USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1029 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 131 HIS : no HE2:sc= -1.78 K(o=-3.8,f=-7) USER MOD Set 1.2: A 141 GLN : amide:sc= -0.881 K(o=-3.8,f=-8.8!) USER MOD Set 1.3: A 142 CYS SG : rot -110:sc= 1.35 USER MOD Set 1.4: A 143 CYS SG : rot 151:sc= -1.08 USER MOD Set 1.5: A 145 GLN :FLIP amide:sc= 0.648 F(o=-7.4,f=-3.8) USER MOD Set 1.6: A 153 CYS SG : rot -140:sc= -2.1! USER MOD Set 2.1: A 71 CYS SG : rot 13:sc= -1.83! USER MOD Set 2.2: A 127 MET CE :methyl -177:sc= -1.46 (180deg=-1.51) USER MOD Set 3.1: A 70 LYS NZ :NH3+ 145:sc= 0.72 (180deg=-0.0712) USER MOD Set 3.2: A 125 ASN : amide:sc= 0.462 K(o=1.2,f=-6.1!) USER MOD Single : A 15 THR OG1 : rot 37:sc= 0.759 USER MOD Single : A 23 LYS NZ :NH3+ -156:sc= -0.0113 (180deg=-0.321) USER MOD Single : A 25 SER OG : rot 175:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00645) USER MOD Single : A 44 THR OG1 : rot -23:sc= 1.16 USER MOD Single : A 45 LYS NZ :NH3+ 170:sc= 0.538 (180deg=0.369) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -162:sc= -0.135 (180deg=-0.632) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 165:sc= 0.427 (180deg=0.324) USER MOD Single : A 76 LYS NZ :NH3+ -176:sc= 0.315 (180deg=0.313) USER MOD Single : A 84 CYS SG : rot 125:sc= -3.22 USER MOD Single : A 85 GLN : amide:sc= 0.219 X(o=0.22,f=-0.26) USER MOD Single : A 86 ASN : amide:sc= -1.25 X(o=-1.3,f=-1.5) USER MOD Single : A 87 LYS NZ :NH3+ -119:sc= 0.265 (180deg=-0.189) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0.366 K(o=0.37,f=-0.29) USER MOD Single : A 94 HIS : no HD1:sc= -0.899 X(o=-0.9,f=-0.64) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 100 TYR OH : rot -30:sc= 0.915 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ -127:sc= -0.264 (180deg=-2.21!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -112:sc= 1.3 (180deg=0.326) USER MOD Single : A 121 LYS NZ :NH3+ 171:sc= -0.0213 (180deg=-0.14) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 123 ASN : amide:sc= -0.872 K(o=-0.87,f=-2.7!) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00671) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ -170:sc= 0.885 (180deg=0.748) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0.783 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot 70:sc= 0.607 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0113) USER MOD Single : A 156 TYR OH : rot -21:sc= 0.0314 USER MOD Single : A 157 ASN : amide:sc= 0 X(o=0,f=-0.071) USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -9.622 -1.823 14.530 1.00 50.35 N ATOM 230 CA THR A 15 -9.205 -1.656 13.134 1.00 34.53 C ATOM 231 C THR A 15 -10.063 -0.597 12.404 1.00 71.25 C ATOM 232 O THR A 15 -11.292 -0.560 12.550 1.00 11.33 O ATOM 233 CB THR A 15 -9.238 -3.033 12.366 1.00 54.41 C ATOM 234 OG1 THR A 15 -8.883 -2.868 10.980 1.00 14.42 O ATOM 235 CG2 THR A 15 -10.604 -3.733 12.464 1.00 34.14 C ATOM 0 HA THR A 15 -8.177 -1.295 13.143 1.00 34.53 H new ATOM 0 HB THR A 15 -8.499 -3.667 12.856 1.00 54.41 H new ATOM 0 HG1 THR A 15 -8.178 -2.191 10.901 1.00 14.42 H new ATOM 0 HG21 THR A 15 -10.570 -4.676 11.918 1.00 34.14 H new ATOM 0 HG22 THR A 15 -10.838 -3.928 13.510 1.00 34.14 H new ATOM 0 HG23 THR A 15 -11.373 -3.092 12.033 1.00 34.14 H new ATOM 243 N ILE A 16 -9.370 0.299 11.689 1.00 33.05 N ATOM 244 CA ILE A 16 -9.974 1.333 10.836 1.00 55.41 C ATOM 245 C ILE A 16 -10.695 0.666 9.655 1.00 15.44 C ATOM 246 O ILE A 16 -11.822 1.038 9.298 1.00 54.15 O ATOM 247 CB ILE A 16 -8.869 2.311 10.274 1.00 24.43 C ATOM 248 CG1 ILE A 16 -7.977 2.873 11.424 1.00 45.25 C ATOM 249 CG2 ILE A 16 -9.497 3.464 9.448 1.00 15.44 C ATOM 250 CD1 ILE A 16 -6.810 3.717 10.943 1.00 61.31 C ATOM 0 H ILE A 16 -8.350 0.326 11.687 1.00 33.05 H new ATOM 0 HA ILE A 16 -10.681 1.905 11.437 1.00 55.41 H new ATOM 0 HB ILE A 16 -8.232 1.733 9.604 1.00 24.43 H new ATOM 0 HG12 ILE A 16 -8.596 3.474 12.090 1.00 45.25 H new ATOM 0 HG13 ILE A 16 -7.592 2.040 12.012 1.00 45.25 H new ATOM 0 HG21 ILE A 16 -8.708 4.118 9.077 1.00 15.44 H new ATOM 0 HG22 ILE A 16 -10.050 3.049 8.606 1.00 15.44 H new ATOM 0 HG23 ILE A 16 -10.175 4.037 10.080 1.00 15.44 H new ATOM 0 HD11 ILE A 16 -6.238 4.070 11.801 1.00 61.31 H new ATOM 0 HD12 ILE A 16 -6.166 3.116 10.301 1.00 61.31 H new ATOM 0 HD13 ILE A 16 -7.186 4.572 10.381 1.00 61.31 H new ATOM 262 N LEU A 17 -10.018 -0.333 9.072 1.00 61.44 N ATOM 263 CA LEU A 17 -10.493 -1.047 7.891 1.00 64.34 C ATOM 264 C LEU A 17 -9.780 -2.402 7.809 1.00 50.50 C ATOM 265 O LEU A 17 -8.570 -2.485 8.063 1.00 1.11 O ATOM 266 CB LEU A 17 -10.226 -0.191 6.616 1.00 12.35 C ATOM 267 CG LEU A 17 -10.867 -0.691 5.279 1.00 53.31 C ATOM 268 CD1 LEU A 17 -12.397 -0.869 5.412 1.00 14.04 C ATOM 269 CD2 LEU A 17 -10.511 0.274 4.123 1.00 61.10 C ATOM 0 H LEU A 17 -9.117 -0.667 9.415 1.00 61.44 H new ATOM 0 HA LEU A 17 -11.567 -1.220 7.961 1.00 64.34 H new ATOM 0 HB2 LEU A 17 -10.584 0.821 6.806 1.00 12.35 H new ATOM 0 HB3 LEU A 17 -9.148 -0.126 6.471 1.00 12.35 H new ATOM 0 HG LEU A 17 -10.452 -1.673 5.050 1.00 53.31 H new ATOM 0 HD11 LEU A 17 -12.807 -1.217 4.464 1.00 14.04 H new ATOM 0 HD12 LEU A 17 -12.612 -1.601 6.191 1.00 14.04 H new ATOM 0 HD13 LEU A 17 -12.853 0.085 5.675 1.00 14.04 H new ATOM 0 HD21 LEU A 17 -10.963 -0.084 3.198 1.00 61.10 H new ATOM 0 HD22 LEU A 17 -10.891 1.270 4.350 1.00 61.10 H new ATOM 0 HD23 LEU A 17 -9.428 0.317 4.005 1.00 61.10 H new ATOM 281 N GLU A 18 -10.538 -3.448 7.465 1.00 52.43 N ATOM 282 CA GLU A 18 -10.043 -4.831 7.386 1.00 14.11 C ATOM 283 C GLU A 18 -10.648 -5.504 6.139 1.00 2.11 C ATOM 284 O GLU A 18 -11.865 -5.447 5.913 1.00 13.51 O ATOM 285 CB GLU A 18 -10.363 -5.606 8.710 1.00 42.34 C ATOM 286 CG GLU A 18 -11.864 -5.888 9.031 1.00 51.32 C ATOM 287 CD GLU A 18 -12.775 -4.637 9.051 1.00 0.14 C ATOM 288 OE1 GLU A 18 -12.690 -3.843 10.000 1.00 5.54 O ATOM 289 OE2 GLU A 18 -13.548 -4.423 8.094 1.00 24.42 O ATOM 0 H GLU A 18 -11.527 -3.359 7.230 1.00 52.43 H new ATOM 0 HA GLU A 18 -8.958 -4.841 7.282 1.00 14.11 H new ATOM 0 HB2 GLU A 18 -9.840 -6.562 8.676 1.00 42.34 H new ATOM 0 HB3 GLU A 18 -9.941 -5.042 9.541 1.00 42.34 H new ATOM 0 HG2 GLU A 18 -12.252 -6.590 8.293 1.00 51.32 H new ATOM 0 HG3 GLU A 18 -11.926 -6.380 10.002 1.00 51.32 H new ATOM 296 N GLU A 19 -9.797 -6.119 5.320 1.00 41.04 N ATOM 297 CA GLU A 19 -10.187 -6.614 3.993 1.00 13.14 C ATOM 298 C GLU A 19 -9.235 -7.723 3.555 1.00 65.44 C ATOM 299 O GLU A 19 -8.059 -7.726 3.944 1.00 32.33 O ATOM 300 CB GLU A 19 -10.160 -5.426 2.982 1.00 52.42 C ATOM 301 CG GLU A 19 -10.380 -5.769 1.490 1.00 75.20 C ATOM 302 CD GLU A 19 -11.793 -6.261 1.153 1.00 54.10 C ATOM 303 OE1 GLU A 19 -12.056 -7.481 1.222 1.00 11.31 O ATOM 304 OE2 GLU A 19 -12.647 -5.428 0.801 1.00 44.31 O ATOM 0 H GLU A 19 -8.819 -6.290 5.553 1.00 41.04 H new ATOM 0 HA GLU A 19 -11.195 -7.027 4.028 1.00 13.14 H new ATOM 0 HB2 GLU A 19 -10.925 -4.709 3.281 1.00 52.42 H new ATOM 0 HB3 GLU A 19 -9.197 -4.923 3.076 1.00 52.42 H new ATOM 0 HG2 GLU A 19 -10.164 -4.884 0.891 1.00 75.20 H new ATOM 0 HG3 GLU A 19 -9.662 -6.535 1.197 1.00 75.20 H new ATOM 311 N ILE A 20 -9.752 -8.663 2.753 1.00 1.44 N ATOM 312 CA ILE A 20 -8.951 -9.705 2.126 1.00 61.44 C ATOM 313 C ILE A 20 -8.266 -9.097 0.877 1.00 34.34 C ATOM 314 O ILE A 20 -8.865 -8.985 -0.197 1.00 32.21 O ATOM 315 CB ILE A 20 -9.838 -10.958 1.755 1.00 24.02 C ATOM 316 CG1 ILE A 20 -10.587 -11.509 3.014 1.00 64.25 C ATOM 317 CG2 ILE A 20 -8.995 -12.075 1.097 1.00 73.24 C ATOM 318 CD1 ILE A 20 -9.683 -12.064 4.104 1.00 15.11 C ATOM 0 H ILE A 20 -10.745 -8.716 2.524 1.00 1.44 H new ATOM 0 HA ILE A 20 -8.190 -10.063 2.820 1.00 61.44 H new ATOM 0 HB ILE A 20 -10.581 -10.626 1.029 1.00 24.02 H new ATOM 0 HG12 ILE A 20 -11.193 -10.708 3.438 1.00 64.25 H new ATOM 0 HG13 ILE A 20 -11.273 -12.294 2.696 1.00 64.25 H new ATOM 0 HG21 ILE A 20 -9.638 -12.921 0.855 1.00 73.24 H new ATOM 0 HG22 ILE A 20 -8.537 -11.695 0.184 1.00 73.24 H new ATOM 0 HG23 ILE A 20 -8.215 -12.397 1.787 1.00 73.24 H new ATOM 0 HD11 ILE A 20 -10.292 -12.422 4.934 1.00 15.11 H new ATOM 0 HD12 ILE A 20 -9.095 -12.890 3.703 1.00 15.11 H new ATOM 0 HD13 ILE A 20 -9.014 -11.279 4.456 1.00 15.11 H new ATOM 330 N LEU A 21 -7.033 -8.635 1.071 1.00 31.14 N ATOM 331 CA LEU A 21 -6.215 -8.006 0.020 1.00 43.01 C ATOM 332 C LEU A 21 -5.138 -8.992 -0.452 1.00 65.51 C ATOM 333 O LEU A 21 -4.897 -10.006 0.193 1.00 52.53 O ATOM 334 CB LEU A 21 -5.539 -6.738 0.584 1.00 21.44 C ATOM 335 CG LEU A 21 -6.464 -5.601 1.111 1.00 33.14 C ATOM 336 CD1 LEU A 21 -5.646 -4.537 1.866 1.00 44.42 C ATOM 337 CD2 LEU A 21 -7.258 -4.953 -0.032 1.00 65.11 C ATOM 0 H LEU A 21 -6.561 -8.685 1.974 1.00 31.14 H new ATOM 0 HA LEU A 21 -6.853 -7.735 -0.822 1.00 43.01 H new ATOM 0 HB2 LEU A 21 -4.882 -7.042 1.399 1.00 21.44 H new ATOM 0 HB3 LEU A 21 -4.904 -6.320 -0.197 1.00 21.44 H new ATOM 0 HG LEU A 21 -7.175 -6.049 1.805 1.00 33.14 H new ATOM 0 HD11 LEU A 21 -6.312 -3.753 2.225 1.00 44.42 H new ATOM 0 HD12 LEU A 21 -5.141 -5.000 2.714 1.00 44.42 H new ATOM 0 HD13 LEU A 21 -4.905 -4.104 1.194 1.00 44.42 H new ATOM 0 HD21 LEU A 21 -7.894 -4.164 0.369 1.00 65.11 H new ATOM 0 HD22 LEU A 21 -6.567 -4.528 -0.760 1.00 65.11 H new ATOM 0 HD23 LEU A 21 -7.878 -5.707 -0.517 1.00 65.11 H new ATOM 349 N ILE A 22 -4.463 -8.667 -1.556 1.00 62.33 N ATOM 350 CA ILE A 22 -3.402 -9.516 -2.117 1.00 42.24 C ATOM 351 C ILE A 22 -2.017 -8.960 -1.766 1.00 51.43 C ATOM 352 O ILE A 22 -1.671 -7.851 -2.154 1.00 61.31 O ATOM 353 CB ILE A 22 -3.555 -9.689 -3.670 1.00 53.23 C ATOM 354 CG1 ILE A 22 -4.888 -10.438 -3.975 1.00 44.30 C ATOM 355 CG2 ILE A 22 -2.333 -10.410 -4.299 1.00 55.41 C ATOM 356 CD1 ILE A 22 -5.071 -10.896 -5.402 1.00 52.13 C ATOM 0 H ILE A 22 -4.633 -7.813 -2.087 1.00 62.33 H new ATOM 0 HA ILE A 22 -3.502 -10.504 -1.667 1.00 42.24 H new ATOM 0 HB ILE A 22 -3.590 -8.701 -4.129 1.00 53.23 H new ATOM 0 HG12 ILE A 22 -4.951 -11.309 -3.323 1.00 44.30 H new ATOM 0 HG13 ILE A 22 -5.719 -9.783 -3.714 1.00 44.30 H new ATOM 0 HG21 ILE A 22 -2.482 -10.508 -5.374 1.00 55.41 H new ATOM 0 HG22 ILE A 22 -1.430 -9.829 -4.109 1.00 55.41 H new ATOM 0 HG23 ILE A 22 -2.227 -11.400 -3.856 1.00 55.41 H new ATOM 0 HD11 ILE A 22 -6.030 -11.404 -5.501 1.00 52.13 H new ATOM 0 HD12 ILE A 22 -5.047 -10.033 -6.067 1.00 52.13 H new ATOM 0 HD13 ILE A 22 -4.268 -11.582 -5.670 1.00 52.13 H new ATOM 368 N LYS A 23 -1.249 -9.758 -1.025 1.00 12.53 N ATOM 369 CA LYS A 23 0.123 -9.457 -0.640 1.00 32.23 C ATOM 370 C LYS A 23 1.103 -9.907 -1.739 1.00 32.24 C ATOM 371 O LYS A 23 0.981 -11.020 -2.274 1.00 21.42 O ATOM 372 CB LYS A 23 0.439 -10.196 0.683 1.00 63.32 C ATOM 373 CG LYS A 23 1.875 -9.998 1.212 1.00 41.44 C ATOM 374 CD LYS A 23 2.122 -10.801 2.505 1.00 55.25 C ATOM 375 CE LYS A 23 3.591 -10.785 2.945 1.00 32.01 C ATOM 376 NZ LYS A 23 3.807 -11.647 4.133 1.00 65.11 N ATOM 0 H LYS A 23 -1.576 -10.656 -0.668 1.00 12.53 H new ATOM 0 HA LYS A 23 0.235 -8.381 -0.504 1.00 32.23 H new ATOM 0 HB2 LYS A 23 -0.263 -9.860 1.446 1.00 63.32 H new ATOM 0 HB3 LYS A 23 0.265 -11.262 0.537 1.00 63.32 H new ATOM 0 HG2 LYS A 23 2.590 -10.307 0.449 1.00 41.44 H new ATOM 0 HG3 LYS A 23 2.050 -8.939 1.402 1.00 41.44 H new ATOM 0 HD2 LYS A 23 1.504 -10.392 3.304 1.00 55.25 H new ATOM 0 HD3 LYS A 23 1.805 -11.833 2.352 1.00 55.25 H new ATOM 0 HE2 LYS A 23 4.222 -11.127 2.125 1.00 32.01 H new ATOM 0 HE3 LYS A 23 3.893 -9.763 3.175 1.00 32.01 H new ATOM 0 HZ1 LYS A 23 4.652 -11.325 4.646 1.00 65.11 H new ATOM 0 HZ2 LYS A 23 2.979 -11.589 4.759 1.00 65.11 H new ATOM 0 HZ3 LYS A 23 3.941 -12.632 3.827 1.00 65.11 H new ATOM 390 N ARG A 24 2.061 -9.031 -2.060 1.00 71.10 N ATOM 391 CA ARG A 24 3.193 -9.359 -2.932 1.00 32.11 C ATOM 392 C ARG A 24 4.322 -10.003 -2.105 1.00 73.35 C ATOM 393 O ARG A 24 4.639 -9.536 -0.997 1.00 24.12 O ATOM 394 CB ARG A 24 3.694 -8.066 -3.636 1.00 32.20 C ATOM 395 CG ARG A 24 4.979 -8.227 -4.482 1.00 13.52 C ATOM 396 CD ARG A 24 5.341 -6.956 -5.273 1.00 53.51 C ATOM 397 NE ARG A 24 6.691 -7.022 -5.867 1.00 33.43 N ATOM 398 CZ ARG A 24 6.987 -6.781 -7.158 1.00 33.11 C ATOM 399 NH1 ARG A 24 6.032 -6.466 -8.033 1.00 22.12 N ATOM 400 NH2 ARG A 24 8.252 -6.811 -7.547 1.00 13.11 N ATOM 0 H ARG A 24 2.073 -8.069 -1.720 1.00 71.10 H new ATOM 0 HA ARG A 24 2.876 -10.073 -3.692 1.00 32.11 H new ATOM 0 HB2 ARG A 24 2.899 -7.692 -4.281 1.00 32.20 H new ATOM 0 HB3 ARG A 24 3.872 -7.305 -2.877 1.00 32.20 H new ATOM 0 HG2 ARG A 24 5.809 -8.489 -3.826 1.00 13.52 H new ATOM 0 HG3 ARG A 24 4.848 -9.056 -5.177 1.00 13.52 H new ATOM 0 HD2 ARG A 24 4.607 -6.804 -6.064 1.00 53.51 H new ATOM 0 HD3 ARG A 24 5.281 -6.092 -4.612 1.00 53.51 H new ATOM 0 HE ARG A 24 7.463 -7.271 -5.248 1.00 33.43 H new ATOM 0 HH11 ARG A 24 5.061 -6.405 -7.728 1.00 22.12 H new ATOM 0 HH12 ARG A 24 6.273 -6.286 -9.008 1.00 22.12 H new ATOM 0 HH21 ARG A 24 8.989 -7.015 -6.872 1.00 13.11 H new ATOM 0 HH22 ARG A 24 8.490 -6.630 -8.522 1.00 13.11 H new ATOM 414 N SER A 25 4.920 -11.077 -2.650 1.00 25.15 N ATOM 415 CA SER A 25 6.099 -11.724 -2.066 1.00 65.23 C ATOM 416 C SER A 25 7.336 -10.910 -2.479 1.00 3.02 C ATOM 417 O SER A 25 7.431 -10.473 -3.628 1.00 23.20 O ATOM 418 CB SER A 25 6.204 -13.176 -2.560 1.00 23.30 C ATOM 419 OG SER A 25 7.319 -13.851 -1.993 1.00 52.21 O ATOM 0 H SER A 25 4.595 -11.519 -3.510 1.00 25.15 H new ATOM 0 HA SER A 25 6.023 -11.753 -0.979 1.00 65.23 H new ATOM 0 HB2 SER A 25 5.289 -13.712 -2.308 1.00 23.30 H new ATOM 0 HB3 SER A 25 6.289 -13.184 -3.647 1.00 23.30 H new ATOM 0 HG SER A 25 7.305 -14.792 -2.267 1.00 52.21 H new ATOM 583 N ASN A 35 5.506 -13.946 -6.065 1.00 64.50 N ATOM 584 CA ASN A 35 4.137 -14.492 -6.182 1.00 2.43 C ATOM 585 C ASN A 35 3.124 -13.554 -5.508 1.00 74.53 C ATOM 586 O ASN A 35 3.489 -12.684 -4.709 1.00 25.22 O ATOM 587 CB ASN A 35 4.054 -15.932 -5.596 1.00 20.31 C ATOM 588 CG ASN A 35 4.382 -16.029 -4.103 1.00 72.33 C ATOM 589 OD1 ASN A 35 3.500 -15.952 -3.243 1.00 3.52 O ATOM 590 ND2 ASN A 35 5.661 -16.192 -3.784 1.00 32.54 N ATOM 0 HA ASN A 35 3.885 -14.557 -7.240 1.00 2.43 H new ATOM 0 HB2 ASN A 35 3.049 -16.320 -5.760 1.00 20.31 H new ATOM 0 HB3 ASN A 35 4.739 -16.576 -6.148 1.00 20.31 H new ATOM 0 HD21 ASN A 35 5.938 -16.257 -2.805 1.00 32.54 H new ATOM 0 HD22 ASN A 35 6.366 -16.252 -4.519 1.00 32.54 H new ATOM 597 N TYR A 36 1.843 -13.731 -5.859 1.00 4.13 N ATOM 598 CA TYR A 36 0.733 -12.920 -5.337 1.00 25.23 C ATOM 599 C TYR A 36 -0.264 -13.834 -4.608 1.00 64.43 C ATOM 600 O TYR A 36 -0.708 -14.849 -5.169 1.00 14.31 O ATOM 601 CB TYR A 36 0.060 -12.141 -6.501 1.00 35.14 C ATOM 602 CG TYR A 36 0.961 -11.034 -7.086 1.00 71.43 C ATOM 603 CD1 TYR A 36 1.235 -9.878 -6.348 1.00 51.32 C ATOM 604 CD2 TYR A 36 1.556 -11.147 -8.350 1.00 12.40 C ATOM 605 CE1 TYR A 36 2.055 -8.884 -6.847 1.00 3.34 C ATOM 606 CE2 TYR A 36 2.381 -10.150 -8.850 1.00 44.10 C ATOM 607 CZ TYR A 36 2.628 -9.019 -8.094 1.00 53.31 C ATOM 608 OH TYR A 36 3.451 -8.017 -8.582 1.00 63.23 O ATOM 0 H TYR A 36 1.545 -14.448 -6.520 1.00 4.13 H new ATOM 0 HA TYR A 36 1.105 -12.187 -4.621 1.00 25.23 H new ATOM 0 HB2 TYR A 36 -0.207 -12.841 -7.293 1.00 35.14 H new ATOM 0 HB3 TYR A 36 -0.868 -11.695 -6.144 1.00 35.14 H new ATOM 0 HD1 TYR A 36 0.797 -9.760 -5.368 1.00 51.32 H new ATOM 0 HD2 TYR A 36 1.369 -12.028 -8.946 1.00 12.40 H new ATOM 0 HE1 TYR A 36 2.248 -7.999 -6.259 1.00 3.34 H new ATOM 0 HE2 TYR A 36 2.829 -10.257 -9.827 1.00 44.10 H new ATOM 0 HH TYR A 36 3.776 -8.265 -9.473 1.00 63.23 H new ATOM 618 N LYS A 37 -0.616 -13.469 -3.365 1.00 63.33 N ATOM 619 CA LYS A 37 -1.422 -14.319 -2.467 1.00 22.42 C ATOM 620 C LYS A 37 -2.511 -13.471 -1.799 1.00 64.04 C ATOM 621 O LYS A 37 -2.220 -12.383 -1.326 1.00 72.43 O ATOM 622 CB LYS A 37 -0.482 -14.973 -1.402 1.00 30.42 C ATOM 623 CG LYS A 37 -1.066 -16.195 -0.650 1.00 34.31 C ATOM 624 CD LYS A 37 -1.476 -17.364 -1.583 1.00 40.14 C ATOM 625 CE LYS A 37 -0.372 -17.786 -2.578 1.00 24.41 C ATOM 626 NZ LYS A 37 0.909 -18.129 -1.909 1.00 44.53 N ATOM 0 H LYS A 37 -0.351 -12.575 -2.951 1.00 63.33 H new ATOM 0 HA LYS A 37 -1.910 -15.112 -3.034 1.00 22.42 H new ATOM 0 HB2 LYS A 37 0.439 -15.281 -1.897 1.00 30.42 H new ATOM 0 HB3 LYS A 37 -0.211 -14.214 -0.668 1.00 30.42 H new ATOM 0 HG2 LYS A 37 -0.328 -16.556 0.067 1.00 34.31 H new ATOM 0 HG3 LYS A 37 -1.937 -15.876 -0.078 1.00 34.31 H new ATOM 0 HD2 LYS A 37 -1.750 -18.225 -0.973 1.00 40.14 H new ATOM 0 HD3 LYS A 37 -2.365 -17.075 -2.143 1.00 40.14 H new ATOM 0 HE2 LYS A 37 -0.717 -18.645 -3.153 1.00 24.41 H new ATOM 0 HE3 LYS A 37 -0.200 -16.976 -3.287 1.00 24.41 H new ATOM 0 HZ1 LYS A 37 1.596 -18.453 -2.620 1.00 44.53 H new ATOM 0 HZ2 LYS A 37 1.283 -17.289 -1.424 1.00 44.53 H new ATOM 0 HZ3 LYS A 37 0.746 -18.886 -1.215 1.00 44.53 H new ATOM 640 N GLU A 38 -3.732 -14.015 -1.675 1.00 52.33 N ATOM 641 CA GLU A 38 -4.921 -13.222 -1.286 1.00 0.41 C ATOM 642 C GLU A 38 -5.319 -13.588 0.149 1.00 1.41 C ATOM 643 O GLU A 38 -5.899 -14.658 0.393 1.00 2.40 O ATOM 644 CB GLU A 38 -6.084 -13.473 -2.280 1.00 55.00 C ATOM 645 CG GLU A 38 -7.321 -12.594 -2.022 1.00 2.24 C ATOM 646 CD GLU A 38 -8.468 -12.855 -3.000 1.00 43.15 C ATOM 647 OE1 GLU A 38 -9.118 -13.920 -2.888 1.00 32.42 O ATOM 648 OE2 GLU A 38 -8.724 -12.008 -3.876 1.00 4.20 O ATOM 0 H GLU A 38 -3.927 -15.003 -1.838 1.00 52.33 H new ATOM 0 HA GLU A 38 -4.686 -12.158 -1.322 1.00 0.41 H new ATOM 0 HB2 GLU A 38 -5.728 -13.294 -3.294 1.00 55.00 H new ATOM 0 HB3 GLU A 38 -6.377 -14.522 -2.225 1.00 55.00 H new ATOM 0 HG2 GLU A 38 -7.674 -12.767 -1.005 1.00 2.24 H new ATOM 0 HG3 GLU A 38 -7.031 -11.545 -2.085 1.00 2.24 H new ATOM 655 N ARG A 39 -4.988 -12.697 1.098 1.00 21.14 N ATOM 656 CA ARG A 39 -5.034 -12.957 2.555 1.00 24.41 C ATOM 657 C ARG A 39 -5.548 -11.712 3.331 1.00 1.32 C ATOM 658 O ARG A 39 -5.827 -10.672 2.734 1.00 40.44 O ATOM 659 CB ARG A 39 -3.616 -13.378 3.037 1.00 13.11 C ATOM 660 CG ARG A 39 -3.074 -14.692 2.404 1.00 51.23 C ATOM 661 CD ARG A 39 -3.989 -15.903 2.684 1.00 64.34 C ATOM 662 NE ARG A 39 -3.489 -17.152 2.083 1.00 73.33 N ATOM 663 CZ ARG A 39 -4.150 -17.899 1.183 1.00 42.10 C ATOM 664 NH1 ARG A 39 -5.365 -17.547 0.750 1.00 22.33 N ATOM 665 NH2 ARG A 39 -3.586 -19.007 0.729 1.00 30.24 N ATOM 0 H ARG A 39 -4.673 -11.753 0.873 1.00 21.14 H new ATOM 0 HA ARG A 39 -5.736 -13.767 2.756 1.00 24.41 H new ATOM 0 HB2 ARG A 39 -2.918 -12.570 2.816 1.00 13.11 H new ATOM 0 HB3 ARG A 39 -3.636 -13.495 4.121 1.00 13.11 H new ATOM 0 HG2 ARG A 39 -2.973 -14.558 1.327 1.00 51.23 H new ATOM 0 HG3 ARG A 39 -2.077 -14.896 2.795 1.00 51.23 H new ATOM 0 HD2 ARG A 39 -4.085 -16.038 3.761 1.00 64.34 H new ATOM 0 HD3 ARG A 39 -4.987 -15.695 2.298 1.00 64.34 H new ATOM 0 HE ARG A 39 -2.566 -17.476 2.374 1.00 73.33 H new ATOM 0 HH11 ARG A 39 -5.806 -16.698 1.103 1.00 22.33 H new ATOM 0 HH12 ARG A 39 -5.851 -18.128 0.066 1.00 22.33 H new ATOM 0 HH21 ARG A 39 -2.662 -19.283 1.063 1.00 30.24 H new ATOM 0 HH22 ARG A 39 -4.075 -19.585 0.045 1.00 30.24 H new ATOM 679 N LEU A 40 -5.650 -11.823 4.672 1.00 3.20 N ATOM 680 CA LEU A 40 -6.322 -10.808 5.520 1.00 5.11 C ATOM 681 C LEU A 40 -5.339 -9.693 5.942 1.00 61.40 C ATOM 682 O LEU A 40 -4.242 -9.970 6.434 1.00 24.34 O ATOM 683 CB LEU A 40 -6.957 -11.468 6.785 1.00 13.44 C ATOM 684 CG LEU A 40 -7.707 -10.499 7.771 1.00 15.14 C ATOM 685 CD1 LEU A 40 -8.861 -9.732 7.075 1.00 65.44 C ATOM 686 CD2 LEU A 40 -8.217 -11.264 9.010 1.00 61.52 C ATOM 0 H LEU A 40 -5.273 -12.612 5.197 1.00 3.20 H new ATOM 0 HA LEU A 40 -7.117 -10.359 4.924 1.00 5.11 H new ATOM 0 HB2 LEU A 40 -7.660 -12.233 6.456 1.00 13.44 H new ATOM 0 HB3 LEU A 40 -6.168 -11.977 7.339 1.00 13.44 H new ATOM 0 HG LEU A 40 -6.984 -9.753 8.101 1.00 15.14 H new ATOM 0 HD11 LEU A 40 -9.349 -9.076 7.796 1.00 65.44 H new ATOM 0 HD12 LEU A 40 -8.459 -9.136 6.256 1.00 65.44 H new ATOM 0 HD13 LEU A 40 -9.587 -10.444 6.684 1.00 65.44 H new ATOM 0 HD21 LEU A 40 -8.732 -10.573 9.677 1.00 61.52 H new ATOM 0 HD22 LEU A 40 -8.907 -12.047 8.696 1.00 61.52 H new ATOM 0 HD23 LEU A 40 -7.373 -11.713 9.534 1.00 61.52 H new ATOM 698 N PHE A 41 -5.758 -8.435 5.726 1.00 15.42 N ATOM 699 CA PHE A 41 -5.028 -7.225 6.154 1.00 42.41 C ATOM 700 C PHE A 41 -5.883 -6.444 7.165 1.00 75.01 C ATOM 701 O PHE A 41 -7.085 -6.248 6.953 1.00 72.12 O ATOM 702 CB PHE A 41 -4.676 -6.324 4.938 1.00 2.33 C ATOM 703 CG PHE A 41 -3.506 -6.829 4.086 1.00 74.32 C ATOM 704 CD1 PHE A 41 -3.601 -8.014 3.350 1.00 24.43 C ATOM 705 CD2 PHE A 41 -2.305 -6.117 4.030 1.00 71.24 C ATOM 706 CE1 PHE A 41 -2.539 -8.462 2.588 1.00 52.24 C ATOM 707 CE2 PHE A 41 -1.247 -6.572 3.270 1.00 34.13 C ATOM 708 CZ PHE A 41 -1.365 -7.739 2.550 1.00 4.04 C ATOM 0 H PHE A 41 -6.630 -8.224 5.240 1.00 15.42 H new ATOM 0 HA PHE A 41 -4.093 -7.530 6.625 1.00 42.41 H new ATOM 0 HB2 PHE A 41 -5.557 -6.233 4.303 1.00 2.33 H new ATOM 0 HB3 PHE A 41 -4.439 -5.324 5.300 1.00 2.33 H new ATOM 0 HD1 PHE A 41 -4.516 -8.587 3.377 1.00 24.43 H new ATOM 0 HD2 PHE A 41 -2.203 -5.198 4.589 1.00 71.24 H new ATOM 0 HE1 PHE A 41 -2.628 -9.378 2.022 1.00 52.24 H new ATOM 0 HE2 PHE A 41 -0.324 -6.011 3.240 1.00 34.13 H new ATOM 0 HZ PHE A 41 -0.536 -8.090 1.953 1.00 4.04 H new ATOM 718 N VAL A 42 -5.235 -6.005 8.256 1.00 41.05 N ATOM 719 CA VAL A 42 -5.868 -5.280 9.372 1.00 11.01 C ATOM 720 C VAL A 42 -5.106 -3.956 9.608 1.00 12.52 C ATOM 721 O VAL A 42 -3.915 -3.975 9.938 1.00 71.15 O ATOM 722 CB VAL A 42 -5.855 -6.164 10.688 1.00 62.43 C ATOM 723 CG1 VAL A 42 -6.392 -5.385 11.913 1.00 44.43 C ATOM 724 CG2 VAL A 42 -6.649 -7.485 10.483 1.00 52.41 C ATOM 0 H VAL A 42 -4.234 -6.147 8.391 1.00 41.05 H new ATOM 0 HA VAL A 42 -6.906 -5.065 9.120 1.00 11.01 H new ATOM 0 HB VAL A 42 -4.815 -6.418 10.893 1.00 62.43 H new ATOM 0 HG11 VAL A 42 -6.366 -6.028 12.793 1.00 44.43 H new ATOM 0 HG12 VAL A 42 -5.771 -4.506 12.087 1.00 44.43 H new ATOM 0 HG13 VAL A 42 -7.419 -5.071 11.723 1.00 44.43 H new ATOM 0 HG21 VAL A 42 -6.623 -8.071 11.402 1.00 52.41 H new ATOM 0 HG22 VAL A 42 -7.683 -7.252 10.230 1.00 52.41 H new ATOM 0 HG23 VAL A 42 -6.198 -8.059 9.674 1.00 52.41 H new ATOM 734 N LEU A 43 -5.792 -2.814 9.431 1.00 73.41 N ATOM 735 CA LEU A 43 -5.198 -1.473 9.614 1.00 34.22 C ATOM 736 C LEU A 43 -5.677 -0.872 10.937 1.00 22.14 C ATOM 737 O LEU A 43 -6.868 -0.814 11.183 1.00 42.52 O ATOM 738 CB LEU A 43 -5.595 -0.538 8.435 1.00 42.34 C ATOM 739 CG LEU A 43 -5.184 0.968 8.570 1.00 45.12 C ATOM 740 CD1 LEU A 43 -3.658 1.137 8.743 1.00 30.42 C ATOM 741 CD2 LEU A 43 -5.713 1.799 7.384 1.00 54.43 C ATOM 0 H LEU A 43 -6.774 -2.792 9.157 1.00 73.41 H new ATOM 0 HA LEU A 43 -4.112 -1.570 9.633 1.00 34.22 H new ATOM 0 HB2 LEU A 43 -5.150 -0.933 7.522 1.00 42.34 H new ATOM 0 HB3 LEU A 43 -6.677 -0.587 8.310 1.00 42.34 H new ATOM 0 HG LEU A 43 -5.651 1.350 9.478 1.00 45.12 H new ATOM 0 HD11 LEU A 43 -3.417 2.196 8.833 1.00 30.42 H new ATOM 0 HD12 LEU A 43 -3.334 0.614 9.642 1.00 30.42 H new ATOM 0 HD13 LEU A 43 -3.145 0.721 7.876 1.00 30.42 H new ATOM 0 HD21 LEU A 43 -5.412 2.840 7.506 1.00 54.43 H new ATOM 0 HD22 LEU A 43 -5.301 1.409 6.454 1.00 54.43 H new ATOM 0 HD23 LEU A 43 -6.801 1.737 7.353 1.00 54.43 H new ATOM 753 N THR A 44 -4.733 -0.414 11.761 1.00 64.54 N ATOM 754 CA THR A 44 -5.013 0.357 12.988 1.00 42.43 C ATOM 755 C THR A 44 -4.309 1.718 12.881 1.00 44.31 C ATOM 756 O THR A 44 -3.471 1.922 11.991 1.00 10.03 O ATOM 757 CB THR A 44 -4.546 -0.397 14.285 1.00 33.45 C ATOM 758 OG1 THR A 44 -3.131 -0.650 14.240 1.00 61.22 O ATOM 759 CG2 THR A 44 -5.295 -1.728 14.477 1.00 63.20 C ATOM 0 H THR A 44 -3.738 -0.567 11.599 1.00 64.54 H new ATOM 0 HA THR A 44 -6.091 0.490 13.074 1.00 42.43 H new ATOM 0 HB THR A 44 -4.777 0.251 15.131 1.00 33.45 H new ATOM 0 HG1 THR A 44 -2.829 -0.653 13.308 1.00 61.22 H new ATOM 0 HG21 THR A 44 -4.942 -2.217 15.385 1.00 63.20 H new ATOM 0 HG22 THR A 44 -6.364 -1.535 14.561 1.00 63.20 H new ATOM 0 HG23 THR A 44 -5.110 -2.376 13.621 1.00 63.20 H new ATOM 767 N LYS A 45 -4.630 2.638 13.808 1.00 10.14 N ATOM 768 CA LYS A 45 -4.072 4.006 13.826 1.00 1.31 C ATOM 769 C LYS A 45 -2.583 4.033 14.238 1.00 5.23 C ATOM 770 O LYS A 45 -1.937 5.087 14.174 1.00 25.00 O ATOM 771 CB LYS A 45 -4.906 4.920 14.772 1.00 45.23 C ATOM 772 CG LYS A 45 -6.375 5.131 14.334 1.00 31.30 C ATOM 773 CD LYS A 45 -7.129 6.162 15.206 1.00 33.52 C ATOM 774 CE LYS A 45 -6.528 7.580 15.130 1.00 45.02 C ATOM 775 NZ LYS A 45 -6.491 8.112 13.737 1.00 0.14 N ATOM 0 H LYS A 45 -5.285 2.455 14.568 1.00 10.14 H new ATOM 0 HA LYS A 45 -4.132 4.386 12.806 1.00 1.31 H new ATOM 0 HB2 LYS A 45 -4.898 4.489 15.773 1.00 45.23 H new ATOM 0 HB3 LYS A 45 -4.418 5.892 14.840 1.00 45.23 H new ATOM 0 HG2 LYS A 45 -6.394 5.461 13.295 1.00 31.30 H new ATOM 0 HG3 LYS A 45 -6.900 4.177 14.375 1.00 31.30 H new ATOM 0 HD2 LYS A 45 -8.172 6.200 14.892 1.00 33.52 H new ATOM 0 HD3 LYS A 45 -7.120 5.826 16.243 1.00 33.52 H new ATOM 0 HE2 LYS A 45 -7.113 8.253 15.757 1.00 45.02 H new ATOM 0 HE3 LYS A 45 -5.517 7.565 15.536 1.00 45.02 H new ATOM 0 HZ1 LYS A 45 -6.240 9.121 13.757 1.00 0.14 H new ATOM 0 HZ2 LYS A 45 -5.781 7.590 13.185 1.00 0.14 H new ATOM 0 HZ3 LYS A 45 -7.426 7.997 13.296 1.00 0.14 H new ATOM 789 N SER A 46 -2.045 2.877 14.664 1.00 33.44 N ATOM 790 CA SER A 46 -0.660 2.758 15.149 1.00 50.13 C ATOM 791 C SER A 46 0.182 1.859 14.222 1.00 54.03 C ATOM 792 O SER A 46 1.353 2.163 13.946 1.00 35.20 O ATOM 793 CB SER A 46 -0.684 2.191 16.587 1.00 24.35 C ATOM 794 OG SER A 46 -1.486 3.007 17.427 1.00 72.42 O ATOM 0 H SER A 46 -2.560 1.997 14.681 1.00 33.44 H new ATOM 0 HA SER A 46 -0.195 3.744 15.150 1.00 50.13 H new ATOM 0 HB2 SER A 46 -1.075 1.173 16.577 1.00 24.35 H new ATOM 0 HB3 SER A 46 0.331 2.139 16.981 1.00 24.35 H new ATOM 0 HG SER A 46 -1.494 2.635 18.334 1.00 72.42 H new ATOM 800 N MET A 47 -0.428 0.761 13.719 1.00 22.32 N ATOM 801 CA MET A 47 0.281 -0.245 12.885 1.00 14.24 C ATOM 802 C MET A 47 -0.574 -0.715 11.691 1.00 73.54 C ATOM 803 O MET A 47 -1.796 -0.793 11.782 1.00 41.11 O ATOM 804 CB MET A 47 0.689 -1.491 13.740 1.00 3.44 C ATOM 805 CG MET A 47 1.728 -1.229 14.840 1.00 30.32 C ATOM 806 SD MET A 47 2.146 -2.721 15.778 1.00 14.35 S ATOM 807 CE MET A 47 0.553 -3.167 16.480 1.00 14.41 C ATOM 0 H MET A 47 -1.413 0.546 13.875 1.00 22.32 H new ATOM 0 HA MET A 47 1.174 0.247 12.499 1.00 14.24 H new ATOM 0 HB2 MET A 47 -0.208 -1.901 14.203 1.00 3.44 H new ATOM 0 HB3 MET A 47 1.081 -2.257 13.070 1.00 3.44 H new ATOM 0 HG2 MET A 47 2.634 -0.823 14.389 1.00 30.32 H new ATOM 0 HG3 MET A 47 1.344 -0.471 15.523 1.00 30.32 H new ATOM 0 HE1 MET A 47 0.702 -3.851 17.315 1.00 14.41 H new ATOM 0 HE2 MET A 47 0.046 -2.269 16.833 1.00 14.41 H new ATOM 0 HE3 MET A 47 -0.057 -3.652 15.718 1.00 14.41 H new ATOM 817 N LEU A 48 0.100 -1.024 10.569 1.00 24.12 N ATOM 818 CA LEU A 48 -0.480 -1.787 9.454 1.00 22.23 C ATOM 819 C LEU A 48 -0.026 -3.255 9.598 1.00 43.51 C ATOM 820 O LEU A 48 1.131 -3.596 9.320 1.00 63.13 O ATOM 821 CB LEU A 48 -0.037 -1.195 8.086 1.00 31.34 C ATOM 822 CG LEU A 48 -0.571 -1.934 6.808 1.00 52.35 C ATOM 823 CD1 LEU A 48 -2.116 -1.895 6.732 1.00 74.45 C ATOM 824 CD2 LEU A 48 0.071 -1.350 5.530 1.00 21.31 C ATOM 0 H LEU A 48 1.069 -0.748 10.411 1.00 24.12 H new ATOM 0 HA LEU A 48 -1.568 -1.729 9.485 1.00 22.23 H new ATOM 0 HB2 LEU A 48 -0.361 -0.155 8.041 1.00 31.34 H new ATOM 0 HB3 LEU A 48 1.052 -1.192 8.050 1.00 31.34 H new ATOM 0 HG LEU A 48 -0.280 -2.982 6.883 1.00 52.35 H new ATOM 0 HD11 LEU A 48 -2.449 -2.416 5.835 1.00 74.45 H new ATOM 0 HD12 LEU A 48 -2.536 -2.382 7.612 1.00 74.45 H new ATOM 0 HD13 LEU A 48 -2.452 -0.859 6.696 1.00 74.45 H new ATOM 0 HD21 LEU A 48 -0.313 -1.877 4.656 1.00 21.31 H new ATOM 0 HD22 LEU A 48 -0.173 -0.291 5.451 1.00 21.31 H new ATOM 0 HD23 LEU A 48 1.153 -1.470 5.579 1.00 21.31 H new ATOM 836 N THR A 49 -0.938 -4.096 10.086 1.00 4.21 N ATOM 837 CA THR A 49 -0.697 -5.531 10.332 1.00 55.20 C ATOM 838 C THR A 49 -1.345 -6.366 9.204 1.00 61.52 C ATOM 839 O THR A 49 -2.260 -5.890 8.525 1.00 60.24 O ATOM 840 CB THR A 49 -1.295 -5.928 11.733 1.00 41.44 C ATOM 841 OG1 THR A 49 -0.823 -5.002 12.731 1.00 73.53 O ATOM 842 CG2 THR A 49 -0.927 -7.369 12.171 1.00 74.44 C ATOM 0 H THR A 49 -1.884 -3.801 10.328 1.00 4.21 H new ATOM 0 HA THR A 49 0.374 -5.731 10.339 1.00 55.20 H new ATOM 0 HB THR A 49 -2.380 -5.888 11.635 1.00 41.44 H new ATOM 0 HG1 THR A 49 -1.195 -5.245 13.605 1.00 73.53 H new ATOM 0 HG21 THR A 49 -1.371 -7.578 13.144 1.00 74.44 H new ATOM 0 HG22 THR A 49 -1.308 -8.080 11.438 1.00 74.44 H new ATOM 0 HG23 THR A 49 0.157 -7.463 12.239 1.00 74.44 H new ATOM 850 N TYR A 50 -0.850 -7.599 8.994 1.00 41.24 N ATOM 851 CA TYR A 50 -1.450 -8.563 8.049 1.00 24.11 C ATOM 852 C TYR A 50 -1.175 -10.008 8.490 1.00 40.11 C ATOM 853 O TYR A 50 -0.358 -10.259 9.392 1.00 50.43 O ATOM 854 CB TYR A 50 -0.966 -8.307 6.593 1.00 52.34 C ATOM 855 CG TYR A 50 0.563 -8.236 6.393 1.00 13.43 C ATOM 856 CD1 TYR A 50 1.348 -9.390 6.353 1.00 44.14 C ATOM 857 CD2 TYR A 50 1.218 -7.006 6.223 1.00 74.42 C ATOM 858 CE1 TYR A 50 2.711 -9.323 6.160 1.00 72.44 C ATOM 859 CE2 TYR A 50 2.586 -6.943 6.027 1.00 61.31 C ATOM 860 CZ TYR A 50 3.324 -8.106 5.995 1.00 14.23 C ATOM 861 OH TYR A 50 4.689 -8.055 5.801 1.00 13.03 O ATOM 0 H TYR A 50 -0.024 -7.957 9.473 1.00 41.24 H new ATOM 0 HA TYR A 50 -2.530 -8.414 8.060 1.00 24.11 H new ATOM 0 HB2 TYR A 50 -1.360 -9.098 5.955 1.00 52.34 H new ATOM 0 HB3 TYR A 50 -1.402 -7.371 6.245 1.00 52.34 H new ATOM 0 HD1 TYR A 50 0.878 -10.354 6.476 1.00 44.14 H new ATOM 0 HD2 TYR A 50 0.643 -6.092 6.246 1.00 74.42 H new ATOM 0 HE1 TYR A 50 3.298 -10.229 6.139 1.00 72.44 H new ATOM 0 HE2 TYR A 50 3.073 -5.987 5.900 1.00 61.31 H new ATOM 0 HH TYR A 50 4.970 -7.122 5.700 1.00 13.03 H new ATOM 871 N TYR A 51 -1.859 -10.945 7.819 1.00 22.22 N ATOM 872 CA TYR A 51 -1.872 -12.377 8.155 1.00 74.41 C ATOM 873 C TYR A 51 -2.018 -13.170 6.858 1.00 30.55 C ATOM 874 O TYR A 51 -2.899 -12.844 6.051 1.00 30.21 O ATOM 875 CB TYR A 51 -3.078 -12.729 9.085 1.00 23.25 C ATOM 876 CG TYR A 51 -3.168 -11.904 10.377 1.00 55.23 C ATOM 877 CD1 TYR A 51 -2.349 -12.188 11.474 1.00 33.10 C ATOM 878 CD2 TYR A 51 -4.065 -10.830 10.494 1.00 22.12 C ATOM 879 CE1 TYR A 51 -2.419 -11.429 12.628 1.00 61.04 C ATOM 880 CE2 TYR A 51 -4.130 -10.071 11.647 1.00 74.45 C ATOM 881 CZ TYR A 51 -3.312 -10.378 12.709 1.00 25.33 C ATOM 882 OH TYR A 51 -3.377 -9.625 13.858 1.00 14.13 O ATOM 0 H TYR A 51 -2.434 -10.723 7.006 1.00 22.22 H new ATOM 0 HA TYR A 51 -0.947 -12.624 8.675 1.00 74.41 H new ATOM 0 HB2 TYR A 51 -4.002 -12.595 8.522 1.00 23.25 H new ATOM 0 HB3 TYR A 51 -3.016 -13.784 9.350 1.00 23.25 H new ATOM 0 HD1 TYR A 51 -1.652 -13.011 11.419 1.00 33.10 H new ATOM 0 HD2 TYR A 51 -4.717 -10.592 9.666 1.00 22.12 H new ATOM 0 HE1 TYR A 51 -1.776 -11.658 13.465 1.00 61.04 H new ATOM 0 HE2 TYR A 51 -4.819 -9.242 11.714 1.00 74.45 H new ATOM 0 HH TYR A 51 -4.054 -8.925 13.752 1.00 14.13 H new ATOM 1081 N PHE A 63 4.758 -7.130 10.763 1.00 43.24 N ATOM 1082 CA PHE A 63 3.842 -5.975 10.833 1.00 65.33 C ATOM 1083 C PHE A 63 4.639 -4.669 10.752 1.00 0.15 C ATOM 1084 O PHE A 63 5.832 -4.625 11.084 1.00 13.42 O ATOM 1085 CB PHE A 63 2.968 -6.030 12.128 1.00 54.21 C ATOM 1086 CG PHE A 63 3.759 -6.142 13.437 1.00 51.22 C ATOM 1087 CD1 PHE A 63 4.197 -5.004 14.122 1.00 22.43 C ATOM 1088 CD2 PHE A 63 4.068 -7.393 13.978 1.00 13.44 C ATOM 1089 CE1 PHE A 63 4.914 -5.117 15.296 1.00 10.45 C ATOM 1090 CE2 PHE A 63 4.786 -7.498 15.155 1.00 41.21 C ATOM 1091 CZ PHE A 63 5.208 -6.362 15.813 1.00 35.12 C ATOM 0 HA PHE A 63 3.162 -6.015 9.982 1.00 65.33 H new ATOM 0 HB2 PHE A 63 2.350 -5.133 12.170 1.00 54.21 H new ATOM 0 HB3 PHE A 63 2.291 -6.881 12.056 1.00 54.21 H new ATOM 0 HD1 PHE A 63 3.971 -4.024 13.727 1.00 22.43 H new ATOM 0 HD2 PHE A 63 3.742 -8.289 13.470 1.00 13.44 H new ATOM 0 HE1 PHE A 63 5.246 -4.228 15.812 1.00 10.45 H new ATOM 0 HE2 PHE A 63 5.017 -8.472 15.560 1.00 41.21 H new ATOM 0 HZ PHE A 63 5.768 -6.447 16.732 1.00 35.12 H new ATOM 1101 N ILE A 64 3.946 -3.600 10.358 1.00 75.25 N ATOM 1102 CA ILE A 64 4.550 -2.315 9.973 1.00 15.22 C ATOM 1103 C ILE A 64 3.938 -1.228 10.866 1.00 74.31 C ATOM 1104 O ILE A 64 2.782 -1.345 11.245 1.00 13.21 O ATOM 1105 CB ILE A 64 4.264 -1.993 8.446 1.00 25.43 C ATOM 1106 CG1 ILE A 64 4.780 -3.152 7.524 1.00 33.15 C ATOM 1107 CG2 ILE A 64 4.890 -0.634 8.026 1.00 21.22 C ATOM 1108 CD1 ILE A 64 4.458 -2.990 6.046 1.00 53.13 C ATOM 0 H ILE A 64 2.928 -3.599 10.295 1.00 75.25 H new ATOM 0 HA ILE A 64 5.631 -2.357 10.103 1.00 15.22 H new ATOM 0 HB ILE A 64 3.184 -1.913 8.322 1.00 25.43 H new ATOM 0 HG12 ILE A 64 5.861 -3.233 7.638 1.00 33.15 H new ATOM 0 HG13 ILE A 64 4.352 -4.092 7.873 1.00 33.15 H new ATOM 0 HG21 ILE A 64 4.675 -0.444 6.974 1.00 21.22 H new ATOM 0 HG22 ILE A 64 4.465 0.165 8.633 1.00 21.22 H new ATOM 0 HG23 ILE A 64 5.969 -0.669 8.176 1.00 21.22 H new ATOM 0 HD11 ILE A 64 4.856 -3.840 5.492 1.00 53.13 H new ATOM 0 HD12 ILE A 64 3.377 -2.943 5.912 1.00 53.13 H new ATOM 0 HD13 ILE A 64 4.910 -2.071 5.674 1.00 53.13 H new ATOM 1120 N ASP A 65 4.710 -0.187 11.217 1.00 53.13 N ATOM 1121 CA ASP A 65 4.180 0.980 11.943 1.00 50.00 C ATOM 1122 C ASP A 65 3.684 1.982 10.905 1.00 31.31 C ATOM 1123 O ASP A 65 4.359 2.205 9.886 1.00 62.31 O ATOM 1124 CB ASP A 65 5.267 1.667 12.812 1.00 71.52 C ATOM 1125 CG ASP A 65 5.949 0.731 13.818 1.00 41.12 C ATOM 1126 OD1 ASP A 65 5.262 0.234 14.730 1.00 25.32 O ATOM 1127 OD2 ASP A 65 7.175 0.476 13.695 1.00 44.51 O ATOM 0 H ASP A 65 5.707 -0.129 11.009 1.00 53.13 H new ATOM 0 HA ASP A 65 3.383 0.647 12.608 1.00 50.00 H new ATOM 0 HB2 ASP A 65 6.026 2.093 12.156 1.00 71.52 H new ATOM 0 HB3 ASP A 65 4.813 2.497 13.354 1.00 71.52 H new ATOM 1132 N VAL A 66 2.527 2.602 11.175 1.00 63.41 N ATOM 1133 CA VAL A 66 1.994 3.709 10.353 1.00 35.14 C ATOM 1134 C VAL A 66 2.985 4.903 10.351 1.00 10.43 C ATOM 1135 O VAL A 66 3.089 5.637 9.365 1.00 71.02 O ATOM 1136 CB VAL A 66 0.570 4.163 10.868 1.00 75.41 C ATOM 1137 CG1 VAL A 66 0.049 5.409 10.115 1.00 1.14 C ATOM 1138 CG2 VAL A 66 -0.453 3.004 10.764 1.00 54.31 C ATOM 0 H VAL A 66 1.932 2.355 11.966 1.00 63.41 H new ATOM 0 HA VAL A 66 1.880 3.351 9.330 1.00 35.14 H new ATOM 0 HB VAL A 66 0.685 4.436 11.917 1.00 75.41 H new ATOM 0 HG11 VAL A 66 -0.932 5.684 10.502 1.00 1.14 H new ATOM 0 HG12 VAL A 66 0.742 6.238 10.260 1.00 1.14 H new ATOM 0 HG13 VAL A 66 -0.031 5.184 9.051 1.00 1.14 H new ATOM 0 HG21 VAL A 66 -1.424 3.343 11.125 1.00 54.31 H new ATOM 0 HG22 VAL A 66 -0.542 2.689 9.724 1.00 54.31 H new ATOM 0 HG23 VAL A 66 -0.114 2.164 11.370 1.00 54.31 H new ATOM 1148 N SER A 67 3.756 5.011 11.449 1.00 31.32 N ATOM 1149 CA SER A 67 4.735 6.083 11.684 1.00 20.10 C ATOM 1150 C SER A 67 5.947 5.975 10.738 1.00 51.22 C ATOM 1151 O SER A 67 6.522 6.991 10.336 1.00 44.14 O ATOM 1152 CB SER A 67 5.191 6.016 13.156 1.00 12.41 C ATOM 1153 OG SER A 67 4.070 6.015 14.025 1.00 11.22 O ATOM 0 H SER A 67 3.713 4.338 12.214 1.00 31.32 H new ATOM 0 HA SER A 67 4.261 7.043 11.478 1.00 20.10 H new ATOM 0 HB2 SER A 67 5.785 5.116 13.318 1.00 12.41 H new ATOM 0 HB3 SER A 67 5.833 6.867 13.383 1.00 12.41 H new ATOM 0 HG SER A 67 4.377 5.970 14.955 1.00 11.22 H new ATOM 1159 N LYS A 68 6.311 4.731 10.375 1.00 74.12 N ATOM 1160 CA LYS A 68 7.492 4.448 9.534 1.00 3.33 C ATOM 1161 C LYS A 68 7.184 4.664 8.039 1.00 71.14 C ATOM 1162 O LYS A 68 8.106 4.768 7.225 1.00 25.35 O ATOM 1163 CB LYS A 68 7.979 2.991 9.775 1.00 24.22 C ATOM 1164 CG LYS A 68 8.356 2.672 11.240 1.00 1.21 C ATOM 1165 CD LYS A 68 9.622 3.402 11.733 1.00 14.13 C ATOM 1166 CE LYS A 68 9.856 3.240 13.252 1.00 54.41 C ATOM 1167 NZ LYS A 68 9.954 1.817 13.685 1.00 71.42 N ATOM 0 H LYS A 68 5.797 3.895 10.655 1.00 74.12 H new ATOM 0 HA LYS A 68 8.281 5.144 9.816 1.00 3.33 H new ATOM 0 HB2 LYS A 68 7.196 2.303 9.457 1.00 24.22 H new ATOM 0 HB3 LYS A 68 8.846 2.802 9.141 1.00 24.22 H new ATOM 0 HG2 LYS A 68 7.520 2.939 11.886 1.00 1.21 H new ATOM 0 HG3 LYS A 68 8.506 1.597 11.340 1.00 1.21 H new ATOM 0 HD2 LYS A 68 10.489 3.020 11.194 1.00 14.13 H new ATOM 0 HD3 LYS A 68 9.540 4.462 11.494 1.00 14.13 H new ATOM 0 HE2 LYS A 68 10.773 3.761 13.529 1.00 54.41 H new ATOM 0 HE3 LYS A 68 9.040 3.721 13.792 1.00 54.41 H new ATOM 0 HZ1 LYS A 68 10.357 1.773 14.643 1.00 71.42 H new ATOM 0 HZ2 LYS A 68 9.006 1.389 13.688 1.00 71.42 H new ATOM 0 HZ3 LYS A 68 10.567 1.295 13.027 1.00 71.42 H new ATOM 1181 N ILE A 69 5.885 4.730 7.692 1.00 72.22 N ATOM 1182 CA ILE A 69 5.435 4.809 6.294 1.00 74.10 C ATOM 1183 C ILE A 69 5.768 6.186 5.678 1.00 31.21 C ATOM 1184 O ILE A 69 5.335 7.232 6.175 1.00 45.51 O ATOM 1185 CB ILE A 69 3.903 4.494 6.145 1.00 61.34 C ATOM 1186 CG1 ILE A 69 3.566 3.083 6.735 1.00 5.23 C ATOM 1187 CG2 ILE A 69 3.464 4.588 4.663 1.00 33.43 C ATOM 1188 CD1 ILE A 69 2.088 2.697 6.686 1.00 31.34 C ATOM 0 H ILE A 69 5.123 4.730 8.370 1.00 72.22 H new ATOM 0 HA ILE A 69 5.981 4.042 5.744 1.00 74.10 H new ATOM 0 HB ILE A 69 3.347 5.241 6.712 1.00 61.34 H new ATOM 0 HG12 ILE A 69 4.140 2.332 6.192 1.00 5.23 H new ATOM 0 HG13 ILE A 69 3.900 3.051 7.772 1.00 5.23 H new ATOM 0 HG21 ILE A 69 2.400 4.366 4.584 1.00 33.43 H new ATOM 0 HG22 ILE A 69 3.653 5.595 4.291 1.00 33.43 H new ATOM 0 HG23 ILE A 69 4.030 3.869 4.070 1.00 33.43 H new ATOM 0 HD11 ILE A 69 1.957 1.704 7.117 1.00 31.34 H new ATOM 0 HD12 ILE A 69 1.504 3.420 7.255 1.00 31.34 H new ATOM 0 HD13 ILE A 69 1.748 2.691 5.650 1.00 31.34 H new ATOM 1200 N LYS A 70 6.564 6.142 4.602 1.00 21.04 N ATOM 1201 CA LYS A 70 6.992 7.323 3.839 1.00 63.32 C ATOM 1202 C LYS A 70 5.874 7.827 2.902 1.00 75.44 C ATOM 1203 O LYS A 70 5.713 9.035 2.711 1.00 1.24 O ATOM 1204 CB LYS A 70 8.236 6.973 2.984 1.00 32.21 C ATOM 1205 CG LYS A 70 9.461 6.451 3.773 1.00 52.25 C ATOM 1206 CD LYS A 70 10.696 6.255 2.855 1.00 64.52 C ATOM 1207 CE LYS A 70 11.938 5.744 3.602 1.00 65.43 C ATOM 1208 NZ LYS A 70 12.345 6.649 4.712 1.00 31.43 N ATOM 0 H LYS A 70 6.936 5.268 4.230 1.00 21.04 H new ATOM 0 HA LYS A 70 7.230 8.110 4.555 1.00 63.32 H new ATOM 0 HB2 LYS A 70 7.950 6.219 2.250 1.00 32.21 H new ATOM 0 HB3 LYS A 70 8.535 7.862 2.429 1.00 32.21 H new ATOM 0 HG2 LYS A 70 9.707 7.154 4.569 1.00 52.25 H new ATOM 0 HG3 LYS A 70 9.209 5.504 4.251 1.00 52.25 H new ATOM 0 HD2 LYS A 70 10.442 5.550 2.063 1.00 64.52 H new ATOM 0 HD3 LYS A 70 10.935 7.203 2.374 1.00 64.52 H new ATOM 0 HE2 LYS A 70 11.735 4.751 4.003 1.00 65.43 H new ATOM 0 HE3 LYS A 70 12.765 5.641 2.899 1.00 65.43 H new ATOM 0 HZ1 LYS A 70 12.721 6.084 5.500 1.00 31.43 H new ATOM 0 HZ2 LYS A 70 13.079 7.304 4.374 1.00 31.43 H new ATOM 0 HZ3 LYS A 70 11.520 7.192 5.038 1.00 31.43 H new ATOM 1222 N CYS A 71 5.114 6.882 2.323 1.00 41.11 N ATOM 1223 CA CYS A 71 4.137 7.169 1.255 1.00 11.22 C ATOM 1224 C CYS A 71 3.139 6.006 1.090 1.00 35.44 C ATOM 1225 O CYS A 71 3.528 4.844 1.160 1.00 41.13 O ATOM 1226 CB CYS A 71 4.855 7.437 -0.105 1.00 4.53 C ATOM 1227 SG CYS A 71 5.811 8.969 -0.170 1.00 12.05 S ATOM 0 H CYS A 71 5.159 5.896 2.581 1.00 41.11 H new ATOM 0 HA CYS A 71 3.590 8.065 1.548 1.00 11.22 H new ATOM 0 HB2 CYS A 71 5.521 6.601 -0.319 1.00 4.53 H new ATOM 0 HB3 CYS A 71 4.106 7.459 -0.897 1.00 4.53 H new ATOM 0 HG CYS A 71 5.948 9.447 1.031 1.00 12.05 H new ATOM 1233 N VAL A 72 1.850 6.338 0.908 1.00 1.54 N ATOM 1234 CA VAL A 72 0.818 5.413 0.404 1.00 2.21 C ATOM 1235 C VAL A 72 0.018 6.136 -0.675 1.00 61.32 C ATOM 1236 O VAL A 72 -0.563 7.201 -0.422 1.00 44.34 O ATOM 1237 CB VAL A 72 -0.191 4.879 1.493 1.00 54.24 C ATOM 1238 CG1 VAL A 72 -1.287 3.997 0.826 1.00 21.52 C ATOM 1239 CG2 VAL A 72 0.539 4.090 2.599 1.00 44.51 C ATOM 0 H VAL A 72 1.489 7.270 1.110 1.00 1.54 H new ATOM 0 HA VAL A 72 1.351 4.538 0.032 1.00 2.21 H new ATOM 0 HB VAL A 72 -0.667 5.741 1.961 1.00 54.24 H new ATOM 0 HG11 VAL A 72 -1.977 3.635 1.589 1.00 21.52 H new ATOM 0 HG12 VAL A 72 -1.835 4.590 0.093 1.00 21.52 H new ATOM 0 HG13 VAL A 72 -0.818 3.148 0.329 1.00 21.52 H new ATOM 0 HG21 VAL A 72 -0.186 3.737 3.333 1.00 44.51 H new ATOM 0 HG22 VAL A 72 1.054 3.237 2.158 1.00 44.51 H new ATOM 0 HG23 VAL A 72 1.265 4.738 3.090 1.00 44.51 H new ATOM 1249 N GLU A 73 -0.026 5.537 -1.853 1.00 23.00 N ATOM 1250 CA GLU A 73 -0.754 6.065 -2.996 1.00 43.10 C ATOM 1251 C GLU A 73 -1.181 4.878 -3.869 1.00 5.24 C ATOM 1252 O GLU A 73 -0.748 3.739 -3.625 1.00 52.22 O ATOM 1253 CB GLU A 73 0.149 7.077 -3.767 1.00 4.33 C ATOM 1254 CG GLU A 73 -0.562 7.896 -4.863 1.00 15.01 C ATOM 1255 CD GLU A 73 -1.788 8.672 -4.360 1.00 35.22 C ATOM 1256 OE1 GLU A 73 -1.612 9.773 -3.796 1.00 30.42 O ATOM 1257 OE2 GLU A 73 -2.934 8.197 -4.546 1.00 44.01 O ATOM 0 H GLU A 73 0.451 4.656 -2.046 1.00 23.00 H new ATOM 0 HA GLU A 73 -1.647 6.609 -2.687 1.00 43.10 H new ATOM 0 HB2 GLU A 73 0.587 7.768 -3.047 1.00 4.33 H new ATOM 0 HB3 GLU A 73 0.972 6.528 -4.224 1.00 4.33 H new ATOM 0 HG2 GLU A 73 0.149 8.600 -5.296 1.00 15.01 H new ATOM 0 HG3 GLU A 73 -0.872 7.223 -5.662 1.00 15.01 H new ATOM 1264 N ILE A 74 -2.056 5.123 -4.862 1.00 32.23 N ATOM 1265 CA ILE A 74 -2.413 4.100 -5.856 1.00 72.15 C ATOM 1266 C ILE A 74 -1.171 3.776 -6.707 1.00 63.50 C ATOM 1267 O ILE A 74 -0.255 4.615 -6.844 1.00 61.32 O ATOM 1268 CB ILE A 74 -3.632 4.521 -6.798 1.00 22.35 C ATOM 1269 CG1 ILE A 74 -3.224 5.427 -8.029 1.00 30.51 C ATOM 1270 CG2 ILE A 74 -4.741 5.212 -5.969 1.00 34.43 C ATOM 1271 CD1 ILE A 74 -2.754 6.843 -7.708 1.00 41.21 C ATOM 0 H ILE A 74 -2.526 6.018 -4.995 1.00 32.23 H new ATOM 0 HA ILE A 74 -2.749 3.220 -5.308 1.00 72.15 H new ATOM 0 HB ILE A 74 -4.007 3.591 -7.226 1.00 22.35 H new ATOM 0 HG12 ILE A 74 -2.430 4.920 -8.577 1.00 30.51 H new ATOM 0 HG13 ILE A 74 -4.080 5.496 -8.700 1.00 30.51 H new ATOM 0 HG21 ILE A 74 -5.565 5.493 -6.626 1.00 34.43 H new ATOM 0 HG22 ILE A 74 -5.104 4.526 -5.204 1.00 34.43 H new ATOM 0 HG23 ILE A 74 -4.336 6.105 -5.493 1.00 34.43 H new ATOM 0 HD11 ILE A 74 -2.504 7.362 -8.633 1.00 41.21 H new ATOM 0 HD12 ILE A 74 -3.549 7.382 -7.193 1.00 41.21 H new ATOM 0 HD13 ILE A 74 -1.873 6.798 -7.068 1.00 41.21 H new ATOM 1283 N VAL A 75 -1.150 2.586 -7.282 1.00 41.35 N ATOM 1284 CA VAL A 75 -0.112 2.193 -8.226 1.00 33.43 C ATOM 1285 C VAL A 75 -0.671 2.470 -9.611 1.00 0.54 C ATOM 1286 O VAL A 75 -1.605 1.775 -10.042 1.00 73.02 O ATOM 1287 CB VAL A 75 0.287 0.672 -8.126 1.00 62.41 C ATOM 1288 CG1 VAL A 75 1.431 0.321 -9.112 1.00 34.24 C ATOM 1289 CG2 VAL A 75 0.670 0.297 -6.692 1.00 33.31 C ATOM 0 H VAL A 75 -1.850 1.864 -7.110 1.00 41.35 H new ATOM 0 HA VAL A 75 0.795 2.756 -8.006 1.00 33.43 H new ATOM 0 HB VAL A 75 -0.587 0.085 -8.408 1.00 62.41 H new ATOM 0 HG11 VAL A 75 1.682 -0.736 -9.017 1.00 34.24 H new ATOM 0 HG12 VAL A 75 1.108 0.527 -10.132 1.00 34.24 H new ATOM 0 HG13 VAL A 75 2.309 0.924 -8.881 1.00 34.24 H new ATOM 0 HG21 VAL A 75 0.941 -0.758 -6.652 1.00 33.31 H new ATOM 0 HG22 VAL A 75 1.518 0.902 -6.372 1.00 33.31 H new ATOM 0 HG23 VAL A 75 -0.176 0.480 -6.030 1.00 33.31 H new ATOM 1299 N LYS A 76 -0.168 3.522 -10.272 1.00 43.42 N ATOM 1300 CA LYS A 76 -0.503 3.797 -11.667 1.00 60.41 C ATOM 1301 C LYS A 76 0.047 2.635 -12.502 1.00 74.15 C ATOM 1302 O LYS A 76 1.234 2.586 -12.817 1.00 64.34 O ATOM 1303 CB LYS A 76 0.088 5.163 -12.098 1.00 50.25 C ATOM 1304 CG LYS A 76 -0.487 6.367 -11.310 1.00 70.45 C ATOM 1305 CD LYS A 76 0.203 7.704 -11.670 1.00 62.45 C ATOM 1306 CE LYS A 76 0.064 8.093 -13.152 1.00 55.52 C ATOM 1307 NZ LYS A 76 0.718 9.400 -13.454 1.00 52.04 N ATOM 0 H LYS A 76 0.475 4.196 -9.856 1.00 43.42 H new ATOM 0 HA LYS A 76 -1.581 3.869 -11.814 1.00 60.41 H new ATOM 0 HB2 LYS A 76 1.170 5.138 -11.968 1.00 50.25 H new ATOM 0 HB3 LYS A 76 -0.102 5.312 -13.161 1.00 50.25 H new ATOM 0 HG2 LYS A 76 -1.555 6.449 -11.510 1.00 70.45 H new ATOM 0 HG3 LYS A 76 -0.376 6.182 -10.241 1.00 70.45 H new ATOM 0 HD2 LYS A 76 -0.219 8.498 -11.054 1.00 62.45 H new ATOM 0 HD3 LYS A 76 1.262 7.635 -11.419 1.00 62.45 H new ATOM 0 HE2 LYS A 76 0.507 7.315 -13.774 1.00 55.52 H new ATOM 0 HE3 LYS A 76 -0.993 8.148 -13.414 1.00 55.52 H new ATOM 0 HZ1 LYS A 76 0.542 9.655 -14.447 1.00 52.04 H new ATOM 0 HZ2 LYS A 76 0.326 10.136 -12.833 1.00 52.04 H new ATOM 0 HZ3 LYS A 76 1.742 9.321 -13.294 1.00 52.04 H new ATOM 1382 N ILE A 82 -1.839 -7.042 -15.688 1.00 5.03 N ATOM 1383 CA ILE A 82 -1.864 -7.432 -14.269 1.00 61.52 C ATOM 1384 C ILE A 82 -1.884 -8.972 -14.225 1.00 23.32 C ATOM 1385 O ILE A 82 -2.787 -9.585 -14.809 1.00 64.33 O ATOM 1386 CB ILE A 82 -3.127 -6.852 -13.505 1.00 42.51 C ATOM 1387 CG1 ILE A 82 -3.101 -5.283 -13.439 1.00 23.14 C ATOM 1388 CG2 ILE A 82 -3.260 -7.465 -12.083 1.00 23.34 C ATOM 1389 CD1 ILE A 82 -1.974 -4.676 -12.609 1.00 43.03 C ATOM 0 HA ILE A 82 -0.987 -7.024 -13.767 1.00 61.52 H new ATOM 0 HB ILE A 82 -4.007 -7.141 -14.080 1.00 42.51 H new ATOM 0 HG12 ILE A 82 -3.029 -4.896 -14.455 1.00 23.14 H new ATOM 0 HG13 ILE A 82 -4.052 -4.939 -13.034 1.00 23.14 H new ATOM 0 HG21 ILE A 82 -4.135 -7.046 -11.587 1.00 23.34 H new ATOM 0 HG22 ILE A 82 -3.370 -8.547 -12.162 1.00 23.34 H new ATOM 0 HG23 ILE A 82 -2.368 -7.233 -11.502 1.00 23.34 H new ATOM 0 HD11 ILE A 82 -2.050 -3.589 -12.631 1.00 43.03 H new ATOM 0 HD12 ILE A 82 -2.052 -5.024 -11.579 1.00 43.03 H new ATOM 0 HD13 ILE A 82 -1.013 -4.981 -13.023 1.00 43.03 H new ATOM 1401 N PRO A 83 -0.904 -9.638 -13.544 1.00 10.13 N ATOM 1402 CA PRO A 83 -0.853 -11.119 -13.474 1.00 0.14 C ATOM 1403 C PRO A 83 -1.733 -11.713 -12.338 1.00 12.24 C ATOM 1404 O PRO A 83 -1.357 -12.725 -11.719 1.00 21.13 O ATOM 1405 CB PRO A 83 0.653 -11.361 -13.231 1.00 35.11 C ATOM 1406 CG PRO A 83 1.079 -10.210 -12.368 1.00 31.42 C ATOM 1407 CD PRO A 83 0.252 -9.017 -12.824 1.00 71.50 C ATOM 0 HA PRO A 83 -1.250 -11.606 -14.365 1.00 0.14 H new ATOM 0 HB2 PRO A 83 0.827 -12.316 -12.735 1.00 35.11 H new ATOM 0 HB3 PRO A 83 1.209 -11.382 -14.168 1.00 35.11 H new ATOM 0 HG2 PRO A 83 0.904 -10.426 -11.314 1.00 31.42 H new ATOM 0 HG3 PRO A 83 2.145 -10.012 -12.480 1.00 31.42 H new ATOM 0 HD2 PRO A 83 -0.080 -8.414 -11.979 1.00 71.50 H new ATOM 0 HD3 PRO A 83 0.825 -8.360 -13.479 1.00 71.50 H new ATOM 1415 N CYS A 84 -2.922 -11.115 -12.106 1.00 40.30 N ATOM 1416 CA CYS A 84 -3.830 -11.534 -11.026 1.00 11.52 C ATOM 1417 C CYS A 84 -5.278 -11.069 -11.288 1.00 22.23 C ATOM 1418 O CYS A 84 -5.515 -10.110 -12.046 1.00 50.51 O ATOM 1419 CB CYS A 84 -3.333 -11.002 -9.667 1.00 44.53 C ATOM 1420 SG CYS A 84 -4.237 -11.684 -8.275 1.00 32.34 S ATOM 0 H CYS A 84 -3.274 -10.334 -12.660 1.00 40.30 H new ATOM 0 HA CYS A 84 -3.831 -12.624 -11.000 1.00 11.52 H new ATOM 0 HB2 CYS A 84 -2.274 -11.237 -9.556 1.00 44.53 H new ATOM 0 HB3 CYS A 84 -3.422 -9.916 -9.654 1.00 44.53 H new ATOM 0 HG CYS A 84 -3.403 -12.231 -7.442 1.00 32.34 H new ATOM 1426 N GLN A 85 -6.232 -11.776 -10.639 1.00 55.23 N ATOM 1427 CA GLN A 85 -7.675 -11.477 -10.689 1.00 74.03 C ATOM 1428 C GLN A 85 -7.970 -10.053 -10.163 1.00 52.13 C ATOM 1429 O GLN A 85 -8.742 -9.302 -10.775 1.00 20.40 O ATOM 1430 CB GLN A 85 -8.469 -12.544 -9.872 1.00 33.43 C ATOM 1431 CG GLN A 85 -8.026 -12.688 -8.395 1.00 61.30 C ATOM 1432 CD GLN A 85 -8.823 -13.717 -7.588 1.00 0.40 C ATOM 1433 OE1 GLN A 85 -9.334 -14.698 -8.129 1.00 14.02 O ATOM 1434 NE2 GLN A 85 -8.916 -13.513 -6.287 1.00 64.14 N ATOM 0 H GLN A 85 -6.012 -12.584 -10.057 1.00 55.23 H new ATOM 0 HA GLN A 85 -7.999 -11.517 -11.729 1.00 74.03 H new ATOM 0 HB2 GLN A 85 -9.528 -12.287 -9.896 1.00 33.43 H new ATOM 0 HB3 GLN A 85 -8.365 -13.511 -10.365 1.00 33.43 H new ATOM 0 HG2 GLN A 85 -6.972 -12.964 -8.371 1.00 61.30 H new ATOM 0 HG3 GLN A 85 -8.112 -11.717 -7.907 1.00 61.30 H new ATOM 0 HE21 GLN A 85 -8.482 -12.691 -5.867 1.00 64.14 H new ATOM 0 HE22 GLN A 85 -9.422 -14.178 -5.701 1.00 64.14 H new ATOM 1443 N ASN A 86 -7.327 -9.686 -9.037 1.00 15.44 N ATOM 1444 CA ASN A 86 -7.448 -8.348 -8.444 1.00 43.20 C ATOM 1445 C ASN A 86 -6.458 -7.415 -9.133 1.00 60.11 C ATOM 1446 O ASN A 86 -5.345 -7.824 -9.487 1.00 31.01 O ATOM 1447 CB ASN A 86 -7.197 -8.371 -6.914 1.00 72.33 C ATOM 1448 CG ASN A 86 -8.219 -9.201 -6.131 1.00 12.41 C ATOM 1449 OD1 ASN A 86 -9.203 -9.705 -6.681 1.00 22.14 O ATOM 1450 ND2 ASN A 86 -8.015 -9.313 -4.824 1.00 40.15 N ATOM 0 H ASN A 86 -6.711 -10.311 -8.517 1.00 15.44 H new ATOM 0 HA ASN A 86 -8.467 -7.990 -8.593 1.00 43.20 H new ATOM 0 HB2 ASN A 86 -6.200 -8.768 -6.725 1.00 72.33 H new ATOM 0 HB3 ASN A 86 -7.209 -7.348 -6.538 1.00 72.33 H new ATOM 0 HD21 ASN A 86 -8.681 -9.826 -4.246 1.00 40.15 H new ATOM 0 HD22 ASN A 86 -7.193 -8.886 -4.398 1.00 40.15 H new ATOM 1457 N LYS A 87 -6.877 -6.170 -9.317 1.00 3.12 N ATOM 1458 CA LYS A 87 -6.132 -5.166 -10.077 1.00 1.32 C ATOM 1459 C LYS A 87 -6.530 -3.771 -9.618 1.00 52.24 C ATOM 1460 O LYS A 87 -7.430 -3.622 -8.771 1.00 11.31 O ATOM 1461 CB LYS A 87 -6.374 -5.362 -11.597 1.00 74.34 C ATOM 1462 CG LYS A 87 -7.858 -5.482 -12.009 1.00 31.22 C ATOM 1463 CD LYS A 87 -8.035 -5.806 -13.509 1.00 71.22 C ATOM 1464 CE LYS A 87 -7.256 -7.069 -13.932 1.00 35.44 C ATOM 1465 NZ LYS A 87 -7.588 -8.256 -13.096 1.00 3.25 N ATOM 0 H LYS A 87 -7.757 -5.821 -8.938 1.00 3.12 H new ATOM 0 HA LYS A 87 -5.064 -5.286 -9.894 1.00 1.32 H new ATOM 0 HB2 LYS A 87 -5.930 -4.522 -12.132 1.00 74.34 H new ATOM 0 HB3 LYS A 87 -5.848 -6.260 -11.921 1.00 74.34 H new ATOM 0 HG2 LYS A 87 -8.334 -6.262 -11.414 1.00 31.22 H new ATOM 0 HG3 LYS A 87 -8.371 -4.548 -11.780 1.00 31.22 H new ATOM 0 HD2 LYS A 87 -9.094 -5.946 -13.726 1.00 71.22 H new ATOM 0 HD3 LYS A 87 -7.697 -4.957 -14.104 1.00 71.22 H new ATOM 0 HE2 LYS A 87 -7.474 -7.293 -14.976 1.00 35.44 H new ATOM 0 HE3 LYS A 87 -6.186 -6.870 -13.865 1.00 35.44 H new ATOM 0 HZ1 LYS A 87 -6.731 -8.589 -12.610 1.00 3.25 H new ATOM 0 HZ2 LYS A 87 -8.306 -7.994 -12.391 1.00 3.25 H new ATOM 0 HZ3 LYS A 87 -7.959 -9.015 -13.702 1.00 3.25 H new ATOM 1479 N TYR A 88 -5.873 -2.762 -10.229 1.00 22.13 N ATOM 1480 CA TYR A 88 -5.888 -1.373 -9.760 1.00 64.31 C ATOM 1481 C TYR A 88 -5.401 -1.339 -8.294 1.00 65.23 C ATOM 1482 O TYR A 88 -6.190 -1.091 -7.384 1.00 73.14 O ATOM 1483 CB TYR A 88 -7.291 -0.726 -9.940 1.00 63.30 C ATOM 1484 CG TYR A 88 -7.797 -0.731 -11.394 1.00 45.14 C ATOM 1485 CD1 TYR A 88 -8.539 -1.801 -11.908 1.00 72.31 C ATOM 1486 CD2 TYR A 88 -7.523 0.332 -12.255 1.00 72.42 C ATOM 1487 CE1 TYR A 88 -8.982 -1.807 -13.218 1.00 62.21 C ATOM 1488 CE2 TYR A 88 -7.968 0.329 -13.565 1.00 22.10 C ATOM 1489 CZ TYR A 88 -8.698 -0.742 -14.041 1.00 21.35 C ATOM 1490 OH TYR A 88 -9.146 -0.750 -15.348 1.00 20.22 O ATOM 0 H TYR A 88 -5.313 -2.898 -11.071 1.00 22.13 H new ATOM 0 HA TYR A 88 -5.208 -0.773 -10.365 1.00 64.31 H new ATOM 0 HB2 TYR A 88 -8.008 -1.257 -9.314 1.00 63.30 H new ATOM 0 HB3 TYR A 88 -7.255 0.303 -9.581 1.00 63.30 H new ATOM 0 HD1 TYR A 88 -8.770 -2.640 -11.268 1.00 72.31 H new ATOM 0 HD2 TYR A 88 -6.952 1.174 -11.892 1.00 72.42 H new ATOM 0 HE1 TYR A 88 -9.549 -2.646 -13.594 1.00 62.21 H new ATOM 0 HE2 TYR A 88 -7.745 1.163 -14.214 1.00 22.10 H new ATOM 0 HH TYR A 88 -8.863 0.075 -15.796 1.00 20.22 H new ATOM 1500 N PRO A 89 -4.090 -1.671 -8.049 1.00 71.30 N ATOM 1501 CA PRO A 89 -3.555 -1.871 -6.686 1.00 13.52 C ATOM 1502 C PRO A 89 -3.100 -0.564 -6.017 1.00 32.24 C ATOM 1503 O PRO A 89 -3.118 0.502 -6.642 1.00 71.44 O ATOM 1504 CB PRO A 89 -2.362 -2.810 -6.944 1.00 72.11 C ATOM 1505 CG PRO A 89 -1.838 -2.408 -8.295 1.00 63.32 C ATOM 1506 CD PRO A 89 -3.025 -1.867 -9.081 1.00 2.35 C ATOM 0 HA PRO A 89 -4.301 -2.267 -5.997 1.00 13.52 H new ATOM 0 HB2 PRO A 89 -1.598 -2.698 -6.175 1.00 72.11 H new ATOM 0 HB3 PRO A 89 -2.673 -3.855 -6.936 1.00 72.11 H new ATOM 0 HG2 PRO A 89 -1.060 -1.651 -8.199 1.00 63.32 H new ATOM 0 HG3 PRO A 89 -1.391 -3.261 -8.806 1.00 63.32 H new ATOM 0 HD2 PRO A 89 -2.778 -0.931 -9.581 1.00 2.35 H new ATOM 0 HD3 PRO A 89 -3.343 -2.567 -9.854 1.00 2.35 H new ATOM 1514 N PHE A 90 -2.737 -0.654 -4.730 1.00 42.33 N ATOM 1515 CA PHE A 90 -2.075 0.436 -3.999 1.00 45.30 C ATOM 1516 C PHE A 90 -0.742 -0.065 -3.455 1.00 52.11 C ATOM 1517 O PHE A 90 -0.500 -1.276 -3.377 1.00 4.40 O ATOM 1518 CB PHE A 90 -2.965 0.998 -2.857 1.00 1.41 C ATOM 1519 CG PHE A 90 -3.283 0.040 -1.699 1.00 74.43 C ATOM 1520 CD1 PHE A 90 -4.271 -0.944 -1.826 1.00 52.00 C ATOM 1521 CD2 PHE A 90 -2.618 0.147 -0.471 1.00 63.42 C ATOM 1522 CE1 PHE A 90 -4.578 -1.782 -0.771 1.00 5.51 C ATOM 1523 CE2 PHE A 90 -2.927 -0.698 0.576 1.00 11.14 C ATOM 1524 CZ PHE A 90 -3.905 -1.657 0.427 1.00 12.32 C ATOM 0 H PHE A 90 -2.895 -1.488 -4.164 1.00 42.33 H new ATOM 0 HA PHE A 90 -1.902 1.260 -4.691 1.00 45.30 H new ATOM 0 HB2 PHE A 90 -2.474 1.880 -2.445 1.00 1.41 H new ATOM 0 HB3 PHE A 90 -3.907 1.332 -3.292 1.00 1.41 H new ATOM 0 HD1 PHE A 90 -4.800 -1.049 -2.761 1.00 52.00 H new ATOM 0 HD2 PHE A 90 -1.854 0.900 -0.342 1.00 63.42 H new ATOM 0 HE1 PHE A 90 -5.344 -2.534 -0.884 1.00 5.51 H new ATOM 0 HE2 PHE A 90 -2.401 -0.607 1.515 1.00 11.14 H new ATOM 0 HZ PHE A 90 -4.146 -2.313 1.251 1.00 12.32 H new ATOM 1534 N GLN A 91 0.120 0.879 -3.093 1.00 74.34 N ATOM 1535 CA GLN A 91 1.462 0.600 -2.587 1.00 4.34 C ATOM 1536 C GLN A 91 1.654 1.286 -1.238 1.00 72.45 C ATOM 1537 O GLN A 91 1.093 2.362 -0.988 1.00 70.23 O ATOM 1538 CB GLN A 91 2.522 1.082 -3.611 1.00 25.22 C ATOM 1539 CG GLN A 91 2.456 2.579 -3.969 1.00 72.40 C ATOM 1540 CD GLN A 91 3.467 2.978 -5.042 1.00 65.33 C ATOM 1541 OE1 GLN A 91 3.165 2.952 -6.234 1.00 51.01 O ATOM 1542 NE2 GLN A 91 4.684 3.310 -4.628 1.00 63.43 N ATOM 0 H GLN A 91 -0.096 1.875 -3.143 1.00 74.34 H new ATOM 0 HA GLN A 91 1.585 -0.474 -2.449 1.00 4.34 H new ATOM 0 HB2 GLN A 91 3.513 0.863 -3.214 1.00 25.22 H new ATOM 0 HB3 GLN A 91 2.410 0.501 -4.526 1.00 25.22 H new ATOM 0 HG2 GLN A 91 1.451 2.821 -4.316 1.00 72.40 H new ATOM 0 HG3 GLN A 91 2.634 3.170 -3.071 1.00 72.40 H new ATOM 0 HE21 GLN A 91 4.898 3.321 -3.631 1.00 63.43 H new ATOM 0 HE22 GLN A 91 5.405 3.554 -5.307 1.00 63.43 H new ATOM 1551 N VAL A 92 2.459 0.655 -0.382 1.00 54.40 N ATOM 1552 CA VAL A 92 2.817 1.173 0.930 1.00 64.14 C ATOM 1553 C VAL A 92 4.344 1.243 0.982 1.00 32.21 C ATOM 1554 O VAL A 92 5.017 0.229 1.210 1.00 51.20 O ATOM 1555 CB VAL A 92 2.263 0.253 2.092 1.00 13.41 C ATOM 1556 CG1 VAL A 92 2.673 0.787 3.488 1.00 72.10 C ATOM 1557 CG2 VAL A 92 0.726 0.083 1.986 1.00 65.04 C ATOM 0 H VAL A 92 2.886 -0.248 -0.590 1.00 54.40 H new ATOM 0 HA VAL A 92 2.373 2.157 1.077 1.00 64.14 H new ATOM 0 HB VAL A 92 2.717 -0.731 1.974 1.00 13.41 H new ATOM 0 HG11 VAL A 92 2.274 0.129 4.261 1.00 72.10 H new ATOM 0 HG12 VAL A 92 3.760 0.816 3.562 1.00 72.10 H new ATOM 0 HG13 VAL A 92 2.273 1.792 3.625 1.00 72.10 H new ATOM 0 HG21 VAL A 92 0.374 -0.554 2.797 1.00 65.04 H new ATOM 0 HG22 VAL A 92 0.246 1.059 2.056 1.00 65.04 H new ATOM 0 HG23 VAL A 92 0.476 -0.376 1.030 1.00 65.04 H new ATOM 1567 N VAL A 93 4.886 2.437 0.727 1.00 13.42 N ATOM 1568 CA VAL A 93 6.316 2.703 0.847 1.00 23.33 C ATOM 1569 C VAL A 93 6.588 3.046 2.304 1.00 30.35 C ATOM 1570 O VAL A 93 6.227 4.129 2.760 1.00 1.31 O ATOM 1571 CB VAL A 93 6.801 3.898 -0.060 1.00 5.04 C ATOM 1572 CG1 VAL A 93 8.348 3.976 -0.076 1.00 41.51 C ATOM 1573 CG2 VAL A 93 6.215 3.815 -1.485 1.00 63.33 C ATOM 0 H VAL A 93 4.341 3.247 0.431 1.00 13.42 H new ATOM 0 HA VAL A 93 6.861 1.819 0.516 1.00 23.33 H new ATOM 0 HB VAL A 93 6.423 4.823 0.376 1.00 5.04 H new ATOM 0 HG11 VAL A 93 8.664 4.807 -0.707 1.00 41.51 H new ATOM 0 HG12 VAL A 93 8.715 4.131 0.939 1.00 41.51 H new ATOM 0 HG13 VAL A 93 8.755 3.045 -0.471 1.00 41.51 H new ATOM 0 HG21 VAL A 93 6.575 4.657 -2.076 1.00 63.33 H new ATOM 0 HG22 VAL A 93 6.529 2.882 -1.954 1.00 63.33 H new ATOM 0 HG23 VAL A 93 5.127 3.847 -1.433 1.00 63.33 H new ATOM 1583 N HIS A 94 7.165 2.104 3.030 1.00 31.53 N ATOM 1584 CA HIS A 94 7.553 2.284 4.438 1.00 41.32 C ATOM 1585 C HIS A 94 9.081 2.396 4.543 1.00 52.30 C ATOM 1586 O HIS A 94 9.791 2.175 3.552 1.00 70.12 O ATOM 1587 CB HIS A 94 6.963 1.150 5.327 1.00 32.44 C ATOM 1588 CG HIS A 94 7.265 -0.263 4.870 1.00 34.23 C ATOM 1589 ND1 HIS A 94 8.148 -1.099 5.520 1.00 54.34 N ATOM 1590 CD2 HIS A 94 6.758 -0.999 3.840 1.00 13.23 C ATOM 1591 CE1 HIS A 94 8.172 -2.267 4.917 1.00 22.51 C ATOM 1592 NE2 HIS A 94 7.340 -2.234 3.903 1.00 4.40 N ATOM 0 H HIS A 94 7.384 1.178 2.663 1.00 31.53 H new ATOM 0 HA HIS A 94 7.131 3.215 4.818 1.00 41.32 H new ATOM 0 HB2 HIS A 94 7.342 1.274 6.342 1.00 32.44 H new ATOM 0 HB3 HIS A 94 5.881 1.275 5.373 1.00 32.44 H new ATOM 0 HD2 HIS A 94 6.033 -0.668 3.111 1.00 13.23 H new ATOM 0 HE1 HIS A 94 8.776 -3.113 5.208 1.00 22.51 H new ATOM 0 HE2 HIS A 94 7.157 -3.007 3.263 1.00 4.40 H new ATOM 1601 N ASP A 95 9.572 2.735 5.753 1.00 32.35 N ATOM 1602 CA ASP A 95 10.984 3.115 5.994 1.00 64.41 C ATOM 1603 C ASP A 95 11.976 1.988 5.635 1.00 40.04 C ATOM 1604 O ASP A 95 13.139 2.247 5.308 1.00 14.00 O ATOM 1605 CB ASP A 95 11.166 3.591 7.461 1.00 22.44 C ATOM 1606 CG ASP A 95 12.550 4.211 7.731 1.00 44.24 C ATOM 1607 OD1 ASP A 95 12.797 5.356 7.284 1.00 14.13 O ATOM 1608 OD2 ASP A 95 13.382 3.576 8.413 1.00 22.11 O ATOM 0 H ASP A 95 8.999 2.754 6.596 1.00 32.35 H new ATOM 0 HA ASP A 95 11.219 3.943 5.325 1.00 64.41 H new ATOM 0 HB2 ASP A 95 10.395 4.324 7.697 1.00 22.44 H new ATOM 0 HB3 ASP A 95 11.017 2.745 8.132 1.00 22.44 H new ATOM 1613 N ALA A 96 11.493 0.742 5.681 1.00 3.32 N ATOM 1614 CA ALA A 96 12.286 -0.434 5.304 1.00 31.33 C ATOM 1615 C ALA A 96 12.368 -0.596 3.770 1.00 33.21 C ATOM 1616 O ALA A 96 13.467 -0.692 3.209 1.00 42.21 O ATOM 1617 CB ALA A 96 11.695 -1.686 5.963 1.00 1.21 C ATOM 0 H ALA A 96 10.543 0.520 5.980 1.00 3.32 H new ATOM 0 HA ALA A 96 13.306 -0.294 5.662 1.00 31.33 H new ATOM 0 HB1 ALA A 96 12.285 -2.558 5.682 1.00 1.21 H new ATOM 0 HB2 ALA A 96 11.713 -1.570 7.047 1.00 1.21 H new ATOM 0 HB3 ALA A 96 10.666 -1.821 5.630 1.00 1.21 H new ATOM 1623 N ASN A 97 11.193 -0.590 3.099 1.00 73.31 N ATOM 1624 CA ASN A 97 11.080 -0.901 1.649 1.00 11.14 C ATOM 1625 C ASN A 97 9.671 -0.539 1.120 1.00 21.20 C ATOM 1626 O ASN A 97 8.882 0.075 1.835 1.00 0.10 O ATOM 1627 CB ASN A 97 11.385 -2.410 1.400 1.00 12.43 C ATOM 1628 CG ASN A 97 10.316 -3.337 1.986 1.00 0.24 C ATOM 1629 OD1 ASN A 97 10.335 -3.660 3.173 1.00 73.30 O ATOM 1630 ND2 ASN A 97 9.371 -3.757 1.168 1.00 11.42 N ATOM 0 H ASN A 97 10.300 -0.371 3.541 1.00 73.31 H new ATOM 0 HA ASN A 97 11.811 -0.301 1.107 1.00 11.14 H new ATOM 0 HB2 ASN A 97 11.465 -2.588 0.328 1.00 12.43 H new ATOM 0 HB3 ASN A 97 12.353 -2.657 1.837 1.00 12.43 H new ATOM 0 HD21 ASN A 97 8.630 -4.366 1.515 1.00 11.42 H new ATOM 0 HD22 ASN A 97 9.381 -3.473 0.188 1.00 11.42 H new ATOM 1637 N THR A 98 9.363 -0.938 -0.137 1.00 64.21 N ATOM 1638 CA THR A 98 8.041 -0.707 -0.762 1.00 41.20 C ATOM 1639 C THR A 98 7.263 -2.042 -0.932 1.00 63.21 C ATOM 1640 O THR A 98 7.738 -2.966 -1.605 1.00 31.22 O ATOM 1641 CB THR A 98 8.198 -0.005 -2.155 1.00 62.12 C ATOM 1642 OG1 THR A 98 9.032 1.160 -2.015 1.00 44.05 O ATOM 1643 CG2 THR A 98 6.837 0.414 -2.749 1.00 22.45 C ATOM 0 H THR A 98 10.022 -1.427 -0.743 1.00 64.21 H new ATOM 0 HA THR A 98 7.474 -0.054 -0.099 1.00 41.20 H new ATOM 0 HB THR A 98 8.655 -0.723 -2.836 1.00 62.12 H new ATOM 0 HG1 THR A 98 9.131 1.598 -2.886 1.00 44.05 H new ATOM 0 HG21 THR A 98 6.994 0.896 -3.714 1.00 22.45 H new ATOM 0 HG22 THR A 98 6.211 -0.468 -2.882 1.00 22.45 H new ATOM 0 HG23 THR A 98 6.343 1.111 -2.071 1.00 22.45 H new ATOM 1651 N LEU A 99 6.077 -2.122 -0.304 1.00 43.33 N ATOM 1652 CA LEU A 99 5.147 -3.278 -0.413 1.00 24.41 C ATOM 1653 C LEU A 99 4.024 -2.947 -1.426 1.00 52.42 C ATOM 1654 O LEU A 99 3.626 -1.788 -1.544 1.00 52.44 O ATOM 1655 CB LEU A 99 4.554 -3.610 0.996 1.00 42.54 C ATOM 1656 CG LEU A 99 3.462 -4.744 1.082 1.00 53.41 C ATOM 1657 CD1 LEU A 99 3.965 -6.099 0.531 1.00 65.34 C ATOM 1658 CD2 LEU A 99 2.941 -4.891 2.533 1.00 64.55 C ATOM 0 H LEU A 99 5.726 -1.381 0.303 1.00 43.33 H new ATOM 0 HA LEU A 99 5.686 -4.154 -0.773 1.00 24.41 H new ATOM 0 HB2 LEU A 99 5.380 -3.889 1.650 1.00 42.54 H new ATOM 0 HB3 LEU A 99 4.121 -2.696 1.402 1.00 42.54 H new ATOM 0 HG LEU A 99 2.634 -4.438 0.443 1.00 53.41 H new ATOM 0 HD11 LEU A 99 3.173 -6.843 0.615 1.00 65.34 H new ATOM 0 HD12 LEU A 99 4.246 -5.984 -0.516 1.00 65.34 H new ATOM 0 HD13 LEU A 99 4.832 -6.426 1.105 1.00 65.34 H new ATOM 0 HD21 LEU A 99 2.188 -5.678 2.571 1.00 64.55 H new ATOM 0 HD22 LEU A 99 3.770 -5.149 3.193 1.00 64.55 H new ATOM 0 HD23 LEU A 99 2.498 -3.950 2.858 1.00 64.55 H new ATOM 1670 N TYR A 100 3.542 -3.963 -2.172 1.00 35.35 N ATOM 1671 CA TYR A 100 2.447 -3.810 -3.164 1.00 70.01 C ATOM 1672 C TYR A 100 1.287 -4.723 -2.803 1.00 42.32 C ATOM 1673 O TYR A 100 1.485 -5.914 -2.527 1.00 72.35 O ATOM 1674 CB TYR A 100 2.948 -4.100 -4.597 1.00 52.34 C ATOM 1675 CG TYR A 100 3.875 -2.998 -5.096 1.00 50.21 C ATOM 1676 CD1 TYR A 100 3.359 -1.886 -5.757 1.00 64.03 C ATOM 1677 CD2 TYR A 100 5.246 -3.030 -4.844 1.00 74.13 C ATOM 1678 CE1 TYR A 100 4.170 -0.849 -6.146 1.00 1.10 C ATOM 1679 CE2 TYR A 100 6.057 -2.001 -5.240 1.00 41.44 C ATOM 1680 CZ TYR A 100 5.512 -0.911 -5.885 1.00 32.01 C ATOM 1681 OH TYR A 100 6.324 0.129 -6.251 1.00 33.53 O ATOM 0 H TYR A 100 3.899 -4.916 -2.106 1.00 35.35 H new ATOM 0 HA TYR A 100 2.101 -2.777 -3.139 1.00 70.01 H new ATOM 0 HB2 TYR A 100 3.473 -5.055 -4.614 1.00 52.34 H new ATOM 0 HB3 TYR A 100 2.096 -4.193 -5.270 1.00 52.34 H new ATOM 0 HD1 TYR A 100 2.301 -1.839 -5.968 1.00 64.03 H new ATOM 0 HD2 TYR A 100 5.674 -3.878 -4.330 1.00 74.13 H new ATOM 0 HE1 TYR A 100 3.753 0.008 -6.653 1.00 1.10 H new ATOM 0 HE2 TYR A 100 7.119 -2.043 -5.048 1.00 41.44 H new ATOM 0 HH TYR A 100 5.954 0.570 -7.044 1.00 33.53 H new ATOM 1691 N ILE A 101 0.074 -4.144 -2.804 1.00 61.22 N ATOM 1692 CA ILE A 101 -1.137 -4.786 -2.296 1.00 71.23 C ATOM 1693 C ILE A 101 -2.310 -4.560 -3.289 1.00 10.04 C ATOM 1694 O ILE A 101 -2.731 -3.420 -3.501 1.00 73.31 O ATOM 1695 CB ILE A 101 -1.516 -4.220 -0.866 1.00 31.32 C ATOM 1696 CG1 ILE A 101 -0.288 -4.213 0.110 1.00 21.05 C ATOM 1697 CG2 ILE A 101 -2.668 -5.038 -0.258 1.00 63.34 C ATOM 1698 CD1 ILE A 101 -0.550 -3.600 1.481 1.00 44.11 C ATOM 0 H ILE A 101 -0.088 -3.204 -3.164 1.00 61.22 H new ATOM 0 HA ILE A 101 -0.949 -5.855 -2.201 1.00 71.23 H new ATOM 0 HB ILE A 101 -1.835 -3.186 -1.000 1.00 31.32 H new ATOM 0 HG12 ILE A 101 0.052 -5.240 0.248 1.00 21.05 H new ATOM 0 HG13 ILE A 101 0.529 -3.668 -0.364 1.00 21.05 H new ATOM 0 HG21 ILE A 101 -2.919 -4.639 0.725 1.00 63.34 H new ATOM 0 HG22 ILE A 101 -3.541 -4.976 -0.908 1.00 63.34 H new ATOM 0 HG23 ILE A 101 -2.362 -6.080 -0.159 1.00 63.34 H new ATOM 0 HD11 ILE A 101 0.360 -3.644 2.079 1.00 44.11 H new ATOM 0 HD12 ILE A 101 -0.857 -2.561 1.362 1.00 44.11 H new ATOM 0 HD13 ILE A 101 -1.341 -4.157 1.983 1.00 44.11 H new ATOM 1710 N PHE A 102 -2.820 -5.657 -3.894 1.00 44.03 N ATOM 1711 CA PHE A 102 -3.915 -5.617 -4.892 1.00 52.30 C ATOM 1712 C PHE A 102 -5.270 -5.825 -4.193 1.00 74.24 C ATOM 1713 O PHE A 102 -5.484 -6.845 -3.539 1.00 72.34 O ATOM 1714 CB PHE A 102 -3.700 -6.711 -5.989 1.00 11.11 C ATOM 1715 CG PHE A 102 -2.474 -6.508 -6.895 1.00 31.13 C ATOM 1716 CD1 PHE A 102 -1.180 -6.422 -6.365 1.00 53.21 C ATOM 1717 CD2 PHE A 102 -2.616 -6.397 -8.284 1.00 63.14 C ATOM 1718 CE1 PHE A 102 -0.084 -6.229 -7.186 1.00 73.51 C ATOM 1719 CE2 PHE A 102 -1.515 -6.207 -9.099 1.00 24.53 C ATOM 1720 CZ PHE A 102 -0.252 -6.126 -8.552 1.00 1.10 C ATOM 0 H PHE A 102 -2.482 -6.600 -3.703 1.00 44.03 H new ATOM 0 HA PHE A 102 -3.910 -4.640 -5.375 1.00 52.30 H new ATOM 0 HB2 PHE A 102 -3.611 -7.680 -5.498 1.00 11.11 H new ATOM 0 HB3 PHE A 102 -4.591 -6.752 -6.616 1.00 11.11 H new ATOM 0 HD1 PHE A 102 -1.036 -6.508 -5.298 1.00 53.21 H new ATOM 0 HD2 PHE A 102 -3.600 -6.461 -8.725 1.00 63.14 H new ATOM 0 HE1 PHE A 102 0.905 -6.159 -6.758 1.00 73.51 H new ATOM 0 HE2 PHE A 102 -1.645 -6.122 -10.168 1.00 24.53 H new ATOM 0 HZ PHE A 102 0.606 -5.982 -9.192 1.00 1.10 H new ATOM 1730 N ALA A 103 -6.179 -4.859 -4.348 1.00 11.15 N ATOM 1731 CA ALA A 103 -7.501 -4.892 -3.697 1.00 13.13 C ATOM 1732 C ALA A 103 -8.542 -5.598 -4.594 1.00 3.03 C ATOM 1733 O ALA A 103 -8.413 -5.538 -5.826 1.00 25.14 O ATOM 1734 CB ALA A 103 -7.946 -3.462 -3.369 1.00 3.20 C ATOM 0 H ALA A 103 -6.025 -4.032 -4.925 1.00 11.15 H new ATOM 0 HA ALA A 103 -7.424 -5.462 -2.771 1.00 13.13 H new ATOM 0 HB1 ALA A 103 -8.924 -3.487 -2.888 1.00 3.20 H new ATOM 0 HB2 ALA A 103 -7.222 -3.001 -2.697 1.00 3.20 H new ATOM 0 HB3 ALA A 103 -8.009 -2.881 -4.289 1.00 3.20 H new ATOM 1740 N PRO A 104 -9.609 -6.253 -3.997 1.00 70.00 N ATOM 1741 CA PRO A 104 -10.683 -6.955 -4.773 1.00 21.53 C ATOM 1742 C PRO A 104 -11.418 -6.033 -5.761 1.00 53.45 C ATOM 1743 O PRO A 104 -12.016 -6.502 -6.735 1.00 24.20 O ATOM 1744 CB PRO A 104 -11.645 -7.488 -3.672 1.00 21.25 C ATOM 1745 CG PRO A 104 -11.338 -6.657 -2.462 1.00 63.12 C ATOM 1746 CD PRO A 104 -9.852 -6.386 -2.532 1.00 41.43 C ATOM 0 HA PRO A 104 -10.271 -7.742 -5.405 1.00 21.53 H new ATOM 0 HB2 PRO A 104 -12.688 -7.381 -3.972 1.00 21.25 H new ATOM 0 HB3 PRO A 104 -11.476 -8.547 -3.478 1.00 21.25 H new ATOM 0 HG2 PRO A 104 -11.908 -5.728 -2.468 1.00 63.12 H new ATOM 0 HG3 PRO A 104 -11.599 -7.186 -1.545 1.00 63.12 H new ATOM 0 HD2 PRO A 104 -9.581 -5.478 -1.993 1.00 41.43 H new ATOM 0 HD3 PRO A 104 -9.272 -7.200 -2.098 1.00 41.43 H new ATOM 1754 N SER A 105 -11.363 -4.721 -5.487 1.00 14.14 N ATOM 1755 CA SER A 105 -11.990 -3.690 -6.314 1.00 75.04 C ATOM 1756 C SER A 105 -11.107 -2.418 -6.333 1.00 44.53 C ATOM 1757 O SER A 105 -10.437 -2.127 -5.337 1.00 15.51 O ATOM 1758 CB SER A 105 -13.397 -3.363 -5.749 1.00 11.35 C ATOM 1759 OG SER A 105 -14.231 -4.510 -5.717 1.00 15.14 O ATOM 0 H SER A 105 -10.875 -4.346 -4.674 1.00 14.14 H new ATOM 0 HA SER A 105 -12.092 -4.055 -7.336 1.00 75.04 H new ATOM 0 HB2 SER A 105 -13.299 -2.957 -4.742 1.00 11.35 H new ATOM 0 HB3 SER A 105 -13.864 -2.591 -6.361 1.00 11.35 H new ATOM 0 HG SER A 105 -15.108 -4.267 -5.354 1.00 15.14 H new ATOM 1765 N PRO A 106 -11.113 -1.618 -7.461 1.00 64.22 N ATOM 1766 CA PRO A 106 -10.550 -0.226 -7.480 1.00 61.31 C ATOM 1767 C PRO A 106 -11.288 0.726 -6.508 1.00 34.34 C ATOM 1768 O PRO A 106 -10.783 1.803 -6.186 1.00 24.10 O ATOM 1769 CB PRO A 106 -10.740 0.226 -8.957 1.00 13.54 C ATOM 1770 CG PRO A 106 -11.799 -0.685 -9.511 1.00 43.32 C ATOM 1771 CD PRO A 106 -11.597 -2.014 -8.815 1.00 30.01 C ATOM 0 HA PRO A 106 -9.511 -0.203 -7.151 1.00 61.31 H new ATOM 0 HB2 PRO A 106 -11.049 1.270 -9.013 1.00 13.54 H new ATOM 0 HB3 PRO A 106 -9.810 0.138 -9.519 1.00 13.54 H new ATOM 0 HG2 PRO A 106 -12.796 -0.289 -9.319 1.00 43.32 H new ATOM 0 HG3 PRO A 106 -11.700 -0.789 -10.592 1.00 43.32 H new ATOM 0 HD2 PRO A 106 -12.524 -2.585 -8.760 1.00 30.01 H new ATOM 0 HD3 PRO A 106 -10.870 -2.636 -9.337 1.00 30.01 H new ATOM 1779 N GLN A 107 -12.464 0.275 -6.024 1.00 51.23 N ATOM 1780 CA GLN A 107 -13.291 1.013 -5.062 1.00 52.00 C ATOM 1781 C GLN A 107 -12.702 0.784 -3.663 1.00 74.02 C ATOM 1782 O GLN A 107 -12.459 1.733 -2.901 1.00 15.22 O ATOM 1783 CB GLN A 107 -14.762 0.516 -5.112 1.00 21.21 C ATOM 1784 CG GLN A 107 -15.430 0.599 -6.493 1.00 53.21 C ATOM 1785 CD GLN A 107 -16.886 0.110 -6.480 1.00 43.20 C ATOM 1786 OE1 GLN A 107 -17.814 0.889 -6.258 1.00 44.43 O ATOM 1787 NE2 GLN A 107 -17.096 -1.185 -6.689 1.00 64.21 N ATOM 0 H GLN A 107 -12.865 -0.622 -6.297 1.00 51.23 H new ATOM 0 HA GLN A 107 -13.291 2.075 -5.306 1.00 52.00 H new ATOM 0 HB2 GLN A 107 -14.791 -0.519 -4.773 1.00 21.21 H new ATOM 0 HB3 GLN A 107 -15.351 1.100 -4.405 1.00 21.21 H new ATOM 0 HG2 GLN A 107 -15.401 1.630 -6.844 1.00 53.21 H new ATOM 0 HG3 GLN A 107 -14.858 0.004 -7.205 1.00 53.21 H new ATOM 0 HE21 GLN A 107 -16.308 -1.807 -6.871 1.00 64.21 H new ATOM 0 HE22 GLN A 107 -18.045 -1.558 -6.668 1.00 64.21 H new ATOM 1796 N SER A 108 -12.438 -0.515 -3.375 1.00 14.42 N ATOM 1797 CA SER A 108 -11.816 -0.977 -2.130 1.00 4.52 C ATOM 1798 C SER A 108 -10.433 -0.338 -1.969 1.00 21.50 C ATOM 1799 O SER A 108 -10.092 0.159 -0.893 1.00 43.34 O ATOM 1800 CB SER A 108 -11.699 -2.526 -2.150 1.00 30.50 C ATOM 1801 OG SER A 108 -11.076 -3.034 -0.976 1.00 24.15 O ATOM 0 H SER A 108 -12.659 -1.275 -4.018 1.00 14.42 H new ATOM 0 HA SER A 108 -12.436 -0.681 -1.284 1.00 4.52 H new ATOM 0 HB2 SER A 108 -12.693 -2.962 -2.249 1.00 30.50 H new ATOM 0 HB3 SER A 108 -11.127 -2.834 -3.025 1.00 30.50 H new ATOM 0 HG SER A 108 -11.024 -4.011 -1.030 1.00 24.15 H new ATOM 1807 N ARG A 109 -9.674 -0.311 -3.087 1.00 32.13 N ATOM 1808 CA ARG A 109 -8.309 0.223 -3.128 1.00 64.04 C ATOM 1809 C ARG A 109 -8.292 1.722 -2.835 1.00 25.22 C ATOM 1810 O ARG A 109 -7.475 2.183 -2.045 1.00 12.00 O ATOM 1811 CB ARG A 109 -7.662 -0.065 -4.511 1.00 34.23 C ATOM 1812 CG ARG A 109 -6.176 0.382 -4.632 1.00 72.22 C ATOM 1813 CD ARG A 109 -5.972 1.780 -5.252 1.00 25.33 C ATOM 1814 NE ARG A 109 -6.159 1.780 -6.713 1.00 23.15 N ATOM 1815 CZ ARG A 109 -7.107 2.451 -7.386 1.00 60.25 C ATOM 1816 NH1 ARG A 109 -7.995 3.207 -6.750 1.00 2.52 N ATOM 1817 NH2 ARG A 109 -7.126 2.380 -8.704 1.00 24.41 N ATOM 0 H ARG A 109 -10.000 -0.663 -3.987 1.00 32.13 H new ATOM 0 HA ARG A 109 -7.727 -0.276 -2.353 1.00 64.04 H new ATOM 0 HB2 ARG A 109 -7.724 -1.135 -4.712 1.00 34.23 H new ATOM 0 HB3 ARG A 109 -8.244 0.439 -5.283 1.00 34.23 H new ATOM 0 HG2 ARG A 109 -5.725 0.370 -3.640 1.00 72.22 H new ATOM 0 HG3 ARG A 109 -5.638 -0.350 -5.235 1.00 72.22 H new ATOM 0 HD2 ARG A 109 -6.673 2.481 -4.799 1.00 25.33 H new ATOM 0 HD3 ARG A 109 -4.969 2.136 -5.017 1.00 25.33 H new ATOM 0 HE ARG A 109 -5.509 1.219 -7.264 1.00 23.15 H new ATOM 0 HH11 ARG A 109 -7.964 3.285 -5.733 1.00 2.52 H new ATOM 0 HH12 ARG A 109 -8.708 3.710 -7.278 1.00 2.52 H new ATOM 0 HH21 ARG A 109 -6.428 1.822 -9.195 1.00 24.41 H new ATOM 0 HH22 ARG A 109 -7.839 2.883 -9.232 1.00 24.41 H new ATOM 1831 N ASP A 110 -9.196 2.460 -3.503 1.00 1.44 N ATOM 1832 CA ASP A 110 -9.303 3.926 -3.375 1.00 52.24 C ATOM 1833 C ASP A 110 -9.588 4.333 -1.917 1.00 12.22 C ATOM 1834 O ASP A 110 -9.081 5.352 -1.437 1.00 3.04 O ATOM 1835 CB ASP A 110 -10.400 4.456 -4.330 1.00 61.11 C ATOM 1836 CG ASP A 110 -10.531 5.989 -4.308 1.00 12.14 C ATOM 1837 OD1 ASP A 110 -9.559 6.678 -4.685 1.00 14.15 O ATOM 1838 OD2 ASP A 110 -11.592 6.509 -3.907 1.00 53.44 O ATOM 0 H ASP A 110 -9.875 2.057 -4.149 1.00 1.44 H new ATOM 0 HA ASP A 110 -8.351 4.375 -3.657 1.00 52.24 H new ATOM 0 HB2 ASP A 110 -10.177 4.131 -5.346 1.00 61.11 H new ATOM 0 HB3 ASP A 110 -11.357 4.012 -4.056 1.00 61.11 H new ATOM 1843 N LEU A 111 -10.376 3.486 -1.218 1.00 74.15 N ATOM 1844 CA LEU A 111 -10.681 3.674 0.207 1.00 25.23 C ATOM 1845 C LEU A 111 -9.445 3.363 1.081 1.00 33.41 C ATOM 1846 O LEU A 111 -9.174 4.094 2.019 1.00 74.52 O ATOM 1847 CB LEU A 111 -11.888 2.805 0.654 1.00 42.31 C ATOM 1848 CG LEU A 111 -12.374 3.039 2.127 1.00 71.24 C ATOM 1849 CD1 LEU A 111 -12.827 4.504 2.346 1.00 71.23 C ATOM 1850 CD2 LEU A 111 -13.484 2.042 2.517 1.00 13.23 C ATOM 0 H LEU A 111 -10.813 2.660 -1.628 1.00 74.15 H new ATOM 0 HA LEU A 111 -10.952 4.721 0.344 1.00 25.23 H new ATOM 0 HB2 LEU A 111 -12.722 2.997 -0.021 1.00 42.31 H new ATOM 0 HB3 LEU A 111 -11.620 1.755 0.540 1.00 42.31 H new ATOM 0 HG LEU A 111 -11.525 2.858 2.786 1.00 71.24 H new ATOM 0 HD11 LEU A 111 -13.158 4.632 3.377 1.00 71.23 H new ATOM 0 HD12 LEU A 111 -11.993 5.177 2.146 1.00 71.23 H new ATOM 0 HD13 LEU A 111 -13.650 4.735 1.670 1.00 71.23 H new ATOM 0 HD21 LEU A 111 -13.799 2.231 3.543 1.00 13.23 H new ATOM 0 HD22 LEU A 111 -14.336 2.166 1.848 1.00 13.23 H new ATOM 0 HD23 LEU A 111 -13.103 1.024 2.436 1.00 13.23 H new ATOM 1862 N TRP A 112 -8.712 2.268 0.768 1.00 1.43 N ATOM 1863 CA TRP A 112 -7.468 1.899 1.491 1.00 44.14 C ATOM 1864 C TRP A 112 -6.376 2.981 1.380 1.00 45.12 C ATOM 1865 O TRP A 112 -5.670 3.240 2.362 1.00 1.43 O ATOM 1866 CB TRP A 112 -6.918 0.524 1.002 1.00 32.42 C ATOM 1867 CG TRP A 112 -7.521 -0.657 1.725 1.00 30.45 C ATOM 1868 CD1 TRP A 112 -8.567 -1.432 1.327 1.00 4.11 C ATOM 1869 CD2 TRP A 112 -7.094 -1.183 2.991 1.00 61.24 C ATOM 1870 NE1 TRP A 112 -8.836 -2.385 2.272 1.00 0.33 N ATOM 1871 CE2 TRP A 112 -7.937 -2.261 3.301 1.00 43.41 C ATOM 1872 CE3 TRP A 112 -6.077 -0.841 3.892 1.00 61.00 C ATOM 1873 CZ2 TRP A 112 -7.797 -3.007 4.471 1.00 34.22 C ATOM 1874 CZ3 TRP A 112 -5.937 -1.584 5.051 1.00 2.30 C ATOM 1875 CH2 TRP A 112 -6.794 -2.656 5.332 1.00 20.31 C ATOM 0 H TRP A 112 -8.960 1.623 0.018 1.00 1.43 H new ATOM 0 HA TRP A 112 -7.738 1.816 2.544 1.00 44.14 H new ATOM 0 HB2 TRP A 112 -7.111 0.423 -0.066 1.00 32.42 H new ATOM 0 HB3 TRP A 112 -5.836 0.507 1.133 1.00 32.42 H new ATOM 0 HD1 TRP A 112 -9.107 -1.312 0.399 1.00 4.11 H new ATOM 0 HE1 TRP A 112 -9.584 -3.076 2.220 1.00 0.33 H new ATOM 0 HE3 TRP A 112 -5.415 -0.013 3.686 1.00 61.00 H new ATOM 0 HZ2 TRP A 112 -8.458 -3.833 4.690 1.00 34.22 H new ATOM 0 HZ3 TRP A 112 -5.154 -1.333 5.751 1.00 2.30 H new ATOM 0 HH2 TRP A 112 -6.660 -3.216 6.246 1.00 20.31 H new ATOM 1886 N VAL A 113 -6.247 3.603 0.192 1.00 41.15 N ATOM 1887 CA VAL A 113 -5.304 4.713 -0.022 1.00 43.42 C ATOM 1888 C VAL A 113 -5.706 5.897 0.862 1.00 3.34 C ATOM 1889 O VAL A 113 -4.868 6.448 1.555 1.00 33.00 O ATOM 1890 CB VAL A 113 -5.244 5.154 -1.536 1.00 0.32 C ATOM 1891 CG1 VAL A 113 -4.330 6.387 -1.749 1.00 3.14 C ATOM 1892 CG2 VAL A 113 -4.784 3.980 -2.424 1.00 30.05 C ATOM 0 H VAL A 113 -6.787 3.353 -0.636 1.00 41.15 H new ATOM 0 HA VAL A 113 -4.307 4.369 0.251 1.00 43.42 H new ATOM 0 HB VAL A 113 -6.253 5.445 -1.828 1.00 0.32 H new ATOM 0 HG11 VAL A 113 -4.320 6.654 -2.806 1.00 3.14 H new ATOM 0 HG12 VAL A 113 -4.710 7.226 -1.166 1.00 3.14 H new ATOM 0 HG13 VAL A 113 -3.317 6.149 -1.425 1.00 3.14 H new ATOM 0 HG21 VAL A 113 -4.749 4.303 -3.464 1.00 30.05 H new ATOM 0 HG22 VAL A 113 -3.792 3.654 -2.111 1.00 30.05 H new ATOM 0 HG23 VAL A 113 -5.486 3.152 -2.325 1.00 30.05 H new ATOM 1902 N LYS A 114 -7.025 6.206 0.866 1.00 11.44 N ATOM 1903 CA LYS A 114 -7.632 7.284 1.672 1.00 45.32 C ATOM 1904 C LYS A 114 -7.284 7.101 3.155 1.00 22.33 C ATOM 1905 O LYS A 114 -6.728 8.005 3.774 1.00 5.23 O ATOM 1906 CB LYS A 114 -9.175 7.277 1.431 1.00 71.12 C ATOM 1907 CG LYS A 114 -10.002 8.430 2.075 1.00 41.41 C ATOM 1908 CD LYS A 114 -10.402 8.188 3.547 1.00 34.13 C ATOM 1909 CE LYS A 114 -11.247 9.340 4.118 1.00 71.51 C ATOM 1910 NZ LYS A 114 -10.570 10.666 4.002 1.00 34.55 N ATOM 0 H LYS A 114 -7.706 5.702 0.298 1.00 11.44 H new ATOM 0 HA LYS A 114 -7.235 8.253 1.370 1.00 45.32 H new ATOM 0 HB2 LYS A 114 -9.349 7.297 0.355 1.00 71.12 H new ATOM 0 HB3 LYS A 114 -9.570 6.331 1.800 1.00 71.12 H new ATOM 0 HG2 LYS A 114 -9.423 9.352 2.016 1.00 41.41 H new ATOM 0 HG3 LYS A 114 -10.907 8.583 1.487 1.00 41.41 H new ATOM 0 HD2 LYS A 114 -10.964 7.257 3.620 1.00 34.13 H new ATOM 0 HD3 LYS A 114 -9.503 8.066 4.151 1.00 34.13 H new ATOM 0 HE2 LYS A 114 -12.202 9.378 3.595 1.00 71.51 H new ATOM 0 HE3 LYS A 114 -11.466 9.139 5.167 1.00 71.51 H new ATOM 0 HZ1 LYS A 114 -10.547 11.127 4.934 1.00 34.55 H new ATOM 0 HZ2 LYS A 114 -9.598 10.531 3.659 1.00 34.55 H new ATOM 0 HZ3 LYS A 114 -11.093 11.265 3.332 1.00 34.55 H new ATOM 1924 N LYS A 115 -7.590 5.899 3.684 1.00 21.41 N ATOM 1925 CA LYS A 115 -7.375 5.560 5.097 1.00 74.55 C ATOM 1926 C LYS A 115 -5.908 5.787 5.503 1.00 61.24 C ATOM 1927 O LYS A 115 -5.622 6.545 6.432 1.00 34.22 O ATOM 1928 CB LYS A 115 -7.763 4.079 5.375 1.00 65.42 C ATOM 1929 CG LYS A 115 -9.250 3.731 5.156 1.00 52.41 C ATOM 1930 CD LYS A 115 -10.188 4.578 6.030 1.00 0.31 C ATOM 1931 CE LYS A 115 -11.659 4.172 5.914 1.00 44.54 C ATOM 1932 NZ LYS A 115 -12.517 5.037 6.762 1.00 20.23 N ATOM 0 H LYS A 115 -7.994 5.138 3.138 1.00 21.41 H new ATOM 0 HA LYS A 115 -8.012 6.215 5.691 1.00 74.55 H new ATOM 0 HB2 LYS A 115 -7.159 3.437 4.734 1.00 65.42 H new ATOM 0 HB3 LYS A 115 -7.499 3.840 6.405 1.00 65.42 H new ATOM 0 HG2 LYS A 115 -9.504 3.880 4.106 1.00 52.41 H new ATOM 0 HG3 LYS A 115 -9.409 2.675 5.376 1.00 52.41 H new ATOM 0 HD2 LYS A 115 -9.877 4.494 7.071 1.00 0.31 H new ATOM 0 HD3 LYS A 115 -10.085 5.626 5.750 1.00 0.31 H new ATOM 0 HE2 LYS A 115 -11.979 4.243 4.874 1.00 44.54 H new ATOM 0 HE3 LYS A 115 -11.777 3.131 6.213 1.00 44.54 H new ATOM 0 HZ1 LYS A 115 -13.510 4.742 6.666 1.00 20.23 H new ATOM 0 HZ2 LYS A 115 -12.224 4.949 7.756 1.00 20.23 H new ATOM 0 HZ3 LYS A 115 -12.419 6.027 6.459 1.00 20.23 H new ATOM 1946 N LEU A 116 -5.005 5.169 4.727 1.00 3.54 N ATOM 1947 CA LEU A 116 -3.569 5.157 5.002 1.00 54.03 C ATOM 1948 C LEU A 116 -2.946 6.564 4.887 1.00 74.42 C ATOM 1949 O LEU A 116 -2.287 6.993 5.819 1.00 13.34 O ATOM 1950 CB LEU A 116 -2.873 4.125 4.072 1.00 54.11 C ATOM 1951 CG LEU A 116 -3.042 2.615 4.470 1.00 33.41 C ATOM 1952 CD1 LEU A 116 -2.704 1.664 3.301 1.00 22.14 C ATOM 1953 CD2 LEU A 116 -2.173 2.287 5.701 1.00 31.13 C ATOM 0 H LEU A 116 -5.259 4.658 3.881 1.00 3.54 H new ATOM 0 HA LEU A 116 -3.412 4.850 6.036 1.00 54.03 H new ATOM 0 HB2 LEU A 116 -3.258 4.259 3.061 1.00 54.11 H new ATOM 0 HB3 LEU A 116 -1.808 4.355 4.040 1.00 54.11 H new ATOM 0 HG LEU A 116 -4.091 2.458 4.720 1.00 33.41 H new ATOM 0 HD11 LEU A 116 -2.835 0.631 3.623 1.00 22.14 H new ATOM 0 HD12 LEU A 116 -3.368 1.869 2.461 1.00 22.14 H new ATOM 0 HD13 LEU A 116 -1.670 1.820 2.993 1.00 22.14 H new ATOM 0 HD21 LEU A 116 -2.299 1.237 5.966 1.00 31.13 H new ATOM 0 HD22 LEU A 116 -1.126 2.479 5.468 1.00 31.13 H new ATOM 0 HD23 LEU A 116 -2.479 2.913 6.539 1.00 31.13 H new ATOM 1965 N LYS A 117 -3.170 7.279 3.757 1.00 1.40 N ATOM 1966 CA LYS A 117 -2.627 8.648 3.556 1.00 20.41 C ATOM 1967 C LYS A 117 -3.092 9.649 4.645 1.00 12.21 C ATOM 1968 O LYS A 117 -2.312 10.514 5.055 1.00 14.13 O ATOM 1969 CB LYS A 117 -2.924 9.196 2.129 1.00 62.50 C ATOM 1970 CG LYS A 117 -4.412 9.474 1.826 1.00 71.24 C ATOM 1971 CD LYS A 117 -4.677 9.896 0.360 1.00 72.53 C ATOM 1972 CE LYS A 117 -4.077 11.266 0.017 1.00 41.32 C ATOM 1973 NZ LYS A 117 -4.621 12.348 0.873 1.00 33.05 N ATOM 0 H LYS A 117 -3.721 6.932 2.972 1.00 1.40 H new ATOM 0 HA LYS A 117 -1.546 8.551 3.656 1.00 20.41 H new ATOM 0 HB2 LYS A 117 -2.363 10.120 1.988 1.00 62.50 H new ATOM 0 HB3 LYS A 117 -2.549 8.480 1.397 1.00 62.50 H new ATOM 0 HG2 LYS A 117 -4.993 8.579 2.048 1.00 71.24 H new ATOM 0 HG3 LYS A 117 -4.769 10.260 2.492 1.00 71.24 H new ATOM 0 HD2 LYS A 117 -4.261 9.144 -0.310 1.00 72.53 H new ATOM 0 HD3 LYS A 117 -5.752 9.921 0.183 1.00 72.53 H new ATOM 0 HE2 LYS A 117 -2.994 11.225 0.131 1.00 41.32 H new ATOM 0 HE3 LYS A 117 -4.278 11.497 -1.029 1.00 41.32 H new ATOM 0 HZ1 LYS A 117 -5.204 12.987 0.296 1.00 33.05 H new ATOM 0 HZ2 LYS A 117 -5.204 11.933 1.628 1.00 33.05 H new ATOM 0 HZ3 LYS A 117 -3.836 12.883 1.296 1.00 33.05 H new ATOM 1987 N GLU A 118 -4.348 9.506 5.130 1.00 24.43 N ATOM 1988 CA GLU A 118 -4.875 10.366 6.217 1.00 25.11 C ATOM 1989 C GLU A 118 -4.311 9.981 7.602 1.00 14.42 C ATOM 1990 O GLU A 118 -4.377 10.776 8.548 1.00 20.21 O ATOM 1991 CB GLU A 118 -6.420 10.363 6.231 1.00 10.43 C ATOM 1992 CG GLU A 118 -7.070 10.868 4.924 1.00 42.32 C ATOM 1993 CD GLU A 118 -6.561 12.241 4.448 1.00 21.44 C ATOM 1994 OE1 GLU A 118 -7.028 13.275 4.976 1.00 54.34 O ATOM 1995 OE2 GLU A 118 -5.710 12.297 3.525 1.00 13.21 O ATOM 0 H GLU A 118 -5.011 8.809 4.789 1.00 24.43 H new ATOM 0 HA GLU A 118 -4.534 11.380 6.006 1.00 25.11 H new ATOM 0 HB2 GLU A 118 -6.768 9.349 6.427 1.00 10.43 H new ATOM 0 HB3 GLU A 118 -6.765 10.984 7.058 1.00 10.43 H new ATOM 0 HG2 GLU A 118 -6.891 10.135 4.137 1.00 42.32 H new ATOM 0 HG3 GLU A 118 -8.149 10.924 5.068 1.00 42.32 H new ATOM 2002 N GLU A 119 -3.765 8.765 7.727 1.00 72.55 N ATOM 2003 CA GLU A 119 -3.056 8.339 8.945 1.00 61.43 C ATOM 2004 C GLU A 119 -1.584 8.785 8.905 1.00 41.13 C ATOM 2005 O GLU A 119 -1.061 9.329 9.882 1.00 71.12 O ATOM 2006 CB GLU A 119 -3.152 6.801 9.124 1.00 40.24 C ATOM 2007 CG GLU A 119 -4.559 6.279 9.471 1.00 32.20 C ATOM 2008 CD GLU A 119 -5.162 6.923 10.737 1.00 21.51 C ATOM 2009 OE1 GLU A 119 -4.537 6.844 11.816 1.00 31.23 O ATOM 2010 OE2 GLU A 119 -6.267 7.506 10.671 1.00 63.20 O ATOM 0 H GLU A 119 -3.800 8.054 6.997 1.00 72.55 H new ATOM 0 HA GLU A 119 -3.535 8.817 9.800 1.00 61.43 H new ATOM 0 HB2 GLU A 119 -2.818 6.321 8.204 1.00 40.24 H new ATOM 0 HB3 GLU A 119 -2.462 6.497 9.911 1.00 40.24 H new ATOM 0 HG2 GLU A 119 -5.224 6.464 8.628 1.00 32.20 H new ATOM 0 HG3 GLU A 119 -4.513 5.199 9.610 1.00 32.20 H new ATOM 2017 N ILE A 120 -0.928 8.581 7.754 1.00 51.32 N ATOM 2018 CA ILE A 120 0.526 8.780 7.620 1.00 42.33 C ATOM 2019 C ILE A 120 0.883 10.266 7.424 1.00 63.11 C ATOM 2020 O ILE A 120 2.056 10.617 7.438 1.00 53.00 O ATOM 2021 CB ILE A 120 1.144 7.923 6.451 1.00 5.11 C ATOM 2022 CG1 ILE A 120 0.725 8.476 5.055 1.00 44.12 C ATOM 2023 CG2 ILE A 120 0.760 6.429 6.598 1.00 32.21 C ATOM 2024 CD1 ILE A 120 1.368 7.775 3.873 1.00 11.33 C ATOM 0 H ILE A 120 -1.384 8.276 6.894 1.00 51.32 H new ATOM 0 HA ILE A 120 0.963 8.436 8.557 1.00 42.33 H new ATOM 0 HB ILE A 120 2.229 8.001 6.521 1.00 5.11 H new ATOM 0 HG12 ILE A 120 -0.358 8.399 4.960 1.00 44.12 H new ATOM 0 HG13 ILE A 120 0.974 9.536 5.010 1.00 44.12 H new ATOM 0 HG21 ILE A 120 1.198 5.858 5.779 1.00 32.21 H new ATOM 0 HG22 ILE A 120 1.136 6.048 7.548 1.00 32.21 H new ATOM 0 HG23 ILE A 120 -0.325 6.328 6.571 1.00 32.21 H new ATOM 0 HD11 ILE A 120 1.016 8.228 2.946 1.00 11.33 H new ATOM 0 HD12 ILE A 120 2.452 7.874 3.937 1.00 11.33 H new ATOM 0 HD13 ILE A 120 1.098 6.719 3.886 1.00 11.33 H new ATOM 2036 N LYS A 121 -0.128 11.142 7.271 1.00 32.53 N ATOM 2037 CA LYS A 121 0.113 12.595 7.169 1.00 41.03 C ATOM 2038 C LYS A 121 0.521 13.178 8.534 1.00 0.11 C ATOM 2039 O LYS A 121 0.956 14.327 8.622 1.00 61.21 O ATOM 2040 CB LYS A 121 -1.099 13.334 6.561 1.00 75.20 C ATOM 2041 CG LYS A 121 -2.408 13.259 7.361 1.00 52.21 C ATOM 2042 CD LYS A 121 -3.540 14.060 6.677 1.00 40.31 C ATOM 2043 CE LYS A 121 -4.864 13.973 7.442 1.00 61.21 C ATOM 2044 NZ LYS A 121 -4.738 14.409 8.852 1.00 23.30 N ATOM 0 H LYS A 121 -1.110 10.873 7.216 1.00 32.53 H new ATOM 0 HA LYS A 121 0.946 12.750 6.483 1.00 41.03 H new ATOM 0 HB2 LYS A 121 -0.833 14.384 6.436 1.00 75.20 H new ATOM 0 HB3 LYS A 121 -1.282 12.931 5.565 1.00 75.20 H new ATOM 0 HG2 LYS A 121 -2.711 12.217 7.467 1.00 52.21 H new ATOM 0 HG3 LYS A 121 -2.243 13.647 8.366 1.00 52.21 H new ATOM 0 HD2 LYS A 121 -3.241 15.105 6.592 1.00 40.31 H new ATOM 0 HD3 LYS A 121 -3.684 13.686 5.663 1.00 40.31 H new ATOM 0 HE2 LYS A 121 -5.610 14.589 6.940 1.00 61.21 H new ATOM 0 HE3 LYS A 121 -5.228 12.946 7.414 1.00 61.21 H new ATOM 0 HZ1 LYS A 121 -5.683 14.476 9.280 1.00 23.30 H new ATOM 0 HZ2 LYS A 121 -4.167 13.718 9.379 1.00 23.30 H new ATOM 0 HZ3 LYS A 121 -4.275 15.339 8.888 1.00 23.30 H new ATOM 2058 N ASN A 122 0.368 12.357 9.594 1.00 31.41 N ATOM 2059 CA ASN A 122 0.837 12.678 10.951 1.00 63.10 C ATOM 2060 C ASN A 122 2.370 12.462 11.087 1.00 15.11 C ATOM 2061 O ASN A 122 2.957 12.856 12.097 1.00 25.51 O ATOM 2062 CB ASN A 122 0.091 11.803 12.004 1.00 11.34 C ATOM 2063 CG ASN A 122 -1.442 11.858 11.897 1.00 50.42 C ATOM 2064 OD1 ASN A 122 -2.026 12.819 11.380 1.00 71.03 O ATOM 2065 ND2 ASN A 122 -2.109 10.838 12.416 1.00 3.01 N ATOM 0 H ASN A 122 -0.088 11.447 9.528 1.00 31.41 H new ATOM 0 HA ASN A 122 0.620 13.730 11.134 1.00 63.10 H new ATOM 0 HB2 ASN A 122 0.415 10.768 11.895 1.00 11.34 H new ATOM 0 HB3 ASN A 122 0.386 12.125 13.002 1.00 11.34 H new ATOM 0 HD21 ASN A 122 -3.129 10.832 12.395 1.00 3.01 H new ATOM 0 HD22 ASN A 122 -1.603 10.058 12.836 1.00 3.01 H new ATOM 2072 N ASN A 123 3.003 11.836 10.065 1.00 61.52 N ATOM 2073 CA ASN A 123 4.448 11.468 10.093 1.00 33.35 C ATOM 2074 C ASN A 123 5.356 12.643 9.700 1.00 62.22 C ATOM 2075 O ASN A 123 4.900 13.667 9.183 1.00 45.33 O ATOM 2076 CB ASN A 123 4.761 10.284 9.129 1.00 45.23 C ATOM 2077 CG ASN A 123 3.926 9.041 9.368 1.00 45.45 C ATOM 2078 OD1 ASN A 123 3.404 8.818 10.454 1.00 52.51 O ATOM 2079 ND2 ASN A 123 3.809 8.215 8.350 1.00 45.14 N ATOM 0 H ASN A 123 2.532 11.571 9.200 1.00 61.52 H new ATOM 0 HA ASN A 123 4.652 11.177 11.123 1.00 33.35 H new ATOM 0 HB2 ASN A 123 4.608 10.617 8.103 1.00 45.23 H new ATOM 0 HB3 ASN A 123 5.815 10.023 9.225 1.00 45.23 H new ATOM 0 HD21 ASN A 123 3.269 7.355 8.450 1.00 45.14 H new ATOM 0 HD22 ASN A 123 4.258 8.435 7.461 1.00 45.14 H new ATOM 2086 N ASN A 124 6.657 12.446 9.940 1.00 54.21 N ATOM 2087 CA ASN A 124 7.744 13.316 9.448 1.00 32.14 C ATOM 2088 C ASN A 124 8.704 12.488 8.559 1.00 63.11 C ATOM 2089 O ASN A 124 9.811 12.932 8.237 1.00 32.50 O ATOM 2090 CB ASN A 124 8.489 13.942 10.656 1.00 13.22 C ATOM 2091 CG ASN A 124 9.194 12.909 11.543 1.00 74.03 C ATOM 2092 OD1 ASN A 124 8.580 12.307 12.428 1.00 33.34 O ATOM 2093 ND2 ASN A 124 10.486 12.703 11.322 1.00 13.25 N ATOM 0 H ASN A 124 6.997 11.660 10.494 1.00 54.21 H new ATOM 0 HA ASN A 124 7.335 14.126 8.844 1.00 32.14 H new ATOM 0 HB2 ASN A 124 9.226 14.656 10.288 1.00 13.22 H new ATOM 0 HB3 ASN A 124 7.777 14.503 11.261 1.00 13.22 H new ATOM 0 HD21 ASN A 124 11.000 12.031 11.892 1.00 13.25 H new ATOM 0 HD22 ASN A 124 10.965 13.217 10.582 1.00 13.25 H new ATOM 2100 N ASN A 125 8.253 11.279 8.161 1.00 54.44 N ATOM 2101 CA ASN A 125 9.035 10.345 7.312 1.00 11.12 C ATOM 2102 C ASN A 125 8.577 10.462 5.840 1.00 1.53 C ATOM 2103 O ASN A 125 9.049 9.721 4.975 1.00 61.51 O ATOM 2104 CB ASN A 125 8.850 8.873 7.834 1.00 34.22 C ATOM 2105 CG ASN A 125 10.031 7.931 7.541 1.00 10.14 C ATOM 2106 OD1 ASN A 125 10.785 8.105 6.584 1.00 53.25 O ATOM 2107 ND2 ASN A 125 10.190 6.904 8.366 1.00 31.02 N ATOM 0 H ASN A 125 7.334 10.919 8.419 1.00 54.44 H new ATOM 0 HA ASN A 125 10.092 10.605 7.366 1.00 11.12 H new ATOM 0 HB2 ASN A 125 8.686 8.902 8.911 1.00 34.22 H new ATOM 0 HB3 ASN A 125 7.949 8.454 7.385 1.00 34.22 H new ATOM 0 HD21 ASN A 125 10.949 6.240 8.213 1.00 31.02 H new ATOM 0 HD22 ASN A 125 9.553 6.779 9.153 1.00 31.02 H new ATOM 2114 N ILE A 126 7.685 11.434 5.562 1.00 72.12 N ATOM 2115 CA ILE A 126 6.981 11.537 4.278 1.00 12.32 C ATOM 2116 C ILE A 126 7.918 12.022 3.159 1.00 23.54 C ATOM 2117 O ILE A 126 8.615 13.031 3.308 1.00 14.15 O ATOM 2118 CB ILE A 126 5.729 12.485 4.385 1.00 42.12 C ATOM 2119 CG1 ILE A 126 4.705 11.930 5.423 1.00 62.14 C ATOM 2120 CG2 ILE A 126 5.056 12.697 2.999 1.00 3.41 C ATOM 2121 CD1 ILE A 126 4.127 10.565 5.075 1.00 43.04 C ATOM 0 H ILE A 126 7.436 12.168 6.225 1.00 72.12 H new ATOM 0 HA ILE A 126 6.634 10.535 4.024 1.00 12.32 H new ATOM 0 HB ILE A 126 6.077 13.458 4.733 1.00 42.12 H new ATOM 0 HG12 ILE A 126 5.192 11.866 6.396 1.00 62.14 H new ATOM 0 HG13 ILE A 126 3.886 12.642 5.522 1.00 62.14 H new ATOM 0 HG21 ILE A 126 4.195 13.356 3.110 1.00 3.41 H new ATOM 0 HG22 ILE A 126 5.772 13.147 2.312 1.00 3.41 H new ATOM 0 HG23 ILE A 126 4.728 11.736 2.603 1.00 3.41 H new ATOM 0 HD11 ILE A 126 3.426 10.258 5.851 1.00 43.04 H new ATOM 0 HD12 ILE A 126 3.607 10.623 4.119 1.00 43.04 H new ATOM 0 HD13 ILE A 126 4.934 9.835 5.006 1.00 43.04 H new ATOM 2133 N MET A 127 7.940 11.262 2.060 1.00 74.35 N ATOM 2134 CA MET A 127 8.619 11.661 0.826 1.00 53.42 C ATOM 2135 C MET A 127 7.727 12.623 0.018 1.00 11.45 C ATOM 2136 O MET A 127 6.511 12.420 -0.088 1.00 62.44 O ATOM 2137 CB MET A 127 8.991 10.426 -0.027 1.00 60.33 C ATOM 2138 CG MET A 127 9.979 9.462 0.637 1.00 11.30 C ATOM 2139 SD MET A 127 10.446 8.077 -0.431 1.00 44.22 S ATOM 2140 CE MET A 127 8.851 7.456 -0.968 1.00 31.02 C ATOM 0 H MET A 127 7.486 10.351 2.002 1.00 74.35 H new ATOM 0 HA MET A 127 9.542 12.175 1.094 1.00 53.42 H new ATOM 0 HB2 MET A 127 8.079 9.880 -0.268 1.00 60.33 H new ATOM 0 HB3 MET A 127 9.417 10.768 -0.970 1.00 60.33 H new ATOM 0 HG2 MET A 127 10.876 10.011 0.923 1.00 11.30 H new ATOM 0 HG3 MET A 127 9.537 9.073 1.554 1.00 11.30 H new ATOM 0 HE1 MET A 127 8.995 6.571 -1.587 1.00 31.02 H new ATOM 0 HE2 MET A 127 8.250 7.196 -0.097 1.00 31.02 H new ATOM 0 HE3 MET A 127 8.338 8.224 -1.547 1.00 31.02 H new ATOM 2150 N ILE A 128 8.365 13.660 -0.544 1.00 35.40 N ATOM 2151 CA ILE A 128 7.700 14.695 -1.367 1.00 23.13 C ATOM 2152 C ILE A 128 7.309 14.123 -2.759 1.00 13.40 C ATOM 2153 O ILE A 128 6.460 14.679 -3.454 1.00 41.24 O ATOM 2154 CB ILE A 128 8.643 15.966 -1.512 1.00 22.21 C ATOM 2155 CG1 ILE A 128 9.095 16.459 -0.096 1.00 33.05 C ATOM 2156 CG2 ILE A 128 7.960 17.120 -2.306 1.00 2.10 C ATOM 2157 CD1 ILE A 128 10.069 17.631 -0.097 1.00 61.42 C ATOM 0 H ILE A 128 9.369 13.810 -0.442 1.00 35.40 H new ATOM 0 HA ILE A 128 6.782 15.005 -0.868 1.00 23.13 H new ATOM 0 HB ILE A 128 9.520 15.664 -2.085 1.00 22.21 H new ATOM 0 HG12 ILE A 128 8.209 16.744 0.472 1.00 33.05 H new ATOM 0 HG13 ILE A 128 9.557 15.624 0.431 1.00 33.05 H new ATOM 0 HG21 ILE A 128 8.643 17.966 -2.378 1.00 2.10 H new ATOM 0 HG22 ILE A 128 7.706 16.772 -3.307 1.00 2.10 H new ATOM 0 HG23 ILE A 128 7.052 17.430 -1.788 1.00 2.10 H new ATOM 0 HD11 ILE A 128 10.320 17.896 0.930 1.00 61.42 H new ATOM 0 HD12 ILE A 128 10.976 17.350 -0.631 1.00 61.42 H new ATOM 0 HD13 ILE A 128 9.608 18.487 -0.590 1.00 61.42 H new ATOM 2169 N LYS A 129 7.953 13.001 -3.145 1.00 13.44 N ATOM 2170 CA LYS A 129 7.714 12.256 -4.413 1.00 64.02 C ATOM 2171 C LYS A 129 7.555 10.746 -4.088 1.00 34.51 C ATOM 2172 O LYS A 129 7.818 10.320 -2.963 1.00 43.01 O ATOM 2173 CB LYS A 129 8.891 12.455 -5.440 1.00 1.22 C ATOM 2174 CG LYS A 129 8.853 13.741 -6.315 1.00 32.31 C ATOM 2175 CD LYS A 129 9.095 15.051 -5.536 1.00 40.03 C ATOM 2176 CE LYS A 129 8.919 16.308 -6.405 1.00 32.53 C ATOM 2177 NZ LYS A 129 9.850 16.341 -7.561 1.00 63.43 N ATOM 0 H LYS A 129 8.677 12.570 -2.570 1.00 13.44 H new ATOM 0 HA LYS A 129 6.806 12.646 -4.873 1.00 64.02 H new ATOM 0 HB2 LYS A 129 9.829 12.450 -4.885 1.00 1.22 H new ATOM 0 HB3 LYS A 129 8.910 11.592 -6.106 1.00 1.22 H new ATOM 0 HG2 LYS A 129 9.606 13.655 -7.099 1.00 32.31 H new ATOM 0 HG3 LYS A 129 7.883 13.801 -6.809 1.00 32.31 H new ATOM 0 HD2 LYS A 129 8.405 15.099 -4.693 1.00 40.03 H new ATOM 0 HD3 LYS A 129 10.103 15.040 -5.122 1.00 40.03 H new ATOM 0 HE2 LYS A 129 7.893 16.352 -6.769 1.00 32.53 H new ATOM 0 HE3 LYS A 129 9.078 17.194 -5.791 1.00 32.53 H new ATOM 0 HZ1 LYS A 129 9.712 17.224 -8.093 1.00 63.43 H new ATOM 0 HZ2 LYS A 129 10.831 16.293 -7.218 1.00 63.43 H new ATOM 0 HZ3 LYS A 129 9.660 15.529 -8.183 1.00 63.43 H new ATOM 2191 N TYR A 130 7.090 9.952 -5.075 1.00 13.11 N ATOM 2192 CA TYR A 130 7.020 8.476 -4.983 1.00 4.21 C ATOM 2193 C TYR A 130 7.216 7.846 -6.387 1.00 43.40 C ATOM 2194 O TYR A 130 7.270 8.562 -7.404 1.00 12.34 O ATOM 2195 CB TYR A 130 5.657 8.032 -4.360 1.00 14.20 C ATOM 2196 CG TYR A 130 4.440 8.169 -5.299 1.00 21.04 C ATOM 2197 CD1 TYR A 130 4.049 9.410 -5.808 1.00 51.22 C ATOM 2198 CD2 TYR A 130 3.700 7.047 -5.687 1.00 61.30 C ATOM 2199 CE1 TYR A 130 2.974 9.526 -6.663 1.00 73.00 C ATOM 2200 CE2 TYR A 130 2.624 7.163 -6.537 1.00 41.22 C ATOM 2201 CZ TYR A 130 2.267 8.400 -7.023 1.00 53.42 C ATOM 2202 OH TYR A 130 1.191 8.510 -7.873 1.00 2.54 O ATOM 0 H TYR A 130 6.750 10.318 -5.964 1.00 13.11 H new ATOM 0 HA TYR A 130 7.820 8.125 -4.332 1.00 4.21 H new ATOM 0 HB2 TYR A 130 5.740 6.992 -4.045 1.00 14.20 H new ATOM 0 HB3 TYR A 130 5.474 8.623 -3.463 1.00 14.20 H new ATOM 0 HD1 TYR A 130 4.600 10.295 -5.526 1.00 51.22 H new ATOM 0 HD2 TYR A 130 3.978 6.073 -5.313 1.00 61.30 H new ATOM 0 HE1 TYR A 130 2.688 10.494 -7.048 1.00 73.00 H new ATOM 0 HE2 TYR A 130 2.062 6.286 -6.822 1.00 41.22 H new ATOM 0 HH TYR A 130 0.804 7.623 -8.027 1.00 2.54 H new ATOM 2212 N HIS A 131 7.325 6.502 -6.426 1.00 12.40 N ATOM 2213 CA HIS A 131 7.406 5.721 -7.681 1.00 24.14 C ATOM 2214 C HIS A 131 6.057 5.010 -7.920 1.00 61.23 C ATOM 2215 O HIS A 131 5.748 4.050 -7.217 1.00 43.52 O ATOM 2216 CB HIS A 131 8.552 4.681 -7.618 1.00 71.54 C ATOM 2217 CG HIS A 131 9.919 5.285 -7.466 1.00 52.02 C ATOM 2218 ND1 HIS A 131 10.689 5.599 -8.551 1.00 43.12 N ATOM 2219 CD2 HIS A 131 10.599 5.604 -6.343 1.00 71.11 C ATOM 2220 CE1 HIS A 131 11.806 6.098 -8.075 1.00 44.12 C ATOM 2221 NE2 HIS A 131 11.797 6.125 -6.738 1.00 1.12 N ATOM 0 H HIS A 131 7.360 5.925 -5.586 1.00 12.40 H new ATOM 0 HA HIS A 131 7.618 6.401 -8.506 1.00 24.14 H new ATOM 0 HB2 HIS A 131 8.370 4.005 -6.782 1.00 71.54 H new ATOM 0 HB3 HIS A 131 8.532 4.078 -8.526 1.00 71.54 H new ATOM 0 HD1 HIS A 131 10.445 5.471 -9.533 1.00 43.12 H new ATOM 0 HD2 HIS A 131 10.259 5.472 -5.326 1.00 71.11 H new ATOM 0 HE1 HIS A 131 12.628 6.443 -8.685 1.00 44.12 H new ATOM 2229 N PRO A 132 5.237 5.475 -8.913 1.00 64.51 N ATOM 2230 CA PRO A 132 3.848 4.976 -9.137 1.00 4.53 C ATOM 2231 C PRO A 132 3.758 3.603 -9.837 1.00 12.22 C ATOM 2232 O PRO A 132 2.664 3.076 -9.999 1.00 34.52 O ATOM 2233 CB PRO A 132 3.248 6.085 -10.020 1.00 75.24 C ATOM 2234 CG PRO A 132 4.410 6.552 -10.832 1.00 64.25 C ATOM 2235 CD PRO A 132 5.590 6.536 -9.896 1.00 51.22 C ATOM 0 HA PRO A 132 3.330 4.798 -8.195 1.00 4.53 H new ATOM 0 HB2 PRO A 132 2.445 5.705 -10.651 1.00 75.24 H new ATOM 0 HB3 PRO A 132 2.827 6.892 -9.420 1.00 75.24 H new ATOM 0 HG2 PRO A 132 4.579 5.898 -11.687 1.00 64.25 H new ATOM 0 HG3 PRO A 132 4.236 7.553 -11.226 1.00 64.25 H new ATOM 0 HD2 PRO A 132 6.516 6.305 -10.422 1.00 51.22 H new ATOM 0 HD3 PRO A 132 5.731 7.502 -9.411 1.00 51.22 H new ATOM 2243 N LYS A 133 4.897 3.068 -10.299 1.00 33.21 N ATOM 2244 CA LYS A 133 4.972 1.718 -10.896 1.00 52.23 C ATOM 2245 C LYS A 133 5.478 0.702 -9.858 1.00 3.35 C ATOM 2246 O LYS A 133 5.654 1.038 -8.691 1.00 1.21 O ATOM 2247 CB LYS A 133 5.881 1.741 -12.153 1.00 21.14 C ATOM 2248 CG LYS A 133 5.246 2.387 -13.404 1.00 21.20 C ATOM 2249 CD LYS A 133 4.068 1.559 -13.958 1.00 71.12 C ATOM 2250 CE LYS A 133 3.409 2.214 -15.180 1.00 0.33 C ATOM 2251 NZ LYS A 133 2.900 3.574 -14.863 1.00 21.03 N ATOM 0 H LYS A 133 5.793 3.554 -10.272 1.00 33.21 H new ATOM 0 HA LYS A 133 3.974 1.409 -11.206 1.00 52.23 H new ATOM 0 HB2 LYS A 133 6.798 2.278 -11.910 1.00 21.14 H new ATOM 0 HB3 LYS A 133 6.166 0.717 -12.396 1.00 21.14 H new ATOM 0 HG2 LYS A 133 4.897 3.389 -13.155 1.00 21.20 H new ATOM 0 HG3 LYS A 133 6.005 2.497 -14.178 1.00 21.20 H new ATOM 0 HD2 LYS A 133 4.424 0.565 -14.231 1.00 71.12 H new ATOM 0 HD3 LYS A 133 3.322 1.427 -13.175 1.00 71.12 H new ATOM 0 HE2 LYS A 133 4.131 2.276 -15.994 1.00 0.33 H new ATOM 0 HE3 LYS A 133 2.587 1.589 -15.529 1.00 0.33 H new ATOM 0 HZ1 LYS A 133 2.316 3.919 -15.652 1.00 21.03 H new ATOM 0 HZ2 LYS A 133 2.325 3.536 -13.997 1.00 21.03 H new ATOM 0 HZ3 LYS A 133 3.702 4.220 -14.718 1.00 21.03 H new ATOM 2265 N PHE A 134 5.721 -0.540 -10.314 1.00 15.44 N ATOM 2266 CA PHE A 134 6.081 -1.671 -9.446 1.00 33.02 C ATOM 2267 C PHE A 134 7.608 -1.762 -9.254 1.00 1.25 C ATOM 2268 O PHE A 134 8.351 -1.932 -10.232 1.00 35.33 O ATOM 2269 CB PHE A 134 5.525 -2.989 -10.053 1.00 32.32 C ATOM 2270 CG PHE A 134 4.002 -3.025 -10.149 1.00 11.42 C ATOM 2271 CD1 PHE A 134 3.234 -3.294 -9.019 1.00 34.21 C ATOM 2272 CD2 PHE A 134 3.340 -2.778 -11.358 1.00 74.12 C ATOM 2273 CE1 PHE A 134 1.858 -3.321 -9.090 1.00 44.53 C ATOM 2274 CE2 PHE A 134 1.958 -2.806 -11.426 1.00 61.34 C ATOM 2275 CZ PHE A 134 1.218 -3.077 -10.292 1.00 54.30 C ATOM 0 H PHE A 134 5.672 -0.787 -11.303 1.00 15.44 H new ATOM 0 HA PHE A 134 5.636 -1.513 -8.464 1.00 33.02 H new ATOM 0 HB2 PHE A 134 5.946 -3.126 -11.049 1.00 32.32 H new ATOM 0 HB3 PHE A 134 5.862 -3.829 -9.446 1.00 32.32 H new ATOM 0 HD1 PHE A 134 3.723 -3.484 -8.075 1.00 34.21 H new ATOM 0 HD2 PHE A 134 3.914 -2.563 -12.247 1.00 74.12 H new ATOM 0 HE1 PHE A 134 1.277 -3.533 -8.204 1.00 44.53 H new ATOM 0 HE2 PHE A 134 1.459 -2.616 -12.365 1.00 61.34 H new ATOM 0 HZ PHE A 134 0.139 -3.098 -10.343 1.00 54.30 H new ATOM 2285 N TRP A 135 8.051 -1.614 -7.993 1.00 34.23 N ATOM 2286 CA TRP A 135 9.443 -1.847 -7.574 1.00 20.52 C ATOM 2287 C TRP A 135 9.853 -3.319 -7.809 1.00 61.41 C ATOM 2288 O TRP A 135 9.540 -4.213 -7.007 1.00 62.41 O ATOM 2289 CB TRP A 135 9.650 -1.434 -6.078 1.00 23.35 C ATOM 2290 CG TRP A 135 10.021 0.020 -5.872 1.00 53.11 C ATOM 2291 CD1 TRP A 135 9.230 1.119 -6.051 1.00 33.24 C ATOM 2292 CD2 TRP A 135 11.299 0.519 -5.453 1.00 31.43 C ATOM 2293 NE1 TRP A 135 9.933 2.256 -5.755 1.00 50.23 N ATOM 2294 CE2 TRP A 135 11.203 1.917 -5.394 1.00 62.14 C ATOM 2295 CE3 TRP A 135 12.514 -0.085 -5.121 1.00 33.45 C ATOM 2296 CZ2 TRP A 135 12.268 2.723 -5.018 1.00 73.21 C ATOM 2297 CZ3 TRP A 135 13.576 0.714 -4.749 1.00 21.34 C ATOM 2298 CH2 TRP A 135 13.442 2.107 -4.702 1.00 54.11 C ATOM 0 H TRP A 135 7.443 -1.325 -7.226 1.00 34.23 H new ATOM 0 HA TRP A 135 10.091 -1.221 -8.187 1.00 20.52 H new ATOM 0 HB2 TRP A 135 8.733 -1.643 -5.527 1.00 23.35 H new ATOM 0 HB3 TRP A 135 10.431 -2.060 -5.647 1.00 23.35 H new ATOM 0 HD1 TRP A 135 8.201 1.095 -6.378 1.00 33.24 H new ATOM 0 HE1 TRP A 135 9.565 3.206 -5.798 1.00 50.23 H new ATOM 0 HE3 TRP A 135 12.621 -1.159 -5.155 1.00 33.45 H new ATOM 0 HZ2 TRP A 135 12.170 3.798 -4.977 1.00 73.21 H new ATOM 0 HZ3 TRP A 135 14.521 0.260 -4.491 1.00 21.34 H new ATOM 0 HH2 TRP A 135 14.290 2.708 -4.408 1.00 54.11 H new ATOM 2309 N THR A 136 10.518 -3.549 -8.947 1.00 21.43 N ATOM 2310 CA THR A 136 11.129 -4.827 -9.297 1.00 35.13 C ATOM 2311 C THR A 136 12.565 -4.522 -9.758 1.00 61.43 C ATOM 2312 O THR A 136 12.770 -4.027 -10.874 1.00 24.51 O ATOM 2313 CB THR A 136 10.307 -5.555 -10.421 1.00 41.02 C ATOM 2314 OG1 THR A 136 8.917 -5.627 -10.046 1.00 32.44 O ATOM 2315 CG2 THR A 136 10.831 -6.977 -10.691 1.00 23.52 C ATOM 0 H THR A 136 10.647 -2.834 -9.663 1.00 21.43 H new ATOM 0 HA THR A 136 11.139 -5.502 -8.441 1.00 35.13 H new ATOM 0 HB THR A 136 10.422 -4.972 -11.335 1.00 41.02 H new ATOM 0 HG1 THR A 136 8.411 -6.080 -10.752 1.00 32.44 H new ATOM 0 HG21 THR A 136 10.233 -7.442 -11.475 1.00 23.52 H new ATOM 0 HG22 THR A 136 11.872 -6.927 -11.010 1.00 23.52 H new ATOM 0 HG23 THR A 136 10.759 -7.570 -9.779 1.00 23.52 H new ATOM 2323 N ASP A 137 13.540 -4.742 -8.857 1.00 11.34 N ATOM 2324 CA ASP A 137 14.943 -4.353 -9.079 1.00 12.42 C ATOM 2325 C ASP A 137 15.605 -5.228 -10.166 1.00 23.31 C ATOM 2326 O ASP A 137 15.721 -6.456 -10.023 1.00 2.41 O ATOM 2327 CB ASP A 137 15.739 -4.340 -7.735 1.00 34.40 C ATOM 2328 CG ASP A 137 15.836 -5.694 -7.020 1.00 21.23 C ATOM 2329 OD1 ASP A 137 14.786 -6.320 -6.750 1.00 64.11 O ATOM 2330 OD2 ASP A 137 16.963 -6.152 -6.730 1.00 52.12 O ATOM 0 H ASP A 137 13.377 -5.193 -7.957 1.00 11.34 H new ATOM 0 HA ASP A 137 14.961 -3.332 -9.461 1.00 12.42 H new ATOM 0 HB2 ASP A 137 16.748 -3.978 -7.932 1.00 34.40 H new ATOM 0 HB3 ASP A 137 15.270 -3.624 -7.060 1.00 34.40 H new ATOM 2335 N GLY A 138 15.994 -4.564 -11.275 1.00 61.34 N ATOM 2336 CA GLY A 138 16.505 -5.231 -12.478 1.00 41.21 C ATOM 2337 C GLY A 138 15.453 -5.340 -13.581 1.00 63.42 C ATOM 2338 O GLY A 138 15.608 -6.140 -14.508 1.00 54.42 O ATOM 0 H GLY A 138 15.960 -3.548 -11.355 1.00 61.34 H new ATOM 0 HA2 GLY A 138 17.367 -4.681 -12.856 1.00 41.21 H new ATOM 0 HA3 GLY A 138 16.855 -6.229 -12.215 1.00 41.21 H new ATOM 2342 N SER A 139 14.382 -4.533 -13.481 1.00 64.14 N ATOM 2343 CA SER A 139 13.256 -4.544 -14.442 1.00 33.42 C ATOM 2344 C SER A 139 12.783 -3.119 -14.778 1.00 33.03 C ATOM 2345 O SER A 139 13.281 -2.131 -14.209 1.00 15.55 O ATOM 2346 CB SER A 139 12.081 -5.358 -13.862 1.00 15.34 C ATOM 2347 OG SER A 139 12.422 -6.718 -13.691 1.00 45.15 O ATOM 0 H SER A 139 14.269 -3.851 -12.731 1.00 64.14 H new ATOM 0 HA SER A 139 13.608 -5.008 -15.363 1.00 33.42 H new ATOM 0 HB2 SER A 139 11.783 -4.934 -12.903 1.00 15.34 H new ATOM 0 HB3 SER A 139 11.221 -5.279 -14.527 1.00 15.34 H new ATOM 0 HG SER A 139 11.655 -7.203 -13.321 1.00 45.15 H new ATOM 2353 N TYR A 140 11.811 -3.030 -15.713 1.00 51.35 N ATOM 2354 CA TYR A 140 11.212 -1.757 -16.114 1.00 73.33 C ATOM 2355 C TYR A 140 10.161 -1.301 -15.089 1.00 52.11 C ATOM 2356 O TYR A 140 9.223 -2.040 -14.767 1.00 74.03 O ATOM 2357 CB TYR A 140 10.555 -1.833 -17.529 1.00 3.33 C ATOM 2358 CG TYR A 140 10.022 -0.466 -18.017 1.00 23.13 C ATOM 2359 CD1 TYR A 140 10.880 0.463 -18.603 1.00 54.35 C ATOM 2360 CD2 TYR A 140 8.682 -0.078 -17.834 1.00 71.34 C ATOM 2361 CE1 TYR A 140 10.435 1.706 -18.995 1.00 61.33 C ATOM 2362 CE2 TYR A 140 8.240 1.176 -18.219 1.00 73.25 C ATOM 2363 CZ TYR A 140 9.122 2.060 -18.798 1.00 22.12 C ATOM 2364 OH TYR A 140 8.694 3.314 -19.174 1.00 64.25 O ATOM 0 H TYR A 140 11.428 -3.839 -16.203 1.00 51.35 H new ATOM 0 HA TYR A 140 12.023 -1.030 -16.155 1.00 73.33 H new ATOM 0 HB2 TYR A 140 11.287 -2.209 -18.244 1.00 3.33 H new ATOM 0 HB3 TYR A 140 9.735 -2.550 -17.505 1.00 3.33 H new ATOM 0 HD1 TYR A 140 11.917 0.202 -18.753 1.00 54.35 H new ATOM 0 HD2 TYR A 140 7.986 -0.771 -17.385 1.00 71.34 H new ATOM 0 HE1 TYR A 140 11.118 2.403 -19.457 1.00 61.33 H new ATOM 0 HE2 TYR A 140 7.209 1.459 -18.066 1.00 73.25 H new ATOM 0 HH TYR A 140 7.740 3.409 -18.969 1.00 64.25 H new ATOM 2374 N GLN A 141 10.325 -0.073 -14.606 1.00 14.04 N ATOM 2375 CA GLN A 141 9.274 0.677 -13.919 1.00 42.54 C ATOM 2376 C GLN A 141 9.318 2.129 -14.423 1.00 4.32 C ATOM 2377 O GLN A 141 9.951 2.403 -15.453 1.00 73.12 O ATOM 2378 CB GLN A 141 9.413 0.560 -12.369 1.00 24.43 C ATOM 2379 CG GLN A 141 10.737 1.062 -11.780 1.00 63.20 C ATOM 2380 CD GLN A 141 10.750 1.039 -10.250 1.00 74.41 C ATOM 2381 OE1 GLN A 141 11.096 0.032 -9.644 1.00 71.35 O ATOM 2382 NE2 GLN A 141 10.367 2.141 -9.614 1.00 50.20 N ATOM 0 H GLN A 141 11.204 0.438 -14.681 1.00 14.04 H new ATOM 0 HA GLN A 141 8.294 0.259 -14.148 1.00 42.54 H new ATOM 0 HB2 GLN A 141 8.597 1.116 -11.907 1.00 24.43 H new ATOM 0 HB3 GLN A 141 9.285 -0.486 -12.089 1.00 24.43 H new ATOM 0 HG2 GLN A 141 11.554 0.445 -12.155 1.00 63.20 H new ATOM 0 HG3 GLN A 141 10.921 2.079 -12.125 1.00 63.20 H new ATOM 0 HE21 GLN A 141 10.084 2.964 -10.145 1.00 50.20 H new ATOM 0 HE22 GLN A 141 10.356 2.164 -8.594 1.00 50.20 H new ATOM 2391 N CYS A 142 8.637 3.016 -13.692 1.00 44.34 N ATOM 2392 CA CYS A 142 8.453 4.439 -14.010 1.00 62.31 C ATOM 2393 C CYS A 142 9.739 5.135 -14.517 1.00 20.34 C ATOM 2394 O CYS A 142 9.759 5.670 -15.631 1.00 33.45 O ATOM 2395 CB CYS A 142 7.912 5.101 -12.728 1.00 20.51 C ATOM 2396 SG CYS A 142 8.669 4.430 -11.212 1.00 3.54 S ATOM 0 H CYS A 142 8.177 2.751 -12.821 1.00 44.34 H new ATOM 0 HA CYS A 142 7.755 4.542 -14.841 1.00 62.31 H new ATOM 0 HB2 CYS A 142 8.094 6.175 -12.775 1.00 20.51 H new ATOM 0 HB3 CYS A 142 6.832 4.962 -12.681 1.00 20.51 H new ATOM 0 HG CYS A 142 7.786 3.736 -10.557 1.00 3.54 H new ATOM 2401 N CYS A 143 10.804 5.096 -13.698 1.00 15.44 N ATOM 2402 CA CYS A 143 12.136 5.632 -14.066 1.00 74.44 C ATOM 2403 C CYS A 143 13.237 4.553 -13.959 1.00 24.40 C ATOM 2404 O CYS A 143 14.414 4.853 -14.187 1.00 23.44 O ATOM 2405 CB CYS A 143 12.461 6.830 -13.154 1.00 5.13 C ATOM 2406 SG CYS A 143 12.369 6.443 -11.381 1.00 22.12 S ATOM 0 H CYS A 143 10.771 4.693 -12.761 1.00 15.44 H new ATOM 0 HA CYS A 143 12.108 5.955 -15.107 1.00 74.44 H new ATOM 0 HB2 CYS A 143 13.463 7.191 -13.387 1.00 5.13 H new ATOM 0 HB3 CYS A 143 11.769 7.643 -13.376 1.00 5.13 H new ATOM 0 HG CYS A 143 13.190 7.210 -10.726 1.00 22.12 H new ATOM 2411 N ARG A 144 12.835 3.309 -13.589 1.00 50.13 N ATOM 2412 CA ARG A 144 13.733 2.137 -13.418 1.00 71.24 C ATOM 2413 C ARG A 144 14.757 2.323 -12.275 1.00 20.12 C ATOM 2414 O ARG A 144 15.719 1.553 -12.171 1.00 25.32 O ATOM 2415 CB ARG A 144 14.424 1.766 -14.757 1.00 75.34 C ATOM 2416 CG ARG A 144 13.433 1.503 -15.912 1.00 72.54 C ATOM 2417 CD ARG A 144 14.136 1.027 -17.184 1.00 32.11 C ATOM 2418 NE ARG A 144 15.109 2.004 -17.701 1.00 72.20 N ATOM 2419 CZ ARG A 144 15.820 1.867 -18.835 1.00 72.43 C ATOM 2420 NH1 ARG A 144 15.679 0.786 -19.611 1.00 24.43 N ATOM 2421 NH2 ARG A 144 16.670 2.825 -19.190 1.00 44.54 N ATOM 0 H ARG A 144 11.858 3.089 -13.397 1.00 50.13 H new ATOM 0 HA ARG A 144 13.103 1.299 -13.120 1.00 71.24 H new ATOM 0 HB2 ARG A 144 15.098 2.573 -15.044 1.00 75.34 H new ATOM 0 HB3 ARG A 144 15.037 0.877 -14.606 1.00 75.34 H new ATOM 0 HG2 ARG A 144 12.705 0.754 -15.600 1.00 72.54 H new ATOM 0 HG3 ARG A 144 12.878 2.416 -16.126 1.00 72.54 H new ATOM 0 HD2 ARG A 144 14.647 0.086 -16.980 1.00 32.11 H new ATOM 0 HD3 ARG A 144 13.389 0.824 -17.952 1.00 32.11 H new ATOM 0 HE ARG A 144 15.256 2.853 -17.155 1.00 72.20 H new ATOM 0 HH11 ARG A 144 15.025 0.050 -19.346 1.00 24.43 H new ATOM 0 HH12 ARG A 144 16.226 0.698 -20.467 1.00 24.43 H new ATOM 0 HH21 ARG A 144 16.778 3.653 -18.605 1.00 44.54 H new ATOM 0 HH22 ARG A 144 17.214 2.732 -20.048 1.00 44.54 H new ATOM 2435 N GLN A 145 14.520 3.317 -11.398 1.00 34.21 N ATOM 2436 CA GLN A 145 15.380 3.585 -10.232 1.00 3.24 C ATOM 2437 C GLN A 145 14.964 2.667 -9.071 1.00 25.53 C ATOM 2438 O GLN A 145 14.052 2.986 -8.292 1.00 43.41 O ATOM 2439 CB GLN A 145 15.309 5.077 -9.831 1.00 41.14 C ATOM 2440 CG GLN A 145 15.784 6.043 -10.933 1.00 41.03 C ATOM 2441 CD GLN A 145 15.679 7.524 -10.559 1.00 62.53 C ATOM 2442 OE1 GLN A 145 14.681 7.891 -9.757 1.00 51.42 O flip ATOM 2443 NE2 GLN A 145 16.484 8.346 -11.001 1.00 3.31 N flip ATOM 0 H GLN A 145 13.728 3.955 -11.478 1.00 34.21 H new ATOM 0 HA GLN A 145 16.417 3.371 -10.489 1.00 3.24 H new ATOM 0 HB2 GLN A 145 14.281 5.323 -9.564 1.00 41.14 H new ATOM 0 HB3 GLN A 145 15.916 5.233 -8.939 1.00 41.14 H new ATOM 0 HG2 GLN A 145 16.821 5.815 -11.178 1.00 41.03 H new ATOM 0 HG3 GLN A 145 15.197 5.865 -11.834 1.00 41.03 H new ATOM 0 HE21 GLN A 145 17.240 8.041 -11.614 1.00 3.31 H new ATOM 0 HE22 GLN A 145 16.394 9.332 -10.754 1.00 3.31 H new ATOM 2452 N THR A 146 15.628 1.502 -9.008 1.00 24.31 N ATOM 2453 CA THR A 146 15.286 0.423 -8.082 1.00 44.33 C ATOM 2454 C THR A 146 16.536 -0.438 -7.760 1.00 2.10 C ATOM 2455 O THR A 146 16.874 -1.390 -8.457 1.00 44.31 O ATOM 2456 CB THR A 146 14.087 -0.426 -8.649 1.00 21.11 C ATOM 2457 OG1 THR A 146 13.803 -1.546 -7.800 1.00 62.15 O ATOM 2458 CG2 THR A 146 14.314 -0.895 -10.110 1.00 2.13 C ATOM 0 H THR A 146 16.425 1.285 -9.607 1.00 24.31 H new ATOM 0 HA THR A 146 14.952 0.851 -7.137 1.00 44.33 H new ATOM 0 HB THR A 146 13.222 0.237 -8.662 1.00 21.11 H new ATOM 0 HG1 THR A 146 13.411 -1.228 -6.960 1.00 62.15 H new ATOM 0 HG21 THR A 146 13.454 -1.475 -10.444 1.00 2.13 H new ATOM 0 HG22 THR A 146 14.438 -0.026 -10.756 1.00 2.13 H new ATOM 0 HG23 THR A 146 15.210 -1.514 -10.158 1.00 2.13 H new ATOM 2466 N GLU A 147 17.261 0.003 -6.722 1.00 75.24 N ATOM 2467 CA GLU A 147 18.417 -0.704 -6.116 1.00 61.13 C ATOM 2468 C GLU A 147 18.342 -0.453 -4.604 1.00 24.43 C ATOM 2469 O GLU A 147 18.310 -1.383 -3.791 1.00 30.22 O ATOM 2470 CB GLU A 147 19.782 -0.175 -6.675 1.00 72.54 C ATOM 2471 CG GLU A 147 20.149 -0.650 -8.093 1.00 45.41 C ATOM 2472 CD GLU A 147 20.377 -2.172 -8.189 1.00 73.51 C ATOM 2473 OE1 GLU A 147 21.393 -2.664 -7.646 1.00 63.04 O ATOM 2474 OE2 GLU A 147 19.544 -2.884 -8.791 1.00 32.31 O ATOM 0 H GLU A 147 17.059 0.890 -6.260 1.00 75.24 H new ATOM 0 HA GLU A 147 18.370 -1.766 -6.355 1.00 61.13 H new ATOM 0 HB2 GLU A 147 19.758 0.915 -6.671 1.00 72.54 H new ATOM 0 HB3 GLU A 147 20.576 -0.479 -5.993 1.00 72.54 H new ATOM 0 HG2 GLU A 147 19.353 -0.365 -8.781 1.00 45.41 H new ATOM 0 HG3 GLU A 147 21.052 -0.134 -8.419 1.00 45.41 H new ATOM 2481 N LYS A 148 18.306 0.838 -4.260 1.00 64.02 N ATOM 2482 CA LYS A 148 18.096 1.329 -2.894 1.00 43.11 C ATOM 2483 C LYS A 148 16.883 2.283 -2.931 1.00 74.42 C ATOM 2484 O LYS A 148 16.435 2.651 -4.024 1.00 70.24 O ATOM 2485 CB LYS A 148 19.384 2.045 -2.380 1.00 34.22 C ATOM 2486 CG LYS A 148 19.446 2.239 -0.843 1.00 44.12 C ATOM 2487 CD LYS A 148 19.433 0.897 -0.062 1.00 42.15 C ATOM 2488 CE LYS A 148 20.640 -0.007 -0.389 1.00 30.44 C ATOM 2489 NZ LYS A 148 20.559 -1.332 0.285 1.00 71.20 N ATOM 0 H LYS A 148 18.425 1.589 -4.940 1.00 64.02 H new ATOM 0 HA LYS A 148 17.894 0.510 -2.203 1.00 43.11 H new ATOM 0 HB2 LYS A 148 20.254 1.469 -2.696 1.00 34.22 H new ATOM 0 HB3 LYS A 148 19.457 3.021 -2.859 1.00 34.22 H new ATOM 0 HG2 LYS A 148 20.350 2.793 -0.588 1.00 44.12 H new ATOM 0 HG3 LYS A 148 18.599 2.847 -0.524 1.00 44.12 H new ATOM 0 HD2 LYS A 148 19.423 1.106 1.008 1.00 42.15 H new ATOM 0 HD3 LYS A 148 18.512 0.360 -0.290 1.00 42.15 H new ATOM 0 HE2 LYS A 148 20.698 -0.154 -1.467 1.00 30.44 H new ATOM 0 HE3 LYS A 148 21.559 0.495 -0.086 1.00 30.44 H new ATOM 0 HZ1 LYS A 148 21.392 -1.901 0.033 1.00 71.20 H new ATOM 0 HZ2 LYS A 148 20.531 -1.196 1.316 1.00 71.20 H new ATOM 0 HZ3 LYS A 148 19.697 -1.826 -0.023 1.00 71.20 H new ATOM 2503 N LEU A 149 16.371 2.681 -1.755 1.00 13.40 N ATOM 2504 CA LEU A 149 15.169 3.531 -1.638 1.00 14.52 C ATOM 2505 C LEU A 149 15.371 4.914 -2.304 1.00 32.13 C ATOM 2506 O LEU A 149 15.915 5.845 -1.694 1.00 30.10 O ATOM 2507 CB LEU A 149 14.758 3.674 -0.146 1.00 44.33 C ATOM 2508 CG LEU A 149 14.408 2.342 0.599 1.00 10.30 C ATOM 2509 CD1 LEU A 149 14.033 2.608 2.073 1.00 61.41 C ATOM 2510 CD2 LEU A 149 13.288 1.560 -0.132 1.00 62.04 C ATOM 0 H LEU A 149 16.778 2.423 -0.856 1.00 13.40 H new ATOM 0 HA LEU A 149 14.357 3.042 -2.176 1.00 14.52 H new ATOM 0 HB2 LEU A 149 15.571 4.164 0.389 1.00 44.33 H new ATOM 0 HB3 LEU A 149 13.895 4.337 -0.089 1.00 44.33 H new ATOM 0 HG LEU A 149 15.302 1.718 0.591 1.00 10.30 H new ATOM 0 HD11 LEU A 149 13.795 1.664 2.564 1.00 61.41 H new ATOM 0 HD12 LEU A 149 14.873 3.081 2.583 1.00 61.41 H new ATOM 0 HD13 LEU A 149 13.166 3.267 2.115 1.00 61.41 H new ATOM 0 HD21 LEU A 149 13.071 0.641 0.413 1.00 62.04 H new ATOM 0 HD22 LEU A 149 12.389 2.174 -0.182 1.00 62.04 H new ATOM 0 HD23 LEU A 149 13.616 1.314 -1.142 1.00 62.04 H new ATOM 2522 N ALA A 150 14.992 4.992 -3.594 1.00 73.21 N ATOM 2523 CA ALA A 150 14.963 6.239 -4.359 1.00 31.21 C ATOM 2524 C ALA A 150 13.733 7.074 -3.933 1.00 23.23 C ATOM 2525 O ALA A 150 12.633 6.515 -3.847 1.00 21.43 O ATOM 2526 CB ALA A 150 14.948 5.927 -5.871 1.00 64.30 C ATOM 0 H ALA A 150 14.696 4.179 -4.134 1.00 73.21 H new ATOM 0 HA ALA A 150 15.858 6.825 -4.153 1.00 31.21 H new ATOM 0 HB1 ALA A 150 14.926 6.860 -6.435 1.00 64.30 H new ATOM 0 HB2 ALA A 150 15.843 5.364 -6.135 1.00 64.30 H new ATOM 0 HB3 ALA A 150 14.064 5.337 -6.112 1.00 64.30 H new ATOM 2532 N PRO A 151 13.907 8.412 -3.660 1.00 30.21 N ATOM 2533 CA PRO A 151 12.831 9.287 -3.105 1.00 0.53 C ATOM 2534 C PRO A 151 11.519 9.267 -3.928 1.00 21.14 C ATOM 2535 O PRO A 151 10.425 9.217 -3.358 1.00 20.52 O ATOM 2536 CB PRO A 151 13.489 10.702 -3.084 1.00 71.33 C ATOM 2537 CG PRO A 151 14.684 10.601 -3.987 1.00 73.42 C ATOM 2538 CD PRO A 151 15.170 9.178 -3.843 1.00 75.25 C ATOM 0 HA PRO A 151 12.505 8.947 -2.122 1.00 0.53 H new ATOM 0 HB2 PRO A 151 12.794 11.464 -3.437 1.00 71.33 H new ATOM 0 HB3 PRO A 151 13.784 10.983 -2.073 1.00 71.33 H new ATOM 0 HG2 PRO A 151 14.417 10.823 -5.020 1.00 73.42 H new ATOM 0 HG3 PRO A 151 15.457 11.312 -3.698 1.00 73.42 H new ATOM 0 HD2 PRO A 151 15.719 8.847 -4.725 1.00 75.25 H new ATOM 0 HD3 PRO A 151 15.839 9.064 -2.990 1.00 75.25 H new ATOM 2546 N GLY A 152 11.648 9.320 -5.265 1.00 10.34 N ATOM 2547 CA GLY A 152 10.494 9.205 -6.167 1.00 3.31 C ATOM 2548 C GLY A 152 10.689 9.922 -7.482 1.00 51.44 C ATOM 2549 O GLY A 152 11.546 10.804 -7.581 1.00 23.24 O ATOM 0 H GLY A 152 12.541 9.442 -5.743 1.00 10.34 H new ATOM 0 HA2 GLY A 152 10.298 8.151 -6.362 1.00 3.31 H new ATOM 0 HA3 GLY A 152 9.611 9.607 -5.669 1.00 3.31 H new ATOM 2553 N CYS A 153 9.893 9.542 -8.500 1.00 24.30 N ATOM 2554 CA CYS A 153 9.943 10.139 -9.847 1.00 71.45 C ATOM 2555 C CYS A 153 8.800 11.154 -10.056 1.00 41.43 C ATOM 2556 O CYS A 153 9.034 12.239 -10.602 1.00 50.10 O ATOM 2557 CB CYS A 153 9.863 9.010 -10.889 1.00 3.13 C ATOM 2558 SG CYS A 153 8.507 7.843 -10.596 1.00 54.33 S ATOM 0 H CYS A 153 9.192 8.806 -8.409 1.00 24.30 H new ATOM 0 HA CYS A 153 10.880 10.684 -9.961 1.00 71.45 H new ATOM 0 HB2 CYS A 153 9.745 9.449 -11.879 1.00 3.13 H new ATOM 0 HB3 CYS A 153 10.806 8.464 -10.893 1.00 3.13 H new ATOM 0 HG CYS A 153 8.913 6.634 -10.848 1.00 54.33 H new ATOM 2563 N GLU A 154 7.566 10.799 -9.623 1.00 71.53 N ATOM 2564 CA GLU A 154 6.384 11.697 -9.724 1.00 45.45 C ATOM 2565 C GLU A 154 6.014 12.213 -8.330 1.00 10.32 C ATOM 2566 O GLU A 154 6.166 11.488 -7.350 1.00 64.20 O ATOM 2567 CB GLU A 154 5.156 10.996 -10.373 1.00 64.53 C ATOM 2568 CG GLU A 154 5.361 10.594 -11.845 1.00 70.51 C ATOM 2569 CD GLU A 154 4.053 10.244 -12.590 1.00 30.45 C ATOM 2570 OE1 GLU A 154 3.369 11.163 -13.079 1.00 61.22 O ATOM 2571 OE2 GLU A 154 3.702 9.056 -12.698 1.00 11.04 O ATOM 0 H GLU A 154 7.361 9.894 -9.199 1.00 71.53 H new ATOM 0 HA GLU A 154 6.658 12.528 -10.374 1.00 45.45 H new ATOM 0 HB2 GLU A 154 4.914 10.104 -9.795 1.00 64.53 H new ATOM 0 HB3 GLU A 154 4.295 11.662 -10.307 1.00 64.53 H new ATOM 0 HG2 GLU A 154 5.857 11.411 -12.368 1.00 70.51 H new ATOM 0 HG3 GLU A 154 6.031 9.735 -11.886 1.00 70.51 H new ATOM 2578 N LYS A 155 5.526 13.465 -8.261 1.00 1.33 N ATOM 2579 CA LYS A 155 5.236 14.160 -6.989 1.00 55.44 C ATOM 2580 C LYS A 155 4.101 13.468 -6.192 1.00 61.32 C ATOM 2581 O LYS A 155 3.084 13.048 -6.756 1.00 5.24 O ATOM 2582 CB LYS A 155 4.970 15.688 -7.251 1.00 43.21 C ATOM 2583 CG LYS A 155 3.929 16.025 -8.353 1.00 3.03 C ATOM 2584 CD LYS A 155 2.467 16.029 -7.854 1.00 63.04 C ATOM 2585 CE LYS A 155 1.456 16.133 -9.005 1.00 11.41 C ATOM 2586 NZ LYS A 155 1.657 17.340 -9.852 1.00 73.31 N ATOM 0 H LYS A 155 5.320 14.027 -9.087 1.00 1.33 H new ATOM 0 HA LYS A 155 6.116 14.092 -6.349 1.00 55.44 H new ATOM 0 HB2 LYS A 155 4.640 16.143 -6.317 1.00 43.21 H new ATOM 0 HB3 LYS A 155 5.916 16.159 -7.518 1.00 43.21 H new ATOM 0 HG2 LYS A 155 4.162 17.004 -8.772 1.00 3.03 H new ATOM 0 HG3 LYS A 155 4.024 15.301 -9.162 1.00 3.03 H new ATOM 0 HD2 LYS A 155 2.277 15.117 -7.288 1.00 63.04 H new ATOM 0 HD3 LYS A 155 2.322 16.865 -7.170 1.00 63.04 H new ATOM 0 HE2 LYS A 155 1.532 15.242 -9.629 1.00 11.41 H new ATOM 0 HE3 LYS A 155 0.447 16.149 -8.594 1.00 11.41 H new ATOM 0 HZ1 LYS A 155 0.905 17.390 -10.569 1.00 73.31 H new ATOM 0 HZ2 LYS A 155 1.625 18.192 -9.256 1.00 73.31 H new ATOM 0 HZ3 LYS A 155 2.582 17.283 -10.324 1.00 73.31 H new ATOM 2600 N TYR A 156 4.321 13.325 -4.884 1.00 72.14 N ATOM 2601 CA TYR A 156 3.389 12.670 -3.956 1.00 34.22 C ATOM 2602 C TYR A 156 2.447 13.724 -3.335 1.00 43.43 C ATOM 2603 O TYR A 156 2.910 14.686 -2.707 1.00 63.41 O ATOM 2604 CB TYR A 156 4.210 11.931 -2.862 1.00 73.32 C ATOM 2605 CG TYR A 156 3.368 11.187 -1.828 1.00 61.34 C ATOM 2606 CD1 TYR A 156 2.695 10.008 -2.164 1.00 74.23 C ATOM 2607 CD2 TYR A 156 3.228 11.667 -0.524 1.00 24.24 C ATOM 2608 CE1 TYR A 156 1.924 9.348 -1.236 1.00 13.41 C ATOM 2609 CE2 TYR A 156 2.454 11.007 0.399 1.00 63.31 C ATOM 2610 CZ TYR A 156 1.807 9.853 0.041 1.00 4.33 C ATOM 2611 OH TYR A 156 1.023 9.206 0.960 1.00 15.41 O ATOM 0 H TYR A 156 5.167 13.667 -4.428 1.00 72.14 H new ATOM 0 HA TYR A 156 2.773 11.942 -4.485 1.00 34.22 H new ATOM 0 HB2 TYR A 156 4.878 11.219 -3.347 1.00 73.32 H new ATOM 0 HB3 TYR A 156 4.838 12.657 -2.345 1.00 73.32 H new ATOM 0 HD1 TYR A 156 2.782 9.611 -3.165 1.00 74.23 H new ATOM 0 HD2 TYR A 156 3.738 12.574 -0.236 1.00 24.24 H new ATOM 0 HE1 TYR A 156 1.412 8.437 -1.507 1.00 13.41 H new ATOM 0 HE2 TYR A 156 2.356 11.395 1.402 1.00 63.31 H new ATOM 0 HH TYR A 156 0.376 8.635 0.494 1.00 15.41 H new ATOM 2621 N ASN A 157 1.126 13.535 -3.512 1.00 13.22 N ATOM 2622 CA ASN A 157 0.087 14.472 -3.029 1.00 13.20 C ATOM 2623 C ASN A 157 -0.501 13.964 -1.698 1.00 13.41 C ATOM 2624 O ASN A 157 -1.547 13.300 -1.676 1.00 4.04 O ATOM 2625 CB ASN A 157 -1.030 14.643 -4.100 1.00 63.31 C ATOM 2626 CG ASN A 157 -0.503 15.116 -5.458 1.00 31.43 C ATOM 2627 OD1 ASN A 157 -0.381 16.319 -5.717 1.00 31.44 O ATOM 2628 ND2 ASN A 157 -0.185 14.177 -6.334 1.00 53.44 N ATOM 0 H ASN A 157 0.744 12.723 -3.997 1.00 13.22 H new ATOM 0 HA ASN A 157 0.541 15.448 -2.857 1.00 13.20 H new ATOM 0 HB2 ASN A 157 -1.547 13.692 -4.230 1.00 63.31 H new ATOM 0 HB3 ASN A 157 -1.767 15.359 -3.735 1.00 63.31 H new ATOM 0 HD21 ASN A 157 0.172 14.437 -7.253 1.00 53.44 H new ATOM 0 HD22 ASN A 157 -0.297 13.193 -6.090 1.00 53.44 H new ATOM 2635 N LEU A 158 0.216 14.245 -0.597 1.00 52.34 N ATOM 2636 CA LEU A 158 -0.196 13.855 0.763 1.00 44.33 C ATOM 2637 C LEU A 158 -1.440 14.658 1.210 1.00 62.34 C ATOM 2638 O LEU A 158 -2.509 14.090 1.450 1.00 73.14 O ATOM 2639 CB LEU A 158 0.973 14.087 1.759 1.00 34.35 C ATOM 2640 CG LEU A 158 0.702 13.651 3.234 1.00 61.01 C ATOM 2641 CD1 LEU A 158 0.567 12.116 3.355 1.00 64.24 C ATOM 2642 CD2 LEU A 158 1.784 14.207 4.184 1.00 72.43 C ATOM 0 H LEU A 158 1.101 14.751 -0.625 1.00 52.34 H new ATOM 0 HA LEU A 158 -0.455 12.796 0.755 1.00 44.33 H new ATOM 0 HB2 LEU A 158 1.848 13.549 1.395 1.00 34.35 H new ATOM 0 HB3 LEU A 158 1.226 15.147 1.753 1.00 34.35 H new ATOM 0 HG LEU A 158 -0.253 14.080 3.538 1.00 61.01 H new ATOM 0 HD11 LEU A 158 0.379 11.848 4.395 1.00 64.24 H new ATOM 0 HD12 LEU A 158 -0.263 11.774 2.736 1.00 64.24 H new ATOM 0 HD13 LEU A 158 1.489 11.642 3.019 1.00 64.24 H new ATOM 0 HD21 LEU A 158 1.571 13.888 5.204 1.00 72.43 H new ATOM 0 HD22 LEU A 158 2.761 13.830 3.883 1.00 72.43 H new ATOM 0 HD23 LEU A 158 1.785 15.296 4.137 1.00 72.43 H new ATOM 2654 N PHE A 159 -1.272 15.988 1.329 1.00 23.35 N ATOM 2655 CA PHE A 159 -2.366 16.916 1.665 1.00 1.20 C ATOM 2656 C PHE A 159 -3.064 17.377 0.384 1.00 63.31 C ATOM 2657 O PHE A 159 -4.294 17.344 0.295 1.00 62.11 O ATOM 2658 CB PHE A 159 -1.829 18.147 2.442 1.00 65.33 C ATOM 2659 CG PHE A 159 -1.195 17.815 3.791 1.00 3.31 C ATOM 2660 CD1 PHE A 159 -1.986 17.419 4.871 1.00 42.23 C ATOM 2661 CD2 PHE A 159 0.188 17.900 3.983 1.00 24.41 C ATOM 2662 CE1 PHE A 159 -1.418 17.127 6.096 1.00 62.22 C ATOM 2663 CE2 PHE A 159 0.753 17.609 5.211 1.00 54.51 C ATOM 2664 CZ PHE A 159 -0.051 17.220 6.264 1.00 44.13 C ATOM 0 H PHE A 159 -0.372 16.449 1.195 1.00 23.35 H new ATOM 0 HA PHE A 159 -3.079 16.392 2.302 1.00 1.20 H new ATOM 0 HB2 PHE A 159 -1.091 18.658 1.824 1.00 65.33 H new ATOM 0 HB3 PHE A 159 -2.650 18.846 2.602 1.00 65.33 H new ATOM 0 HD1 PHE A 159 -3.056 17.340 4.747 1.00 42.23 H new ATOM 0 HD2 PHE A 159 0.823 18.197 3.161 1.00 24.41 H new ATOM 0 HE1 PHE A 159 -2.044 16.826 6.923 1.00 62.22 H new ATOM 0 HE2 PHE A 159 1.822 17.686 5.346 1.00 54.51 H new ATOM 0 HZ PHE A 159 0.391 16.988 7.222 1.00 44.13 H new