USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=18 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 30 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 68 GLN : amide:sc= 0.524 K(o=0.52,f=-1.2) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0.0148 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN :FLIP amide:sc= -0.0886 F(o=-1,f=-0.089) USER MOD Single : A 49 GLN : amide:sc= -0.769 K(o=-0.77,f=-5.3!) USER MOD Single : A 54 HIS : no HD1:sc= -0.622 X(o=-0.62,f=-0.94) USER MOD Single : A 72 THR OG1 : rot -67:sc= 0.964 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.0091) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0.0645 X(o=0.065,f=0) USER MOD Single : A 79 LYS NZ :NH3+ -112:sc= -0.416 (180deg=-2.19!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 86:sc= 1.25 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 140:sc= 0.827 USER MOD Single : A 99 MET CE :methyl 137:sc= -1.69! (180deg=-2.77!) USER MOD Single : A 104 THR OG1 : rot 99:sc= 1.27 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -2.07! C(o=-2.1!,f=-4!) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 133 GLN : amide:sc= 0.196 K(o=0.2,f=-2.1) USER MOD Single : A 142 GLN : amide:sc= -0.0401 K(o=-0.04,f=-1.5) USER MOD Single : A 144 MET CE :methyl 139:sc= -0.0929 (180deg=-0.568) USER MOD Single : A 146 TYR OH : rot 30:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 239 N ALA A 18 -7.906 5.089 -4.388 1.00 22.34 N ATOM 240 CA ALA A 18 -6.748 4.585 -5.075 1.00 43.14 C ATOM 241 C ALA A 18 -6.337 5.539 -6.196 1.00 75.32 C ATOM 242 O ALA A 18 -7.197 6.048 -6.942 1.00 62.13 O ATOM 243 CB ALA A 18 -7.052 3.206 -5.609 1.00 43.14 C ATOM 0 HA ALA A 18 -5.909 4.515 -4.382 1.00 43.14 H new ATOM 0 HB1 ALA A 18 -6.178 2.817 -6.131 1.00 43.14 H new ATOM 0 HB2 ALA A 18 -7.305 2.543 -4.782 1.00 43.14 H new ATOM 0 HB3 ALA A 18 -7.893 3.261 -6.300 1.00 43.14 H new ATOM 249 N GLY A 19 -5.052 5.796 -6.303 1.00 71.42 N ATOM 250 CA GLY A 19 -4.553 6.725 -7.284 1.00 41.34 C ATOM 251 C GLY A 19 -3.673 6.089 -8.340 1.00 60.12 C ATOM 252 O GLY A 19 -4.177 5.523 -9.319 1.00 63.43 O ATOM 0 H GLY A 19 -4.333 5.371 -5.718 1.00 71.42 H new ATOM 0 HA2 GLY A 19 -5.398 7.210 -7.773 1.00 41.34 H new ATOM 0 HA3 GLY A 19 -3.987 7.506 -6.776 1.00 41.34 H new ATOM 256 N ASP A 20 -2.370 6.165 -8.149 1.00 61.53 N ATOM 257 CA ASP A 20 -1.418 5.681 -9.147 1.00 11.40 C ATOM 258 C ASP A 20 -0.795 4.376 -8.736 1.00 61.43 C ATOM 259 O ASP A 20 -0.343 4.213 -7.599 1.00 52.22 O ATOM 260 CB ASP A 20 -0.318 6.726 -9.426 1.00 20.10 C ATOM 261 CG ASP A 20 0.729 6.265 -10.442 1.00 11.33 C ATOM 262 OD1 ASP A 20 0.383 6.097 -11.630 1.00 64.30 O ATOM 263 OD2 ASP A 20 1.918 6.103 -10.087 1.00 75.32 O ATOM 0 H ASP A 20 -1.939 6.557 -7.312 1.00 61.53 H new ATOM 0 HA ASP A 20 -1.982 5.515 -10.065 1.00 11.40 H new ATOM 0 HB2 ASP A 20 -0.784 7.642 -9.789 1.00 20.10 H new ATOM 0 HB3 ASP A 20 0.182 6.972 -8.489 1.00 20.10 H new ATOM 268 N ASP A 21 -0.786 3.448 -9.655 1.00 2.02 N ATOM 269 CA ASP A 21 -0.186 2.155 -9.459 1.00 34.02 C ATOM 270 C ASP A 21 1.331 2.261 -9.522 1.00 5.53 C ATOM 271 O ASP A 21 1.933 2.301 -10.591 1.00 10.11 O ATOM 272 CB ASP A 21 -0.742 1.120 -10.469 1.00 31.43 C ATOM 273 CG ASP A 21 -0.601 1.531 -11.939 1.00 43.12 C ATOM 274 OD1 ASP A 21 -1.222 2.548 -12.354 1.00 11.44 O ATOM 275 OD2 ASP A 21 0.122 0.849 -12.704 1.00 31.22 O ATOM 0 H ASP A 21 -1.203 3.571 -10.578 1.00 2.02 H new ATOM 0 HA ASP A 21 -0.451 1.795 -8.465 1.00 34.02 H new ATOM 0 HB2 ASP A 21 -0.227 0.171 -10.319 1.00 31.43 H new ATOM 0 HB3 ASP A 21 -1.796 0.949 -10.252 1.00 31.43 H new ATOM 280 N VAL A 22 1.927 2.405 -8.352 1.00 33.13 N ATOM 281 CA VAL A 22 3.377 2.532 -8.208 1.00 64.50 C ATOM 282 C VAL A 22 4.091 1.296 -8.746 1.00 53.33 C ATOM 283 O VAL A 22 5.067 1.405 -9.508 1.00 61.30 O ATOM 284 CB VAL A 22 3.784 2.772 -6.726 1.00 11.13 C ATOM 285 CG1 VAL A 22 5.294 2.942 -6.585 1.00 63.22 C ATOM 286 CG2 VAL A 22 3.064 3.987 -6.169 1.00 72.10 C ATOM 0 H VAL A 22 1.421 2.438 -7.467 1.00 33.13 H new ATOM 0 HA VAL A 22 3.682 3.399 -8.794 1.00 64.50 H new ATOM 0 HB VAL A 22 3.490 1.893 -6.153 1.00 11.13 H new ATOM 0 HG11 VAL A 22 5.545 3.108 -5.537 1.00 63.22 H new ATOM 0 HG12 VAL A 22 5.796 2.042 -6.940 1.00 63.22 H new ATOM 0 HG13 VAL A 22 5.621 3.797 -7.176 1.00 63.22 H new ATOM 0 HG21 VAL A 22 3.360 4.141 -5.131 1.00 72.10 H new ATOM 0 HG22 VAL A 22 3.327 4.867 -6.756 1.00 72.10 H new ATOM 0 HG23 VAL A 22 1.987 3.827 -6.219 1.00 72.10 H new ATOM 296 N LEU A 23 3.595 0.129 -8.382 1.00 20.32 N ATOM 297 CA LEU A 23 4.188 -1.093 -8.854 1.00 42.43 C ATOM 298 C LEU A 23 3.954 -1.320 -10.339 1.00 44.22 C ATOM 299 O LEU A 23 2.957 -0.852 -10.918 1.00 2.23 O ATOM 300 CB LEU A 23 3.826 -2.340 -7.996 1.00 64.15 C ATOM 301 CG LEU A 23 2.356 -2.578 -7.558 1.00 60.35 C ATOM 302 CD1 LEU A 23 1.374 -2.558 -8.720 1.00 61.43 C ATOM 303 CD2 LEU A 23 2.267 -3.920 -6.864 1.00 24.11 C ATOM 0 H LEU A 23 2.791 0.008 -7.767 1.00 20.32 H new ATOM 0 HA LEU A 23 5.262 -0.958 -8.723 1.00 42.43 H new ATOM 0 HB2 LEU A 23 4.145 -3.221 -8.553 1.00 64.15 H new ATOM 0 HB3 LEU A 23 4.432 -2.298 -7.091 1.00 64.15 H new ATOM 0 HG LEU A 23 2.080 -1.761 -6.892 1.00 60.35 H new ATOM 0 HD11 LEU A 23 0.365 -2.730 -8.346 1.00 61.43 H new ATOM 0 HD12 LEU A 23 1.417 -1.588 -9.216 1.00 61.43 H new ATOM 0 HD13 LEU A 23 1.636 -3.341 -9.431 1.00 61.43 H new ATOM 0 HD21 LEU A 23 1.239 -4.100 -6.551 1.00 24.11 H new ATOM 0 HD22 LEU A 23 2.580 -4.706 -7.551 1.00 24.11 H new ATOM 0 HD23 LEU A 23 2.918 -3.921 -5.990 1.00 24.11 H new ATOM 315 N ASP A 24 4.874 -2.003 -10.944 1.00 30.42 N ATOM 316 CA ASP A 24 4.797 -2.334 -12.347 1.00 73.40 C ATOM 317 C ASP A 24 3.731 -3.381 -12.548 1.00 53.51 C ATOM 318 O ASP A 24 3.459 -4.156 -11.638 1.00 4.34 O ATOM 319 CB ASP A 24 6.144 -2.872 -12.850 1.00 32.43 C ATOM 320 CG ASP A 24 7.232 -1.834 -12.875 1.00 62.11 C ATOM 321 OD1 ASP A 24 7.850 -1.573 -11.822 1.00 63.24 O ATOM 322 OD2 ASP A 24 7.511 -1.286 -13.948 1.00 21.42 O ATOM 0 H ASP A 24 5.712 -2.354 -10.480 1.00 30.42 H new ATOM 0 HA ASP A 24 4.550 -1.434 -12.911 1.00 73.40 H new ATOM 0 HB2 ASP A 24 6.457 -3.700 -12.213 1.00 32.43 H new ATOM 0 HB3 ASP A 24 6.013 -3.275 -13.854 1.00 32.43 H new ATOM 327 N PRO A 25 3.087 -3.417 -13.722 1.00 30.41 N ATOM 328 CA PRO A 25 2.061 -4.419 -14.035 1.00 12.11 C ATOM 329 C PRO A 25 2.574 -5.862 -13.895 1.00 65.15 C ATOM 330 O PRO A 25 1.791 -6.793 -13.657 1.00 53.14 O ATOM 331 CB PRO A 25 1.673 -4.120 -15.491 1.00 60.42 C ATOM 332 CG PRO A 25 2.725 -3.204 -16.000 1.00 31.53 C ATOM 333 CD PRO A 25 3.249 -2.455 -14.818 1.00 74.21 C ATOM 0 HA PRO A 25 1.222 -4.353 -13.343 1.00 12.11 H new ATOM 0 HB2 PRO A 25 1.630 -5.035 -16.082 1.00 60.42 H new ATOM 0 HB3 PRO A 25 0.688 -3.657 -15.548 1.00 60.42 H new ATOM 0 HG2 PRO A 25 3.523 -3.764 -16.488 1.00 31.53 H new ATOM 0 HG3 PRO A 25 2.316 -2.519 -16.742 1.00 31.53 H new ATOM 0 HD2 PRO A 25 4.292 -2.167 -14.952 1.00 74.21 H new ATOM 0 HD3 PRO A 25 2.686 -1.539 -14.638 1.00 74.21 H new ATOM 341 N ASP A 26 3.886 -6.051 -14.042 1.00 3.02 N ATOM 342 CA ASP A 26 4.476 -7.382 -13.886 1.00 61.05 C ATOM 343 C ASP A 26 4.404 -7.843 -12.431 1.00 40.12 C ATOM 344 O ASP A 26 4.310 -9.047 -12.157 1.00 52.30 O ATOM 345 CB ASP A 26 5.922 -7.431 -14.395 1.00 2.00 C ATOM 346 CG ASP A 26 6.538 -8.815 -14.251 1.00 1.43 C ATOM 347 OD1 ASP A 26 6.086 -9.757 -14.946 1.00 52.05 O ATOM 348 OD2 ASP A 26 7.476 -8.985 -13.447 1.00 1.21 O ATOM 0 H ASP A 26 4.552 -5.312 -14.266 1.00 3.02 H new ATOM 0 HA ASP A 26 3.889 -8.067 -14.498 1.00 61.05 H new ATOM 0 HB2 ASP A 26 5.946 -7.132 -15.443 1.00 2.00 H new ATOM 0 HB3 ASP A 26 6.524 -6.709 -13.843 1.00 2.00 H new ATOM 353 N GLU A 27 4.411 -6.886 -11.512 1.00 65.23 N ATOM 354 CA GLU A 27 4.321 -7.175 -10.090 1.00 25.02 C ATOM 355 C GLU A 27 2.886 -7.613 -9.814 1.00 51.21 C ATOM 356 O GLU A 27 1.952 -6.837 -10.047 1.00 4.23 O ATOM 357 CB GLU A 27 4.650 -5.918 -9.260 1.00 72.40 C ATOM 358 CG GLU A 27 5.980 -5.242 -9.607 1.00 54.05 C ATOM 359 CD GLU A 27 7.196 -6.084 -9.306 1.00 72.54 C ATOM 360 OE1 GLU A 27 7.376 -7.136 -9.932 1.00 52.24 O ATOM 361 OE2 GLU A 27 8.040 -5.669 -8.483 1.00 73.10 O ATOM 0 H GLU A 27 4.479 -5.892 -11.732 1.00 65.23 H new ATOM 0 HA GLU A 27 5.033 -7.953 -9.813 1.00 25.02 H new ATOM 0 HB2 GLU A 27 3.846 -5.194 -9.392 1.00 72.40 H new ATOM 0 HB3 GLU A 27 4.663 -6.191 -8.205 1.00 72.40 H new ATOM 0 HG2 GLU A 27 5.981 -4.988 -10.667 1.00 54.05 H new ATOM 0 HG3 GLU A 27 6.054 -4.305 -9.055 1.00 54.05 H new ATOM 368 N PRO A 28 2.686 -8.851 -9.345 1.00 72.34 N ATOM 369 CA PRO A 28 1.348 -9.421 -9.176 1.00 61.33 C ATOM 370 C PRO A 28 0.493 -8.701 -8.123 1.00 45.43 C ATOM 371 O PRO A 28 1.001 -8.182 -7.100 1.00 32.32 O ATOM 372 CB PRO A 28 1.621 -10.874 -8.780 1.00 20.50 C ATOM 373 CG PRO A 28 2.986 -10.855 -8.184 1.00 72.05 C ATOM 374 CD PRO A 28 3.744 -9.795 -8.925 1.00 3.02 C ATOM 0 HA PRO A 28 0.759 -9.321 -10.088 1.00 61.33 H new ATOM 0 HB2 PRO A 28 0.882 -11.235 -8.065 1.00 20.50 H new ATOM 0 HB3 PRO A 28 1.576 -11.535 -9.645 1.00 20.50 H new ATOM 0 HG2 PRO A 28 2.944 -10.632 -7.118 1.00 72.05 H new ATOM 0 HG3 PRO A 28 3.471 -11.826 -8.287 1.00 72.05 H new ATOM 0 HD2 PRO A 28 4.485 -9.311 -8.289 1.00 3.02 H new ATOM 0 HD3 PRO A 28 4.279 -10.207 -9.781 1.00 3.02 H new ATOM 382 N THR A 29 -0.796 -8.675 -8.359 1.00 2.23 N ATOM 383 CA THR A 29 -1.710 -7.993 -7.490 1.00 41.53 C ATOM 384 C THR A 29 -2.896 -8.875 -7.093 1.00 11.53 C ATOM 385 O THR A 29 -3.034 -10.012 -7.559 1.00 33.54 O ATOM 386 CB THR A 29 -2.230 -6.702 -8.160 1.00 53.55 C ATOM 387 OG1 THR A 29 -2.631 -6.988 -9.508 1.00 3.23 O ATOM 388 CG2 THR A 29 -1.178 -5.601 -8.149 1.00 20.43 C ATOM 0 H THR A 29 -1.236 -9.127 -9.160 1.00 2.23 H new ATOM 0 HA THR A 29 -1.159 -7.742 -6.583 1.00 41.53 H new ATOM 0 HB THR A 29 -3.087 -6.344 -7.589 1.00 53.55 H new ATOM 0 HG1 THR A 29 -2.962 -6.169 -9.932 1.00 3.23 H new ATOM 0 HG21 THR A 29 -1.580 -4.709 -8.629 1.00 20.43 H new ATOM 0 HG22 THR A 29 -0.906 -5.368 -7.120 1.00 20.43 H new ATOM 0 HG23 THR A 29 -0.294 -5.937 -8.691 1.00 20.43 H new ATOM 396 N TYR A 30 -3.675 -8.357 -6.190 1.00 61.23 N ATOM 397 CA TYR A 30 -4.923 -8.899 -5.720 1.00 42.40 C ATOM 398 C TYR A 30 -6.022 -7.919 -6.063 1.00 72.43 C ATOM 399 O TYR A 30 -5.756 -6.738 -6.247 1.00 73.15 O ATOM 400 CB TYR A 30 -4.920 -9.092 -4.195 1.00 74.10 C ATOM 401 CG TYR A 30 -4.370 -10.402 -3.691 1.00 63.43 C ATOM 402 CD1 TYR A 30 -4.928 -11.594 -4.108 1.00 11.21 C ATOM 403 CD2 TYR A 30 -3.334 -10.451 -2.774 1.00 63.20 C ATOM 404 CE1 TYR A 30 -4.477 -12.802 -3.639 1.00 65.34 C ATOM 405 CE2 TYR A 30 -2.874 -11.661 -2.284 1.00 44.04 C ATOM 406 CZ TYR A 30 -3.452 -12.839 -2.724 1.00 11.12 C ATOM 407 OH TYR A 30 -3.014 -14.060 -2.234 1.00 2.50 O ATOM 0 H TYR A 30 -3.440 -7.479 -5.726 1.00 61.23 H new ATOM 0 HA TYR A 30 -5.076 -9.869 -6.193 1.00 42.40 H new ATOM 0 HB2 TYR A 30 -4.342 -8.283 -3.748 1.00 74.10 H new ATOM 0 HB3 TYR A 30 -5.943 -8.989 -3.835 1.00 74.10 H new ATOM 0 HD1 TYR A 30 -5.739 -11.575 -4.821 1.00 11.21 H new ATOM 0 HD2 TYR A 30 -2.878 -9.532 -2.436 1.00 63.20 H new ATOM 0 HE1 TYR A 30 -4.926 -13.720 -3.988 1.00 65.34 H new ATOM 0 HE2 TYR A 30 -2.070 -11.686 -1.564 1.00 44.04 H new ATOM 0 HH TYR A 30 -2.283 -13.914 -1.597 1.00 2.50 H new ATOM 417 N ASP A 31 -7.233 -8.391 -6.073 1.00 73.05 N ATOM 418 CA ASP A 31 -8.409 -7.583 -6.366 1.00 74.51 C ATOM 419 C ASP A 31 -9.397 -7.927 -5.305 1.00 13.43 C ATOM 420 O ASP A 31 -9.240 -8.968 -4.640 1.00 65.02 O ATOM 421 CB ASP A 31 -9.089 -7.948 -7.718 1.00 71.24 C ATOM 422 CG ASP A 31 -8.363 -7.569 -8.994 1.00 63.04 C ATOM 423 OD1 ASP A 31 -7.524 -8.350 -9.472 1.00 41.23 O ATOM 424 OD2 ASP A 31 -8.710 -6.523 -9.598 1.00 42.33 O ATOM 0 H ASP A 31 -7.450 -9.368 -5.875 1.00 73.05 H new ATOM 0 HA ASP A 31 -8.109 -6.536 -6.412 1.00 74.51 H new ATOM 0 HB2 ASP A 31 -9.252 -9.026 -7.732 1.00 71.24 H new ATOM 0 HB3 ASP A 31 -10.072 -7.477 -7.738 1.00 71.24 H new ATOM 429 N LEU A 32 -10.413 -7.089 -5.158 1.00 4.10 N ATOM 430 CA LEU A 32 -11.425 -7.208 -4.095 1.00 13.15 C ATOM 431 C LEU A 32 -11.931 -8.644 -3.817 1.00 72.42 C ATOM 432 O LEU A 32 -11.828 -9.098 -2.681 1.00 31.41 O ATOM 433 CB LEU A 32 -12.599 -6.229 -4.275 1.00 4.24 C ATOM 434 CG LEU A 32 -12.304 -4.726 -4.068 1.00 23.02 C ATOM 435 CD1 LEU A 32 -11.580 -4.458 -2.753 1.00 12.24 C ATOM 436 CD2 LEU A 32 -11.579 -4.097 -5.250 1.00 14.14 C ATOM 0 H LEU A 32 -10.568 -6.293 -5.777 1.00 4.10 H new ATOM 0 HA LEU A 32 -10.877 -6.921 -3.198 1.00 13.15 H new ATOM 0 HB2 LEU A 32 -12.996 -6.360 -5.282 1.00 4.24 H new ATOM 0 HB3 LEU A 32 -13.388 -6.517 -3.581 1.00 4.24 H new ATOM 0 HG LEU A 32 -13.276 -4.236 -4.007 1.00 23.02 H new ATOM 0 HD11 LEU A 32 -11.394 -3.389 -2.651 1.00 12.24 H new ATOM 0 HD12 LEU A 32 -12.197 -4.800 -1.922 1.00 12.24 H new ATOM 0 HD13 LEU A 32 -10.631 -4.994 -2.745 1.00 12.24 H new ATOM 0 HD21 LEU A 32 -11.399 -3.041 -5.047 1.00 14.14 H new ATOM 0 HD22 LEU A 32 -10.627 -4.604 -5.404 1.00 14.14 H new ATOM 0 HD23 LEU A 32 -12.191 -4.195 -6.146 1.00 14.14 H new ATOM 448 N PRO A 33 -12.446 -9.404 -4.834 1.00 0.22 N ATOM 449 CA PRO A 33 -12.953 -10.769 -4.611 1.00 25.01 C ATOM 450 C PRO A 33 -11.890 -11.718 -4.038 1.00 45.31 C ATOM 451 O PRO A 33 -12.181 -12.526 -3.145 1.00 3.11 O ATOM 452 CB PRO A 33 -13.385 -11.238 -6.013 1.00 1.32 C ATOM 453 CG PRO A 33 -12.671 -10.331 -6.949 1.00 3.05 C ATOM 454 CD PRO A 33 -12.599 -9.012 -6.249 1.00 2.11 C ATOM 0 HA PRO A 33 -13.759 -10.774 -3.877 1.00 25.01 H new ATOM 0 HB2 PRO A 33 -13.112 -12.279 -6.184 1.00 1.32 H new ATOM 0 HB3 PRO A 33 -14.465 -11.167 -6.139 1.00 1.32 H new ATOM 0 HG2 PRO A 33 -11.675 -10.709 -7.178 1.00 3.05 H new ATOM 0 HG3 PRO A 33 -13.205 -10.245 -7.896 1.00 3.05 H new ATOM 0 HD2 PRO A 33 -11.757 -8.414 -6.597 1.00 2.11 H new ATOM 0 HD3 PRO A 33 -13.499 -8.418 -6.410 1.00 2.11 H new ATOM 462 N ARG A 34 -10.658 -11.625 -4.541 1.00 11.10 N ATOM 463 CA ARG A 34 -9.602 -12.499 -4.081 1.00 42.21 C ATOM 464 C ARG A 34 -9.174 -12.128 -2.662 1.00 34.12 C ATOM 465 O ARG A 34 -8.829 -12.986 -1.865 1.00 74.11 O ATOM 466 CB ARG A 34 -8.408 -12.503 -5.026 1.00 70.12 C ATOM 467 CG ARG A 34 -7.779 -13.884 -5.175 1.00 73.12 C ATOM 468 CD ARG A 34 -8.723 -14.803 -5.949 1.00 33.41 C ATOM 469 NE ARG A 34 -8.281 -16.201 -6.004 1.00 10.05 N ATOM 470 CZ ARG A 34 -7.917 -16.852 -7.132 1.00 31.41 C ATOM 471 NH1 ARG A 34 -7.737 -16.183 -8.270 1.00 25.12 N ATOM 472 NH2 ARG A 34 -7.717 -18.164 -7.107 1.00 3.02 N ATOM 0 H ARG A 34 -10.378 -10.957 -5.259 1.00 11.10 H new ATOM 0 HA ARG A 34 -10.003 -13.513 -4.069 1.00 42.21 H new ATOM 0 HB2 ARG A 34 -8.724 -12.145 -6.006 1.00 70.12 H new ATOM 0 HB3 ARG A 34 -7.657 -11.804 -4.658 1.00 70.12 H new ATOM 0 HG2 ARG A 34 -6.825 -13.805 -5.697 1.00 73.12 H new ATOM 0 HG3 ARG A 34 -7.570 -14.306 -4.192 1.00 73.12 H new ATOM 0 HD2 ARG A 34 -9.711 -14.763 -5.490 1.00 33.41 H new ATOM 0 HD3 ARG A 34 -8.829 -14.425 -6.966 1.00 33.41 H new ATOM 0 HE ARG A 34 -8.246 -16.720 -5.127 1.00 10.05 H new ATOM 0 HH11 ARG A 34 -7.874 -15.173 -8.295 1.00 25.12 H new ATOM 0 HH12 ARG A 34 -7.462 -16.681 -9.117 1.00 25.12 H new ATOM 0 HH21 ARG A 34 -7.838 -18.682 -6.237 1.00 3.02 H new ATOM 0 HH22 ARG A 34 -7.442 -18.654 -7.958 1.00 3.02 H new ATOM 486 N VAL A 35 -9.203 -10.841 -2.352 1.00 64.15 N ATOM 487 CA VAL A 35 -8.857 -10.380 -1.003 1.00 2.12 C ATOM 488 C VAL A 35 -9.936 -10.821 -0.021 1.00 43.20 C ATOM 489 O VAL A 35 -9.644 -11.298 1.090 1.00 1.20 O ATOM 490 CB VAL A 35 -8.674 -8.841 -0.938 1.00 61.15 C ATOM 491 CG1 VAL A 35 -8.333 -8.381 0.476 1.00 35.11 C ATOM 492 CG2 VAL A 35 -7.598 -8.396 -1.907 1.00 51.32 C ATOM 0 H VAL A 35 -9.459 -10.099 -3.003 1.00 64.15 H new ATOM 0 HA VAL A 35 -7.901 -10.830 -0.733 1.00 2.12 H new ATOM 0 HB VAL A 35 -9.620 -8.381 -1.223 1.00 61.15 H new ATOM 0 HG11 VAL A 35 -8.211 -7.298 0.487 1.00 35.11 H new ATOM 0 HG12 VAL A 35 -9.138 -8.663 1.154 1.00 35.11 H new ATOM 0 HG13 VAL A 35 -7.405 -8.854 0.799 1.00 35.11 H new ATOM 0 HG21 VAL A 35 -7.482 -7.314 -1.850 1.00 51.32 H new ATOM 0 HG22 VAL A 35 -6.654 -8.877 -1.649 1.00 51.32 H new ATOM 0 HG23 VAL A 35 -7.883 -8.677 -2.921 1.00 51.32 H new ATOM 502 N ALA A 36 -11.171 -10.700 -0.464 1.00 2.30 N ATOM 503 CA ALA A 36 -12.325 -11.125 0.293 1.00 42.33 C ATOM 504 C ALA A 36 -12.235 -12.621 0.574 1.00 65.13 C ATOM 505 O ALA A 36 -12.588 -13.086 1.643 1.00 40.35 O ATOM 506 CB ALA A 36 -13.589 -10.796 -0.484 1.00 14.30 C ATOM 0 H ALA A 36 -11.402 -10.298 -1.373 1.00 2.30 H new ATOM 0 HA ALA A 36 -12.355 -10.598 1.247 1.00 42.33 H new ATOM 0 HB1 ALA A 36 -14.461 -11.116 0.087 1.00 14.30 H new ATOM 0 HB2 ALA A 36 -13.642 -9.721 -0.654 1.00 14.30 H new ATOM 0 HB3 ALA A 36 -13.572 -11.315 -1.443 1.00 14.30 H new ATOM 512 N GLU A 37 -11.704 -13.340 -0.400 1.00 5.31 N ATOM 513 CA GLU A 37 -11.494 -14.779 -0.344 1.00 4.12 C ATOM 514 C GLU A 37 -10.486 -15.131 0.752 1.00 0.23 C ATOM 515 O GLU A 37 -10.711 -16.045 1.555 1.00 72.21 O ATOM 516 CB GLU A 37 -10.942 -15.214 -1.692 1.00 62.32 C ATOM 517 CG GLU A 37 -10.819 -16.702 -1.896 1.00 65.41 C ATOM 518 CD GLU A 37 -10.293 -17.037 -3.267 1.00 32.23 C ATOM 519 OE1 GLU A 37 -11.104 -17.143 -4.210 1.00 43.21 O ATOM 520 OE2 GLU A 37 -9.070 -17.218 -3.431 1.00 54.53 O ATOM 0 H GLU A 37 -11.397 -12.926 -1.280 1.00 5.31 H new ATOM 0 HA GLU A 37 -12.433 -15.285 -0.120 1.00 4.12 H new ATOM 0 HB2 GLU A 37 -11.584 -14.810 -2.475 1.00 62.32 H new ATOM 0 HB3 GLU A 37 -9.958 -14.765 -1.823 1.00 62.32 H new ATOM 0 HG2 GLU A 37 -10.154 -17.119 -1.140 1.00 65.41 H new ATOM 0 HG3 GLU A 37 -11.794 -17.170 -1.756 1.00 65.41 H new ATOM 527 N LEU A 38 -9.397 -14.370 0.793 1.00 51.14 N ATOM 528 CA LEU A 38 -8.316 -14.579 1.760 1.00 24.42 C ATOM 529 C LEU A 38 -8.815 -14.428 3.178 1.00 63.15 C ATOM 530 O LEU A 38 -8.504 -15.236 4.061 1.00 52.25 O ATOM 531 CB LEU A 38 -7.197 -13.559 1.551 1.00 3.24 C ATOM 532 CG LEU A 38 -6.467 -13.579 0.218 1.00 75.14 C ATOM 533 CD1 LEU A 38 -5.466 -12.441 0.167 1.00 24.34 C ATOM 534 CD2 LEU A 38 -5.762 -14.907 0.018 1.00 63.01 C ATOM 0 H LEU A 38 -9.235 -13.589 0.157 1.00 51.14 H new ATOM 0 HA LEU A 38 -7.943 -15.591 1.602 1.00 24.42 H new ATOM 0 HB2 LEU A 38 -7.620 -12.564 1.688 1.00 3.24 H new ATOM 0 HB3 LEU A 38 -6.459 -13.703 2.340 1.00 3.24 H new ATOM 0 HG LEU A 38 -7.194 -13.453 -0.584 1.00 75.14 H new ATOM 0 HD11 LEU A 38 -4.944 -12.458 -0.790 1.00 24.34 H new ATOM 0 HD12 LEU A 38 -5.989 -11.491 0.278 1.00 24.34 H new ATOM 0 HD13 LEU A 38 -4.744 -12.555 0.976 1.00 24.34 H new ATOM 0 HD21 LEU A 38 -5.245 -14.903 -0.941 1.00 63.01 H new ATOM 0 HD22 LEU A 38 -5.039 -15.060 0.819 1.00 63.01 H new ATOM 0 HD23 LEU A 38 -6.495 -15.714 0.032 1.00 63.01 H new ATOM 546 N LEU A 39 -9.579 -13.388 3.392 1.00 50.33 N ATOM 547 CA LEU A 39 -10.075 -13.063 4.711 1.00 54.53 C ATOM 548 C LEU A 39 -11.352 -13.830 5.029 1.00 44.11 C ATOM 549 O LEU A 39 -11.731 -13.978 6.199 1.00 24.25 O ATOM 550 CB LEU A 39 -10.302 -11.553 4.811 1.00 10.41 C ATOM 551 CG LEU A 39 -9.071 -10.663 4.572 1.00 32.44 C ATOM 552 CD1 LEU A 39 -9.442 -9.195 4.699 1.00 45.02 C ATOM 553 CD2 LEU A 39 -7.939 -11.014 5.533 1.00 12.33 C ATOM 0 H LEU A 39 -9.876 -12.742 2.661 1.00 50.33 H new ATOM 0 HA LEU A 39 -9.330 -13.362 5.449 1.00 54.53 H new ATOM 0 HB2 LEU A 39 -11.071 -11.274 4.091 1.00 10.41 H new ATOM 0 HB3 LEU A 39 -10.698 -11.331 5.802 1.00 10.41 H new ATOM 0 HG LEU A 39 -8.717 -10.847 3.557 1.00 32.44 H new ATOM 0 HD11 LEU A 39 -8.559 -8.580 4.527 1.00 45.02 H new ATOM 0 HD12 LEU A 39 -10.206 -8.948 3.962 1.00 45.02 H new ATOM 0 HD13 LEU A 39 -9.828 -9.003 5.700 1.00 45.02 H new ATOM 0 HD21 LEU A 39 -7.083 -10.367 5.339 1.00 12.33 H new ATOM 0 HD22 LEU A 39 -8.276 -10.871 6.560 1.00 12.33 H new ATOM 0 HD23 LEU A 39 -7.648 -12.054 5.388 1.00 12.33 H new ATOM 565 N GLY A 40 -11.990 -14.334 3.994 1.00 4.32 N ATOM 566 CA GLY A 40 -13.225 -15.064 4.134 1.00 3.40 C ATOM 567 C GLY A 40 -14.358 -14.154 4.534 1.00 50.12 C ATOM 568 O GLY A 40 -15.288 -14.571 5.231 1.00 73.32 O ATOM 0 H GLY A 40 -11.664 -14.247 3.032 1.00 4.32 H new ATOM 0 HA2 GLY A 40 -13.467 -15.557 3.192 1.00 3.40 H new ATOM 0 HA3 GLY A 40 -13.104 -15.847 4.882 1.00 3.40 H new ATOM 572 N VAL A 41 -14.286 -12.918 4.101 1.00 11.42 N ATOM 573 CA VAL A 41 -15.287 -11.913 4.438 1.00 21.31 C ATOM 574 C VAL A 41 -15.772 -11.223 3.160 1.00 41.12 C ATOM 575 O VAL A 41 -15.107 -11.306 2.137 1.00 74.43 O ATOM 576 CB VAL A 41 -14.722 -10.832 5.429 1.00 34.51 C ATOM 577 CG1 VAL A 41 -14.229 -11.464 6.720 1.00 42.22 C ATOM 578 CG2 VAL A 41 -13.618 -10.001 4.785 1.00 34.32 C ATOM 0 H VAL A 41 -13.534 -12.572 3.504 1.00 11.42 H new ATOM 0 HA VAL A 41 -16.114 -12.423 4.932 1.00 21.31 H new ATOM 0 HB VAL A 41 -15.547 -10.163 5.673 1.00 34.51 H new ATOM 0 HG11 VAL A 41 -13.845 -10.688 7.382 1.00 42.22 H new ATOM 0 HG12 VAL A 41 -15.053 -11.983 7.209 1.00 42.22 H new ATOM 0 HG13 VAL A 41 -13.434 -12.176 6.496 1.00 42.22 H new ATOM 0 HG21 VAL A 41 -13.252 -9.265 5.501 1.00 34.32 H new ATOM 0 HG22 VAL A 41 -12.798 -10.654 4.486 1.00 34.32 H new ATOM 0 HG23 VAL A 41 -14.013 -9.489 3.907 1.00 34.32 H new ATOM 588 N PRO A 42 -16.958 -10.597 3.171 1.00 70.04 N ATOM 589 CA PRO A 42 -17.436 -9.806 2.031 1.00 70.33 C ATOM 590 C PRO A 42 -16.563 -8.559 1.782 1.00 5.13 C ATOM 591 O PRO A 42 -15.840 -8.078 2.690 1.00 23.41 O ATOM 592 CB PRO A 42 -18.851 -9.383 2.446 1.00 63.31 C ATOM 593 CG PRO A 42 -18.859 -9.504 3.930 1.00 75.12 C ATOM 594 CD PRO A 42 -17.965 -10.664 4.239 1.00 65.22 C ATOM 0 HA PRO A 42 -17.404 -10.377 1.103 1.00 70.33 H new ATOM 0 HB2 PRO A 42 -19.068 -8.363 2.130 1.00 63.31 H new ATOM 0 HB3 PRO A 42 -19.606 -10.025 1.992 1.00 63.31 H new ATOM 0 HG2 PRO A 42 -18.495 -8.591 4.401 1.00 75.12 H new ATOM 0 HG3 PRO A 42 -19.868 -9.675 4.305 1.00 75.12 H new ATOM 0 HD2 PRO A 42 -17.513 -10.574 5.227 1.00 65.22 H new ATOM 0 HD3 PRO A 42 -18.509 -11.609 4.223 1.00 65.22 H new ATOM 602 N VAL A 43 -16.671 -8.022 0.575 1.00 54.12 N ATOM 603 CA VAL A 43 -15.896 -6.862 0.123 1.00 42.54 C ATOM 604 C VAL A 43 -16.140 -5.638 1.007 1.00 52.40 C ATOM 605 O VAL A 43 -15.242 -4.836 1.233 1.00 42.52 O ATOM 606 CB VAL A 43 -16.180 -6.533 -1.369 1.00 25.35 C ATOM 607 CG1 VAL A 43 -15.383 -5.326 -1.842 1.00 35.14 C ATOM 608 CG2 VAL A 43 -15.867 -7.735 -2.244 1.00 61.51 C ATOM 0 H VAL A 43 -17.309 -8.382 -0.134 1.00 54.12 H new ATOM 0 HA VAL A 43 -14.843 -7.129 0.212 1.00 42.54 H new ATOM 0 HB VAL A 43 -17.239 -6.290 -1.454 1.00 25.35 H new ATOM 0 HG11 VAL A 43 -15.609 -5.128 -2.890 1.00 35.14 H new ATOM 0 HG12 VAL A 43 -15.650 -4.456 -1.243 1.00 35.14 H new ATOM 0 HG13 VAL A 43 -14.317 -5.528 -1.733 1.00 35.14 H new ATOM 0 HG21 VAL A 43 -16.071 -7.489 -3.286 1.00 61.51 H new ATOM 0 HG22 VAL A 43 -14.816 -8.002 -2.133 1.00 61.51 H new ATOM 0 HG23 VAL A 43 -16.489 -8.577 -1.941 1.00 61.51 H new ATOM 618 N SER A 44 -17.336 -5.523 1.515 1.00 14.33 N ATOM 619 CA SER A 44 -17.704 -4.440 2.383 1.00 42.23 C ATOM 620 C SER A 44 -16.829 -4.421 3.655 1.00 11.05 C ATOM 621 O SER A 44 -16.389 -3.366 4.104 1.00 31.33 O ATOM 622 CB SER A 44 -19.177 -4.574 2.696 1.00 5.43 C ATOM 623 OG SER A 44 -19.477 -5.903 3.138 1.00 65.35 O ATOM 0 H SER A 44 -18.090 -6.186 1.336 1.00 14.33 H new ATOM 0 HA SER A 44 -17.530 -3.483 1.892 1.00 42.23 H new ATOM 0 HB2 SER A 44 -19.458 -3.856 3.467 1.00 5.43 H new ATOM 0 HB3 SER A 44 -19.766 -4.337 1.810 1.00 5.43 H new ATOM 0 HG SER A 44 -20.434 -5.973 3.338 1.00 65.35 H new ATOM 629 N LYS A 45 -16.550 -5.603 4.199 1.00 52.44 N ATOM 630 CA LYS A 45 -15.665 -5.729 5.346 1.00 64.12 C ATOM 631 C LYS A 45 -14.221 -5.421 4.970 1.00 41.10 C ATOM 632 O LYS A 45 -13.463 -4.878 5.770 1.00 65.23 O ATOM 633 CB LYS A 45 -15.823 -7.079 6.045 1.00 24.15 C ATOM 634 CG LYS A 45 -17.160 -7.194 6.768 1.00 25.33 C ATOM 635 CD LYS A 45 -17.365 -8.529 7.474 1.00 64.44 C ATOM 636 CE LYS A 45 -16.293 -8.821 8.514 1.00 2.10 C ATOM 637 NZ LYS A 45 -16.606 -10.040 9.294 1.00 50.21 N ATOM 0 H LYS A 45 -16.927 -6.488 3.860 1.00 52.44 H new ATOM 0 HA LYS A 45 -15.963 -4.977 6.077 1.00 64.12 H new ATOM 0 HB2 LYS A 45 -15.738 -7.880 5.310 1.00 24.15 H new ATOM 0 HB3 LYS A 45 -15.011 -7.214 6.760 1.00 24.15 H new ATOM 0 HG2 LYS A 45 -17.236 -6.391 7.501 1.00 25.33 H new ATOM 0 HG3 LYS A 45 -17.965 -7.047 6.048 1.00 25.33 H new ATOM 0 HD2 LYS A 45 -18.342 -8.533 7.957 1.00 64.44 H new ATOM 0 HD3 LYS A 45 -17.372 -9.328 6.733 1.00 64.44 H new ATOM 0 HE2 LYS A 45 -15.329 -8.943 8.019 1.00 2.10 H new ATOM 0 HE3 LYS A 45 -16.200 -7.971 9.189 1.00 2.10 H new ATOM 0 HZ1 LYS A 45 -15.854 -10.208 9.993 1.00 50.21 H new ATOM 0 HZ2 LYS A 45 -17.514 -9.914 9.786 1.00 50.21 H new ATOM 0 HZ3 LYS A 45 -16.670 -10.856 8.652 1.00 50.21 H new ATOM 651 N VAL A 46 -13.859 -5.747 3.740 1.00 71.03 N ATOM 652 CA VAL A 46 -12.539 -5.397 3.198 1.00 24.41 C ATOM 653 C VAL A 46 -12.424 -3.865 3.112 1.00 4.50 C ATOM 654 O VAL A 46 -11.388 -3.277 3.451 1.00 41.13 O ATOM 655 CB VAL A 46 -12.316 -6.028 1.791 1.00 41.50 C ATOM 656 CG1 VAL A 46 -10.958 -5.643 1.227 1.00 55.20 C ATOM 657 CG2 VAL A 46 -12.455 -7.543 1.852 1.00 51.32 C ATOM 0 H VAL A 46 -14.457 -6.256 3.089 1.00 71.03 H new ATOM 0 HA VAL A 46 -11.772 -5.794 3.863 1.00 24.41 H new ATOM 0 HB VAL A 46 -13.084 -5.636 1.124 1.00 41.50 H new ATOM 0 HG11 VAL A 46 -10.830 -6.097 0.245 1.00 55.20 H new ATOM 0 HG12 VAL A 46 -10.896 -4.559 1.136 1.00 55.20 H new ATOM 0 HG13 VAL A 46 -10.173 -5.996 1.895 1.00 55.20 H new ATOM 0 HG21 VAL A 46 -12.296 -7.963 0.859 1.00 51.32 H new ATOM 0 HG22 VAL A 46 -11.714 -7.949 2.541 1.00 51.32 H new ATOM 0 HG23 VAL A 46 -13.455 -7.803 2.200 1.00 51.32 H new ATOM 667 N ALA A 47 -13.510 -3.236 2.695 1.00 23.11 N ATOM 668 CA ALA A 47 -13.604 -1.789 2.633 1.00 62.23 C ATOM 669 C ALA A 47 -13.448 -1.187 4.024 1.00 52.42 C ATOM 670 O ALA A 47 -12.852 -0.131 4.182 1.00 23.12 O ATOM 671 CB ALA A 47 -14.920 -1.355 2.009 1.00 61.43 C ATOM 0 H ALA A 47 -14.355 -3.718 2.389 1.00 23.11 H new ATOM 0 HA ALA A 47 -12.795 -1.423 2.002 1.00 62.23 H new ATOM 0 HB1 ALA A 47 -14.965 -0.266 1.975 1.00 61.43 H new ATOM 0 HB2 ALA A 47 -14.992 -1.753 0.997 1.00 61.43 H new ATOM 0 HB3 ALA A 47 -15.749 -1.733 2.607 1.00 61.43 H new ATOM 677 N GLN A 48 -13.978 -1.878 5.029 1.00 43.34 N ATOM 678 CA GLN A 48 -13.873 -1.433 6.422 1.00 42.24 C ATOM 679 C GLN A 48 -12.419 -1.370 6.847 1.00 42.43 C ATOM 680 O GLN A 48 -12.018 -0.438 7.526 1.00 4.35 O ATOM 681 CB GLN A 48 -14.620 -2.354 7.374 1.00 73.10 C ATOM 682 CG GLN A 48 -16.102 -2.449 7.133 1.00 72.01 C ATOM 683 CD GLN A 48 -16.801 -3.330 8.152 1.00 40.35 C ATOM 684 OE1 GLN A 48 -16.103 -4.321 8.674 1.00 13.35 O flip ATOM 685 NE2 GLN A 48 -17.969 -3.120 8.468 1.00 40.34 N flip ATOM 0 H GLN A 48 -14.488 -2.753 4.907 1.00 43.34 H new ATOM 0 HA GLN A 48 -14.325 -0.443 6.472 1.00 42.24 H new ATOM 0 HB2 GLN A 48 -14.190 -3.353 7.301 1.00 73.10 H new ATOM 0 HB3 GLN A 48 -14.454 -2.009 8.395 1.00 73.10 H new ATOM 0 HG2 GLN A 48 -16.536 -1.450 7.163 1.00 72.01 H new ATOM 0 HG3 GLN A 48 -16.280 -2.844 6.133 1.00 72.01 H new ATOM 0 HE21 GLN A 48 -18.480 -2.345 8.045 1.00 40.34 H new ATOM 0 HE22 GLN A 48 -18.428 -3.720 9.153 1.00 40.34 H new ATOM 694 N GLN A 49 -11.631 -2.348 6.406 1.00 23.31 N ATOM 695 CA GLN A 49 -10.198 -2.386 6.699 1.00 43.54 C ATOM 696 C GLN A 49 -9.553 -1.116 6.161 1.00 53.55 C ATOM 697 O GLN A 49 -8.816 -0.424 6.867 1.00 12.23 O ATOM 698 CB GLN A 49 -9.536 -3.603 6.034 1.00 43.02 C ATOM 699 CG GLN A 49 -10.127 -4.959 6.408 1.00 60.21 C ATOM 700 CD GLN A 49 -9.929 -5.349 7.864 1.00 23.32 C ATOM 701 OE1 GLN A 49 -9.862 -4.504 8.767 1.00 34.21 O ATOM 702 NE2 GLN A 49 -9.850 -6.626 8.114 1.00 52.03 N ATOM 0 H GLN A 49 -11.962 -3.130 5.841 1.00 23.31 H new ATOM 0 HA GLN A 49 -10.061 -2.461 7.778 1.00 43.54 H new ATOM 0 HB2 GLN A 49 -9.601 -3.484 4.952 1.00 43.02 H new ATOM 0 HB3 GLN A 49 -8.477 -3.604 6.292 1.00 43.02 H new ATOM 0 HG2 GLN A 49 -11.195 -4.950 6.189 1.00 60.21 H new ATOM 0 HG3 GLN A 49 -9.678 -5.725 5.775 1.00 60.21 H new ATOM 0 HE21 GLN A 49 -9.908 -7.300 7.350 1.00 52.03 H new ATOM 0 HE22 GLN A 49 -9.730 -6.951 9.073 1.00 52.03 H new ATOM 711 N LEU A 50 -9.911 -0.787 4.933 1.00 62.21 N ATOM 712 CA LEU A 50 -9.417 0.400 4.243 1.00 71.32 C ATOM 713 C LEU A 50 -9.841 1.679 4.991 1.00 11.20 C ATOM 714 O LEU A 50 -9.060 2.609 5.138 1.00 12.41 O ATOM 715 CB LEU A 50 -9.975 0.412 2.807 1.00 44.40 C ATOM 716 CG LEU A 50 -9.596 1.610 1.917 1.00 15.01 C ATOM 717 CD1 LEU A 50 -8.105 1.646 1.641 1.00 52.41 C ATOM 718 CD2 LEU A 50 -10.380 1.577 0.616 1.00 63.15 C ATOM 0 H LEU A 50 -10.561 -1.341 4.376 1.00 62.21 H new ATOM 0 HA LEU A 50 -8.328 0.373 4.214 1.00 71.32 H new ATOM 0 HB2 LEU A 50 -9.644 -0.498 2.308 1.00 44.40 H new ATOM 0 HB3 LEU A 50 -11.062 0.365 2.866 1.00 44.40 H new ATOM 0 HG LEU A 50 -9.855 2.521 2.457 1.00 15.01 H new ATOM 0 HD11 LEU A 50 -7.872 2.504 1.010 1.00 52.41 H new ATOM 0 HD12 LEU A 50 -7.563 1.730 2.583 1.00 52.41 H new ATOM 0 HD13 LEU A 50 -7.807 0.730 1.132 1.00 52.41 H new ATOM 0 HD21 LEU A 50 -10.099 2.431 0.000 1.00 63.15 H new ATOM 0 HD22 LEU A 50 -10.157 0.654 0.080 1.00 63.15 H new ATOM 0 HD23 LEU A 50 -11.447 1.622 0.833 1.00 63.15 H new ATOM 730 N ARG A 51 -11.068 1.684 5.493 1.00 13.10 N ATOM 731 CA ARG A 51 -11.618 2.828 6.236 1.00 4.53 C ATOM 732 C ARG A 51 -10.929 3.015 7.588 1.00 62.14 C ATOM 733 O ARG A 51 -10.896 4.124 8.129 1.00 61.25 O ATOM 734 CB ARG A 51 -13.107 2.639 6.501 1.00 73.23 C ATOM 735 CG ARG A 51 -13.989 2.556 5.285 1.00 2.02 C ATOM 736 CD ARG A 51 -15.418 2.290 5.705 1.00 31.12 C ATOM 737 NE ARG A 51 -16.304 2.084 4.565 1.00 44.04 N ATOM 738 CZ ARG A 51 -17.394 1.309 4.584 1.00 11.21 C ATOM 739 NH1 ARG A 51 -17.758 0.692 5.707 1.00 31.34 N ATOM 740 NH2 ARG A 51 -18.122 1.163 3.484 1.00 35.03 N ATOM 0 H ARG A 51 -11.715 0.901 5.401 1.00 13.10 H new ATOM 0 HA ARG A 51 -11.446 3.706 5.613 1.00 4.53 H new ATOM 0 HB2 ARG A 51 -13.239 1.727 7.084 1.00 73.23 H new ATOM 0 HB3 ARG A 51 -13.453 3.466 7.120 1.00 73.23 H new ATOM 0 HG2 ARG A 51 -13.934 3.487 4.720 1.00 2.02 H new ATOM 0 HG3 ARG A 51 -13.640 1.761 4.625 1.00 2.02 H new ATOM 0 HD2 ARG A 51 -15.447 1.410 6.348 1.00 31.12 H new ATOM 0 HD3 ARG A 51 -15.782 3.130 6.297 1.00 31.12 H new ATOM 0 HE ARG A 51 -16.077 2.564 3.694 1.00 44.04 H new ATOM 0 HH11 ARG A 51 -17.205 0.810 6.556 1.00 31.34 H new ATOM 0 HH12 ARG A 51 -18.590 0.102 5.718 1.00 31.34 H new ATOM 0 HH21 ARG A 51 -17.850 1.642 2.625 1.00 35.03 H new ATOM 0 HH22 ARG A 51 -18.953 0.572 3.497 1.00 35.03 H new ATOM 754 N GLU A 52 -10.406 1.931 8.142 1.00 74.53 N ATOM 755 CA GLU A 52 -9.786 1.984 9.456 1.00 73.44 C ATOM 756 C GLU A 52 -8.280 2.179 9.352 1.00 44.12 C ATOM 757 O GLU A 52 -7.605 2.402 10.357 1.00 34.02 O ATOM 758 CB GLU A 52 -10.086 0.712 10.254 1.00 4.02 C ATOM 759 CG GLU A 52 -11.560 0.454 10.524 1.00 53.34 C ATOM 760 CD GLU A 52 -11.781 -0.797 11.344 1.00 21.31 C ATOM 761 OE1 GLU A 52 -11.872 -1.907 10.769 1.00 62.21 O ATOM 762 OE2 GLU A 52 -11.864 -0.700 12.581 1.00 3.11 O ATOM 0 H GLU A 52 -10.399 1.010 7.705 1.00 74.53 H new ATOM 0 HA GLU A 52 -10.211 2.841 9.979 1.00 73.44 H new ATOM 0 HB2 GLU A 52 -9.676 -0.142 9.715 1.00 4.02 H new ATOM 0 HB3 GLU A 52 -9.562 0.768 11.208 1.00 4.02 H new ATOM 0 HG2 GLU A 52 -11.987 1.309 11.048 1.00 53.34 H new ATOM 0 HG3 GLU A 52 -12.091 0.363 9.576 1.00 53.34 H new ATOM 769 N GLY A 53 -7.763 2.100 8.143 1.00 20.10 N ATOM 770 CA GLY A 53 -6.337 2.234 7.943 1.00 41.34 C ATOM 771 C GLY A 53 -5.609 0.927 8.177 1.00 31.14 C ATOM 772 O GLY A 53 -4.428 0.911 8.520 1.00 0.13 O ATOM 0 H GLY A 53 -8.304 1.945 7.292 1.00 20.10 H new ATOM 0 HA2 GLY A 53 -6.144 2.581 6.928 1.00 41.34 H new ATOM 0 HA3 GLY A 53 -5.945 2.994 8.619 1.00 41.34 H new ATOM 776 N HIS A 54 -6.318 -0.170 7.995 1.00 1.42 N ATOM 777 CA HIS A 54 -5.740 -1.498 8.166 1.00 0.52 C ATOM 778 C HIS A 54 -5.302 -2.061 6.831 1.00 14.13 C ATOM 779 O HIS A 54 -4.697 -3.125 6.774 1.00 52.30 O ATOM 780 CB HIS A 54 -6.738 -2.484 8.828 1.00 4.04 C ATOM 781 CG HIS A 54 -7.115 -2.174 10.254 1.00 63.35 C ATOM 782 ND1 HIS A 54 -8.415 -2.127 10.719 1.00 15.40 N ATOM 783 CD2 HIS A 54 -6.333 -1.952 11.335 1.00 31.53 C ATOM 784 CE1 HIS A 54 -8.378 -1.882 12.032 1.00 61.11 C ATOM 785 NE2 HIS A 54 -7.133 -1.766 12.460 1.00 11.13 N ATOM 0 H HIS A 54 -7.302 -0.172 7.727 1.00 1.42 H new ATOM 0 HA HIS A 54 -4.878 -1.387 8.824 1.00 0.52 H new ATOM 0 HB2 HIS A 54 -7.648 -2.508 8.228 1.00 4.04 H new ATOM 0 HB3 HIS A 54 -6.307 -3.485 8.795 1.00 4.04 H new ATOM 0 HD2 HIS A 54 -5.253 -1.923 11.327 1.00 31.53 H new ATOM 0 HE1 HIS A 54 -9.251 -1.791 12.661 1.00 61.11 H new ATOM 0 HE2 HIS A 54 -6.823 -1.579 13.414 1.00 11.13 H new ATOM 793 N LEU A 55 -5.607 -1.344 5.765 1.00 2.31 N ATOM 794 CA LEU A 55 -5.324 -1.804 4.426 1.00 74.41 C ATOM 795 C LEU A 55 -5.401 -0.604 3.482 1.00 34.23 C ATOM 796 O LEU A 55 -6.069 0.376 3.807 1.00 13.32 O ATOM 797 CB LEU A 55 -6.386 -2.853 4.052 1.00 54.44 C ATOM 798 CG LEU A 55 -6.229 -3.600 2.730 1.00 43.44 C ATOM 799 CD1 LEU A 55 -4.922 -4.386 2.698 1.00 60.51 C ATOM 800 CD2 LEU A 55 -7.414 -4.533 2.536 1.00 43.03 C ATOM 0 H LEU A 55 -6.057 -0.429 5.807 1.00 2.31 H new ATOM 0 HA LEU A 55 -4.332 -2.251 4.355 1.00 74.41 H new ATOM 0 HB2 LEU A 55 -6.418 -3.594 4.851 1.00 54.44 H new ATOM 0 HB3 LEU A 55 -7.356 -2.355 4.040 1.00 54.44 H new ATOM 0 HG LEU A 55 -6.200 -2.875 1.917 1.00 43.44 H new ATOM 0 HD11 LEU A 55 -4.835 -4.909 1.746 1.00 60.51 H new ATOM 0 HD12 LEU A 55 -4.082 -3.701 2.814 1.00 60.51 H new ATOM 0 HD13 LEU A 55 -4.913 -5.111 3.512 1.00 60.51 H new ATOM 0 HD21 LEU A 55 -7.305 -5.068 1.593 1.00 43.03 H new ATOM 0 HD22 LEU A 55 -7.452 -5.249 3.357 1.00 43.03 H new ATOM 0 HD23 LEU A 55 -8.336 -3.952 2.519 1.00 43.03 H new ATOM 812 N VAL A 56 -4.693 -0.659 2.361 1.00 44.43 N ATOM 813 CA VAL A 56 -4.741 0.386 1.361 1.00 0.44 C ATOM 814 C VAL A 56 -4.613 -0.283 -0.009 1.00 51.33 C ATOM 815 O VAL A 56 -4.160 -1.433 -0.088 1.00 74.52 O ATOM 816 CB VAL A 56 -3.622 1.459 1.580 1.00 61.21 C ATOM 817 CG1 VAL A 56 -2.234 0.912 1.301 1.00 0.51 C ATOM 818 CG2 VAL A 56 -3.890 2.740 0.797 1.00 24.15 C ATOM 0 H VAL A 56 -4.071 -1.432 2.125 1.00 44.43 H new ATOM 0 HA VAL A 56 -5.686 0.925 1.434 1.00 0.44 H new ATOM 0 HB VAL A 56 -3.652 1.719 2.638 1.00 61.21 H new ATOM 0 HG11 VAL A 56 -1.494 1.695 1.467 1.00 0.51 H new ATOM 0 HG12 VAL A 56 -2.032 0.074 1.968 1.00 0.51 H new ATOM 0 HG13 VAL A 56 -2.178 0.573 0.266 1.00 0.51 H new ATOM 0 HG21 VAL A 56 -3.087 3.454 0.981 1.00 24.15 H new ATOM 0 HG22 VAL A 56 -3.936 2.513 -0.268 1.00 24.15 H new ATOM 0 HG23 VAL A 56 -4.839 3.171 1.118 1.00 24.15 H new ATOM 828 N ALA A 57 -4.998 0.405 -1.052 1.00 65.43 N ATOM 829 CA ALA A 57 -5.020 -0.155 -2.383 1.00 11.42 C ATOM 830 C ALA A 57 -4.639 0.904 -3.394 1.00 12.43 C ATOM 831 O ALA A 57 -4.685 2.086 -3.083 1.00 72.23 O ATOM 832 CB ALA A 57 -6.410 -0.686 -2.686 1.00 75.34 C ATOM 0 H ALA A 57 -5.307 1.376 -1.004 1.00 65.43 H new ATOM 0 HA ALA A 57 -4.302 -0.973 -2.443 1.00 11.42 H new ATOM 0 HB1 ALA A 57 -6.427 -1.109 -3.691 1.00 75.34 H new ATOM 0 HB2 ALA A 57 -6.670 -1.459 -1.963 1.00 75.34 H new ATOM 0 HB3 ALA A 57 -7.132 0.128 -2.623 1.00 75.34 H new ATOM 838 N VAL A 58 -4.274 0.473 -4.585 1.00 43.41 N ATOM 839 CA VAL A 58 -3.925 1.372 -5.673 1.00 71.21 C ATOM 840 C VAL A 58 -4.751 1.044 -6.887 1.00 1.20 C ATOM 841 O VAL A 58 -5.366 -0.016 -6.961 1.00 33.15 O ATOM 842 CB VAL A 58 -2.420 1.364 -6.060 1.00 62.31 C ATOM 843 CG1 VAL A 58 -1.599 2.089 -5.020 1.00 3.24 C ATOM 844 CG2 VAL A 58 -1.905 -0.063 -6.254 1.00 34.00 C ATOM 0 H VAL A 58 -4.210 -0.515 -4.829 1.00 43.41 H new ATOM 0 HA VAL A 58 -4.139 2.376 -5.306 1.00 71.21 H new ATOM 0 HB VAL A 58 -2.317 1.889 -7.010 1.00 62.31 H new ATOM 0 HG11 VAL A 58 -0.548 2.072 -5.309 1.00 3.24 H new ATOM 0 HG12 VAL A 58 -1.938 3.122 -4.944 1.00 3.24 H new ATOM 0 HG13 VAL A 58 -1.717 1.597 -4.055 1.00 3.24 H new ATOM 0 HG21 VAL A 58 -0.849 -0.035 -6.524 1.00 34.00 H new ATOM 0 HG22 VAL A 58 -2.028 -0.623 -5.327 1.00 34.00 H new ATOM 0 HG23 VAL A 58 -2.470 -0.549 -7.049 1.00 34.00 H new ATOM 854 N ARG A 59 -4.772 1.935 -7.820 1.00 70.10 N ATOM 855 CA ARG A 59 -5.607 1.801 -8.977 1.00 64.34 C ATOM 856 C ARG A 59 -4.767 1.554 -10.210 1.00 21.40 C ATOM 857 O ARG A 59 -3.790 2.251 -10.441 1.00 35.40 O ATOM 858 CB ARG A 59 -6.400 3.085 -9.154 1.00 41.01 C ATOM 859 CG ARG A 59 -7.351 3.101 -10.327 1.00 31.10 C ATOM 860 CD ARG A 59 -7.843 4.508 -10.578 1.00 31.02 C ATOM 861 NE ARG A 59 -6.714 5.414 -10.856 1.00 33.51 N ATOM 862 CZ ARG A 59 -6.798 6.613 -11.418 1.00 35.20 C ATOM 863 NH1 ARG A 59 -7.974 7.122 -11.755 1.00 62.53 N ATOM 864 NH2 ARG A 59 -5.692 7.305 -11.638 1.00 62.51 N ATOM 0 H ARG A 59 -4.208 2.785 -7.806 1.00 70.10 H new ATOM 0 HA ARG A 59 -6.280 0.954 -8.841 1.00 64.34 H new ATOM 0 HB2 ARG A 59 -6.970 3.269 -8.243 1.00 41.01 H new ATOM 0 HB3 ARG A 59 -5.699 3.913 -9.264 1.00 41.01 H new ATOM 0 HG2 ARG A 59 -6.850 2.719 -11.216 1.00 31.10 H new ATOM 0 HG3 ARG A 59 -8.196 2.442 -10.129 1.00 31.10 H new ATOM 0 HD2 ARG A 59 -8.534 4.512 -11.421 1.00 31.02 H new ATOM 0 HD3 ARG A 59 -8.397 4.865 -9.710 1.00 31.02 H new ATOM 0 HE ARG A 59 -5.784 5.090 -10.592 1.00 33.51 H new ATOM 0 HH11 ARG A 59 -8.828 6.591 -11.583 1.00 62.53 H new ATOM 0 HH12 ARG A 59 -8.026 8.045 -12.186 1.00 62.53 H new ATOM 0 HH21 ARG A 59 -4.786 6.916 -11.376 1.00 62.51 H new ATOM 0 HH22 ARG A 59 -5.745 8.228 -12.069 1.00 62.51 H new ATOM 878 N ARG A 60 -5.151 0.575 -10.988 1.00 2.41 N ATOM 879 CA ARG A 60 -4.498 0.283 -12.238 1.00 71.23 C ATOM 880 C ARG A 60 -5.538 0.011 -13.303 1.00 14.34 C ATOM 881 O ARG A 60 -6.450 -0.789 -13.083 1.00 33.40 O ATOM 882 CB ARG A 60 -3.458 -0.874 -12.103 1.00 72.43 C ATOM 883 CG ARG A 60 -3.985 -2.229 -11.598 1.00 20.10 C ATOM 884 CD ARG A 60 -4.638 -3.084 -12.687 1.00 33.31 C ATOM 885 NE ARG A 60 -5.215 -4.315 -12.133 1.00 51.55 N ATOM 886 CZ ARG A 60 -4.630 -5.521 -12.177 1.00 44.13 C ATOM 887 NH1 ARG A 60 -3.462 -5.674 -12.792 1.00 64.32 N ATOM 888 NH2 ARG A 60 -5.213 -6.571 -11.597 1.00 53.34 N ATOM 0 H ARG A 60 -5.930 -0.046 -10.771 1.00 2.41 H new ATOM 0 HA ARG A 60 -3.921 1.156 -12.543 1.00 71.23 H new ATOM 0 HB2 ARG A 60 -2.997 -1.031 -13.078 1.00 72.43 H new ATOM 0 HB3 ARG A 60 -2.669 -0.544 -11.427 1.00 72.43 H new ATOM 0 HG2 ARG A 60 -3.159 -2.788 -11.157 1.00 20.10 H new ATOM 0 HG3 ARG A 60 -4.711 -2.053 -10.804 1.00 20.10 H new ATOM 0 HD2 ARG A 60 -5.418 -2.507 -13.184 1.00 33.31 H new ATOM 0 HD3 ARG A 60 -3.897 -3.338 -13.445 1.00 33.31 H new ATOM 0 HE ARG A 60 -6.127 -4.248 -11.682 1.00 51.55 H new ATOM 0 HH11 ARG A 60 -3.008 -4.873 -13.232 1.00 64.32 H new ATOM 0 HH12 ARG A 60 -3.019 -6.592 -12.824 1.00 64.32 H new ATOM 0 HH21 ARG A 60 -6.107 -6.458 -11.118 1.00 53.34 H new ATOM 0 HH22 ARG A 60 -4.765 -7.487 -11.632 1.00 53.34 H new ATOM 902 N ALA A 61 -5.467 0.757 -14.395 1.00 63.42 N ATOM 903 CA ALA A 61 -6.337 0.581 -15.568 1.00 41.42 C ATOM 904 C ALA A 61 -7.832 0.658 -15.199 1.00 20.34 C ATOM 905 O ALA A 61 -8.684 0.034 -15.850 1.00 4.21 O ATOM 906 CB ALA A 61 -6.002 -0.736 -16.268 1.00 43.01 C ATOM 0 H ALA A 61 -4.795 1.517 -14.501 1.00 63.42 H new ATOM 0 HA ALA A 61 -6.148 1.404 -16.257 1.00 41.42 H new ATOM 0 HB1 ALA A 61 -6.649 -0.862 -17.136 1.00 43.01 H new ATOM 0 HB2 ALA A 61 -4.961 -0.722 -16.591 1.00 43.01 H new ATOM 0 HB3 ALA A 61 -6.157 -1.565 -15.577 1.00 43.01 H new ATOM 912 N GLY A 62 -8.133 1.438 -14.174 1.00 42.33 N ATOM 913 CA GLY A 62 -9.493 1.614 -13.726 1.00 35.24 C ATOM 914 C GLY A 62 -9.885 0.666 -12.601 1.00 61.24 C ATOM 915 O GLY A 62 -10.993 0.758 -12.066 1.00 10.10 O ATOM 0 H GLY A 62 -7.442 1.961 -13.636 1.00 42.33 H new ATOM 0 HA2 GLY A 62 -9.627 2.642 -13.389 1.00 35.24 H new ATOM 0 HA3 GLY A 62 -10.168 1.465 -14.569 1.00 35.24 H new ATOM 919 N GLY A 63 -9.002 -0.234 -12.239 1.00 41.51 N ATOM 920 CA GLY A 63 -9.301 -1.202 -11.206 1.00 53.40 C ATOM 921 C GLY A 63 -8.573 -0.930 -9.928 1.00 52.51 C ATOM 922 O GLY A 63 -7.450 -0.451 -9.950 1.00 62.41 O ATOM 0 H GLY A 63 -8.069 -0.318 -12.644 1.00 41.51 H new ATOM 0 HA2 GLY A 63 -10.374 -1.202 -11.014 1.00 53.40 H new ATOM 0 HA3 GLY A 63 -9.040 -2.199 -11.562 1.00 53.40 H new ATOM 926 N VAL A 64 -9.199 -1.236 -8.827 1.00 40.42 N ATOM 927 CA VAL A 64 -8.606 -1.055 -7.526 1.00 24.14 C ATOM 928 C VAL A 64 -8.028 -2.392 -7.102 1.00 34.35 C ATOM 929 O VAL A 64 -8.748 -3.399 -7.024 1.00 11.42 O ATOM 930 CB VAL A 64 -9.666 -0.586 -6.490 1.00 4.11 C ATOM 931 CG1 VAL A 64 -9.040 -0.359 -5.123 1.00 64.32 C ATOM 932 CG2 VAL A 64 -10.367 0.678 -6.966 1.00 15.11 C ATOM 0 H VAL A 64 -10.143 -1.621 -8.804 1.00 40.42 H new ATOM 0 HA VAL A 64 -7.832 -0.289 -7.573 1.00 24.14 H new ATOM 0 HB VAL A 64 -10.407 -1.380 -6.396 1.00 4.11 H new ATOM 0 HG11 VAL A 64 -9.807 -0.032 -4.421 1.00 64.32 H new ATOM 0 HG12 VAL A 64 -8.596 -1.289 -4.767 1.00 64.32 H new ATOM 0 HG13 VAL A 64 -8.268 0.406 -5.199 1.00 64.32 H new ATOM 0 HG21 VAL A 64 -11.104 0.987 -6.225 1.00 15.11 H new ATOM 0 HG22 VAL A 64 -9.633 1.472 -7.101 1.00 15.11 H new ATOM 0 HG23 VAL A 64 -10.867 0.482 -7.914 1.00 15.11 H new ATOM 942 N VAL A 65 -6.749 -2.407 -6.860 1.00 4.21 N ATOM 943 CA VAL A 65 -6.030 -3.618 -6.558 1.00 52.41 C ATOM 944 C VAL A 65 -5.097 -3.420 -5.380 1.00 14.43 C ATOM 945 O VAL A 65 -4.724 -2.290 -5.040 1.00 3.10 O ATOM 946 CB VAL A 65 -5.194 -4.097 -7.773 1.00 71.23 C ATOM 947 CG1 VAL A 65 -6.095 -4.575 -8.888 1.00 42.05 C ATOM 948 CG2 VAL A 65 -4.303 -2.978 -8.277 1.00 21.03 C ATOM 0 H VAL A 65 -6.166 -1.570 -6.866 1.00 4.21 H new ATOM 0 HA VAL A 65 -6.777 -4.373 -6.312 1.00 52.41 H new ATOM 0 HB VAL A 65 -4.570 -4.929 -7.447 1.00 71.23 H new ATOM 0 HG11 VAL A 65 -5.487 -4.906 -9.730 1.00 42.05 H new ATOM 0 HG12 VAL A 65 -6.705 -5.405 -8.532 1.00 42.05 H new ATOM 0 HG13 VAL A 65 -6.743 -3.759 -9.207 1.00 42.05 H new ATOM 0 HG21 VAL A 65 -3.723 -3.331 -9.130 1.00 21.03 H new ATOM 0 HG22 VAL A 65 -4.919 -2.132 -8.582 1.00 21.03 H new ATOM 0 HG23 VAL A 65 -3.626 -2.666 -7.482 1.00 21.03 H new ATOM 958 N ILE A 66 -4.719 -4.507 -4.777 1.00 71.04 N ATOM 959 CA ILE A 66 -3.829 -4.494 -3.647 1.00 62.11 C ATOM 960 C ILE A 66 -2.634 -5.389 -3.970 1.00 33.42 C ATOM 961 O ILE A 66 -2.819 -6.505 -4.427 1.00 11.44 O ATOM 962 CB ILE A 66 -4.541 -5.017 -2.363 1.00 71.13 C ATOM 963 CG1 ILE A 66 -5.822 -4.208 -2.113 1.00 24.31 C ATOM 964 CG2 ILE A 66 -3.605 -4.920 -1.155 1.00 31.34 C ATOM 965 CD1 ILE A 66 -6.625 -4.650 -0.919 1.00 61.12 C ATOM 0 H ILE A 66 -5.021 -5.440 -5.056 1.00 71.04 H new ATOM 0 HA ILE A 66 -3.506 -3.470 -3.456 1.00 62.11 H new ATOM 0 HB ILE A 66 -4.806 -6.064 -2.508 1.00 71.13 H new ATOM 0 HG12 ILE A 66 -5.553 -3.159 -1.985 1.00 24.31 H new ATOM 0 HG13 ILE A 66 -6.452 -4.269 -3.000 1.00 24.31 H new ATOM 0 HG21 ILE A 66 -4.118 -5.289 -0.267 1.00 31.34 H new ATOM 0 HG22 ILE A 66 -2.714 -5.521 -1.336 1.00 31.34 H new ATOM 0 HG23 ILE A 66 -3.316 -3.880 -1.001 1.00 31.34 H new ATOM 0 HD11 ILE A 66 -7.510 -4.021 -0.823 1.00 61.12 H new ATOM 0 HD12 ILE A 66 -6.930 -5.688 -1.050 1.00 61.12 H new ATOM 0 HD13 ILE A 66 -6.017 -4.561 -0.019 1.00 61.12 H new ATOM 977 N PRO A 67 -1.404 -4.898 -3.811 1.00 33.14 N ATOM 978 CA PRO A 67 -0.196 -5.689 -4.075 1.00 73.25 C ATOM 979 C PRO A 67 -0.109 -6.960 -3.218 1.00 74.21 C ATOM 980 O PRO A 67 -0.401 -6.935 -2.019 1.00 73.41 O ATOM 981 CB PRO A 67 0.939 -4.740 -3.700 1.00 10.44 C ATOM 982 CG PRO A 67 0.347 -3.379 -3.788 1.00 43.30 C ATOM 983 CD PRO A 67 -1.080 -3.527 -3.382 1.00 53.10 C ATOM 0 HA PRO A 67 -0.172 -6.038 -5.107 1.00 73.25 H new ATOM 0 HB2 PRO A 67 1.309 -4.945 -2.696 1.00 10.44 H new ATOM 0 HB3 PRO A 67 1.784 -4.848 -4.380 1.00 10.44 H new ATOM 0 HG2 PRO A 67 0.869 -2.683 -3.132 1.00 43.30 H new ATOM 0 HG3 PRO A 67 0.426 -2.983 -4.801 1.00 43.30 H new ATOM 0 HD2 PRO A 67 -1.210 -3.399 -2.307 1.00 53.10 H new ATOM 0 HD3 PRO A 67 -1.717 -2.790 -3.870 1.00 53.10 H new ATOM 991 N GLN A 68 0.322 -8.055 -3.854 1.00 1.42 N ATOM 992 CA GLN A 68 0.514 -9.377 -3.208 1.00 23.33 C ATOM 993 C GLN A 68 1.389 -9.275 -1.964 1.00 21.44 C ATOM 994 O GLN A 68 1.171 -9.958 -0.970 1.00 50.21 O ATOM 995 CB GLN A 68 1.220 -10.306 -4.187 1.00 74.22 C ATOM 996 CG GLN A 68 0.392 -10.780 -5.359 1.00 65.54 C ATOM 997 CD GLN A 68 -0.631 -11.812 -4.986 1.00 12.45 C ATOM 998 OE1 GLN A 68 -0.433 -12.587 -4.067 1.00 30.23 O ATOM 999 NE2 GLN A 68 -1.728 -11.834 -5.687 1.00 0.14 N ATOM 0 H GLN A 68 0.553 -8.057 -4.847 1.00 1.42 H new ATOM 0 HA GLN A 68 -0.469 -9.754 -2.924 1.00 23.33 H new ATOM 0 HB2 GLN A 68 2.102 -9.794 -4.573 1.00 74.22 H new ATOM 0 HB3 GLN A 68 1.573 -11.180 -3.639 1.00 74.22 H new ATOM 0 HG2 GLN A 68 -0.113 -9.924 -5.808 1.00 65.54 H new ATOM 0 HG3 GLN A 68 1.055 -11.194 -6.119 1.00 65.54 H new ATOM 0 HE21 GLN A 68 -1.859 -11.169 -6.450 1.00 0.14 H new ATOM 0 HE22 GLN A 68 -2.456 -12.516 -5.474 1.00 0.14 H new ATOM 1008 N VAL A 69 2.358 -8.390 -2.040 1.00 11.41 N ATOM 1009 CA VAL A 69 3.367 -8.193 -1.005 1.00 42.31 C ATOM 1010 C VAL A 69 2.808 -7.578 0.295 1.00 30.44 C ATOM 1011 O VAL A 69 3.502 -7.509 1.295 1.00 12.11 O ATOM 1012 CB VAL A 69 4.532 -7.333 -1.540 1.00 44.13 C ATOM 1013 CG1 VAL A 69 5.240 -8.044 -2.688 1.00 14.23 C ATOM 1014 CG2 VAL A 69 4.027 -5.972 -1.997 1.00 50.31 C ATOM 0 H VAL A 69 2.475 -7.769 -2.840 1.00 11.41 H new ATOM 0 HA VAL A 69 3.730 -9.188 -0.746 1.00 42.31 H new ATOM 0 HB VAL A 69 5.246 -7.185 -0.729 1.00 44.13 H new ATOM 0 HG11 VAL A 69 6.058 -7.422 -3.052 1.00 14.23 H new ATOM 0 HG12 VAL A 69 5.637 -8.997 -2.337 1.00 14.23 H new ATOM 0 HG13 VAL A 69 4.532 -8.222 -3.497 1.00 14.23 H new ATOM 0 HG21 VAL A 69 4.863 -5.380 -2.371 1.00 50.31 H new ATOM 0 HG22 VAL A 69 3.292 -6.104 -2.791 1.00 50.31 H new ATOM 0 HG23 VAL A 69 3.564 -5.455 -1.157 1.00 50.31 H new ATOM 1024 N PHE A 70 1.558 -7.133 0.262 1.00 31.42 N ATOM 1025 CA PHE A 70 0.900 -6.602 1.455 1.00 63.10 C ATOM 1026 C PHE A 70 0.399 -7.732 2.326 1.00 73.03 C ATOM 1027 O PHE A 70 0.081 -7.551 3.509 1.00 13.11 O ATOM 1028 CB PHE A 70 -0.261 -5.676 1.078 1.00 31.31 C ATOM 1029 CG PHE A 70 0.134 -4.249 0.853 1.00 51.53 C ATOM 1030 CD1 PHE A 70 1.070 -3.891 -0.099 1.00 62.50 C ATOM 1031 CD2 PHE A 70 -0.423 -3.263 1.631 1.00 53.44 C ATOM 1032 CE1 PHE A 70 1.429 -2.566 -0.267 1.00 53.50 C ATOM 1033 CE2 PHE A 70 -0.069 -1.946 1.473 1.00 42.21 C ATOM 1034 CZ PHE A 70 0.851 -1.595 0.529 1.00 2.41 C ATOM 0 H PHE A 70 0.977 -7.128 -0.577 1.00 31.42 H new ATOM 0 HA PHE A 70 1.634 -6.021 2.013 1.00 63.10 H new ATOM 0 HB2 PHE A 70 -0.734 -6.056 0.173 1.00 31.31 H new ATOM 0 HB3 PHE A 70 -1.010 -5.713 1.869 1.00 31.31 H new ATOM 0 HD1 PHE A 70 1.524 -4.652 -0.716 1.00 62.50 H new ATOM 0 HD2 PHE A 70 -1.153 -3.529 2.381 1.00 53.44 H new ATOM 0 HE1 PHE A 70 2.157 -2.291 -1.016 1.00 53.50 H new ATOM 0 HE2 PHE A 70 -0.519 -1.188 2.096 1.00 42.21 H new ATOM 0 HZ PHE A 70 1.128 -0.559 0.404 1.00 2.41 H new ATOM 1044 N PHE A 71 0.342 -8.891 1.747 1.00 12.10 N ATOM 1045 CA PHE A 71 -0.129 -10.044 2.427 1.00 72.33 C ATOM 1046 C PHE A 71 1.009 -11.002 2.639 1.00 44.20 C ATOM 1047 O PHE A 71 2.057 -10.901 2.000 1.00 71.20 O ATOM 1048 CB PHE A 71 -1.255 -10.731 1.635 1.00 75.02 C ATOM 1049 CG PHE A 71 -2.476 -9.878 1.435 1.00 5.51 C ATOM 1050 CD1 PHE A 71 -2.582 -9.049 0.333 1.00 64.51 C ATOM 1051 CD2 PHE A 71 -3.516 -9.905 2.347 1.00 61.22 C ATOM 1052 CE1 PHE A 71 -3.696 -8.265 0.145 1.00 12.51 C ATOM 1053 CE2 PHE A 71 -4.637 -9.119 2.164 1.00 73.40 C ATOM 1054 CZ PHE A 71 -4.724 -8.297 1.060 1.00 3.23 C ATOM 0 H PHE A 71 0.625 -9.059 0.781 1.00 12.10 H new ATOM 0 HA PHE A 71 -0.533 -9.737 3.392 1.00 72.33 H new ATOM 0 HB2 PHE A 71 -0.869 -11.028 0.660 1.00 75.02 H new ATOM 0 HB3 PHE A 71 -1.545 -11.644 2.155 1.00 75.02 H new ATOM 0 HD1 PHE A 71 -1.780 -9.017 -0.389 1.00 64.51 H new ATOM 0 HD2 PHE A 71 -3.451 -10.548 3.212 1.00 61.22 H new ATOM 0 HE1 PHE A 71 -3.764 -7.624 -0.721 1.00 12.51 H new ATOM 0 HE2 PHE A 71 -5.442 -9.148 2.883 1.00 73.40 H new ATOM 0 HZ PHE A 71 -5.598 -7.679 0.913 1.00 3.23 H new ATOM 1064 N THR A 72 0.814 -11.905 3.532 1.00 1.32 N ATOM 1065 CA THR A 72 1.767 -12.932 3.784 1.00 35.02 C ATOM 1066 C THR A 72 1.490 -14.059 2.801 1.00 45.25 C ATOM 1067 O THR A 72 0.409 -14.095 2.184 1.00 61.43 O ATOM 1068 CB THR A 72 1.620 -13.461 5.234 1.00 44.23 C ATOM 1069 OG1 THR A 72 0.267 -13.912 5.444 1.00 52.24 O ATOM 1070 CG2 THR A 72 1.949 -12.369 6.251 1.00 51.40 C ATOM 0 H THR A 72 -0.021 -11.954 4.116 1.00 1.32 H new ATOM 0 HA THR A 72 2.779 -12.546 3.664 1.00 35.02 H new ATOM 0 HB THR A 72 2.318 -14.287 5.372 1.00 44.23 H new ATOM 0 HG1 THR A 72 -0.342 -13.144 5.417 1.00 52.24 H new ATOM 0 HG21 THR A 72 1.838 -12.766 7.260 1.00 51.40 H new ATOM 0 HG22 THR A 72 2.975 -12.032 6.104 1.00 51.40 H new ATOM 0 HG23 THR A 72 1.269 -11.528 6.115 1.00 51.40 H new ATOM 1078 N ASN A 73 2.416 -14.979 2.660 1.00 54.20 N ATOM 1079 CA ASN A 73 2.226 -16.133 1.778 1.00 61.21 C ATOM 1080 C ASN A 73 1.115 -17.030 2.340 1.00 1.12 C ATOM 1081 O ASN A 73 0.458 -17.775 1.621 1.00 22.42 O ATOM 1082 CB ASN A 73 3.547 -16.919 1.634 1.00 54.40 C ATOM 1083 CG ASN A 73 3.429 -18.148 0.733 1.00 74.40 C ATOM 1084 OD1 ASN A 73 3.119 -19.249 1.195 1.00 1.14 O ATOM 1085 ND2 ASN A 73 3.698 -17.984 -0.536 1.00 63.35 N ATOM 0 H ASN A 73 3.315 -14.960 3.142 1.00 54.20 H new ATOM 0 HA ASN A 73 1.930 -15.787 0.788 1.00 61.21 H new ATOM 0 HB2 ASN A 73 4.313 -16.256 1.232 1.00 54.40 H new ATOM 0 HB3 ASN A 73 3.883 -17.233 2.622 1.00 54.40 H new ATOM 0 HD21 ASN A 73 3.654 -18.779 -1.173 1.00 63.35 H new ATOM 0 HD22 ASN A 73 3.951 -17.061 -0.888 1.00 63.35 H new ATOM 1092 N SER A 74 0.876 -16.884 3.630 1.00 30.05 N ATOM 1093 CA SER A 74 -0.110 -17.648 4.343 1.00 44.43 C ATOM 1094 C SER A 74 -1.547 -17.089 4.134 1.00 3.44 C ATOM 1095 O SER A 74 -2.521 -17.621 4.678 1.00 52.43 O ATOM 1096 CB SER A 74 0.274 -17.636 5.803 1.00 1.41 C ATOM 1097 OG SER A 74 1.657 -17.958 5.931 1.00 55.41 O ATOM 0 H SER A 74 1.376 -16.216 4.216 1.00 30.05 H new ATOM 0 HA SER A 74 -0.129 -18.669 3.961 1.00 44.43 H new ATOM 0 HB2 SER A 74 0.076 -16.655 6.234 1.00 1.41 H new ATOM 0 HB3 SER A 74 -0.331 -18.355 6.356 1.00 1.41 H new ATOM 0 HG SER A 74 1.909 -17.949 6.878 1.00 55.41 H new ATOM 1103 N GLY A 75 -1.668 -15.999 3.387 1.00 72.34 N ATOM 1104 CA GLY A 75 -2.981 -15.496 3.030 1.00 63.51 C ATOM 1105 C GLY A 75 -3.484 -14.356 3.891 1.00 20.21 C ATOM 1106 O GLY A 75 -4.437 -13.676 3.519 1.00 43.01 O ATOM 0 H GLY A 75 -0.885 -15.456 3.023 1.00 72.34 H new ATOM 0 HA2 GLY A 75 -2.957 -15.165 1.992 1.00 63.51 H new ATOM 0 HA3 GLY A 75 -3.696 -16.317 3.086 1.00 63.51 H new ATOM 1110 N GLN A 76 -2.896 -14.146 5.050 1.00 62.13 N ATOM 1111 CA GLN A 76 -3.350 -13.052 5.900 1.00 0.35 C ATOM 1112 C GLN A 76 -2.543 -11.811 5.603 1.00 62.31 C ATOM 1113 O GLN A 76 -1.480 -11.900 4.983 1.00 4.31 O ATOM 1114 CB GLN A 76 -3.273 -13.386 7.394 1.00 73.34 C ATOM 1115 CG GLN A 76 -1.882 -13.691 7.910 1.00 61.24 C ATOM 1116 CD GLN A 76 -1.825 -13.647 9.415 1.00 61.25 C ATOM 1117 OE1 GLN A 76 -2.045 -14.650 10.101 1.00 32.42 O ATOM 1118 NE2 GLN A 76 -1.550 -12.485 9.944 1.00 11.22 N ATOM 0 H GLN A 76 -2.123 -14.698 5.423 1.00 62.13 H new ATOM 0 HA GLN A 76 -4.402 -12.880 5.671 1.00 0.35 H new ATOM 0 HB2 GLN A 76 -3.679 -12.547 7.960 1.00 73.34 H new ATOM 0 HB3 GLN A 76 -3.914 -14.245 7.593 1.00 73.34 H new ATOM 0 HG2 GLN A 76 -1.573 -14.677 7.563 1.00 61.24 H new ATOM 0 HG3 GLN A 76 -1.175 -12.971 7.498 1.00 61.24 H new ATOM 0 HE21 GLN A 76 -1.374 -11.680 9.343 1.00 11.22 H new ATOM 0 HE22 GLN A 76 -1.511 -12.383 10.958 1.00 11.22 H new ATOM 1127 N VAL A 77 -3.010 -10.673 6.047 1.00 51.33 N ATOM 1128 CA VAL A 77 -2.310 -9.444 5.790 1.00 45.13 C ATOM 1129 C VAL A 77 -1.215 -9.281 6.852 1.00 62.15 C ATOM 1130 O VAL A 77 -1.302 -9.902 7.943 1.00 31.31 O ATOM 1131 CB VAL A 77 -3.279 -8.212 5.778 1.00 54.52 C ATOM 1132 CG1 VAL A 77 -3.638 -7.723 7.170 1.00 41.11 C ATOM 1133 CG2 VAL A 77 -2.740 -7.090 4.920 1.00 51.41 C ATOM 0 H VAL A 77 -3.870 -10.573 6.587 1.00 51.33 H new ATOM 0 HA VAL A 77 -1.860 -9.487 4.798 1.00 45.13 H new ATOM 0 HB VAL A 77 -4.208 -8.562 5.329 1.00 54.52 H new ATOM 0 HG11 VAL A 77 -4.311 -6.869 7.093 1.00 41.11 H new ATOM 0 HG12 VAL A 77 -4.130 -8.524 7.721 1.00 41.11 H new ATOM 0 HG13 VAL A 77 -2.731 -7.424 7.696 1.00 41.11 H new ATOM 0 HG21 VAL A 77 -3.438 -6.253 4.935 1.00 51.41 H new ATOM 0 HG22 VAL A 77 -1.775 -6.765 5.310 1.00 51.41 H new ATOM 0 HG23 VAL A 77 -2.618 -7.442 3.896 1.00 51.41 H new ATOM 1143 N VAL A 78 -0.179 -8.525 6.532 1.00 72.12 N ATOM 1144 CA VAL A 78 0.899 -8.288 7.473 1.00 61.42 C ATOM 1145 C VAL A 78 0.361 -7.478 8.655 1.00 14.51 C ATOM 1146 O VAL A 78 -0.229 -6.424 8.467 1.00 3.45 O ATOM 1147 CB VAL A 78 2.081 -7.515 6.821 1.00 34.15 C ATOM 1148 CG1 VAL A 78 3.245 -7.366 7.790 1.00 1.04 C ATOM 1149 CG2 VAL A 78 2.541 -8.185 5.539 1.00 43.42 C ATOM 0 H VAL A 78 -0.063 -8.066 5.629 1.00 72.12 H new ATOM 0 HA VAL A 78 1.275 -9.256 7.805 1.00 61.42 H new ATOM 0 HB VAL A 78 1.716 -6.519 6.571 1.00 34.15 H new ATOM 0 HG11 VAL A 78 4.055 -6.822 7.305 1.00 1.04 H new ATOM 0 HG12 VAL A 78 2.916 -6.817 8.672 1.00 1.04 H new ATOM 0 HG13 VAL A 78 3.599 -8.353 8.088 1.00 1.04 H new ATOM 0 HG21 VAL A 78 3.368 -7.619 5.109 1.00 43.42 H new ATOM 0 HG22 VAL A 78 2.871 -9.201 5.757 1.00 43.42 H new ATOM 0 HG23 VAL A 78 1.715 -8.217 4.828 1.00 43.42 H new ATOM 1159 N LYS A 79 0.564 -7.978 9.854 1.00 11.23 N ATOM 1160 CA LYS A 79 0.067 -7.323 11.075 1.00 33.51 C ATOM 1161 C LYS A 79 0.662 -5.915 11.277 1.00 64.31 C ATOM 1162 O LYS A 79 0.044 -5.045 11.888 1.00 20.05 O ATOM 1163 CB LYS A 79 0.316 -8.201 12.305 1.00 11.34 C ATOM 1164 CG LYS A 79 1.768 -8.487 12.551 1.00 31.52 C ATOM 1165 CD LYS A 79 2.039 -9.446 13.733 1.00 1.24 C ATOM 1166 CE LYS A 79 1.620 -8.892 15.113 1.00 15.33 C ATOM 1167 NZ LYS A 79 0.152 -8.950 15.370 1.00 1.35 N ATOM 0 H LYS A 79 1.074 -8.845 10.025 1.00 11.23 H new ATOM 0 HA LYS A 79 -1.008 -7.196 10.948 1.00 33.51 H new ATOM 0 HB2 LYS A 79 -0.103 -7.710 13.183 1.00 11.34 H new ATOM 0 HB3 LYS A 79 -0.216 -9.144 12.182 1.00 11.34 H new ATOM 0 HG2 LYS A 79 2.200 -8.914 11.646 1.00 31.52 H new ATOM 0 HG3 LYS A 79 2.285 -7.545 12.737 1.00 31.52 H new ATOM 0 HD2 LYS A 79 1.509 -10.382 13.555 1.00 1.24 H new ATOM 0 HD3 LYS A 79 3.103 -9.682 13.757 1.00 1.24 H new ATOM 0 HE2 LYS A 79 2.137 -9.454 15.891 1.00 15.33 H new ATOM 0 HE3 LYS A 79 1.952 -7.857 15.193 1.00 15.33 H new ATOM 0 HZ1 LYS A 79 -0.234 -7.985 15.399 1.00 1.35 H new ATOM 0 HZ2 LYS A 79 -0.313 -9.486 14.609 1.00 1.35 H new ATOM 0 HZ3 LYS A 79 -0.023 -9.420 16.281 1.00 1.35 H new ATOM 1181 N SER A 80 1.837 -5.708 10.737 1.00 73.20 N ATOM 1182 CA SER A 80 2.544 -4.449 10.841 1.00 2.14 C ATOM 1183 C SER A 80 2.089 -3.442 9.762 1.00 34.24 C ATOM 1184 O SER A 80 2.571 -2.307 9.721 1.00 43.24 O ATOM 1185 CB SER A 80 4.029 -4.736 10.706 1.00 21.10 C ATOM 1186 OG SER A 80 4.397 -5.789 11.591 1.00 33.23 O ATOM 0 H SER A 80 2.340 -6.418 10.204 1.00 73.20 H new ATOM 0 HA SER A 80 2.325 -3.992 11.806 1.00 2.14 H new ATOM 0 HB2 SER A 80 4.264 -5.013 9.678 1.00 21.10 H new ATOM 0 HB3 SER A 80 4.605 -3.839 10.934 1.00 21.10 H new ATOM 0 HG SER A 80 5.355 -5.973 11.500 1.00 33.23 H new ATOM 1192 N LEU A 81 1.157 -3.857 8.913 1.00 13.11 N ATOM 1193 CA LEU A 81 0.658 -3.007 7.842 1.00 41.35 C ATOM 1194 C LEU A 81 -0.011 -1.701 8.363 1.00 40.24 C ATOM 1195 O LEU A 81 0.392 -0.605 7.961 1.00 62.41 O ATOM 1196 CB LEU A 81 -0.303 -3.759 6.921 1.00 11.33 C ATOM 1197 CG LEU A 81 -0.823 -2.950 5.753 1.00 0.14 C ATOM 1198 CD1 LEU A 81 0.317 -2.579 4.851 1.00 21.24 C ATOM 1199 CD2 LEU A 81 -1.872 -3.711 4.996 1.00 1.31 C ATOM 0 H LEU A 81 0.730 -4.783 8.947 1.00 13.11 H new ATOM 0 HA LEU A 81 1.537 -2.716 7.267 1.00 41.35 H new ATOM 0 HB2 LEU A 81 0.203 -4.644 6.536 1.00 11.33 H new ATOM 0 HB3 LEU A 81 -1.151 -4.108 7.510 1.00 11.33 H new ATOM 0 HG LEU A 81 -1.286 -2.040 6.135 1.00 0.14 H new ATOM 0 HD11 LEU A 81 -0.059 -1.996 4.010 1.00 21.24 H new ATOM 0 HD12 LEU A 81 1.043 -1.986 5.407 1.00 21.24 H new ATOM 0 HD13 LEU A 81 0.796 -3.485 4.479 1.00 21.24 H new ATOM 0 HD21 LEU A 81 -2.229 -3.107 4.162 1.00 1.31 H new ATOM 0 HD22 LEU A 81 -1.445 -4.639 4.616 1.00 1.31 H new ATOM 0 HD23 LEU A 81 -2.705 -3.941 5.660 1.00 1.31 H new ATOM 1211 N PRO A 82 -1.039 -1.784 9.274 1.00 50.55 N ATOM 1212 CA PRO A 82 -1.724 -0.594 9.785 1.00 64.23 C ATOM 1213 C PRO A 82 -0.776 0.377 10.468 1.00 11.43 C ATOM 1214 O PRO A 82 -0.999 1.579 10.440 1.00 21.52 O ATOM 1215 CB PRO A 82 -2.733 -1.135 10.801 1.00 32.51 C ATOM 1216 CG PRO A 82 -2.311 -2.534 11.078 1.00 52.51 C ATOM 1217 CD PRO A 82 -1.622 -3.012 9.846 1.00 51.44 C ATOM 0 HA PRO A 82 -2.184 -0.034 8.971 1.00 64.23 H new ATOM 0 HB2 PRO A 82 -2.730 -0.537 11.712 1.00 32.51 H new ATOM 0 HB3 PRO A 82 -3.747 -1.103 10.402 1.00 32.51 H new ATOM 0 HG2 PRO A 82 -1.643 -2.576 11.939 1.00 52.51 H new ATOM 0 HG3 PRO A 82 -3.171 -3.161 11.311 1.00 52.51 H new ATOM 0 HD2 PRO A 82 -0.854 -3.750 10.077 1.00 51.44 H new ATOM 0 HD3 PRO A 82 -2.320 -3.484 9.154 1.00 51.44 H new ATOM 1225 N GLY A 83 0.303 -0.146 11.040 1.00 14.33 N ATOM 1226 CA GLY A 83 1.256 0.687 11.733 1.00 53.04 C ATOM 1227 C GLY A 83 1.902 1.696 10.809 1.00 53.34 C ATOM 1228 O GLY A 83 2.000 2.886 11.147 1.00 45.31 O ATOM 0 H GLY A 83 0.532 -1.140 11.033 1.00 14.33 H new ATOM 0 HA2 GLY A 83 0.756 1.210 12.548 1.00 53.04 H new ATOM 0 HA3 GLY A 83 2.027 0.060 12.182 1.00 53.04 H new ATOM 1232 N LEU A 84 2.315 1.241 9.634 1.00 45.34 N ATOM 1233 CA LEU A 84 2.922 2.132 8.654 1.00 51.35 C ATOM 1234 C LEU A 84 1.875 3.087 8.086 1.00 60.13 C ATOM 1235 O LEU A 84 2.121 4.278 7.912 1.00 41.35 O ATOM 1236 CB LEU A 84 3.675 1.347 7.543 1.00 11.31 C ATOM 1237 CG LEU A 84 2.840 0.591 6.490 1.00 40.44 C ATOM 1238 CD1 LEU A 84 2.559 1.469 5.267 1.00 30.22 C ATOM 1239 CD2 LEU A 84 3.521 -0.707 6.090 1.00 22.24 C ATOM 0 H LEU A 84 2.242 0.268 9.337 1.00 45.34 H new ATOM 0 HA LEU A 84 3.678 2.732 9.160 1.00 51.35 H new ATOM 0 HB2 LEU A 84 4.317 2.052 7.015 1.00 11.31 H new ATOM 0 HB3 LEU A 84 4.328 0.624 8.031 1.00 11.31 H new ATOM 0 HG LEU A 84 1.880 0.342 6.941 1.00 40.44 H new ATOM 0 HD11 LEU A 84 1.969 0.907 4.543 1.00 30.22 H new ATOM 0 HD12 LEU A 84 2.006 2.356 5.575 1.00 30.22 H new ATOM 0 HD13 LEU A 84 3.502 1.770 4.810 1.00 30.22 H new ATOM 0 HD21 LEU A 84 2.913 -1.223 5.346 1.00 22.24 H new ATOM 0 HD22 LEU A 84 4.502 -0.488 5.668 1.00 22.24 H new ATOM 0 HD23 LEU A 84 3.637 -1.343 6.968 1.00 22.24 H new ATOM 1251 N LEU A 85 0.692 2.552 7.832 1.00 62.34 N ATOM 1252 CA LEU A 85 -0.391 3.317 7.243 1.00 51.15 C ATOM 1253 C LEU A 85 -0.851 4.431 8.152 1.00 1.24 C ATOM 1254 O LEU A 85 -1.035 5.550 7.710 1.00 1.15 O ATOM 1255 CB LEU A 85 -1.572 2.412 6.877 1.00 52.50 C ATOM 1256 CG LEU A 85 -1.311 1.364 5.795 1.00 22.33 C ATOM 1257 CD1 LEU A 85 -2.528 0.483 5.610 1.00 21.11 C ATOM 1258 CD2 LEU A 85 -0.951 2.038 4.482 1.00 1.24 C ATOM 0 H LEU A 85 0.457 1.579 8.028 1.00 62.34 H new ATOM 0 HA LEU A 85 -0.001 3.768 6.331 1.00 51.15 H new ATOM 0 HB2 LEU A 85 -1.902 1.897 7.780 1.00 52.50 H new ATOM 0 HB3 LEU A 85 -2.398 3.043 6.550 1.00 52.50 H new ATOM 0 HG LEU A 85 -0.473 0.743 6.112 1.00 22.33 H new ATOM 0 HD11 LEU A 85 -2.327 -0.258 4.836 1.00 21.11 H new ATOM 0 HD12 LEU A 85 -2.756 -0.024 6.548 1.00 21.11 H new ATOM 0 HD13 LEU A 85 -3.379 1.096 5.313 1.00 21.11 H new ATOM 0 HD21 LEU A 85 -0.768 1.279 3.722 1.00 1.24 H new ATOM 0 HD22 LEU A 85 -1.774 2.679 4.164 1.00 1.24 H new ATOM 0 HD23 LEU A 85 -0.053 2.641 4.617 1.00 1.24 H new ATOM 1270 N THR A 86 -0.968 4.129 9.421 1.00 30.50 N ATOM 1271 CA THR A 86 -1.479 5.089 10.398 1.00 52.34 C ATOM 1272 C THR A 86 -0.575 6.340 10.517 1.00 33.11 C ATOM 1273 O THR A 86 -1.069 7.473 10.473 1.00 23.03 O ATOM 1274 CB THR A 86 -1.700 4.425 11.786 1.00 62.43 C ATOM 1275 OG1 THR A 86 -2.588 3.296 11.638 1.00 21.35 O ATOM 1276 CG2 THR A 86 -2.315 5.408 12.778 1.00 71.23 C ATOM 0 H THR A 86 -0.717 3.222 9.815 1.00 30.50 H new ATOM 0 HA THR A 86 -2.448 5.426 10.029 1.00 52.34 H new ATOM 0 HB THR A 86 -0.731 4.105 12.168 1.00 62.43 H new ATOM 0 HG1 THR A 86 -2.070 2.503 11.388 1.00 21.35 H new ATOM 0 HG21 THR A 86 -2.457 4.914 13.739 1.00 71.23 H new ATOM 0 HG22 THR A 86 -1.649 6.262 12.904 1.00 71.23 H new ATOM 0 HG23 THR A 86 -3.278 5.751 12.400 1.00 71.23 H new ATOM 1284 N ILE A 87 0.740 6.137 10.597 1.00 5.34 N ATOM 1285 CA ILE A 87 1.663 7.259 10.730 1.00 13.41 C ATOM 1286 C ILE A 87 1.632 8.145 9.463 1.00 32.03 C ATOM 1287 O ILE A 87 1.578 9.380 9.555 1.00 72.24 O ATOM 1288 CB ILE A 87 3.123 6.780 11.166 1.00 2.51 C ATOM 1289 CG1 ILE A 87 4.161 7.939 11.333 1.00 45.44 C ATOM 1290 CG2 ILE A 87 3.670 5.677 10.272 1.00 70.14 C ATOM 1291 CD1 ILE A 87 4.748 8.513 10.046 1.00 24.14 C ATOM 0 H ILE A 87 1.183 5.219 10.572 1.00 5.34 H new ATOM 0 HA ILE A 87 1.327 7.896 11.549 1.00 13.41 H new ATOM 0 HB ILE A 87 2.979 6.363 12.163 1.00 2.51 H new ATOM 0 HG12 ILE A 87 3.683 8.750 11.882 1.00 45.44 H new ATOM 0 HG13 ILE A 87 4.982 7.576 11.951 1.00 45.44 H new ATOM 0 HG21 ILE A 87 4.664 5.391 10.615 1.00 70.14 H new ATOM 0 HG22 ILE A 87 3.008 4.812 10.315 1.00 70.14 H new ATOM 0 HG23 ILE A 87 3.730 6.037 9.245 1.00 70.14 H new ATOM 0 HD11 ILE A 87 5.453 9.308 10.290 1.00 24.14 H new ATOM 0 HD12 ILE A 87 5.265 7.725 9.499 1.00 24.14 H new ATOM 0 HD13 ILE A 87 3.946 8.917 9.429 1.00 24.14 H new ATOM 1303 N LEU A 88 1.623 7.515 8.300 1.00 14.22 N ATOM 1304 CA LEU A 88 1.529 8.234 7.034 1.00 35.23 C ATOM 1305 C LEU A 88 0.173 8.909 6.848 1.00 5.21 C ATOM 1306 O LEU A 88 0.090 9.991 6.266 1.00 4.31 O ATOM 1307 CB LEU A 88 1.841 7.342 5.843 1.00 41.42 C ATOM 1308 CG LEU A 88 3.322 7.096 5.480 1.00 60.12 C ATOM 1309 CD1 LEU A 88 4.026 8.383 5.101 1.00 12.12 C ATOM 1310 CD2 LEU A 88 4.073 6.403 6.579 1.00 52.43 C ATOM 0 H LEU A 88 1.680 6.501 8.203 1.00 14.22 H new ATOM 0 HA LEU A 88 2.288 9.015 7.080 1.00 35.23 H new ATOM 0 HB2 LEU A 88 1.378 6.372 6.024 1.00 41.42 H new ATOM 0 HB3 LEU A 88 1.351 7.771 4.969 1.00 41.42 H new ATOM 0 HG LEU A 88 3.314 6.435 4.613 1.00 60.12 H new ATOM 0 HD11 LEU A 88 5.066 8.169 4.852 1.00 12.12 H new ATOM 0 HD12 LEU A 88 3.531 8.828 4.238 1.00 12.12 H new ATOM 0 HD13 LEU A 88 3.989 9.078 5.940 1.00 12.12 H new ATOM 0 HD21 LEU A 88 5.109 6.254 6.274 1.00 52.43 H new ATOM 0 HD22 LEU A 88 4.045 7.015 7.481 1.00 52.43 H new ATOM 0 HD23 LEU A 88 3.612 5.437 6.782 1.00 52.43 H new ATOM 1322 N HIS A 89 -0.877 8.260 7.323 1.00 74.25 N ATOM 1323 CA HIS A 89 -2.241 8.780 7.227 1.00 62.10 C ATOM 1324 C HIS A 89 -2.346 10.088 7.997 1.00 50.21 C ATOM 1325 O HIS A 89 -2.922 11.061 7.510 1.00 21.33 O ATOM 1326 CB HIS A 89 -3.253 7.752 7.769 1.00 64.30 C ATOM 1327 CG HIS A 89 -4.693 8.119 7.557 1.00 51.01 C ATOM 1328 ND1 HIS A 89 -5.531 8.561 8.551 1.00 43.54 N ATOM 1329 CD2 HIS A 89 -5.441 8.079 6.432 1.00 11.15 C ATOM 1330 CE1 HIS A 89 -6.734 8.767 8.017 1.00 32.13 C ATOM 1331 NE2 HIS A 89 -6.733 8.491 6.725 1.00 64.33 N ATOM 0 H HIS A 89 -0.813 7.355 7.788 1.00 74.25 H new ATOM 0 HA HIS A 89 -2.476 8.965 6.179 1.00 62.10 H new ATOM 0 HB2 HIS A 89 -3.063 6.790 7.293 1.00 64.30 H new ATOM 0 HB3 HIS A 89 -3.079 7.619 8.837 1.00 64.30 H new ATOM 0 HD2 HIS A 89 -5.088 7.774 5.458 1.00 11.15 H new ATOM 0 HE1 HIS A 89 -7.596 9.114 8.567 1.00 32.13 H new ATOM 0 HE2 HIS A 89 -7.518 8.565 6.078 1.00 64.33 H new ATOM 1339 N ASP A 90 -1.739 10.116 9.173 1.00 60.11 N ATOM 1340 CA ASP A 90 -1.692 11.326 10.005 1.00 5.52 C ATOM 1341 C ASP A 90 -0.901 12.437 9.303 1.00 1.24 C ATOM 1342 O ASP A 90 -1.205 13.632 9.443 1.00 4.03 O ATOM 1343 CB ASP A 90 -1.075 11.001 11.374 1.00 31.32 C ATOM 1344 CG ASP A 90 -0.794 12.230 12.207 1.00 51.32 C ATOM 1345 OD1 ASP A 90 -1.737 12.865 12.712 1.00 11.10 O ATOM 1346 OD2 ASP A 90 0.387 12.593 12.351 1.00 40.14 O ATOM 0 H ASP A 90 -1.266 9.311 9.583 1.00 60.11 H new ATOM 0 HA ASP A 90 -2.710 11.684 10.158 1.00 5.52 H new ATOM 0 HB2 ASP A 90 -1.750 10.344 11.923 1.00 31.32 H new ATOM 0 HB3 ASP A 90 -0.146 10.451 11.225 1.00 31.32 H new ATOM 1351 N GLY A 91 0.069 12.026 8.501 1.00 63.03 N ATOM 1352 CA GLY A 91 0.869 12.960 7.735 1.00 43.24 C ATOM 1353 C GLY A 91 0.173 13.389 6.443 1.00 61.40 C ATOM 1354 O GLY A 91 0.644 14.288 5.734 1.00 25.22 O ATOM 0 H GLY A 91 0.320 11.047 8.366 1.00 63.03 H new ATOM 0 HA2 GLY A 91 1.079 13.840 8.343 1.00 43.24 H new ATOM 0 HA3 GLY A 91 1.829 12.502 7.495 1.00 43.24 H new ATOM 1358 N GLY A 92 -0.924 12.724 6.126 1.00 1.15 N ATOM 1359 CA GLY A 92 -1.712 13.072 4.962 1.00 71.11 C ATOM 1360 C GLY A 92 -1.196 12.470 3.671 1.00 43.12 C ATOM 1361 O GLY A 92 -1.498 12.976 2.584 1.00 35.35 O ATOM 0 H GLY A 92 -1.289 11.937 6.663 1.00 1.15 H new ATOM 0 HA2 GLY A 92 -2.740 12.744 5.119 1.00 71.11 H new ATOM 0 HA3 GLY A 92 -1.735 14.157 4.862 1.00 71.11 H new ATOM 1365 N TYR A 93 -0.456 11.395 3.766 1.00 10.40 N ATOM 1366 CA TYR A 93 0.112 10.770 2.583 1.00 20.03 C ATOM 1367 C TYR A 93 -0.854 9.764 1.962 1.00 34.21 C ATOM 1368 O TYR A 93 -1.406 8.904 2.648 1.00 53.13 O ATOM 1369 CB TYR A 93 1.474 10.139 2.891 1.00 43.32 C ATOM 1370 CG TYR A 93 2.548 11.154 3.232 1.00 22.11 C ATOM 1371 CD1 TYR A 93 2.709 11.628 4.527 1.00 23.12 C ATOM 1372 CD2 TYR A 93 3.398 11.642 2.252 1.00 60.14 C ATOM 1373 CE1 TYR A 93 3.682 12.557 4.830 1.00 43.14 C ATOM 1374 CE2 TYR A 93 4.374 12.568 2.548 1.00 1.42 C ATOM 1375 CZ TYR A 93 4.513 13.022 3.837 1.00 75.14 C ATOM 1376 OH TYR A 93 5.477 13.958 4.132 1.00 53.41 O ATOM 0 H TYR A 93 -0.229 10.930 4.645 1.00 10.40 H new ATOM 0 HA TYR A 93 0.276 11.552 1.841 1.00 20.03 H new ATOM 0 HB2 TYR A 93 1.364 9.445 3.724 1.00 43.32 H new ATOM 0 HB3 TYR A 93 1.798 9.555 2.030 1.00 43.32 H new ATOM 0 HD1 TYR A 93 2.061 11.263 5.310 1.00 23.12 H new ATOM 0 HD2 TYR A 93 3.293 11.289 1.237 1.00 60.14 H new ATOM 0 HE1 TYR A 93 3.791 12.918 5.842 1.00 43.14 H new ATOM 0 HE2 TYR A 93 5.027 12.935 1.770 1.00 1.42 H new ATOM 0 HH TYR A 93 5.978 14.179 3.319 1.00 53.41 H new ATOM 1386 N ARG A 94 -1.058 9.903 0.674 1.00 44.03 N ATOM 1387 CA ARG A 94 -1.991 9.085 -0.099 1.00 4.13 C ATOM 1388 C ARG A 94 -1.383 7.710 -0.414 1.00 74.23 C ATOM 1389 O ARG A 94 -0.185 7.487 -0.203 1.00 41.14 O ATOM 1390 CB ARG A 94 -2.383 9.806 -1.401 1.00 54.10 C ATOM 1391 CG ARG A 94 -1.317 9.753 -2.484 1.00 44.14 C ATOM 1392 CD ARG A 94 -1.528 10.814 -3.539 1.00 4.32 C ATOM 1393 NE ARG A 94 -1.218 12.150 -3.002 1.00 65.14 N ATOM 1394 CZ ARG A 94 -1.307 13.303 -3.678 1.00 44.41 C ATOM 1395 NH1 ARG A 94 -1.658 13.308 -4.958 1.00 73.22 N ATOM 1396 NH2 ARG A 94 -1.013 14.446 -3.079 1.00 60.55 N ATOM 0 H ARG A 94 -0.573 10.602 0.111 1.00 44.03 H new ATOM 0 HA ARG A 94 -2.888 8.932 0.502 1.00 4.13 H new ATOM 0 HB2 ARG A 94 -3.301 9.363 -1.787 1.00 54.10 H new ATOM 0 HB3 ARG A 94 -2.604 10.849 -1.174 1.00 54.10 H new ATOM 0 HG2 ARG A 94 -0.334 9.882 -2.031 1.00 44.14 H new ATOM 0 HG3 ARG A 94 -1.325 8.769 -2.953 1.00 44.14 H new ATOM 0 HD2 ARG A 94 -0.895 10.607 -4.402 1.00 4.32 H new ATOM 0 HD3 ARG A 94 -2.560 10.787 -3.888 1.00 4.32 H new ATOM 0 HE ARG A 94 -0.909 12.202 -2.031 1.00 65.14 H new ATOM 0 HH11 ARG A 94 -1.862 12.429 -5.434 1.00 73.22 H new ATOM 0 HH12 ARG A 94 -1.723 14.190 -5.465 1.00 73.22 H new ATOM 0 HH21 ARG A 94 -0.719 14.449 -2.102 1.00 60.55 H new ATOM 0 HH22 ARG A 94 -1.081 15.324 -3.594 1.00 60.55 H new ATOM 1410 N ASP A 95 -2.206 6.842 -0.979 1.00 73.12 N ATOM 1411 CA ASP A 95 -1.879 5.435 -1.314 1.00 13.03 C ATOM 1412 C ASP A 95 -0.611 5.354 -2.171 1.00 41.24 C ATOM 1413 O ASP A 95 0.302 4.561 -1.894 1.00 51.44 O ATOM 1414 CB ASP A 95 -3.067 4.825 -2.121 1.00 34.41 C ATOM 1415 CG ASP A 95 -3.271 5.491 -3.500 1.00 31.34 C ATOM 1416 OD1 ASP A 95 -3.263 6.757 -3.569 1.00 20.30 O ATOM 1417 OD2 ASP A 95 -3.369 4.798 -4.514 1.00 12.43 O ATOM 0 H ASP A 95 -3.162 7.092 -1.233 1.00 73.12 H new ATOM 0 HA ASP A 95 -1.711 4.885 -0.388 1.00 13.03 H new ATOM 0 HB2 ASP A 95 -2.892 3.758 -2.262 1.00 34.41 H new ATOM 0 HB3 ASP A 95 -3.983 4.924 -1.538 1.00 34.41 H new ATOM 1422 N THR A 96 -0.549 6.216 -3.155 1.00 43.22 N ATOM 1423 CA THR A 96 0.532 6.296 -4.068 1.00 3.44 C ATOM 1424 C THR A 96 1.815 6.680 -3.336 1.00 64.41 C ATOM 1425 O THR A 96 2.864 6.092 -3.559 1.00 3.11 O ATOM 1426 CB THR A 96 0.205 7.332 -5.142 1.00 52.02 C ATOM 1427 OG1 THR A 96 -1.083 7.021 -5.730 1.00 4.53 O ATOM 1428 CG2 THR A 96 1.275 7.342 -6.218 1.00 12.41 C ATOM 0 H THR A 96 -1.283 6.900 -3.337 1.00 43.22 H new ATOM 0 HA THR A 96 0.684 5.324 -4.537 1.00 3.44 H new ATOM 0 HB THR A 96 0.171 8.320 -4.683 1.00 52.02 H new ATOM 0 HG1 THR A 96 -1.583 7.850 -5.880 1.00 4.53 H new ATOM 0 HG21 THR A 96 1.024 8.086 -6.974 1.00 12.41 H new ATOM 0 HG22 THR A 96 2.238 7.589 -5.771 1.00 12.41 H new ATOM 0 HG23 THR A 96 1.333 6.358 -6.683 1.00 12.41 H new ATOM 1436 N GLU A 97 1.698 7.626 -2.419 1.00 11.52 N ATOM 1437 CA GLU A 97 2.833 8.124 -1.677 1.00 13.44 C ATOM 1438 C GLU A 97 3.405 7.030 -0.794 1.00 2.14 C ATOM 1439 O GLU A 97 4.620 6.851 -0.742 1.00 32.05 O ATOM 1440 CB GLU A 97 2.453 9.371 -0.861 1.00 34.52 C ATOM 1441 CG GLU A 97 2.129 10.595 -1.722 1.00 42.13 C ATOM 1442 CD GLU A 97 1.535 11.753 -0.932 1.00 44.22 C ATOM 1443 OE1 GLU A 97 0.312 11.765 -0.711 1.00 62.42 O ATOM 1444 OE2 GLU A 97 2.271 12.673 -0.547 1.00 52.54 O ATOM 0 H GLU A 97 0.812 8.067 -2.172 1.00 11.52 H new ATOM 0 HA GLU A 97 3.607 8.424 -2.383 1.00 13.44 H new ATOM 0 HB2 GLU A 97 1.590 9.137 -0.238 1.00 34.52 H new ATOM 0 HB3 GLU A 97 3.274 9.618 -0.188 1.00 34.52 H new ATOM 0 HG2 GLU A 97 3.040 10.932 -2.217 1.00 42.13 H new ATOM 0 HG3 GLU A 97 1.430 10.303 -2.506 1.00 42.13 H new ATOM 1451 N ILE A 98 2.518 6.237 -0.185 1.00 41.45 N ATOM 1452 CA ILE A 98 2.935 5.160 0.726 1.00 52.32 C ATOM 1453 C ILE A 98 3.791 4.150 -0.034 1.00 63.25 C ATOM 1454 O ILE A 98 4.890 3.781 0.389 1.00 23.42 O ATOM 1455 CB ILE A 98 1.724 4.346 1.291 1.00 34.42 C ATOM 1456 CG1 ILE A 98 0.591 5.229 1.812 1.00 74.41 C ATOM 1457 CG2 ILE A 98 2.181 3.405 2.385 1.00 12.22 C ATOM 1458 CD1 ILE A 98 1.003 6.265 2.813 1.00 30.31 C ATOM 0 H ILE A 98 1.508 6.318 -0.304 1.00 41.45 H new ATOM 0 HA ILE A 98 3.471 5.645 1.542 1.00 52.32 H new ATOM 0 HB ILE A 98 1.325 3.777 0.452 1.00 34.42 H new ATOM 0 HG12 ILE A 98 0.123 5.730 0.965 1.00 74.41 H new ATOM 0 HG13 ILE A 98 -0.168 4.591 2.264 1.00 74.41 H new ATOM 0 HG21 ILE A 98 1.326 2.847 2.766 1.00 12.22 H new ATOM 0 HG22 ILE A 98 2.918 2.710 1.983 1.00 12.22 H new ATOM 0 HG23 ILE A 98 2.630 3.980 3.195 1.00 12.22 H new ATOM 0 HD11 ILE A 98 0.130 6.840 3.122 1.00 30.31 H new ATOM 0 HD12 ILE A 98 1.442 5.776 3.683 1.00 30.31 H new ATOM 0 HD13 ILE A 98 1.737 6.934 2.363 1.00 30.31 H new ATOM 1470 N MET A 99 3.295 3.749 -1.186 1.00 74.45 N ATOM 1471 CA MET A 99 3.951 2.731 -1.967 1.00 24.35 C ATOM 1472 C MET A 99 5.198 3.219 -2.671 1.00 24.23 C ATOM 1473 O MET A 99 6.007 2.401 -3.106 1.00 74.41 O ATOM 1474 CB MET A 99 2.994 2.060 -2.934 1.00 15.20 C ATOM 1475 CG MET A 99 1.809 1.446 -2.237 1.00 50.44 C ATOM 1476 SD MET A 99 0.803 0.425 -3.313 1.00 4.42 S ATOM 1477 CE MET A 99 -0.579 0.106 -2.219 1.00 12.42 C ATOM 0 H MET A 99 2.438 4.116 -1.600 1.00 74.45 H new ATOM 0 HA MET A 99 4.286 1.981 -1.250 1.00 24.35 H new ATOM 0 HB2 MET A 99 2.644 2.792 -3.662 1.00 15.20 H new ATOM 0 HB3 MET A 99 3.526 1.287 -3.489 1.00 15.20 H new ATOM 0 HG2 MET A 99 2.161 0.843 -1.400 1.00 50.44 H new ATOM 0 HG3 MET A 99 1.191 2.240 -1.819 1.00 50.44 H new ATOM 0 HE1 MET A 99 -1.512 0.203 -2.774 1.00 12.42 H new ATOM 0 HE2 MET A 99 -0.499 -0.904 -1.817 1.00 12.42 H new ATOM 0 HE3 MET A 99 -0.568 0.825 -1.400 1.00 12.42 H new ATOM 1487 N ARG A 100 5.367 4.545 -2.773 1.00 31.14 N ATOM 1488 CA ARG A 100 6.562 5.112 -3.416 1.00 32.02 C ATOM 1489 C ARG A 100 7.827 4.597 -2.762 1.00 72.25 C ATOM 1490 O ARG A 100 8.596 3.859 -3.370 1.00 5.04 O ATOM 1491 CB ARG A 100 6.567 6.642 -3.384 1.00 20.13 C ATOM 1492 CG ARG A 100 5.553 7.304 -4.282 1.00 5.44 C ATOM 1493 CD ARG A 100 5.675 8.811 -4.202 1.00 62.41 C ATOM 1494 NE ARG A 100 4.773 9.493 -5.140 1.00 21.12 N ATOM 1495 CZ ARG A 100 4.985 10.728 -5.627 1.00 5.13 C ATOM 1496 NH1 ARG A 100 6.016 11.444 -5.197 1.00 50.02 N ATOM 1497 NH2 ARG A 100 4.147 11.246 -6.511 1.00 71.21 N ATOM 0 H ARG A 100 4.703 5.236 -2.425 1.00 31.14 H new ATOM 0 HA ARG A 100 6.531 4.791 -4.457 1.00 32.02 H new ATOM 0 HB2 ARG A 100 6.390 6.969 -2.359 1.00 20.13 H new ATOM 0 HB3 ARG A 100 7.561 6.993 -3.664 1.00 20.13 H new ATOM 0 HG2 ARG A 100 5.701 6.976 -5.311 1.00 5.44 H new ATOM 0 HG3 ARG A 100 4.548 6.999 -3.991 1.00 5.44 H new ATOM 0 HD2 ARG A 100 5.454 9.138 -3.186 1.00 62.41 H new ATOM 0 HD3 ARG A 100 6.704 9.102 -4.414 1.00 62.41 H new ATOM 0 HE ARG A 100 3.933 8.998 -5.441 1.00 21.12 H new ATOM 0 HH11 ARG A 100 6.649 11.057 -4.496 1.00 50.02 H new ATOM 0 HH12 ARG A 100 6.176 12.381 -5.567 1.00 50.02 H new ATOM 0 HH21 ARG A 100 3.339 10.708 -6.824 1.00 71.21 H new ATOM 0 HH22 ARG A 100 4.309 12.183 -6.879 1.00 71.21 H new ATOM 1511 N TRP A 101 8.016 4.952 -1.521 1.00 1.14 N ATOM 1512 CA TRP A 101 9.187 4.537 -0.779 1.00 13.10 C ATOM 1513 C TRP A 101 9.197 3.034 -0.482 1.00 54.13 C ATOM 1514 O TRP A 101 10.246 2.426 -0.445 1.00 11.21 O ATOM 1515 CB TRP A 101 9.419 5.410 0.472 1.00 43.45 C ATOM 1516 CG TRP A 101 8.193 5.662 1.299 1.00 14.42 C ATOM 1517 CD1 TRP A 101 7.381 6.759 1.234 1.00 23.52 C ATOM 1518 CD2 TRP A 101 7.641 4.814 2.307 1.00 44.31 C ATOM 1519 NE1 TRP A 101 6.363 6.642 2.136 1.00 43.34 N ATOM 1520 CE2 TRP A 101 6.499 5.456 2.810 1.00 72.34 C ATOM 1521 CE3 TRP A 101 7.999 3.578 2.833 1.00 11.42 C ATOM 1522 CZ2 TRP A 101 5.719 4.899 3.807 1.00 33.12 C ATOM 1523 CZ3 TRP A 101 7.220 3.029 3.818 1.00 10.53 C ATOM 1524 CH2 TRP A 101 6.093 3.687 4.300 1.00 54.15 C ATOM 0 H TRP A 101 7.368 5.535 -0.992 1.00 1.14 H new ATOM 0 HA TRP A 101 10.047 4.706 -1.427 1.00 13.10 H new ATOM 0 HB2 TRP A 101 10.171 4.930 1.099 1.00 43.45 H new ATOM 0 HB3 TRP A 101 9.831 6.369 0.157 1.00 43.45 H new ATOM 0 HD1 TRP A 101 7.524 7.596 0.567 1.00 23.52 H new ATOM 0 HE1 TRP A 101 5.621 7.326 2.284 1.00 43.34 H new ATOM 0 HE3 TRP A 101 8.875 3.060 2.472 1.00 11.42 H new ATOM 0 HZ2 TRP A 101 4.843 5.408 4.181 1.00 33.12 H new ATOM 0 HZ3 TRP A 101 7.486 2.066 4.228 1.00 10.53 H new ATOM 0 HH2 TRP A 101 5.504 3.227 5.080 1.00 54.15 H new ATOM 1535 N LEU A 102 8.016 2.445 -0.302 1.00 71.34 N ATOM 1536 CA LEU A 102 7.898 1.009 0.001 1.00 32.03 C ATOM 1537 C LEU A 102 8.439 0.104 -1.109 1.00 35.13 C ATOM 1538 O LEU A 102 9.101 -0.903 -0.826 1.00 62.00 O ATOM 1539 CB LEU A 102 6.438 0.635 0.290 1.00 31.14 C ATOM 1540 CG LEU A 102 5.910 0.795 1.708 1.00 65.01 C ATOM 1541 CD1 LEU A 102 4.424 0.518 1.733 1.00 65.31 C ATOM 1542 CD2 LEU A 102 6.616 -0.161 2.649 1.00 65.52 C ATOM 0 H LEU A 102 7.123 2.935 -0.360 1.00 71.34 H new ATOM 0 HA LEU A 102 8.514 0.842 0.884 1.00 32.03 H new ATOM 0 HB2 LEU A 102 5.807 1.234 -0.367 1.00 31.14 H new ATOM 0 HB3 LEU A 102 6.300 -0.407 0.002 1.00 31.14 H new ATOM 0 HG LEU A 102 6.099 1.817 2.036 1.00 65.01 H new ATOM 0 HD11 LEU A 102 4.049 0.634 2.750 1.00 65.31 H new ATOM 0 HD12 LEU A 102 3.912 1.221 1.076 1.00 65.31 H new ATOM 0 HD13 LEU A 102 4.238 -0.500 1.391 1.00 65.31 H new ATOM 0 HD21 LEU A 102 6.226 -0.033 3.659 1.00 65.52 H new ATOM 0 HD22 LEU A 102 6.445 -1.187 2.322 1.00 65.52 H new ATOM 0 HD23 LEU A 102 7.686 0.048 2.644 1.00 65.52 H new ATOM 1554 N PHE A 103 8.173 0.451 -2.349 1.00 13.32 N ATOM 1555 CA PHE A 103 8.593 -0.387 -3.465 1.00 71.24 C ATOM 1556 C PHE A 103 9.935 0.017 -4.018 1.00 61.22 C ATOM 1557 O PHE A 103 10.578 -0.752 -4.743 1.00 73.11 O ATOM 1558 CB PHE A 103 7.536 -0.419 -4.569 1.00 73.41 C ATOM 1559 CG PHE A 103 6.310 -1.220 -4.221 1.00 25.51 C ATOM 1560 CD1 PHE A 103 5.333 -0.708 -3.385 1.00 42.05 C ATOM 1561 CD2 PHE A 103 6.140 -2.491 -4.738 1.00 60.23 C ATOM 1562 CE1 PHE A 103 4.212 -1.447 -3.076 1.00 61.32 C ATOM 1563 CE2 PHE A 103 5.019 -3.231 -4.434 1.00 65.52 C ATOM 1564 CZ PHE A 103 4.055 -2.707 -3.603 1.00 54.20 C ATOM 0 H PHE A 103 7.673 1.299 -2.615 1.00 13.32 H new ATOM 0 HA PHE A 103 8.702 -1.396 -3.068 1.00 71.24 H new ATOM 0 HB2 PHE A 103 7.236 0.603 -4.800 1.00 73.41 H new ATOM 0 HB3 PHE A 103 7.983 -0.832 -5.473 1.00 73.41 H new ATOM 0 HD1 PHE A 103 5.451 0.282 -2.970 1.00 42.05 H new ATOM 0 HD2 PHE A 103 6.895 -2.908 -5.388 1.00 60.23 H new ATOM 0 HE1 PHE A 103 3.458 -1.037 -2.421 1.00 61.32 H new ATOM 0 HE2 PHE A 103 4.896 -4.221 -4.847 1.00 65.52 H new ATOM 0 HZ PHE A 103 3.175 -3.286 -3.365 1.00 54.20 H new ATOM 1574 N THR A 104 10.368 1.190 -3.679 1.00 11.03 N ATOM 1575 CA THR A 104 11.634 1.670 -4.147 1.00 23.31 C ATOM 1576 C THR A 104 12.739 1.208 -3.186 1.00 75.31 C ATOM 1577 O THR A 104 12.629 1.411 -1.982 1.00 13.41 O ATOM 1578 CB THR A 104 11.610 3.209 -4.284 1.00 74.15 C ATOM 1579 OG1 THR A 104 10.514 3.577 -5.156 1.00 63.01 O ATOM 1580 CG2 THR A 104 12.912 3.737 -4.874 1.00 3.32 C ATOM 0 H THR A 104 9.861 1.838 -3.076 1.00 11.03 H new ATOM 0 HA THR A 104 11.840 1.258 -5.135 1.00 23.31 H new ATOM 0 HB THR A 104 11.485 3.644 -3.292 1.00 74.15 H new ATOM 0 HG1 THR A 104 9.746 3.857 -4.616 1.00 63.01 H new ATOM 0 HG21 THR A 104 12.860 4.823 -4.956 1.00 3.32 H new ATOM 0 HG22 THR A 104 13.744 3.461 -4.225 1.00 3.32 H new ATOM 0 HG23 THR A 104 13.065 3.305 -5.863 1.00 3.32 H new ATOM 1588 N PRO A 105 13.768 0.500 -3.703 1.00 64.44 N ATOM 1589 CA PRO A 105 14.899 0.030 -2.891 1.00 30.41 C ATOM 1590 C PRO A 105 15.560 1.169 -2.121 1.00 50.21 C ATOM 1591 O PRO A 105 15.893 2.219 -2.705 1.00 50.35 O ATOM 1592 CB PRO A 105 15.871 -0.511 -3.941 1.00 61.54 C ATOM 1593 CG PRO A 105 15.004 -0.929 -5.067 1.00 31.43 C ATOM 1594 CD PRO A 105 13.903 0.084 -5.115 1.00 11.11 C ATOM 0 HA PRO A 105 14.593 -0.699 -2.140 1.00 30.41 H new ATOM 0 HB2 PRO A 105 16.585 0.252 -4.252 1.00 61.54 H new ATOM 0 HB3 PRO A 105 16.449 -1.349 -3.552 1.00 61.54 H new ATOM 0 HG2 PRO A 105 15.560 -0.950 -6.004 1.00 31.43 H new ATOM 0 HG3 PRO A 105 14.609 -1.932 -4.908 1.00 31.43 H new ATOM 0 HD2 PRO A 105 14.157 0.925 -5.760 1.00 11.11 H new ATOM 0 HD3 PRO A 105 12.977 -0.345 -5.499 1.00 11.11 H new ATOM 1602 N ASP A 106 15.744 0.975 -0.836 1.00 32.24 N ATOM 1603 CA ASP A 106 16.384 1.982 -0.007 1.00 71.54 C ATOM 1604 C ASP A 106 17.883 1.868 -0.196 1.00 23.13 C ATOM 1605 O ASP A 106 18.451 0.779 -0.031 1.00 73.34 O ATOM 1606 CB ASP A 106 16.032 1.790 1.472 1.00 22.35 C ATOM 1607 CG ASP A 106 16.642 2.857 2.391 1.00 55.14 C ATOM 1608 OD1 ASP A 106 17.874 2.868 2.586 1.00 30.41 O ATOM 1609 OD2 ASP A 106 15.890 3.692 2.955 1.00 24.13 O ATOM 0 H ASP A 106 15.461 0.131 -0.338 1.00 32.24 H new ATOM 0 HA ASP A 106 16.031 2.969 -0.305 1.00 71.54 H new ATOM 0 HB2 ASP A 106 14.948 1.803 1.584 1.00 22.35 H new ATOM 0 HB3 ASP A 106 16.374 0.806 1.794 1.00 22.35 H new ATOM 1614 N PRO A 107 18.552 2.973 -0.547 1.00 74.15 N ATOM 1615 CA PRO A 107 19.988 2.980 -0.832 1.00 61.45 C ATOM 1616 C PRO A 107 20.872 2.539 0.347 1.00 71.14 C ATOM 1617 O PRO A 107 22.017 2.128 0.148 1.00 12.00 O ATOM 1618 CB PRO A 107 20.284 4.440 -1.208 1.00 41.31 C ATOM 1619 CG PRO A 107 19.154 5.223 -0.641 1.00 74.24 C ATOM 1620 CD PRO A 107 17.960 4.321 -0.693 1.00 64.21 C ATOM 0 HA PRO A 107 20.222 2.259 -1.616 1.00 61.45 H new ATOM 0 HB2 PRO A 107 21.238 4.768 -0.794 1.00 41.31 H new ATOM 0 HB3 PRO A 107 20.346 4.564 -2.289 1.00 41.31 H new ATOM 0 HG2 PRO A 107 19.367 5.530 0.383 1.00 74.24 H new ATOM 0 HG3 PRO A 107 18.982 6.132 -1.217 1.00 74.24 H new ATOM 0 HD2 PRO A 107 17.254 4.540 0.108 1.00 64.21 H new ATOM 0 HD3 PRO A 107 17.418 4.424 -1.633 1.00 64.21 H new ATOM 1628 N SER A 108 20.356 2.601 1.552 1.00 4.13 N ATOM 1629 CA SER A 108 21.137 2.284 2.718 1.00 24.44 C ATOM 1630 C SER A 108 20.594 1.053 3.452 1.00 32.21 C ATOM 1631 O SER A 108 21.111 0.678 4.522 1.00 4.12 O ATOM 1632 CB SER A 108 21.132 3.491 3.645 1.00 71.33 C ATOM 1633 OG SER A 108 21.518 4.663 2.927 1.00 23.35 O ATOM 0 H SER A 108 19.392 2.870 1.748 1.00 4.13 H new ATOM 0 HA SER A 108 22.154 2.047 2.405 1.00 24.44 H new ATOM 0 HB2 SER A 108 20.138 3.627 4.072 1.00 71.33 H new ATOM 0 HB3 SER A 108 21.816 3.323 4.477 1.00 71.33 H new ATOM 0 HG SER A 108 21.510 5.434 3.531 1.00 23.35 H new ATOM 1639 N LEU A 109 19.591 0.409 2.897 1.00 51.34 N ATOM 1640 CA LEU A 109 18.990 -0.706 3.581 1.00 13.54 C ATOM 1641 C LEU A 109 19.446 -2.023 3.012 1.00 5.04 C ATOM 1642 O LEU A 109 19.241 -2.333 1.839 1.00 34.40 O ATOM 1643 CB LEU A 109 17.477 -0.634 3.559 1.00 15.33 C ATOM 1644 CG LEU A 109 16.746 -1.689 4.391 1.00 13.02 C ATOM 1645 CD1 LEU A 109 17.050 -1.537 5.879 1.00 23.40 C ATOM 1646 CD2 LEU A 109 15.266 -1.617 4.139 1.00 4.13 C ATOM 0 H LEU A 109 19.183 0.635 1.990 1.00 51.34 H new ATOM 0 HA LEU A 109 19.322 -0.643 4.617 1.00 13.54 H new ATOM 0 HB2 LEU A 109 17.174 0.352 3.911 1.00 15.33 H new ATOM 0 HB3 LEU A 109 17.143 -0.720 2.525 1.00 15.33 H new ATOM 0 HG LEU A 109 17.107 -2.670 4.082 1.00 13.02 H new ATOM 0 HD11 LEU A 109 16.514 -2.303 6.440 1.00 23.40 H new ATOM 0 HD12 LEU A 109 18.121 -1.649 6.045 1.00 23.40 H new ATOM 0 HD13 LEU A 109 16.732 -0.551 6.216 1.00 23.40 H new ATOM 0 HD21 LEU A 109 14.758 -2.373 4.737 1.00 4.13 H new ATOM 0 HD22 LEU A 109 14.898 -0.629 4.414 1.00 4.13 H new ATOM 0 HD23 LEU A 109 15.068 -1.797 3.082 1.00 4.13 H new ATOM 1658 N THR A 110 20.046 -2.779 3.851 1.00 54.21 N ATOM 1659 CA THR A 110 20.523 -4.083 3.536 1.00 0.23 C ATOM 1660 C THR A 110 19.809 -5.050 4.476 1.00 64.52 C ATOM 1661 O THR A 110 19.752 -4.808 5.689 1.00 75.44 O ATOM 1662 CB THR A 110 22.048 -4.147 3.773 1.00 61.23 C ATOM 1663 OG1 THR A 110 22.683 -3.040 3.096 1.00 33.23 O ATOM 1664 CG2 THR A 110 22.635 -5.457 3.254 1.00 12.44 C ATOM 0 H THR A 110 20.229 -2.502 4.815 1.00 54.21 H new ATOM 0 HA THR A 110 20.329 -4.336 2.494 1.00 0.23 H new ATOM 0 HB THR A 110 22.230 -4.091 4.846 1.00 61.23 H new ATOM 0 HG1 THR A 110 23.651 -3.077 3.246 1.00 33.23 H new ATOM 0 HG21 THR A 110 23.710 -5.471 3.436 1.00 12.44 H new ATOM 0 HG22 THR A 110 22.168 -6.295 3.772 1.00 12.44 H new ATOM 0 HG23 THR A 110 22.447 -5.541 2.184 1.00 12.44 H new ATOM 1672 N ILE A 111 19.260 -6.104 3.956 1.00 31.31 N ATOM 1673 CA ILE A 111 18.530 -7.029 4.788 1.00 22.24 C ATOM 1674 C ILE A 111 19.172 -8.374 4.837 1.00 61.33 C ATOM 1675 O ILE A 111 19.901 -8.763 3.930 1.00 51.00 O ATOM 1676 CB ILE A 111 17.039 -7.156 4.429 1.00 33.21 C ATOM 1677 CG1 ILE A 111 16.839 -7.346 2.922 1.00 53.02 C ATOM 1678 CG2 ILE A 111 16.292 -5.938 4.935 1.00 42.33 C ATOM 1679 CD1 ILE A 111 15.429 -7.744 2.529 1.00 11.10 C ATOM 0 H ILE A 111 19.299 -6.350 2.967 1.00 31.31 H new ATOM 0 HA ILE A 111 18.571 -6.589 5.784 1.00 22.24 H new ATOM 0 HB ILE A 111 16.636 -8.045 4.915 1.00 33.21 H new ATOM 0 HG12 ILE A 111 17.098 -6.418 2.412 1.00 53.02 H new ATOM 0 HG13 ILE A 111 17.532 -8.109 2.568 1.00 53.02 H new ATOM 0 HG21 ILE A 111 15.236 -6.027 4.681 1.00 42.33 H new ATOM 0 HG22 ILE A 111 16.400 -5.868 6.017 1.00 42.33 H new ATOM 0 HG23 ILE A 111 16.702 -5.041 4.471 1.00 42.33 H new ATOM 0 HD11 ILE A 111 15.372 -7.858 1.447 1.00 11.10 H new ATOM 0 HD12 ILE A 111 15.171 -8.688 3.008 1.00 11.10 H new ATOM 0 HD13 ILE A 111 14.730 -6.972 2.850 1.00 11.10 H new ATOM 1805 N VAL A 120 20.311 -8.924 1.056 1.00 4.12 N ATOM 1806 CA VAL A 120 19.971 -8.078 -0.059 1.00 71.23 C ATOM 1807 C VAL A 120 20.339 -6.655 0.249 1.00 4.41 C ATOM 1808 O VAL A 120 19.848 -6.071 1.219 1.00 13.25 O ATOM 1809 CB VAL A 120 18.450 -8.162 -0.427 1.00 0.23 C ATOM 1810 CG1 VAL A 120 18.121 -7.278 -1.629 1.00 51.41 C ATOM 1811 CG2 VAL A 120 18.031 -9.601 -0.707 1.00 63.43 C ATOM 0 HA VAL A 120 20.537 -8.433 -0.920 1.00 71.23 H new ATOM 0 HB VAL A 120 17.888 -7.798 0.433 1.00 0.23 H new ATOM 0 HG11 VAL A 120 17.059 -7.358 -1.860 1.00 51.41 H new ATOM 0 HG12 VAL A 120 18.365 -6.241 -1.396 1.00 51.41 H new ATOM 0 HG13 VAL A 120 18.705 -7.603 -2.490 1.00 51.41 H new ATOM 0 HG21 VAL A 120 16.971 -9.629 -0.960 1.00 63.43 H new ATOM 0 HG22 VAL A 120 18.613 -9.994 -1.541 1.00 63.43 H new ATOM 0 HG23 VAL A 120 18.209 -10.211 0.179 1.00 63.43 H new ATOM 1821 N SER A 121 21.217 -6.122 -0.538 1.00 22.43 N ATOM 1822 CA SER A 121 21.620 -4.753 -0.424 1.00 74.13 C ATOM 1823 C SER A 121 20.664 -3.938 -1.290 1.00 55.41 C ATOM 1824 O SER A 121 20.291 -4.399 -2.380 1.00 63.35 O ATOM 1825 CB SER A 121 23.057 -4.633 -0.917 1.00 12.34 C ATOM 1826 OG SER A 121 23.871 -5.637 -0.303 1.00 54.41 O ATOM 0 H SER A 121 21.682 -6.631 -1.290 1.00 22.43 H new ATOM 0 HA SER A 121 21.583 -4.390 0.603 1.00 74.13 H new ATOM 0 HB2 SER A 121 23.088 -4.741 -2.001 1.00 12.34 H new ATOM 0 HB3 SER A 121 23.449 -3.643 -0.684 1.00 12.34 H new ATOM 0 HG SER A 121 24.792 -5.554 -0.626 1.00 54.41 H new ATOM 1832 N ASN A 122 20.256 -2.764 -0.810 1.00 3.15 N ATOM 1833 CA ASN A 122 19.273 -1.918 -1.474 1.00 42.15 C ATOM 1834 C ASN A 122 17.948 -2.638 -1.539 1.00 54.43 C ATOM 1835 O ASN A 122 17.399 -2.896 -2.614 1.00 65.43 O ATOM 1836 CB ASN A 122 19.700 -1.433 -2.878 1.00 71.53 C ATOM 1837 CG ASN A 122 20.957 -0.589 -2.881 1.00 53.24 C ATOM 1838 OD1 ASN A 122 20.902 0.629 -2.704 1.00 41.45 O ATOM 1839 ND2 ASN A 122 22.089 -1.211 -3.136 1.00 43.31 N ATOM 0 H ASN A 122 20.606 -2.371 0.064 1.00 3.15 H new ATOM 0 HA ASN A 122 19.184 -1.014 -0.872 1.00 42.15 H new ATOM 0 HB2 ASN A 122 19.855 -2.301 -3.519 1.00 71.53 H new ATOM 0 HB3 ASN A 122 18.886 -0.855 -3.315 1.00 71.53 H new ATOM 0 HD21 ASN A 122 22.960 -0.683 -3.193 1.00 43.31 H new ATOM 0 HD22 ASN A 122 22.095 -2.221 -3.277 1.00 43.31 H new ATOM 1846 N ALA A 123 17.473 -3.039 -0.394 1.00 51.40 N ATOM 1847 CA ALA A 123 16.226 -3.715 -0.306 1.00 4.11 C ATOM 1848 C ALA A 123 15.092 -2.726 -0.241 1.00 54.42 C ATOM 1849 O ALA A 123 15.241 -1.631 0.314 1.00 40.23 O ATOM 1850 CB ALA A 123 16.214 -4.591 0.910 1.00 44.43 C ATOM 0 H ALA A 123 17.945 -2.903 0.500 1.00 51.40 H new ATOM 0 HA ALA A 123 16.095 -4.330 -1.196 1.00 4.11 H new ATOM 0 HB1 ALA A 123 15.257 -5.109 0.976 1.00 44.43 H new ATOM 0 HB2 ALA A 123 17.018 -5.323 0.839 1.00 44.43 H new ATOM 0 HB3 ALA A 123 16.358 -3.979 1.801 1.00 44.43 H new ATOM 1856 N ARG A 124 13.986 -3.074 -0.841 1.00 31.43 N ATOM 1857 CA ARG A 124 12.813 -2.257 -0.732 1.00 12.24 C ATOM 1858 C ARG A 124 12.206 -2.516 0.660 1.00 13.45 C ATOM 1859 O ARG A 124 12.226 -3.664 1.140 1.00 45.13 O ATOM 1860 CB ARG A 124 11.797 -2.584 -1.855 1.00 24.12 C ATOM 1861 CG ARG A 124 11.164 -3.955 -1.739 1.00 1.52 C ATOM 1862 CD ARG A 124 10.210 -4.275 -2.880 1.00 62.11 C ATOM 1863 NE ARG A 124 10.896 -4.433 -4.167 1.00 42.41 N ATOM 1864 CZ ARG A 124 11.232 -5.627 -4.717 1.00 63.44 C ATOM 1865 NH1 ARG A 124 11.154 -6.757 -4.001 1.00 32.01 N ATOM 1866 NH2 ARG A 124 11.696 -5.671 -5.958 1.00 63.22 N ATOM 0 H ARG A 124 13.875 -3.915 -1.408 1.00 31.43 H new ATOM 0 HA ARG A 124 13.070 -1.204 -0.846 1.00 12.24 H new ATOM 0 HB2 ARG A 124 11.009 -1.831 -1.848 1.00 24.12 H new ATOM 0 HB3 ARG A 124 12.301 -2.509 -2.819 1.00 24.12 H new ATOM 0 HG2 ARG A 124 11.950 -4.709 -1.709 1.00 1.52 H new ATOM 0 HG3 ARG A 124 10.624 -4.020 -0.794 1.00 1.52 H new ATOM 0 HD2 ARG A 124 9.667 -5.191 -2.648 1.00 62.11 H new ATOM 0 HD3 ARG A 124 9.470 -3.479 -2.963 1.00 62.11 H new ATOM 0 HE ARG A 124 11.137 -3.587 -4.684 1.00 42.41 H new ATOM 0 HH11 ARG A 124 10.839 -6.726 -3.031 1.00 32.01 H new ATOM 0 HH12 ARG A 124 11.409 -7.649 -4.426 1.00 32.01 H new ATOM 0 HH21 ARG A 124 11.799 -4.810 -6.495 1.00 63.22 H new ATOM 0 HH22 ARG A 124 11.950 -6.566 -6.376 1.00 63.22 H new ATOM 1880 N PRO A 125 11.721 -1.475 1.347 1.00 52.33 N ATOM 1881 CA PRO A 125 11.121 -1.597 2.689 1.00 13.10 C ATOM 1882 C PRO A 125 10.047 -2.709 2.812 1.00 1.12 C ATOM 1883 O PRO A 125 9.899 -3.305 3.880 1.00 20.50 O ATOM 1884 CB PRO A 125 10.516 -0.221 2.921 1.00 45.34 C ATOM 1885 CG PRO A 125 11.400 0.695 2.158 1.00 72.22 C ATOM 1886 CD PRO A 125 11.778 -0.058 0.914 1.00 24.43 C ATOM 0 HA PRO A 125 11.866 -1.892 3.428 1.00 13.10 H new ATOM 0 HB2 PRO A 125 9.487 -0.172 2.564 1.00 45.34 H new ATOM 0 HB3 PRO A 125 10.498 0.033 3.981 1.00 45.34 H new ATOM 0 HG2 PRO A 125 10.885 1.624 1.913 1.00 72.22 H new ATOM 0 HG3 PRO A 125 12.283 0.963 2.738 1.00 72.22 H new ATOM 0 HD2 PRO A 125 11.086 0.142 0.096 1.00 24.43 H new ATOM 0 HD3 PRO A 125 12.773 0.217 0.563 1.00 24.43 H new ATOM 1894 N VAL A 126 9.325 -3.001 1.724 1.00 72.22 N ATOM 1895 CA VAL A 126 8.309 -4.073 1.744 1.00 44.12 C ATOM 1896 C VAL A 126 8.956 -5.434 2.071 1.00 20.35 C ATOM 1897 O VAL A 126 8.461 -6.198 2.901 1.00 23.42 O ATOM 1898 CB VAL A 126 7.549 -4.189 0.391 1.00 61.21 C ATOM 1899 CG1 VAL A 126 6.549 -5.320 0.432 1.00 52.52 C ATOM 1900 CG2 VAL A 126 6.831 -2.908 0.057 1.00 11.53 C ATOM 0 H VAL A 126 9.419 -2.521 0.829 1.00 72.22 H new ATOM 0 HA VAL A 126 7.593 -3.805 2.521 1.00 44.12 H new ATOM 0 HB VAL A 126 8.292 -4.390 -0.380 1.00 61.21 H new ATOM 0 HG11 VAL A 126 6.030 -5.382 -0.525 1.00 52.52 H new ATOM 0 HG12 VAL A 126 7.069 -6.259 0.624 1.00 52.52 H new ATOM 0 HG13 VAL A 126 5.825 -5.137 1.226 1.00 52.52 H new ATOM 0 HG21 VAL A 126 6.310 -3.020 -0.894 1.00 11.53 H new ATOM 0 HG22 VAL A 126 6.110 -2.680 0.842 1.00 11.53 H new ATOM 0 HG23 VAL A 126 7.553 -2.095 -0.019 1.00 11.53 H new ATOM 1910 N ASP A 127 10.087 -5.692 1.462 1.00 23.13 N ATOM 1911 CA ASP A 127 10.803 -6.942 1.678 1.00 50.42 C ATOM 1912 C ASP A 127 11.393 -6.986 3.056 1.00 5.22 C ATOM 1913 O ASP A 127 11.489 -8.039 3.662 1.00 64.30 O ATOM 1914 CB ASP A 127 11.883 -7.177 0.617 1.00 43.34 C ATOM 1915 CG ASP A 127 11.324 -7.689 -0.692 1.00 73.24 C ATOM 1916 OD1 ASP A 127 10.613 -6.956 -1.391 1.00 72.14 O ATOM 1917 OD2 ASP A 127 11.604 -8.838 -1.057 1.00 22.52 O ATOM 0 H ASP A 127 10.540 -5.054 0.808 1.00 23.13 H new ATOM 0 HA ASP A 127 10.077 -7.750 1.585 1.00 50.42 H new ATOM 0 HB2 ASP A 127 12.417 -6.244 0.437 1.00 43.34 H new ATOM 0 HB3 ASP A 127 12.611 -7.893 1.000 1.00 43.34 H new ATOM 1922 N ALA A 128 11.749 -5.826 3.566 1.00 14.14 N ATOM 1923 CA ALA A 128 12.326 -5.712 4.885 1.00 10.24 C ATOM 1924 C ALA A 128 11.300 -6.023 5.972 1.00 11.44 C ATOM 1925 O ALA A 128 11.607 -6.719 6.936 1.00 31.33 O ATOM 1926 CB ALA A 128 12.926 -4.334 5.089 1.00 11.44 C ATOM 0 H ALA A 128 11.646 -4.937 3.077 1.00 14.14 H new ATOM 0 HA ALA A 128 13.124 -6.451 4.964 1.00 10.24 H new ATOM 0 HB1 ALA A 128 13.355 -4.269 6.089 1.00 11.44 H new ATOM 0 HB2 ALA A 128 13.706 -4.163 4.347 1.00 11.44 H new ATOM 0 HB3 ALA A 128 12.148 -3.578 4.978 1.00 11.44 H new ATOM 1932 N LEU A 129 10.077 -5.534 5.810 1.00 23.31 N ATOM 1933 CA LEU A 129 9.032 -5.775 6.803 1.00 61.24 C ATOM 1934 C LEU A 129 8.652 -7.249 6.849 1.00 52.43 C ATOM 1935 O LEU A 129 8.419 -7.805 7.922 1.00 43.45 O ATOM 1936 CB LEU A 129 7.813 -4.836 6.592 1.00 31.30 C ATOM 1937 CG LEU A 129 7.044 -4.961 5.276 1.00 20.03 C ATOM 1938 CD1 LEU A 129 5.999 -6.059 5.345 1.00 13.00 C ATOM 1939 CD2 LEU A 129 6.428 -3.635 4.868 1.00 30.52 C ATOM 0 H LEU A 129 9.784 -4.973 5.010 1.00 23.31 H new ATOM 0 HA LEU A 129 9.432 -5.527 7.786 1.00 61.24 H new ATOM 0 HB2 LEU A 129 7.112 -5.007 7.409 1.00 31.30 H new ATOM 0 HB3 LEU A 129 8.162 -3.807 6.681 1.00 31.30 H new ATOM 0 HG LEU A 129 7.761 -5.242 4.504 1.00 20.03 H new ATOM 0 HD11 LEU A 129 5.472 -6.120 4.393 1.00 13.00 H new ATOM 0 HD12 LEU A 129 6.486 -7.012 5.552 1.00 13.00 H new ATOM 0 HD13 LEU A 129 5.288 -5.835 6.140 1.00 13.00 H new ATOM 0 HD21 LEU A 129 5.889 -3.758 3.929 1.00 30.52 H new ATOM 0 HD22 LEU A 129 5.737 -3.301 5.642 1.00 30.52 H new ATOM 0 HD23 LEU A 129 7.215 -2.892 4.740 1.00 30.52 H new ATOM 1951 N HIS A 130 8.669 -7.889 5.682 1.00 53.10 N ATOM 1952 CA HIS A 130 8.350 -9.310 5.558 1.00 71.11 C ATOM 1953 C HIS A 130 9.501 -10.133 6.141 1.00 63.13 C ATOM 1954 O HIS A 130 9.324 -11.247 6.611 1.00 24.44 O ATOM 1955 CB HIS A 130 8.123 -9.664 4.067 1.00 51.00 C ATOM 1956 CG HIS A 130 7.623 -11.069 3.811 1.00 41.30 C ATOM 1957 ND1 HIS A 130 8.373 -12.069 3.215 1.00 42.41 N ATOM 1958 CD2 HIS A 130 6.405 -11.616 4.052 1.00 33.41 C ATOM 1959 CE1 HIS A 130 7.607 -13.157 3.115 1.00 3.33 C ATOM 1960 NE2 HIS A 130 6.401 -12.938 3.609 1.00 13.12 N ATOM 0 H HIS A 130 8.904 -7.439 4.797 1.00 53.10 H new ATOM 0 HA HIS A 130 7.437 -9.538 6.108 1.00 71.11 H new ATOM 0 HB2 HIS A 130 7.407 -8.958 3.647 1.00 51.00 H new ATOM 0 HB3 HIS A 130 9.061 -9.525 3.529 1.00 51.00 H new ATOM 0 HD2 HIS A 130 5.571 -11.108 4.514 1.00 33.41 H new ATOM 0 HE1 HIS A 130 7.930 -14.094 2.686 1.00 3.33 H new ATOM 0 HE2 HIS A 130 5.626 -13.600 3.656 1.00 13.12 H new ATOM 1968 N ALA A 131 10.669 -9.532 6.147 1.00 63.52 N ATOM 1969 CA ALA A 131 11.881 -10.169 6.655 1.00 4.31 C ATOM 1970 C ALA A 131 12.119 -9.831 8.138 1.00 32.22 C ATOM 1971 O ALA A 131 13.251 -9.917 8.626 1.00 44.13 O ATOM 1972 CB ALA A 131 13.077 -9.755 5.811 1.00 33.31 C ATOM 0 H ALA A 131 10.815 -8.584 5.800 1.00 63.52 H new ATOM 0 HA ALA A 131 11.752 -11.249 6.584 1.00 4.31 H new ATOM 0 HB1 ALA A 131 13.977 -10.234 6.196 1.00 33.31 H new ATOM 0 HB2 ALA A 131 12.916 -10.062 4.777 1.00 33.31 H new ATOM 0 HB3 ALA A 131 13.195 -8.672 5.854 1.00 33.31 H new ATOM 1978 N HIS A 132 11.036 -9.430 8.828 1.00 21.40 N ATOM 1979 CA HIS A 132 11.014 -9.117 10.291 1.00 13.50 C ATOM 1980 C HIS A 132 11.919 -7.940 10.641 1.00 12.33 C ATOM 1981 O HIS A 132 12.356 -7.771 11.772 1.00 21.15 O ATOM 1982 CB HIS A 132 11.408 -10.350 11.138 1.00 23.31 C ATOM 1983 CG HIS A 132 10.503 -11.527 10.957 1.00 45.42 C ATOM 1984 ND1 HIS A 132 10.920 -12.751 10.486 1.00 65.13 N ATOM 1985 CD2 HIS A 132 9.177 -11.651 11.200 1.00 73.43 C ATOM 1986 CE1 HIS A 132 9.859 -13.559 10.449 1.00 12.40 C ATOM 1987 NE2 HIS A 132 8.773 -12.940 10.874 1.00 63.41 N ATOM 0 H HIS A 132 10.125 -9.308 8.385 1.00 21.40 H new ATOM 0 HA HIS A 132 9.988 -8.838 10.530 1.00 13.50 H new ATOM 0 HB2 HIS A 132 12.426 -10.644 10.881 1.00 23.31 H new ATOM 0 HB3 HIS A 132 11.414 -10.068 12.191 1.00 23.31 H new ATOM 0 HD2 HIS A 132 8.536 -10.872 11.586 1.00 73.43 H new ATOM 0 HE1 HIS A 132 9.885 -14.586 10.115 1.00 12.40 H new ATOM 0 HE2 HIS A 132 7.832 -13.328 10.948 1.00 63.41 H new ATOM 1995 N GLN A 133 12.106 -7.084 9.691 1.00 54.04 N ATOM 1996 CA GLN A 133 12.912 -5.899 9.835 1.00 20.00 C ATOM 1997 C GLN A 133 12.029 -4.676 9.703 1.00 32.41 C ATOM 1998 O GLN A 133 12.479 -3.563 9.416 1.00 52.03 O ATOM 1999 CB GLN A 133 14.075 -5.960 8.857 1.00 20.40 C ATOM 2000 CG GLN A 133 15.085 -7.012 9.298 1.00 31.23 C ATOM 2001 CD GLN A 133 16.001 -7.498 8.212 1.00 52.23 C ATOM 2002 OE1 GLN A 133 17.064 -6.938 7.963 1.00 65.11 O ATOM 2003 NE2 GLN A 133 15.629 -8.589 7.607 1.00 62.44 N ATOM 0 H GLN A 133 11.694 -7.185 8.763 1.00 54.04 H new ATOM 0 HA GLN A 133 13.363 -5.833 10.825 1.00 20.00 H new ATOM 0 HB2 GLN A 133 13.707 -6.196 7.859 1.00 20.40 H new ATOM 0 HB3 GLN A 133 14.559 -4.985 8.796 1.00 20.40 H new ATOM 0 HG2 GLN A 133 15.689 -6.600 10.106 1.00 31.23 H new ATOM 0 HG3 GLN A 133 14.545 -7.865 9.707 1.00 31.23 H new ATOM 0 HE21 GLN A 133 14.737 -9.024 7.843 1.00 62.44 H new ATOM 0 HE22 GLN A 133 16.229 -9.009 6.897 1.00 62.44 H new ATOM 2012 N ALA A 134 10.749 -4.922 9.992 1.00 54.42 N ATOM 2013 CA ALA A 134 9.664 -3.938 10.001 1.00 74.45 C ATOM 2014 C ALA A 134 10.000 -2.736 10.880 1.00 30.13 C ATOM 2015 O ALA A 134 9.516 -1.635 10.640 1.00 61.11 O ATOM 2016 CB ALA A 134 8.367 -4.587 10.454 1.00 32.21 C ATOM 0 H ALA A 134 10.426 -5.858 10.238 1.00 54.42 H new ATOM 0 HA ALA A 134 9.538 -3.572 8.982 1.00 74.45 H new ATOM 0 HB1 ALA A 134 7.570 -3.844 10.456 1.00 32.21 H new ATOM 0 HB2 ALA A 134 8.107 -5.396 9.772 1.00 32.21 H new ATOM 0 HB3 ALA A 134 8.492 -4.987 11.460 1.00 32.21 H new ATOM 2022 N ARG A 135 10.848 -2.961 11.887 1.00 42.32 N ATOM 2023 CA ARG A 135 11.296 -1.909 12.804 1.00 52.44 C ATOM 2024 C ARG A 135 11.898 -0.747 12.003 1.00 30.13 C ATOM 2025 O ARG A 135 11.518 0.415 12.198 1.00 34.40 O ATOM 2026 CB ARG A 135 12.378 -2.464 13.748 1.00 71.20 C ATOM 2027 CG ARG A 135 11.925 -3.596 14.661 1.00 33.15 C ATOM 2028 CD ARG A 135 10.943 -3.120 15.723 1.00 22.42 C ATOM 2029 NE ARG A 135 11.564 -2.189 16.666 1.00 3.42 N ATOM 2030 CZ ARG A 135 11.273 -2.084 17.969 1.00 20.21 C ATOM 2031 NH1 ARG A 135 10.360 -2.877 18.526 1.00 54.44 N ATOM 2032 NH2 ARG A 135 11.912 -1.195 18.713 1.00 15.25 N ATOM 0 H ARG A 135 11.244 -3.879 12.090 1.00 42.32 H new ATOM 0 HA ARG A 135 10.441 -1.561 13.383 1.00 52.44 H new ATOM 0 HB2 ARG A 135 13.216 -2.817 13.146 1.00 71.20 H new ATOM 0 HB3 ARG A 135 12.751 -1.648 14.366 1.00 71.20 H new ATOM 0 HG2 ARG A 135 11.459 -4.379 14.063 1.00 33.15 H new ATOM 0 HG3 ARG A 135 12.795 -4.040 15.145 1.00 33.15 H new ATOM 0 HD2 ARG A 135 10.094 -2.635 15.241 1.00 22.42 H new ATOM 0 HD3 ARG A 135 10.552 -3.980 16.267 1.00 22.42 H new ATOM 0 HE ARG A 135 12.282 -1.565 16.298 1.00 3.42 H new ATOM 0 HH11 ARG A 135 9.875 -3.573 17.959 1.00 54.44 H new ATOM 0 HH12 ARG A 135 10.146 -2.789 19.519 1.00 54.44 H new ATOM 0 HH21 ARG A 135 12.622 -0.595 18.293 1.00 15.25 H new ATOM 0 HH22 ARG A 135 11.695 -1.110 19.706 1.00 15.25 H new ATOM 2046 N GLU A 136 12.761 -1.076 11.051 1.00 54.55 N ATOM 2047 CA GLU A 136 13.397 -0.072 10.214 1.00 23.04 C ATOM 2048 C GLU A 136 12.422 0.528 9.236 1.00 62.25 C ATOM 2049 O GLU A 136 12.546 1.683 8.873 1.00 53.20 O ATOM 2050 CB GLU A 136 14.601 -0.643 9.471 1.00 42.54 C ATOM 2051 CG GLU A 136 15.789 -0.908 10.360 1.00 73.24 C ATOM 2052 CD GLU A 136 16.246 0.350 11.055 1.00 3.14 C ATOM 2053 OE1 GLU A 136 16.821 1.235 10.397 1.00 14.21 O ATOM 2054 OE2 GLU A 136 16.053 0.475 12.261 1.00 2.51 O ATOM 0 H GLU A 136 13.036 -2.035 10.840 1.00 54.55 H new ATOM 0 HA GLU A 136 13.748 0.718 10.878 1.00 23.04 H new ATOM 0 HB2 GLU A 136 14.309 -1.573 8.983 1.00 42.54 H new ATOM 0 HB3 GLU A 136 14.895 0.052 8.684 1.00 42.54 H new ATOM 0 HG2 GLU A 136 15.529 -1.662 11.103 1.00 73.24 H new ATOM 0 HG3 GLU A 136 16.607 -1.315 9.766 1.00 73.24 H new ATOM 2061 N VAL A 137 11.436 -0.247 8.848 1.00 73.10 N ATOM 2062 CA VAL A 137 10.431 0.195 7.897 1.00 72.40 C ATOM 2063 C VAL A 137 9.542 1.261 8.523 1.00 71.41 C ATOM 2064 O VAL A 137 9.326 2.319 7.934 1.00 43.44 O ATOM 2065 CB VAL A 137 9.580 -0.989 7.383 1.00 41.13 C ATOM 2066 CG1 VAL A 137 8.532 -0.528 6.373 1.00 45.23 C ATOM 2067 CG2 VAL A 137 10.486 -2.041 6.771 1.00 52.10 C ATOM 0 H VAL A 137 11.304 -1.202 9.180 1.00 73.10 H new ATOM 0 HA VAL A 137 10.948 0.627 7.040 1.00 72.40 H new ATOM 0 HB VAL A 137 9.047 -1.422 8.230 1.00 41.13 H new ATOM 0 HG11 VAL A 137 7.952 -1.386 6.033 1.00 45.23 H new ATOM 0 HG12 VAL A 137 7.867 0.196 6.844 1.00 45.23 H new ATOM 0 HG13 VAL A 137 9.028 -0.064 5.520 1.00 45.23 H new ATOM 0 HG21 VAL A 137 9.884 -2.874 6.410 1.00 52.10 H new ATOM 0 HG22 VAL A 137 11.039 -1.605 5.939 1.00 52.10 H new ATOM 0 HG23 VAL A 137 11.187 -2.400 7.524 1.00 52.10 H new ATOM 2077 N VAL A 138 9.068 0.996 9.732 1.00 65.23 N ATOM 2078 CA VAL A 138 8.243 1.960 10.453 1.00 50.41 C ATOM 2079 C VAL A 138 9.068 3.211 10.746 1.00 73.53 C ATOM 2080 O VAL A 138 8.607 4.324 10.556 1.00 4.33 O ATOM 2081 CB VAL A 138 7.667 1.378 11.779 1.00 43.23 C ATOM 2082 CG1 VAL A 138 6.810 2.417 12.504 1.00 21.22 C ATOM 2083 CG2 VAL A 138 6.846 0.124 11.507 1.00 32.12 C ATOM 0 H VAL A 138 9.239 0.125 10.235 1.00 65.23 H new ATOM 0 HA VAL A 138 7.392 2.208 9.819 1.00 50.41 H new ATOM 0 HB VAL A 138 8.508 1.113 12.419 1.00 43.23 H new ATOM 0 HG11 VAL A 138 6.419 1.987 13.426 1.00 21.22 H new ATOM 0 HG12 VAL A 138 7.419 3.290 12.740 1.00 21.22 H new ATOM 0 HG13 VAL A 138 5.980 2.716 11.863 1.00 21.22 H new ATOM 0 HG21 VAL A 138 6.454 -0.265 12.447 1.00 32.12 H new ATOM 0 HG22 VAL A 138 6.018 0.368 10.842 1.00 32.12 H new ATOM 0 HG23 VAL A 138 7.478 -0.630 11.038 1.00 32.12 H new ATOM 2093 N ARG A 139 10.307 2.998 11.158 1.00 11.01 N ATOM 2094 CA ARG A 139 11.255 4.075 11.457 1.00 64.21 C ATOM 2095 C ARG A 139 11.459 4.955 10.212 1.00 73.15 C ATOM 2096 O ARG A 139 11.436 6.186 10.282 1.00 23.11 O ATOM 2097 CB ARG A 139 12.586 3.441 11.857 1.00 62.30 C ATOM 2098 CG ARG A 139 13.685 4.403 12.262 1.00 2.12 C ATOM 2099 CD ARG A 139 14.968 3.632 12.504 1.00 61.45 C ATOM 2100 NE ARG A 139 16.049 4.471 13.018 1.00 70.34 N ATOM 2101 CZ ARG A 139 17.343 4.128 13.038 1.00 22.13 C ATOM 2102 NH1 ARG A 139 17.767 3.017 12.425 1.00 1.32 N ATOM 2103 NH2 ARG A 139 18.222 4.926 13.648 1.00 60.22 N ATOM 0 H ARG A 139 10.693 2.064 11.298 1.00 11.01 H new ATOM 0 HA ARG A 139 10.871 4.697 12.266 1.00 64.21 H new ATOM 0 HB2 ARG A 139 12.405 2.757 12.686 1.00 62.30 H new ATOM 0 HB3 ARG A 139 12.946 2.841 11.021 1.00 62.30 H new ATOM 0 HG2 ARG A 139 13.837 5.147 11.481 1.00 2.12 H new ATOM 0 HG3 ARG A 139 13.397 4.942 13.164 1.00 2.12 H new ATOM 0 HD2 ARG A 139 14.773 2.826 13.211 1.00 61.45 H new ATOM 0 HD3 ARG A 139 15.288 3.167 11.571 1.00 61.45 H new ATOM 0 HE ARG A 139 15.798 5.387 13.390 1.00 70.34 H new ATOM 0 HH11 ARG A 139 17.102 2.420 11.935 1.00 1.32 H new ATOM 0 HH12 ARG A 139 18.756 2.767 12.448 1.00 1.32 H new ATOM 0 HH21 ARG A 139 17.905 5.788 14.093 1.00 60.22 H new ATOM 0 HH22 ARG A 139 19.210 4.674 13.669 1.00 60.22 H new ATOM 2117 N ARG A 140 11.618 4.294 9.077 1.00 45.23 N ATOM 2118 CA ARG A 140 11.845 4.938 7.793 1.00 52.52 C ATOM 2119 C ARG A 140 10.611 5.751 7.414 1.00 12.22 C ATOM 2120 O ARG A 140 10.720 6.845 6.893 1.00 43.25 O ATOM 2121 CB ARG A 140 12.103 3.852 6.742 1.00 61.22 C ATOM 2122 CG ARG A 140 12.945 4.265 5.545 1.00 55.22 C ATOM 2123 CD ARG A 140 14.361 4.671 5.970 1.00 44.54 C ATOM 2124 NE ARG A 140 14.975 3.705 6.918 1.00 31.32 N ATOM 2125 CZ ARG A 140 16.090 2.986 6.695 1.00 44.41 C ATOM 2126 NH1 ARG A 140 16.629 2.925 5.480 1.00 31.11 N ATOM 2127 NH2 ARG A 140 16.643 2.282 7.693 1.00 32.24 N ATOM 0 H ARG A 140 11.592 3.276 9.021 1.00 45.23 H new ATOM 0 HA ARG A 140 12.705 5.605 7.848 1.00 52.52 H new ATOM 0 HB2 ARG A 140 12.593 3.010 7.232 1.00 61.22 H new ATOM 0 HB3 ARG A 140 11.141 3.493 6.377 1.00 61.22 H new ATOM 0 HG2 ARG A 140 12.999 3.440 4.835 1.00 55.22 H new ATOM 0 HG3 ARG A 140 12.465 5.098 5.031 1.00 55.22 H new ATOM 0 HD2 ARG A 140 14.991 4.755 5.085 1.00 44.54 H new ATOM 0 HD3 ARG A 140 14.328 5.657 6.433 1.00 44.54 H new ATOM 0 HE ARG A 140 14.510 3.576 7.817 1.00 31.32 H new ATOM 0 HH11 ARG A 140 16.197 3.427 4.704 1.00 31.11 H new ATOM 0 HH12 ARG A 140 17.475 2.376 5.324 1.00 31.11 H new ATOM 0 HH21 ARG A 140 16.218 2.292 8.620 1.00 32.24 H new ATOM 0 HH22 ARG A 140 17.488 1.737 7.525 1.00 32.24 H new ATOM 2141 N ALA A 141 9.445 5.199 7.724 1.00 32.12 N ATOM 2142 CA ALA A 141 8.165 5.825 7.461 1.00 73.45 C ATOM 2143 C ALA A 141 7.999 7.082 8.309 1.00 70.13 C ATOM 2144 O ALA A 141 7.571 8.131 7.808 1.00 30.42 O ATOM 2145 CB ALA A 141 7.053 4.832 7.753 1.00 54.42 C ATOM 0 H ALA A 141 9.366 4.287 8.173 1.00 32.12 H new ATOM 0 HA ALA A 141 8.117 6.120 6.413 1.00 73.45 H new ATOM 0 HB1 ALA A 141 6.088 5.299 7.557 1.00 54.42 H new ATOM 0 HB2 ALA A 141 7.170 3.957 7.114 1.00 54.42 H new ATOM 0 HB3 ALA A 141 7.103 4.527 8.798 1.00 54.42 H new ATOM 2151 N GLN A 142 8.364 6.976 9.585 1.00 60.41 N ATOM 2152 CA GLN A 142 8.291 8.101 10.524 1.00 34.40 C ATOM 2153 C GLN A 142 9.169 9.231 10.039 1.00 53.34 C ATOM 2154 O GLN A 142 8.723 10.364 9.898 1.00 42.32 O ATOM 2155 CB GLN A 142 8.776 7.681 11.907 1.00 41.13 C ATOM 2156 CG GLN A 142 7.983 6.569 12.552 1.00 72.44 C ATOM 2157 CD GLN A 142 8.616 6.105 13.842 1.00 65.21 C ATOM 2158 OE1 GLN A 142 9.835 6.171 14.012 1.00 24.32 O ATOM 2159 NE2 GLN A 142 7.818 5.650 14.752 1.00 30.45 N ATOM 0 H GLN A 142 8.718 6.113 9.999 1.00 60.41 H new ATOM 0 HA GLN A 142 7.251 8.423 10.583 1.00 34.40 H new ATOM 0 HB2 GLN A 142 9.817 7.367 11.830 1.00 41.13 H new ATOM 0 HB3 GLN A 142 8.753 8.551 12.563 1.00 41.13 H new ATOM 0 HG2 GLN A 142 6.968 6.913 12.748 1.00 72.44 H new ATOM 0 HG3 GLN A 142 7.907 5.729 11.862 1.00 72.44 H new ATOM 0 HE21 GLN A 142 6.814 5.610 14.576 1.00 30.45 H new ATOM 0 HE22 GLN A 142 8.192 5.331 15.646 1.00 30.45 H new ATOM 2168 N ALA A 143 10.399 8.879 9.718 1.00 61.12 N ATOM 2169 CA ALA A 143 11.409 9.817 9.266 1.00 12.31 C ATOM 2170 C ALA A 143 11.101 10.360 7.875 1.00 31.33 C ATOM 2171 O ALA A 143 11.693 11.347 7.442 1.00 51.14 O ATOM 2172 CB ALA A 143 12.781 9.157 9.281 1.00 13.45 C ATOM 0 H ALA A 143 10.731 7.916 9.765 1.00 61.12 H new ATOM 0 HA ALA A 143 11.406 10.661 9.955 1.00 12.31 H new ATOM 0 HB1 ALA A 143 13.532 9.870 8.940 1.00 13.45 H new ATOM 0 HB2 ALA A 143 13.019 8.836 10.295 1.00 13.45 H new ATOM 0 HB3 ALA A 143 12.776 8.291 8.619 1.00 13.45 H new ATOM 2178 N MET A 144 10.234 9.686 7.156 1.00 5.44 N ATOM 2179 CA MET A 144 9.864 10.111 5.820 1.00 23.22 C ATOM 2180 C MET A 144 8.797 11.193 5.894 1.00 72.43 C ATOM 2181 O MET A 144 8.836 12.173 5.153 1.00 2.44 O ATOM 2182 CB MET A 144 9.331 8.919 5.008 1.00 41.21 C ATOM 2183 CG MET A 144 9.113 9.207 3.529 1.00 22.11 C ATOM 2184 SD MET A 144 10.657 9.578 2.649 1.00 60.52 S ATOM 2185 CE MET A 144 11.563 8.036 2.864 1.00 12.13 C ATOM 0 H MET A 144 9.768 8.836 7.473 1.00 5.44 H new ATOM 0 HA MET A 144 10.750 10.510 5.326 1.00 23.22 H new ATOM 0 HB2 MET A 144 10.031 8.089 5.104 1.00 41.21 H new ATOM 0 HB3 MET A 144 8.387 8.592 5.444 1.00 41.21 H new ATOM 0 HG2 MET A 144 8.632 8.347 3.063 1.00 22.11 H new ATOM 0 HG3 MET A 144 8.429 10.049 3.425 1.00 22.11 H new ATOM 0 HE1 MET A 144 12.072 7.781 1.935 1.00 12.13 H new ATOM 0 HE2 MET A 144 12.298 8.154 3.660 1.00 12.13 H new ATOM 0 HE3 MET A 144 10.868 7.239 3.127 1.00 12.13 H new ATOM 2195 N ALA A 145 7.861 11.011 6.801 1.00 10.52 N ATOM 2196 CA ALA A 145 6.742 11.924 6.948 1.00 54.32 C ATOM 2197 C ALA A 145 7.092 13.105 7.845 1.00 33.44 C ATOM 2198 O ALA A 145 6.853 14.272 7.494 1.00 61.23 O ATOM 2199 CB ALA A 145 5.541 11.181 7.507 1.00 42.50 C ATOM 0 H ALA A 145 7.852 10.229 7.456 1.00 10.52 H new ATOM 0 HA ALA A 145 6.500 12.320 5.962 1.00 54.32 H new ATOM 0 HB1 ALA A 145 4.704 11.871 7.615 1.00 42.50 H new ATOM 0 HB2 ALA A 145 5.262 10.376 6.827 1.00 42.50 H new ATOM 0 HB3 ALA A 145 5.794 10.762 8.481 1.00 42.50 H new ATOM 2205 N TYR A 146 7.659 12.812 8.983 1.00 13.23 N ATOM 2206 CA TYR A 146 7.993 13.816 9.951 1.00 44.31 C ATOM 2207 C TYR A 146 9.478 13.856 10.142 1.00 12.52 C ATOM 2208 O TYR A 146 10.130 14.721 9.514 1.00 38.13 O ATOM 2209 CB TYR A 146 7.264 13.575 11.286 1.00 64.42 C ATOM 2210 CG TYR A 146 5.765 13.780 11.205 1.00 5.23 C ATOM 2211 CD1 TYR A 146 4.908 12.739 10.871 1.00 44.44 C ATOM 2212 CD2 TYR A 146 5.214 15.028 11.448 1.00 71.30 C ATOM 2213 CE1 TYR A 146 3.545 12.940 10.781 1.00 25.33 C ATOM 2214 CE2 TYR A 146 3.856 15.235 11.366 1.00 63.32 C ATOM 2215 CZ TYR A 146 3.024 14.193 11.033 1.00 12.31 C ATOM 2216 OH TYR A 146 1.667 14.410 10.936 1.00 3.11 O ATOM 2217 OXT TYR A 146 10.014 13.016 10.879 1.00 38.13 O ATOM 0 H TYR A 146 7.903 11.863 9.265 1.00 13.23 H new ATOM 0 HA TYR A 146 7.660 14.785 9.578 1.00 44.31 H new ATOM 0 HB2 TYR A 146 7.465 12.558 11.622 1.00 64.42 H new ATOM 0 HB3 TYR A 146 7.674 14.247 12.040 1.00 64.42 H new ATOM 0 HD1 TYR A 146 5.314 11.757 10.679 1.00 44.44 H new ATOM 0 HD2 TYR A 146 5.862 15.853 11.706 1.00 71.30 H new ATOM 0 HE1 TYR A 146 2.891 12.123 10.515 1.00 25.33 H new ATOM 0 HE2 TYR A 146 3.445 16.214 11.563 1.00 63.32 H new ATOM 0 HH TYR A 146 1.187 13.584 11.156 1.00 3.11 H new