USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 748 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 76 LYS NZ :NH3+ 177:sc= 1.61 (180deg=1.2) USER MOD Set 1.2: A 79 TYR OH : rot 180:sc= 0.374 USER MOD Set 2.1: A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 74 CYS SG : rot 172:sc= 0.171 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 MET CE :methyl 141:sc= -0.59 (180deg=-2.84!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 29:sc= 1.26 USER MOD Single : A 39 THR OG1 : rot 92:sc= 1.28 USER MOD Single : A 45 MET CE :methyl -168:sc= -0.42 (180deg=-0.639) USER MOD Single : A 47 LYS NZ :NH3+ -156:sc= 1.23 (180deg=1.16) USER MOD Single : A 49 LYS NZ :NH3+ 159:sc= 1.21 (180deg=1.14) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 170:sc= 1.26 (180deg=1.15) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 MET CE :methyl -143:sc= -0.0787 (180deg=-0.337) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 129:sc= 1.99 USER MOD Single : A 109 THR OG1 : rot 120:sc= 0.671 USER MOD Single : A 110 GLN : amide:sc= 0.187 X(o=0.19,f=-0.19) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 217 N ILE A 14 -6.721 8.373 -4.508 1.00 0.00 N ATOM 218 CA ILE A 14 -6.247 7.997 -5.833 1.00 0.00 C ATOM 219 C ILE A 14 -7.358 7.210 -6.537 1.00 0.00 C ATOM 220 O ILE A 14 -7.845 7.629 -7.590 1.00 0.00 O ATOM 221 CB ILE A 14 -4.898 7.242 -5.707 1.00 0.00 C ATOM 222 CG1 ILE A 14 -3.766 8.222 -5.319 1.00 0.00 C ATOM 223 CG2 ILE A 14 -4.505 6.504 -6.998 1.00 0.00 C ATOM 224 CD1 ILE A 14 -2.510 7.537 -4.762 1.00 0.00 C ATOM 0 HA ILE A 14 -6.036 8.866 -6.456 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.035 6.495 -4.926 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.489 8.807 -6.196 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.145 8.923 -4.575 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.553 5.994 -6.850 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.274 5.772 -7.247 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.410 7.222 -7.813 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.764 8.292 -4.514 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.770 6.975 -3.865 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.104 6.857 -5.511 1.00 0.00 H new ATOM 236 N GLU A 15 -7.798 6.108 -5.933 1.00 0.00 N ATOM 237 CA GLU A 15 -8.720 5.172 -6.557 1.00 0.00 C ATOM 238 C GLU A 15 -10.118 5.768 -6.776 1.00 0.00 C ATOM 239 O GLU A 15 -10.741 5.472 -7.795 1.00 0.00 O ATOM 240 CB GLU A 15 -8.779 3.921 -5.663 1.00 0.00 C ATOM 241 CG GLU A 15 -9.801 2.883 -6.139 1.00 0.00 C ATOM 242 CD GLU A 15 -9.692 1.572 -5.340 1.00 0.00 C ATOM 243 OE1 GLU A 15 -10.372 1.428 -4.299 1.00 0.00 O ATOM 244 OE2 GLU A 15 -8.944 0.659 -5.758 1.00 0.00 O ATOM 0 H GLU A 15 -7.520 5.841 -4.989 1.00 0.00 H new ATOM 0 HA GLU A 15 -8.358 4.921 -7.554 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -7.792 3.460 -5.630 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -9.025 4.222 -4.645 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -10.807 3.289 -6.037 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -9.646 2.678 -7.198 1.00 0.00 H new ATOM 251 N THR A 16 -10.613 6.596 -5.853 1.00 0.00 N ATOM 252 CA THR A 16 -12.011 7.034 -5.852 1.00 0.00 C ATOM 253 C THR A 16 -12.237 8.421 -6.469 1.00 0.00 C ATOM 254 O THR A 16 -13.391 8.762 -6.739 1.00 0.00 O ATOM 255 CB THR A 16 -12.613 6.928 -4.435 1.00 0.00 C ATOM 256 OG1 THR A 16 -11.938 7.749 -3.503 1.00 0.00 O ATOM 257 CG2 THR A 16 -12.613 5.486 -3.910 1.00 0.00 C ATOM 0 H THR A 16 -10.059 6.981 -5.088 1.00 0.00 H new ATOM 0 HA THR A 16 -12.544 6.349 -6.511 1.00 0.00 H new ATOM 0 HB THR A 16 -13.642 7.272 -4.534 1.00 0.00 H new ATOM 0 HG1 THR A 16 -12.353 7.652 -2.621 1.00 0.00 H new ATOM 0 HG21 THR A 16 -13.046 5.463 -2.910 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.203 4.856 -4.576 1.00 0.00 H new ATOM 0 HG23 THR A 16 -11.590 5.113 -3.871 1.00 0.00 H new ATOM 265 N GLU A 17 -11.186 9.206 -6.745 1.00 0.00 N ATOM 266 CA GLU A 17 -11.357 10.520 -7.372 1.00 0.00 C ATOM 267 C GLU A 17 -10.249 10.933 -8.349 1.00 0.00 C ATOM 268 O GLU A 17 -10.526 11.783 -9.197 1.00 0.00 O ATOM 269 CB GLU A 17 -11.663 11.609 -6.320 1.00 0.00 C ATOM 270 CG GLU A 17 -10.634 11.769 -5.192 1.00 0.00 C ATOM 271 CD GLU A 17 -11.027 12.903 -4.229 1.00 0.00 C ATOM 272 OE1 GLU A 17 -11.904 12.697 -3.358 1.00 0.00 O ATOM 273 OE2 GLU A 17 -10.453 14.011 -4.323 1.00 0.00 O ATOM 0 H GLU A 17 -10.218 8.955 -6.545 1.00 0.00 H new ATOM 0 HA GLU A 17 -12.231 10.414 -8.015 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.759 12.565 -6.834 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -12.632 11.390 -5.871 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.550 10.833 -4.639 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -9.653 11.976 -5.619 1.00 0.00 H new ATOM 280 N ILE A 18 -9.049 10.336 -8.324 1.00 0.00 N ATOM 281 CA ILE A 18 -7.990 10.723 -9.268 1.00 0.00 C ATOM 282 C ILE A 18 -8.070 9.850 -10.529 1.00 0.00 C ATOM 283 O ILE A 18 -8.073 10.384 -11.637 1.00 0.00 O ATOM 284 CB ILE A 18 -6.591 10.700 -8.606 1.00 0.00 C ATOM 285 CG1 ILE A 18 -6.609 11.508 -7.285 1.00 0.00 C ATOM 286 CG2 ILE A 18 -5.537 11.269 -9.570 1.00 0.00 C ATOM 287 CD1 ILE A 18 -5.248 11.743 -6.619 1.00 0.00 C ATOM 0 H ILE A 18 -8.789 9.596 -7.672 1.00 0.00 H new ATOM 0 HA ILE A 18 -8.151 11.757 -9.572 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.329 9.667 -8.376 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -7.066 12.478 -7.482 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -7.254 10.990 -6.575 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.558 11.247 -9.092 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.511 10.666 -10.478 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.794 12.297 -9.824 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -5.385 12.319 -5.704 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -4.790 10.784 -6.379 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.600 12.294 -7.300 1.00 0.00 H new ATOM 299 N ILE A 19 -8.191 8.526 -10.383 1.00 0.00 N ATOM 300 CA ILE A 19 -8.175 7.575 -11.502 1.00 0.00 C ATOM 301 C ILE A 19 -9.451 6.719 -11.554 1.00 0.00 C ATOM 302 O ILE A 19 -9.499 5.724 -12.275 1.00 0.00 O ATOM 303 CB ILE A 19 -6.876 6.751 -11.488 1.00 0.00 C ATOM 304 CG1 ILE A 19 -6.698 6.061 -10.127 1.00 0.00 C ATOM 305 CG2 ILE A 19 -5.665 7.634 -11.851 1.00 0.00 C ATOM 306 CD1 ILE A 19 -5.689 4.934 -10.212 1.00 0.00 C ATOM 0 H ILE A 19 -8.304 8.078 -9.473 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.179 8.138 -12.435 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.943 5.971 -12.247 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.371 6.791 -9.386 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.657 5.670 -9.787 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.757 7.031 -11.835 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.805 8.052 -12.848 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.575 8.444 -11.127 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.584 4.465 -9.234 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.031 4.193 -10.935 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.725 5.332 -10.529 1.00 0.00 H new ATOM 318 N VAL A 20 -10.500 7.105 -10.822 1.00 0.00 N ATOM 319 CA VAL A 20 -11.778 6.394 -10.776 1.00 0.00 C ATOM 320 C VAL A 20 -12.382 6.165 -12.173 1.00 0.00 C ATOM 321 O VAL A 20 -12.987 5.121 -12.422 1.00 0.00 O ATOM 322 CB VAL A 20 -12.720 7.148 -9.813 1.00 0.00 C ATOM 323 CG1 VAL A 20 -13.169 8.530 -10.321 1.00 0.00 C ATOM 324 CG2 VAL A 20 -13.941 6.311 -9.413 1.00 0.00 C ATOM 0 H VAL A 20 -10.483 7.938 -10.233 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.620 5.386 -10.391 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.109 7.322 -8.927 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -13.828 8.992 -9.585 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -12.295 9.163 -10.473 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -13.703 8.415 -11.264 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -14.571 6.887 -8.735 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -14.511 6.050 -10.305 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -13.610 5.400 -8.914 1.00 0.00 H new ATOM 334 N ASP A 21 -12.197 7.117 -13.096 1.00 0.00 N ATOM 335 CA ASP A 21 -12.756 7.065 -14.449 1.00 0.00 C ATOM 336 C ASP A 21 -11.818 6.351 -15.437 1.00 0.00 C ATOM 337 O ASP A 21 -12.197 6.102 -16.583 1.00 0.00 O ATOM 338 CB ASP A 21 -13.041 8.500 -14.917 1.00 0.00 C ATOM 339 CG ASP A 21 -13.762 8.548 -16.276 1.00 0.00 C ATOM 340 OD1 ASP A 21 -14.907 8.050 -16.378 1.00 0.00 O ATOM 341 OD2 ASP A 21 -13.220 9.145 -17.233 1.00 0.00 O ATOM 0 H ASP A 21 -11.646 7.957 -12.919 1.00 0.00 H new ATOM 0 HA ASP A 21 -13.679 6.486 -14.422 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -13.650 9.008 -14.169 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.101 9.048 -14.989 1.00 0.00 H new ATOM 346 N ALA A 22 -10.587 6.033 -15.017 1.00 0.00 N ATOM 347 CA ALA A 22 -9.571 5.449 -15.885 1.00 0.00 C ATOM 348 C ALA A 22 -9.825 3.954 -16.141 1.00 0.00 C ATOM 349 O ALA A 22 -10.707 3.341 -15.534 1.00 0.00 O ATOM 350 CB ALA A 22 -8.179 5.686 -15.290 1.00 0.00 C ATOM 0 H ALA A 22 -10.271 6.177 -14.058 1.00 0.00 H new ATOM 0 HA ALA A 22 -9.626 5.944 -16.855 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.425 5.247 -15.943 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -8.000 6.757 -15.198 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.120 5.222 -14.305 1.00 0.00 H new ATOM 356 N GLU A 23 -9.019 3.359 -17.028 1.00 0.00 N ATOM 357 CA GLU A 23 -9.131 1.957 -17.425 1.00 0.00 C ATOM 358 C GLU A 23 -7.745 1.394 -17.765 1.00 0.00 C ATOM 359 O GLU A 23 -7.378 0.334 -17.261 1.00 0.00 O ATOM 360 CB GLU A 23 -10.088 1.858 -18.630 1.00 0.00 C ATOM 361 CG GLU A 23 -10.431 0.418 -19.040 1.00 0.00 C ATOM 362 CD GLU A 23 -11.288 -0.309 -17.985 1.00 0.00 C ATOM 363 OE1 GLU A 23 -12.532 -0.163 -17.999 1.00 0.00 O ATOM 364 OE2 GLU A 23 -10.734 -1.056 -17.149 1.00 0.00 O ATOM 0 H GLU A 23 -8.258 3.850 -17.497 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.534 1.364 -16.604 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.011 2.387 -18.392 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -9.638 2.370 -19.481 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -10.965 0.432 -19.990 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -9.508 -0.140 -19.201 1.00 0.00 H new ATOM 371 N ASP A 24 -6.934 2.128 -18.534 1.00 0.00 N ATOM 372 CA ASP A 24 -5.590 1.730 -18.972 1.00 0.00 C ATOM 373 C ASP A 24 -4.665 2.938 -18.880 1.00 0.00 C ATOM 374 O ASP A 24 -5.130 4.043 -18.610 1.00 0.00 O ATOM 375 CB ASP A 24 -5.636 1.180 -20.408 1.00 0.00 C ATOM 376 CG ASP A 24 -4.380 0.395 -20.838 1.00 0.00 C ATOM 377 OD1 ASP A 24 -3.501 0.105 -19.997 1.00 0.00 O ATOM 378 OD2 ASP A 24 -4.273 0.062 -22.039 1.00 0.00 O ATOM 0 H ASP A 24 -7.204 3.048 -18.881 1.00 0.00 H new ATOM 0 HA ASP A 24 -5.210 0.938 -18.327 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.505 0.530 -20.506 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -5.781 2.012 -21.097 1.00 0.00 H new ATOM 383 N LYS A 25 -3.369 2.750 -19.105 1.00 0.00 N ATOM 384 CA LYS A 25 -2.293 3.693 -18.872 1.00 0.00 C ATOM 385 C LYS A 25 -2.570 5.115 -19.342 1.00 0.00 C ATOM 386 O LYS A 25 -2.298 6.066 -18.612 1.00 0.00 O ATOM 387 CB LYS A 25 -1.080 3.105 -19.589 1.00 0.00 C ATOM 388 CG LYS A 25 0.200 3.551 -18.903 1.00 0.00 C ATOM 389 CD LYS A 25 1.425 2.793 -19.427 1.00 0.00 C ATOM 390 CE LYS A 25 1.515 2.891 -20.954 1.00 0.00 C ATOM 391 NZ LYS A 25 2.722 2.220 -21.498 1.00 0.00 N ATOM 0 H LYS A 25 -3.023 1.868 -19.483 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.145 3.810 -17.798 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.141 2.017 -19.590 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.074 3.425 -20.631 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.341 4.621 -19.059 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.109 3.395 -17.828 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.330 3.202 -18.978 1.00 0.00 H new ATOM 0 HD3 LYS A 25 1.366 1.746 -19.128 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.625 2.444 -21.396 1.00 0.00 H new ATOM 0 HE3 LYS A 25 1.524 3.941 -21.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 2.735 2.315 -22.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 3.575 2.662 -21.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.703 1.212 -21.243 1.00 0.00 H new ATOM 405 N GLU A 26 -3.110 5.258 -20.548 1.00 0.00 N ATOM 406 CA GLU A 26 -3.375 6.569 -21.133 1.00 0.00 C ATOM 407 C GLU A 26 -4.517 7.243 -20.372 1.00 0.00 C ATOM 408 O GLU A 26 -4.437 8.423 -20.038 1.00 0.00 O ATOM 409 CB GLU A 26 -3.709 6.427 -22.626 1.00 0.00 C ATOM 410 CG GLU A 26 -2.492 5.962 -23.439 1.00 0.00 C ATOM 411 CD GLU A 26 -2.822 5.849 -24.939 1.00 0.00 C ATOM 412 OE1 GLU A 26 -3.286 4.775 -25.387 1.00 0.00 O ATOM 413 OE2 GLU A 26 -2.601 6.824 -25.693 1.00 0.00 O ATOM 0 H GLU A 26 -3.375 4.474 -21.145 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.486 7.194 -21.050 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -4.524 5.714 -22.750 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.061 7.383 -23.013 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.670 6.664 -23.299 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -2.153 4.995 -23.067 1.00 0.00 H new ATOM 420 N GLU A 27 -5.554 6.479 -20.025 1.00 0.00 N ATOM 421 CA GLU A 27 -6.675 6.967 -19.234 1.00 0.00 C ATOM 422 C GLU A 27 -6.224 7.269 -17.801 1.00 0.00 C ATOM 423 O GLU A 27 -6.721 8.210 -17.191 1.00 0.00 O ATOM 424 CB GLU A 27 -7.823 5.945 -19.243 1.00 0.00 C ATOM 425 CG GLU A 27 -8.236 5.445 -20.637 1.00 0.00 C ATOM 426 CD GLU A 27 -8.612 6.581 -21.608 1.00 0.00 C ATOM 427 OE1 GLU A 27 -9.479 7.419 -21.272 1.00 0.00 O ATOM 428 OE2 GLU A 27 -8.073 6.621 -22.737 1.00 0.00 O ATOM 0 H GLU A 27 -5.636 5.497 -20.289 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.041 7.892 -19.679 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.531 5.087 -18.638 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -8.692 6.393 -18.762 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.417 4.867 -21.065 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -9.084 4.768 -20.535 1.00 0.00 H new ATOM 435 N ARG A 28 -5.269 6.504 -17.259 1.00 0.00 N ATOM 436 CA ARG A 28 -4.723 6.726 -15.919 1.00 0.00 C ATOM 437 C ARG A 28 -3.935 8.034 -15.915 1.00 0.00 C ATOM 438 O ARG A 28 -4.131 8.850 -15.013 1.00 0.00 O ATOM 439 CB ARG A 28 -3.875 5.513 -15.473 1.00 0.00 C ATOM 440 CG ARG A 28 -4.716 4.231 -15.294 1.00 0.00 C ATOM 441 CD ARG A 28 -3.872 2.947 -15.222 1.00 0.00 C ATOM 442 NE ARG A 28 -4.704 1.752 -15.473 1.00 0.00 N ATOM 443 CZ ARG A 28 -4.289 0.477 -15.484 1.00 0.00 C ATOM 444 NH1 ARG A 28 -3.029 0.154 -15.220 1.00 0.00 N ATOM 445 NH2 ARG A 28 -5.153 -0.488 -15.778 1.00 0.00 N ATOM 0 H ARG A 28 -4.852 5.709 -17.743 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.529 6.819 -15.191 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.094 5.330 -16.211 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.376 5.750 -14.533 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -5.308 4.319 -14.383 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -5.418 4.148 -16.123 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -3.067 2.995 -15.956 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -3.404 2.869 -14.240 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.694 1.913 -15.656 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.350 0.884 -15.002 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -2.739 -0.824 -15.235 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -6.123 -0.256 -15.993 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -4.847 -1.461 -15.789 1.00 0.00 H new ATOM 459 N ALA A 29 -3.106 8.277 -16.937 1.00 0.00 N ATOM 460 CA ALA A 29 -2.420 9.554 -17.102 1.00 0.00 C ATOM 461 C ALA A 29 -3.431 10.697 -17.228 1.00 0.00 C ATOM 462 O ALA A 29 -3.276 11.720 -16.563 1.00 0.00 O ATOM 463 CB ALA A 29 -1.479 9.484 -18.309 1.00 0.00 C ATOM 0 H ALA A 29 -2.896 7.596 -17.666 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.817 9.758 -16.217 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -0.969 10.440 -18.429 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -0.742 8.697 -18.151 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.056 9.266 -19.208 1.00 0.00 H new ATOM 469 N MET A 30 -4.492 10.525 -18.024 1.00 0.00 N ATOM 470 CA MET A 30 -5.528 11.544 -18.162 1.00 0.00 C ATOM 471 C MET A 30 -6.288 11.780 -16.857 1.00 0.00 C ATOM 472 O MET A 30 -6.592 12.930 -16.557 1.00 0.00 O ATOM 473 CB MET A 30 -6.475 11.221 -19.322 1.00 0.00 C ATOM 474 CG MET A 30 -5.802 11.375 -20.694 1.00 0.00 C ATOM 475 SD MET A 30 -5.250 13.049 -21.148 1.00 0.00 S ATOM 476 CE MET A 30 -3.541 13.086 -20.527 1.00 0.00 C ATOM 0 H MET A 30 -4.652 9.686 -18.582 1.00 0.00 H new ATOM 0 HA MET A 30 -5.024 12.481 -18.399 1.00 0.00 H new ATOM 0 HB2 MET A 30 -6.841 10.200 -19.214 1.00 0.00 H new ATOM 0 HB3 MET A 30 -7.343 11.878 -19.271 1.00 0.00 H new ATOM 0 HG2 MET A 30 -4.938 10.711 -20.726 1.00 0.00 H new ATOM 0 HG3 MET A 30 -6.499 11.028 -21.456 1.00 0.00 H new ATOM 0 HE1 MET A 30 -2.908 13.618 -21.236 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.515 13.596 -19.564 1.00 0.00 H new ATOM 0 HE3 MET A 30 -3.175 12.066 -20.408 1.00 0.00 H new ATOM 486 N GLY A 31 -6.544 10.749 -16.049 1.00 0.00 N ATOM 487 CA GLY A 31 -7.179 10.897 -14.746 1.00 0.00 C ATOM 488 C GLY A 31 -6.356 11.826 -13.856 1.00 0.00 C ATOM 489 O GLY A 31 -6.868 12.843 -13.379 1.00 0.00 O ATOM 0 H GLY A 31 -6.314 9.784 -16.285 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.186 11.297 -14.868 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.279 9.921 -14.270 1.00 0.00 H new ATOM 493 N TRP A 32 -5.058 11.533 -13.714 1.00 0.00 N ATOM 494 CA TRP A 32 -4.134 12.395 -12.988 1.00 0.00 C ATOM 495 C TRP A 32 -4.126 13.811 -13.559 1.00 0.00 C ATOM 496 O TRP A 32 -4.251 14.771 -12.798 1.00 0.00 O ATOM 497 CB TRP A 32 -2.723 11.794 -13.009 1.00 0.00 C ATOM 498 CG TRP A 32 -2.473 10.805 -11.919 1.00 0.00 C ATOM 499 CD1 TRP A 32 -2.504 9.459 -12.022 1.00 0.00 C ATOM 500 CD2 TRP A 32 -2.169 11.092 -10.524 1.00 0.00 C ATOM 501 NE1 TRP A 32 -2.230 8.891 -10.793 1.00 0.00 N ATOM 502 CE2 TRP A 32 -2.030 9.857 -9.825 1.00 0.00 C ATOM 503 CE3 TRP A 32 -2.014 12.284 -9.782 1.00 0.00 C ATOM 504 CZ2 TRP A 32 -1.747 9.816 -8.452 1.00 0.00 C ATOM 505 CZ3 TRP A 32 -1.719 12.249 -8.407 1.00 0.00 C ATOM 506 CH2 TRP A 32 -1.578 11.017 -7.747 1.00 0.00 C ATOM 0 H TRP A 32 -4.625 10.694 -14.100 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.474 12.460 -11.954 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -2.559 11.309 -13.971 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -1.994 12.600 -12.930 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -2.712 8.910 -12.928 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -2.181 7.887 -10.622 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -2.124 13.237 -10.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -1.660 8.868 -7.942 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -1.601 13.171 -7.858 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -1.339 10.994 -6.694 1.00 0.00 H new ATOM 517 N TYR A 33 -4.011 13.944 -14.881 1.00 0.00 N ATOM 518 CA TYR A 33 -3.908 15.234 -15.538 1.00 0.00 C ATOM 519 C TYR A 33 -5.150 16.080 -15.267 1.00 0.00 C ATOM 520 O TYR A 33 -5.019 17.228 -14.850 1.00 0.00 O ATOM 521 CB TYR A 33 -3.683 15.013 -17.039 1.00 0.00 C ATOM 522 CG TYR A 33 -3.835 16.249 -17.901 1.00 0.00 C ATOM 523 CD1 TYR A 33 -3.087 17.410 -17.633 1.00 0.00 C ATOM 524 CD2 TYR A 33 -4.769 16.250 -18.949 1.00 0.00 C ATOM 525 CE1 TYR A 33 -3.272 18.568 -18.408 1.00 0.00 C ATOM 526 CE2 TYR A 33 -4.993 17.415 -19.699 1.00 0.00 C ATOM 527 CZ TYR A 33 -4.228 18.577 -19.449 1.00 0.00 C ATOM 528 OH TYR A 33 -4.427 19.693 -20.205 1.00 0.00 O ATOM 0 H TYR A 33 -3.987 13.152 -15.523 1.00 0.00 H new ATOM 0 HA TYR A 33 -3.058 15.786 -15.136 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.681 14.609 -17.185 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -4.386 14.257 -17.388 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -2.367 17.412 -16.828 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -5.318 15.349 -19.179 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -2.683 19.451 -18.208 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -5.751 17.424 -20.468 1.00 0.00 H new ATOM 0 HH TYR A 33 -5.121 19.516 -20.874 1.00 0.00 H new ATOM 538 N TYR A 34 -6.351 15.526 -15.451 1.00 0.00 N ATOM 539 CA TYR A 34 -7.591 16.267 -15.272 1.00 0.00 C ATOM 540 C TYR A 34 -7.786 16.642 -13.802 1.00 0.00 C ATOM 541 O TYR A 34 -8.226 17.753 -13.511 1.00 0.00 O ATOM 542 CB TYR A 34 -8.782 15.431 -15.765 1.00 0.00 C ATOM 543 CG TYR A 34 -8.816 15.004 -17.229 1.00 0.00 C ATOM 544 CD1 TYR A 34 -8.002 15.597 -18.221 1.00 0.00 C ATOM 545 CD2 TYR A 34 -9.715 13.983 -17.596 1.00 0.00 C ATOM 546 CE1 TYR A 34 -8.106 15.182 -19.563 1.00 0.00 C ATOM 547 CE2 TYR A 34 -9.817 13.558 -18.932 1.00 0.00 C ATOM 548 CZ TYR A 34 -9.014 14.161 -19.925 1.00 0.00 C ATOM 549 OH TYR A 34 -9.123 13.747 -21.219 1.00 0.00 O ATOM 0 H TYR A 34 -6.486 14.553 -15.727 1.00 0.00 H new ATOM 0 HA TYR A 34 -7.533 17.184 -15.859 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -8.828 14.529 -15.155 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -9.691 15.998 -15.564 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -7.299 16.370 -17.949 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -10.334 13.521 -16.841 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -7.489 15.646 -20.319 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -10.508 12.772 -19.199 1.00 0.00 H new ATOM 0 HH TYR A 34 -9.796 13.037 -21.280 1.00 0.00 H new ATOM 559 N TYR A 35 -7.454 15.742 -12.869 1.00 0.00 N ATOM 560 CA TYR A 35 -7.594 16.002 -11.444 1.00 0.00 C ATOM 561 C TYR A 35 -6.677 17.154 -11.021 1.00 0.00 C ATOM 562 O TYR A 35 -7.121 18.093 -10.358 1.00 0.00 O ATOM 563 CB TYR A 35 -7.285 14.716 -10.668 1.00 0.00 C ATOM 564 CG TYR A 35 -7.519 14.823 -9.175 1.00 0.00 C ATOM 565 CD1 TYR A 35 -8.805 14.601 -8.649 1.00 0.00 C ATOM 566 CD2 TYR A 35 -6.453 15.128 -8.309 1.00 0.00 C ATOM 567 CE1 TYR A 35 -9.022 14.662 -7.262 1.00 0.00 C ATOM 568 CE2 TYR A 35 -6.663 15.208 -6.921 1.00 0.00 C ATOM 569 CZ TYR A 35 -7.950 14.960 -6.388 1.00 0.00 C ATOM 570 OH TYR A 35 -8.135 14.982 -5.041 1.00 0.00 O ATOM 0 H TYR A 35 -7.082 14.817 -13.087 1.00 0.00 H new ATOM 0 HA TYR A 35 -8.617 16.305 -11.219 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -7.900 13.908 -11.064 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -6.245 14.440 -10.843 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -9.628 14.383 -9.313 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -5.467 15.302 -8.713 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -10.009 14.481 -6.862 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -5.844 15.458 -6.263 1.00 0.00 H new ATOM 0 HH TYR A 35 -8.855 14.363 -4.800 1.00 0.00 H new ATOM 580 N LEU A 36 -5.408 17.120 -11.439 1.00 0.00 N ATOM 581 CA LEU A 36 -4.440 18.166 -11.134 1.00 0.00 C ATOM 582 C LEU A 36 -4.866 19.469 -11.802 1.00 0.00 C ATOM 583 O LEU A 36 -4.840 20.507 -11.148 1.00 0.00 O ATOM 584 CB LEU A 36 -3.032 17.738 -11.588 1.00 0.00 C ATOM 585 CG LEU A 36 -2.169 17.057 -10.507 1.00 0.00 C ATOM 586 CD1 LEU A 36 -2.898 15.999 -9.670 1.00 0.00 C ATOM 587 CD2 LEU A 36 -0.954 16.401 -11.166 1.00 0.00 C ATOM 0 H LEU A 36 -5.026 16.360 -12.001 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.407 18.327 -10.057 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.132 17.056 -12.432 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.502 18.619 -11.951 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.886 17.853 -9.818 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.210 15.577 -8.938 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.740 16.460 -9.153 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.263 15.207 -10.323 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.342 15.919 -10.403 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.289 15.655 -11.887 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.363 17.161 -11.678 1.00 0.00 H new ATOM 599 N ASP A 37 -5.320 19.428 -13.054 1.00 0.00 N ATOM 600 CA ASP A 37 -5.782 20.611 -13.775 1.00 0.00 C ATOM 601 C ASP A 37 -6.969 21.273 -13.074 1.00 0.00 C ATOM 602 O ASP A 37 -7.080 22.499 -13.077 1.00 0.00 O ATOM 603 CB ASP A 37 -6.148 20.239 -15.216 1.00 0.00 C ATOM 604 CG ASP A 37 -6.763 21.426 -15.975 1.00 0.00 C ATOM 605 OD1 ASP A 37 -6.004 22.275 -16.492 1.00 0.00 O ATOM 606 OD2 ASP A 37 -8.006 21.486 -16.108 1.00 0.00 O ATOM 0 H ASP A 37 -5.378 18.568 -13.599 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.967 21.334 -13.789 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.256 19.896 -15.740 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.853 19.408 -15.209 1.00 0.00 H new ATOM 611 N ASP A 38 -7.830 20.480 -12.430 1.00 0.00 N ATOM 612 CA ASP A 38 -8.973 20.988 -11.675 1.00 0.00 C ATOM 613 C ASP A 38 -8.578 21.486 -10.278 1.00 0.00 C ATOM 614 O ASP A 38 -9.288 22.306 -9.693 1.00 0.00 O ATOM 615 CB ASP A 38 -10.035 19.887 -11.551 1.00 0.00 C ATOM 616 CG ASP A 38 -11.280 20.376 -10.793 1.00 0.00 C ATOM 617 OD1 ASP A 38 -12.026 21.226 -11.331 1.00 0.00 O ATOM 618 OD2 ASP A 38 -11.554 19.877 -9.678 1.00 0.00 O ATOM 0 H ASP A 38 -7.751 19.463 -12.419 1.00 0.00 H new ATOM 0 HA ASP A 38 -9.374 21.842 -12.222 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.325 19.548 -12.546 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -9.609 19.028 -11.033 1.00 0.00 H new ATOM 623 N THR A 39 -7.447 21.020 -9.742 1.00 0.00 N ATOM 624 CA THR A 39 -7.074 21.245 -8.348 1.00 0.00 C ATOM 625 C THR A 39 -6.043 22.367 -8.186 1.00 0.00 C ATOM 626 O THR A 39 -6.173 23.197 -7.285 1.00 0.00 O ATOM 627 CB THR A 39 -6.542 19.922 -7.768 1.00 0.00 C ATOM 628 OG1 THR A 39 -7.539 18.924 -7.832 1.00 0.00 O ATOM 629 CG2 THR A 39 -6.082 20.082 -6.319 1.00 0.00 C ATOM 0 H THR A 39 -6.763 20.474 -10.267 1.00 0.00 H new ATOM 0 HA THR A 39 -7.959 21.571 -7.801 1.00 0.00 H new ATOM 0 HB THR A 39 -5.682 19.627 -8.370 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.454 18.430 -8.674 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.714 19.126 -5.947 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.284 20.822 -6.270 1.00 0.00 H new ATOM 0 HG23 THR A 39 -6.920 20.412 -5.705 1.00 0.00 H new ATOM 637 N LEU A 40 -5.001 22.371 -9.019 1.00 0.00 N ATOM 638 CA LEU A 40 -3.839 23.235 -8.854 1.00 0.00 C ATOM 639 C LEU A 40 -4.251 24.690 -9.091 1.00 0.00 C ATOM 640 O LEU A 40 -4.805 25.023 -10.139 1.00 0.00 O ATOM 641 CB LEU A 40 -2.741 22.823 -9.848 1.00 0.00 C ATOM 642 CG LEU A 40 -2.113 21.430 -9.631 1.00 0.00 C ATOM 643 CD1 LEU A 40 -1.297 21.048 -10.872 1.00 0.00 C ATOM 644 CD2 LEU A 40 -1.196 21.341 -8.413 1.00 0.00 C ATOM 0 H LEU A 40 -4.943 21.765 -9.837 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.449 23.136 -7.841 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.159 22.857 -10.854 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.946 23.567 -9.808 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.945 20.748 -9.456 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.850 20.065 -10.725 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.951 21.023 -11.744 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.509 21.784 -11.030 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.796 20.330 -8.332 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.374 22.049 -8.524 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.762 21.580 -7.513 1.00 0.00 H new ATOM 656 N GLU A 41 -3.936 25.570 -8.143 1.00 0.00 N ATOM 657 CA GLU A 41 -4.246 26.998 -8.177 1.00 0.00 C ATOM 658 C GLU A 41 -3.185 27.758 -8.996 1.00 0.00 C ATOM 659 O GLU A 41 -2.686 28.802 -8.570 1.00 0.00 O ATOM 660 CB GLU A 41 -4.376 27.525 -6.731 1.00 0.00 C ATOM 661 CG GLU A 41 -5.598 26.979 -5.974 1.00 0.00 C ATOM 662 CD GLU A 41 -6.920 27.563 -6.507 1.00 0.00 C ATOM 663 OE1 GLU A 41 -7.332 28.656 -6.053 1.00 0.00 O ATOM 664 OE2 GLU A 41 -7.574 26.939 -7.373 1.00 0.00 O ATOM 0 H GLU A 41 -3.438 25.297 -7.296 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.200 27.165 -8.677 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.473 27.266 -6.178 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.433 28.613 -6.756 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.621 25.893 -6.060 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.501 27.212 -4.914 1.00 0.00 H new ATOM 671 N PHE A 42 -2.778 27.220 -10.152 1.00 0.00 N ATOM 672 CA PHE A 42 -1.902 27.937 -11.078 1.00 0.00 C ATOM 673 C PHE A 42 -2.609 29.205 -11.611 1.00 0.00 C ATOM 674 O PHE A 42 -3.845 29.244 -11.622 1.00 0.00 O ATOM 675 CB PHE A 42 -1.422 27.004 -12.203 1.00 0.00 C ATOM 676 CG PHE A 42 -2.495 26.212 -12.927 1.00 0.00 C ATOM 677 CD1 PHE A 42 -3.407 26.853 -13.790 1.00 0.00 C ATOM 678 CD2 PHE A 42 -2.543 24.813 -12.783 1.00 0.00 C ATOM 679 CE1 PHE A 42 -4.388 26.104 -14.463 1.00 0.00 C ATOM 680 CE2 PHE A 42 -3.527 24.066 -13.451 1.00 0.00 C ATOM 681 CZ PHE A 42 -4.455 24.712 -14.285 1.00 0.00 C ATOM 0 H PHE A 42 -3.044 26.287 -10.467 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.010 28.269 -10.547 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -0.885 27.604 -12.938 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -0.705 26.300 -11.781 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -3.352 27.922 -13.934 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -1.820 24.312 -12.156 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -5.091 26.599 -15.117 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -3.570 22.994 -13.324 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.219 24.139 -14.789 1.00 0.00 H new ATOM 691 N PRO A 43 -1.877 30.225 -12.102 1.00 0.00 N ATOM 692 CA PRO A 43 -0.421 30.352 -12.068 1.00 0.00 C ATOM 693 C PRO A 43 0.082 30.494 -10.626 1.00 0.00 C ATOM 694 O PRO A 43 -0.588 31.109 -9.793 1.00 0.00 O ATOM 695 CB PRO A 43 -0.106 31.601 -12.900 1.00 0.00 C ATOM 696 CG PRO A 43 -1.355 32.464 -12.753 1.00 0.00 C ATOM 697 CD PRO A 43 -2.473 31.426 -12.674 1.00 0.00 C ATOM 0 HA PRO A 43 0.077 29.470 -12.471 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.781 32.115 -12.529 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.085 31.349 -13.943 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -1.315 33.085 -11.858 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -1.485 33.136 -13.602 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -3.294 31.786 -12.054 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -2.885 31.223 -13.662 1.00 0.00 H new ATOM 705 N PHE A 44 1.255 29.929 -10.327 1.00 0.00 N ATOM 706 CA PHE A 44 1.870 30.028 -9.004 1.00 0.00 C ATOM 707 C PHE A 44 3.388 30.056 -9.148 1.00 0.00 C ATOM 708 O PHE A 44 3.920 29.657 -10.179 1.00 0.00 O ATOM 709 CB PHE A 44 1.394 28.900 -8.070 1.00 0.00 C ATOM 710 CG PHE A 44 1.660 27.453 -8.473 1.00 0.00 C ATOM 711 CD1 PHE A 44 2.969 26.937 -8.472 1.00 0.00 C ATOM 712 CD2 PHE A 44 0.587 26.579 -8.738 1.00 0.00 C ATOM 713 CE1 PHE A 44 3.213 25.582 -8.745 1.00 0.00 C ATOM 714 CE2 PHE A 44 0.828 25.223 -9.023 1.00 0.00 C ATOM 715 CZ PHE A 44 2.140 24.720 -9.025 1.00 0.00 C ATOM 0 H PHE A 44 1.804 29.390 -10.997 1.00 0.00 H new ATOM 0 HA PHE A 44 1.553 30.960 -8.536 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.855 29.062 -7.095 1.00 0.00 H new ATOM 0 HB3 PHE A 44 0.318 29.013 -7.937 1.00 0.00 H new ATOM 0 HD1 PHE A 44 3.799 27.594 -8.258 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -0.426 26.952 -8.722 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.224 25.203 -8.740 1.00 0.00 H new ATOM 0 HE2 PHE A 44 0.000 24.565 -9.242 1.00 0.00 H new ATOM 0 HZ PHE A 44 2.322 23.677 -9.240 1.00 0.00 H new ATOM 725 N MET A 45 4.105 30.514 -8.126 1.00 0.00 N ATOM 726 CA MET A 45 5.562 30.503 -8.132 1.00 0.00 C ATOM 727 C MET A 45 6.050 29.131 -7.663 1.00 0.00 C ATOM 728 O MET A 45 5.433 28.524 -6.788 1.00 0.00 O ATOM 729 CB MET A 45 6.038 31.614 -7.185 1.00 0.00 C ATOM 730 CG MET A 45 7.558 31.755 -7.128 1.00 0.00 C ATOM 731 SD MET A 45 8.107 32.965 -5.901 1.00 0.00 S ATOM 732 CE MET A 45 9.884 32.739 -6.120 1.00 0.00 C ATOM 0 H MET A 45 3.694 30.901 -7.276 1.00 0.00 H new ATOM 0 HA MET A 45 5.961 30.681 -9.130 1.00 0.00 H new ATOM 0 HB2 MET A 45 5.605 32.562 -7.503 1.00 0.00 H new ATOM 0 HB3 MET A 45 5.662 31.412 -6.182 1.00 0.00 H new ATOM 0 HG2 MET A 45 7.999 30.785 -6.897 1.00 0.00 H new ATOM 0 HG3 MET A 45 7.928 32.048 -8.111 1.00 0.00 H new ATOM 0 HE1 MET A 45 10.417 33.237 -5.310 1.00 0.00 H new ATOM 0 HE2 MET A 45 10.119 31.675 -6.109 1.00 0.00 H new ATOM 0 HE3 MET A 45 10.191 33.169 -7.074 1.00 0.00 H new ATOM 742 N GLY A 46 7.180 28.648 -8.178 1.00 0.00 N ATOM 743 CA GLY A 46 7.796 27.434 -7.678 1.00 0.00 C ATOM 744 C GLY A 46 9.288 27.409 -7.953 1.00 0.00 C ATOM 745 O GLY A 46 9.827 28.242 -8.684 1.00 0.00 O ATOM 0 H GLY A 46 7.686 29.088 -8.947 1.00 0.00 H new ATOM 0 HA2 GLY A 46 7.622 27.353 -6.605 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.325 26.568 -8.144 1.00 0.00 H new ATOM 749 N LYS A 47 9.965 26.442 -7.345 1.00 0.00 N ATOM 750 CA LYS A 47 11.352 26.136 -7.667 1.00 0.00 C ATOM 751 C LYS A 47 11.329 24.963 -8.642 1.00 0.00 C ATOM 752 O LYS A 47 10.677 23.954 -8.367 1.00 0.00 O ATOM 753 CB LYS A 47 12.130 25.784 -6.384 1.00 0.00 C ATOM 754 CG LYS A 47 13.650 25.958 -6.551 1.00 0.00 C ATOM 755 CD LYS A 47 14.100 27.429 -6.463 1.00 0.00 C ATOM 756 CE LYS A 47 14.112 27.983 -5.029 1.00 0.00 C ATOM 757 NZ LYS A 47 15.306 27.561 -4.254 1.00 0.00 N ATOM 0 H LYS A 47 9.568 25.849 -6.616 1.00 0.00 H new ATOM 0 HA LYS A 47 11.855 26.992 -8.117 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.783 26.416 -5.567 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.914 24.753 -6.103 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.163 25.380 -5.782 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.954 25.548 -7.514 1.00 0.00 H new ATOM 0 HD2 LYS A 47 15.100 27.521 -6.888 1.00 0.00 H new ATOM 0 HD3 LYS A 47 13.437 28.041 -7.075 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.076 29.072 -5.066 1.00 0.00 H new ATOM 0 HE3 LYS A 47 13.213 27.651 -4.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.091 27.598 -3.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 15.566 26.589 -4.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 16.099 28.200 -4.463 1.00 0.00 H new ATOM 771 N TRP A 48 12.023 25.079 -9.769 1.00 0.00 N ATOM 772 CA TRP A 48 12.263 23.973 -10.680 1.00 0.00 C ATOM 773 C TRP A 48 13.552 23.307 -10.207 1.00 0.00 C ATOM 774 O TRP A 48 14.638 23.869 -10.352 1.00 0.00 O ATOM 775 CB TRP A 48 12.368 24.485 -12.129 1.00 0.00 C ATOM 776 CG TRP A 48 12.498 23.456 -13.220 1.00 0.00 C ATOM 777 CD1 TRP A 48 12.496 22.112 -13.065 1.00 0.00 C ATOM 778 CD2 TRP A 48 12.624 23.670 -14.663 1.00 0.00 C ATOM 779 NE1 TRP A 48 12.624 21.487 -14.286 1.00 0.00 N ATOM 780 CE2 TRP A 48 12.688 22.400 -15.314 1.00 0.00 C ATOM 781 CE3 TRP A 48 12.669 24.813 -15.492 1.00 0.00 C ATOM 782 CZ2 TRP A 48 12.775 22.273 -16.709 1.00 0.00 C ATOM 783 CZ3 TRP A 48 12.748 24.698 -16.894 1.00 0.00 C ATOM 784 CH2 TRP A 48 12.796 23.431 -17.503 1.00 0.00 C ATOM 0 H TRP A 48 12.439 25.958 -10.077 1.00 0.00 H new ATOM 0 HA TRP A 48 11.444 23.253 -10.676 1.00 0.00 H new ATOM 0 HB2 TRP A 48 11.484 25.088 -12.338 1.00 0.00 H new ATOM 0 HB3 TRP A 48 13.229 25.151 -12.189 1.00 0.00 H new ATOM 0 HD1 TRP A 48 12.407 21.601 -12.118 1.00 0.00 H new ATOM 0 HE1 TRP A 48 12.666 20.476 -14.412 1.00 0.00 H new ATOM 0 HE3 TRP A 48 12.642 25.794 -15.042 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 12.825 21.296 -17.167 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 12.772 25.588 -17.505 1.00 0.00 H new ATOM 0 HH2 TRP A 48 12.849 23.349 -18.579 1.00 0.00 H new ATOM 795 N LYS A 49 13.440 22.128 -9.600 1.00 0.00 N ATOM 796 CA LYS A 49 14.567 21.257 -9.286 1.00 0.00 C ATOM 797 C LYS A 49 14.907 20.504 -10.573 1.00 0.00 C ATOM 798 O LYS A 49 14.511 19.352 -10.759 1.00 0.00 O ATOM 799 CB LYS A 49 14.179 20.321 -8.127 1.00 0.00 C ATOM 800 CG LYS A 49 14.328 21.043 -6.783 1.00 0.00 C ATOM 801 CD LYS A 49 13.881 20.168 -5.607 1.00 0.00 C ATOM 802 CE LYS A 49 14.452 20.752 -4.310 1.00 0.00 C ATOM 803 NZ LYS A 49 13.905 20.086 -3.104 1.00 0.00 N ATOM 0 H LYS A 49 12.542 21.744 -9.306 1.00 0.00 H new ATOM 0 HA LYS A 49 15.446 21.808 -8.953 1.00 0.00 H new ATOM 0 HB2 LYS A 49 13.150 19.983 -8.253 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.811 19.433 -8.142 1.00 0.00 H new ATOM 0 HG2 LYS A 49 15.369 21.335 -6.642 1.00 0.00 H new ATOM 0 HG3 LYS A 49 13.739 21.960 -6.797 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.793 20.131 -5.557 1.00 0.00 H new ATOM 0 HD3 LYS A 49 14.229 19.144 -5.745 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.537 20.652 -4.316 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.230 21.818 -4.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 14.546 20.242 -2.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.969 20.483 -2.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.815 19.065 -3.282 1.00 0.00 H new ATOM 817 N LYS A 50 15.562 21.191 -11.507 1.00 0.00 N ATOM 818 CA LYS A 50 15.961 20.593 -12.777 1.00 0.00 C ATOM 819 C LYS A 50 17.239 19.798 -12.530 1.00 0.00 C ATOM 820 O LYS A 50 18.004 20.149 -11.632 1.00 0.00 O ATOM 821 CB LYS A 50 16.188 21.714 -13.807 1.00 0.00 C ATOM 822 CG LYS A 50 16.214 21.176 -15.246 1.00 0.00 C ATOM 823 CD LYS A 50 16.411 22.305 -16.265 1.00 0.00 C ATOM 824 CE LYS A 50 16.393 21.720 -17.685 1.00 0.00 C ATOM 825 NZ LYS A 50 16.602 22.754 -18.730 1.00 0.00 N ATOM 0 H LYS A 50 15.829 22.170 -11.405 1.00 0.00 H new ATOM 0 HA LYS A 50 15.192 19.927 -13.169 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.398 22.459 -13.713 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.130 22.219 -13.592 1.00 0.00 H new ATOM 0 HG2 LYS A 50 17.018 20.447 -15.349 1.00 0.00 H new ATOM 0 HG3 LYS A 50 15.281 20.653 -15.457 1.00 0.00 H new ATOM 0 HD2 LYS A 50 15.622 23.049 -16.157 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.357 22.814 -16.082 1.00 0.00 H new ATOM 0 HE2 LYS A 50 17.169 20.960 -17.771 1.00 0.00 H new ATOM 0 HE3 LYS A 50 15.439 21.222 -17.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 16.581 22.308 -19.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 15.847 23.467 -18.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 17.524 23.213 -18.585 1.00 0.00 H new ATOM 957 N ILE A 58 20.919 17.841 -8.748 1.00 0.00 N ATOM 958 CA ILE A 58 19.870 18.826 -9.010 1.00 0.00 C ATOM 959 C ILE A 58 20.508 20.222 -9.069 1.00 0.00 C ATOM 960 O ILE A 58 21.533 20.492 -8.438 1.00 0.00 O ATOM 961 CB ILE A 58 18.772 18.665 -7.927 1.00 0.00 C ATOM 962 CG1 ILE A 58 18.007 17.332 -8.129 1.00 0.00 C ATOM 963 CG2 ILE A 58 17.782 19.839 -7.814 1.00 0.00 C ATOM 964 CD1 ILE A 58 17.090 17.251 -9.359 1.00 0.00 C ATOM 0 HA ILE A 58 19.383 18.675 -9.973 1.00 0.00 H new ATOM 0 HB ILE A 58 19.310 18.657 -6.979 1.00 0.00 H new ATOM 0 HG12 ILE A 58 18.737 16.525 -8.193 1.00 0.00 H new ATOM 0 HG13 ILE A 58 17.404 17.146 -7.240 1.00 0.00 H new ATOM 0 HG21 ILE A 58 17.056 19.628 -7.029 1.00 0.00 H new ATOM 0 HG22 ILE A 58 18.326 20.751 -7.569 1.00 0.00 H new ATOM 0 HG23 ILE A 58 17.263 19.970 -8.763 1.00 0.00 H new ATOM 0 HD11 ILE A 58 16.611 16.272 -9.392 1.00 0.00 H new ATOM 0 HD12 ILE A 58 16.327 18.027 -9.296 1.00 0.00 H new ATOM 0 HD13 ILE A 58 17.681 17.396 -10.263 1.00 0.00 H new ATOM 976 N GLU A 59 19.866 21.111 -9.822 1.00 0.00 N ATOM 977 CA GLU A 59 20.205 22.504 -10.021 1.00 0.00 C ATOM 978 C GLU A 59 18.869 23.249 -9.929 1.00 0.00 C ATOM 979 O GLU A 59 17.994 23.116 -10.789 1.00 0.00 O ATOM 980 CB GLU A 59 20.909 22.657 -11.381 1.00 0.00 C ATOM 981 CG GLU A 59 21.312 24.096 -11.730 1.00 0.00 C ATOM 982 CD GLU A 59 22.409 24.642 -10.798 1.00 0.00 C ATOM 983 OE1 GLU A 59 22.089 25.129 -9.692 1.00 0.00 O ATOM 984 OE2 GLU A 59 23.604 24.605 -11.173 1.00 0.00 O ATOM 0 H GLU A 59 19.032 20.849 -10.347 1.00 0.00 H new ATOM 0 HA GLU A 59 20.900 22.908 -9.285 1.00 0.00 H new ATOM 0 HB2 GLU A 59 21.802 22.032 -11.386 1.00 0.00 H new ATOM 0 HB3 GLU A 59 20.250 22.278 -12.162 1.00 0.00 H new ATOM 0 HG2 GLU A 59 21.664 24.132 -12.761 1.00 0.00 H new ATOM 0 HG3 GLU A 59 20.435 24.740 -11.670 1.00 0.00 H new ATOM 991 N GLU A 60 18.664 23.944 -8.813 1.00 0.00 N ATOM 992 CA GLU A 60 17.431 24.667 -8.538 1.00 0.00 C ATOM 993 C GLU A 60 17.393 25.964 -9.351 1.00 0.00 C ATOM 994 O GLU A 60 18.364 26.727 -9.353 1.00 0.00 O ATOM 995 CB GLU A 60 17.360 25.000 -7.038 1.00 0.00 C ATOM 996 CG GLU A 60 16.960 23.791 -6.185 1.00 0.00 C ATOM 997 CD GLU A 60 17.025 24.113 -4.682 1.00 0.00 C ATOM 998 OE1 GLU A 60 16.240 24.966 -4.211 1.00 0.00 O ATOM 999 OE2 GLU A 60 17.855 23.511 -3.963 1.00 0.00 O ATOM 0 H GLU A 60 19.357 24.020 -8.069 1.00 0.00 H new ATOM 0 HA GLU A 60 16.580 24.046 -8.818 1.00 0.00 H new ATOM 0 HB2 GLU A 60 18.330 25.370 -6.705 1.00 0.00 H new ATOM 0 HB3 GLU A 60 16.641 25.804 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 60 15.949 23.478 -6.447 1.00 0.00 H new ATOM 0 HG3 GLU A 60 17.621 22.953 -6.407 1.00 0.00 H new ATOM 1006 N LYS A 61 16.250 26.251 -9.980 1.00 0.00 N ATOM 1007 CA LYS A 61 15.955 27.538 -10.610 1.00 0.00 C ATOM 1008 C LYS A 61 14.631 28.031 -10.051 1.00 0.00 C ATOM 1009 O LYS A 61 13.795 27.221 -9.655 1.00 0.00 O ATOM 1010 CB LYS A 61 15.850 27.406 -12.137 1.00 0.00 C ATOM 1011 CG LYS A 61 17.191 27.074 -12.809 1.00 0.00 C ATOM 1012 CD LYS A 61 17.191 27.514 -14.279 1.00 0.00 C ATOM 1013 CE LYS A 61 16.156 26.780 -15.143 1.00 0.00 C ATOM 1014 NZ LYS A 61 16.086 27.373 -16.501 1.00 0.00 N ATOM 0 H LYS A 61 15.488 25.579 -10.067 1.00 0.00 H new ATOM 0 HA LYS A 61 16.762 28.239 -10.396 1.00 0.00 H new ATOM 0 HB2 LYS A 61 15.127 26.627 -12.379 1.00 0.00 H new ATOM 0 HB3 LYS A 61 15.465 28.338 -12.550 1.00 0.00 H new ATOM 0 HG2 LYS A 61 18.002 27.571 -12.277 1.00 0.00 H new ATOM 0 HG3 LYS A 61 17.378 26.002 -12.746 1.00 0.00 H new ATOM 0 HD2 LYS A 61 16.998 28.586 -14.328 1.00 0.00 H new ATOM 0 HD3 LYS A 61 18.184 27.349 -14.698 1.00 0.00 H new ATOM 0 HE2 LYS A 61 16.419 25.725 -15.215 1.00 0.00 H new ATOM 0 HE3 LYS A 61 15.176 26.832 -14.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 15.511 26.763 -17.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 15.652 28.317 -16.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 17.045 27.455 -16.894 1.00 0.00 H new ATOM 1028 N THR A 62 14.407 29.338 -10.050 1.00 0.00 N ATOM 1029 CA THR A 62 13.196 29.929 -9.499 1.00 0.00 C ATOM 1030 C THR A 62 12.322 30.342 -10.683 1.00 0.00 C ATOM 1031 O THR A 62 12.790 31.043 -11.583 1.00 0.00 O ATOM 1032 CB THR A 62 13.598 31.084 -8.570 1.00 0.00 C ATOM 1033 OG1 THR A 62 14.566 30.643 -7.630 1.00 0.00 O ATOM 1034 CG2 THR A 62 12.401 31.590 -7.776 1.00 0.00 C ATOM 0 H THR A 62 15.062 30.020 -10.432 1.00 0.00 H new ATOM 0 HA THR A 62 12.613 29.241 -8.887 1.00 0.00 H new ATOM 0 HB THR A 62 13.996 31.879 -9.200 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.816 31.388 -7.044 1.00 0.00 H new ATOM 0 HG21 THR A 62 12.714 32.407 -7.127 1.00 0.00 H new ATOM 0 HG22 THR A 62 11.633 31.946 -8.463 1.00 0.00 H new ATOM 0 HG23 THR A 62 11.998 30.779 -7.170 1.00 0.00 H new ATOM 1042 N VAL A 63 11.070 29.881 -10.717 1.00 0.00 N ATOM 1043 CA VAL A 63 10.207 30.011 -11.881 1.00 0.00 C ATOM 1044 C VAL A 63 8.781 30.368 -11.449 1.00 0.00 C ATOM 1045 O VAL A 63 8.376 30.155 -10.306 1.00 0.00 O ATOM 1046 CB VAL A 63 10.256 28.720 -12.742 1.00 0.00 C ATOM 1047 CG1 VAL A 63 11.685 28.329 -13.171 1.00 0.00 C ATOM 1048 CG2 VAL A 63 9.639 27.495 -12.046 1.00 0.00 C ATOM 0 H VAL A 63 10.629 29.405 -9.930 1.00 0.00 H new ATOM 0 HA VAL A 63 10.570 30.827 -12.506 1.00 0.00 H new ATOM 0 HB VAL A 63 9.663 28.982 -13.618 1.00 0.00 H new ATOM 0 HG11 VAL A 63 11.649 27.419 -13.770 1.00 0.00 H new ATOM 0 HG12 VAL A 63 12.121 29.135 -13.762 1.00 0.00 H new ATOM 0 HG13 VAL A 63 12.296 28.157 -12.285 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.708 26.629 -12.705 1.00 0.00 H new ATOM 0 HG22 VAL A 63 10.179 27.291 -11.122 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.592 27.695 -11.818 1.00 0.00 H new ATOM 1058 N GLU A 64 8.005 30.903 -12.381 1.00 0.00 N ATOM 1059 CA GLU A 64 6.570 31.108 -12.239 1.00 0.00 C ATOM 1060 C GLU A 64 5.912 30.091 -13.166 1.00 0.00 C ATOM 1061 O GLU A 64 6.195 30.094 -14.361 1.00 0.00 O ATOM 1062 CB GLU A 64 6.198 32.556 -12.596 1.00 0.00 C ATOM 1063 CG GLU A 64 4.695 32.811 -12.413 1.00 0.00 C ATOM 1064 CD GLU A 64 4.351 34.301 -12.590 1.00 0.00 C ATOM 1065 OE1 GLU A 64 4.198 34.768 -13.741 1.00 0.00 O ATOM 1066 OE2 GLU A 64 4.214 35.020 -11.574 1.00 0.00 O ATOM 0 H GLU A 64 8.366 31.215 -13.282 1.00 0.00 H new ATOM 0 HA GLU A 64 6.229 30.961 -11.214 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.764 33.244 -11.968 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.480 32.761 -13.629 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.134 32.218 -13.135 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.387 32.480 -11.421 1.00 0.00 H new ATOM 1073 N VAL A 65 5.089 29.191 -12.633 1.00 0.00 N ATOM 1074 CA VAL A 65 4.313 28.263 -13.449 1.00 0.00 C ATOM 1075 C VAL A 65 3.097 29.015 -13.983 1.00 0.00 C ATOM 1076 O VAL A 65 2.446 29.749 -13.234 1.00 0.00 O ATOM 1077 CB VAL A 65 3.943 26.953 -12.708 1.00 0.00 C ATOM 1078 CG1 VAL A 65 5.051 26.473 -11.751 1.00 0.00 C ATOM 1079 CG2 VAL A 65 2.597 26.944 -11.974 1.00 0.00 C ATOM 0 H VAL A 65 4.942 29.085 -11.629 1.00 0.00 H new ATOM 0 HA VAL A 65 4.924 27.919 -14.283 1.00 0.00 H new ATOM 0 HB VAL A 65 3.837 26.251 -13.535 1.00 0.00 H new ATOM 0 HG11 VAL A 65 4.735 25.552 -11.261 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.965 26.288 -12.316 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.238 27.239 -10.998 1.00 0.00 H new ATOM 0 HG21 VAL A 65 2.450 25.976 -11.495 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.590 27.728 -11.217 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.792 27.122 -12.687 1.00 0.00 H new ATOM 1089 N LEU A 66 2.771 28.821 -15.261 1.00 0.00 N ATOM 1090 CA LEU A 66 1.643 29.493 -15.899 1.00 0.00 C ATOM 1091 C LEU A 66 0.398 28.605 -15.889 1.00 0.00 C ATOM 1092 O LEU A 66 -0.720 29.119 -15.934 1.00 0.00 O ATOM 1093 CB LEU A 66 1.980 29.897 -17.348 1.00 0.00 C ATOM 1094 CG LEU A 66 3.157 30.875 -17.559 1.00 0.00 C ATOM 1095 CD1 LEU A 66 3.167 32.039 -16.560 1.00 0.00 C ATOM 1096 CD2 LEU A 66 4.517 30.171 -17.527 1.00 0.00 C ATOM 0 H LEU A 66 3.282 28.193 -15.881 1.00 0.00 H new ATOM 0 HA LEU A 66 1.438 30.396 -15.324 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.193 28.988 -17.910 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.089 30.343 -17.789 1.00 0.00 H new ATOM 0 HG LEU A 66 2.994 31.286 -18.555 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.019 32.687 -16.765 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.244 32.611 -16.658 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.245 31.647 -15.546 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.310 30.903 -17.680 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.653 29.686 -16.560 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.558 29.422 -18.318 1.00 0.00 H new ATOM 1108 N GLY A 67 0.575 27.283 -15.831 1.00 0.00 N ATOM 1109 CA GLY A 67 -0.483 26.303 -15.958 1.00 0.00 C ATOM 1110 C GLY A 67 0.137 24.955 -16.292 1.00 0.00 C ATOM 1111 O GLY A 67 1.340 24.861 -16.553 1.00 0.00 O ATOM 0 H GLY A 67 1.493 26.861 -15.689 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.051 26.238 -15.030 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.182 26.601 -16.739 1.00 0.00 H new ATOM 1115 N MET A 68 -0.678 23.905 -16.281 1.00 0.00 N ATOM 1116 CA MET A 68 -0.259 22.601 -16.784 1.00 0.00 C ATOM 1117 C MET A 68 -0.016 22.671 -18.293 1.00 0.00 C ATOM 1118 O MET A 68 -0.628 23.476 -19.002 1.00 0.00 O ATOM 1119 CB MET A 68 -1.272 21.504 -16.445 1.00 0.00 C ATOM 1120 CG MET A 68 -1.309 21.238 -14.938 1.00 0.00 C ATOM 1121 SD MET A 68 -2.251 19.763 -14.486 1.00 0.00 S ATOM 1122 CE MET A 68 -0.994 18.481 -14.736 1.00 0.00 C ATOM 0 H MET A 68 -1.635 23.932 -15.928 1.00 0.00 H new ATOM 0 HA MET A 68 0.675 22.337 -16.287 1.00 0.00 H new ATOM 0 HB2 MET A 68 -2.263 21.800 -16.790 1.00 0.00 H new ATOM 0 HB3 MET A 68 -1.011 20.587 -16.973 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.288 21.133 -14.571 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.741 22.103 -14.435 1.00 0.00 H new ATOM 0 HE1 MET A 68 -1.417 17.505 -14.499 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.666 18.491 -15.775 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.142 18.675 -14.084 1.00 0.00 H new ATOM 1132 N ALA A 69 0.871 21.801 -18.777 1.00 0.00 N ATOM 1133 CA ALA A 69 1.075 21.571 -20.204 1.00 0.00 C ATOM 1134 C ALA A 69 -0.207 20.985 -20.835 1.00 0.00 C ATOM 1135 O ALA A 69 -1.070 20.487 -20.102 1.00 0.00 O ATOM 1136 CB ALA A 69 2.251 20.602 -20.362 1.00 0.00 C ATOM 0 H ALA A 69 1.473 21.232 -18.182 1.00 0.00 H new ATOM 0 HA ALA A 69 1.297 22.508 -20.715 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.426 20.412 -21.421 1.00 0.00 H new ATOM 0 HB2 ALA A 69 3.145 21.040 -19.919 1.00 0.00 H new ATOM 0 HB3 ALA A 69 2.019 19.663 -19.858 1.00 0.00 H new ATOM 1142 N PRO A 70 -0.346 20.998 -22.174 1.00 0.00 N ATOM 1143 CA PRO A 70 -1.461 20.339 -22.843 1.00 0.00 C ATOM 1144 C PRO A 70 -1.425 18.819 -22.636 1.00 0.00 C ATOM 1145 O PRO A 70 -0.381 18.222 -22.353 1.00 0.00 O ATOM 1146 CB PRO A 70 -1.351 20.727 -24.322 1.00 0.00 C ATOM 1147 CG PRO A 70 0.131 21.048 -24.501 1.00 0.00 C ATOM 1148 CD PRO A 70 0.511 21.655 -23.153 1.00 0.00 C ATOM 0 HA PRO A 70 -2.418 20.657 -22.430 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -1.666 19.913 -24.974 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -1.979 21.586 -24.559 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.715 20.154 -24.721 1.00 0.00 H new ATOM 0 HG3 PRO A 70 0.297 21.747 -25.321 1.00 0.00 H new ATOM 0 HD2 PRO A 70 1.564 21.485 -22.929 1.00 0.00 H new ATOM 0 HD3 PRO A 70 0.354 22.734 -23.150 1.00 0.00 H new ATOM 1156 N ASP A 71 -2.578 18.185 -22.855 1.00 0.00 N ATOM 1157 CA ASP A 71 -2.791 16.749 -22.675 1.00 0.00 C ATOM 1158 C ASP A 71 -1.817 15.886 -23.484 1.00 0.00 C ATOM 1159 O ASP A 71 -1.506 14.771 -23.073 1.00 0.00 O ATOM 1160 CB ASP A 71 -4.238 16.372 -23.025 1.00 0.00 C ATOM 1161 CG ASP A 71 -4.463 16.140 -24.531 1.00 0.00 C ATOM 1162 OD1 ASP A 71 -4.552 17.133 -25.287 1.00 0.00 O ATOM 1163 OD2 ASP A 71 -4.594 14.973 -24.961 1.00 0.00 O ATOM 0 H ASP A 71 -3.416 18.673 -23.173 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.598 16.542 -21.622 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -4.512 15.468 -22.481 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.905 17.164 -22.683 1.00 0.00 H new ATOM 1168 N ASP A 72 -1.306 16.407 -24.603 1.00 0.00 N ATOM 1169 CA ASP A 72 -0.358 15.705 -25.467 1.00 0.00 C ATOM 1170 C ASP A 72 0.960 15.417 -24.746 1.00 0.00 C ATOM 1171 O ASP A 72 1.598 14.394 -25.000 1.00 0.00 O ATOM 1172 CB ASP A 72 -0.091 16.535 -26.727 1.00 0.00 C ATOM 1173 CG ASP A 72 0.924 15.836 -27.648 1.00 0.00 C ATOM 1174 OD1 ASP A 72 0.563 14.828 -28.296 1.00 0.00 O ATOM 1175 OD2 ASP A 72 2.073 16.319 -27.767 1.00 0.00 O ATOM 0 H ASP A 72 -1.544 17.341 -24.937 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.803 14.749 -25.742 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.025 16.694 -27.265 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.286 17.518 -26.445 1.00 0.00 H new ATOM 1180 N GLU A 73 1.352 16.291 -23.817 1.00 0.00 N ATOM 1181 CA GLU A 73 2.496 16.051 -22.948 1.00 0.00 C ATOM 1182 C GLU A 73 2.055 15.171 -21.783 1.00 0.00 C ATOM 1183 O GLU A 73 2.700 14.163 -21.488 1.00 0.00 O ATOM 1184 CB GLU A 73 3.071 17.378 -22.421 1.00 0.00 C ATOM 1185 CG GLU A 73 3.722 18.253 -23.505 1.00 0.00 C ATOM 1186 CD GLU A 73 4.938 17.608 -24.203 1.00 0.00 C ATOM 1187 OE1 GLU A 73 5.496 16.604 -23.703 1.00 0.00 O ATOM 1188 OE2 GLU A 73 5.359 18.125 -25.263 1.00 0.00 O ATOM 0 H GLU A 73 0.884 17.182 -23.649 1.00 0.00 H new ATOM 0 HA GLU A 73 3.279 15.549 -23.517 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.271 17.944 -21.944 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.811 17.161 -21.651 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.972 18.494 -24.258 1.00 0.00 H new ATOM 0 HG3 GLU A 73 4.035 19.195 -23.054 1.00 0.00 H new ATOM 1195 N CYS A 74 0.924 15.509 -21.155 1.00 0.00 N ATOM 1196 CA CYS A 74 0.475 14.912 -19.900 1.00 0.00 C ATOM 1197 C CYS A 74 0.016 13.443 -19.993 1.00 0.00 C ATOM 1198 O CYS A 74 -0.580 12.924 -19.050 1.00 0.00 O ATOM 1199 CB CYS A 74 -0.574 15.819 -19.252 1.00 0.00 C ATOM 1200 SG CYS A 74 0.168 17.443 -18.908 1.00 0.00 S ATOM 0 H CYS A 74 0.286 16.219 -21.514 1.00 0.00 H new ATOM 0 HA CYS A 74 1.352 14.849 -19.256 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -1.433 15.931 -19.913 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -0.939 15.370 -18.328 1.00 0.00 H new ATOM 0 HG CYS A 74 -0.757 18.269 -18.517 1.00 0.00 H new ATOM 1206 N LEU A 75 0.285 12.762 -21.109 1.00 0.00 N ATOM 1207 CA LEU A 75 0.118 11.319 -21.288 1.00 0.00 C ATOM 1208 C LEU A 75 1.379 10.550 -20.856 1.00 0.00 C ATOM 1209 O LEU A 75 1.353 9.319 -20.821 1.00 0.00 O ATOM 1210 CB LEU A 75 -0.162 11.029 -22.777 1.00 0.00 C ATOM 1211 CG LEU A 75 -1.624 11.280 -23.191 1.00 0.00 C ATOM 1212 CD1 LEU A 75 -1.720 11.406 -24.714 1.00 0.00 C ATOM 1213 CD2 LEU A 75 -2.544 10.146 -22.715 1.00 0.00 C ATOM 0 H LEU A 75 0.640 13.221 -21.948 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.714 10.989 -20.666 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.492 11.651 -23.389 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.094 9.991 -22.991 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.950 12.207 -22.720 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.757 11.583 -25.000 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.103 12.240 -25.050 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -1.368 10.485 -25.178 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.568 10.355 -23.024 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.217 9.204 -23.155 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.500 10.074 -21.628 1.00 0.00 H new ATOM 1225 N LYS A 76 2.479 11.247 -20.537 1.00 0.00 N ATOM 1226 CA LYS A 76 3.806 10.646 -20.332 1.00 0.00 C ATOM 1227 C LYS A 76 4.344 10.871 -18.921 1.00 0.00 C ATOM 1228 O LYS A 76 5.033 10.010 -18.375 1.00 0.00 O ATOM 1229 CB LYS A 76 4.786 11.247 -21.358 1.00 0.00 C ATOM 1230 CG LYS A 76 4.407 10.926 -22.814 1.00 0.00 C ATOM 1231 CD LYS A 76 5.293 11.635 -23.848 1.00 0.00 C ATOM 1232 CE LYS A 76 5.046 13.154 -23.908 1.00 0.00 C ATOM 1233 NZ LYS A 76 6.088 13.956 -23.219 1.00 0.00 N ATOM 0 H LYS A 76 2.472 12.259 -20.412 1.00 0.00 H new ATOM 0 HA LYS A 76 3.708 9.569 -20.467 1.00 0.00 H new ATOM 0 HB2 LYS A 76 4.821 12.329 -21.228 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.789 10.869 -21.158 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.472 9.849 -22.969 1.00 0.00 H new ATOM 0 HG3 LYS A 76 3.368 11.210 -22.982 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.340 11.452 -23.608 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.111 11.203 -24.832 1.00 0.00 H new ATOM 0 HE2 LYS A 76 4.993 13.464 -24.952 1.00 0.00 H new ATOM 0 HE3 LYS A 76 4.076 13.373 -23.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.885 14.968 -23.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.090 13.725 -22.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.020 13.737 -23.626 1.00 0.00 H new ATOM 1247 N ASP A 77 4.030 12.020 -18.337 1.00 0.00 N ATOM 1248 CA ASP A 77 4.416 12.490 -17.004 1.00 0.00 C ATOM 1249 C ASP A 77 3.447 13.643 -16.715 1.00 0.00 C ATOM 1250 O ASP A 77 2.674 14.010 -17.607 1.00 0.00 O ATOM 1251 CB ASP A 77 5.875 12.994 -17.008 1.00 0.00 C ATOM 1252 CG ASP A 77 6.553 12.904 -15.632 1.00 0.00 C ATOM 1253 OD1 ASP A 77 6.124 13.602 -14.688 1.00 0.00 O ATOM 1254 OD2 ASP A 77 7.543 12.145 -15.516 1.00 0.00 O ATOM 0 H ASP A 77 3.451 12.707 -18.820 1.00 0.00 H new ATOM 0 HA ASP A 77 4.364 11.703 -16.252 1.00 0.00 H new ATOM 0 HB2 ASP A 77 6.451 12.412 -17.728 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.893 14.030 -17.347 1.00 0.00 H new ATOM 1259 N MET A 78 3.445 14.233 -15.523 1.00 0.00 N ATOM 1260 CA MET A 78 2.695 15.474 -15.309 1.00 0.00 C ATOM 1261 C MET A 78 3.636 16.628 -15.658 1.00 0.00 C ATOM 1262 O MET A 78 4.803 16.590 -15.267 1.00 0.00 O ATOM 1263 CB MET A 78 2.197 15.566 -13.861 1.00 0.00 C ATOM 1264 CG MET A 78 1.100 14.540 -13.548 1.00 0.00 C ATOM 1265 SD MET A 78 -0.448 14.701 -14.488 1.00 0.00 S ATOM 1266 CE MET A 78 -0.241 13.363 -15.695 1.00 0.00 C ATOM 0 H MET A 78 3.942 13.884 -14.704 1.00 0.00 H new ATOM 0 HA MET A 78 1.807 15.510 -15.940 1.00 0.00 H new ATOM 0 HB2 MET A 78 3.036 15.414 -13.182 1.00 0.00 H new ATOM 0 HB3 MET A 78 1.814 16.570 -13.675 1.00 0.00 H new ATOM 0 HG2 MET A 78 1.504 13.543 -13.723 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.863 14.606 -12.486 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.650 13.674 -16.656 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.819 13.136 -15.808 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.767 12.474 -15.347 1.00 0.00 H new ATOM 1276 N TYR A 79 3.161 17.671 -16.348 1.00 0.00 N ATOM 1277 CA TYR A 79 4.008 18.770 -16.820 1.00 0.00 C ATOM 1278 C TYR A 79 3.308 20.116 -16.641 1.00 0.00 C ATOM 1279 O TYR A 79 2.078 20.192 -16.597 1.00 0.00 O ATOM 1280 CB TYR A 79 4.350 18.607 -18.311 1.00 0.00 C ATOM 1281 CG TYR A 79 5.124 17.383 -18.753 1.00 0.00 C ATOM 1282 CD1 TYR A 79 4.420 16.214 -19.088 1.00 0.00 C ATOM 1283 CD2 TYR A 79 6.513 17.452 -18.979 1.00 0.00 C ATOM 1284 CE1 TYR A 79 5.094 15.121 -19.649 1.00 0.00 C ATOM 1285 CE2 TYR A 79 7.194 16.357 -19.547 1.00 0.00 C ATOM 1286 CZ TYR A 79 6.481 15.184 -19.886 1.00 0.00 C ATOM 1287 OH TYR A 79 7.097 14.108 -20.458 1.00 0.00 O ATOM 0 H TYR A 79 2.177 17.776 -16.595 1.00 0.00 H new ATOM 0 HA TYR A 79 4.921 18.742 -16.225 1.00 0.00 H new ATOM 0 HB2 TYR A 79 3.413 18.624 -18.868 1.00 0.00 H new ATOM 0 HB3 TYR A 79 4.919 19.485 -18.617 1.00 0.00 H new ATOM 0 HD1 TYR A 79 3.356 16.158 -18.913 1.00 0.00 H new ATOM 0 HD2 TYR A 79 7.057 18.347 -18.716 1.00 0.00 H new ATOM 0 HE1 TYR A 79 4.547 14.225 -19.901 1.00 0.00 H new ATOM 0 HE2 TYR A 79 8.258 16.414 -19.723 1.00 0.00 H new ATOM 0 HH TYR A 79 8.053 14.296 -20.562 1.00 0.00 H new ATOM 1297 N VAL A 80 4.106 21.181 -16.603 1.00 0.00 N ATOM 1298 CA VAL A 80 3.677 22.552 -16.378 1.00 0.00 C ATOM 1299 C VAL A 80 4.519 23.465 -17.262 1.00 0.00 C ATOM 1300 O VAL A 80 5.709 23.221 -17.461 1.00 0.00 O ATOM 1301 CB VAL A 80 3.798 22.936 -14.884 1.00 0.00 C ATOM 1302 CG1 VAL A 80 2.611 22.413 -14.066 1.00 0.00 C ATOM 1303 CG2 VAL A 80 5.097 22.444 -14.220 1.00 0.00 C ATOM 0 H VAL A 80 5.115 21.104 -16.735 1.00 0.00 H new ATOM 0 HA VAL A 80 2.625 22.661 -16.641 1.00 0.00 H new ATOM 0 HB VAL A 80 3.808 24.026 -14.883 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.732 22.703 -13.022 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.686 22.838 -14.455 1.00 0.00 H new ATOM 0 HG13 VAL A 80 2.570 21.326 -14.138 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.110 22.751 -13.174 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.147 21.357 -14.280 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.955 22.875 -14.735 1.00 0.00 H new ATOM 1313 N GLU A 81 3.897 24.506 -17.805 1.00 0.00 N ATOM 1314 CA GLU A 81 4.599 25.577 -18.491 1.00 0.00 C ATOM 1315 C GLU A 81 5.146 26.501 -17.405 1.00 0.00 C ATOM 1316 O GLU A 81 4.422 26.819 -16.456 1.00 0.00 O ATOM 1317 CB GLU A 81 3.644 26.335 -19.424 1.00 0.00 C ATOM 1318 CG GLU A 81 3.145 25.453 -20.577 1.00 0.00 C ATOM 1319 CD GLU A 81 2.305 26.263 -21.581 1.00 0.00 C ATOM 1320 OE1 GLU A 81 1.111 26.526 -21.316 1.00 0.00 O ATOM 1321 OE2 GLU A 81 2.826 26.629 -22.659 1.00 0.00 O ATOM 0 H GLU A 81 2.885 24.628 -17.780 1.00 0.00 H new ATOM 0 HA GLU A 81 5.405 25.187 -19.112 1.00 0.00 H new ATOM 0 HB2 GLU A 81 2.791 26.700 -18.851 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.152 27.209 -19.830 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.997 25.006 -21.090 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.547 24.634 -20.178 1.00 0.00 H new ATOM 1328 N VAL A 82 6.398 26.940 -17.528 1.00 0.00 N ATOM 1329 CA VAL A 82 7.071 27.733 -16.505 1.00 0.00 C ATOM 1330 C VAL A 82 7.868 28.861 -17.161 1.00 0.00 C ATOM 1331 O VAL A 82 8.379 28.693 -18.266 1.00 0.00 O ATOM 1332 CB VAL A 82 7.943 26.840 -15.590 1.00 0.00 C ATOM 1333 CG1 VAL A 82 7.154 25.676 -14.969 1.00 0.00 C ATOM 1334 CG2 VAL A 82 9.184 26.253 -16.281 1.00 0.00 C ATOM 0 H VAL A 82 6.976 26.753 -18.347 1.00 0.00 H new ATOM 0 HA VAL A 82 6.323 28.192 -15.858 1.00 0.00 H new ATOM 0 HB VAL A 82 8.272 27.528 -14.811 1.00 0.00 H new ATOM 0 HG11 VAL A 82 7.816 25.084 -14.337 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.336 26.071 -14.367 1.00 0.00 H new ATOM 0 HG13 VAL A 82 6.750 25.046 -15.762 1.00 0.00 H new ATOM 0 HG21 VAL A 82 9.740 25.640 -15.571 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.873 25.638 -17.126 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.820 27.064 -16.637 1.00 0.00 H new ATOM 1344 N ALA A 83 8.003 29.997 -16.481 1.00 0.00 N ATOM 1345 CA ALA A 83 8.744 31.163 -16.934 1.00 0.00 C ATOM 1346 C ALA A 83 9.849 31.407 -15.917 1.00 0.00 C ATOM 1347 O ALA A 83 9.614 31.376 -14.708 1.00 0.00 O ATOM 1348 CB ALA A 83 7.818 32.378 -17.051 1.00 0.00 C ATOM 0 H ALA A 83 7.581 30.132 -15.562 1.00 0.00 H new ATOM 0 HA ALA A 83 9.169 30.997 -17.924 1.00 0.00 H new ATOM 0 HB1 ALA A 83 8.391 33.241 -17.391 1.00 0.00 H new ATOM 0 HB2 ALA A 83 7.025 32.163 -17.767 1.00 0.00 H new ATOM 0 HB3 ALA A 83 7.378 32.595 -16.078 1.00 0.00 H new ATOM 1354 N ASP A 84 11.065 31.607 -16.409 1.00 0.00 N ATOM 1355 CA ASP A 84 12.269 31.645 -15.592 1.00 0.00 C ATOM 1356 C ASP A 84 12.447 33.056 -15.043 1.00 0.00 C ATOM 1357 O ASP A 84 13.006 33.927 -15.716 1.00 0.00 O ATOM 1358 CB ASP A 84 13.454 31.172 -16.443 1.00 0.00 C ATOM 1359 CG ASP A 84 14.730 30.898 -15.638 1.00 0.00 C ATOM 1360 OD1 ASP A 84 14.933 31.483 -14.554 1.00 0.00 O ATOM 1361 OD2 ASP A 84 15.530 30.061 -16.116 1.00 0.00 O ATOM 0 H ASP A 84 11.244 31.750 -17.403 1.00 0.00 H new ATOM 0 HA ASP A 84 12.198 30.975 -14.735 1.00 0.00 H new ATOM 0 HB2 ASP A 84 13.168 30.263 -16.972 1.00 0.00 H new ATOM 0 HB3 ASP A 84 13.669 31.927 -17.199 1.00 0.00 H new ATOM 1366 N ILE A 85 11.874 33.300 -13.861 1.00 0.00 N ATOM 1367 CA ILE A 85 11.894 34.584 -13.162 1.00 0.00 C ATOM 1368 C ILE A 85 13.342 35.098 -13.103 1.00 0.00 C ATOM 1369 O ILE A 85 14.194 34.517 -12.429 1.00 0.00 O ATOM 1370 CB ILE A 85 11.264 34.473 -11.750 1.00 0.00 C ATOM 1371 CG1 ILE A 85 9.840 33.868 -11.759 1.00 0.00 C ATOM 1372 CG2 ILE A 85 11.208 35.861 -11.081 1.00 0.00 C ATOM 1373 CD1 ILE A 85 9.305 33.562 -10.351 1.00 0.00 C ATOM 0 H ILE A 85 11.365 32.581 -13.347 1.00 0.00 H new ATOM 0 HA ILE A 85 11.285 35.302 -13.712 1.00 0.00 H new ATOM 0 HB ILE A 85 11.906 33.796 -11.187 1.00 0.00 H new ATOM 0 HG12 ILE A 85 9.161 34.560 -12.256 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.846 32.950 -12.346 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.764 35.770 -10.090 1.00 0.00 H new ATOM 0 HG22 ILE A 85 12.217 36.262 -10.990 1.00 0.00 H new ATOM 0 HG23 ILE A 85 10.603 36.534 -11.689 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.303 33.140 -10.426 1.00 0.00 H new ATOM 0 HD12 ILE A 85 9.964 32.847 -9.859 1.00 0.00 H new ATOM 0 HD13 ILE A 85 9.268 34.482 -9.768 1.00 0.00 H new ATOM 1457 N VAL A 92 9.176 31.375 -21.958 1.00 0.00 N ATOM 1458 CA VAL A 92 8.536 30.249 -21.296 1.00 0.00 C ATOM 1459 C VAL A 92 9.161 28.922 -21.751 1.00 0.00 C ATOM 1460 O VAL A 92 9.654 28.791 -22.875 1.00 0.00 O ATOM 1461 CB VAL A 92 7.015 30.365 -21.558 1.00 0.00 C ATOM 1462 CG1 VAL A 92 6.624 30.187 -23.035 1.00 0.00 C ATOM 1463 CG2 VAL A 92 6.176 29.418 -20.694 1.00 0.00 C ATOM 0 HA VAL A 92 8.695 30.267 -20.218 1.00 0.00 H new ATOM 0 HB VAL A 92 6.786 31.391 -21.270 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.543 30.281 -23.139 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.115 30.952 -23.636 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.937 29.201 -23.378 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.120 29.551 -20.928 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.466 28.387 -20.897 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.345 29.641 -19.640 1.00 0.00 H new ATOM 1473 N TYR A 93 9.106 27.941 -20.854 1.00 0.00 N ATOM 1474 CA TYR A 93 9.596 26.579 -20.997 1.00 0.00 C ATOM 1475 C TYR A 93 8.507 25.620 -20.493 1.00 0.00 C ATOM 1476 O TYR A 93 7.442 26.052 -20.047 1.00 0.00 O ATOM 1477 CB TYR A 93 10.883 26.410 -20.163 1.00 0.00 C ATOM 1478 CG TYR A 93 12.057 27.310 -20.515 1.00 0.00 C ATOM 1479 CD1 TYR A 93 12.627 27.261 -21.803 1.00 0.00 C ATOM 1480 CD2 TYR A 93 12.636 28.134 -19.528 1.00 0.00 C ATOM 1481 CE1 TYR A 93 13.773 28.019 -22.102 1.00 0.00 C ATOM 1482 CE2 TYR A 93 13.792 28.883 -19.815 1.00 0.00 C ATOM 1483 CZ TYR A 93 14.372 28.820 -21.104 1.00 0.00 C ATOM 1484 OH TYR A 93 15.517 29.506 -21.385 1.00 0.00 O ATOM 0 H TYR A 93 8.684 28.093 -19.938 1.00 0.00 H new ATOM 0 HA TYR A 93 9.824 26.360 -22.040 1.00 0.00 H new ATOM 0 HB2 TYR A 93 10.632 26.575 -19.115 1.00 0.00 H new ATOM 0 HB3 TYR A 93 11.211 25.374 -20.253 1.00 0.00 H new ATOM 0 HD1 TYR A 93 12.181 26.638 -22.564 1.00 0.00 H new ATOM 0 HD2 TYR A 93 12.190 28.191 -18.546 1.00 0.00 H new ATOM 0 HE1 TYR A 93 14.196 27.989 -23.095 1.00 0.00 H new ATOM 0 HE2 TYR A 93 14.236 29.505 -19.052 1.00 0.00 H new ATOM 0 HH TYR A 93 15.800 30.009 -20.593 1.00 0.00 H new ATOM 1494 N THR A 94 8.803 24.322 -20.499 1.00 0.00 N ATOM 1495 CA THR A 94 7.972 23.293 -19.883 1.00 0.00 C ATOM 1496 C THR A 94 8.871 22.475 -18.955 1.00 0.00 C ATOM 1497 O THR A 94 10.021 22.179 -19.295 1.00 0.00 O ATOM 1498 CB THR A 94 7.274 22.431 -20.958 1.00 0.00 C ATOM 1499 OG1 THR A 94 6.794 23.227 -22.029 1.00 0.00 O ATOM 1500 CG2 THR A 94 6.076 21.662 -20.390 1.00 0.00 C ATOM 0 H THR A 94 9.644 23.950 -20.941 1.00 0.00 H new ATOM 0 HA THR A 94 7.166 23.736 -19.299 1.00 0.00 H new ATOM 0 HB THR A 94 8.031 21.731 -21.311 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.359 22.653 -22.694 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.616 21.070 -21.181 1.00 0.00 H new ATOM 0 HG22 THR A 94 6.413 21.001 -19.591 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.346 22.367 -19.993 1.00 0.00 H new ATOM 1508 N ALA A 95 8.337 22.123 -17.788 1.00 0.00 N ATOM 1509 CA ALA A 95 8.990 21.331 -16.760 1.00 0.00 C ATOM 1510 C ALA A 95 8.040 20.199 -16.379 1.00 0.00 C ATOM 1511 O ALA A 95 6.829 20.309 -16.582 1.00 0.00 O ATOM 1512 CB ALA A 95 9.282 22.226 -15.548 1.00 0.00 C ATOM 0 H ALA A 95 7.391 22.398 -17.525 1.00 0.00 H new ATOM 0 HA ALA A 95 9.934 20.917 -17.115 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.772 21.639 -14.772 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.934 23.045 -15.850 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.347 22.631 -15.161 1.00 0.00 H new ATOM 1518 N LYS A 96 8.567 19.113 -15.810 1.00 0.00 N ATOM 1519 CA LYS A 96 7.702 18.103 -15.223 1.00 0.00 C ATOM 1520 C LYS A 96 7.232 18.675 -13.894 1.00 0.00 C ATOM 1521 O LYS A 96 8.026 19.283 -13.175 1.00 0.00 O ATOM 1522 CB LYS A 96 8.416 16.761 -14.987 1.00 0.00 C ATOM 1523 CG LYS A 96 8.709 15.930 -16.249 1.00 0.00 C ATOM 1524 CD LYS A 96 9.899 16.385 -17.110 1.00 0.00 C ATOM 1525 CE LYS A 96 11.220 16.305 -16.327 1.00 0.00 C ATOM 1526 NZ LYS A 96 12.403 16.637 -17.158 1.00 0.00 N ATOM 0 H LYS A 96 9.566 18.918 -15.746 1.00 0.00 H new ATOM 0 HA LYS A 96 6.880 17.886 -15.905 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.359 16.957 -14.476 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.807 16.160 -14.312 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.883 14.898 -15.945 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.816 15.932 -16.874 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.964 15.762 -18.002 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.736 17.408 -17.448 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.175 16.987 -15.478 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.337 15.300 -15.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.264 16.567 -16.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.466 15.971 -17.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.309 17.606 -17.524 1.00 0.00 H new ATOM 1540 N LEU A 97 5.982 18.422 -13.515 1.00 0.00 N ATOM 1541 CA LEU A 97 5.513 18.720 -12.162 1.00 0.00 C ATOM 1542 C LEU A 97 6.352 17.897 -11.168 1.00 0.00 C ATOM 1543 O LEU A 97 6.635 18.345 -10.062 1.00 0.00 O ATOM 1544 CB LEU A 97 4.015 18.398 -12.024 1.00 0.00 C ATOM 1545 CG LEU A 97 3.397 18.900 -10.700 1.00 0.00 C ATOM 1546 CD1 LEU A 97 3.362 20.434 -10.636 1.00 0.00 C ATOM 1547 CD2 LEU A 97 1.969 18.363 -10.566 1.00 0.00 C ATOM 0 H LEU A 97 5.275 18.011 -14.125 1.00 0.00 H new ATOM 0 HA LEU A 97 5.634 19.782 -11.950 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.477 18.845 -12.860 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.875 17.319 -12.095 1.00 0.00 H new ATOM 0 HG LEU A 97 4.020 18.537 -9.883 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.921 20.749 -9.690 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.377 20.825 -10.711 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.763 20.819 -11.462 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.533 18.717 -9.632 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.368 18.716 -11.404 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.989 17.273 -10.567 1.00 0.00 H new ATOM 1559 N SER A 98 6.817 16.726 -11.612 1.00 0.00 N ATOM 1560 CA SER A 98 7.748 15.839 -10.926 1.00 0.00 C ATOM 1561 C SER A 98 9.097 16.498 -10.589 1.00 0.00 C ATOM 1562 O SER A 98 9.808 16.011 -9.709 1.00 0.00 O ATOM 1563 CB SER A 98 7.948 14.626 -11.844 1.00 0.00 C ATOM 1564 OG SER A 98 6.674 14.102 -12.173 1.00 0.00 O ATOM 0 H SER A 98 6.533 16.353 -12.518 1.00 0.00 H new ATOM 0 HA SER A 98 7.329 15.559 -9.959 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.483 14.918 -12.748 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.553 13.868 -11.346 1.00 0.00 H new ATOM 0 HG SER A 98 6.604 13.999 -13.145 1.00 0.00 H new ATOM 1570 N ASP A 99 9.438 17.609 -11.251 1.00 0.00 N ATOM 1571 CA ASP A 99 10.681 18.360 -11.059 1.00 0.00 C ATOM 1572 C ASP A 99 10.386 19.728 -10.426 1.00 0.00 C ATOM 1573 O ASP A 99 11.285 20.552 -10.287 1.00 0.00 O ATOM 1574 CB ASP A 99 11.419 18.541 -12.406 1.00 0.00 C ATOM 1575 CG ASP A 99 12.267 17.352 -12.887 1.00 0.00 C ATOM 1576 OD1 ASP A 99 12.242 16.255 -12.285 1.00 0.00 O ATOM 1577 OD2 ASP A 99 12.956 17.525 -13.919 1.00 0.00 O ATOM 0 H ASP A 99 8.834 18.024 -11.960 1.00 0.00 H new ATOM 0 HA ASP A 99 11.325 17.795 -10.385 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.678 18.765 -13.174 1.00 0.00 H new ATOM 0 HB3 ASP A 99 12.068 19.413 -12.325 1.00 0.00 H new ATOM 1582 N ILE A 100 9.143 20.001 -10.029 1.00 0.00 N ATOM 1583 CA ILE A 100 8.716 21.293 -9.505 1.00 0.00 C ATOM 1584 C ILE A 100 8.371 21.131 -8.032 1.00 0.00 C ATOM 1585 O ILE A 100 7.852 20.106 -7.583 1.00 0.00 O ATOM 1586 CB ILE A 100 7.566 21.857 -10.379 1.00 0.00 C ATOM 1587 CG1 ILE A 100 8.176 22.557 -11.613 1.00 0.00 C ATOM 1588 CG2 ILE A 100 6.554 22.770 -9.658 1.00 0.00 C ATOM 1589 CD1 ILE A 100 8.576 24.026 -11.435 1.00 0.00 C ATOM 0 H ILE A 100 8.391 19.313 -10.065 1.00 0.00 H new ATOM 0 HA ILE A 100 9.513 22.035 -9.558 1.00 0.00 H new ATOM 0 HB ILE A 100 6.961 20.999 -10.671 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.059 21.997 -11.921 1.00 0.00 H new ATOM 0 HG13 ILE A 100 7.458 22.495 -12.431 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.796 23.104 -10.367 1.00 0.00 H new ATOM 0 HG22 ILE A 100 6.076 22.216 -8.850 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.073 23.636 -9.247 1.00 0.00 H new ATOM 0 HD11 ILE A 100 8.991 24.406 -12.369 1.00 0.00 H new ATOM 0 HD12 ILE A 100 7.698 24.612 -11.163 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.324 24.106 -10.646 1.00 0.00 H new ATOM 1601 N GLU A 101 8.654 22.196 -7.296 1.00 0.00 N ATOM 1602 CA GLU A 101 8.359 22.340 -5.882 1.00 0.00 C ATOM 1603 C GLU A 101 7.666 23.693 -5.736 1.00 0.00 C ATOM 1604 O GLU A 101 8.303 24.741 -5.853 1.00 0.00 O ATOM 1605 CB GLU A 101 9.660 22.210 -5.075 1.00 0.00 C ATOM 1606 CG GLU A 101 9.396 22.201 -3.564 1.00 0.00 C ATOM 1607 CD GLU A 101 10.699 22.020 -2.768 1.00 0.00 C ATOM 1608 OE1 GLU A 101 11.277 20.909 -2.787 1.00 0.00 O ATOM 1609 OE2 GLU A 101 11.147 22.979 -2.100 1.00 0.00 O ATOM 0 H GLU A 101 9.115 23.017 -7.687 1.00 0.00 H new ATOM 0 HA GLU A 101 7.700 21.564 -5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.174 21.292 -5.359 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.325 23.037 -5.323 1.00 0.00 H new ATOM 0 HG2 GLU A 101 8.916 23.135 -3.271 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.703 21.396 -3.319 1.00 0.00 H new ATOM 1616 N ALA A 102 6.340 23.678 -5.586 1.00 0.00 N ATOM 1617 CA ALA A 102 5.546 24.899 -5.542 1.00 0.00 C ATOM 1618 C ALA A 102 5.856 25.699 -4.275 1.00 0.00 C ATOM 1619 O ALA A 102 6.167 25.132 -3.223 1.00 0.00 O ATOM 1620 CB ALA A 102 4.057 24.556 -5.601 1.00 0.00 C ATOM 0 H ALA A 102 5.793 22.822 -5.492 1.00 0.00 H new ATOM 0 HA ALA A 102 5.803 25.512 -6.405 1.00 0.00 H new ATOM 0 HB1 ALA A 102 3.471 25.474 -5.568 1.00 0.00 H new ATOM 0 HB2 ALA A 102 3.843 24.022 -6.527 1.00 0.00 H new ATOM 0 HB3 ALA A 102 3.795 23.927 -4.751 1.00 0.00 H new ATOM 1626 N ILE A 103 5.715 27.018 -4.379 1.00 0.00 N ATOM 1627 CA ILE A 103 5.991 27.970 -3.310 1.00 0.00 C ATOM 1628 C ILE A 103 4.705 28.767 -3.056 1.00 0.00 C ATOM 1629 O ILE A 103 4.081 29.273 -3.990 1.00 0.00 O ATOM 1630 CB ILE A 103 7.195 28.863 -3.711 1.00 0.00 C ATOM 1631 CG1 ILE A 103 8.494 28.035 -3.881 1.00 0.00 C ATOM 1632 CG2 ILE A 103 7.439 29.982 -2.684 1.00 0.00 C ATOM 1633 CD1 ILE A 103 9.638 28.807 -4.553 1.00 0.00 C ATOM 0 H ILE A 103 5.395 27.466 -5.238 1.00 0.00 H new ATOM 0 HA ILE A 103 6.274 27.473 -2.382 1.00 0.00 H new ATOM 0 HB ILE A 103 6.936 29.312 -4.670 1.00 0.00 H new ATOM 0 HG12 ILE A 103 8.826 27.692 -2.901 1.00 0.00 H new ATOM 0 HG13 ILE A 103 8.272 27.146 -4.471 1.00 0.00 H new ATOM 0 HG21 ILE A 103 8.290 30.586 -2.999 1.00 0.00 H new ATOM 0 HG22 ILE A 103 6.552 30.612 -2.615 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.648 29.542 -1.709 1.00 0.00 H new ATOM 0 HD11 ILE A 103 10.512 28.162 -4.637 1.00 0.00 H new ATOM 0 HD12 ILE A 103 9.326 29.127 -5.547 1.00 0.00 H new ATOM 0 HD13 ILE A 103 9.889 29.682 -3.953 1.00 0.00 H new ATOM 1645 N ASP A 104 4.348 28.903 -1.773 1.00 0.00 N ATOM 1646 CA ASP A 104 3.229 29.712 -1.273 1.00 0.00 C ATOM 1647 C ASP A 104 1.903 29.445 -2.008 1.00 0.00 C ATOM 1648 O ASP A 104 1.155 30.364 -2.351 1.00 0.00 O ATOM 1649 CB ASP A 104 3.632 31.195 -1.234 1.00 0.00 C ATOM 1650 CG ASP A 104 2.591 32.077 -0.518 1.00 0.00 C ATOM 1651 OD1 ASP A 104 2.115 31.704 0.578 1.00 0.00 O ATOM 1652 OD2 ASP A 104 2.289 33.187 -1.014 1.00 0.00 O ATOM 0 H ASP A 104 4.853 28.432 -1.022 1.00 0.00 H new ATOM 0 HA ASP A 104 3.019 29.402 -0.249 1.00 0.00 H new ATOM 0 HB2 ASP A 104 4.593 31.293 -0.729 1.00 0.00 H new ATOM 0 HB3 ASP A 104 3.769 31.557 -2.253 1.00 0.00 H new ATOM 1657 N VAL A 105 1.620 28.168 -2.280 1.00 0.00 N ATOM 1658 CA VAL A 105 0.350 27.728 -2.859 1.00 0.00 C ATOM 1659 C VAL A 105 -0.654 27.364 -1.758 1.00 0.00 C ATOM 1660 O VAL A 105 -0.321 27.353 -0.568 1.00 0.00 O ATOM 1661 CB VAL A 105 0.571 26.556 -3.835 1.00 0.00 C ATOM 1662 CG1 VAL A 105 1.310 27.044 -5.081 1.00 0.00 C ATOM 1663 CG2 VAL A 105 1.269 25.340 -3.203 1.00 0.00 C ATOM 0 H VAL A 105 2.273 27.405 -2.102 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.073 28.555 -3.429 1.00 0.00 H new ATOM 0 HB VAL A 105 -0.418 26.196 -4.120 1.00 0.00 H new ATOM 0 HG11 VAL A 105 1.462 26.209 -5.765 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.719 27.815 -5.576 1.00 0.00 H new ATOM 0 HG13 VAL A 105 2.277 27.457 -4.792 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.388 24.558 -3.953 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.249 25.637 -2.829 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.665 24.962 -2.378 1.00 0.00 H new ATOM 1673 N ASP A 106 -1.891 27.061 -2.162 1.00 0.00 N ATOM 1674 CA ASP A 106 -2.906 26.522 -1.264 1.00 0.00 C ATOM 1675 C ASP A 106 -2.554 25.088 -0.865 1.00 0.00 C ATOM 1676 O ASP A 106 -1.782 24.397 -1.538 1.00 0.00 O ATOM 1677 CB ASP A 106 -4.286 26.537 -1.931 1.00 0.00 C ATOM 1678 CG ASP A 106 -5.423 26.311 -0.925 1.00 0.00 C ATOM 1679 OD1 ASP A 106 -5.812 27.271 -0.224 1.00 0.00 O ATOM 1680 OD2 ASP A 106 -5.901 25.163 -0.815 1.00 0.00 O ATOM 0 H ASP A 106 -2.213 27.184 -3.122 1.00 0.00 H new ATOM 0 HA ASP A 106 -2.935 27.151 -0.374 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -4.434 27.493 -2.434 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.324 25.764 -2.699 1.00 0.00 H new ATOM 1685 N ASP A 107 -3.198 24.622 0.196 1.00 0.00 N ATOM 1686 CA ASP A 107 -3.094 23.259 0.705 1.00 0.00 C ATOM 1687 C ASP A 107 -3.547 22.254 -0.343 1.00 0.00 C ATOM 1688 O ASP A 107 -2.912 21.217 -0.479 1.00 0.00 O ATOM 1689 CB ASP A 107 -3.940 23.113 1.973 1.00 0.00 C ATOM 1690 CG ASP A 107 -3.908 21.670 2.503 1.00 0.00 C ATOM 1691 OD1 ASP A 107 -2.880 21.263 3.089 1.00 0.00 O ATOM 1692 OD2 ASP A 107 -4.933 20.960 2.395 1.00 0.00 O ATOM 0 H ASP A 107 -3.830 25.203 0.747 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.050 23.057 0.943 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -3.569 23.793 2.740 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.969 23.402 1.761 1.00 0.00 H new ATOM 1697 N ASP A 108 -4.587 22.557 -1.125 1.00 0.00 N ATOM 1698 CA ASP A 108 -5.117 21.608 -2.102 1.00 0.00 C ATOM 1699 C ASP A 108 -4.161 21.453 -3.293 1.00 0.00 C ATOM 1700 O ASP A 108 -4.009 20.361 -3.839 1.00 0.00 O ATOM 1701 CB ASP A 108 -6.514 22.063 -2.551 1.00 0.00 C ATOM 1702 CG ASP A 108 -7.401 20.929 -3.098 1.00 0.00 C ATOM 1703 OD1 ASP A 108 -7.183 19.739 -2.777 1.00 0.00 O ATOM 1704 OD2 ASP A 108 -8.401 21.247 -3.781 1.00 0.00 O ATOM 0 H ASP A 108 -5.077 23.451 -1.099 1.00 0.00 H new ATOM 0 HA ASP A 108 -5.205 20.626 -1.637 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.021 22.530 -1.707 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.405 22.827 -3.320 1.00 0.00 H new ATOM 1709 N THR A 109 -3.448 22.528 -3.657 1.00 0.00 N ATOM 1710 CA THR A 109 -2.414 22.496 -4.690 1.00 0.00 C ATOM 1711 C THR A 109 -1.225 21.697 -4.158 1.00 0.00 C ATOM 1712 O THR A 109 -0.749 20.777 -4.826 1.00 0.00 O ATOM 1713 CB THR A 109 -2.042 23.949 -5.032 1.00 0.00 C ATOM 1714 OG1 THR A 109 -3.192 24.605 -5.521 1.00 0.00 O ATOM 1715 CG2 THR A 109 -0.962 24.129 -6.100 1.00 0.00 C ATOM 0 H THR A 109 -3.577 23.449 -3.237 1.00 0.00 H new ATOM 0 HA THR A 109 -2.757 22.009 -5.603 1.00 0.00 H new ATOM 0 HB THR A 109 -1.646 24.358 -4.103 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.404 25.368 -4.943 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.781 25.192 -6.259 1.00 0.00 H new ATOM 0 HG22 THR A 109 -0.040 23.650 -5.770 1.00 0.00 H new ATOM 0 HG23 THR A 109 -1.294 23.673 -7.033 1.00 0.00 H new ATOM 1723 N GLN A 110 -0.769 22.000 -2.938 1.00 0.00 N ATOM 1724 CA GLN A 110 0.370 21.320 -2.350 1.00 0.00 C ATOM 1725 C GLN A 110 0.069 19.836 -2.116 1.00 0.00 C ATOM 1726 O GLN A 110 0.966 19.011 -2.282 1.00 0.00 O ATOM 1727 CB GLN A 110 0.782 22.056 -1.069 1.00 0.00 C ATOM 1728 CG GLN A 110 2.099 21.565 -0.462 1.00 0.00 C ATOM 1729 CD GLN A 110 3.278 21.557 -1.439 1.00 0.00 C ATOM 1730 OE1 GLN A 110 4.000 22.539 -1.577 1.00 0.00 O ATOM 1731 NE2 GLN A 110 3.501 20.451 -2.134 1.00 0.00 N ATOM 0 H GLN A 110 -1.181 22.718 -2.342 1.00 0.00 H new ATOM 0 HA GLN A 110 1.214 21.344 -3.040 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.869 23.121 -1.286 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -0.010 21.946 -0.329 1.00 0.00 H new ATOM 0 HG2 GLN A 110 2.352 22.198 0.389 1.00 0.00 H new ATOM 0 HG3 GLN A 110 1.954 20.556 -0.077 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.894 19.640 -2.011 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.280 20.410 -2.792 1.00 0.00 H new ATOM 1740 N GLU A 111 -1.174 19.485 -1.785 1.00 0.00 N ATOM 1741 CA GLU A 111 -1.622 18.108 -1.657 1.00 0.00 C ATOM 1742 C GLU A 111 -1.552 17.400 -2.994 1.00 0.00 C ATOM 1743 O GLU A 111 -0.995 16.311 -3.053 1.00 0.00 O ATOM 1744 CB GLU A 111 -3.063 18.044 -1.123 1.00 0.00 C ATOM 1745 CG GLU A 111 -3.091 17.951 0.403 1.00 0.00 C ATOM 1746 CD GLU A 111 -2.584 16.574 0.871 1.00 0.00 C ATOM 1747 OE1 GLU A 111 -3.199 15.539 0.516 1.00 0.00 O ATOM 1748 OE2 GLU A 111 -1.540 16.494 1.553 1.00 0.00 O ATOM 0 H GLU A 111 -1.908 20.167 -1.596 1.00 0.00 H new ATOM 0 HA GLU A 111 -0.960 17.610 -0.948 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -3.611 18.929 -1.445 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -3.573 17.181 -1.551 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -2.471 18.738 0.832 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -4.107 18.113 0.764 1.00 0.00 H new ATOM 1755 N ALA A 112 -2.068 18.007 -4.064 1.00 0.00 N ATOM 1756 CA ALA A 112 -2.032 17.395 -5.388 1.00 0.00 C ATOM 1757 C ALA A 112 -0.589 17.102 -5.812 1.00 0.00 C ATOM 1758 O ALA A 112 -0.305 16.026 -6.338 1.00 0.00 O ATOM 1759 CB ALA A 112 -2.726 18.315 -6.391 1.00 0.00 C ATOM 0 H ALA A 112 -2.516 18.923 -4.037 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.562 16.443 -5.358 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -2.700 17.859 -7.381 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -3.762 18.467 -6.089 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -2.212 19.276 -6.420 1.00 0.00 H new ATOM 1765 N ILE A 113 0.321 18.043 -5.549 1.00 0.00 N ATOM 1766 CA ILE A 113 1.741 17.894 -5.844 1.00 0.00 C ATOM 1767 C ILE A 113 2.328 16.762 -4.996 1.00 0.00 C ATOM 1768 O ILE A 113 2.956 15.859 -5.543 1.00 0.00 O ATOM 1769 CB ILE A 113 2.448 19.245 -5.606 1.00 0.00 C ATOM 1770 CG1 ILE A 113 1.982 20.272 -6.659 1.00 0.00 C ATOM 1771 CG2 ILE A 113 3.981 19.108 -5.640 1.00 0.00 C ATOM 1772 CD1 ILE A 113 2.194 21.714 -6.203 1.00 0.00 C ATOM 0 H ILE A 113 0.086 18.938 -5.120 1.00 0.00 H new ATOM 0 HA ILE A 113 1.893 17.621 -6.888 1.00 0.00 H new ATOM 0 HB ILE A 113 2.175 19.592 -4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.524 20.105 -7.590 1.00 0.00 H new ATOM 0 HG13 ILE A 113 0.925 20.114 -6.873 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.437 20.083 -5.468 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.302 18.415 -4.862 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.291 18.729 -6.614 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.850 22.396 -6.981 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.630 21.893 -5.288 1.00 0.00 H new ATOM 0 HD13 ILE A 113 3.254 21.884 -6.015 1.00 0.00 H new ATOM 1784 N ALA A 114 2.134 16.793 -3.675 1.00 0.00 N ATOM 1785 CA ALA A 114 2.717 15.812 -2.770 1.00 0.00 C ATOM 1786 C ALA A 114 2.216 14.407 -3.115 1.00 0.00 C ATOM 1787 O ALA A 114 3.007 13.479 -3.250 1.00 0.00 O ATOM 1788 CB ALA A 114 2.372 16.185 -1.324 1.00 0.00 C ATOM 0 H ALA A 114 1.568 17.501 -3.207 1.00 0.00 H new ATOM 0 HA ALA A 114 3.801 15.813 -2.880 1.00 0.00 H new ATOM 0 HB1 ALA A 114 2.808 15.452 -0.645 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.773 17.173 -1.097 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.289 16.196 -1.200 1.00 0.00 H new ATOM 1794 N ASP A 115 0.906 14.266 -3.315 1.00 0.00 N ATOM 1795 CA ASP A 115 0.254 13.001 -3.629 1.00 0.00 C ATOM 1796 C ASP A 115 0.779 12.432 -4.951 1.00 0.00 C ATOM 1797 O ASP A 115 1.060 11.234 -5.046 1.00 0.00 O ATOM 1798 CB ASP A 115 -1.264 13.217 -3.670 1.00 0.00 C ATOM 1799 CG ASP A 115 -2.028 11.914 -3.439 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -2.295 11.183 -4.412 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -2.380 11.663 -2.264 1.00 0.00 O ATOM 0 H ASP A 115 0.255 15.050 -3.261 1.00 0.00 H new ATOM 0 HA ASP A 115 0.483 12.269 -2.855 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.548 13.945 -2.910 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -1.546 13.637 -4.635 1.00 0.00 H new ATOM 1806 N TRP A 116 1.011 13.304 -5.942 1.00 0.00 N ATOM 1807 CA TRP A 116 1.629 12.924 -7.206 1.00 0.00 C ATOM 1808 C TRP A 116 3.071 12.466 -6.981 1.00 0.00 C ATOM 1809 O TRP A 116 3.482 11.443 -7.527 1.00 0.00 O ATOM 1810 CB TRP A 116 1.585 14.098 -8.198 1.00 0.00 C ATOM 1811 CG TRP A 116 2.457 13.915 -9.401 1.00 0.00 C ATOM 1812 CD1 TRP A 116 3.608 14.581 -9.649 1.00 0.00 C ATOM 1813 CD2 TRP A 116 2.324 12.937 -10.478 1.00 0.00 C ATOM 1814 NE1 TRP A 116 4.191 14.083 -10.795 1.00 0.00 N ATOM 1815 CE2 TRP A 116 3.443 13.072 -11.350 1.00 0.00 C ATOM 1816 CE3 TRP A 116 1.390 11.929 -10.791 1.00 0.00 C ATOM 1817 CZ2 TRP A 116 3.614 12.265 -12.482 1.00 0.00 C ATOM 1818 CZ3 TRP A 116 1.535 11.127 -11.938 1.00 0.00 C ATOM 1819 CH2 TRP A 116 2.645 11.297 -12.786 1.00 0.00 C ATOM 0 H TRP A 116 0.772 14.294 -5.883 1.00 0.00 H new ATOM 0 HA TRP A 116 1.067 12.092 -7.630 1.00 0.00 H new ATOM 0 HB2 TRP A 116 0.556 14.243 -8.527 1.00 0.00 H new ATOM 0 HB3 TRP A 116 1.885 15.009 -7.680 1.00 0.00 H new ATOM 0 HD1 TRP A 116 4.009 15.380 -9.043 1.00 0.00 H new ATOM 0 HE1 TRP A 116 5.070 14.423 -11.184 1.00 0.00 H new ATOM 0 HE3 TRP A 116 0.546 11.769 -10.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 4.482 12.386 -13.113 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 0.792 10.378 -12.168 1.00 0.00 H new ATOM 0 HH2 TRP A 116 2.751 10.684 -13.669 1.00 0.00 H new ATOM 1830 N LEU A 117 3.844 13.190 -6.169 1.00 0.00 N ATOM 1831 CA LEU A 117 5.232 12.846 -5.893 1.00 0.00 C ATOM 1832 C LEU A 117 5.329 11.508 -5.158 1.00 0.00 C ATOM 1833 O LEU A 117 6.286 10.776 -5.390 1.00 0.00 O ATOM 1834 CB LEU A 117 5.933 13.967 -5.109 1.00 0.00 C ATOM 1835 CG LEU A 117 6.199 15.237 -5.946 1.00 0.00 C ATOM 1836 CD1 LEU A 117 6.615 16.383 -5.019 1.00 0.00 C ATOM 1837 CD2 LEU A 117 7.279 15.021 -7.013 1.00 0.00 C ATOM 0 H LEU A 117 3.522 14.029 -5.687 1.00 0.00 H new ATOM 0 HA LEU A 117 5.748 12.738 -6.847 1.00 0.00 H new ATOM 0 HB2 LEU A 117 5.321 14.232 -4.247 1.00 0.00 H new ATOM 0 HB3 LEU A 117 6.881 13.591 -4.724 1.00 0.00 H new ATOM 0 HG LEU A 117 5.274 15.485 -6.466 1.00 0.00 H new ATOM 0 HD11 LEU A 117 6.803 17.279 -5.610 1.00 0.00 H new ATOM 0 HD12 LEU A 117 5.817 16.581 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 117 7.522 16.106 -4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 117 7.427 15.944 -7.573 1.00 0.00 H new ATOM 0 HD22 LEU A 117 8.214 14.735 -6.532 1.00 0.00 H new ATOM 0 HD23 LEU A 117 6.965 14.230 -7.694 1.00 0.00 H new ATOM 1849 N TYR A 118 4.356 11.138 -4.321 1.00 0.00 N ATOM 1850 CA TYR A 118 4.346 9.830 -3.668 1.00 0.00 C ATOM 1851 C TYR A 118 3.964 8.719 -4.651 1.00 0.00 C ATOM 1852 O TYR A 118 4.505 7.616 -4.569 1.00 0.00 O ATOM 1853 CB TYR A 118 3.403 9.846 -2.455 1.00 0.00 C ATOM 1854 CG TYR A 118 3.684 10.930 -1.423 1.00 0.00 C ATOM 1855 CD1 TYR A 118 5.004 11.262 -1.050 1.00 0.00 C ATOM 1856 CD2 TYR A 118 2.608 11.638 -0.856 1.00 0.00 C ATOM 1857 CE1 TYR A 118 5.247 12.295 -0.129 1.00 0.00 C ATOM 1858 CE2 TYR A 118 2.843 12.695 0.038 1.00 0.00 C ATOM 1859 CZ TYR A 118 4.164 13.024 0.415 1.00 0.00 C ATOM 1860 OH TYR A 118 4.380 14.048 1.289 1.00 0.00 O ATOM 0 H TYR A 118 3.562 11.731 -4.080 1.00 0.00 H new ATOM 0 HA TYR A 118 5.355 9.618 -3.316 1.00 0.00 H new ATOM 0 HB2 TYR A 118 2.380 9.965 -2.813 1.00 0.00 H new ATOM 0 HB3 TYR A 118 3.457 8.876 -1.962 1.00 0.00 H new ATOM 0 HD1 TYR A 118 5.834 10.718 -1.476 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.594 11.366 -1.110 1.00 0.00 H new ATOM 0 HE1 TYR A 118 6.259 12.532 0.163 1.00 0.00 H new ATOM 0 HE2 TYR A 118 2.012 13.257 0.438 1.00 0.00 H new ATOM 0 HH TYR A 118 3.521 14.435 1.558 1.00 0.00 H new ATOM 1870 N TRP A 119 3.059 8.981 -5.595 1.00 0.00 N ATOM 1871 CA TRP A 119 2.758 8.054 -6.686 1.00 0.00 C ATOM 1872 C TRP A 119 3.996 7.861 -7.573 1.00 0.00 C ATOM 1873 O TRP A 119 4.321 6.732 -7.940 1.00 0.00 O ATOM 1874 CB TRP A 119 1.536 8.584 -7.453 1.00 0.00 C ATOM 1875 CG TRP A 119 1.266 8.022 -8.818 1.00 0.00 C ATOM 1876 CD1 TRP A 119 1.923 8.382 -9.943 1.00 0.00 C ATOM 1877 CD2 TRP A 119 0.209 7.114 -9.263 1.00 0.00 C ATOM 1878 NE1 TRP A 119 1.408 7.713 -11.032 1.00 0.00 N ATOM 1879 CE2 TRP A 119 0.315 6.952 -10.678 1.00 0.00 C ATOM 1880 CE3 TRP A 119 -0.869 6.459 -8.628 1.00 0.00 C ATOM 1881 CZ2 TRP A 119 -0.599 6.181 -11.410 1.00 0.00 C ATOM 1882 CZ3 TRP A 119 -1.812 5.713 -9.363 1.00 0.00 C ATOM 1883 CH2 TRP A 119 -1.675 5.567 -10.753 1.00 0.00 C ATOM 0 H TRP A 119 2.514 9.843 -5.624 1.00 0.00 H new ATOM 0 HA TRP A 119 2.506 7.065 -6.302 1.00 0.00 H new ATOM 0 HB2 TRP A 119 0.653 8.408 -6.838 1.00 0.00 H new ATOM 0 HB3 TRP A 119 1.646 9.664 -7.552 1.00 0.00 H new ATOM 0 HD1 TRP A 119 2.735 9.092 -9.983 1.00 0.00 H new ATOM 0 HE1 TRP A 119 1.787 7.773 -11.977 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -0.973 6.531 -7.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -0.475 6.060 -12.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -2.645 5.251 -8.854 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -2.393 4.986 -11.312 1.00 0.00 H new ATOM 1894 N LEU A 120 4.733 8.933 -7.874 1.00 0.00 N ATOM 1895 CA LEU A 120 5.984 8.884 -8.624 1.00 0.00 C ATOM 1896 C LEU A 120 7.030 8.067 -7.866 1.00 0.00 C ATOM 1897 O LEU A 120 7.579 7.110 -8.412 1.00 0.00 O ATOM 1898 CB LEU A 120 6.457 10.328 -8.859 1.00 0.00 C ATOM 1899 CG LEU A 120 7.836 10.460 -9.531 1.00 0.00 C ATOM 1900 CD1 LEU A 120 7.799 9.976 -10.981 1.00 0.00 C ATOM 1901 CD2 LEU A 120 8.258 11.930 -9.476 1.00 0.00 C ATOM 0 H LEU A 120 4.468 9.878 -7.596 1.00 0.00 H new ATOM 0 HA LEU A 120 5.833 8.393 -9.585 1.00 0.00 H new ATOM 0 HB2 LEU A 120 5.719 10.840 -9.476 1.00 0.00 H new ATOM 0 HB3 LEU A 120 6.486 10.845 -7.900 1.00 0.00 H new ATOM 0 HG LEU A 120 8.555 9.837 -9.000 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.788 10.083 -11.426 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.501 8.928 -11.007 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.081 10.572 -11.545 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.234 12.046 -9.947 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.525 12.539 -10.005 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.316 12.253 -8.437 1.00 0.00 H new ATOM 1913 N ALA A 121 7.268 8.410 -6.596 1.00 0.00 N ATOM 1914 CA ALA A 121 8.244 7.750 -5.734 1.00 0.00 C ATOM 1915 C ALA A 121 7.912 6.273 -5.495 1.00 0.00 C ATOM 1916 O ALA A 121 8.792 5.504 -5.106 1.00 0.00 O ATOM 1917 CB ALA A 121 8.326 8.491 -4.397 1.00 0.00 C ATOM 0 H ALA A 121 6.774 9.172 -6.132 1.00 0.00 H new ATOM 0 HA ALA A 121 9.208 7.782 -6.243 1.00 0.00 H new ATOM 0 HB1 ALA A 121 9.054 7.999 -3.752 1.00 0.00 H new ATOM 0 HB2 ALA A 121 8.633 9.522 -4.571 1.00 0.00 H new ATOM 0 HB3 ALA A 121 7.349 8.480 -3.914 1.00 0.00 H new ATOM 1923 N ARG A 122 6.669 5.853 -5.758 1.00 0.00 N ATOM 1924 CA ARG A 122 6.279 4.443 -5.745 1.00 0.00 C ATOM 1925 C ARG A 122 6.939 3.629 -6.868 1.00 0.00 C ATOM 1926 O ARG A 122 6.752 2.413 -6.908 1.00 0.00 O ATOM 1927 CB ARG A 122 4.742 4.343 -5.857 1.00 0.00 C ATOM 1928 CG ARG A 122 4.139 3.386 -4.821 1.00 0.00 C ATOM 1929 CD ARG A 122 4.105 4.039 -3.431 1.00 0.00 C ATOM 1930 NE ARG A 122 3.140 5.154 -3.372 1.00 0.00 N ATOM 1931 CZ ARG A 122 1.831 5.031 -3.106 1.00 0.00 C ATOM 1932 NH1 ARG A 122 1.296 3.834 -2.901 1.00 0.00 N ATOM 1933 NH2 ARG A 122 1.040 6.094 -3.054 1.00 0.00 N ATOM 0 H ARG A 122 5.903 6.487 -5.987 1.00 0.00 H new ATOM 0 HA ARG A 122 6.625 4.016 -4.804 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.306 5.334 -5.729 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.475 4.005 -6.858 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.129 3.107 -5.121 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.725 2.468 -4.782 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.841 3.290 -2.684 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.100 4.406 -3.177 1.00 0.00 H new ATOM 0 HE ARG A 122 3.497 6.093 -3.548 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.881 3.000 -2.945 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.300 3.748 -2.699 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.425 7.024 -3.218 1.00 0.00 H new ATOM 0 HH22 ARG A 122 0.047 5.981 -2.850 1.00 0.00 H new