436 CD2 LEU A 32 -12.726 -3.508 -2.687 1.00 31.44 C ATOM 0 H LEU A 32 -10.397 -6.158 -5.172 1.00 33.10 H new ATOM 0 HA LEU A 32 -10.362 -6.858 -2.513 1.00 22.10 H new ATOM 0 HB2 LEU A 32 -12.640 -5.858 -4.222 1.00 55.50 H new ATOM 0 HB3 LEU A 32 -12.793 -6.114 -2.495 1.00 55.50 H new ATOM 0 HG LEU A 32 -10.888 -4.478 -2.175 1.00 72.25 H new ATOM 0 HD11 LEU A 32 -10.428 -2.861 -3.960 1.00 33.31 H new ATOM 0 HD12 LEU A 32 -9.899 -4.508 -4.379 1.00 33.31 H new ATOM 0 HD13 LEU A 32 -11.390 -3.845 -5.088 1.00 33.31 H new ATOM 0 HD21 LEU A 32 -12.351 -2.501 -2.507 1.00 31.44 H new ATOM 0 HD22 LEU A 32 -13.431 -3.490 -3.518 1.00 31.44 H new ATOM 0 HD23 LEU A 32 -13.230 -3.872 -1.792 1.00 31.44 H new ATOM 448 N PRO A 33 -12.352 -8.997 -4.186 1.00 72.51 N ATOM 449 CA PRO A 33 -12.905 -10.352 -4.061 1.00 51.15 C ATOM 450 C PRO A 33 -11.821 -11.412 -3.742 1.00 73.30 C ATOM 451 O PRO A 33 -12.063 -12.352 -2.989 1.00 22.13 O ATOM 452 CB PRO A 33 -13.550 -10.620 -5.426 1.00 73.41 C ATOM 453 CG PRO A 33 -12.995 -9.585 -6.342 1.00 3.25 C ATOM 454 CD PRO A 33 -12.697 -8.398 -5.491 1.00 73.43 C ATOM 0 HA PRO A 33 -13.610 -10.420 -3.233 1.00 51.15 H new ATOM 0 HB2 PRO A 33 -13.315 -11.624 -5.780 1.00 73.41 H new ATOM 0 HB3 PRO A 33 -14.636 -10.549 -5.367 1.00 73.41 H new ATOM 0 HG2 PRO A 33 -12.094 -9.946 -6.837 1.00 3.25 H new ATOM 0 HG3 PRO A 33 -13.710 -9.334 -7.125 1.00 3.25 H new ATOM 0 HD2 PRO A 33 -11.873 -7.810 -5.895 1.00 73.43 H new ATOM 0 HD3 PRO A 33 -13.556 -7.732 -5.414 1.00 73.43 H new ATOM 462 N ARG A 34 -10.625 -11.244 -4.308 1.00 21.34 N ATOM 463 CA ARG A 34 -9.507 -12.128 -4.049 1.00 24.10 C ATOM 464 C ARG A 34 -9.054 -11.984 -2.585 1.00 43.31 C ATOM 465 O ARG A 34 -8.674 -12.963 -1.942 1.00 74.44 O ATOM 466 CB ARG A 34 -8.374 -11.767 -5.003 1.00 33.21 C ATOM 467 CG ARG A 34 -7.178 -12.696 -4.999 1.00 31.04 C ATOM 468 CD ARG A 34 -7.546 -14.086 -5.476 1.00 63.04 C ATOM 469 NE ARG A 34 -6.334 -14.835 -5.869 1.00 61.14 N ATOM 470 CZ ARG A 34 -6.157 -16.174 -5.870 1.00 25.34 C ATOM 471 NH1 ARG A 34 -7.055 -17.000 -5.345 1.00 64.42 N ATOM 472 NH2 ARG A 34 -5.028 -16.675 -6.356 1.00 63.30 N ATOM 0 H ARG A 34 -10.412 -10.488 -4.959 1.00 21.34 H new ATOM 0 HA ARG A 34 -9.800 -13.165 -4.211 1.00 24.10 H new ATOM 0 HB2 ARG A 34 -8.776 -11.730 -6.015 1.00 33.21 H new ATOM 0 HB3 ARG A 34 -8.029 -10.762 -4.761 1.00 33.21 H new ATOM 0 HG2 ARG A 34 -6.397 -12.286 -5.640 1.00 31.04 H new ATOM 0 HG3 ARG A 34 -6.766 -12.754 -3.992 1.00 31.04 H new ATOM 0 HD2 ARG A 34 -8.071 -14.621 -4.685 1.00 63.04 H new ATOM 0 HD3 ARG A 34 -8.229 -14.018 -6.323 1.00 63.04 H new ATOM 0 HE ARG A 34 -5.538 -14.275 -6.175 1.00 61.14 H new ATOM 0 HH11 ARG A 34 -7.907 -16.627 -4.926 1.00 64.42 H new ATOM 0 HH12 ARG A 34 -6.893 -18.007 -5.361 1.00 64.42 H new ATOM 0 HH21 ARG A 34 -4.309 -16.051 -6.722 1.00 63.30 H new ATOM 0 HH22 ARG A 34 -4.879 -17.684 -6.364 1.00 63.30 H new ATOM 486 N VAL A 35 -9.089 -10.762 -2.081 1.00 35.14 N ATOM 487 CA VAL A 35 -8.751 -10.483 -0.687 1.00 72.21 C ATOM 488 C VAL A 35 -9.820 -11.041 0.238 1.00 12.03 C ATOM 489 O VAL A 35 -9.513 -11.627 1.284 1.00 51.21 O ATOM 490 CB VAL A 35 -8.542 -8.962 -0.418 1.00 22.20 C ATOM 491 CG1 VAL A 35 -8.301 -8.681 1.058 1.00 40.00 C ATOM 492 CG2 VAL A 35 -7.388 -8.428 -1.238 1.00 43.44 C ATOM 0 H VAL A 35 -9.351 -9.936 -2.620 1.00 35.14 H new ATOM 0 HA VAL A 35 -7.802 -10.978 -0.482 1.00 72.21 H new ATOM 0 HB VAL A 35 -9.458 -8.452 -0.715 1.00 22.20 H new ATOM 0 HG11 VAL A 35 -8.160 -7.610 1.206 1.00 40.00 H new ATOM 0 HG12 VAL A 35 -9.161 -9.017 1.638 1.00 40.00 H new ATOM 0 HG13 VAL A 35 -7.410 -9.214 1.389 1.00 40.00 H new ATOM 0 HG21 VAL A 35 -7.259 -7.365 -1.035 1.00 43.44 H new ATOM 0 HG22 VAL A 35 -6.475 -8.961 -0.972 1.00 43.44 H new ATOM 0 HG23 VAL A 35 -7.597 -8.573 -2.298 1.00 43.44 H new ATOM 502 N ALA A 36 -11.062 -10.877 -0.173 1.00 60.32 N ATOM 503 CA ALA A 36 -12.208 -11.373 0.566 1.00 41.22 C ATOM 504 C ALA A 36 -12.066 -12.868 0.754 1.00 14.32 C ATOM 505 O ALA A 36 -12.247 -13.390 1.841 1.00 5.40 O ATOM 506 CB ALA A 36 -13.487 -11.050 -0.192 1.00 3.42 C ATOM 0 H ALA A 36 -11.307 -10.392 -1.036 1.00 60.32 H new ATOM 0 HA ALA A 36 -12.256 -10.893 1.543 1.00 41.22 H new ATOM 0 HB1 ALA A 36 -14.345 -11.424 0.366 1.00 3.42 H new ATOM 0 HB2 ALA A 36 -13.575 -9.970 -0.313 1.00 3.42 H new ATOM 0 HB3 ALA A 36 -13.458 -11.524 -1.173 1.00 3.42 H new ATOM 512 N GLU A 37 -11.662 -13.510 -0.312 1.00 53.54 N ATOM 513 CA GLU A 37 -11.411 -14.931 -0.376 1.00 1.22 C ATOM 514 C GLU A 37 -10.258 -15.313 0.575 1.00 74.13 C ATOM 515 O GLU A 37 -10.352 -16.270 1.349 1.00 33.55 O ATOM 516 CB GLU A 37 -10.966 -15.215 -1.790 1.00 43.05 C ATOM 517 CG GLU A 37 -10.879 -16.667 -2.164 1.00 15.12 C ATOM 518 CD GLU A 37 -10.262 -16.834 -3.515 1.00 41.42 C ATOM 519 OE1 GLU A 37 -9.024 -16.826 -3.604 1.00 40.10 O ATOM 520 OE2 GLU A 37 -10.994 -16.954 -4.513 1.00 32.42 O ATOM 0 H GLU A 37 -11.491 -13.037 -1.200 1.00 53.54 H new ATOM 0 HA GLU A 37 -12.301 -15.493 -0.093 1.00 1.22 H new ATOM 0 HB2 GLU A 37 -11.656 -14.723 -2.475 1.00 43.05 H new ATOM 0 HB3 GLU A 37 -9.987 -14.760 -1.942 1.00 43.05 H new ATOM 0 HG2 GLU A 37 -10.288 -17.203 -1.421 1.00 15.12 H new ATOM 0 HG3 GLU A 37 -11.876 -17.109 -2.158 1.00 15.12 H new ATOM 527 N LEU A 38 -9.203 -14.516 0.522 1.00 12.51 N ATOM 528 CA LEU A 38 -7.976 -14.736 1.267 1.00 74.44 C ATOM 529 C LEU A 38 -8.211 -14.640 2.773 1.00 41.20 C ATOM 530 O LEU A 38 -7.668 -15.426 3.551 1.00 31.41 O ATOM 531 CB LEU A 38 -6.943 -13.691 0.844 1.00 73.40 C ATOM 532 CG LEU A 38 -5.549 -13.820 1.441 1.00 61.52 C ATOM 533 CD1 LEU A 38 -4.845 -15.062 0.916 1.00 4.23 C ATOM 534 CD2 LEU A 38 -4.741 -12.577 1.153 1.00 41.33 C ATOM 0 H LEU A 38 -9.177 -13.676 -0.056 1.00 12.51 H new ATOM 0 HA LEU A 38 -7.614 -15.740 1.047 1.00 74.44 H new ATOM 0 HB2 LEU A 38 -6.852 -13.724 -0.242 1.00 73.40 H new ATOM 0 HB3 LEU A 38 -7.332 -12.706 1.101 1.00 73.40 H new ATOM 0 HG LEU A 38 -5.644 -13.926 2.522 1.00 61.52 H new ATOM 0 HD11 LEU A 38 -3.851 -15.131 1.358 1.00 4.23 H new ATOM 0 HD12 LEU A 38 -5.423 -15.947 1.182 1.00 4.23 H new ATOM 0 HD13 LEU A 38 -4.756 -14.999 -0.169 1.00 4.23 H new ATOM 0 HD21 LEU A 38 -3.746 -12.682 1.585 1.00 41.33 H new ATOM 0 HD22 LEU A 38 -4.656 -12.440 0.075 1.00 41.33 H new ATOM 0 HD23 LEU A 38 -5.237 -11.711 1.591 1.00 41.33 H new ATOM 546 N LEU A 39 -9.012 -13.686 3.178 1.00 55.53 N ATOM 547 CA LEU A 39 -9.267 -13.479 4.590 1.00 43.40 C ATOM 548 C LEU A 39 -10.522 -14.223 5.046 1.00 44.22 C ATOM 549 O LEU A 39 -10.715 -14.463 6.241 1.00 14.20 O ATOM 550 CB LEU A 39 -9.393 -11.987 4.895 1.00 31.35 C ATOM 551 CG LEU A 39 -8.207 -11.102 4.478 1.00 15.42 C ATOM 552 CD1 LEU A 39 -8.474 -9.657 4.841 1.00 10.30 C ATOM 553 CD2 LEU A 39 -6.910 -11.577 5.117 1.00 44.23 C ATOM 0 H LEU A 39 -9.499 -13.041 2.556 1.00 55.53 H new ATOM 0 HA LEU A 39 -8.420 -13.883 5.144 1.00 43.40 H new ATOM 0 HB2 LEU A 39 -10.289 -11.612 4.401 1.00 31.35 H new ATOM 0 HB3 LEU A 39 -9.547 -11.869 5.968 1.00 31.35 H new ATOM 0 HG LEU A 39 -8.096 -11.180 3.396 1.00 15.42 H new ATOM 0 HD11 LEU A 39 -7.625 -9.043 4.539 1.00 10.30 H new ATOM 0 HD12 LEU A 39 -9.372 -9.313 4.327 1.00 10.30 H new ATOM 0 HD13 LEU A 39 -8.618 -9.573 5.918 1.00 10.30 H new ATOM 0 HD21 LEU A 39 -6.091 -10.930 4.802 1.00 44.23 H new ATOM 0 HD22 LEU A 39 -7.004 -11.540 6.202 1.00 44.23 H new ATOM 0 HD23 LEU A 39 -6.704 -12.601 4.805 1.00 44.23 H new ATOM 565 N GLY A 40 -11.357 -14.596 4.101 1.00 54.41 N ATOM 566 CA GLY A 40 -12.594 -15.286 4.412 1.00 3.15 C ATOM 567 C GLY A 40 -13.668 -14.317 4.872 1.00 15.42 C ATOM 568 O GLY A 40 -14.614 -14.696 5.566 1.00 44.44 O ATOM 0 H GLY A 40 -11.203 -14.433 3.106 1.00 54.41 H new ATOM 0 HA2 GLY A 40 -12.942 -15.826 3.532 1.00 3.15 H new ATOM 0 HA3 GLY A 40 -12.413 -16.027 5.190 1.00 3.15 H new ATOM 572 N VAL A 41 -13.521 -13.074 4.481 1.00 25.13 N ATOM 573 CA VAL A 41 -14.439 -12.019 4.874 1.00 61.41 C ATOM 574 C VAL A 41 -15.188 -11.529 3.639 1.00 52.33 C ATOM 575 O VAL A 41 -14.783 -11.835 2.525 1.00 13.31 O ATOM 576 CB VAL A 41 -13.688 -10.814 5.552 1.00 23.15 C ATOM 577 CG1 VAL A 41 -12.899 -11.271 6.767 1.00 21.31 C ATOM 578 CG2 VAL A 41 -12.785 -10.071 4.564 1.00 64.52 C ATOM 0 H VAL A 41 -12.760 -12.759 3.879 1.00 25.13 H new ATOM 0 HA VAL A 41 -15.136 -12.426 5.606 1.00 61.41 H new ATOM 0 HB VAL A 41 -14.452 -10.112 5.886 1.00 23.15 H new ATOM 0 HG11 VAL A 41 -12.391 -10.416 7.214 1.00 21.31 H new ATOM 0 HG12 VAL A 41 -13.578 -11.712 7.497 1.00 21.31 H new ATOM 0 HG13 VAL A 41 -12.161 -12.013 6.463 1.00 21.31 H new ATOM 0 HG21 VAL A 41 -12.287 -9.247 5.075 1.00 64.52 H new ATOM 0 HG22 VAL A 41 -12.037 -10.758 4.167 1.00 64.52 H new ATOM 0 HG23 VAL A 41 -13.387 -9.678 3.745 1.00 64.52 H new ATOM 588 N PRO A 42 -16.317 -10.840 3.799 1.00 22.41 N ATOM 589 CA PRO A 42 -17.019 -10.245 2.667 1.00 33.51 C ATOM 590 C PRO A 42 -16.230 -9.082 2.049 1.00 75.54 C ATOM 591 O PRO A 42 -15.414 -8.422 2.730 1.00 13.44 O ATOM 592 CB PRO A 42 -18.318 -9.722 3.276 1.00 31.14 C ATOM 593 CG PRO A 42 -18.014 -9.560 4.719 1.00 72.35 C ATOM 594 CD PRO A 42 -17.048 -10.648 5.058 1.00 62.31 C ATOM 0 HA PRO A 42 -17.169 -10.966 1.863 1.00 33.51 H new ATOM 0 HB2 PRO A 42 -18.615 -8.775 2.824 1.00 31.14 H new ATOM 0 HB3 PRO A 42 -19.139 -10.421 3.120 1.00 31.14 H new ATOM 0 HG2 PRO A 42 -17.584 -8.579 4.920 1.00 72.35 H new ATOM 0 HG3 PRO A 42 -18.920 -9.640 5.320 1.00 72.35 H new ATOM 0 HD2 PRO A 42 -16.383 -10.359 5.872 1.00 62.31 H new ATOM 0 HD3 PRO A 42 -17.558 -11.558 5.372 1.00 62.31 H new ATOM 602 N VAL A 43 -16.502 -8.812 0.778 1.00 71.05 N ATOM 603 CA VAL A 43 -15.863 -7.726 0.030 1.00 11.11 C ATOM 604 C VAL A 43 -16.153 -6.392 0.712 1.00 11.00 C ATOM 605 O VAL A 43 -15.298 -5.504 0.763 1.00 24.22 O ATOM 606 CB VAL A 43 -16.390 -7.671 -1.432 1.00 43.03 C ATOM 607 CG1 VAL A 43 -15.712 -6.561 -2.230 1.00 50.11 C ATOM 608 CG2 VAL A 43 -16.212 -9.010 -2.130 1.00 23.55 C ATOM 0 H VAL A 43 -17.178 -9.343 0.229 1.00 71.05 H new ATOM 0 HA VAL A 43 -14.789 -7.913 0.011 1.00 11.11 H new ATOM 0 HB VAL A 43 -17.456 -7.448 -1.382 1.00 43.03 H new ATOM 0 HG11 VAL A 43 -16.105 -6.552 -3.247 1.00 50.11 H new ATOM 0 HG12 VAL A 43 -15.910 -5.599 -1.756 1.00 50.11 H new ATOM 0 HG13 VAL A 43 -14.637 -6.738 -2.258 1.00 50.11 H new ATOM 0 HG21 VAL A 43 -16.589 -8.941 -3.150 1.00 23.55 H new ATOM 0 HG22 VAL A 43 -15.154 -9.271 -2.151 1.00 23.55 H new ATOM 0 HG23 VAL A 43 -16.765 -9.778 -1.590 1.00 23.55 H new ATOM 618 N SER A 44 -17.351 -6.283 1.266 1.00 73.03 N ATOM 619 CA SER A 44 -17.764 -5.101 1.980 1.00 2.14 C ATOM 620 C SER A 44 -16.818 -4.837 3.175 1.00 20.21 C ATOM 621 O SER A 44 -16.446 -3.701 3.435 1.00 52.53 O ATOM 622 CB SER A 44 -19.227 -5.244 2.432 1.00 12.42 C ATOM 623 OG SER A 44 -19.721 -4.038 2.986 1.00 32.12 O ATOM 0 H SER A 44 -18.059 -7.016 1.229 1.00 73.03 H new ATOM 0 HA SER A 44 -17.702 -4.238 1.316 1.00 2.14 H new ATOM 0 HB2 SER A 44 -19.844 -5.534 1.582 1.00 12.42 H new ATOM 0 HB3 SER A 44 -19.304 -6.043 3.170 1.00 12.42 H new ATOM 0 HG SER A 44 -20.653 -4.162 3.262 1.00 32.12 H new ATOM 629 N LYS A 45 -16.380 -5.899 3.860 1.00 75.04 N ATOM 630 CA LYS A 45 -15.438 -5.740 4.958 1.00 61.42 C ATOM 631 C LYS A 45 -14.070 -5.313 4.472 1.00 54.32 C ATOM 632 O LYS A 45 -13.378 -4.573 5.159 1.00 0.22 O ATOM 633 CB LYS A 45 -15.367 -6.942 5.899 1.00 14.15 C ATOM 634 CG LYS A 45 -16.482 -6.973 6.936 1.00 41.22 C ATOM 635 CD LYS A 45 -16.271 -8.094 7.940 1.00 31.11 C ATOM 636 CE LYS A 45 -17.252 -8.013 9.107 1.00 30.25 C ATOM 637 NZ LYS A 45 -18.665 -8.190 8.697 1.00 65.22 N ATOM 0 H LYS A 45 -16.661 -6.861 3.673 1.00 75.04 H new ATOM 0 HA LYS A 45 -15.839 -4.929 5.566 1.00 61.42 H new ATOM 0 HB2 LYS A 45 -15.406 -7.857 5.309 1.00 14.15 H new ATOM 0 HB3 LYS A 45 -14.405 -6.934 6.412 1.00 14.15 H new ATOM 0 HG2 LYS A 45 -16.523 -6.017 7.458 1.00 41.22 H new ATOM 0 HG3 LYS A 45 -17.442 -7.105 6.437 1.00 41.22 H new ATOM 0 HD2 LYS A 45 -16.384 -9.055 7.438 1.00 31.11 H new ATOM 0 HD3 LYS A 45 -15.251 -8.051 8.321 1.00 31.11 H new ATOM 0 HE2 LYS A 45 -16.996 -8.776 9.842 1.00 30.25 H new ATOM 0 HE3 LYS A 45 -17.142 -7.047 9.599 1.00 30.25 H new ATOM 0 HZ1 LYS A 45 -19.280 -8.125 9.533 1.00 65.22 H new ATOM 0 HZ2 LYS A 45 -18.925 -7.447 8.017 1.00 65.22 H new ATOM 0 HZ3 LYS A 45 -18.783 -9.123 8.253 1.00 65.22 H new ATOM 651 N VAL A 46 -13.693 -5.764 3.285 1.00 4.53 N ATOM 652 CA VAL A 46 -12.443 -5.320 2.662 1.00 42.33 C ATOM 653 C VAL A 46 -12.524 -3.810 2.413 1.00 13.03 C ATOM 654 O VAL A 46 -11.585 -3.062 2.705 1.00 10.01 O ATOM 655 CB VAL A 46 -12.167 -6.061 1.323 1.00 34.32 C ATOM 656 CG1 VAL A 46 -10.869 -5.578 0.693 1.00 65.13 C ATOM 657 CG2 VAL A 46 -12.125 -7.568 1.541 1.00 61.24 C ATOM 0 H VAL A 46 -14.228 -6.434 2.732 1.00 4.53 H new ATOM 0 HA VAL A 46 -11.620 -5.553 3.338 1.00 42.33 H new ATOM 0 HB VAL A 46 -12.984 -5.834 0.638 1.00 34.32 H new ATOM 0 HG11 VAL A 46 -10.698 -6.111 -0.242 1.00 65.13 H new ATOM 0 HG12 VAL A 46 -10.937 -4.509 0.494 1.00 65.13 H new ATOM 0 HG13 VAL A 46 -10.041 -5.768 1.375 1.00 65.13 H new ATOM 0 HG21 VAL A 46 -11.931 -8.068 0.592 1.00 61.24 H new ATOM 0 HG22 VAL A 46 -11.332 -7.811 2.248 1.00 61.24 H new ATOM 0 HG23 VAL A 46 -13.082 -7.905 1.939 1.00 61.24 H new ATOM 667 N ALA A 47 -13.675 -3.368 1.931 1.00 62.50 N ATOM 668 CA ALA A 47 -13.938 -1.955 1.711 1.00 74.33 C ATOM 669 C ALA A 47 -13.880 -1.190 3.040 1.00 73.00 C ATOM 670 O ALA A 47 -13.390 -0.066 3.105 1.00 63.21 O ATOM 671 CB ALA A 47 -15.290 -1.766 1.043 1.00 33.21 C ATOM 0 H ALA A 47 -14.453 -3.979 1.681 1.00 62.50 H new ATOM 0 HA ALA A 47 -13.170 -1.555 1.049 1.00 74.33 H new ATOM 0 HB1 ALA A 47 -15.472 -0.703 0.885 1.00 33.21 H new ATOM 0 HB2 ALA A 47 -15.297 -2.282 0.083 1.00 33.21 H new ATOM 0 HB3 ALA A 47 -16.072 -2.177 1.681 1.00 33.21 H new ATOM 677 N GLN A 48 -14.357 -1.827 4.097 1.00 22.34 N ATOM 678 CA GLN A 48 -14.327 -1.243 5.437 1.00 65.13 C ATOM 679 C GLN A 48 -12.893 -1.103 5.940 1.00 42.42 C ATOM 680 O GLN A 48 -12.567 -0.136 6.601 1.00 71.33 O ATOM 681 CB GLN A 48 -15.183 -2.043 6.435 1.00 2.45 C ATOM 682 CG GLN A 48 -16.678 -2.050 6.111 1.00 23.11 C ATOM 683 CD GLN A 48 -17.310 -0.658 6.110 1.00 3.11 C ATOM 684 OE1 GLN A 48 -16.847 0.214 6.964 1.00 42.41 O flip ATOM 685 NE2 GLN A 48 -18.248 -0.389 5.365 1.00 73.35 N flip ATOM 0 H GLN A 48 -14.774 -2.757 4.056 1.00 22.34 H new ATOM 0 HA GLN A 48 -14.764 -0.247 5.363 1.00 65.13 H new ATOM 0 HB2 GLN A 48 -14.823 -3.072 6.463 1.00 2.45 H new ATOM 0 HB3 GLN A 48 -15.040 -1.629 7.433 1.00 2.45 H new ATOM 0 HG2 GLN A 48 -16.827 -2.508 5.133 1.00 23.11 H new ATOM 0 HG3 GLN A 48 -17.196 -2.675 6.839 1.00 23.11 H new ATOM 0 HE21 GLN A 48 -18.592 -1.087 4.706 1.00 73.35 H new ATOM 0 HE22 GLN A 48 -18.683 0.533 5.405 1.00 73.35 H new ATOM 694 N GLN A 49 -12.039 -2.062 5.598 1.00 73.03 N ATOM 695 CA GLN A 49 -10.611 -2.002 5.949 1.00 2.42 C ATOM 696 C GLN A 49 -9.980 -0.793 5.306 1.00 24.45 C ATOM 697 O GLN A 49 -9.220 -0.048 5.938 1.00 64.24 O ATOM 698 CB GLN A 49 -9.886 -3.245 5.479 1.00 23.32 C ATOM 699 CG GLN A 49 -10.382 -4.504 6.112 1.00 41.23 C ATOM 700 CD GLN A 49 -9.572 -5.706 5.701 1.00 21.35 C ATOM 701 OE1 GLN A 49 -8.381 -5.598 5.419 1.00 22.42 O ATOM 702 NE2 GLN A 49 -10.190 -6.854 5.681 1.00 41.24 N ATOM 0 H GLN A 49 -12.306 -2.897 5.076 1.00 73.03 H new ATOM 0 HA GLN A 49 -10.530 -1.935 7.034 1.00 2.42 H new ATOM 0 HB2 GLN A 49 -9.989 -3.328 4.397 1.00 23.32 H new ATOM 0 HB3 GLN A 49 -8.822 -3.137 5.691 1.00 23.32 H new ATOM 0 HG2 GLN A 49 -10.350 -4.400 7.197 1.00 41.23 H new ATOM 0 HG3 GLN A 49 -11.425 -4.660 5.837 1.00 41.23 H new ATOM 0 HE21 GLN A 49 -11.180 -6.905 5.921 1.00 41.24 H new ATOM 0 HE22 GLN A 49 -9.683 -7.701 5.425 1.00 41.24 H new ATOM 711 N LEU A 50 -10.336 -0.593 4.063 1.00 42.54 N ATOM 712 CA LEU A 50 -9.897 0.563 3.266 1.00 22.43 C ATOM 713 C LEU A 50 -10.389 1.868 3.899 1.00 20.11 C ATOM 714 O LEU A 50 -9.732 2.907 3.825 1.00 12.21 O ATOM 715 CB LEU A 50 -10.433 0.448 1.819 1.00 24.45 C ATOM 716 CG LEU A 50 -9.529 -0.213 0.759 1.00 51.51 C ATOM 717 CD1 LEU A 50 -8.304 0.637 0.505 1.00 61.41 C ATOM 718 CD2 LEU A 50 -9.124 -1.625 1.158 1.00 61.45 C ATOM 0 H LEU A 50 -10.949 -1.229 3.553 1.00 42.54 H new ATOM 0 HA LEU A 50 -8.807 0.572 3.244 1.00 22.43 H new ATOM 0 HB2 LEU A 50 -11.369 -0.110 1.854 1.00 24.45 H new ATOM 0 HB3 LEU A 50 -10.674 1.453 1.472 1.00 24.45 H new ATOM 0 HG LEU A 50 -10.106 -0.287 -0.163 1.00 51.51 H new ATOM 0 HD11 LEU A 50 -7.677 0.156 -0.246 1.00 61.41 H new ATOM 0 HD12 LEU A 50 -8.611 1.619 0.146 1.00 61.41 H new ATOM 0 HD13 LEU A 50 -7.740 0.749 1.431 1.00 61.41 H new ATOM 0 HD21 LEU A 50 -8.488 -2.054 0.384 1.00 61.45 H new ATOM 0 HD22 LEU A 50 -8.577 -1.594 2.101 1.00 61.45 H new ATOM 0 HD23 LEU A 50 -10.016 -2.240 1.276 1.00 61.45 H new ATOM 730 N ARG A 51 -11.558 1.807 4.479 1.00 43.54 N ATOM 731 CA ARG A 51 -12.142 2.921 5.206 1.00 54.42 C ATOM 732 C ARG A 51 -11.437 3.192 6.545 1.00 14.24 C ATOM 733 O ARG A 51 -11.334 4.328 6.980 1.00 3.32 O ATOM 734 CB ARG A 51 -13.635 2.693 5.426 1.00 73.55 C ATOM 735 CG ARG A 51 -14.499 2.874 4.189 1.00 73.22 C ATOM 736 CD ARG A 51 -15.957 2.541 4.482 1.00 53.11 C ATOM 737 NE ARG A 51 -16.462 3.247 5.678 1.00 34.21 N ATOM 738 CZ ARG A 51 -17.716 3.668 5.874 1.00 63.05 C ATOM 739 NH1 ARG A 51 -18.641 3.521 4.924 1.00 24.12 N ATOM 740 NH2 ARG A 51 -18.036 4.243 7.033 1.00 42.21 N ATOM 0 H ARG A 51 -12.146 0.974 4.464 1.00 43.54 H new ATOM 0 HA ARG A 51 -12.001 3.808 4.589 1.00 54.42 H new ATOM 0 HB2 ARG A 51 -13.781 1.683 5.809 1.00 73.55 H new ATOM 0 HB3 ARG A 51 -13.983 3.380 6.198 1.00 73.55 H new ATOM 0 HG2 ARG A 51 -14.422 3.902 3.836 1.00 73.22 H new ATOM 0 HG3 ARG A 51 -14.131 2.233 3.388 1.00 73.22 H new ATOM 0 HD2 ARG A 51 -16.569 2.807 3.620 1.00 53.11 H new ATOM 0 HD3 ARG A 51 -16.060 1.466 4.627 1.00 53.11 H new ATOM 0 HE ARG A 51 -15.791 3.430 6.424 1.00 34.21 H new ATOM 0 HH11 ARG A 51 -18.395 3.083 4.036 1.00 24.12 H new ATOM 0 HH12 ARG A 51 -19.594 3.846 5.086 1.00 24.12 H new ATOM 0 HH21 ARG A 51 -17.328 4.358 7.758 1.00 42.21 H new ATOM 0 HH22 ARG A 51 -18.989 4.568 7.195 1.00 42.21 H new ATOM 754 N GLU A 52 -10.945 2.152 7.182 1.00 3.44 N ATOM 755 CA GLU A 52 -10.336 2.300 8.498 1.00 25.04 C ATOM 756 C GLU A 52 -8.842 2.530 8.415 1.00 72.30 C ATOM 757 O GLU A 52 -8.196 2.906 9.403 1.00 12.41 O ATOM 758 CB GLU A 52 -10.637 1.082 9.358 1.00 62.14 C ATOM 759 CG GLU A 52 -12.100 0.943 9.716 1.00 34.10 C ATOM 760 CD GLU A 52 -12.379 -0.276 10.541 1.00 61.25 C ATOM 761 OE1 GLU A 52 -11.974 -0.320 11.721 1.00 71.41 O ATOM 762 OE2 GLU A 52 -13.032 -1.209 10.038 1.00 61.14 O ATOM 0 H GLU A 52 -10.951 1.199 6.819 1.00 3.44 H new ATOM 0 HA GLU A 52 -10.774 3.185 8.961 1.00 25.04 H new ATOM 0 HB2 GLU A 52 -10.314 0.185 8.830 1.00 62.14 H new ATOM 0 HB3 GLU A 52 -10.051 1.141 10.275 1.00 62.14 H new ATOM 0 HG2 GLU A 52 -12.422 1.829 10.263 1.00 34.10 H new ATOM 0 HG3 GLU A 52 -12.691 0.901 8.801 1.00 34.10 H new ATOM 769 N GLY A 53 -8.293 2.328 7.252 1.00 75.35 N ATOM 770 CA GLY A 53 -6.877 2.475 7.095 1.00 72.02 C ATOM 771 C GLY A 53 -6.153 1.252 7.606 1.00 34.15 C ATOM 772 O GLY A 53 -5.096 1.346 8.229 1.00 20.50 O ATOM 0 H GLY A 53 -8.799 2.064 6.407 1.00 75.35 H new ATOM 0 HA2 GLY A 53 -6.637 2.633 6.043 1.00 72.02 H new ATOM 0 HA3 GLY A 53 -6.536 3.358 7.636 1.00 72.02 H new ATOM 776 N HIS A 54 -6.764 0.112 7.398 1.00 30.15 N ATOM 777 CA HIS A 54 -6.166 -1.166 7.751 1.00 52.01 C ATOM 778 C HIS A 54 -5.433 -1.695 6.535 1.00 32.50 C ATOM 779 O HIS A 54 -4.448 -2.408 6.641 1.00 63.52 O ATOM 780 CB HIS A 54 -7.261 -2.171 8.185 1.00 60.30 C ATOM 781 CG HIS A 54 -6.751 -3.559 8.521 1.00 40.04 C ATOM 782 ND1 HIS A 54 -6.844 -4.648 7.667 1.00 41.02 N ATOM 783 CD2 HIS A 54 -6.132 -4.018 9.635 1.00 45.42 C ATOM 784 CE1 HIS A 54 -6.296 -5.695 8.271 1.00 63.45 C ATOM 785 NE2 HIS A 54 -5.845 -5.375 9.473 1.00 41.54 N ATOM 0 H HIS A 54 -7.691 0.036 6.979 1.00 30.15 H new ATOM 0 HA HIS A 54 -5.475 -1.036 8.584 1.00 52.01 H new ATOM 0 HB2 HIS A 54 -7.779 -1.769 9.055 1.00 60.30 H new ATOM 0 HB3 HIS A 54 -7.997 -2.253 7.385 1.00 60.30 H new ATOM 0 HD1 HIS A 54 -7.261 -4.645 6.736 1.00 41.02 H new ATOM 0 HD2 HIS A 54 -5.898 -3.428 10.509 1.00 45.42 H new ATOM 0 HE1 HIS A 54 -6.227 -6.682 7.837 1.00 63.45 H new ATOM 793 N LEU A 55 -5.910 -1.291 5.395 1.00 21.45 N ATOM 794 CA LEU A 55 -5.407 -1.749 4.150 1.00 23.52 C ATOM 795 C LEU A 55 -5.557 -0.606 3.169 1.00 31.32 C ATOM 796 O LEU A 55 -6.440 0.245 3.356 1.00 11.14 O ATOM 797 CB LEU A 55 -6.257 -2.954 3.726 1.00 24.15 C ATOM 798 CG LEU A 55 -5.859 -3.703 2.462 1.00 15.14 C ATOM 799 CD1 LEU A 55 -4.449 -4.263 2.588 1.00 42.22 C ATOM 800 CD2 LEU A 55 -6.859 -4.818 2.206 1.00 11.41 C ATOM 0 H LEU A 55 -6.674 -0.621 5.311 1.00 21.45 H new ATOM 0 HA LEU A 55 -4.361 -2.053 4.199 1.00 23.52 H new ATOM 0 HB2 LEU A 55 -6.258 -3.668 4.550 1.00 24.15 H new ATOM 0 HB3 LEU A 55 -7.284 -2.610 3.601 1.00 24.15 H new ATOM 0 HG LEU A 55 -5.866 -3.013 1.619 1.00 15.14 H new ATOM 0 HD11 LEU A 55 -4.185 -4.794 1.673 1.00 42.22 H new ATOM 0 HD12 LEU A 55 -3.746 -3.446 2.748 1.00 42.22 H new ATOM 0 HD13 LEU A 55 -4.405 -4.951 3.433 1.00 42.22 H new ATOM 0 HD21 LEU A 55 -6.578 -5.358 1.302 1.00 11.41 H new ATOM 0 HD22 LEU A 55 -6.862 -5.505 3.052 1.00 11.41 H new ATOM 0 HD23 LEU A 55 -7.854 -4.392 2.080 1.00 11.41 H new ATOM 812 N VAL A 56 -4.714 -0.556 2.163 1.00 33.12 N ATOM 813 CA VAL A 56 -4.774 0.492 1.182 1.00 54.22 C ATOM 814 C VAL A 56 -4.560 -0.119 -0.205 1.00 33.02 C ATOM 815 O VAL A 56 -3.954 -1.189 -0.323 1.00 60.34 O ATOM 816 CB VAL A 56 -3.753 1.630 1.496 1.00 1.24 C ATOM 817 CG1 VAL A 56 -2.312 1.178 1.364 1.00 0.32 C ATOM 818 CG2 VAL A 56 -4.026 2.877 0.681 1.00 24.24 C ATOM 0 H VAL A 56 -3.973 -1.239 2.006 1.00 33.12 H new ATOM 0 HA VAL A 56 -5.757 0.962 1.208 1.00 54.22 H new ATOM 0 HB VAL A 56 -3.900 1.889 2.545 1.00 1.24 H new ATOM 0 HG11 VAL A 56 -1.647 2.010 1.594 1.00 0.32 H new ATOM 0 HG12 VAL A 56 -2.122 0.360 2.058 1.00 0.32 H new ATOM 0 HG13 VAL A 56 -2.129 0.839 0.344 1.00 0.32 H new ATOM 0 HG21 VAL A 56 -3.292 3.643 0.931 1.00 24.24 H new ATOM 0 HG22 VAL A 56 -3.956 2.640 -0.381 1.00 24.24 H new ATOM 0 HG23 VAL A 56 -5.027 3.246 0.905 1.00 24.24 H new ATOM 828 N ALA A 57 -5.064 0.537 -1.219 1.00 32.44 N ATOM 829 CA ALA A 57 -5.047 0.019 -2.568 1.00 70.55 C ATOM 830 C ALA A 57 -4.633 1.102 -3.540 1.00 75.33 C ATOM 831 O ALA A 57 -4.695 2.275 -3.206 1.00 70.22 O ATOM 832 CB ALA A 57 -6.431 -0.490 -2.928 1.00 23.12 C ATOM 0 H ALA A 57 -5.502 1.454 -1.133 1.00 32.44 H new ATOM 0 HA ALA A 57 -4.328 -0.798 -2.628 1.00 70.55 H new ATOM 0 HB1 ALA A 57 -6.421 -0.881 -3.945 1.00 23.12 H new ATOM 0 HB2 ALA A 57 -6.718 -1.282 -2.237 1.00 23.12 H new ATOM 0 HB3 ALA A 57 -7.148 0.328 -2.861 1.00 23.12 H new ATOM 838 N VAL A 58 -4.224 0.694 -4.724 1.00 62.25 N ATOM 839 CA VAL A 58 -3.813 1.594 -5.798 1.00 45.01 C ATOM 840 C VAL A 58 -4.495 1.183 -7.092 1.00 10.34 C ATOM 841 O VAL A 58 -5.093 0.107 -7.160 1.00 52.23 O ATOM 842 CB VAL A 58 -2.277 1.629 -6.014 1.00 61.22 C ATOM 843 CG1 VAL A 58 -1.595 2.387 -4.894 1.00 54.44 C ATOM 844 CG2 VAL A 58 -1.705 0.216 -6.124 1.00 24.22 C ATOM 0 H VAL A 58 -4.164 -0.292 -4.978 1.00 62.25 H new ATOM 0 HA VAL A 58 -4.115 2.598 -5.501 1.00 45.01 H new ATOM 0 HB VAL A 58 -2.084 2.149 -6.953 1.00 61.22 H new ATOM 0 HG11 VAL A 58 -0.519 2.399 -5.066 1.00 54.44 H new ATOM 0 HG12 VAL A 58 -1.970 3.410 -4.866 1.00 54.44 H new ATOM 0 HG13 VAL A 58 -1.805 1.898 -3.943 1.00 54.44 H new ATOM 0 HG21 VAL A 58 -0.627 0.271 -6.275 1.00 24.22 H new ATOM 0 HG22 VAL A 58 -1.916 -0.334 -5.207 1.00 24.22 H new ATOM 0 HG23 VAL A 58 -2.164 -0.298 -6.969 1.00 24.22 H new ATOM 854 N ARG A 59 -4.459 2.025 -8.097 1.00 43.32 N ATOM 855 CA ARG A 59 -5.115 1.699 -9.341 1.00 13.31 C ATOM 856 C ARG A 59 -4.142 1.442 -10.469 1.00 11.31 C ATOM 857 O ARG A 59 -3.258 2.261 -10.739 1.00 71.24 O ATOM 858 CB ARG A 59 -6.125 2.765 -9.757 1.00 21.15 C ATOM 859 CG ARG A 59 -7.267 2.933 -8.781 1.00 12.22 C ATOM 860 CD ARG A 59 -8.312 3.897 -9.304 1.00 14.01 C ATOM 861 NE ARG A 59 -7.780 5.240 -9.544 1.00 75.44 N ATOM 862 CZ ARG A 59 -8.463 6.229 -10.141 1.00 71.44 C ATOM 863 NH1 ARG A 59 -9.712 6.025 -10.552 1.00 23.20 N ATOM 864 NH2 ARG A 59 -7.901 7.413 -10.315 1.00 41.41 N ATOM 0 H ARG A 59 -3.989 2.930 -8.080 1.00 43.32 H new ATOM 0 HA ARG A 59 -5.652 0.770 -9.148 1.00 13.31 H new ATOM 0 HB2 ARG A 59 -5.609 3.719 -9.867 1.00 21.15 H new ATOM 0 HB3 ARG A 59 -6.530 2.507 -10.736 1.00 21.15 H new ATOM 0 HG2 ARG A 59 -7.728 1.964 -8.590 1.00 12.22 H new ATOM 0 HG3 ARG A 59 -6.881 3.296 -7.828 1.00 12.22 H new ATOM 0 HD2 ARG A 59 -8.728 3.505 -10.232 1.00 14.01 H new ATOM 0 HD3 ARG A 59 -9.132 3.959 -8.589 1.00 14.01 H new ATOM 0 HE ARG A 59 -6.827 5.437 -9.237 1.00 75.44 H new ATOM 0 HH11 ARG A 59 -10.152 5.115 -10.414 1.00 23.20 H new ATOM 0 HH12 ARG A 59 -10.229 6.778 -11.005 1.00 23.20 H new ATOM 0 HH21 ARG A 59 -6.946 7.576 -9.995 1.00 41.41 H new ATOM 0 HH22 ARG A 59 -8.422 8.163 -10.769 1.00 41.41 H new ATOM 878 N ARG A 60 -4.360 0.337 -11.164 1.00 44.35 N ATOM 879 CA ARG A 60 -3.578 -0.040 -12.328 1.00 63.14 C ATOM 880 C ARG A 60 -4.532 -0.037 -13.525 1.00 63.40 C ATOM 881 O ARG A 60 -5.545 -0.753 -13.529 1.00 74.13 O ATOM 882 CB ARG A 60 -2.908 -1.444 -12.177 1.00 31.31 C ATOM 883 CG ARG A 60 -3.895 -2.605 -12.056 1.00 71.25 C ATOM 884 CD ARG A 60 -3.241 -3.969 -12.158 1.00 23.54 C ATOM 885 NE ARG A 60 -4.267 -5.019 -12.117 1.00 53.42 N ATOM 886 CZ ARG A 60 -4.094 -6.320 -12.388 1.00 43.11 C ATOM 887 NH1 ARG A 60 -2.921 -6.784 -12.810 1.00 32.52 N ATOM 888 NH2 ARG A 60 -5.121 -7.150 -12.262 1.00 14.03 N ATOM 0 H ARG A 60 -5.095 -0.331 -10.932 1.00 44.35 H new ATOM 0 HA ARG A 60 -2.761 0.670 -12.458 1.00 63.14 H new ATOM 0 HB2 ARG A 60 -2.263 -1.620 -13.038 1.00 31.31 H new ATOM 0 HB3 ARG A 60 -2.267 -1.434 -11.295 1.00 31.31 H new ATOM 0 HG2 ARG A 60 -4.415 -2.531 -11.101 1.00 71.25 H new ATOM 0 HG3 ARG A 60 -4.649 -2.513 -12.838 1.00 71.25 H new ATOM 0 HD2 ARG A 60 -2.672 -4.041 -13.085 1.00 23.54 H new ATOM 0 HD3 ARG A 60 -2.535 -4.106 -11.339 1.00 23.54 H new ATOM 0 HE ARG A 60 -5.209 -4.728 -11.855 1.00 53.42 H new ATOM 0 HH11 ARG A 60 -2.134 -6.146 -12.932 1.00 32.52 H new ATOM 0 HH12 ARG A 60 -2.808 -7.778 -13.011 1.00 32.52 H new ATOM 0 HH21 ARG A 60 -6.029 -6.796 -11.962 1.00 14.03 H new ATOM 0 HH22 ARG A 60 -5.003 -8.143 -12.465 1.00 14.03 H new ATOM 902 N ALA A 61 -4.277 0.848 -14.475 1.00 41.44 N ATOM 903 CA ALA A 61 -5.128 1.033 -15.668 1.00 0.10 C ATOM 904 C ALA A 61 -6.543 1.500 -15.271 1.00 62.32 C ATOM 905 O ALA A 61 -7.465 1.529 -16.084 1.00 40.11 O ATOM 906 CB ALA A 61 -5.177 -0.236 -16.528 1.00 24.31 C ATOM 0 H ALA A 61 -3.469 1.470 -14.451 1.00 41.44 H new ATOM 0 HA ALA A 61 -4.677 1.817 -16.277 1.00 0.10 H new ATOM 0 HB1 ALA A 61 -5.812 -0.063 -17.397 1.00 24.31 H new ATOM 0 HB2 ALA A 61 -4.170 -0.490 -16.860 1.00 24.31 H new ATOM 0 HB3 ALA A 61 -5.583 -1.059 -15.940 1.00 24.31 H new ATOM 912 N GLY A 62 -6.679 1.929 -14.035 1.00 4.35 N ATOM 913 CA GLY A 62 -7.956 2.335 -13.511 1.00 61.31 C ATOM 914 C GLY A 62 -8.543 1.319 -12.542 1.00 1.45 C ATOM 915 O GLY A 62 -9.380 1.666 -11.715 1.00 70.43 O ATOM 0 H GLY A 62 -5.908 2.004 -13.371 1.00 4.35 H new ATOM 0 HA2 GLY A 62 -7.848 3.294 -13.004 1.00 61.31 H new ATOM 0 HA3 GLY A 62 -8.651 2.487 -14.337 1.00 61.31 H new ATOM 919 N GLY A 63 -8.085 0.083 -12.622 1.00 40.33 N ATOM 920 CA GLY A 63 -8.596 -0.960 -11.757 1.00 43.13 C ATOM 921 C GLY A 63 -7.986 -0.858 -10.391 1.00 30.34 C ATOM 922 O GLY A 63 -6.818 -0.517 -10.271 1.00 60.22 O ATOM 0 H GLY A 63 -7.363 -0.221 -13.275 1.00 40.33 H new ATOM 0 HA2 GLY A 63 -9.681 -0.880 -11.684 1.00 43.13 H new ATOM 0 HA3 GLY A 63 -8.376 -1.937 -12.187 1.00 43.13 H new ATOM 926 N VAL A 64 -8.734 -1.184 -9.373 1.00 12.53 N ATOM 927 CA VAL A 64 -8.247 -1.027 -8.016 1.00 30.11 C ATOM 928 C VAL A 64 -7.682 -2.353 -7.538 1.00 10.44 C ATOM 929 O VAL A 64 -8.385 -3.362 -7.494 1.00 1.43 O ATOM 930 CB VAL A 64 -9.398 -0.585 -7.057 1.00 5.42 C ATOM 931 CG1 VAL A 64 -8.885 -0.358 -5.642 1.00 12.54 C ATOM 932 CG2 VAL A 64 -10.101 0.666 -7.576 1.00 43.11 C ATOM 0 H VAL A 64 -9.680 -1.559 -9.449 1.00 12.53 H new ATOM 0 HA VAL A 64 -7.475 -0.257 -8.008 1.00 30.11 H new ATOM 0 HB VAL A 64 -10.124 -1.397 -7.028 1.00 5.42 H new ATOM 0 HG11 VAL A 64 -9.711 -0.051 -5.000 1.00 12.54 H new ATOM 0 HG12 VAL A 64 -8.452 -1.282 -5.259 1.00 12.54 H new ATOM 0 HG13 VAL A 64 -8.124 0.422 -5.652 1.00 12.54 H new ATOM 0 HG21 VAL A 64 -10.897 0.948 -6.887 1.00 43.11 H new ATOM 0 HG22 VAL A 64 -9.382 1.482 -7.654 1.00 43.11 H new ATOM 0 HG23 VAL A 64 -10.527 0.463 -8.559 1.00 43.11 H new ATOM 942 N VAL A 65 -6.416 -2.340 -7.195 1.00 22.54 N ATOM 943 CA VAL A 65 -5.707 -3.529 -6.772 1.00 72.10 C ATOM 944 C VAL A 65 -4.865 -3.265 -5.554 1.00 73.22 C ATOM 945 O VAL A 65 -4.591 -2.114 -5.202 1.00 2.42 O ATOM 946 CB VAL A 65 -4.804 -4.114 -7.889 1.00 42.02 C ATOM 947 CG1 VAL A 65 -5.639 -4.790 -8.964 1.00 30.53 C ATOM 948 CG2 VAL A 65 -3.936 -3.022 -8.500 1.00 0.33 C ATOM 0 H VAL A 65 -5.842 -1.497 -7.201 1.00 22.54 H new ATOM 0 HA VAL A 65 -6.478 -4.261 -6.533 1.00 72.10 H new ATOM 0 HB VAL A 65 -4.154 -4.865 -7.440 1.00 42.02 H new ATOM 0 HG11 VAL A 65 -4.982 -5.192 -9.736 1.00 30.53 H new ATOM 0 HG12 VAL A 65 -6.216 -5.601 -8.520 1.00 30.53 H new ATOM 0 HG13 VAL A 65 -6.318 -4.062 -9.408 1.00 30.53 H new ATOM 0 HG21 VAL A 65 -3.309 -3.450 -9.282 1.00 0.33 H new ATOM 0 HG22 VAL A 65 -4.573 -2.248 -8.929 1.00 0.33 H new ATOM 0 HG23 VAL A 65 -3.304 -2.584 -7.727 1.00 0.33 H new ATOM 958 N ILE A 66 -4.464 -4.325 -4.922 1.00 24.31 N ATOM 959 CA ILE A 66 -3.667 -4.278 -3.727 1.00 12.54 C ATOM 960 C ILE A 66 -2.459 -5.195 -3.929 1.00 22.10 C ATOM 961 O ILE A 66 -2.629 -6.334 -4.304 1.00 2.12 O ATOM 962 CB ILE A 66 -4.501 -4.780 -2.513 1.00 34.02 C ATOM 963 CG1 ILE A 66 -5.787 -3.948 -2.389 1.00 12.14 C ATOM 964 CG2 ILE A 66 -3.683 -4.700 -1.225 1.00 70.35 C ATOM 965 CD1 ILE A 66 -6.764 -4.437 -1.352 1.00 34.44 C ATOM 0 H ILE A 66 -4.686 -5.272 -5.228 1.00 24.31 H new ATOM 0 HA ILE A 66 -3.345 -3.255 -3.531 1.00 12.54 H new ATOM 0 HB ILE A 66 -4.768 -5.824 -2.677 1.00 34.02 H new ATOM 0 HG12 ILE A 66 -5.515 -2.919 -2.153 1.00 12.14 H new ATOM 0 HG13 ILE A 66 -6.286 -3.932 -3.358 1.00 12.14 H new ATOM 0 HG21 ILE A 66 -4.285 -5.056 -0.389 1.00 70.35 H new ATOM 0 HG22 ILE A 66 -2.792 -5.321 -1.321 1.00 70.35 H new ATOM 0 HG23 ILE A 66 -3.387 -3.666 -1.045 1.00 70.35 H new ATOM 0 HD11 ILE A 66 -7.638 -3.786 -1.340 1.00 34.44 H new ATOM 0 HD12 ILE A 66 -7.073 -5.454 -1.594 1.00 34.44 H new ATOM 0 HD13 ILE A 66 -6.289 -4.426 -0.371 1.00 34.44 H new ATOM 977 N PRO A 67 -1.236 -4.702 -3.758 1.00 2.55 N ATOM 978 CA PRO A 67 -0.023 -5.523 -3.904 1.00 73.24 C ATOM 979 C PRO A 67 -0.017 -6.765 -2.994 1.00 61.25 C ATOM 980 O PRO A 67 -0.416 -6.696 -1.828 1.00 40.52 O ATOM 981 CB PRO A 67 1.095 -4.572 -3.484 1.00 3.33 C ATOM 982 CG PRO A 67 0.552 -3.214 -3.743 1.00 45.23 C ATOM 983 CD PRO A 67 -0.914 -3.299 -3.445 1.00 0.11 C ATOM 0 HA PRO A 67 0.069 -5.915 -4.917 1.00 73.24 H new ATOM 0 HB2 PRO A 67 1.351 -4.702 -2.433 1.00 3.33 H new ATOM 0 HB3 PRO A 67 2.004 -4.751 -4.058 1.00 3.33 H new ATOM 0 HG2 PRO A 67 1.038 -2.471 -3.110 1.00 45.23 H new ATOM 0 HG3 PRO A 67 0.725 -2.914 -4.777 1.00 45.23 H new ATOM 0 HD2 PRO A 67 -1.129 -3.058 -2.404 1.00 0.11 H new ATOM 0 HD3 PRO A 67 -1.491 -2.606 -4.058 1.00 0.11 H new ATOM 991 N GLN A 68 0.455 -7.896 -3.553 1.00 71.44 N ATOM 992 CA GLN A 68 0.606 -9.187 -2.831 1.00 63.25 C ATOM 993 C GLN A 68 1.319 -9.027 -1.494 1.00 44.41 C ATOM 994 O GLN A 68 0.991 -9.686 -0.523 1.00 45.12 O ATOM 995 CB GLN A 68 1.431 -10.152 -3.680 1.00 25.42 C ATOM 996 CG GLN A 68 0.713 -10.743 -4.870 1.00 24.23 C ATOM 997 CD GLN A 68 -0.353 -11.736 -4.485 1.00 53.12 C ATOM 998 OE1 GLN A 68 -0.239 -12.418 -3.482 1.00 2.11 O ATOM 999 NE2 GLN A 68 -1.376 -11.846 -5.285 1.00 1.41 N ATOM 0 H GLN A 68 0.747 -7.946 -4.529 1.00 71.44 H new ATOM 0 HA GLN A 68 -0.400 -9.566 -2.649 1.00 63.25 H new ATOM 0 HB2 GLN A 68 2.319 -9.629 -4.036 1.00 25.42 H new ATOM 0 HB3 GLN A 68 1.775 -10.967 -3.043 1.00 25.42 H new ATOM 0 HG2 GLN A 68 0.259 -9.939 -5.449 1.00 24.23 H new ATOM 0 HG3 GLN A 68 1.440 -11.232 -5.519 1.00 24.23 H new ATOM 0 HE21 GLN A 68 -1.439 -11.258 -6.116 1.00 1.41 H new ATOM 0 HE22 GLN A 68 -2.114 -12.520 -5.080 1.00 1.41 H new ATOM 1008 N VAL A 69 2.260 -8.111 -1.470 1.00 41.10 N ATOM 1009 CA VAL A 69 3.138 -7.863 -0.330 1.00 5.44 C ATOM 1010 C VAL A 69 2.430 -7.203 0.872 1.00 34.54 C ATOM 1011 O VAL A 69 3.029 -6.981 1.906 1.00 32.22 O ATOM 1012 CB VAL A 69 4.343 -7.011 -0.761 1.00 2.33 C ATOM 1013 CG1 VAL A 69 5.192 -7.759 -1.783 1.00 42.02 C ATOM 1014 CG2 VAL A 69 3.872 -5.683 -1.336 1.00 1.54 C ATOM 0 H VAL A 69 2.448 -7.496 -2.262 1.00 41.10 H new ATOM 0 HA VAL A 69 3.472 -8.843 0.011 1.00 5.44 H new ATOM 0 HB VAL A 69 4.957 -6.814 0.118 1.00 2.33 H new ATOM 0 HG11 VAL A 69 6.040 -7.139 -2.075 1.00 42.02 H new ATOM 0 HG12 VAL A 69 5.556 -8.688 -1.344 1.00 42.02 H new ATOM 0 HG13 VAL A 69 4.588 -7.986 -2.662 1.00 42.02 H new ATOM 0 HG21 VAL A 69 4.736 -5.090 -1.637 1.00 1.54 H new ATOM 0 HG22 VAL A 69 3.238 -5.867 -2.203 1.00 1.54 H new ATOM 0 HG23 VAL A 69 3.305 -5.140 -0.580 1.00 1.54 H new ATOM 1024 N PHE A 70 1.167 -6.880 0.727 1.00 51.45 N ATOM 1025 CA PHE A 70 0.415 -6.336 1.844 1.00 40.15 C ATOM 1026 C PHE A 70 -0.169 -7.461 2.678 1.00 21.00 C ATOM 1027 O PHE A 70 -0.723 -7.254 3.762 1.00 11.41 O ATOM 1028 CB PHE A 70 -0.656 -5.343 1.371 1.00 62.31 C ATOM 1029 CG PHE A 70 -0.115 -3.951 1.139 1.00 12.22 C ATOM 1030 CD1 PHE A 70 0.914 -3.710 0.237 1.00 62.44 C ATOM 1031 CD2 PHE A 70 -0.613 -2.889 1.866 1.00 75.12 C ATOM 1032 CE1 PHE A 70 1.416 -2.432 0.067 1.00 31.51 C ATOM 1033 CE2 PHE A 70 -0.114 -1.621 1.705 1.00 2.22 C ATOM 1034 CZ PHE A 70 0.897 -1.386 0.807 1.00 2.24 C ATOM 0 H PHE A 70 0.639 -6.981 -0.140 1.00 51.45 H new ATOM 0 HA PHE A 70 1.096 -5.770 2.480 1.00 40.15 H new ATOM 0 HB2 PHE A 70 -1.101 -5.712 0.447 1.00 62.31 H new ATOM 0 HB3 PHE A 70 -1.453 -5.297 2.113 1.00 62.31 H new ATOM 0 HD1 PHE A 70 1.326 -4.527 -0.336 1.00 62.44 H new ATOM 0 HD2 PHE A 70 -1.410 -3.059 2.575 1.00 75.12 H new ATOM 0 HE1 PHE A 70 2.211 -2.252 -0.642 1.00 31.51 H new ATOM 0 HE2 PHE A 70 -0.518 -0.806 2.287 1.00 2.22 H new ATOM 0 HZ PHE A 70 1.286 -0.387 0.679 1.00 2.24 H new ATOM 1044 N PHE A 71 0.004 -8.654 2.184 1.00 23.43 N ATOM 1045 CA PHE A 71 -0.448 -9.838 2.835 1.00 62.11 C ATOM 1046 C PHE A 71 0.655 -10.844 2.787 1.00 0.20 C ATOM 1047 O PHE A 71 1.609 -10.701 2.020 1.00 32.42 O ATOM 1048 CB PHE A 71 -1.677 -10.434 2.140 1.00 31.31 C ATOM 1049 CG PHE A 71 -2.873 -9.544 2.108 1.00 24.44 C ATOM 1050 CD1 PHE A 71 -3.062 -8.669 1.062 1.00 31.04 C ATOM 1051 CD2 PHE A 71 -3.810 -9.592 3.116 1.00 21.14 C ATOM 1052 CE1 PHE A 71 -4.156 -7.857 1.018 1.00 34.25 C ATOM 1053 CE2 PHE A 71 -4.913 -8.778 3.081 1.00 53.21 C ATOM 1054 CZ PHE A 71 -5.086 -7.908 2.031 1.00 14.22 C ATOM 0 H PHE A 71 0.475 -8.828 1.296 1.00 23.43 H new ATOM 0 HA PHE A 71 -0.724 -9.587 3.859 1.00 62.11 H new ATOM 0 HB2 PHE A 71 -1.407 -10.693 1.116 1.00 31.31 H new ATOM 0 HB3 PHE A 71 -1.946 -11.363 2.643 1.00 31.31 H new ATOM 0 HD1 PHE A 71 -2.334 -8.625 0.266 1.00 31.04 H new ATOM 0 HD2 PHE A 71 -3.675 -10.276 3.941 1.00 21.14 H new ATOM 0 HE1 PHE A 71 -4.292 -7.176 0.191 1.00 34.25 H new ATOM 0 HE2 PHE A 71 -5.643 -8.820 3.876 1.00 53.21 H new ATOM 0 HZ PHE A 71 -5.952 -7.264 2.001 1.00 14.22 H new ATOM 1064 N THR A 72 0.542 -11.839 3.578 1.00 1.42 N ATOM 1065 CA THR A 72 1.490 -12.884 3.552 1.00 43.25 C ATOM 1066 C THR A 72 0.943 -13.961 2.645 1.00 41.20 C ATOM 1067 O THR A 72 -0.281 -14.037 2.420 1.00 25.43 O ATOM 1068 CB THR A 72 1.705 -13.475 4.957 1.00 63.41 C ATOM 1069 OG1 THR A 72 0.454 -13.978 5.454 1.00 14.14 O ATOM 1070 CG2 THR A 72 2.245 -12.418 5.912 1.00 63.10 C ATOM 0 H THR A 72 -0.207 -11.954 4.261 1.00 1.42 H new ATOM 0 HA THR A 72 2.448 -12.502 3.198 1.00 43.25 H new ATOM 0 HB THR A 72 2.433 -14.283 4.890 1.00 63.41 H new ATOM 0 HG1 THR A 72 -0.191 -13.243 5.519 1.00 14.14 H new ATOM 0 HG21 THR A 72 2.389 -12.859 6.899 1.00 63.10 H new ATOM 0 HG22 THR A 72 3.198 -12.044 5.539 1.00 63.10 H new ATOM 0 HG23 THR A 72 1.534 -11.594 5.983 1.00 63.10 H new ATOM 1078 N ASN A 73 1.803 -14.790 2.143 1.00 74.31 N ATOM 1079 CA ASN A 73 1.396 -15.920 1.317 1.00 20.30 C ATOM 1080 C ASN A 73 0.675 -16.969 2.158 1.00 22.03 C ATOM 1081 O ASN A 73 -0.021 -17.838 1.634 1.00 71.34 O ATOM 1082 CB ASN A 73 2.588 -16.543 0.584 1.00 1.15 C ATOM 1083 CG ASN A 73 3.660 -17.070 1.510 1.00 10.22 C ATOM 1084 OD1 ASN A 73 3.622 -18.218 1.934 1.00 42.13 O ATOM 1085 ND2 ASN A 73 4.629 -16.249 1.814 1.00 21.10 N ATOM 0 H ASN A 73 2.810 -14.717 2.285 1.00 74.31 H new ATOM 0 HA ASN A 73 0.706 -15.543 0.562 1.00 20.30 H new ATOM 0 HB2 ASN A 73 2.231 -17.358 -0.046 1.00 1.15 H new ATOM 0 HB3 ASN A 73 3.027 -15.797 -0.079 1.00 1.15 H new ATOM 0 HD21 ASN A 73 5.387 -16.558 2.423 1.00 21.10 H new ATOM 0 HD22 ASN A 73 4.628 -15.299 1.442 1.00 21.10 H new ATOM 1092 N SER A 74 0.827 -16.854 3.468 1.00 21.23 N ATOM 1093 CA SER A 74 0.252 -17.776 4.408 1.00 14.43 C ATOM 1094 C SER A 74 -1.252 -17.492 4.642 1.00 44.25 C ATOM 1095 O SER A 74 -1.925 -18.240 5.346 1.00 71.25 O ATOM 1096 CB SER A 74 1.034 -17.672 5.707 1.00 1.40 C ATOM 1097 OG SER A 74 2.429 -17.772 5.438 1.00 50.54 O ATOM 0 H SER A 74 1.363 -16.104 3.904 1.00 21.23 H new ATOM 0 HA SER A 74 0.316 -18.789 4.010 1.00 14.43 H new ATOM 0 HB2 SER A 74 0.816 -16.724 6.199 1.00 1.40 H new ATOM 0 HB3 SER A 74 0.728 -18.464 6.391 1.00 1.40 H new ATOM 0 HG SER A 74 2.930 -17.703 6.278 1.00 50.54 H new ATOM 1103 N GLY A 75 -1.769 -16.412 4.064 1.00 63.54 N ATOM 1104 CA GLY A 75 -3.197 -16.167 4.148 1.00 52.01 C ATOM 1105 C GLY A 75 -3.582 -15.056 5.093 1.00 61.53 C ATOM 1106 O GLY A 75 -4.750 -14.668 5.161 1.00 71.35 O ATOM 0 H GLY A 75 -1.235 -15.713 3.547 1.00 63.54 H new ATOM 0 HA2 GLY A 75 -3.572 -15.928 3.153 1.00 52.01 H new ATOM 0 HA3 GLY A 75 -3.693 -17.085 4.463 1.00 52.01 H new ATOM 1110 N GLN A 76 -2.634 -14.544 5.833 1.00 20.11 N ATOM 1111 CA GLN A 76 -2.942 -13.458 6.746 1.00 71.33 C ATOM 1112 C GLN A 76 -2.401 -12.155 6.209 1.00 51.23 C ATOM 1113 O GLN A 76 -1.537 -12.151 5.318 1.00 52.00 O ATOM 1114 CB GLN A 76 -2.388 -13.694 8.163 1.00 60.33 C ATOM 1115 CG GLN A 76 -0.872 -13.763 8.245 1.00 14.54 C ATOM 1116 CD GLN A 76 -0.356 -13.641 9.655 1.00 43.51 C ATOM 1117 OE1 GLN A 76 -0.191 -14.628 10.363 1.00 13.50 O ATOM 1118 NE2 GLN A 76 -0.104 -12.430 10.080 1.00 2.04 N ATOM 0 H GLN A 76 -1.660 -14.848 5.829 1.00 20.11 H new ATOM 0 HA GLN A 76 -4.029 -13.413 6.821 1.00 71.33 H new ATOM 0 HB2 GLN A 76 -2.738 -12.893 8.814 1.00 60.33 H new ATOM 0 HB3 GLN A 76 -2.803 -14.624 8.551 1.00 60.33 H new ATOM 0 HG2 GLN A 76 -0.533 -14.707 7.820 1.00 14.54 H new ATOM 0 HG3 GLN A 76 -0.443 -12.967 7.636 1.00 14.54 H new ATOM 0 HE21 GLN A 76 -0.253 -11.632 9.463 1.00 2.04 H new ATOM 0 HE22 GLN A 76 0.242 -12.284 11.028 1.00 2.04 H new ATOM 1127 N VAL A 77 -2.893 -11.067 6.735 1.00 20.14 N ATOM 1128 CA VAL A 77 -2.383 -9.762 6.391 1.00 65.33 C ATOM 1129 C VAL A 77 -1.069 -9.579 7.165 1.00 73.23 C ATOM 1130 O VAL A 77 -0.843 -10.284 8.175 1.00 21.21 O ATOM 1131 CB VAL A 77 -3.404 -8.632 6.766 1.00 44.23 C ATOM 1132 CG1 VAL A 77 -3.459 -8.379 8.262 1.00 23.41 C ATOM 1133 CG2 VAL A 77 -3.116 -7.350 6.014 1.00 55.14 C ATOM 0 H VAL A 77 -3.656 -11.056 7.412 1.00 20.14 H new ATOM 0 HA VAL A 77 -2.220 -9.691 5.316 1.00 65.33 H new ATOM 0 HB VAL A 77 -4.387 -8.990 6.461 1.00 44.23 H new ATOM 0 HG11 VAL A 77 -4.180 -7.588 8.471 1.00 23.41 H new ATOM 0 HG12 VAL A 77 -3.763 -9.292 8.774 1.00 23.41 H new ATOM 0 HG13 VAL A 77 -2.474 -8.075 8.616 1.00 23.41 H new ATOM 0 HG21 VAL A 77 -3.843 -6.590 6.299 1.00 55.14 H new ATOM 0 HG22 VAL A 77 -2.112 -7.002 6.259 1.00 55.14 H new ATOM 0 HG23 VAL A 77 -3.185 -7.534 4.942 1.00 55.14 H new ATOM 1143 N VAL A 78 -0.184 -8.727 6.693 1.00 3.32 N ATOM 1144 CA VAL A 78 1.043 -8.489 7.424 1.00 65.33 C ATOM 1145 C VAL A 78 0.691 -7.812 8.755 1.00 21.21 C ATOM 1146 O VAL A 78 0.026 -6.787 8.781 1.00 31.11 O ATOM 1147 CB VAL A 78 2.051 -7.623 6.631 1.00 13.13 C ATOM 1148 CG1 VAL A 78 3.348 -7.468 7.407 1.00 43.20 C ATOM 1149 CG2 VAL A 78 2.326 -8.227 5.263 1.00 24.13 C ATOM 0 H VAL A 78 -0.286 -8.198 5.827 1.00 3.32 H new ATOM 0 HA VAL A 78 1.531 -9.448 7.596 1.00 65.33 H new ATOM 0 HB VAL A 78 1.609 -6.637 6.489 1.00 13.13 H new ATOM 0 HG11 VAL A 78 4.044 -6.856 6.833 1.00 43.20 H new ATOM 0 HG12 VAL A 78 3.144 -6.986 8.363 1.00 43.20 H new ATOM 0 HG13 VAL A 78 3.787 -8.450 7.582 1.00 43.20 H new ATOM 0 HG21 VAL A 78 3.037 -7.600 4.725 1.00 24.13 H new ATOM 0 HG22 VAL A 78 2.742 -9.227 5.384 1.00 24.13 H new ATOM 0 HG23 VAL A 78 1.396 -8.287 4.698 1.00 24.13 H new ATOM 1159 N LYS A 79 1.131 -8.400 9.845 1.00 31.22 N ATOM 1160 CA LYS A 79 0.768 -7.947 11.193 1.00 24.43 C ATOM 1161 C LYS A 79 1.230 -6.513 11.516 1.00 52.11 C ATOM 1162 O LYS A 79 0.656 -5.845 12.366 1.00 64.14 O ATOM 1163 CB LYS A 79 1.247 -8.953 12.240 1.00 0.32 C ATOM 1164 CG LYS A 79 2.739 -9.112 12.279 1.00 35.24 C ATOM 1165 CD LYS A 79 3.217 -10.362 13.056 1.00 70.21 C ATOM 1166 CE LYS A 79 2.943 -10.335 14.575 1.00 74.25 C ATOM 1167 NZ LYS A 79 1.508 -10.443 14.944 1.00 33.13 N ATOM 0 H LYS A 79 1.753 -9.209 9.835 1.00 31.22 H new ATOM 0 HA LYS A 79 -0.321 -7.902 11.223 1.00 24.43 H new ATOM 0 HB2 LYS A 79 0.897 -8.637 13.223 1.00 0.32 H new ATOM 0 HB3 LYS A 79 0.791 -9.922 12.036 1.00 0.32 H new ATOM 0 HG2 LYS A 79 3.116 -9.165 11.257 1.00 35.24 H new ATOM 0 HG3 LYS A 79 3.177 -8.224 12.734 1.00 35.24 H new ATOM 0 HD2 LYS A 79 2.733 -11.241 12.631 1.00 70.21 H new ATOM 0 HD3 LYS A 79 4.289 -10.480 12.898 1.00 70.21 H new ATOM 0 HE2 LYS A 79 3.488 -11.154 15.044 1.00 74.25 H new ATOM 0 HE3 LYS A 79 3.342 -9.408 14.987 1.00 74.25 H new ATOM 0 HZ1 LYS A 79 1.408 -11.070 15.768 1.00 33.13 H new ATOM 0 HZ2 LYS A 79 1.138 -9.500 15.180 1.00 33.13 H new ATOM 0 HZ3 LYS A 79 0.972 -10.835 14.143 1.00 33.13 H new ATOM 1181 N SER A 80 2.226 -6.036 10.811 1.00 62.45 N ATOM 1182 CA SER A 80 2.741 -4.712 11.054 1.00 12.23 C ATOM 1183 C SER A 80 2.243 -3.737 9.963 1.00 42.14 C ATOM 1184 O SER A 80 2.703 -2.595 9.876 1.00 73.14 O ATOM 1185 CB SER A 80 4.279 -4.769 11.104 1.00 24.22 C ATOM 1186 OG SER A 80 4.838 -3.544 11.530 1.00 13.21 O ATOM 0 H SER A 80 2.697 -6.546 10.063 1.00 62.45 H new ATOM 0 HA SER A 80 2.377 -4.342 12.013 1.00 12.23 H new ATOM 0 HB2 SER A 80 4.591 -5.565 11.780 1.00 24.22 H new ATOM 0 HB3 SER A 80 4.665 -5.020 10.116 1.00 24.22 H new ATOM 0 HG SER A 80 4.335 -2.801 11.136 1.00 13.21 H new ATOM 1192 N LEU A 81 1.270 -4.183 9.164 1.00 61.31 N ATOM 1193 CA LEU A 81 0.730 -3.372 8.075 1.00 10.11 C ATOM 1194 C LEU A 81 0.041 -2.088 8.602 1.00 11.02 C ATOM 1195 O LEU A 81 0.374 -0.992 8.143 1.00 65.12 O ATOM 1196 CB LEU A 81 -0.248 -4.164 7.209 1.00 23.00 C ATOM 1197 CG LEU A 81 -0.535 -3.566 5.854 1.00 43.21 C ATOM 1198 CD1 LEU A 81 0.651 -3.796 4.947 1.00 62.10 C ATOM 1199 CD2 LEU A 81 -1.792 -4.155 5.268 1.00 22.23 C ATOM 0 H LEU A 81 0.841 -5.104 9.253 1.00 61.31 H new ATOM 0 HA LEU A 81 1.580 -3.081 7.459 1.00 10.11 H new ATOM 0 HB2 LEU A 81 0.148 -5.170 7.068 1.00 23.00 H new ATOM 0 HB3 LEU A 81 -1.189 -4.265 7.751 1.00 23.00 H new ATOM 0 HG LEU A 81 -0.696 -2.493 5.958 1.00 43.21 H new ATOM 0 HD11 LEU A 81 0.448 -3.365 3.966 1.00 62.10 H new ATOM 0 HD12 LEU A 81 1.534 -3.322 5.376 1.00 62.10 H new ATOM 0 HD13 LEU A 81 0.828 -4.867 4.844 1.00 62.10 H new ATOM 0 HD21 LEU A 81 -1.981 -3.710 4.291 1.00 22.23 H new ATOM 0 HD22 LEU A 81 -1.672 -5.233 5.159 1.00 22.23 H new ATOM 0 HD23 LEU A 81 -2.633 -3.948 5.930 1.00 22.23 H new ATOM 1211 N PRO A 82 -0.915 -2.178 9.597 1.00 4.23 N ATOM 1212 CA PRO A 82 -1.584 -0.988 10.119 1.00 42.44 C ATOM 1213 C PRO A 82 -0.601 -0.026 10.764 1.00 50.13 C ATOM 1214 O PRO A 82 -0.800 1.171 10.718 1.00 32.52 O ATOM 1215 CB PRO A 82 -2.560 -1.531 11.175 1.00 4.44 C ATOM 1216 CG PRO A 82 -2.742 -2.960 10.819 1.00 64.05 C ATOM 1217 CD PRO A 82 -1.427 -3.402 10.269 1.00 31.44 C ATOM 0 HA PRO A 82 -2.078 -0.426 9.326 1.00 42.44 H new ATOM 0 HB2 PRO A 82 -2.156 -1.422 12.181 1.00 4.44 H new ATOM 0 HB3 PRO A 82 -3.508 -0.993 11.152 1.00 4.44 H new ATOM 0 HG2 PRO A 82 -3.021 -3.550 11.692 1.00 64.05 H new ATOM 0 HG3 PRO A 82 -3.537 -3.084 10.084 1.00 64.05 H new ATOM 0 HD2 PRO A 82 -0.754 -3.741 11.056 1.00 31.44 H new ATOM 0 HD3 PRO A 82 -1.540 -4.229 9.568 1.00 31.44 H new ATOM 1225 N GLY A 83 0.487 -0.568 11.311 1.00 41.02 N ATOM 1226 CA GLY A 83 1.479 0.246 11.993 1.00 44.44 C ATOM 1227 C GLY A 83 2.111 1.285 11.096 1.00 31.44 C ATOM 1228 O GLY A 83 2.210 2.461 11.476 1.00 72.50 O ATOM 0 H GLY A 83 0.699 -1.566 11.293 1.00 41.02 H new ATOM 0 HA2 GLY A 83 1.010 0.744 12.842 1.00 44.44 H new ATOM 0 HA3 GLY A 83 2.258 -0.402 12.394 1.00 44.44 H new ATOM 1232 N LEU A 84 2.484 0.877 9.889 1.00 44.42 N ATOM 1233 CA LEU A 84 3.089 1.799 8.938 1.00 2.31 C ATOM 1234 C LEU A 84 2.050 2.813 8.484 1.00 62.15 C ATOM 1235 O LEU A 84 2.325 4.007 8.380 1.00 43.02 O ATOM 1236 CB LEU A 84 3.739 1.042 7.740 1.00 71.34 C ATOM 1237 CG LEU A 84 2.805 0.337 6.732 1.00 12.23 C ATOM 1238 CD1 LEU A 84 2.435 1.255 5.560 1.00 2.14 C ATOM 1239 CD2 LEU A 84 3.417 -0.964 6.241 1.00 12.30 C ATOM 0 H LEU A 84 2.379 -0.079 9.548 1.00 44.42 H new ATOM 0 HA LEU A 84 3.900 2.337 9.430 1.00 2.31 H new ATOM 0 HB2 LEU A 84 4.349 1.756 7.186 1.00 71.34 H new ATOM 0 HB3 LEU A 84 4.417 0.292 8.148 1.00 71.34 H new ATOM 0 HG LEU A 84 1.880 0.097 7.256 1.00 12.23 H new ATOM 0 HD11 LEU A 84 1.777 0.722 4.874 1.00 2.14 H new ATOM 0 HD12 LEU A 84 1.924 2.140 5.938 1.00 2.14 H new ATOM 0 HD13 LEU A 84 3.341 1.556 5.034 1.00 2.14 H new ATOM 0 HD21 LEU A 84 2.739 -1.440 5.533 1.00 12.30 H new ATOM 0 HD22 LEU A 84 4.368 -0.756 5.750 1.00 12.30 H new ATOM 0 HD23 LEU A 84 3.584 -1.630 7.088 1.00 12.30 H new ATOM 1251 N LEU A 85 0.842 2.330 8.267 1.00 60.34 N ATOM 1252 CA LEU A 85 -0.249 3.156 7.818 1.00 34.34 C ATOM 1253 C LEU A 85 -0.605 4.208 8.854 1.00 72.22 C ATOM 1254 O LEU A 85 -0.773 5.357 8.519 1.00 15.24 O ATOM 1255 CB LEU A 85 -1.468 2.298 7.460 1.00 50.25 C ATOM 1256 CG LEU A 85 -1.302 1.352 6.261 1.00 11.23 C ATOM 1257 CD1 LEU A 85 -2.521 0.465 6.111 1.00 1.33 C ATOM 1258 CD2 LEU A 85 -1.081 2.143 4.978 1.00 55.45 C ATOM 0 H LEU A 85 0.594 1.349 8.399 1.00 60.34 H new ATOM 0 HA LEU A 85 0.073 3.678 6.917 1.00 34.34 H new ATOM 0 HB2 LEU A 85 -1.736 1.702 8.332 1.00 50.25 H new ATOM 0 HB3 LEU A 85 -2.308 2.963 7.258 1.00 50.25 H new ATOM 0 HG LEU A 85 -0.428 0.726 6.444 1.00 11.23 H new ATOM 0 HD11 LEU A 85 -2.385 -0.198 5.257 1.00 1.33 H new ATOM 0 HD12 LEU A 85 -2.652 -0.130 7.015 1.00 1.33 H new ATOM 0 HD13 LEU A 85 -3.404 1.084 5.953 1.00 1.33 H new ATOM 0 HD21 LEU A 85 -0.966 1.454 4.141 1.00 55.45 H new ATOM 0 HD22 LEU A 85 -1.938 2.792 4.798 1.00 55.45 H new ATOM 0 HD23 LEU A 85 -0.181 2.750 5.075 1.00 55.45 H new ATOM 1270 N THR A 86 -0.636 3.818 10.114 1.00 53.41 N ATOM 1271 CA THR A 86 -1.010 4.722 11.205 1.00 72.21 C ATOM 1272 C THR A 86 -0.100 5.977 11.259 1.00 72.52 C ATOM 1273 O THR A 86 -0.596 7.121 11.332 1.00 5.42 O ATOM 1274 CB THR A 86 -1.005 3.982 12.570 1.00 73.33 C ATOM 1275 OG1 THR A 86 -1.911 2.867 12.509 1.00 32.12 O ATOM 1276 CG2 THR A 86 -1.434 4.904 13.705 1.00 2.25 C ATOM 0 H THR A 86 -0.405 2.872 10.418 1.00 53.41 H new ATOM 0 HA THR A 86 -2.025 5.064 11.002 1.00 72.21 H new ATOM 0 HB THR A 86 0.012 3.642 12.766 1.00 73.33 H new ATOM 0 HG1 THR A 86 -1.651 2.274 11.773 1.00 32.12 H new ATOM 0 HG21 THR A 86 -1.419 4.354 14.646 1.00 2.25 H new ATOM 0 HG22 THR A 86 -0.747 5.748 13.767 1.00 2.25 H new ATOM 0 HG23 THR A 86 -2.443 5.270 13.515 1.00 2.25 H new ATOM 1284 N ILE A 87 1.204 5.769 11.171 1.00 21.13 N ATOM 1285 CA ILE A 87 2.142 6.878 11.209 1.00 12.13 C ATOM 1286 C ILE A 87 2.014 7.750 9.939 1.00 54.24 C ATOM 1287 O ILE A 87 1.991 8.981 10.013 1.00 4.11 O ATOM 1288 CB ILE A 87 3.627 6.391 11.537 1.00 61.14 C ATOM 1289 CG1 ILE A 87 4.693 7.525 11.527 1.00 61.42 C ATOM 1290 CG2 ILE A 87 4.068 5.225 10.664 1.00 73.11 C ATOM 1291 CD1 ILE A 87 5.163 7.980 10.150 1.00 43.34 C ATOM 0 H ILE A 87 1.634 4.849 11.073 1.00 21.13 H new ATOM 0 HA ILE A 87 1.881 7.531 12.041 1.00 12.13 H new ATOM 0 HB ILE A 87 3.568 6.040 12.567 1.00 61.14 H new ATOM 0 HG12 ILE A 87 4.284 8.387 12.054 1.00 61.42 H new ATOM 0 HG13 ILE A 87 5.561 7.187 12.093 1.00 61.42 H new ATOM 0 HG21 ILE A 87 5.085 4.935 10.930 1.00 73.11 H new ATOM 0 HG22 ILE A 87 3.397 4.380 10.820 1.00 73.11 H new ATOM 0 HG23 ILE A 87 4.038 5.523 9.616 1.00 73.11 H new ATOM 0 HD11 ILE A 87 5.904 8.772 10.262 1.00 43.34 H new ATOM 0 HD12 ILE A 87 5.609 7.138 9.621 1.00 43.34 H new ATOM 0 HD13 ILE A 87 4.313 8.356 9.581 1.00 43.34 H new ATOM 1303 N LEU A 88 1.874 7.112 8.802 1.00 64.13 N ATOM 1304 CA LEU A 88 1.726 7.806 7.531 1.00 72.02 C ATOM 1305 C LEU A 88 0.403 8.578 7.438 1.00 22.24 C ATOM 1306 O LEU A 88 0.346 9.673 6.859 1.00 41.43 O ATOM 1307 CB LEU A 88 1.882 6.819 6.397 1.00 13.30 C ATOM 1308 CG LEU A 88 3.288 6.234 6.242 1.00 32.41 C ATOM 1309 CD1 LEU A 88 3.247 5.007 5.386 1.00 4.31 C ATOM 1310 CD2 LEU A 88 4.216 7.283 5.629 1.00 25.22 C ATOM 0 H LEU A 88 1.859 6.095 8.724 1.00 64.13 H new ATOM 0 HA LEU A 88 2.513 8.556 7.456 1.00 72.02 H new ATOM 0 HB2 LEU A 88 1.178 6.001 6.547 1.00 13.30 H new ATOM 0 HB3 LEU A 88 1.604 7.311 5.465 1.00 13.30 H new ATOM 0 HG LEU A 88 3.670 5.954 7.224 1.00 32.41 H new ATOM 0 HD11 LEU A 88 4.253 4.601 5.284 1.00 4.31 H new ATOM 0 HD12 LEU A 88 2.600 4.262 5.849 1.00 4.31 H new ATOM 0 HD13 LEU A 88 2.857 5.264 4.401 1.00 4.31 H new ATOM 0 HD21 LEU A 88 5.216 6.864 5.520 1.00 25.22 H new ATOM 0 HD22 LEU A 88 3.837 7.577 4.650 1.00 25.22 H new ATOM 0 HD23 LEU A 88 4.257 8.157 6.279 1.00 25.22 H new ATOM 1322 N HIS A 89 -0.649 8.020 8.014 1.00 23.20 N ATOM 1323 CA HIS A 89 -1.953 8.674 8.050 1.00 35.44 C ATOM 1324 C HIS A 89 -1.896 9.932 8.877 1.00 52.50 C ATOM 1325 O HIS A 89 -2.582 10.906 8.565 1.00 13.14 O ATOM 1326 CB HIS A 89 -3.085 7.751 8.553 1.00 13.54 C ATOM 1327 CG HIS A 89 -3.400 6.598 7.641 1.00 11.34 C ATOM 1328 ND1 HIS A 89 -3.159 6.440 6.314 1.00 53.10 N flip ATOM 1329 CD2 HIS A 89 -4.021 5.437 8.049 1.00 44.25 C flip ATOM 1330 CE1 HIS A 89 -3.622 5.196 5.914 1.00 4.34 C flip ATOM 1331 NE2 HIS A 89 -4.127 4.637 6.990 1.00 43.35 N flip ATOM 0 H HIS A 89 -0.627 7.107 8.468 1.00 23.20 H new ATOM 0 HA HIS A 89 -2.194 8.930 7.018 1.00 35.44 H new ATOM 0 HB2 HIS A 89 -2.809 7.359 9.532 1.00 13.54 H new ATOM 0 HB3 HIS A 89 -3.988 8.346 8.691 1.00 13.54 H new ATOM 0 HD1 HIS A 89 -2.709 7.127 5.708 1.00 53.10 H new ATOM 0 HD2 HIS A 89 -4.361 5.216 9.050 1.00 44.25 H new ATOM 0 HE1 HIS A 89 -3.577 4.773 4.921 1.00 4.34 H new ATOM 1339 N ASP A 90 -1.063 9.925 9.919 1.00 0.12 N ATOM 1340 CA ASP A 90 -0.892 11.109 10.779 1.00 51.24 C ATOM 1341 C ASP A 90 -0.303 12.265 9.978 1.00 32.31 C ATOM 1342 O ASP A 90 -0.660 13.428 10.194 1.00 72.15 O ATOM 1343 CB ASP A 90 0.034 10.786 11.966 1.00 74.35 C ATOM 1344 CG ASP A 90 0.302 11.984 12.869 1.00 41.14 C ATOM 1345 OD1 ASP A 90 -0.496 12.231 13.806 1.00 2.35 O ATOM 1346 OD2 ASP A 90 1.340 12.670 12.693 1.00 22.34 O ATOM 0 H ASP A 90 -0.497 9.121 10.191 1.00 0.12 H new ATOM 0 HA ASP A 90 -1.872 11.396 11.159 1.00 51.24 H new ATOM 0 HB2 ASP A 90 -0.412 9.987 12.558 1.00 74.35 H new ATOM 0 HB3 ASP A 90 0.983 10.409 11.585 1.00 74.35 H new ATOM 1351 N GLY A 91 0.517 11.925 8.993 1.00 52.53 N ATOM 1352 CA GLY A 91 1.140 12.931 8.155 1.00 44.13 C ATOM 1353 C GLY A 91 0.324 13.231 6.915 1.00 70.42 C ATOM 1354 O GLY A 91 0.689 14.089 6.115 1.00 4.31 O ATOM 0 H GLY A 91 0.763 10.963 8.758 1.00 52.53 H new ATOM 0 HA2 GLY A 91 1.274 13.847 8.730 1.00 44.13 H new ATOM 0 HA3 GLY A 91 2.133 12.591 7.861 1.00 44.13 H new ATOM 1358 N GLY A 92 -0.766 12.509 6.748 1.00 74.21 N ATOM 1359 CA GLY A 92 -1.640 12.711 5.613 1.00 64.13 C ATOM 1360 C GLY A 92 -1.034 12.226 4.306 1.00 35.23 C ATOM 1361 O GLY A 92 -1.116 12.913 3.277 1.00 63.11 O ATOM 0 H GLY A 92 -1.067 11.774 7.388 1.00 74.21 H new ATOM 0 HA2 GLY A 92 -2.580 12.188 5.788 1.00 64.13 H new ATOM 0 HA3 GLY A 92 -1.876 13.772 5.527 1.00 64.13 H new ATOM 1365 N TYR A 93 -0.408 11.074 4.335 1.00 63.12 N ATOM 1366 CA TYR A 93 0.176 10.509 3.139 1.00 35.14 C ATOM 1367 C TYR A 93 -0.775 9.563 2.437 1.00 4.43 C ATOM 1368 O TYR A 93 -1.374 8.695 3.058 1.00 24.24 O ATOM 1369 CB TYR A 93 1.537 9.872 3.417 1.00 54.14 C ATOM 1370 CG TYR A 93 2.628 10.903 3.591 1.00 61.35 C ATOM 1371 CD1 TYR A 93 2.819 11.567 4.794 1.00 72.11 C ATOM 1372 CD2 TYR A 93 3.453 11.228 2.530 1.00 22.21 C ATOM 1373 CE1 TYR A 93 3.806 12.526 4.923 1.00 3.11 C ATOM 1374 CE2 TYR A 93 4.440 12.173 2.652 1.00 63.33 C ATOM 1375 CZ TYR A 93 4.615 12.821 3.845 1.00 13.35 C ATOM 1376 OH TYR A 93 5.604 13.775 3.959 1.00 63.00 O ATOM 0 H TYR A 93 -0.289 10.507 5.175 1.00 63.12 H new ATOM 0 HA TYR A 93 0.355 11.333 2.448 1.00 35.14 H new ATOM 0 HB2 TYR A 93 1.472 9.260 4.316 1.00 54.14 H new ATOM 0 HB3 TYR A 93 1.798 9.205 2.595 1.00 54.14 H new ATOM 0 HD1 TYR A 93 2.189 11.332 5.639 1.00 72.11 H new ATOM 0 HD2 TYR A 93 3.317 10.726 1.583 1.00 22.21 H new ATOM 0 HE1 TYR A 93 3.943 13.041 5.862 1.00 3.11 H new ATOM 0 HE2 TYR A 93 5.076 12.405 1.811 1.00 63.33 H new ATOM 0 HH TYR A 93 6.468 13.335 4.101 1.00 63.00 H new ATOM 1386 N ARG A 94 -0.919 9.773 1.143 1.00 52.43 N ATOM 1387 CA ARG A 94 -1.839 9.012 0.307 1.00 62.41 C ATOM 1388 C ARG A 94 -1.237 7.661 -0.105 1.00 52.11 C ATOM 1389 O ARG A 94 -0.039 7.420 0.084 1.00 1.15 O ATOM 1390 CB ARG A 94 -2.250 9.829 -0.931 1.00 43.10 C ATOM 1391 CG ARG A 94 -1.156 9.985 -1.974 1.00 32.40 C ATOM 1392 CD ARG A 94 -1.540 10.977 -3.055 1.00 12.02 C ATOM 1393 NE ARG A 94 -1.423 12.360 -2.586 1.00 30.24 N ATOM 1394 CZ ARG A 94 -2.019 13.426 -3.134 1.00 50.05 C ATOM 1395 NH1 ARG A 94 -2.990 13.287 -4.036 1.00 30.41 N ATOM 1396 NH2 ARG A 94 -1.678 14.629 -2.731 1.00 25.04 N ATOM 0 H ARG A 94 -0.396 10.485 0.633 1.00 52.43 H new ATOM 0 HA ARG A 94 -2.733 8.808 0.897 1.00 62.41 H new ATOM 0 HB2 ARG A 94 -3.112 9.351 -1.396 1.00 43.10 H new ATOM 0 HB3 ARG A 94 -2.570 10.819 -0.607 1.00 43.10 H new ATOM 0 HG2 ARG A 94 -0.237 10.315 -1.489 1.00 32.40 H new ATOM 0 HG3 ARG A 94 -0.947 9.016 -2.428 1.00 32.40 H new ATOM 0 HD2 ARG A 94 -0.900 10.832 -3.926 1.00 12.02 H new ATOM 0 HD3 ARG A 94 -2.564 10.787 -3.377 1.00 12.02 H new ATOM 0 HE ARG A 94 -0.835 12.525 -1.769 1.00 30.24 H new ATOM 0 HH11 ARG A 94 -3.292 12.355 -4.321 1.00 30.41 H new ATOM 0 HH12 ARG A 94 -3.431 14.112 -4.442 1.00 30.41 H new ATOM 0 HH21 ARG A 94 -0.967 14.742 -2.009 1.00 25.04 H new ATOM 0 HH22 ARG A 94 -2.124 15.450 -3.140 1.00 25.04 H new ATOM 1410 N ASP A 95 -2.064 6.835 -0.721 1.00 12.23 N ATOM 1411 CA ASP A 95 -1.755 5.445 -1.126 1.00 72.41 C ATOM 1412 C ASP A 95 -0.498 5.352 -1.990 1.00 22.53 C ATOM 1413 O ASP A 95 0.386 4.517 -1.729 1.00 20.51 O ATOM 1414 CB ASP A 95 -2.957 4.876 -1.916 1.00 3.51 C ATOM 1415 CG ASP A 95 -3.287 5.693 -3.160 1.00 22.44 C ATOM 1416 OD1 ASP A 95 -3.562 6.910 -3.019 1.00 73.23 O ATOM 1417 OD2 ASP A 95 -3.229 5.170 -4.274 1.00 31.23 O ATOM 0 H ASP A 95 -3.014 7.111 -0.970 1.00 12.23 H new ATOM 0 HA ASP A 95 -1.571 4.869 -0.219 1.00 72.41 H new ATOM 0 HB2 ASP A 95 -2.740 3.849 -2.209 1.00 3.51 H new ATOM 0 HB3 ASP A 95 -3.831 4.844 -1.266 1.00 3.51 H new ATOM 1422 N THR A 96 -0.396 6.228 -2.967 1.00 42.32 N ATOM 1423 CA THR A 96 0.739 6.285 -3.841 1.00 54.22 C ATOM 1424 C THR A 96 2.015 6.597 -3.043 1.00 4.43 C ATOM 1425 O THR A 96 3.046 5.985 -3.258 1.00 64.32 O ATOM 1426 CB THR A 96 0.500 7.304 -4.982 1.00 73.25 C ATOM 1427 OG1 THR A 96 -0.714 6.944 -5.669 1.00 64.52 O ATOM 1428 CG2 THR A 96 1.661 7.310 -5.973 1.00 53.31 C ATOM 0 H THR A 96 -1.111 6.925 -3.173 1.00 42.32 H new ATOM 0 HA THR A 96 0.877 5.309 -4.307 1.00 54.22 H new ATOM 0 HB THR A 96 0.420 8.302 -4.552 1.00 73.25 H new ATOM 0 HG1 THR A 96 -0.539 6.189 -6.269 1.00 64.52 H new ATOM 0 HG21 THR A 96 1.462 8.036 -6.762 1.00 53.31 H new ATOM 0 HG22 THR A 96 2.581 7.580 -5.454 1.00 53.31 H new ATOM 0 HG23 THR A 96 1.770 6.318 -6.412 1.00 53.31 H new ATOM 1436 N GLU A 97 1.905 7.510 -2.085 1.00 52.44 N ATOM 1437 CA GLU A 97 3.033 7.896 -1.252 1.00 53.10 C ATOM 1438 C GLU A 97 3.496 6.746 -0.368 1.00 52.33 C ATOM 1439 O GLU A 97 4.695 6.539 -0.209 1.00 21.22 O ATOM 1440 CB GLU A 97 2.691 9.092 -0.381 1.00 21.31 C ATOM 1441 CG GLU A 97 2.420 10.360 -1.149 1.00 33.01 C ATOM 1442 CD GLU A 97 3.627 10.852 -1.900 1.00 52.52 C ATOM 1443 OE1 GLU A 97 4.438 11.590 -1.317 1.00 70.03 O ATOM 1444 OE2 GLU A 97 3.763 10.545 -3.091 1.00 73.42 O ATOM 0 H GLU A 97 1.037 7.999 -1.866 1.00 52.44 H new ATOM 0 HA GLU A 97 3.844 8.167 -1.928 1.00 53.10 H new ATOM 0 HB2 GLU A 97 1.814 8.850 0.220 1.00 21.31 H new ATOM 0 HB3 GLU A 97 3.513 9.269 0.312 1.00 21.31 H new ATOM 0 HG2 GLU A 97 1.605 10.187 -1.852 1.00 33.01 H new ATOM 0 HG3 GLU A 97 2.086 11.134 -0.458 1.00 33.01 H new ATOM 1451 N ILE A 98 2.544 5.975 0.170 1.00 44.15 N ATOM 1452 CA ILE A 98 2.883 4.876 1.090 1.00 60.42 C ATOM 1453 C ILE A 98 3.760 3.874 0.353 1.00 24.44 C ATOM 1454 O ILE A 98 4.848 3.512 0.801 1.00 60.44 O ATOM 1455 CB ILE A 98 1.602 4.077 1.535 1.00 5.44 C ATOM 1456 CG1 ILE A 98 0.462 4.964 2.063 1.00 32.32 C ATOM 1457 CG2 ILE A 98 1.937 2.988 2.535 1.00 43.02 C ATOM 1458 CD1 ILE A 98 0.842 5.965 3.123 1.00 55.32 C ATOM 0 H ILE A 98 1.546 6.086 -0.010 1.00 44.15 H new ATOM 0 HA ILE A 98 3.374 5.317 1.957 1.00 60.42 H new ATOM 0 HB ILE A 98 1.230 3.613 0.622 1.00 5.44 H new ATOM 0 HG12 ILE A 98 0.028 5.503 1.221 1.00 32.32 H new ATOM 0 HG13 ILE A 98 -0.319 4.318 2.464 1.00 32.32 H new ATOM 0 HG21 ILE A 98 1.026 2.460 2.817 1.00 43.02 H new ATOM 0 HG22 ILE A 98 2.639 2.286 2.086 1.00 43.02 H new ATOM 0 HG23 ILE A 98 2.387 3.434 3.422 1.00 43.02 H new ATOM 0 HD11 ILE A 98 -0.040 6.533 3.419 1.00 55.32 H new ATOM 0 HD12 ILE A 98 1.245 5.442 3.990 1.00 55.32 H new ATOM 0 HD13 ILE A 98 1.596 6.645 2.727 1.00 55.32 H new ATOM 1470 N MET A 99 3.301 3.499 -0.816 1.00 43.21 N ATOM 1471 CA MET A 99 3.975 2.519 -1.631 1.00 2.31 C ATOM 1472 C MET A 99 5.206 3.090 -2.324 1.00 70.24 C ATOM 1473 O MET A 99 6.086 2.347 -2.741 1.00 75.23 O ATOM 1474 CB MET A 99 3.005 1.898 -2.630 1.00 54.50 C ATOM 1475 CG MET A 99 1.779 1.289 -1.977 1.00 31.42 C ATOM 1476 SD MET A 99 0.709 0.441 -3.140 1.00 3.25 S ATOM 1477 CE MET A 99 -0.702 0.098 -2.091 1.00 64.44 C ATOM 0 H MET A 99 2.445 3.867 -1.231 1.00 43.21 H new ATOM 0 HA MET A 99 4.335 1.732 -0.968 1.00 2.31 H new ATOM 0 HB2 MET A 99 2.688 2.661 -3.341 1.00 54.50 H new ATOM 0 HB3 MET A 99 3.525 1.128 -3.200 1.00 54.50 H new ATOM 0 HG2 MET A 99 2.097 0.587 -1.206 1.00 31.42 H new ATOM 0 HG3 MET A 99 1.212 2.075 -1.478 1.00 31.42 H new ATOM 0 HE1 MET A 99 -1.599 0.011 -2.704 1.00 64.44 H new ATOM 0 HE2 MET A 99 -0.538 -0.836 -1.554 1.00 64.44 H new ATOM 0 HE3 MET A 99 -0.829 0.910 -1.376 1.00 64.44 H new ATOM 1487 N ARG A 100 5.269 4.413 -2.407 1.00 64.33 N ATOM 1488 CA ARG A 100 6.329 5.124 -3.117 1.00 52.14 C ATOM 1489 C ARG A 100 7.695 4.742 -2.576 1.00 34.44 C ATOM 1490 O ARG A 100 8.474 4.073 -3.251 1.00 32.01 O ATOM 1491 CB ARG A 100 6.091 6.633 -2.988 1.00 4.31 C ATOM 1492 CG ARG A 100 7.060 7.533 -3.718 1.00 45.04 C ATOM 1493 CD ARG A 100 6.655 8.978 -3.505 1.00 3.10 C ATOM 1494 NE ARG A 100 7.521 9.924 -4.206 1.00 3.12 N ATOM 1495 CZ ARG A 100 7.161 11.174 -4.535 1.00 34.52 C ATOM 1496 NH1 ARG A 100 5.931 11.618 -4.254 1.00 3.24 N ATOM 1497 NH2 ARG A 100 8.034 11.976 -5.147 1.00 65.02 N ATOM 0 H ARG A 100 4.579 5.031 -1.979 1.00 64.33 H new ATOM 0 HA ARG A 100 6.308 4.845 -4.170 1.00 52.14 H new ATOM 0 HB2 ARG A 100 5.085 6.852 -3.347 1.00 4.31 H new ATOM 0 HB3 ARG A 100 6.115 6.893 -1.930 1.00 4.31 H new ATOM 0 HG2 ARG A 100 8.074 7.369 -3.352 1.00 45.04 H new ATOM 0 HG3 ARG A 100 7.063 7.297 -4.782 1.00 45.04 H new ATOM 0 HD2 ARG A 100 5.628 9.115 -3.843 1.00 3.10 H new ATOM 0 HD3 ARG A 100 6.672 9.201 -2.438 1.00 3.10 H new ATOM 0 HE ARG A 100 8.459 9.614 -4.461 1.00 3.12 H new ATOM 0 HH11 ARG A 100 5.262 11.006 -3.788 1.00 3.24 H new ATOM 0 HH12 ARG A 100 5.662 12.569 -4.506 1.00 3.24 H new ATOM 0 HH21 ARG A 100 8.972 11.638 -5.363 1.00 65.02 H new ATOM 0 HH22 ARG A 100 7.764 12.927 -5.399 1.00 65.02 H new ATOM 1511 N TRP A 101 7.961 5.122 -1.354 1.00 10.34 N ATOM 1512 CA TRP A 101 9.230 4.816 -0.736 1.00 64.34 C ATOM 1513 C TRP A 101 9.393 3.326 -0.452 1.00 21.12 C ATOM 1514 O TRP A 101 10.495 2.791 -0.551 1.00 51.04 O ATOM 1515 CB TRP A 101 9.504 5.701 0.491 1.00 75.24 C ATOM 1516 CG TRP A 101 8.376 5.776 1.471 1.00 71.23 C ATOM 1517 CD1 TRP A 101 7.422 6.751 1.541 1.00 74.04 C ATOM 1518 CD2 TRP A 101 8.080 4.853 2.517 1.00 32.11 C ATOM 1519 NE1 TRP A 101 6.565 6.487 2.568 1.00 1.02 N ATOM 1520 CE2 TRP A 101 6.947 5.329 3.175 1.00 54.11 C ATOM 1521 CE3 TRP A 101 8.660 3.665 2.962 1.00 65.01 C ATOM 1522 CZ2 TRP A 101 6.392 4.677 4.238 1.00 72.04 C ATOM 1523 CZ3 TRP A 101 8.096 3.013 4.024 1.00 62.45 C ATOM 1524 CH2 TRP A 101 6.966 3.522 4.655 1.00 2.54 C ATOM 0 H TRP A 101 7.315 5.646 -0.763 1.00 10.34 H new ATOM 0 HA TRP A 101 10.005 5.063 -1.462 1.00 64.34 H new ATOM 0 HB2 TRP A 101 10.389 5.324 1.004 1.00 75.24 H new ATOM 0 HB3 TRP A 101 9.739 6.709 0.150 1.00 75.24 H new ATOM 0 HD1 TRP A 101 7.356 7.604 0.881 1.00 74.04 H new ATOM 0 HE1 TRP A 101 5.768 7.063 2.838 1.00 1.02 H new ATOM 0 HE3 TRP A 101 9.539 3.267 2.477 1.00 65.01 H new ATOM 0 HZ2 TRP A 101 5.518 5.071 4.734 1.00 72.04 H new ATOM 0 HZ3 TRP A 101 8.534 2.091 4.377 1.00 62.45 H new ATOM 0 HH2 TRP A 101 6.539 2.988 5.491 1.00 2.54 H new ATOM 1535 N LEU A 102 8.280 2.663 -0.147 1.00 64.41 N ATOM 1536 CA LEU A 102 8.265 1.236 0.156 1.00 13.11 C ATOM 1537 C LEU A 102 8.770 0.372 -0.995 1.00 74.21 C ATOM 1538 O LEU A 102 9.490 -0.598 -0.773 1.00 43.43 O ATOM 1539 CB LEU A 102 6.860 0.794 0.577 1.00 0.00 C ATOM 1540 CG LEU A 102 6.554 0.785 2.067 1.00 3.11 C ATOM 1541 CD1 LEU A 102 5.080 0.556 2.301 1.00 63.55 C ATOM 1542 CD2 LEU A 102 7.348 -0.305 2.751 1.00 65.53 C ATOM 0 H LEU A 102 7.361 3.103 -0.103 1.00 64.41 H new ATOM 0 HA LEU A 102 8.958 1.088 0.984 1.00 13.11 H new ATOM 0 HB2 LEU A 102 6.139 1.448 0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 102 6.692 -0.211 0.191 1.00 0.00 H new ATOM 0 HG LEU A 102 6.833 1.753 2.483 1.00 3.11 H new ATOM 0 HD11 LEU A 102 4.878 0.552 3.372 1.00 63.55 H new ATOM 0 HD12 LEU A 102 4.508 1.353 1.827 1.00 63.55 H new ATOM 0 HD13 LEU A 102 4.788 -0.403 1.874 1.00 63.55 H new ATOM 0 HD21 LEU A 102 7.123 -0.304 3.818 1.00 65.53 H new ATOM 0 HD22 LEU A 102 7.081 -1.272 2.324 1.00 65.53 H new ATOM 0 HD23 LEU A 102 8.413 -0.126 2.605 1.00 65.53 H new ATOM 1554 N PHE A 103 8.406 0.714 -2.206 1.00 74.45 N ATOM 1555 CA PHE A 103 8.816 -0.074 -3.353 1.00 54.41 C ATOM 1556 C PHE A 103 10.085 0.447 -4.012 1.00 63.33 C ATOM 1557 O PHE A 103 10.562 -0.135 -4.991 1.00 65.23 O ATOM 1558 CB PHE A 103 7.689 -0.207 -4.375 1.00 34.55 C ATOM 1559 CG PHE A 103 6.556 -1.101 -3.942 1.00 2.42 C ATOM 1560 CD1 PHE A 103 5.534 -0.627 -3.142 1.00 33.33 C ATOM 1561 CD2 PHE A 103 6.505 -2.412 -4.362 1.00 74.20 C ATOM 1562 CE1 PHE A 103 4.484 -1.440 -2.777 1.00 63.41 C ATOM 1563 CE2 PHE A 103 5.465 -3.232 -3.993 1.00 73.33 C ATOM 1564 CZ PHE A 103 4.453 -2.744 -3.203 1.00 53.40 C ATOM 0 H PHE A 103 7.830 1.526 -2.427 1.00 74.45 H new ATOM 0 HA PHE A 103 9.048 -1.066 -2.966 1.00 54.41 H new ATOM 0 HB2 PHE A 103 7.291 0.785 -4.589 1.00 34.55 H new ATOM 0 HB3 PHE A 103 8.104 -0.592 -5.306 1.00 34.55 H new ATOM 0 HD1 PHE A 103 5.559 0.396 -2.798 1.00 33.33 H new ATOM 0 HD2 PHE A 103 7.293 -2.801 -4.990 1.00 74.20 H new ATOM 0 HE1 PHE A 103 3.688 -1.053 -2.158 1.00 63.41 H new ATOM 0 HE2 PHE A 103 5.444 -4.260 -4.324 1.00 73.33 H new ATOM 0 HZ PHE A 103 3.633 -3.386 -2.917 1.00 53.40 H new ATOM 1574 N THR A 104 10.635 1.511 -3.496 1.00 52.32 N ATOM 1575 CA THR A 104 11.862 2.036 -4.044 1.00 32.34 C ATOM 1576 C THR A 104 13.064 1.338 -3.370 1.00 62.05 C ATOM 1577 O THR A 104 13.187 1.373 -2.141 1.00 54.24 O ATOM 1578 CB THR A 104 11.971 3.572 -3.850 1.00 51.31 C ATOM 1579 OG1 THR A 104 10.835 4.237 -4.435 1.00 10.01 O ATOM 1580 CG2 THR A 104 13.235 4.111 -4.507 1.00 71.12 C ATOM 0 H THR A 104 10.259 2.031 -2.703 1.00 52.32 H new ATOM 0 HA THR A 104 11.864 1.838 -5.116 1.00 32.34 H new ATOM 0 HB THR A 104 12.003 3.766 -2.778 1.00 51.31 H new ATOM 0 HG1 THR A 104 10.089 4.229 -3.800 1.00 10.01 H new ATOM 0 HG21 THR A 104 13.291 5.189 -4.359 1.00 71.12 H new ATOM 0 HG22 THR A 104 14.108 3.637 -4.059 1.00 71.12 H new ATOM 0 HG23 THR A 104 13.212 3.892 -5.575 1.00 71.12 H new ATOM 1588 N PRO A 105 13.927 0.650 -4.145 1.00 65.51 N ATOM 1589 CA PRO A 105 15.121 0.008 -3.601 1.00 64.32 C ATOM 1590 C PRO A 105 16.117 1.050 -3.108 1.00 74.40 C ATOM 1591 O PRO A 105 16.440 2.008 -3.828 1.00 41.10 O ATOM 1592 CB PRO A 105 15.713 -0.758 -4.794 1.00 62.33 C ATOM 1593 CG PRO A 105 14.635 -0.788 -5.820 1.00 51.21 C ATOM 1594 CD PRO A 105 13.815 0.443 -5.597 1.00 65.05 C ATOM 0 HA PRO A 105 14.893 -0.635 -2.751 1.00 64.32 H new ATOM 0 HB2 PRO A 105 16.605 -0.261 -5.176 1.00 62.33 H new ATOM 0 HB3 PRO A 105 16.009 -1.767 -4.505 1.00 62.33 H new ATOM 0 HG2 PRO A 105 15.055 -0.800 -6.826 1.00 51.21 H new ATOM 0 HG3 PRO A 105 14.025 -1.686 -5.719 1.00 51.21 H new ATOM 0 HD2 PRO A 105 14.202 1.294 -6.158 1.00 65.05 H new ATOM 0 HD3 PRO A 105 12.780 0.301 -5.907 1.00 65.05 H new ATOM 1602 N ASP A 106 16.590 0.892 -1.902 1.00 62.21 N ATOM 1603 CA ASP A 106 17.524 1.849 -1.355 1.00 24.12 C ATOM 1604 C ASP A 106 18.933 1.276 -1.415 1.00 11.25 C ATOM 1605 O ASP A 106 19.181 0.188 -0.886 1.00 52.41 O ATOM 1606 CB ASP A 106 17.162 2.225 0.086 1.00 11.23 C ATOM 1607 CG ASP A 106 17.964 3.406 0.593 1.00 20.32 C ATOM 1608 OD1 ASP A 106 19.147 3.243 0.953 1.00 44.21 O ATOM 1609 OD2 ASP A 106 17.425 4.540 0.640 1.00 51.14 O ATOM 0 H ASP A 106 16.350 0.119 -1.281 1.00 62.21 H new ATOM 0 HA ASP A 106 17.475 2.759 -1.954 1.00 24.12 H new ATOM 0 HB2 ASP A 106 16.099 2.460 0.141 1.00 11.23 H new ATOM 0 HB3 ASP A 106 17.333 1.367 0.736 1.00 11.23 H new ATOM 1614 N PRO A 107 19.876 1.991 -2.057 1.00 10.14 N ATOM 1615 CA PRO A 107 21.269 1.535 -2.232 1.00 14.42 C ATOM 1616 C PRO A 107 22.003 1.299 -0.916 1.00 71.40 C ATOM 1617 O PRO A 107 22.951 0.526 -0.860 1.00 13.13 O ATOM 1618 CB PRO A 107 21.938 2.687 -2.990 1.00 54.44 C ATOM 1619 CG PRO A 107 21.047 3.855 -2.771 1.00 61.51 C ATOM 1620 CD PRO A 107 19.666 3.303 -2.683 1.00 70.33 C ATOM 0 HA PRO A 107 21.297 0.575 -2.748 1.00 14.42 H new ATOM 0 HB2 PRO A 107 22.942 2.879 -2.611 1.00 54.44 H new ATOM 0 HB3 PRO A 107 22.036 2.458 -4.051 1.00 54.44 H new ATOM 0 HG2 PRO A 107 21.315 4.385 -1.857 1.00 61.51 H new ATOM 0 HG3 PRO A 107 21.131 4.569 -3.590 1.00 61.51 H new ATOM 0 HD2 PRO A 107 19.015 3.938 -2.082 1.00 70.33 H new ATOM 0 HD3 PRO A 107 19.204 3.212 -3.666 1.00 70.33 H new ATOM 1628 N SER A 108 21.563 1.943 0.134 1.00 40.32 N ATOM 1629 CA SER A 108 22.220 1.821 1.396 1.00 5.44 C ATOM 1630 C SER A 108 21.425 0.925 2.341 1.00 62.03 C ATOM 1631 O SER A 108 21.723 0.826 3.547 1.00 42.33 O ATOM 1632 CB SER A 108 22.481 3.202 1.974 1.00 23.42 C ATOM 1633 OG SER A 108 23.300 3.956 1.080 1.00 62.24 O ATOM 0 H SER A 108 20.749 2.558 0.133 1.00 40.32 H new ATOM 0 HA SER A 108 23.186 1.335 1.258 1.00 5.44 H new ATOM 0 HB2 SER A 108 21.537 3.720 2.141 1.00 23.42 H new ATOM 0 HB3 SER A 108 22.972 3.113 2.943 1.00 23.42 H new ATOM 0 HG SER A 108 23.463 4.846 1.457 1.00 62.24 H new ATOM 1639 N LEU A 109 20.425 0.265 1.796 1.00 63.44 N ATOM 1640 CA LEU A 109 19.674 -0.691 2.539 1.00 63.23 C ATOM 1641 C LEU A 109 20.104 -2.076 2.115 1.00 72.22 C ATOM 1642 O LEU A 109 20.059 -2.422 0.927 1.00 21.15 O ATOM 1643 CB LEU A 109 18.175 -0.523 2.319 1.00 32.20 C ATOM 1644 CG LEU A 109 17.282 -1.470 3.120 1.00 40.12 C ATOM 1645 CD1 LEU A 109 17.376 -1.181 4.606 1.00 34.54 C ATOM 1646 CD2 LEU A 109 15.854 -1.388 2.648 1.00 32.32 C ATOM 0 H LEU A 109 20.121 0.384 0.830 1.00 63.44 H new ATOM 0 HA LEU A 109 19.867 -0.539 3.601 1.00 63.23 H new ATOM 0 HB2 LEU A 109 17.902 0.503 2.567 1.00 32.20 H new ATOM 0 HB3 LEU A 109 17.963 -0.662 1.259 1.00 32.20 H new ATOM 0 HG LEU A 109 17.637 -2.487 2.953 1.00 40.12 H new ATOM 0 HD11 LEU A 109 16.731 -1.869 5.152 1.00 34.54 H new ATOM 0 HD12 LEU A 109 18.406 -1.310 4.937 1.00 34.54 H new ATOM 0 HD13 LEU A 109 17.058 -0.156 4.798 1.00 34.54 H new ATOM 0 HD21 LEU A 109 15.238 -2.071 3.233 1.00 32.32 H new ATOM 0 HD22 LEU A 109 15.487 -0.369 2.774 1.00 32.32 H new ATOM 0 HD23 LEU A 109 15.802 -1.664 1.595 1.00 32.32 H new ATOM 1658 N THR A 110 20.532 -2.840 3.060 1.00 41.20 N ATOM 1659 CA THR A 110 20.964 -4.188 2.828 1.00 3.25 C ATOM 1660 C THR A 110 20.282 -5.072 3.852 1.00 23.34 C ATOM 1661 O THR A 110 20.548 -4.974 5.045 1.00 63.40 O ATOM 1662 CB THR A 110 22.502 -4.296 2.930 1.00 31.15 C ATOM 1663 OG1 THR A 110 23.108 -3.347 2.023 1.00 31.43 O ATOM 1664 CG2 THR A 110 22.982 -5.694 2.575 1.00 45.41 C ATOM 0 H THR A 110 20.595 -2.547 4.035 1.00 41.20 H new ATOM 0 HA THR A 110 20.692 -4.507 1.822 1.00 3.25 H new ATOM 0 HB THR A 110 22.791 -4.081 3.959 1.00 31.15 H new ATOM 0 HG1 THR A 110 24.084 -3.412 2.086 1.00 31.43 H new ATOM 0 HG21 THR A 110 24.068 -5.737 2.656 1.00 45.41 H new ATOM 0 HG22 THR A 110 22.538 -6.416 3.260 1.00 45.41 H new ATOM 0 HG23 THR A 110 22.685 -5.932 1.554 1.00 45.41 H new ATOM 1672 N ILE A 111 19.389 -5.894 3.397 1.00 72.40 N ATOM 1673 CA ILE A 111 18.555 -6.674 4.287 1.00 35.42 C ATOM 1674 C ILE A 111 18.589 -8.146 3.977 1.00 41.11 C ATOM 1675 O ILE A 111 18.712 -8.549 2.823 1.00 62.54 O ATOM 1676 CB ILE A 111 17.092 -6.171 4.271 1.00 54.40 C ATOM 1677 CG1 ILE A 111 16.610 -5.942 2.815 1.00 52.13 C ATOM 1678 CG2 ILE A 111 16.955 -4.919 5.123 1.00 15.11 C ATOM 1679 CD1 ILE A 111 15.170 -5.496 2.689 1.00 32.34 C ATOM 0 H ILE A 111 19.210 -6.050 2.405 1.00 72.40 H new ATOM 0 HA ILE A 111 18.972 -6.537 5.285 1.00 35.42 H new ATOM 0 HB ILE A 111 16.448 -6.935 4.707 1.00 54.40 H new ATOM 0 HG12 ILE A 111 17.250 -5.193 2.348 1.00 52.13 H new ATOM 0 HG13 ILE A 111 16.740 -6.867 2.254 1.00 52.13 H new ATOM 0 HG21 ILE A 111 15.920 -4.576 5.102 1.00 15.11 H new ATOM 0 HG22 ILE A 111 17.242 -5.145 6.150 1.00 15.11 H new ATOM 0 HG23 ILE A 111 17.604 -4.137 4.728 1.00 15.11 H new ATOM 0 HD11 ILE A 111 14.922 -5.361 1.636 1.00 32.34 H new ATOM 0 HD12 ILE A 111 14.516 -6.253 3.122 1.00 32.34 H new ATOM 0 HD13 ILE A 111 15.034 -4.553 3.218 1.00 32.34 H new ATOM 1805 N VAL A 120 20.514 -8.947 0.835 1.00 52.45 N ATOM 1806 CA VAL A 120 20.381 -8.333 -0.456 1.00 54.30 C ATOM 1807 C VAL A 120 20.571 -6.843 -0.281 1.00 2.24 C ATOM 1808 O VAL A 120 19.870 -6.211 0.528 1.00 33.14 O ATOM 1809 CB VAL A 120 18.977 -8.593 -1.079 1.00 64.32 C ATOM 1810 CG1 VAL A 120 18.861 -7.964 -2.464 1.00 63.01 C ATOM 1811 CG2 VAL A 120 18.681 -10.081 -1.154 1.00 3.43 C ATOM 0 HA VAL A 120 21.126 -8.759 -1.127 1.00 54.30 H new ATOM 0 HB VAL A 120 18.240 -8.125 -0.427 1.00 64.32 H new ATOM 0 HG11 VAL A 120 17.870 -8.163 -2.872 1.00 63.01 H new ATOM 0 HG12 VAL A 120 19.013 -6.887 -2.388 1.00 63.01 H new ATOM 0 HG13 VAL A 120 19.617 -8.392 -3.122 1.00 63.01 H new ATOM 0 HG21 VAL A 120 17.695 -10.234 -1.593 1.00 3.43 H new ATOM 0 HG22 VAL A 120 19.433 -10.571 -1.772 1.00 3.43 H new ATOM 0 HG23 VAL A 120 18.702 -10.507 -0.151 1.00 3.43 H new ATOM 1821 N SER A 121 21.536 -6.301 -0.958 1.00 31.51 N ATOM 1822 CA SER A 121 21.784 -4.900 -0.912 1.00 2.14 C ATOM 1823 C SER A 121 20.983 -4.246 -2.024 1.00 4.14 C ATOM 1824 O SER A 121 20.741 -4.880 -3.062 1.00 11.23 O ATOM 1825 CB SER A 121 23.278 -4.621 -1.071 1.00 50.32 C ATOM 1826 OG SER A 121 23.596 -3.301 -0.675 1.00 52.44 O ATOM 0 H SER A 121 22.174 -6.823 -1.559 1.00 31.51 H new ATOM 0 HA SER A 121 21.478 -4.489 0.050 1.00 2.14 H new ATOM 0 HB2 SER A 121 23.849 -5.331 -0.472 1.00 50.32 H new ATOM 0 HB3 SER A 121 23.571 -4.772 -2.110 1.00 50.32 H new ATOM 0 HG SER A 121 23.333 -3.168 0.260 1.00 52.44 H new ATOM 1832 N ASN A 122 20.549 -3.016 -1.788 1.00 52.35 N ATOM 1833 CA ASN A 122 19.734 -2.241 -2.727 1.00 44.30 C ATOM 1834 C ASN A 122 18.386 -2.926 -2.892 1.00 71.24 C ATOM 1835 O ASN A 122 18.046 -3.474 -3.945 1.00 43.13 O ATOM 1836 CB ASN A 122 20.453 -2.000 -4.088 1.00 33.54 C ATOM 1837 CG ASN A 122 19.709 -1.048 -5.035 1.00 13.21 C ATOM 1838 OD1 ASN A 122 19.895 0.165 -4.981 1.00 0.44 O ATOM 1839 ND2 ASN A 122 18.904 -1.586 -5.925 1.00 23.24 N ATOM 0 H ASN A 122 20.755 -2.515 -0.924 1.00 52.35 H new ATOM 0 HA ASN A 122 19.575 -1.245 -2.315 1.00 44.30 H new ATOM 0 HB2 ASN A 122 21.447 -1.597 -3.894 1.00 33.54 H new ATOM 0 HB3 ASN A 122 20.589 -2.959 -4.588 1.00 33.54 H new ATOM 0 HD21 ASN A 122 18.414 -0.992 -6.595 1.00 23.24 H new ATOM 0 HD22 ASN A 122 18.769 -2.597 -5.946 1.00 23.24 H new ATOM 1846 N ALA A 123 17.666 -2.978 -1.808 1.00 23.51 N ATOM 1847 CA ALA A 123 16.383 -3.612 -1.788 1.00 11.34 C ATOM 1848 C ALA A 123 15.341 -2.636 -1.308 1.00 72.31 C ATOM 1849 O ALA A 123 15.676 -1.568 -0.777 1.00 24.30 O ATOM 1850 CB ALA A 123 16.414 -4.847 -0.901 1.00 3.02 C ATOM 0 H ALA A 123 17.954 -2.581 -0.914 1.00 23.51 H new ATOM 0 HA ALA A 123 16.127 -3.929 -2.799 1.00 11.34 H new ATOM 0 HB1 ALA A 123 15.431 -5.317 -0.897 1.00 3.02 H new ATOM 0 HB2 ALA A 123 17.151 -5.552 -1.285 1.00 3.02 H new ATOM 0 HB3 ALA A 123 16.682 -4.558 0.115 1.00 3.02 H new ATOM 1856 N ARG A 124 14.106 -2.971 -1.530 1.00 34.34 N ATOM 1857 CA ARG A 124 12.995 -2.156 -1.114 1.00 53.41 C ATOM 1858 C ARG A 124 12.598 -2.515 0.329 1.00 1.54 C ATOM 1859 O ARG A 124 12.659 -3.690 0.717 1.00 25.53 O ATOM 1860 CB ARG A 124 11.816 -2.367 -2.071 1.00 52.02 C ATOM 1861 CG ARG A 124 11.343 -3.804 -2.141 1.00 61.41 C ATOM 1862 CD ARG A 124 10.209 -3.984 -3.110 1.00 22.50 C ATOM 1863 NE ARG A 124 9.788 -5.381 -3.182 1.00 30.11 N ATOM 1864 CZ ARG A 124 8.955 -5.882 -4.105 1.00 30.32 C ATOM 1865 NH1 ARG A 124 8.539 -5.120 -5.122 1.00 2.11 N ATOM 1866 NH2 ARG A 124 8.572 -7.153 -4.042 1.00 11.44 N ATOM 0 H ARG A 124 13.834 -3.828 -2.011 1.00 34.34 H new ATOM 0 HA ARG A 124 13.281 -1.105 -1.141 1.00 53.41 H new ATOM 0 HB2 ARG A 124 10.986 -1.735 -1.757 1.00 52.02 H new ATOM 0 HB3 ARG A 124 12.106 -2.039 -3.069 1.00 52.02 H new ATOM 0 HG2 ARG A 124 12.175 -4.444 -2.435 1.00 61.41 H new ATOM 0 HG3 ARG A 124 11.026 -4.129 -1.150 1.00 61.41 H new ATOM 0 HD2 ARG A 124 9.366 -3.363 -2.806 1.00 22.50 H new ATOM 0 HD3 ARG A 124 10.515 -3.643 -4.099 1.00 22.50 H new ATOM 0 HE ARG A 124 10.155 -6.022 -2.478 1.00 30.11 H new ATOM 0 HH11 ARG A 124 8.856 -4.153 -5.198 1.00 2.11 H new ATOM 0 HH12 ARG A 124 7.905 -5.505 -5.822 1.00 2.11 H new ATOM 0 HH21 ARG A 124 8.912 -7.751 -3.289 1.00 11.44 H new ATOM 0 HH22 ARG A 124 7.938 -7.530 -4.746 1.00 11.44 H new ATOM 1880 N PRO A 125 12.199 -1.519 1.146 1.00 43.10 N ATOM 1881 CA PRO A 125 11.793 -1.736 2.550 1.00 4.13 C ATOM 1882 C PRO A 125 10.627 -2.744 2.730 1.00 4.24 C ATOM 1883 O PRO A 125 10.434 -3.274 3.823 1.00 54.53 O ATOM 1884 CB PRO A 125 11.376 -0.341 3.032 1.00 42.21 C ATOM 1885 CG PRO A 125 12.084 0.606 2.127 1.00 12.31 C ATOM 1886 CD PRO A 125 12.168 -0.078 0.793 1.00 21.24 C ATOM 0 HA PRO A 125 12.610 -2.180 3.118 1.00 4.13 H new ATOM 0 HB2 PRO A 125 10.296 -0.210 2.974 1.00 42.21 H new ATOM 0 HB3 PRO A 125 11.661 -0.181 4.072 1.00 42.21 H new ATOM 0 HG2 PRO A 125 11.542 1.549 2.048 1.00 12.31 H new ATOM 0 HG3 PRO A 125 13.078 0.840 2.508 1.00 12.31 H new ATOM 0 HD2 PRO A 125 11.311 0.163 0.163 1.00 21.24 H new ATOM 0 HD3 PRO A 125 13.061 0.220 0.244 1.00 21.24 H new ATOM 1894 N VAL A 126 9.871 -3.017 1.657 1.00 55.14 N ATOM 1895 CA VAL A 126 8.764 -3.994 1.716 1.00 50.20 C ATOM 1896 C VAL A 126 9.297 -5.382 2.094 1.00 61.33 C ATOM 1897 O VAL A 126 8.730 -6.074 2.931 1.00 40.43 O ATOM 1898 CB VAL A 126 7.998 -4.117 0.363 1.00 24.32 C ATOM 1899 CG1 VAL A 126 6.904 -5.156 0.466 1.00 64.43 C ATOM 1900 CG2 VAL A 126 7.389 -2.802 -0.049 1.00 41.14 C ATOM 0 H VAL A 126 10.000 -2.582 0.744 1.00 55.14 H new ATOM 0 HA VAL A 126 8.071 -3.625 2.472 1.00 50.20 H new ATOM 0 HB VAL A 126 8.724 -4.419 -0.392 1.00 24.32 H new ATOM 0 HG11 VAL A 126 6.380 -5.228 -0.487 1.00 64.43 H new ATOM 0 HG12 VAL A 126 7.342 -6.123 0.713 1.00 64.43 H new ATOM 0 HG13 VAL A 126 6.200 -4.867 1.246 1.00 64.43 H new ATOM 0 HG21 VAL A 126 6.863 -2.925 -0.996 1.00 41.14 H new ATOM 0 HG22 VAL A 126 6.686 -2.471 0.716 1.00 41.14 H new ATOM 0 HG23 VAL A 126 8.176 -2.057 -0.165 1.00 41.14 H new ATOM 1910 N ASP A 127 10.421 -5.744 1.512 1.00 21.23 N ATOM 1911 CA ASP A 127 11.044 -7.044 1.757 1.00 40.42 C ATOM 1912 C ASP A 127 11.442 -7.196 3.210 1.00 11.34 C ATOM 1913 O ASP A 127 11.372 -8.293 3.776 1.00 70.12 O ATOM 1914 CB ASP A 127 12.257 -7.252 0.847 1.00 23.31 C ATOM 1915 CG ASP A 127 11.884 -7.579 -0.582 1.00 54.21 C ATOM 1916 OD1 ASP A 127 11.197 -6.775 -1.248 1.00 10.35 O ATOM 1917 OD2 ASP A 127 12.241 -8.681 -1.050 1.00 70.42 O ATOM 0 H ASP A 127 10.933 -5.154 0.857 1.00 21.23 H new ATOM 0 HA ASP A 127 10.305 -7.811 1.525 1.00 40.42 H new ATOM 0 HB2 ASP A 127 12.870 -6.350 0.858 1.00 23.31 H new ATOM 0 HB3 ASP A 127 12.870 -8.059 1.249 1.00 23.31 H new ATOM 1922 N ALA A 128 11.809 -6.083 3.815 1.00 4.44 N ATOM 1923 CA ALA A 128 12.218 -6.041 5.205 1.00 2.54 C ATOM 1924 C ALA A 128 11.021 -6.287 6.112 1.00 31.00 C ATOM 1925 O ALA A 128 11.123 -6.965 7.136 1.00 55.13 O ATOM 1926 CB ALA A 128 12.859 -4.692 5.524 1.00 33.41 C ATOM 0 H ALA A 128 11.832 -5.175 3.351 1.00 4.44 H new ATOM 0 HA ALA A 128 12.954 -6.826 5.380 1.00 2.54 H new ATOM 0 HB1 ALA A 128 13.162 -4.672 6.571 1.00 33.41 H new ATOM 0 HB2 ALA A 128 13.733 -4.546 4.890 1.00 33.41 H new ATOM 0 HB3 ALA A 128 12.139 -3.894 5.339 1.00 33.41 H new ATOM 1932 N LEU A 129 9.879 -5.779 5.700 1.00 63.21 N ATOM 1933 CA LEU A 129 8.660 -5.858 6.453 1.00 53.22 C ATOM 1934 C LEU A 129 8.233 -7.304 6.714 1.00 74.21 C ATOM 1935 O LEU A 129 7.901 -7.664 7.851 1.00 14.15 O ATOM 1936 CB LEU A 129 7.609 -5.157 5.643 1.00 62.52 C ATOM 1937 CG LEU A 129 6.189 -5.433 6.005 1.00 34.12 C ATOM 1938 CD1 LEU A 129 5.840 -4.862 7.374 1.00 32.44 C ATOM 1939 CD2 LEU A 129 5.301 -4.916 4.915 1.00 55.34 C ATOM 0 H LEU A 129 9.777 -5.290 4.811 1.00 63.21 H new ATOM 0 HA LEU A 129 8.802 -5.396 7.430 1.00 53.22 H new ATOM 0 HB2 LEU A 129 7.778 -4.083 5.723 1.00 62.52 H new ATOM 0 HB3 LEU A 129 7.751 -5.425 4.596 1.00 62.52 H new ATOM 0 HG LEU A 129 6.034 -6.509 6.091 1.00 34.12 H new ATOM 0 HD11 LEU A 129 4.798 -5.082 7.605 1.00 32.44 H new ATOM 0 HD12 LEU A 129 6.482 -5.313 8.131 1.00 32.44 H new ATOM 0 HD13 LEU A 129 5.990 -3.782 7.367 1.00 32.44 H new ATOM 0 HD21 LEU A 129 4.260 -5.113 5.170 1.00 55.34 H new ATOM 0 HD22 LEU A 129 5.450 -3.842 4.803 1.00 55.34 H new ATOM 0 HD23 LEU A 129 5.546 -5.416 3.978 1.00 55.34 H new ATOM 1951 N HIS A 130 8.328 -8.136 5.695 1.00 21.21 N ATOM 1952 CA HIS A 130 7.911 -9.536 5.800 1.00 51.25 C ATOM 1953 C HIS A 130 8.886 -10.323 6.654 1.00 23.52 C ATOM 1954 O HIS A 130 8.588 -11.422 7.127 1.00 73.44 O ATOM 1955 CB HIS A 130 7.842 -10.205 4.422 1.00 54.11 C ATOM 1956 CG HIS A 130 6.774 -9.722 3.496 1.00 75.53 C ATOM 1957 ND1 HIS A 130 5.662 -10.463 3.163 1.00 73.03 N ATOM 1958 CD2 HIS A 130 6.690 -8.581 2.778 1.00 45.22 C ATOM 1959 CE1 HIS A 130 4.957 -9.766 2.277 1.00 70.52 C ATOM 1960 NE2 HIS A 130 5.540 -8.616 2.006 1.00 42.44 N ATOM 0 H HIS A 130 8.691 -7.873 4.779 1.00 21.21 H new ATOM 0 HA HIS A 130 6.921 -9.537 6.257 1.00 51.25 H new ATOM 0 HB2 HIS A 130 8.805 -10.071 3.930 1.00 54.11 H new ATOM 0 HB3 HIS A 130 7.706 -11.276 4.570 1.00 54.11 H new ATOM 0 HD1 HIS A 130 5.422 -11.384 3.531 1.00 73.03 H new ATOM 0 HD2 HIS A 130 7.404 -7.771 2.802 1.00 45.22 H new ATOM 0 HE1 HIS A 130 4.028 -10.099 1.837 1.00 70.52 H new ATOM 1968 N ALA A 131 10.032 -9.747 6.862 1.00 25.45 N ATOM 1969 CA ALA A 131 11.107 -10.409 7.567 1.00 34.12 C ATOM 1970 C ALA A 131 11.209 -9.922 9.009 1.00 11.10 C ATOM 1971 O ALA A 131 12.207 -10.190 9.695 1.00 15.43 O ATOM 1972 CB ALA A 131 12.419 -10.200 6.822 1.00 44.23 C ATOM 0 H ALA A 131 10.256 -8.802 6.550 1.00 25.45 H new ATOM 0 HA ALA A 131 10.891 -11.477 7.604 1.00 34.12 H new ATOM 0 HB1 ALA A 131 13.225 -10.701 7.358 1.00 44.23 H new ATOM 0 HB2 ALA A 131 12.337 -10.616 5.818 1.00 44.23 H new ATOM 0 HB3 ALA A 131 12.634 -9.133 6.757 1.00 44.23 H new ATOM 1978 N HIS A 132 10.161 -9.209 9.465 1.00 43.24 N ATOM 1979 CA HIS A 132 10.078 -8.665 10.833 1.00 14.11 C ATOM 1980 C HIS A 132 11.166 -7.576 11.045 1.00 40.23 C ATOM 1981 O HIS A 132 11.553 -7.224 12.151 1.00 63.44 O ATOM 1982 CB HIS A 132 10.145 -9.839 11.868 1.00 14.11 C ATOM 1983 CG HIS A 132 10.186 -9.457 13.322 1.00 11.52 C ATOM 1984 ND1 HIS A 132 11.245 -9.744 14.155 1.00 62.34 N ATOM 1985 CD2 HIS A 132 9.280 -8.803 14.079 1.00 33.20 C ATOM 1986 CE1 HIS A 132 10.960 -9.267 15.365 1.00 32.30 C ATOM 1987 NE2 HIS A 132 9.767 -8.678 15.376 1.00 12.44 N ATOM 0 H HIS A 132 9.345 -8.994 8.892 1.00 43.24 H new ATOM 0 HA HIS A 132 9.122 -8.165 10.989 1.00 14.11 H new ATOM 0 HB2 HIS A 132 9.279 -10.482 11.710 1.00 14.11 H new ATOM 0 HB3 HIS A 132 11.030 -10.436 11.648 1.00 14.11 H new ATOM 0 HD2 HIS A 132 8.326 -8.434 13.732 1.00 33.20 H new ATOM 0 HE1 HIS A 132 11.611 -9.347 16.223 1.00 32.30 H new ATOM 0 HE2 HIS A 132 9.307 -8.230 16.168 1.00 12.44 H new ATOM 1995 N GLN A 133 11.535 -6.955 9.959 1.00 52.43 N ATOM 1996 CA GLN A 133 12.490 -5.859 9.960 1.00 22.01 C ATOM 1997 C GLN A 133 11.703 -4.581 9.721 1.00 0.05 C ATOM 1998 O GLN A 133 12.219 -3.544 9.300 1.00 64.41 O ATOM 1999 CB GLN A 133 13.549 -6.092 8.898 1.00 5.35 C ATOM 2000 CG GLN A 133 14.267 -7.416 9.075 1.00 44.01 C ATOM 2001 CD GLN A 133 15.281 -7.692 8.004 1.00 44.43 C ATOM 2002 OE1 GLN A 133 15.899 -6.787 7.460 1.00 52.54 O ATOM 2003 NE2 GLN A 133 15.452 -8.940 7.689 1.00 45.12 N ATOM 0 H GLN A 133 11.182 -7.192 9.032 1.00 52.43 H new ATOM 0 HA GLN A 133 13.019 -5.785 10.910 1.00 22.01 H new ATOM 0 HB2 GLN A 133 13.083 -6.064 7.913 1.00 5.35 H new ATOM 0 HB3 GLN A 133 14.276 -5.281 8.930 1.00 5.35 H new ATOM 0 HG2 GLN A 133 14.763 -7.425 10.046 1.00 44.01 H new ATOM 0 HG3 GLN A 133 13.532 -8.221 9.085 1.00 44.01 H new ATOM 0 HE21 GLN A 133 14.916 -9.665 8.167 1.00 45.12 H new ATOM 0 HE22 GLN A 133 16.122 -9.196 6.964 1.00 45.12 H new ATOM 2012 N ALA A 134 10.425 -4.702 10.070 1.00 74.04 N ATOM 2013 CA ALA A 134 9.389 -3.679 9.978 1.00 61.25 C ATOM 2014 C ALA A 134 9.805 -2.388 10.666 1.00 22.31 C ATOM 2015 O ALA A 134 9.322 -1.317 10.321 1.00 53.34 O ATOM 2016 CB ALA A 134 8.101 -4.206 10.581 1.00 71.13 C ATOM 0 H ALA A 134 10.062 -5.576 10.450 1.00 74.04 H new ATOM 0 HA ALA A 134 9.234 -3.448 8.924 1.00 61.25 H new ATOM 0 HB1 ALA A 134 7.327 -3.441 10.512 1.00 71.13 H new ATOM 0 HB2 ALA A 134 7.782 -5.095 10.037 1.00 71.13 H new ATOM 0 HB3 ALA A 134 8.267 -4.461 11.628 1.00 71.13 H new ATOM 2022 N ARG A 135 10.676 -2.505 11.652 1.00 43.45 N ATOM 2023 CA ARG A 135 11.188 -1.359 12.388 1.00 44.44 C ATOM 2024 C ARG A 135 11.833 -0.334 11.449 1.00 11.13 C ATOM 2025 O ARG A 135 11.649 0.879 11.626 1.00 5.12 O ATOM 2026 CB ARG A 135 12.194 -1.810 13.409 1.00 33.22 C ATOM 2027 CG ARG A 135 11.629 -2.766 14.431 1.00 5.21 C ATOM 2028 CD ARG A 135 12.643 -3.033 15.490 1.00 71.01 C ATOM 2029 NE ARG A 135 13.017 -1.796 16.172 1.00 10.04 N ATOM 2030 CZ ARG A 135 14.267 -1.419 16.458 1.00 30.22 C ATOM 2031 NH1 ARG A 135 15.305 -2.162 16.084 1.00 64.42 N ATOM 2032 NH2 ARG A 135 14.476 -0.287 17.097 1.00 22.34 N ATOM 0 H ARG A 135 11.051 -3.400 11.967 1.00 43.45 H new ATOM 0 HA ARG A 135 10.346 -0.881 12.889 1.00 44.44 H new ATOM 0 HB2 ARG A 135 13.029 -2.289 12.898 1.00 33.22 H new ATOM 0 HB3 ARG A 135 12.594 -0.936 13.923 1.00 33.22 H new ATOM 0 HG2 ARG A 135 10.727 -2.345 14.876 1.00 5.21 H new ATOM 0 HG3 ARG A 135 11.340 -3.700 13.948 1.00 5.21 H new ATOM 0 HD2 ARG A 135 12.243 -3.745 16.212 1.00 71.01 H new ATOM 0 HD3 ARG A 135 13.527 -3.491 15.046 1.00 71.01 H new ATOM 0 HE ARG A 135 12.263 -1.169 16.453 1.00 10.04 H new ATOM 0 HH11 ARG A 135 15.152 -3.031 15.572 1.00 64.42 H new ATOM 0 HH12 ARG A 135 16.254 -1.863 16.309 1.00 64.42 H new ATOM 0 HH21 ARG A 135 13.686 0.297 17.371 1.00 22.34 H new ATOM 0 HH22 ARG A 135 15.428 0.006 17.318 1.00 22.34 H new ATOM 2046 N GLU A 136 12.553 -0.817 10.435 1.00 32.44 N ATOM 2047 CA GLU A 136 13.129 0.074 9.441 1.00 34.44 C ATOM 2048 C GLU A 136 12.057 0.689 8.588 1.00 70.13 C ATOM 2049 O GLU A 136 12.167 1.829 8.200 1.00 52.23 O ATOM 2050 CB GLU A 136 14.191 -0.602 8.576 1.00 72.31 C ATOM 2051 CG GLU A 136 15.602 -0.399 9.087 1.00 62.25 C ATOM 2052 CD GLU A 136 15.976 1.076 9.133 1.00 41.34 C ATOM 2053 OE1 GLU A 136 16.340 1.656 8.069 1.00 61.15 O ATOM 2054 OE2 GLU A 136 15.934 1.675 10.214 1.00 53.22 O ATOM 0 H GLU A 136 12.746 -1.807 10.286 1.00 32.44 H new ATOM 0 HA GLU A 136 13.637 0.865 9.993 1.00 34.44 H new ATOM 0 HB2 GLU A 136 13.981 -1.670 8.525 1.00 72.31 H new ATOM 0 HB3 GLU A 136 14.121 -0.215 7.560 1.00 72.31 H new ATOM 0 HG2 GLU A 136 15.694 -0.829 10.084 1.00 62.25 H new ATOM 0 HG3 GLU A 136 16.302 -0.932 8.444 1.00 62.25 H new ATOM 2061 N VAL A 137 11.002 -0.060 8.340 1.00 54.35 N ATOM 2062 CA VAL A 137 9.868 0.434 7.570 1.00 20.53 C ATOM 2063 C VAL A 137 9.245 1.610 8.310 1.00 4.01 C ATOM 2064 O VAL A 137 8.952 2.643 7.715 1.00 20.43 O ATOM 2065 CB VAL A 137 8.807 -0.674 7.354 1.00 2.13 C ATOM 2066 CG1 VAL A 137 7.623 -0.162 6.544 1.00 72.45 C ATOM 2067 CG2 VAL A 137 9.435 -1.877 6.676 1.00 72.35 C ATOM 0 H VAL A 137 10.902 -1.023 8.662 1.00 54.35 H new ATOM 0 HA VAL A 137 10.222 0.750 6.589 1.00 20.53 H new ATOM 0 HB VAL A 137 8.432 -0.975 8.332 1.00 2.13 H new ATOM 0 HG11 VAL A 137 6.898 -0.965 6.412 1.00 72.45 H new ATOM 0 HG12 VAL A 137 7.153 0.668 7.072 1.00 72.45 H new ATOM 0 HG13 VAL A 137 7.970 0.178 5.568 1.00 72.45 H new ATOM 0 HG21 VAL A 137 8.679 -2.648 6.530 1.00 72.35 H new ATOM 0 HG22 VAL A 137 9.841 -1.579 5.709 1.00 72.35 H new ATOM 0 HG23 VAL A 137 10.237 -2.269 7.301 1.00 72.35 H new ATOM 2077 N VAL A 138 9.100 1.453 9.626 1.00 60.24 N ATOM 2078 CA VAL A 138 8.588 2.517 10.483 1.00 62.30 C ATOM 2079 C VAL A 138 9.520 3.710 10.416 1.00 51.35 C ATOM 2080 O VAL A 138 9.084 4.819 10.169 1.00 75.14 O ATOM 2081 CB VAL A 138 8.446 2.067 11.964 1.00 42.15 C ATOM 2082 CG1 VAL A 138 7.917 3.199 12.838 1.00 54.05 C ATOM 2083 CG2 VAL A 138 7.534 0.877 12.067 1.00 34.45 C ATOM 0 H VAL A 138 9.332 0.593 10.122 1.00 60.24 H new ATOM 0 HA VAL A 138 7.595 2.780 10.118 1.00 62.30 H new ATOM 0 HB VAL A 138 9.438 1.791 12.322 1.00 42.15 H new ATOM 0 HG11 VAL A 138 7.829 2.853 13.868 1.00 54.05 H new ATOM 0 HG12 VAL A 138 8.606 4.043 12.797 1.00 54.05 H new ATOM 0 HG13 VAL A 138 6.938 3.512 12.475 1.00 54.05 H new ATOM 0 HG21 VAL A 138 7.446 0.575 13.111 1.00 34.45 H new ATOM 0 HG22 VAL A 138 6.549 1.139 11.681 1.00 34.45 H new ATOM 0 HG23 VAL A 138 7.945 0.052 11.484 1.00 34.45 H new ATOM 2093 N ARG A 139 10.806 3.453 10.584 1.00 61.03 N ATOM 2094 CA ARG A 139 11.829 4.492 10.545 1.00 14.22 C ATOM 2095 C ARG A 139 11.809 5.252 9.206 1.00 34.31 C ATOM 2096 O ARG A 139 11.910 6.481 9.180 1.00 61.25 O ATOM 2097 CB ARG A 139 13.218 3.876 10.888 1.00 24.35 C ATOM 2098 CG ARG A 139 14.433 4.803 10.753 1.00 71.14 C ATOM 2099 CD ARG A 139 14.958 4.829 9.326 1.00 60.05 C ATOM 2100 NE ARG A 139 16.072 5.757 9.150 1.00 52.21 N ATOM 2101 CZ ARG A 139 17.275 5.423 8.669 1.00 63.43 C ATOM 2102 NH1 ARG A 139 17.575 4.143 8.402 1.00 15.33 N ATOM 2103 NH2 ARG A 139 18.184 6.368 8.464 1.00 43.41 N ATOM 0 H ARG A 139 11.174 2.517 10.752 1.00 61.03 H new ATOM 0 HA ARG A 139 11.612 5.242 11.306 1.00 14.22 H new ATOM 0 HB2 ARG A 139 13.183 3.507 11.913 1.00 24.35 H new ATOM 0 HB3 ARG A 139 13.376 3.011 10.243 1.00 24.35 H new ATOM 0 HG2 ARG A 139 14.158 5.812 11.059 1.00 71.14 H new ATOM 0 HG3 ARG A 139 15.223 4.470 11.426 1.00 71.14 H new ATOM 0 HD2 ARG A 139 15.278 3.826 9.043 1.00 60.05 H new ATOM 0 HD3 ARG A 139 14.149 5.108 8.651 1.00 60.05 H new ATOM 0 HE ARG A 139 15.922 6.731 9.413 1.00 52.21 H new ATOM 0 HH11 ARG A 139 16.883 3.412 8.565 1.00 15.33 H new ATOM 0 HH12 ARG A 139 18.496 3.901 8.036 1.00 15.33 H new ATOM 0 HH21 ARG A 139 17.963 7.342 8.673 1.00 43.41 H new ATOM 0 HH22 ARG A 139 19.103 6.121 8.098 1.00 43.41 H new ATOM 2117 N ARG A 140 11.646 4.523 8.116 1.00 75.55 N ATOM 2118 CA ARG A 140 11.585 5.136 6.798 1.00 74.22 C ATOM 2119 C ARG A 140 10.308 5.949 6.662 1.00 32.15 C ATOM 2120 O ARG A 140 10.315 7.034 6.093 1.00 4.13 O ATOM 2121 CB ARG A 140 11.695 4.083 5.677 1.00 24.40 C ATOM 2122 CG ARG A 140 12.985 3.259 5.713 1.00 64.42 C ATOM 2123 CD ARG A 140 14.219 4.132 5.601 1.00 63.12 C ATOM 2124 NE ARG A 140 15.471 3.375 5.760 1.00 1.32 N ATOM 2125 CZ ARG A 140 16.608 3.667 5.119 1.00 62.22 C ATOM 2126 NH1 ARG A 140 16.641 4.661 4.225 1.00 32.03 N ATOM 2127 NH2 ARG A 140 17.706 2.969 5.369 1.00 21.13 N ATOM 0 H ARG A 140 11.553 3.507 8.116 1.00 75.55 H new ATOM 0 HA ARG A 140 12.439 5.805 6.693 1.00 74.22 H new ATOM 0 HB2 ARG A 140 10.843 3.406 5.745 1.00 24.40 H new ATOM 0 HB3 ARG A 140 11.626 4.587 4.713 1.00 24.40 H new ATOM 0 HG2 ARG A 140 13.026 2.690 6.642 1.00 64.42 H new ATOM 0 HG3 ARG A 140 12.977 2.536 4.897 1.00 64.42 H new ATOM 0 HD2 ARG A 140 14.221 4.628 4.630 1.00 63.12 H new ATOM 0 HD3 ARG A 140 14.175 4.915 6.358 1.00 63.12 H new ATOM 0 HE ARG A 140 15.472 2.579 6.398 1.00 1.32 H new ATOM 0 HH11 ARG A 140 15.797 5.200 4.030 1.00 32.03 H new ATOM 0 HH12 ARG A 140 17.510 4.881 3.738 1.00 32.03 H new ATOM 0 HH21 ARG A 140 17.684 2.210 6.050 1.00 21.13 H new ATOM 0 HH22 ARG A 140 18.574 3.191 4.881 1.00 21.13 H new ATOM 2141 N ALA A 141 9.224 5.435 7.229 1.00 22.22 N ATOM 2142 CA ALA A 141 7.947 6.127 7.227 1.00 61.15 C ATOM 2143 C ALA A 141 8.054 7.431 8.004 1.00 71.22 C ATOM 2144 O ALA A 141 7.576 8.463 7.550 1.00 32.12 O ATOM 2145 CB ALA A 141 6.855 5.248 7.824 1.00 40.44 C ATOM 0 H ALA A 141 9.208 4.531 7.701 1.00 22.22 H new ATOM 0 HA ALA A 141 7.681 6.351 6.194 1.00 61.15 H new ATOM 0 HB1 ALA A 141 5.907 5.787 7.812 1.00 40.44 H new ATOM 0 HB2 ALA A 141 6.761 4.335 7.236 1.00 40.44 H new ATOM 0 HB3 ALA A 141 7.115 4.993 8.851 1.00 40.44 H new ATOM 2151 N GLN A 142 8.710 7.371 9.162 1.00 34.25 N ATOM 2152 CA GLN A 142 8.929 8.534 10.029 1.00 32.10 C ATOM 2153 C GLN A 142 9.685 9.613 9.271 1.00 63.55 C ATOM 2154 O GLN A 142 9.263 10.766 9.229 1.00 55.31 O ATOM 2155 CB GLN A 142 9.737 8.132 11.274 1.00 65.31 C ATOM 2156 CG GLN A 142 9.075 7.082 12.157 1.00 62.45 C ATOM 2157 CD GLN A 142 10.022 6.529 13.212 1.00 32.33 C ATOM 2158 OE1 GLN A 142 11.233 6.490 13.012 1.00 44.33 O ATOM 2159 NE2 GLN A 142 9.488 6.063 14.311 1.00 43.21 N ATOM 0 H GLN A 142 9.109 6.508 9.530 1.00 34.25 H new ATOM 0 HA GLN A 142 7.957 8.917 10.341 1.00 32.10 H new ATOM 0 HB2 GLN A 142 10.708 7.756 10.953 1.00 65.31 H new ATOM 0 HB3 GLN A 142 9.923 9.024 11.872 1.00 65.31 H new ATOM 0 HG2 GLN A 142 8.205 7.520 12.647 1.00 62.45 H new ATOM 0 HG3 GLN A 142 8.712 6.264 11.534 1.00 62.45 H new ATOM 0 HE21 GLN A 142 8.478 6.110 14.447 1.00 43.21 H new ATOM 0 HE22 GLN A 142 10.081 5.652 15.032 1.00 43.21 H new ATOM 2168 N ALA A 143 10.774 9.206 8.628 1.00 72.13 N ATOM 2169 CA ALA A 143 11.634 10.108 7.868 1.00 45.11 C ATOM 2170 C ALA A 143 10.895 10.733 6.684 1.00 1.23 C ATOM 2171 O ALA A 143 11.192 11.853 6.267 1.00 74.32 O ATOM 2172 CB ALA A 143 12.867 9.364 7.381 1.00 62.24 C ATOM 0 H ALA A 143 11.087 8.235 8.619 1.00 72.13 H new ATOM 0 HA ALA A 143 11.937 10.917 8.533 1.00 45.11 H new ATOM 0 HB1 ALA A 143 13.503 10.045 6.815 1.00 62.24 H new ATOM 0 HB2 ALA A 143 13.420 8.978 8.237 1.00 62.24 H new ATOM 0 HB3 ALA A 143 12.563 8.535 6.741 1.00 62.24 H new ATOM 2178 N MET A 144 9.940 10.017 6.141 1.00 53.43 N ATOM 2179 CA MET A 144 9.187 10.527 5.020 1.00 12.30 C ATOM 2180 C MET A 144 8.038 11.406 5.484 1.00 4.13 C ATOM 2181 O MET A 144 7.733 12.413 4.862 1.00 64.15 O ATOM 2182 CB MET A 144 8.664 9.396 4.126 1.00 41.40 C ATOM 2183 CG MET A 144 9.764 8.554 3.487 1.00 43.14 C ATOM 2184 SD MET A 144 10.902 9.512 2.464 1.00 21.32 S ATOM 2185 CE MET A 144 9.798 10.102 1.173 1.00 23.32 C ATOM 0 H MET A 144 9.667 9.086 6.454 1.00 53.43 H new ATOM 0 HA MET A 144 9.871 11.135 4.427 1.00 12.30 H new ATOM 0 HB2 MET A 144 8.020 8.746 4.719 1.00 41.40 H new ATOM 0 HB3 MET A 144 8.045 9.825 3.338 1.00 41.40 H new ATOM 0 HG2 MET A 144 10.329 8.052 4.272 1.00 43.14 H new ATOM 0 HG3 MET A 144 9.306 7.776 2.876 1.00 43.14 H new ATOM 0 HE1 MET A 144 10.386 10.493 0.342 1.00 23.32 H new ATOM 0 HE2 MET A 144 9.176 9.279 0.822 1.00 23.32 H new ATOM 0 HE3 MET A 144 9.162 10.893 1.571 1.00 23.32 H new ATOM 2195 N ALA A 145 7.423 11.039 6.583 1.00 23.43 N ATOM 2196 CA ALA A 145 6.271 11.759 7.086 1.00 53.54 C ATOM 2197 C ALA A 145 6.634 13.058 7.791 1.00 11.45 C ATOM 2198 O ALA A 145 5.976 14.073 7.584 1.00 35.43 O ATOM 2199 CB ALA A 145 5.427 10.879 7.990 1.00 34.12 C ATOM 0 H ALA A 145 7.702 10.240 7.152 1.00 23.43 H new ATOM 0 HA ALA A 145 5.683 12.034 6.210 1.00 53.54 H new ATOM 0 HB1 ALA A 145 4.570 11.446 8.353 1.00 34.12 H new ATOM 0 HB2 ALA A 145 5.078 10.011 7.430 1.00 34.12 H new ATOM 0 HB3 ALA A 145 6.027 10.547 8.837 1.00 34.12 H new ATOM 2205 N TYR A 146 7.660 13.029 8.601 1.00 52.11 N ATOM 2206 CA TYR A 146 8.033 14.183 9.385 1.00 54.51 C ATOM 2207 C TYR A 146 9.268 14.839 8.808 1.00 3.35 C ATOM 2208 O TYR A 146 10.389 14.393 9.111 1.00 38.23 O ATOM 2209 CB TYR A 146 8.255 13.789 10.855 1.00 41.30 C ATOM 2210 CG TYR A 146 7.037 13.161 11.502 1.00 34.32 C ATOM 2211 CD1 TYR A 146 6.014 13.948 12.006 1.00 31.44 C ATOM 2212 CD2 TYR A 146 6.904 11.780 11.587 1.00 65.02 C ATOM 2213 CE1 TYR A 146 4.895 13.379 12.578 1.00 21.11 C ATOM 2214 CE2 TYR A 146 5.784 11.206 12.155 1.00 55.33 C ATOM 2215 CZ TYR A 146 4.783 12.012 12.649 1.00 65.13 C ATOM 2216 OH TYR A 146 3.656 11.446 13.214 1.00 33.12 O ATOM 2217 OXT TYR A 146 9.135 15.809 8.032 1.00 38.23 O ATOM 0 H TYR A 146 8.258 12.214 8.737 1.00 52.11 H new ATOM 0 HA TYR A 146 7.217 14.905 9.348 1.00 54.51 H new ATOM 0 HB2 TYR A 146 9.089 13.090 10.914 1.00 41.30 H new ATOM 0 HB3 TYR A 146 8.541 14.675 11.421 1.00 41.30 H new ATOM 0 HD1 TYR A 146 6.094 15.024 11.950 1.00 31.44 H new ATOM 0 HD2 TYR A 146 7.689 11.146 11.203 1.00 65.02 H new ATOM 0 HE1 TYR A 146 4.109 14.007 12.969 1.00 21.11 H new ATOM 0 HE2 TYR A 146 5.694 10.131 12.211 1.00 55.33 H new ATOM 0 HH TYR A 146 2.898 12.059 13.116 1.00 33.12 H new