USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1112 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 134 ASN : amide:sc= -0.2 K(o=-0.99,f=-11!) USER MOD Set 1.2: A 139 ASN : amide:sc= -0.789 K(o=-0.99,f=-6.4!) USER MOD Set 2.1: A 52 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 136 HIS : no HD1:sc= -1.09 K(o=-1.1,f=-3.1!) USER MOD Set 3.1: A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 110 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 32 LYS NZ :NH3+ 143:sc= -0.18 (180deg=-2!) USER MOD Set 4.2: A 35 THR OG1 : rot -4:sc= 0.11 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN :FLIP amide:sc= -0.111 F(o=-0.66,f=-0.11) USER MOD Single : A 29 THR OG1 : rot 78:sc= 1.26 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 77:sc= 0.654 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -172:sc=-0.00721 (180deg=-0.081) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.122 USER MOD Single : A 46 LYS NZ :NH3+ 170:sc= -0.0127 (180deg=-0.14) USER MOD Single : A 54 ASN : amide:sc= 0.744 K(o=0.74,f=-1.1) USER MOD Single : A 56 MET CE :methyl -166:sc= -0.0817 (180deg=-0.343) USER MOD Single : A 62 TYR OH : rot 150:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.025) USER MOD Single : A 70 LYS NZ :NH3+ 164:sc= -0.0483 (180deg=-0.291) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -167:sc= 0.436 (180deg=0.353) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0112 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 178:sc= 0.97 (180deg=0.942) USER MOD Single : A 87 LYS NZ :NH3+ 142:sc= 0.222 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -20:sc=-0.00184 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 178:sc= -0.163 (180deg=-0.254) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.0963 K(o=-0.096,f=-1.8) USER MOD Single : A 103 THR OG1 : rot -150:sc= -0.193 USER MOD Single : A 107 THR OG1 : rot -156:sc= 0.345 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc=-0.00518 X(o=-0.0052,f=-0.0052) USER MOD Single : A 117 THR OG1 : rot -120:sc= 0.136 USER MOD Single : A 118 THR OG1 : rot -46:sc= 1.11 USER MOD Single : A 119 CYS SG : rot 180:sc= -0.572 USER MOD Single : A 125 GLN : amide:sc= -1.31 K(o=-1.3,f=-6.7!) USER MOD Single : A 127 TYR OH : rot 180:sc= -0.139 USER MOD Single : A 135 LYS NZ :NH3+ 158:sc= 0.42 (180deg=0.279) USER MOD Single : A 145 GLN :FLIP amide:sc= -0.469 F(o=-1.8,f=-0.47) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 200 N ILE A 15 10.755 9.289 -16.106 1.00 0.00 N ATOM 201 CA ILE A 15 9.762 9.176 -15.020 1.00 0.00 C ATOM 202 C ILE A 15 10.044 7.896 -14.222 1.00 0.00 C ATOM 203 O ILE A 15 10.222 7.953 -13.018 1.00 0.00 O ATOM 204 CB ILE A 15 8.270 9.157 -15.554 1.00 0.00 C ATOM 205 CG1 ILE A 15 7.944 10.461 -16.354 1.00 0.00 C ATOM 206 CG2 ILE A 15 7.249 8.933 -14.402 1.00 0.00 C ATOM 207 CD1 ILE A 15 8.160 11.749 -15.585 1.00 0.00 C ATOM 0 HA ILE A 15 9.859 10.058 -14.387 1.00 0.00 H new ATOM 0 HB ILE A 15 8.178 8.312 -16.236 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.561 10.483 -17.253 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.905 10.420 -16.681 1.00 0.00 H new ATOM 0 HG21 ILE A 15 6.238 8.926 -14.808 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.451 7.978 -13.917 1.00 0.00 H new ATOM 0 HG23 ILE A 15 7.341 9.737 -13.672 1.00 0.00 H new ATOM 0 HD11 ILE A 15 7.908 12.598 -16.220 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.523 11.756 -14.701 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.204 11.820 -15.281 1.00 0.00 H new ATOM 219 N GLU A 16 10.157 6.766 -14.949 1.00 0.00 N ATOM 220 CA GLU A 16 10.407 5.427 -14.366 1.00 0.00 C ATOM 221 C GLU A 16 11.832 5.298 -13.787 1.00 0.00 C ATOM 222 O GLU A 16 12.086 4.414 -12.974 1.00 0.00 O ATOM 223 CB GLU A 16 10.172 4.330 -15.439 1.00 0.00 C ATOM 224 CG GLU A 16 8.749 4.309 -16.020 1.00 0.00 C ATOM 225 CD GLU A 16 8.579 3.264 -17.136 1.00 0.00 C ATOM 226 OE1 GLU A 16 8.914 3.559 -18.303 1.00 0.00 O ATOM 227 OE2 GLU A 16 8.128 2.127 -16.846 1.00 0.00 O ATOM 0 H GLU A 16 10.077 6.754 -15.966 1.00 0.00 H new ATOM 0 HA GLU A 16 9.706 5.295 -13.542 1.00 0.00 H new ATOM 0 HB2 GLU A 16 10.882 4.476 -16.253 1.00 0.00 H new ATOM 0 HB3 GLU A 16 10.387 3.356 -14.999 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.038 4.100 -15.221 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.507 5.297 -16.413 1.00 0.00 H new ATOM 234 N LYS A 17 12.747 6.175 -14.230 1.00 0.00 N ATOM 235 CA LYS A 17 14.156 6.197 -13.777 1.00 0.00 C ATOM 236 C LYS A 17 14.236 6.778 -12.357 1.00 0.00 C ATOM 237 O LYS A 17 14.713 6.122 -11.418 1.00 0.00 O ATOM 238 CB LYS A 17 14.984 7.066 -14.754 1.00 0.00 C ATOM 239 CG LYS A 17 16.515 6.981 -14.608 1.00 0.00 C ATOM 240 CD LYS A 17 17.254 8.020 -15.495 1.00 0.00 C ATOM 241 CE LYS A 17 16.762 8.044 -16.960 1.00 0.00 C ATOM 242 NZ LYS A 17 16.878 6.730 -17.644 1.00 0.00 N ATOM 0 H LYS A 17 12.533 6.897 -14.918 1.00 0.00 H new ATOM 0 HA LYS A 17 14.556 5.183 -13.763 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.721 6.782 -15.773 1.00 0.00 H new ATOM 0 HB3 LYS A 17 14.685 8.106 -14.626 1.00 0.00 H new ATOM 0 HG2 LYS A 17 16.787 7.140 -13.564 1.00 0.00 H new ATOM 0 HG3 LYS A 17 16.847 5.978 -14.875 1.00 0.00 H new ATOM 0 HD2 LYS A 17 17.126 9.012 -15.061 1.00 0.00 H new ATOM 0 HD3 LYS A 17 18.322 7.802 -15.483 1.00 0.00 H new ATOM 0 HE2 LYS A 17 15.721 8.365 -16.980 1.00 0.00 H new ATOM 0 HE3 LYS A 17 17.335 8.786 -17.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 16.532 6.815 -18.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 17.874 6.431 -17.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 16.309 6.023 -17.136 1.00 0.00 H new ATOM 256 N GLN A 18 13.729 8.018 -12.224 1.00 0.00 N ATOM 257 CA GLN A 18 13.669 8.739 -10.943 1.00 0.00 C ATOM 258 C GLN A 18 12.705 8.046 -9.977 1.00 0.00 C ATOM 259 O GLN A 18 12.926 8.036 -8.768 1.00 0.00 O ATOM 260 CB GLN A 18 13.245 10.200 -11.180 1.00 0.00 C ATOM 261 CG GLN A 18 14.267 11.023 -11.976 1.00 0.00 C ATOM 262 CD GLN A 18 13.821 12.463 -12.178 1.00 0.00 C ATOM 263 OE1 GLN A 18 14.050 13.306 -11.318 1.00 0.00 O ATOM 264 NE2 GLN A 18 13.198 12.758 -13.310 1.00 0.00 N ATOM 0 H GLN A 18 13.348 8.549 -13.007 1.00 0.00 H new ATOM 0 HA GLN A 18 14.661 8.732 -10.491 1.00 0.00 H new ATOM 0 HB2 GLN A 18 12.293 10.210 -11.710 1.00 0.00 H new ATOM 0 HB3 GLN A 18 13.078 10.680 -10.216 1.00 0.00 H new ATOM 0 HG2 GLN A 18 15.224 11.012 -11.454 1.00 0.00 H new ATOM 0 HG3 GLN A 18 14.428 10.556 -12.948 1.00 0.00 H new ATOM 0 HE21 GLN A 18 13.025 12.029 -14.002 1.00 0.00 H new ATOM 0 HE22 GLN A 18 12.891 13.714 -13.489 1.00 0.00 H new ATOM 273 N PHE A 19 11.635 7.468 -10.545 1.00 0.00 N ATOM 274 CA PHE A 19 10.697 6.603 -9.816 1.00 0.00 C ATOM 275 C PHE A 19 11.435 5.387 -9.244 1.00 0.00 C ATOM 276 O PHE A 19 11.262 5.079 -8.080 1.00 0.00 O ATOM 277 CB PHE A 19 9.515 6.169 -10.732 1.00 0.00 C ATOM 278 CG PHE A 19 8.715 4.952 -10.267 1.00 0.00 C ATOM 279 CD1 PHE A 19 7.963 4.986 -9.096 1.00 0.00 C ATOM 280 CD2 PHE A 19 8.720 3.763 -11.011 1.00 0.00 C ATOM 281 CE1 PHE A 19 7.251 3.875 -8.686 1.00 0.00 C ATOM 282 CE2 PHE A 19 8.003 2.659 -10.593 1.00 0.00 C ATOM 283 CZ PHE A 19 7.269 2.718 -9.429 1.00 0.00 C ATOM 0 H PHE A 19 11.396 7.589 -11.529 1.00 0.00 H new ATOM 0 HA PHE A 19 10.276 7.168 -8.985 1.00 0.00 H new ATOM 0 HB2 PHE A 19 8.831 7.012 -10.831 1.00 0.00 H new ATOM 0 HB3 PHE A 19 9.910 5.960 -11.726 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.936 5.888 -8.503 1.00 0.00 H new ATOM 0 HD2 PHE A 19 9.293 3.710 -11.925 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.675 3.916 -7.773 1.00 0.00 H new ATOM 0 HE2 PHE A 19 8.018 1.751 -11.178 1.00 0.00 H new ATOM 0 HZ PHE A 19 6.708 1.856 -9.100 1.00 0.00 H new ATOM 293 N ALA A 20 12.288 4.745 -10.067 1.00 0.00 N ATOM 294 CA ALA A 20 12.991 3.504 -9.683 1.00 0.00 C ATOM 295 C ALA A 20 13.838 3.720 -8.421 1.00 0.00 C ATOM 296 O ALA A 20 13.725 2.957 -7.461 1.00 0.00 O ATOM 297 CB ALA A 20 13.869 2.993 -10.835 1.00 0.00 C ATOM 0 H ALA A 20 12.508 5.069 -11.009 1.00 0.00 H new ATOM 0 HA ALA A 20 12.236 2.749 -9.464 1.00 0.00 H new ATOM 0 HB1 ALA A 20 14.376 2.078 -10.528 1.00 0.00 H new ATOM 0 HB2 ALA A 20 13.245 2.787 -11.705 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.610 3.750 -11.091 1.00 0.00 H new ATOM 303 N VAL A 21 14.641 4.803 -8.419 1.00 0.00 N ATOM 304 CA VAL A 21 15.569 5.090 -7.309 1.00 0.00 C ATOM 305 C VAL A 21 14.815 5.472 -6.013 1.00 0.00 C ATOM 306 O VAL A 21 15.113 4.930 -4.944 1.00 0.00 O ATOM 307 CB VAL A 21 16.651 6.170 -7.697 1.00 0.00 C ATOM 308 CG1 VAL A 21 16.027 7.521 -8.114 1.00 0.00 C ATOM 309 CG2 VAL A 21 17.689 6.354 -6.563 1.00 0.00 C ATOM 0 H VAL A 21 14.665 5.491 -9.172 1.00 0.00 H new ATOM 0 HA VAL A 21 16.109 4.165 -7.107 1.00 0.00 H new ATOM 0 HB VAL A 21 17.171 5.788 -8.575 1.00 0.00 H new ATOM 0 HG11 VAL A 21 16.819 8.224 -8.370 1.00 0.00 H new ATOM 0 HG12 VAL A 21 15.381 7.372 -8.979 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.440 7.921 -7.288 1.00 0.00 H new ATOM 0 HG21 VAL A 21 18.422 7.104 -6.859 1.00 0.00 H new ATOM 0 HG22 VAL A 21 17.182 6.680 -5.655 1.00 0.00 H new ATOM 0 HG23 VAL A 21 18.195 5.407 -6.376 1.00 0.00 H new ATOM 319 N VAL A 22 13.812 6.367 -6.115 1.00 0.00 N ATOM 320 CA VAL A 22 13.027 6.800 -4.947 1.00 0.00 C ATOM 321 C VAL A 22 12.125 5.669 -4.412 1.00 0.00 C ATOM 322 O VAL A 22 11.855 5.602 -3.221 1.00 0.00 O ATOM 323 CB VAL A 22 12.170 8.089 -5.242 1.00 0.00 C ATOM 324 CG1 VAL A 22 13.063 9.265 -5.708 1.00 0.00 C ATOM 325 CG2 VAL A 22 11.024 7.822 -6.251 1.00 0.00 C ATOM 0 H VAL A 22 13.529 6.802 -6.993 1.00 0.00 H new ATOM 0 HA VAL A 22 13.753 7.055 -4.175 1.00 0.00 H new ATOM 0 HB VAL A 22 11.700 8.373 -4.300 1.00 0.00 H new ATOM 0 HG11 VAL A 22 12.441 10.139 -5.903 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.788 9.502 -4.929 1.00 0.00 H new ATOM 0 HG13 VAL A 22 13.589 8.983 -6.620 1.00 0.00 H new ATOM 0 HG21 VAL A 22 10.465 8.743 -6.419 1.00 0.00 H new ATOM 0 HG22 VAL A 22 11.444 7.475 -7.195 1.00 0.00 H new ATOM 0 HG23 VAL A 22 10.356 7.060 -5.850 1.00 0.00 H new ATOM 335 N ALA A 23 11.688 4.766 -5.300 1.00 0.00 N ATOM 336 CA ALA A 23 10.778 3.671 -4.937 1.00 0.00 C ATOM 337 C ALA A 23 11.524 2.581 -4.160 1.00 0.00 C ATOM 338 O ALA A 23 11.028 2.107 -3.140 1.00 0.00 O ATOM 339 CB ALA A 23 10.112 3.092 -6.188 1.00 0.00 C ATOM 0 H ALA A 23 11.953 4.773 -6.285 1.00 0.00 H new ATOM 0 HA ALA A 23 9.998 4.071 -4.289 1.00 0.00 H new ATOM 0 HB1 ALA A 23 9.441 2.282 -5.901 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.543 3.873 -6.692 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.877 2.708 -6.863 1.00 0.00 H new ATOM 345 N VAL A 24 12.729 2.205 -4.642 1.00 0.00 N ATOM 346 CA VAL A 24 13.522 1.119 -4.025 1.00 0.00 C ATOM 347 C VAL A 24 14.144 1.565 -2.688 1.00 0.00 C ATOM 348 O VAL A 24 14.230 0.759 -1.752 1.00 0.00 O ATOM 349 CB VAL A 24 14.633 0.543 -4.984 1.00 0.00 C ATOM 350 CG1 VAL A 24 13.994 -0.057 -6.263 1.00 0.00 C ATOM 351 CG2 VAL A 24 15.719 1.601 -5.328 1.00 0.00 C ATOM 0 H VAL A 24 13.172 2.636 -5.453 1.00 0.00 H new ATOM 0 HA VAL A 24 12.818 0.310 -3.831 1.00 0.00 H new ATOM 0 HB VAL A 24 15.142 -0.260 -4.451 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.777 -0.449 -6.912 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.315 -0.863 -5.986 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.440 0.719 -6.791 1.00 0.00 H new ATOM 0 HG21 VAL A 24 16.462 1.157 -5.991 1.00 0.00 H new ATOM 0 HG22 VAL A 24 15.253 2.453 -5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 24 16.204 1.936 -4.411 1.00 0.00 H new ATOM 361 N GLU A 25 14.564 2.851 -2.599 1.00 0.00 N ATOM 362 CA GLU A 25 15.139 3.412 -1.361 1.00 0.00 C ATOM 363 C GLU A 25 14.059 3.579 -0.283 1.00 0.00 C ATOM 364 O GLU A 25 14.315 3.329 0.889 1.00 0.00 O ATOM 365 CB GLU A 25 15.872 4.756 -1.613 1.00 0.00 C ATOM 366 CG GLU A 25 17.137 4.622 -2.477 1.00 0.00 C ATOM 367 CD GLU A 25 17.997 5.901 -2.499 1.00 0.00 C ATOM 368 OE1 GLU A 25 17.606 6.891 -3.152 1.00 0.00 O ATOM 369 OE2 GLU A 25 19.065 5.929 -1.847 1.00 0.00 O ATOM 0 H GLU A 25 14.513 3.515 -3.372 1.00 0.00 H new ATOM 0 HA GLU A 25 15.882 2.700 -1.003 1.00 0.00 H new ATOM 0 HB2 GLU A 25 15.184 5.449 -2.098 1.00 0.00 H new ATOM 0 HB3 GLU A 25 16.144 5.196 -0.654 1.00 0.00 H new ATOM 0 HG2 GLU A 25 17.739 3.794 -2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 25 16.847 4.369 -3.497 1.00 0.00 H new ATOM 376 N GLN A 26 12.848 3.994 -0.691 1.00 0.00 N ATOM 377 CA GLN A 26 11.701 4.079 0.231 1.00 0.00 C ATOM 378 C GLN A 26 11.214 2.671 0.629 1.00 0.00 C ATOM 379 O GLN A 26 10.853 2.457 1.785 1.00 0.00 O ATOM 380 CB GLN A 26 10.550 4.958 -0.364 1.00 0.00 C ATOM 381 CG GLN A 26 10.643 6.468 -0.008 1.00 0.00 C ATOM 382 CD GLN A 26 11.997 7.115 -0.340 1.00 0.00 C ATOM 383 OE1 GLN A 26 12.121 7.685 -1.529 1.00 0.00 O flip ATOM 384 NE2 GLN A 26 12.922 7.104 0.475 1.00 0.00 N flip ATOM 0 H GLN A 26 12.638 4.275 -1.649 1.00 0.00 H new ATOM 0 HA GLN A 26 12.033 4.578 1.142 1.00 0.00 H new ATOM 0 HB2 GLN A 26 10.553 4.853 -1.449 1.00 0.00 H new ATOM 0 HB3 GLN A 26 9.594 4.572 -0.009 1.00 0.00 H new ATOM 0 HG2 GLN A 26 9.857 7.004 -0.541 1.00 0.00 H new ATOM 0 HG3 GLN A 26 10.447 6.591 1.057 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.796 6.657 1.383 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.813 7.542 0.241 1.00 0.00 H new ATOM 393 N ALA A 27 11.263 1.709 -0.317 1.00 0.00 N ATOM 394 CA ALA A 27 10.829 0.310 -0.079 1.00 0.00 C ATOM 395 C ALA A 27 11.693 -0.355 1.007 1.00 0.00 C ATOM 396 O ALA A 27 11.165 -1.005 1.930 1.00 0.00 O ATOM 397 CB ALA A 27 10.885 -0.505 -1.382 1.00 0.00 C ATOM 0 H ALA A 27 11.603 1.876 -1.264 1.00 0.00 H new ATOM 0 HA ALA A 27 9.797 0.332 0.271 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.563 -1.528 -1.186 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.225 -0.053 -2.123 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.906 -0.513 -1.763 1.00 0.00 H new ATOM 403 N GLU A 28 13.031 -0.162 0.897 1.00 0.00 N ATOM 404 CA GLU A 28 13.995 -0.691 1.880 1.00 0.00 C ATOM 405 C GLU A 28 13.871 0.076 3.207 1.00 0.00 C ATOM 406 O GLU A 28 14.085 -0.507 4.260 1.00 0.00 O ATOM 407 CB GLU A 28 15.465 -0.653 1.362 1.00 0.00 C ATOM 408 CG GLU A 28 16.100 0.751 1.253 1.00 0.00 C ATOM 409 CD GLU A 28 17.564 0.730 0.789 1.00 0.00 C ATOM 410 OE1 GLU A 28 18.476 0.623 1.645 1.00 0.00 O ATOM 411 OE2 GLU A 28 17.814 0.801 -0.434 1.00 0.00 O ATOM 0 H GLU A 28 13.463 0.358 0.133 1.00 0.00 H new ATOM 0 HA GLU A 28 13.747 -1.740 2.041 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.081 -1.260 2.026 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.497 -1.124 0.379 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.515 1.352 0.556 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.042 1.243 2.224 1.00 0.00 H new ATOM 418 N THR A 29 13.514 1.386 3.133 1.00 0.00 N ATOM 419 CA THR A 29 13.264 2.216 4.332 1.00 0.00 C ATOM 420 C THR A 29 12.158 1.584 5.195 1.00 0.00 C ATOM 421 O THR A 29 12.369 1.345 6.380 1.00 0.00 O ATOM 422 CB THR A 29 12.891 3.704 3.974 1.00 0.00 C ATOM 423 OG1 THR A 29 14.010 4.359 3.359 1.00 0.00 O ATOM 424 CG2 THR A 29 12.437 4.532 5.193 1.00 0.00 C ATOM 0 H THR A 29 13.394 1.886 2.252 1.00 0.00 H new ATOM 0 HA THR A 29 14.196 2.248 4.897 1.00 0.00 H new ATOM 0 HB THR A 29 12.048 3.647 3.286 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.076 4.083 2.421 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.196 5.546 4.875 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.555 4.072 5.637 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.239 4.564 5.930 1.00 0.00 H new ATOM 432 N TYR A 30 11.005 1.262 4.569 1.00 0.00 N ATOM 433 CA TYR A 30 9.852 0.652 5.270 1.00 0.00 C ATOM 434 C TYR A 30 10.237 -0.709 5.890 1.00 0.00 C ATOM 435 O TYR A 30 9.852 -1.014 7.022 1.00 0.00 O ATOM 436 CB TYR A 30 8.651 0.488 4.301 1.00 0.00 C ATOM 437 CG TYR A 30 8.120 1.813 3.711 1.00 0.00 C ATOM 438 CD1 TYR A 30 7.752 2.880 4.539 1.00 0.00 C ATOM 439 CD2 TYR A 30 7.982 1.993 2.330 1.00 0.00 C ATOM 440 CE1 TYR A 30 7.272 4.069 4.011 1.00 0.00 C ATOM 441 CE2 TYR A 30 7.506 3.184 1.801 1.00 0.00 C ATOM 442 CZ TYR A 30 7.151 4.215 2.643 1.00 0.00 C ATOM 443 OH TYR A 30 6.670 5.403 2.114 1.00 0.00 O ATOM 0 H TYR A 30 10.847 1.415 3.573 1.00 0.00 H new ATOM 0 HA TYR A 30 9.557 1.320 6.079 1.00 0.00 H new ATOM 0 HB2 TYR A 30 8.948 -0.167 3.482 1.00 0.00 H new ATOM 0 HB3 TYR A 30 7.839 -0.011 4.830 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.844 2.775 5.610 1.00 0.00 H new ATOM 0 HD2 TYR A 30 8.252 1.188 1.662 1.00 0.00 H new ATOM 0 HE1 TYR A 30 6.993 4.879 4.668 1.00 0.00 H new ATOM 0 HE2 TYR A 30 7.414 3.303 0.731 1.00 0.00 H new ATOM 0 HH TYR A 30 6.649 5.341 1.136 1.00 0.00 H new ATOM 453 N TRP A 31 11.034 -1.499 5.141 1.00 0.00 N ATOM 454 CA TRP A 31 11.542 -2.814 5.593 1.00 0.00 C ATOM 455 C TRP A 31 12.432 -2.657 6.850 1.00 0.00 C ATOM 456 O TRP A 31 12.216 -3.334 7.854 1.00 0.00 O ATOM 457 CB TRP A 31 12.330 -3.508 4.440 1.00 0.00 C ATOM 458 CG TRP A 31 12.933 -4.866 4.794 1.00 0.00 C ATOM 459 CD1 TRP A 31 14.165 -5.104 5.347 1.00 0.00 C ATOM 460 CD2 TRP A 31 12.330 -6.158 4.615 1.00 0.00 C ATOM 461 NE1 TRP A 31 14.352 -6.450 5.528 1.00 0.00 N ATOM 462 CE2 TRP A 31 13.245 -7.119 5.084 1.00 0.00 C ATOM 463 CE3 TRP A 31 11.106 -6.595 4.107 1.00 0.00 C ATOM 464 CZ2 TRP A 31 12.974 -8.486 5.057 1.00 0.00 C ATOM 465 CZ3 TRP A 31 10.837 -7.952 4.082 1.00 0.00 C ATOM 466 CH2 TRP A 31 11.767 -8.884 4.555 1.00 0.00 C ATOM 0 H TRP A 31 11.345 -1.244 4.204 1.00 0.00 H new ATOM 0 HA TRP A 31 10.692 -3.442 5.861 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.661 -3.635 3.589 1.00 0.00 H new ATOM 0 HB3 TRP A 31 13.132 -2.844 4.118 1.00 0.00 H new ATOM 0 HD1 TRP A 31 14.885 -4.341 5.603 1.00 0.00 H new ATOM 0 HE1 TRP A 31 15.184 -6.883 5.930 1.00 0.00 H new ATOM 0 HE3 TRP A 31 10.380 -5.885 3.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 13.693 -9.206 5.420 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 9.892 -8.298 3.690 1.00 0.00 H new ATOM 0 HH2 TRP A 31 11.527 -9.936 4.523 1.00 0.00 H new ATOM 477 N LYS A 32 13.417 -1.738 6.774 1.00 0.00 N ATOM 478 CA LYS A 32 14.458 -1.574 7.813 1.00 0.00 C ATOM 479 C LYS A 32 13.900 -0.914 9.085 1.00 0.00 C ATOM 480 O LYS A 32 14.373 -1.195 10.192 1.00 0.00 O ATOM 481 CB LYS A 32 15.671 -0.765 7.270 1.00 0.00 C ATOM 482 CG LYS A 32 16.420 -1.420 6.082 1.00 0.00 C ATOM 483 CD LYS A 32 16.976 -2.839 6.360 1.00 0.00 C ATOM 484 CE LYS A 32 18.118 -2.889 7.396 1.00 0.00 C ATOM 485 NZ LYS A 32 17.642 -2.740 8.795 1.00 0.00 N ATOM 0 H LYS A 32 13.514 -1.089 5.993 1.00 0.00 H new ATOM 0 HA LYS A 32 14.800 -2.574 8.080 1.00 0.00 H new ATOM 0 HB2 LYS A 32 15.321 0.220 6.960 1.00 0.00 H new ATOM 0 HB3 LYS A 32 16.379 -0.610 8.085 1.00 0.00 H new ATOM 0 HG2 LYS A 32 15.743 -1.472 5.230 1.00 0.00 H new ATOM 0 HG3 LYS A 32 17.247 -0.772 5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 32 16.160 -3.473 6.707 1.00 0.00 H new ATOM 0 HD3 LYS A 32 17.334 -3.265 5.423 1.00 0.00 H new ATOM 0 HE2 LYS A 32 18.648 -3.836 7.298 1.00 0.00 H new ATOM 0 HE3 LYS A 32 18.835 -2.098 7.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 18.205 -3.351 9.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 17.747 -1.749 9.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 16.641 -3.015 8.852 1.00 0.00 H new ATOM 499 N LEU A 33 12.887 -0.042 8.911 1.00 0.00 N ATOM 500 CA LEU A 33 12.161 0.580 10.037 1.00 0.00 C ATOM 501 C LEU A 33 11.450 -0.511 10.852 1.00 0.00 C ATOM 502 O LEU A 33 11.526 -0.519 12.085 1.00 0.00 O ATOM 503 CB LEU A 33 11.134 1.634 9.524 1.00 0.00 C ATOM 504 CG LEU A 33 11.721 2.978 8.987 1.00 0.00 C ATOM 505 CD1 LEU A 33 10.617 3.860 8.355 1.00 0.00 C ATOM 506 CD2 LEU A 33 12.483 3.736 10.097 1.00 0.00 C ATOM 0 H LEU A 33 12.551 0.250 7.993 1.00 0.00 H new ATOM 0 HA LEU A 33 12.878 1.097 10.675 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.546 1.177 8.728 1.00 0.00 H new ATOM 0 HB3 LEU A 33 10.446 1.864 10.338 1.00 0.00 H new ATOM 0 HG LEU A 33 12.437 2.738 8.201 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.057 4.788 7.991 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.156 3.326 7.524 1.00 0.00 H new ATOM 0 HD13 LEU A 33 9.859 4.088 9.105 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.881 4.668 9.694 1.00 0.00 H new ATOM 0 HD22 LEU A 33 11.803 3.957 10.919 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.304 3.119 10.461 1.00 0.00 H new ATOM 518 N LEU A 34 10.777 -1.436 10.134 1.00 0.00 N ATOM 519 CA LEU A 34 10.084 -2.573 10.750 1.00 0.00 C ATOM 520 C LEU A 34 11.085 -3.509 11.464 1.00 0.00 C ATOM 521 O LEU A 34 10.882 -3.829 12.633 1.00 0.00 O ATOM 522 CB LEU A 34 9.232 -3.341 9.701 1.00 0.00 C ATOM 523 CG LEU A 34 7.993 -2.573 9.127 1.00 0.00 C ATOM 524 CD1 LEU A 34 7.307 -3.374 7.996 1.00 0.00 C ATOM 525 CD2 LEU A 34 6.996 -2.203 10.251 1.00 0.00 C ATOM 0 H LEU A 34 10.703 -1.410 9.117 1.00 0.00 H new ATOM 0 HA LEU A 34 9.401 -2.185 11.506 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.880 -3.619 8.869 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.881 -4.268 10.155 1.00 0.00 H new ATOM 0 HG LEU A 34 8.353 -1.642 8.689 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.451 -2.813 7.620 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.017 -3.540 7.185 1.00 0.00 H new ATOM 0 HD13 LEU A 34 6.969 -4.335 8.384 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.146 -1.671 9.823 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.646 -3.112 10.741 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.492 -1.565 10.982 1.00 0.00 H new ATOM 537 N THR A 35 12.201 -3.886 10.783 1.00 0.00 N ATOM 538 CA THR A 35 13.210 -4.830 11.347 1.00 0.00 C ATOM 539 C THR A 35 13.796 -4.326 12.692 1.00 0.00 C ATOM 540 O THR A 35 14.169 -5.128 13.556 1.00 0.00 O ATOM 541 CB THR A 35 14.376 -5.140 10.336 1.00 0.00 C ATOM 542 OG1 THR A 35 15.022 -3.928 9.902 1.00 0.00 O ATOM 543 CG2 THR A 35 13.885 -5.923 9.099 1.00 0.00 C ATOM 0 H THR A 35 12.426 -3.553 9.846 1.00 0.00 H new ATOM 0 HA THR A 35 12.670 -5.758 11.534 1.00 0.00 H new ATOM 0 HB THR A 35 15.091 -5.762 10.875 1.00 0.00 H new ATOM 0 HG1 THR A 35 14.557 -3.155 10.284 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.725 -6.113 8.431 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.453 -6.872 9.417 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.130 -5.338 8.574 1.00 0.00 H new ATOM 551 N SER A 36 13.832 -2.991 12.859 1.00 0.00 N ATOM 552 CA SER A 36 14.277 -2.350 14.102 1.00 0.00 C ATOM 553 C SER A 36 13.150 -2.388 15.153 1.00 0.00 C ATOM 554 O SER A 36 13.296 -2.984 16.228 1.00 0.00 O ATOM 555 CB SER A 36 14.696 -0.889 13.819 1.00 0.00 C ATOM 556 OG SER A 36 15.673 -0.823 12.795 1.00 0.00 O ATOM 0 H SER A 36 13.553 -2.330 12.134 1.00 0.00 H new ATOM 0 HA SER A 36 15.136 -2.894 14.494 1.00 0.00 H new ATOM 0 HB2 SER A 36 13.821 -0.307 13.528 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.090 -0.438 14.730 1.00 0.00 H new ATOM 0 HG SER A 36 15.243 -0.949 11.924 1.00 0.00 H new ATOM 562 N VAL A 37 12.013 -1.758 14.808 1.00 0.00 N ATOM 563 CA VAL A 37 10.882 -1.530 15.736 1.00 0.00 C ATOM 564 C VAL A 37 9.536 -1.851 15.026 1.00 0.00 C ATOM 565 O VAL A 37 9.434 -1.679 13.808 1.00 0.00 O ATOM 566 CB VAL A 37 10.875 -0.038 16.270 1.00 0.00 C ATOM 567 CG1 VAL A 37 12.089 0.240 17.205 1.00 0.00 C ATOM 568 CG2 VAL A 37 10.831 0.982 15.097 1.00 0.00 C ATOM 0 H VAL A 37 11.848 -1.389 13.872 1.00 0.00 H new ATOM 0 HA VAL A 37 11.003 -2.196 16.591 1.00 0.00 H new ATOM 0 HB VAL A 37 9.967 0.091 16.860 1.00 0.00 H new ATOM 0 HG11 VAL A 37 12.052 1.273 17.552 1.00 0.00 H new ATOM 0 HG12 VAL A 37 12.050 -0.433 18.062 1.00 0.00 H new ATOM 0 HG13 VAL A 37 13.016 0.075 16.656 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.827 1.996 15.497 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.707 0.845 14.463 1.00 0.00 H new ATOM 0 HG23 VAL A 37 9.928 0.821 14.508 1.00 0.00 H new ATOM 578 N PRO A 38 8.481 -2.332 15.779 1.00 0.00 N ATOM 579 CA PRO A 38 7.136 -2.630 15.200 1.00 0.00 C ATOM 580 C PRO A 38 6.476 -1.422 14.507 1.00 0.00 C ATOM 581 O PRO A 38 6.820 -0.271 14.777 1.00 0.00 O ATOM 582 CB PRO A 38 6.301 -3.094 16.426 1.00 0.00 C ATOM 583 CG PRO A 38 7.324 -3.584 17.401 1.00 0.00 C ATOM 584 CD PRO A 38 8.519 -2.674 17.225 1.00 0.00 C ATOM 0 HA PRO A 38 7.207 -3.376 14.408 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.715 -2.275 16.842 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.599 -3.883 16.155 1.00 0.00 H new ATOM 0 HG2 PRO A 38 6.945 -3.541 18.422 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.589 -4.623 17.203 1.00 0.00 H new ATOM 0 HD2 PRO A 38 8.442 -1.785 17.850 1.00 0.00 H new ATOM 0 HD3 PRO A 38 9.449 -3.175 17.495 1.00 0.00 H new ATOM 592 N GLY A 39 5.491 -1.705 13.643 1.00 0.00 N ATOM 593 CA GLY A 39 4.746 -0.660 12.932 1.00 0.00 C ATOM 594 C GLY A 39 3.653 0.004 13.776 1.00 0.00 C ATOM 595 O GLY A 39 2.838 0.760 13.246 1.00 0.00 O ATOM 0 H GLY A 39 5.192 -2.654 13.420 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.445 0.105 12.593 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.291 -1.093 12.041 1.00 0.00 H new ATOM 599 N SER A 40 3.642 -0.280 15.090 1.00 0.00 N ATOM 600 CA SER A 40 2.688 0.314 16.042 1.00 0.00 C ATOM 601 C SER A 40 2.932 1.832 16.192 1.00 0.00 C ATOM 602 O SER A 40 1.987 2.623 16.202 1.00 0.00 O ATOM 603 CB SER A 40 2.809 -0.389 17.411 1.00 0.00 C ATOM 604 OG SER A 40 1.872 0.124 18.347 1.00 0.00 O ATOM 0 H SER A 40 4.297 -0.931 15.523 1.00 0.00 H new ATOM 0 HA SER A 40 1.678 0.172 15.656 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.650 -1.460 17.286 1.00 0.00 H new ATOM 0 HB3 SER A 40 3.819 -0.260 17.799 1.00 0.00 H new ATOM 0 HG SER A 40 1.974 -0.344 19.202 1.00 0.00 H new ATOM 610 N LYS A 41 4.217 2.224 16.317 1.00 0.00 N ATOM 611 CA LYS A 41 4.610 3.650 16.411 1.00 0.00 C ATOM 612 C LYS A 41 4.870 4.234 15.004 1.00 0.00 C ATOM 613 O LYS A 41 4.841 5.455 14.817 1.00 0.00 O ATOM 614 CB LYS A 41 5.855 3.856 17.339 1.00 0.00 C ATOM 615 CG LYS A 41 7.221 3.322 16.816 1.00 0.00 C ATOM 616 CD LYS A 41 7.424 1.799 16.978 1.00 0.00 C ATOM 617 CE LYS A 41 7.523 1.339 18.444 1.00 0.00 C ATOM 618 NZ LYS A 41 8.678 1.966 19.160 1.00 0.00 N ATOM 0 H LYS A 41 5.002 1.574 16.355 1.00 0.00 H new ATOM 0 HA LYS A 41 3.779 4.189 16.865 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.960 4.923 17.533 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.648 3.377 18.296 1.00 0.00 H new ATOM 0 HG2 LYS A 41 7.315 3.577 15.760 1.00 0.00 H new ATOM 0 HG3 LYS A 41 8.023 3.840 17.342 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.595 1.278 16.498 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.332 1.505 16.452 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.598 1.588 18.964 1.00 0.00 H new ATOM 0 HE3 LYS A 41 7.624 0.254 18.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 8.786 1.527 20.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 9.548 1.822 18.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 8.504 2.985 19.273 1.00 0.00 H new ATOM 632 N LEU A 42 5.127 3.342 14.028 1.00 0.00 N ATOM 633 CA LEU A 42 5.429 3.728 12.636 1.00 0.00 C ATOM 634 C LEU A 42 4.121 3.933 11.848 1.00 0.00 C ATOM 635 O LEU A 42 3.393 2.977 11.565 1.00 0.00 O ATOM 636 CB LEU A 42 6.316 2.649 11.957 1.00 0.00 C ATOM 637 CG LEU A 42 7.673 2.332 12.670 1.00 0.00 C ATOM 638 CD1 LEU A 42 8.379 1.126 12.011 1.00 0.00 C ATOM 639 CD2 LEU A 42 8.593 3.582 12.715 1.00 0.00 C ATOM 0 H LEU A 42 5.131 2.334 14.182 1.00 0.00 H new ATOM 0 HA LEU A 42 5.980 4.668 12.642 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.741 1.726 11.886 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.530 2.971 10.938 1.00 0.00 H new ATOM 0 HG LEU A 42 7.452 2.058 13.702 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.319 0.928 12.526 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.737 0.248 12.078 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.580 1.350 10.963 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.527 3.328 13.216 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.805 3.914 11.699 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.093 4.382 13.261 1.00 0.00 H new ATOM 651 N ARG A 43 3.840 5.194 11.509 1.00 0.00 N ATOM 652 CA ARG A 43 2.639 5.596 10.753 1.00 0.00 C ATOM 653 C ARG A 43 3.068 6.212 9.410 1.00 0.00 C ATOM 654 O ARG A 43 4.097 6.897 9.334 1.00 0.00 O ATOM 655 CB ARG A 43 1.741 6.577 11.571 1.00 0.00 C ATOM 656 CG ARG A 43 2.349 7.955 11.940 1.00 0.00 C ATOM 657 CD ARG A 43 3.386 7.904 13.077 1.00 0.00 C ATOM 658 NE ARG A 43 3.934 9.240 13.394 1.00 0.00 N ATOM 659 CZ ARG A 43 5.208 9.499 13.758 1.00 0.00 C ATOM 660 NH1 ARG A 43 6.120 8.533 13.790 1.00 0.00 N ATOM 661 NH2 ARG A 43 5.562 10.734 14.072 1.00 0.00 N ATOM 0 H ARG A 43 4.445 5.979 11.753 1.00 0.00 H new ATOM 0 HA ARG A 43 2.033 4.711 10.562 1.00 0.00 H new ATOM 0 HB2 ARG A 43 0.828 6.752 11.003 1.00 0.00 H new ATOM 0 HB3 ARG A 43 1.450 6.078 12.495 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.819 8.381 11.054 1.00 0.00 H new ATOM 0 HG3 ARG A 43 1.543 8.630 12.229 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.924 7.482 13.969 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.200 7.237 12.794 1.00 0.00 H new ATOM 0 HE ARG A 43 3.296 10.033 13.332 1.00 0.00 H new ATOM 0 HH11 ARG A 43 5.862 7.579 13.537 1.00 0.00 H new ATOM 0 HH12 ARG A 43 7.078 8.745 14.067 1.00 0.00 H new ATOM 0 HH21 ARG A 43 4.874 11.486 14.039 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.523 10.935 14.348 1.00 0.00 H new ATOM 675 N LEU A 44 2.276 5.950 8.358 1.00 0.00 N ATOM 676 CA LEU A 44 2.630 6.296 6.964 1.00 0.00 C ATOM 677 C LEU A 44 2.522 7.820 6.717 1.00 0.00 C ATOM 678 O LEU A 44 3.452 8.450 6.188 1.00 0.00 O ATOM 679 CB LEU A 44 1.733 5.486 5.971 1.00 0.00 C ATOM 680 CG LEU A 44 2.068 3.963 5.778 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.494 3.764 5.231 1.00 0.00 C ATOM 682 CD2 LEU A 44 1.838 3.138 7.065 1.00 0.00 C ATOM 0 H LEU A 44 1.369 5.491 8.446 1.00 0.00 H new ATOM 0 HA LEU A 44 3.670 6.021 6.790 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.700 5.564 6.309 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.787 5.970 4.996 1.00 0.00 H new ATOM 0 HG LEU A 44 1.369 3.583 5.033 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.692 2.699 5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.586 4.262 4.266 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.214 4.190 5.930 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.084 2.093 6.876 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.474 3.523 7.862 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.793 3.216 7.365 1.00 0.00 H new ATOM 694 N THR A 45 1.377 8.393 7.109 1.00 0.00 N ATOM 695 CA THR A 45 1.090 9.839 6.992 1.00 0.00 C ATOM 696 C THR A 45 0.408 10.315 8.292 1.00 0.00 C ATOM 697 O THR A 45 0.430 9.601 9.299 1.00 0.00 O ATOM 698 CB THR A 45 0.168 10.143 5.749 1.00 0.00 C ATOM 699 OG1 THR A 45 -1.061 9.406 5.845 1.00 0.00 O ATOM 700 CG2 THR A 45 0.851 9.819 4.413 1.00 0.00 C ATOM 0 H THR A 45 0.610 7.863 7.523 1.00 0.00 H new ATOM 0 HA THR A 45 2.027 10.375 6.842 1.00 0.00 H new ATOM 0 HB THR A 45 -0.035 11.214 5.767 1.00 0.00 H new ATOM 0 HG1 THR A 45 -1.624 9.606 5.068 1.00 0.00 H new ATOM 0 HG21 THR A 45 0.171 10.047 3.592 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.756 10.418 4.312 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.112 8.761 4.385 1.00 0.00 H new ATOM 708 N LYS A 46 -0.149 11.540 8.279 1.00 0.00 N ATOM 709 CA LYS A 46 -1.036 12.046 9.354 1.00 0.00 C ATOM 710 C LYS A 46 -2.485 11.575 9.133 1.00 0.00 C ATOM 711 O LYS A 46 -3.310 11.610 10.053 1.00 0.00 O ATOM 712 CB LYS A 46 -0.987 13.602 9.413 1.00 0.00 C ATOM 713 CG LYS A 46 0.410 14.181 9.714 1.00 0.00 C ATOM 714 CD LYS A 46 0.425 15.725 9.780 1.00 0.00 C ATOM 715 CE LYS A 46 1.832 16.286 10.061 1.00 0.00 C ATOM 716 NZ LYS A 46 2.825 15.875 9.029 1.00 0.00 N ATOM 0 H LYS A 46 0.000 12.210 7.525 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.680 11.644 10.303 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.336 14.001 8.461 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.683 13.947 10.177 1.00 0.00 H new ATOM 0 HG2 LYS A 46 0.767 13.779 10.662 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.108 13.849 8.945 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.057 16.130 8.837 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.259 16.060 10.560 1.00 0.00 H new ATOM 0 HE2 LYS A 46 1.784 17.374 10.102 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.167 15.944 11.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.707 16.409 9.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.019 14.857 9.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 2.443 16.072 8.082 1.00 0.00 H new ATOM 730 N PHE A 47 -2.782 11.143 7.899 1.00 0.00 N ATOM 731 CA PHE A 47 -4.139 10.763 7.469 1.00 0.00 C ATOM 732 C PHE A 47 -4.213 9.256 7.190 1.00 0.00 C ATOM 733 O PHE A 47 -5.201 8.771 6.659 1.00 0.00 O ATOM 734 CB PHE A 47 -4.518 11.561 6.193 1.00 0.00 C ATOM 735 CG PHE A 47 -4.255 13.057 6.304 1.00 0.00 C ATOM 736 CD1 PHE A 47 -5.131 13.895 6.989 1.00 0.00 C ATOM 737 CD2 PHE A 47 -3.120 13.620 5.732 1.00 0.00 C ATOM 738 CE1 PHE A 47 -4.879 15.250 7.092 1.00 0.00 C ATOM 739 CE2 PHE A 47 -2.865 14.970 5.834 1.00 0.00 C ATOM 740 CZ PHE A 47 -3.741 15.788 6.516 1.00 0.00 C ATOM 0 H PHE A 47 -2.082 11.046 7.163 1.00 0.00 H new ATOM 0 HA PHE A 47 -4.843 10.998 8.267 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.956 11.164 5.347 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.574 11.402 5.977 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.018 13.481 7.445 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.426 12.988 5.198 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.570 15.889 7.622 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.979 15.388 5.380 1.00 0.00 H new ATOM 0 HZ PHE A 47 -3.540 16.846 6.601 1.00 0.00 H new ATOM 750 N ASP A 48 -3.165 8.516 7.566 1.00 0.00 N ATOM 751 CA ASP A 48 -3.056 7.076 7.266 1.00 0.00 C ATOM 752 C ASP A 48 -4.130 6.262 8.026 1.00 0.00 C ATOM 753 O ASP A 48 -4.509 5.158 7.608 1.00 0.00 O ATOM 754 CB ASP A 48 -1.625 6.579 7.582 1.00 0.00 C ATOM 755 CG ASP A 48 -1.274 6.539 9.074 1.00 0.00 C ATOM 756 OD1 ASP A 48 -1.514 7.547 9.775 1.00 0.00 O ATOM 757 OD2 ASP A 48 -0.741 5.505 9.543 1.00 0.00 O ATOM 0 H ASP A 48 -2.370 8.891 8.084 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.241 6.923 6.203 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.503 5.578 7.167 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.910 7.225 7.072 1.00 0.00 H new ATOM 762 N ASP A 49 -4.633 6.842 9.135 1.00 0.00 N ATOM 763 CA ASP A 49 -5.727 6.255 9.927 1.00 0.00 C ATOM 764 C ASP A 49 -7.040 6.255 9.117 1.00 0.00 C ATOM 765 O ASP A 49 -7.711 5.223 9.031 1.00 0.00 O ATOM 766 CB ASP A 49 -5.910 7.013 11.269 1.00 0.00 C ATOM 767 CG ASP A 49 -6.879 6.298 12.237 1.00 0.00 C ATOM 768 OD1 ASP A 49 -6.525 5.209 12.730 1.00 0.00 O ATOM 769 OD2 ASP A 49 -7.982 6.821 12.517 1.00 0.00 O ATOM 0 H ASP A 49 -4.291 7.729 9.504 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.464 5.223 10.158 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.939 7.125 11.752 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.283 8.017 11.065 1.00 0.00 H new ATOM 774 N GLU A 50 -7.376 7.409 8.495 1.00 0.00 N ATOM 775 CA GLU A 50 -8.604 7.539 7.677 1.00 0.00 C ATOM 776 C GLU A 50 -8.462 6.760 6.352 1.00 0.00 C ATOM 777 O GLU A 50 -9.456 6.330 5.796 1.00 0.00 O ATOM 778 CB GLU A 50 -8.972 9.027 7.392 1.00 0.00 C ATOM 779 CG GLU A 50 -8.029 9.739 6.413 1.00 0.00 C ATOM 780 CD GLU A 50 -8.413 11.186 6.101 1.00 0.00 C ATOM 781 OE1 GLU A 50 -9.200 11.422 5.156 1.00 0.00 O ATOM 782 OE2 GLU A 50 -7.924 12.104 6.790 1.00 0.00 O ATOM 0 H GLU A 50 -6.816 8.260 8.544 1.00 0.00 H new ATOM 0 HA GLU A 50 -9.419 7.108 8.259 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.986 9.068 6.995 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.977 9.574 8.335 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -7.020 9.725 6.825 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.000 9.175 5.481 1.00 0.00 H new ATOM 789 N ILE A 51 -7.217 6.604 5.842 1.00 0.00 N ATOM 790 CA ILE A 51 -6.952 5.776 4.635 1.00 0.00 C ATOM 791 C ILE A 51 -7.386 4.316 4.887 1.00 0.00 C ATOM 792 O ILE A 51 -8.016 3.691 4.030 1.00 0.00 O ATOM 793 CB ILE A 51 -5.444 5.863 4.170 1.00 0.00 C ATOM 794 CG1 ILE A 51 -5.081 7.344 3.804 1.00 0.00 C ATOM 795 CG2 ILE A 51 -5.153 4.913 2.973 1.00 0.00 C ATOM 796 CD1 ILE A 51 -3.612 7.604 3.493 1.00 0.00 C ATOM 0 H ILE A 51 -6.384 7.036 6.242 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.548 6.178 3.816 1.00 0.00 H new ATOM 0 HB ILE A 51 -4.817 5.537 5.000 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -5.675 7.642 2.940 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.378 7.987 4.632 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -4.106 5.003 2.684 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -5.362 3.884 3.266 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -5.787 5.186 2.129 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.472 8.658 3.253 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -3.005 7.345 4.361 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.307 6.995 2.642 1.00 0.00 H new ATOM 808 N TYR A 52 -7.091 3.822 6.105 1.00 0.00 N ATOM 809 CA TYR A 52 -7.550 2.503 6.589 1.00 0.00 C ATOM 810 C TYR A 52 -9.098 2.434 6.640 1.00 0.00 C ATOM 811 O TYR A 52 -9.711 1.487 6.124 1.00 0.00 O ATOM 812 CB TYR A 52 -6.959 2.239 8.001 1.00 0.00 C ATOM 813 CG TYR A 52 -7.448 0.950 8.678 1.00 0.00 C ATOM 814 CD1 TYR A 52 -6.898 -0.284 8.347 1.00 0.00 C ATOM 815 CD2 TYR A 52 -8.457 0.971 9.650 1.00 0.00 C ATOM 816 CE1 TYR A 52 -7.327 -1.447 8.958 1.00 0.00 C ATOM 817 CE2 TYR A 52 -8.889 -0.190 10.259 1.00 0.00 C ATOM 818 CZ TYR A 52 -8.321 -1.398 9.908 1.00 0.00 C ATOM 819 OH TYR A 52 -8.739 -2.562 10.514 1.00 0.00 O ATOM 0 H TYR A 52 -6.525 4.329 6.785 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.203 1.737 5.895 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.873 2.201 7.922 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -7.203 3.085 8.644 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.121 -0.334 7.598 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -8.905 1.913 9.928 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -6.882 -2.394 8.690 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -9.668 -0.153 11.006 1.00 0.00 H new ATOM 0 HH TYR A 52 -9.446 -2.358 11.162 1.00 0.00 H new ATOM 829 N GLU A 53 -9.702 3.454 7.286 1.00 0.00 N ATOM 830 CA GLU A 53 -11.155 3.502 7.562 1.00 0.00 C ATOM 831 C GLU A 53 -11.961 3.596 6.258 1.00 0.00 C ATOM 832 O GLU A 53 -12.779 2.733 5.984 1.00 0.00 O ATOM 833 CB GLU A 53 -11.489 4.692 8.505 1.00 0.00 C ATOM 834 CG GLU A 53 -10.771 4.644 9.860 1.00 0.00 C ATOM 835 CD GLU A 53 -11.107 5.839 10.770 1.00 0.00 C ATOM 836 OE1 GLU A 53 -10.739 6.981 10.432 1.00 0.00 O ATOM 837 OE2 GLU A 53 -11.756 5.644 11.823 1.00 0.00 O ATOM 0 H GLU A 53 -9.196 4.269 7.632 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.438 2.576 8.062 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.229 5.623 8.002 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.565 4.713 8.678 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -11.038 3.720 10.372 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -9.694 4.616 9.692 1.00 0.00 H new ATOM 844 N ASN A 54 -11.702 4.630 5.445 1.00 0.00 N ATOM 845 CA ASN A 54 -12.372 4.810 4.136 1.00 0.00 C ATOM 846 C ASN A 54 -12.149 3.600 3.203 1.00 0.00 C ATOM 847 O ASN A 54 -12.977 3.355 2.330 1.00 0.00 O ATOM 848 CB ASN A 54 -11.924 6.103 3.405 1.00 0.00 C ATOM 849 CG ASN A 54 -12.366 7.399 4.089 1.00 0.00 C ATOM 850 OD1 ASN A 54 -13.502 7.838 3.925 1.00 0.00 O ATOM 851 ND2 ASN A 54 -11.468 8.047 4.812 1.00 0.00 N ATOM 0 H ASN A 54 -11.029 5.363 5.668 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.434 4.896 4.366 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.837 6.102 3.323 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.320 6.088 2.390 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -11.711 8.935 5.251 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -10.532 7.659 4.931 1.00 0.00 H new ATOM 858 N PHE A 55 -11.033 2.851 3.375 1.00 0.00 N ATOM 859 CA PHE A 55 -10.786 1.641 2.564 1.00 0.00 C ATOM 860 C PHE A 55 -11.797 0.528 2.910 1.00 0.00 C ATOM 861 O PHE A 55 -12.349 -0.102 2.014 1.00 0.00 O ATOM 862 CB PHE A 55 -9.326 1.128 2.721 1.00 0.00 C ATOM 863 CG PHE A 55 -8.860 0.130 1.646 1.00 0.00 C ATOM 864 CD1 PHE A 55 -9.418 0.125 0.362 1.00 0.00 C ATOM 865 CD2 PHE A 55 -7.845 -0.786 1.913 1.00 0.00 C ATOM 866 CE1 PHE A 55 -8.984 -0.759 -0.603 1.00 0.00 C ATOM 867 CE2 PHE A 55 -7.412 -1.674 0.941 1.00 0.00 C ATOM 868 CZ PHE A 55 -7.981 -1.660 -0.312 1.00 0.00 C ATOM 0 H PHE A 55 -10.303 3.061 4.056 1.00 0.00 H new ATOM 0 HA PHE A 55 -10.925 1.919 1.519 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.654 1.986 2.712 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.227 0.656 3.699 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.203 0.827 0.123 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.389 -0.804 2.892 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.429 -0.746 -1.587 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.626 -2.379 1.168 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.642 -2.354 -1.067 1.00 0.00 H new ATOM 878 N MET A 56 -12.046 0.308 4.216 1.00 0.00 N ATOM 879 CA MET A 56 -12.991 -0.740 4.676 1.00 0.00 C ATOM 880 C MET A 56 -14.462 -0.299 4.504 1.00 0.00 C ATOM 881 O MET A 56 -15.319 -1.126 4.180 1.00 0.00 O ATOM 882 CB MET A 56 -12.675 -1.177 6.143 1.00 0.00 C ATOM 883 CG MET A 56 -12.724 -0.081 7.204 1.00 0.00 C ATOM 884 SD MET A 56 -12.155 -0.648 8.821 1.00 0.00 S ATOM 885 CE MET A 56 -13.298 -1.989 9.173 1.00 0.00 C ATOM 0 H MET A 56 -11.610 0.837 4.971 1.00 0.00 H new ATOM 0 HA MET A 56 -12.852 -1.615 4.040 1.00 0.00 H new ATOM 0 HB2 MET A 56 -13.381 -1.958 6.426 1.00 0.00 H new ATOM 0 HB3 MET A 56 -11.681 -1.624 6.160 1.00 0.00 H new ATOM 0 HG2 MET A 56 -12.109 0.759 6.881 1.00 0.00 H new ATOM 0 HG3 MET A 56 -13.746 0.288 7.292 1.00 0.00 H new ATOM 0 HE1 MET A 56 -13.227 -2.261 10.226 1.00 0.00 H new ATOM 0 HE2 MET A 56 -14.315 -1.668 8.949 1.00 0.00 H new ATOM 0 HE3 MET A 56 -13.046 -2.853 8.558 1.00 0.00 H new ATOM 895 N GLU A 57 -14.726 1.014 4.682 1.00 0.00 N ATOM 896 CA GLU A 57 -16.079 1.607 4.566 1.00 0.00 C ATOM 897 C GLU A 57 -16.567 1.574 3.104 1.00 0.00 C ATOM 898 O GLU A 57 -17.675 1.115 2.817 1.00 0.00 O ATOM 899 CB GLU A 57 -16.076 3.076 5.085 1.00 0.00 C ATOM 900 CG GLU A 57 -15.816 3.239 6.595 1.00 0.00 C ATOM 901 CD GLU A 57 -15.739 4.718 7.040 1.00 0.00 C ATOM 902 OE1 GLU A 57 -16.788 5.403 7.069 1.00 0.00 O ATOM 903 OE2 GLU A 57 -14.635 5.211 7.346 1.00 0.00 O ATOM 0 H GLU A 57 -14.004 1.697 4.911 1.00 0.00 H new ATOM 0 HA GLU A 57 -16.760 1.014 5.177 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.316 3.635 4.540 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.038 3.530 4.847 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.610 2.739 7.150 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -14.883 2.739 6.853 1.00 0.00 H new ATOM 910 N ARG A 58 -15.720 2.083 2.192 1.00 0.00 N ATOM 911 CA ARG A 58 -16.057 2.205 0.755 1.00 0.00 C ATOM 912 C ARG A 58 -15.881 0.857 0.028 1.00 0.00 C ATOM 913 O ARG A 58 -16.634 0.550 -0.904 1.00 0.00 O ATOM 914 CB ARG A 58 -15.200 3.316 0.060 1.00 0.00 C ATOM 915 CG ARG A 58 -15.655 4.781 0.316 1.00 0.00 C ATOM 916 CD ARG A 58 -15.633 5.207 1.799 1.00 0.00 C ATOM 917 NE ARG A 58 -16.093 6.593 1.987 1.00 0.00 N ATOM 918 CZ ARG A 58 -16.510 7.134 3.147 1.00 0.00 C ATOM 919 NH1 ARG A 58 -16.525 6.429 4.274 1.00 0.00 N ATOM 920 NH2 ARG A 58 -16.900 8.395 3.167 1.00 0.00 N ATOM 0 H ARG A 58 -14.786 2.421 2.425 1.00 0.00 H new ATOM 0 HA ARG A 58 -17.105 2.497 0.690 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -14.167 3.213 0.393 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -15.208 3.136 -1.015 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -15.011 5.453 -0.252 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -16.666 4.907 -0.070 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -16.266 4.534 2.378 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -14.620 5.106 2.189 1.00 0.00 H new ATOM 0 HE ARG A 58 -16.096 7.197 1.165 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -16.216 5.457 4.272 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -16.845 6.860 5.141 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -16.883 8.948 2.310 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -17.218 8.817 4.040 1.00 0.00 H new ATOM 934 N PHE A 59 -14.874 0.060 0.454 1.00 0.00 N ATOM 935 CA PHE A 59 -14.541 -1.234 -0.188 1.00 0.00 C ATOM 936 C PHE A 59 -14.587 -2.373 0.853 1.00 0.00 C ATOM 937 O PHE A 59 -13.572 -2.677 1.495 1.00 0.00 O ATOM 938 CB PHE A 59 -13.144 -1.164 -0.880 1.00 0.00 C ATOM 939 CG PHE A 59 -13.013 -0.007 -1.864 1.00 0.00 C ATOM 940 CD1 PHE A 59 -13.500 -0.114 -3.166 1.00 0.00 C ATOM 941 CD2 PHE A 59 -12.426 1.200 -1.480 1.00 0.00 C ATOM 942 CE1 PHE A 59 -13.404 0.948 -4.043 1.00 0.00 C ATOM 943 CE2 PHE A 59 -12.329 2.255 -2.366 1.00 0.00 C ATOM 944 CZ PHE A 59 -12.820 2.129 -3.644 1.00 0.00 C ATOM 0 H PHE A 59 -14.274 0.292 1.245 1.00 0.00 H new ATOM 0 HA PHE A 59 -15.284 -1.443 -0.958 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -12.373 -1.070 -0.116 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -12.960 -2.101 -1.406 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -13.957 -1.037 -3.492 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -12.043 1.310 -0.476 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -13.789 0.852 -5.047 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -11.867 3.180 -2.055 1.00 0.00 H new ATOM 0 HZ PHE A 59 -12.748 2.956 -4.335 1.00 0.00 H new ATOM 954 N PRO A 60 -15.785 -3.015 1.058 1.00 0.00 N ATOM 955 CA PRO A 60 -15.908 -4.218 1.918 1.00 0.00 C ATOM 956 C PRO A 60 -15.326 -5.482 1.247 1.00 0.00 C ATOM 957 O PRO A 60 -15.268 -6.541 1.862 1.00 0.00 O ATOM 958 CB PRO A 60 -17.437 -4.343 2.133 1.00 0.00 C ATOM 959 CG PRO A 60 -18.030 -3.756 0.889 1.00 0.00 C ATOM 960 CD PRO A 60 -17.115 -2.607 0.508 1.00 0.00 C ATOM 0 HA PRO A 60 -15.347 -4.124 2.848 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -17.737 -5.382 2.266 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -17.760 -3.802 3.022 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.082 -4.497 0.092 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -19.047 -3.406 1.066 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.076 -2.468 -0.572 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -17.455 -1.665 0.939 1.00 0.00 H new ATOM 968 N GLU A 61 -14.896 -5.350 -0.020 1.00 0.00 N ATOM 969 CA GLU A 61 -14.262 -6.441 -0.784 1.00 0.00 C ATOM 970 C GLU A 61 -12.918 -6.887 -0.156 1.00 0.00 C ATOM 971 O GLU A 61 -12.495 -8.030 -0.348 1.00 0.00 O ATOM 972 CB GLU A 61 -14.069 -5.993 -2.261 1.00 0.00 C ATOM 973 CG GLU A 61 -13.209 -4.717 -2.451 1.00 0.00 C ATOM 974 CD GLU A 61 -13.228 -4.177 -3.893 1.00 0.00 C ATOM 975 OE1 GLU A 61 -14.159 -3.401 -4.234 1.00 0.00 O ATOM 976 OE2 GLU A 61 -12.336 -4.541 -4.692 1.00 0.00 O ATOM 0 H GLU A 61 -14.978 -4.480 -0.546 1.00 0.00 H new ATOM 0 HA GLU A 61 -14.921 -7.309 -0.753 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -13.607 -6.810 -2.815 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.050 -5.821 -2.704 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.569 -3.941 -1.775 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.180 -4.935 -2.166 1.00 0.00 H new ATOM 983 N TYR A 62 -12.267 -5.984 0.606 1.00 0.00 N ATOM 984 CA TYR A 62 -10.933 -6.237 1.190 1.00 0.00 C ATOM 985 C TYR A 62 -11.026 -6.640 2.694 1.00 0.00 C ATOM 986 O TYR A 62 -10.031 -7.085 3.266 1.00 0.00 O ATOM 987 CB TYR A 62 -9.998 -4.983 0.964 1.00 0.00 C ATOM 988 CG TYR A 62 -9.578 -4.224 2.236 1.00 0.00 C ATOM 989 CD1 TYR A 62 -10.423 -3.287 2.841 1.00 0.00 C ATOM 990 CD2 TYR A 62 -8.343 -4.464 2.845 1.00 0.00 C ATOM 991 CE1 TYR A 62 -10.046 -2.626 3.993 1.00 0.00 C ATOM 992 CE2 TYR A 62 -7.973 -3.804 3.998 1.00 0.00 C ATOM 993 CZ TYR A 62 -8.825 -2.884 4.570 1.00 0.00 C ATOM 994 OH TYR A 62 -8.461 -2.221 5.729 1.00 0.00 O ATOM 0 H TYR A 62 -12.648 -5.065 0.833 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.486 -7.088 0.676 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.097 -5.313 0.446 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -10.510 -4.286 0.300 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.386 -3.077 2.399 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -7.665 -5.180 2.404 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -10.712 -1.904 4.442 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -7.015 -4.008 4.453 1.00 0.00 H new ATOM 0 HH TYR A 62 -7.868 -2.793 6.260 1.00 0.00 H new ATOM 1004 N LYS A 63 -12.220 -6.508 3.312 1.00 0.00 N ATOM 1005 CA LYS A 63 -12.381 -6.577 4.799 1.00 0.00 C ATOM 1006 C LYS A 63 -11.951 -7.936 5.423 1.00 0.00 C ATOM 1007 O LYS A 63 -11.731 -8.022 6.642 1.00 0.00 O ATOM 1008 CB LYS A 63 -13.846 -6.257 5.188 1.00 0.00 C ATOM 1009 CG LYS A 63 -14.864 -7.351 4.788 1.00 0.00 C ATOM 1010 CD LYS A 63 -16.333 -6.905 4.953 1.00 0.00 C ATOM 1011 CE LYS A 63 -16.721 -6.629 6.411 1.00 0.00 C ATOM 1012 NZ LYS A 63 -16.665 -7.857 7.258 1.00 0.00 N ATOM 0 H LYS A 63 -13.095 -6.352 2.811 1.00 0.00 H new ATOM 0 HA LYS A 63 -11.704 -5.829 5.210 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.898 -6.105 6.266 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -14.137 -5.317 4.719 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.692 -7.636 3.750 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.690 -8.239 5.395 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -16.501 -6.004 4.362 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -16.988 -7.677 4.550 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.052 -5.875 6.825 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -17.729 -6.214 6.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.016 -7.637 8.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.257 -8.599 6.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -15.682 -8.192 7.320 1.00 0.00 H new ATOM 1026 N ASP A 64 -11.863 -8.981 4.585 1.00 0.00 N ATOM 1027 CA ASP A 64 -11.436 -10.334 4.993 1.00 0.00 C ATOM 1028 C ASP A 64 -9.935 -10.344 5.326 1.00 0.00 C ATOM 1029 O ASP A 64 -9.173 -9.595 4.725 1.00 0.00 O ATOM 1030 CB ASP A 64 -11.716 -11.343 3.848 1.00 0.00 C ATOM 1031 CG ASP A 64 -13.157 -11.290 3.304 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -13.453 -10.403 2.466 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -14.002 -12.117 3.712 1.00 0.00 O ATOM 0 H ASP A 64 -12.089 -8.912 3.593 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.999 -10.623 5.880 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.022 -11.150 3.030 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.511 -12.351 4.208 1.00 0.00 H new ATOM 1038 N VAL A 65 -9.522 -11.233 6.247 1.00 0.00 N ATOM 1039 CA VAL A 65 -8.112 -11.346 6.700 1.00 0.00 C ATOM 1040 C VAL A 65 -7.160 -11.601 5.511 1.00 0.00 C ATOM 1041 O VAL A 65 -6.105 -10.964 5.403 1.00 0.00 O ATOM 1042 CB VAL A 65 -7.953 -12.498 7.768 1.00 0.00 C ATOM 1043 CG1 VAL A 65 -6.472 -12.711 8.201 1.00 0.00 C ATOM 1044 CG2 VAL A 65 -8.869 -12.242 8.995 1.00 0.00 C ATOM 0 H VAL A 65 -10.151 -11.895 6.701 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.843 -10.396 7.162 1.00 0.00 H new ATOM 0 HB VAL A 65 -8.271 -13.424 7.289 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.420 -13.514 8.936 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.873 -12.977 7.330 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -6.086 -11.791 8.640 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.743 -13.048 9.718 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.599 -11.293 9.459 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.909 -12.205 8.671 1.00 0.00 H new ATOM 1054 N GLU A 66 -7.574 -12.515 4.610 1.00 0.00 N ATOM 1055 CA GLU A 66 -6.810 -12.861 3.399 1.00 0.00 C ATOM 1056 C GLU A 66 -6.727 -11.658 2.440 1.00 0.00 C ATOM 1057 O GLU A 66 -5.682 -11.378 1.860 1.00 0.00 O ATOM 1058 CB GLU A 66 -7.467 -14.058 2.672 1.00 0.00 C ATOM 1059 CG GLU A 66 -7.566 -15.359 3.488 1.00 0.00 C ATOM 1060 CD GLU A 66 -8.062 -16.552 2.645 1.00 0.00 C ATOM 1061 OE1 GLU A 66 -9.269 -16.616 2.323 1.00 0.00 O ATOM 1062 OE2 GLU A 66 -7.238 -17.414 2.270 1.00 0.00 O ATOM 0 H GLU A 66 -8.448 -13.033 4.704 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.801 -13.135 3.706 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.471 -13.766 2.364 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.902 -14.263 1.763 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.588 -15.596 3.906 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.243 -15.206 4.328 1.00 0.00 H new ATOM 1069 N ARG A 67 -7.849 -10.949 2.310 1.00 0.00 N ATOM 1070 CA ARG A 67 -7.989 -9.793 1.407 1.00 0.00 C ATOM 1071 C ARG A 67 -7.259 -8.531 1.960 1.00 0.00 C ATOM 1072 O ARG A 67 -6.995 -7.582 1.216 1.00 0.00 O ATOM 1073 CB ARG A 67 -9.496 -9.519 1.212 1.00 0.00 C ATOM 1074 CG ARG A 67 -10.301 -10.647 0.522 1.00 0.00 C ATOM 1075 CD ARG A 67 -9.979 -10.764 -0.972 1.00 0.00 C ATOM 1076 NE ARG A 67 -10.283 -9.505 -1.682 1.00 0.00 N ATOM 1077 CZ ARG A 67 -9.579 -8.986 -2.695 1.00 0.00 C ATOM 1078 NH1 ARG A 67 -8.541 -9.636 -3.213 1.00 0.00 N ATOM 1079 NH2 ARG A 67 -9.946 -7.827 -3.216 1.00 0.00 N ATOM 0 H ARG A 67 -8.699 -11.159 2.833 1.00 0.00 H new ATOM 0 HA ARG A 67 -7.520 -10.023 0.451 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.940 -9.326 2.188 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -9.608 -8.607 0.625 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -10.086 -11.596 1.013 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.367 -10.458 0.648 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -8.926 -11.013 -1.102 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -10.555 -11.580 -1.409 1.00 0.00 H new ATOM 0 HE ARG A 67 -11.103 -8.984 -1.372 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -8.270 -10.545 -2.838 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -8.016 -9.225 -3.985 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.760 -7.336 -2.846 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -9.415 -7.424 -3.988 1.00 0.00 H new ATOM 1093 N VAL A 68 -6.968 -8.548 3.276 1.00 0.00 N ATOM 1094 CA VAL A 68 -6.202 -7.500 3.971 1.00 0.00 C ATOM 1095 C VAL A 68 -4.699 -7.662 3.675 1.00 0.00 C ATOM 1096 O VAL A 68 -3.998 -6.682 3.382 1.00 0.00 O ATOM 1097 CB VAL A 68 -6.478 -7.553 5.536 1.00 0.00 C ATOM 1098 CG1 VAL A 68 -5.390 -6.825 6.358 1.00 0.00 C ATOM 1099 CG2 VAL A 68 -7.872 -6.967 5.877 1.00 0.00 C ATOM 0 H VAL A 68 -7.264 -9.304 3.894 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.525 -6.526 3.604 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.452 -8.607 5.814 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.629 -6.893 7.419 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.422 -7.291 6.174 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.350 -5.777 6.061 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.034 -7.016 6.954 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.920 -5.928 5.550 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.644 -7.544 5.367 1.00 0.00 H new ATOM 1109 N LYS A 69 -4.220 -8.918 3.754 1.00 0.00 N ATOM 1110 CA LYS A 69 -2.790 -9.222 3.657 1.00 0.00 C ATOM 1111 C LYS A 69 -2.313 -9.357 2.200 1.00 0.00 C ATOM 1112 O LYS A 69 -1.297 -8.751 1.827 1.00 0.00 O ATOM 1113 CB LYS A 69 -2.416 -10.482 4.485 1.00 0.00 C ATOM 1114 CG LYS A 69 -3.158 -11.792 4.135 1.00 0.00 C ATOM 1115 CD LYS A 69 -2.477 -13.042 4.749 1.00 0.00 C ATOM 1116 CE LYS A 69 -1.042 -13.232 4.219 1.00 0.00 C ATOM 1117 NZ LYS A 69 -0.362 -14.420 4.791 1.00 0.00 N ATOM 0 H LYS A 69 -4.811 -9.739 3.886 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.265 -8.369 4.086 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.346 -10.657 4.372 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.594 -10.262 5.538 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.186 -11.730 4.492 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.203 -11.902 3.051 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.454 -12.947 5.835 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.069 -13.928 4.520 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.072 -13.326 3.133 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -0.456 -12.341 4.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 0.598 -14.494 4.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -0.305 -14.323 5.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.901 -15.277 4.553 1.00 0.00 H new ATOM 1131 N LYS A 70 -3.038 -10.141 1.365 1.00 0.00 N ATOM 1132 CA LYS A 70 -2.610 -10.412 -0.023 1.00 0.00 C ATOM 1133 C LYS A 70 -3.700 -10.117 -1.052 1.00 0.00 C ATOM 1134 O LYS A 70 -4.889 -10.005 -0.733 1.00 0.00 O ATOM 1135 CB LYS A 70 -2.044 -11.863 -0.223 1.00 0.00 C ATOM 1136 CG LYS A 70 -3.043 -13.044 -0.368 1.00 0.00 C ATOM 1137 CD LYS A 70 -3.531 -13.613 0.978 1.00 0.00 C ATOM 1138 CE LYS A 70 -4.284 -14.947 0.821 1.00 0.00 C ATOM 1139 NZ LYS A 70 -3.400 -16.025 0.288 1.00 0.00 N ATOM 0 H LYS A 70 -3.914 -10.592 1.629 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.791 -9.714 -0.199 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.415 -11.852 -1.113 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.394 -12.083 0.624 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.905 -12.710 -0.945 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.568 -13.842 -0.939 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -2.676 -13.759 1.638 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.185 -12.886 1.460 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.687 -15.252 1.787 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.132 -14.808 0.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.846 -16.951 0.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.255 -15.882 -0.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.482 -15.994 0.776 1.00 0.00 H new ATOM 1153 N PHE A 71 -3.229 -10.009 -2.292 1.00 0.00 N ATOM 1154 CA PHE A 71 -4.025 -9.719 -3.484 1.00 0.00 C ATOM 1155 C PHE A 71 -3.208 -10.154 -4.718 1.00 0.00 C ATOM 1156 O PHE A 71 -2.034 -10.530 -4.600 1.00 0.00 O ATOM 1157 CB PHE A 71 -4.392 -8.200 -3.555 1.00 0.00 C ATOM 1158 CG PHE A 71 -3.182 -7.267 -3.690 1.00 0.00 C ATOM 1159 CD1 PHE A 71 -2.475 -6.836 -2.565 1.00 0.00 C ATOM 1160 CD2 PHE A 71 -2.724 -6.858 -4.946 1.00 0.00 C ATOM 1161 CE1 PHE A 71 -1.363 -6.026 -2.696 1.00 0.00 C ATOM 1162 CE2 PHE A 71 -1.608 -6.056 -5.074 1.00 0.00 C ATOM 1163 CZ PHE A 71 -0.928 -5.640 -3.951 1.00 0.00 C ATOM 0 H PHE A 71 -2.238 -10.126 -2.504 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.966 -10.269 -3.450 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -5.058 -8.038 -4.402 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -4.947 -7.929 -2.657 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.801 -7.139 -1.581 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.253 -7.175 -5.832 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -0.832 -5.693 -1.816 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -1.268 -5.755 -6.054 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.055 -5.012 -4.050 1.00 0.00 H new ATOM 1173 N THR A 72 -3.832 -10.103 -5.889 1.00 0.00 N ATOM 1174 CA THR A 72 -3.164 -10.369 -7.177 1.00 0.00 C ATOM 1175 C THR A 72 -3.318 -9.111 -8.055 1.00 0.00 C ATOM 1176 O THR A 72 -4.148 -8.247 -7.750 1.00 0.00 O ATOM 1177 CB THR A 72 -3.776 -11.637 -7.878 1.00 0.00 C ATOM 1178 OG1 THR A 72 -3.941 -12.689 -6.909 1.00 0.00 O ATOM 1179 CG2 THR A 72 -2.891 -12.166 -9.021 1.00 0.00 C ATOM 0 H THR A 72 -4.822 -9.875 -5.982 1.00 0.00 H new ATOM 0 HA THR A 72 -2.107 -10.582 -7.018 1.00 0.00 H new ATOM 0 HB THR A 72 -4.734 -11.335 -8.302 1.00 0.00 H new ATOM 0 HG1 THR A 72 -4.324 -13.479 -7.345 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.361 -13.041 -9.470 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.772 -11.390 -9.778 1.00 0.00 H new ATOM 0 HG23 THR A 72 -1.913 -12.441 -8.626 1.00 0.00 H new ATOM 1187 N GLU A 73 -2.509 -8.982 -9.121 1.00 0.00 N ATOM 1188 CA GLU A 73 -2.628 -7.846 -10.048 1.00 0.00 C ATOM 1189 C GLU A 73 -3.884 -8.006 -10.926 1.00 0.00 C ATOM 1190 O GLU A 73 -4.456 -7.012 -11.348 1.00 0.00 O ATOM 1191 CB GLU A 73 -1.355 -7.678 -10.928 1.00 0.00 C ATOM 1192 CG GLU A 73 -1.130 -8.769 -11.997 1.00 0.00 C ATOM 1193 CD GLU A 73 0.125 -8.508 -12.849 1.00 0.00 C ATOM 1194 OE1 GLU A 73 0.040 -7.728 -13.824 1.00 0.00 O ATOM 1195 OE2 GLU A 73 1.203 -9.065 -12.533 1.00 0.00 O ATOM 0 H GLU A 73 -1.772 -9.645 -9.360 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.727 -6.939 -9.452 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.407 -6.711 -11.428 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.484 -7.652 -10.273 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -1.038 -9.739 -11.508 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -2.003 -8.821 -12.648 1.00 0.00 H new ATOM 1202 N GLU A 74 -4.318 -9.276 -11.145 1.00 0.00 N ATOM 1203 CA GLU A 74 -5.421 -9.644 -12.077 1.00 0.00 C ATOM 1204 C GLU A 74 -6.734 -8.886 -11.778 1.00 0.00 C ATOM 1205 O GLU A 74 -7.400 -8.374 -12.692 1.00 0.00 O ATOM 1206 CB GLU A 74 -5.664 -11.176 -12.009 1.00 0.00 C ATOM 1207 CG GLU A 74 -4.435 -12.031 -12.355 1.00 0.00 C ATOM 1208 CD GLU A 74 -4.742 -13.539 -12.350 1.00 0.00 C ATOM 1209 OE1 GLU A 74 -5.192 -14.065 -13.390 1.00 0.00 O ATOM 1210 OE2 GLU A 74 -4.554 -14.197 -11.309 1.00 0.00 O ATOM 0 H GLU A 74 -3.908 -10.083 -10.675 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.111 -9.354 -13.081 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -5.999 -11.434 -11.004 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -6.474 -11.433 -12.691 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -4.062 -11.743 -13.338 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -3.640 -11.824 -11.639 1.00 0.00 H new ATOM 1217 N GLU A 75 -7.063 -8.797 -10.484 1.00 0.00 N ATOM 1218 CA GLU A 75 -8.262 -8.089 -9.985 1.00 0.00 C ATOM 1219 C GLU A 75 -8.149 -6.555 -10.181 1.00 0.00 C ATOM 1220 O GLU A 75 -9.155 -5.841 -10.186 1.00 0.00 O ATOM 1221 CB GLU A 75 -8.459 -8.423 -8.486 1.00 0.00 C ATOM 1222 CG GLU A 75 -7.252 -8.048 -7.609 1.00 0.00 C ATOM 1223 CD GLU A 75 -7.401 -8.460 -6.144 1.00 0.00 C ATOM 1224 OE1 GLU A 75 -7.964 -7.673 -5.355 1.00 0.00 O ATOM 1225 OE2 GLU A 75 -6.967 -9.584 -5.776 1.00 0.00 O ATOM 0 H GLU A 75 -6.503 -9.216 -9.742 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.125 -8.425 -10.560 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -9.342 -7.899 -8.118 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.655 -9.490 -8.383 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -6.357 -8.517 -8.019 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.099 -6.970 -7.660 1.00 0.00 H new ATOM 1232 N LEU A 76 -6.906 -6.070 -10.317 1.00 0.00 N ATOM 1233 CA LEU A 76 -6.587 -4.638 -10.464 1.00 0.00 C ATOM 1234 C LEU A 76 -6.598 -4.201 -11.949 1.00 0.00 C ATOM 1235 O LEU A 76 -6.677 -3.002 -12.235 1.00 0.00 O ATOM 1236 CB LEU A 76 -5.187 -4.354 -9.854 1.00 0.00 C ATOM 1237 CG LEU A 76 -4.944 -4.867 -8.398 1.00 0.00 C ATOM 1238 CD1 LEU A 76 -3.495 -4.582 -7.958 1.00 0.00 C ATOM 1239 CD2 LEU A 76 -5.971 -4.291 -7.397 1.00 0.00 C ATOM 0 H LEU A 76 -6.080 -6.669 -10.328 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.352 -4.067 -9.937 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -4.435 -4.802 -10.503 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.021 -3.277 -9.869 1.00 0.00 H new ATOM 0 HG LEU A 76 -5.091 -5.947 -8.400 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.345 -4.946 -6.942 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -2.804 -5.089 -8.631 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.310 -3.508 -7.990 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.762 -4.676 -6.399 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.900 -3.203 -7.389 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.976 -4.587 -7.696 1.00 0.00 H new ATOM 1251 N LYS A 77 -6.515 -5.176 -12.882 1.00 0.00 N ATOM 1252 CA LYS A 77 -6.330 -4.900 -14.339 1.00 0.00 C ATOM 1253 C LYS A 77 -7.629 -4.387 -15.000 1.00 0.00 C ATOM 1254 O LYS A 77 -7.572 -3.728 -16.046 1.00 0.00 O ATOM 1255 CB LYS A 77 -5.822 -6.175 -15.078 1.00 0.00 C ATOM 1256 CG LYS A 77 -4.636 -6.881 -14.387 1.00 0.00 C ATOM 1257 CD LYS A 77 -3.310 -6.074 -14.354 1.00 0.00 C ATOM 1258 CE LYS A 77 -2.506 -6.173 -15.656 1.00 0.00 C ATOM 1259 NZ LYS A 77 -1.172 -5.539 -15.531 1.00 0.00 N ATOM 0 H LYS A 77 -6.573 -6.169 -12.657 1.00 0.00 H new ATOM 0 HA LYS A 77 -5.581 -4.113 -14.425 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -6.647 -6.881 -15.168 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -5.526 -5.900 -16.090 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.923 -7.118 -13.363 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -4.453 -7.828 -14.894 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.535 -5.027 -14.153 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.696 -6.432 -13.528 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.386 -7.221 -15.930 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.061 -5.695 -16.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -0.750 -5.429 -16.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.272 -4.605 -15.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.556 -6.138 -14.945 1.00 0.00 H new ATOM 1273 N THR A 78 -8.781 -4.671 -14.369 1.00 0.00 N ATOM 1274 CA THR A 78 -10.111 -4.298 -14.893 1.00 0.00 C ATOM 1275 C THR A 78 -10.360 -2.773 -14.790 1.00 0.00 C ATOM 1276 O THR A 78 -9.706 -2.080 -13.993 1.00 0.00 O ATOM 1277 CB THR A 78 -11.242 -5.098 -14.148 1.00 0.00 C ATOM 1278 OG1 THR A 78 -12.532 -4.754 -14.667 1.00 0.00 O ATOM 1279 CG2 THR A 78 -11.239 -4.867 -12.628 1.00 0.00 C ATOM 0 H THR A 78 -8.819 -5.167 -13.479 1.00 0.00 H new ATOM 0 HA THR A 78 -10.135 -4.562 -15.950 1.00 0.00 H new ATOM 0 HB THR A 78 -11.031 -6.152 -14.327 1.00 0.00 H new ATOM 0 HG1 THR A 78 -13.222 -5.263 -14.192 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.042 -5.445 -12.170 1.00 0.00 H new ATOM 0 HG22 THR A 78 -10.282 -5.184 -12.214 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.391 -3.808 -12.421 1.00 0.00 H new ATOM 1287 N LYS A 79 -11.318 -2.270 -15.600 1.00 0.00 N ATOM 1288 CA LYS A 79 -11.702 -0.842 -15.622 1.00 0.00 C ATOM 1289 C LYS A 79 -12.403 -0.467 -14.302 1.00 0.00 C ATOM 1290 O LYS A 79 -12.303 0.674 -13.835 1.00 0.00 O ATOM 1291 CB LYS A 79 -12.648 -0.528 -16.811 1.00 0.00 C ATOM 1292 CG LYS A 79 -13.031 0.968 -16.918 1.00 0.00 C ATOM 1293 CD LYS A 79 -14.087 1.262 -18.001 1.00 0.00 C ATOM 1294 CE LYS A 79 -14.447 2.757 -18.091 1.00 0.00 C ATOM 1295 NZ LYS A 79 -15.570 3.018 -19.032 1.00 0.00 N ATOM 0 H LYS A 79 -11.847 -2.844 -16.257 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.792 -0.254 -15.741 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -12.168 -0.839 -17.739 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -13.557 -1.121 -16.708 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.409 1.307 -15.953 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.134 1.549 -17.131 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.714 0.924 -18.968 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.989 0.688 -17.789 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -14.715 3.123 -17.100 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -13.570 3.320 -18.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -15.773 4.038 -19.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.307 2.695 -19.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.416 2.504 -18.714 1.00 0.00 H new ATOM 1309 N GLU A 80 -13.121 -1.460 -13.724 1.00 0.00 N ATOM 1310 CA GLU A 80 -13.786 -1.338 -12.408 1.00 0.00 C ATOM 1311 C GLU A 80 -12.771 -0.881 -11.351 1.00 0.00 C ATOM 1312 O GLU A 80 -13.024 0.052 -10.597 1.00 0.00 O ATOM 1313 CB GLU A 80 -14.417 -2.699 -11.988 1.00 0.00 C ATOM 1314 CG GLU A 80 -15.378 -3.304 -13.023 1.00 0.00 C ATOM 1315 CD GLU A 80 -15.954 -4.665 -12.582 1.00 0.00 C ATOM 1316 OE1 GLU A 80 -15.224 -5.678 -12.650 1.00 0.00 O ATOM 1317 OE2 GLU A 80 -17.133 -4.727 -12.159 1.00 0.00 O ATOM 0 H GLU A 80 -13.255 -2.372 -14.161 1.00 0.00 H new ATOM 0 HA GLU A 80 -14.581 -0.596 -12.485 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -13.616 -3.412 -11.795 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -14.954 -2.562 -11.050 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -16.198 -2.608 -13.200 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -14.853 -3.427 -13.971 1.00 0.00 H new ATOM 1324 N ALA A 81 -11.582 -1.511 -11.389 1.00 0.00 N ATOM 1325 CA ALA A 81 -10.489 -1.246 -10.443 1.00 0.00 C ATOM 1326 C ALA A 81 -9.850 0.129 -10.699 1.00 0.00 C ATOM 1327 O ALA A 81 -9.440 0.795 -9.751 1.00 0.00 O ATOM 1328 CB ALA A 81 -9.442 -2.357 -10.512 1.00 0.00 C ATOM 0 H ALA A 81 -11.354 -2.223 -12.083 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.909 -1.231 -9.437 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.640 -2.145 -9.805 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -9.906 -3.310 -10.259 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.033 -2.409 -11.521 1.00 0.00 H new ATOM 1334 N LYS A 82 -9.777 0.553 -11.987 1.00 0.00 N ATOM 1335 CA LYS A 82 -9.278 1.906 -12.358 1.00 0.00 C ATOM 1336 C LYS A 82 -10.130 2.977 -11.655 1.00 0.00 C ATOM 1337 O LYS A 82 -9.604 3.941 -11.086 1.00 0.00 O ATOM 1338 CB LYS A 82 -9.348 2.139 -13.897 1.00 0.00 C ATOM 1339 CG LYS A 82 -8.566 1.142 -14.788 1.00 0.00 C ATOM 1340 CD LYS A 82 -7.019 1.173 -14.588 1.00 0.00 C ATOM 1341 CE LYS A 82 -6.497 0.000 -13.738 1.00 0.00 C ATOM 1342 NZ LYS A 82 -6.784 -1.311 -14.384 1.00 0.00 N ATOM 0 H LYS A 82 -10.056 -0.019 -12.784 1.00 0.00 H new ATOM 0 HA LYS A 82 -8.237 1.976 -12.044 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -10.395 2.115 -14.197 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -8.980 3.143 -14.106 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -8.926 0.133 -14.585 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -8.789 1.356 -15.833 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.532 1.153 -15.563 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.739 2.112 -14.111 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -5.422 0.106 -13.590 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.959 0.030 -12.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -6.390 -2.078 -13.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -7.813 -1.437 -14.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.350 -1.335 -15.329 1.00 0.00 H new ATOM 1356 N GLU A 83 -11.458 2.754 -11.686 1.00 0.00 N ATOM 1357 CA GLU A 83 -12.437 3.633 -11.051 1.00 0.00 C ATOM 1358 C GLU A 83 -12.397 3.495 -9.525 1.00 0.00 C ATOM 1359 O GLU A 83 -12.555 4.475 -8.830 1.00 0.00 O ATOM 1360 CB GLU A 83 -13.860 3.349 -11.581 1.00 0.00 C ATOM 1361 CG GLU A 83 -14.010 3.561 -13.100 1.00 0.00 C ATOM 1362 CD GLU A 83 -15.465 3.739 -13.540 1.00 0.00 C ATOM 1363 OE1 GLU A 83 -16.087 4.745 -13.113 1.00 0.00 O ATOM 1364 OE2 GLU A 83 -15.980 2.922 -14.336 1.00 0.00 O ATOM 0 H GLU A 83 -11.876 1.952 -12.157 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.173 4.659 -11.306 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -14.130 2.321 -11.338 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -14.567 3.995 -11.061 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.437 4.439 -13.397 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.580 2.708 -13.624 1.00 0.00 H new ATOM 1371 N ARG A 84 -12.169 2.278 -9.010 1.00 0.00 N ATOM 1372 CA ARG A 84 -12.101 2.040 -7.551 1.00 0.00 C ATOM 1373 C ARG A 84 -10.976 2.870 -6.924 1.00 0.00 C ATOM 1374 O ARG A 84 -11.206 3.636 -5.991 1.00 0.00 O ATOM 1375 CB ARG A 84 -11.890 0.529 -7.234 1.00 0.00 C ATOM 1376 CG ARG A 84 -13.130 -0.358 -7.484 1.00 0.00 C ATOM 1377 CD ARG A 84 -12.842 -1.859 -7.294 1.00 0.00 C ATOM 1378 NE ARG A 84 -14.035 -2.684 -7.555 1.00 0.00 N ATOM 1379 CZ ARG A 84 -14.031 -4.010 -7.757 1.00 0.00 C ATOM 1380 NH1 ARG A 84 -12.898 -4.703 -7.774 1.00 0.00 N ATOM 1381 NH2 ARG A 84 -15.182 -4.639 -7.923 1.00 0.00 N ATOM 0 H ARG A 84 -12.028 1.441 -9.576 1.00 0.00 H new ATOM 0 HA ARG A 84 -13.053 2.349 -7.120 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -11.064 0.156 -7.840 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -11.591 0.428 -6.191 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -13.928 -0.058 -6.805 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -13.493 -0.188 -8.498 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -12.037 -2.162 -7.964 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -12.494 -2.036 -6.276 1.00 0.00 H new ATOM 0 HE ARG A 84 -14.937 -2.208 -7.584 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -12.007 -4.227 -7.632 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -12.919 -5.711 -7.929 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -16.057 -4.116 -7.897 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -15.195 -5.647 -8.078 1.00 0.00 H new ATOM 1395 N TRP A 85 -9.780 2.736 -7.499 1.00 0.00 N ATOM 1396 CA TRP A 85 -8.570 3.438 -7.035 1.00 0.00 C ATOM 1397 C TRP A 85 -8.633 4.954 -7.292 1.00 0.00 C ATOM 1398 O TRP A 85 -7.998 5.726 -6.570 1.00 0.00 O ATOM 1399 CB TRP A 85 -7.313 2.805 -7.685 1.00 0.00 C ATOM 1400 CG TRP A 85 -7.109 1.350 -7.294 1.00 0.00 C ATOM 1401 CD1 TRP A 85 -6.932 0.285 -8.139 1.00 0.00 C ATOM 1402 CD2 TRP A 85 -7.086 0.803 -5.958 1.00 0.00 C ATOM 1403 NE1 TRP A 85 -6.818 -0.872 -7.421 1.00 0.00 N ATOM 1404 CE2 TRP A 85 -6.902 -0.583 -6.085 1.00 0.00 C ATOM 1405 CE3 TRP A 85 -7.200 1.348 -4.665 1.00 0.00 C ATOM 1406 CZ2 TRP A 85 -6.831 -1.430 -4.980 1.00 0.00 C ATOM 1407 CZ3 TRP A 85 -7.131 0.507 -3.573 1.00 0.00 C ATOM 1408 CH2 TRP A 85 -6.949 -0.869 -3.738 1.00 0.00 C ATOM 0 H TRP A 85 -9.617 2.134 -8.306 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.509 3.317 -5.953 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -7.397 2.875 -8.769 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -6.433 3.380 -7.396 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -6.889 0.351 -9.216 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -6.691 -1.803 -7.817 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -7.340 2.410 -4.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -6.688 -2.494 -5.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -7.219 0.917 -2.578 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -6.900 -1.503 -2.865 1.00 0.00 H new ATOM 1419 N ARG A 86 -9.402 5.368 -8.317 1.00 0.00 N ATOM 1420 CA ARG A 86 -9.613 6.795 -8.624 1.00 0.00 C ATOM 1421 C ARG A 86 -10.559 7.435 -7.597 1.00 0.00 C ATOM 1422 O ARG A 86 -10.241 8.470 -7.034 1.00 0.00 O ATOM 1423 CB ARG A 86 -10.177 6.983 -10.051 1.00 0.00 C ATOM 1424 CG ARG A 86 -10.393 8.461 -10.446 1.00 0.00 C ATOM 1425 CD ARG A 86 -10.818 8.630 -11.910 1.00 0.00 C ATOM 1426 NE ARG A 86 -10.863 10.047 -12.316 1.00 0.00 N ATOM 1427 CZ ARG A 86 -11.627 10.550 -13.296 1.00 0.00 C ATOM 1428 NH1 ARG A 86 -12.526 9.791 -13.920 1.00 0.00 N ATOM 1429 NH2 ARG A 86 -11.508 11.822 -13.630 1.00 0.00 N ATOM 0 H ARG A 86 -9.889 4.732 -8.948 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.644 7.292 -8.570 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.495 6.522 -10.765 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -11.126 6.453 -10.129 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.154 8.898 -9.799 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -9.471 9.017 -10.274 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.122 8.091 -12.553 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -11.800 8.180 -12.056 1.00 0.00 H new ATOM 0 HE ARG A 86 -10.263 10.698 -11.809 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -12.640 8.813 -13.654 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -13.100 10.188 -14.664 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.837 12.417 -13.143 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.087 12.210 -14.375 1.00 0.00 H new ATOM 1443 N LYS A 87 -11.723 6.800 -7.374 1.00 0.00 N ATOM 1444 CA LYS A 87 -12.744 7.256 -6.394 1.00 0.00 C ATOM 1445 C LYS A 87 -12.219 7.129 -4.948 1.00 0.00 C ATOM 1446 O LYS A 87 -12.684 7.835 -4.047 1.00 0.00 O ATOM 1447 CB LYS A 87 -14.099 6.485 -6.573 1.00 0.00 C ATOM 1448 CG LYS A 87 -15.006 6.982 -7.738 1.00 0.00 C ATOM 1449 CD LYS A 87 -14.370 6.813 -9.138 1.00 0.00 C ATOM 1450 CE LYS A 87 -15.187 7.454 -10.272 1.00 0.00 C ATOM 1451 NZ LYS A 87 -16.407 6.660 -10.602 1.00 0.00 N ATOM 0 H LYS A 87 -11.991 5.949 -7.869 1.00 0.00 H new ATOM 0 HA LYS A 87 -12.940 8.310 -6.590 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -13.878 5.430 -6.733 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.662 6.555 -5.642 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.950 6.437 -7.709 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.241 8.035 -7.580 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.372 7.252 -9.129 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.249 5.750 -9.346 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.479 8.463 -9.982 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.563 7.546 -11.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.193 7.305 -10.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.216 6.058 -11.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -16.663 6.063 -9.790 1.00 0.00 H new ATOM 1465 N PHE A 88 -11.240 6.232 -4.748 1.00 0.00 N ATOM 1466 CA PHE A 88 -10.526 6.094 -3.471 1.00 0.00 C ATOM 1467 C PHE A 88 -9.607 7.316 -3.281 1.00 0.00 C ATOM 1468 O PHE A 88 -9.562 7.909 -2.204 1.00 0.00 O ATOM 1469 CB PHE A 88 -9.722 4.768 -3.458 1.00 0.00 C ATOM 1470 CG PHE A 88 -9.143 4.362 -2.109 1.00 0.00 C ATOM 1471 CD1 PHE A 88 -9.912 4.439 -0.947 1.00 0.00 C ATOM 1472 CD2 PHE A 88 -7.847 3.869 -2.006 1.00 0.00 C ATOM 1473 CE1 PHE A 88 -9.398 4.043 0.266 1.00 0.00 C ATOM 1474 CE2 PHE A 88 -7.334 3.479 -0.786 1.00 0.00 C ATOM 1475 CZ PHE A 88 -8.107 3.565 0.348 1.00 0.00 C ATOM 0 H PHE A 88 -10.922 5.583 -5.468 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.233 6.058 -2.642 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.372 3.967 -3.810 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.904 4.853 -4.173 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -10.923 4.814 -1.001 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.234 3.790 -2.892 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -10.007 4.107 1.156 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.323 3.105 -0.722 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.704 3.259 1.302 1.00 0.00 H new ATOM 1485 N PHE A 89 -8.906 7.698 -4.372 1.00 0.00 N ATOM 1486 CA PHE A 89 -8.080 8.918 -4.415 1.00 0.00 C ATOM 1487 C PHE A 89 -8.940 10.188 -4.234 1.00 0.00 C ATOM 1488 O PHE A 89 -8.506 11.112 -3.563 1.00 0.00 O ATOM 1489 CB PHE A 89 -7.261 8.998 -5.747 1.00 0.00 C ATOM 1490 CG PHE A 89 -6.771 10.413 -6.122 1.00 0.00 C ATOM 1491 CD1 PHE A 89 -5.886 11.113 -5.297 1.00 0.00 C ATOM 1492 CD2 PHE A 89 -7.236 11.058 -7.272 1.00 0.00 C ATOM 1493 CE1 PHE A 89 -5.479 12.394 -5.615 1.00 0.00 C ATOM 1494 CE2 PHE A 89 -6.828 12.345 -7.584 1.00 0.00 C ATOM 1495 CZ PHE A 89 -5.949 13.009 -6.756 1.00 0.00 C ATOM 0 H PHE A 89 -8.899 7.168 -5.244 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.378 8.864 -3.583 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.396 8.339 -5.666 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -7.878 8.615 -6.560 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -5.515 10.645 -4.397 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -7.924 10.545 -7.928 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.790 12.916 -4.967 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -7.199 12.828 -8.476 1.00 0.00 H new ATOM 0 HZ PHE A 89 -5.628 14.011 -7.001 1.00 0.00 H new ATOM 1505 N THR A 90 -10.146 10.241 -4.838 1.00 0.00 N ATOM 1506 CA THR A 90 -10.995 11.458 -4.797 1.00 0.00 C ATOM 1507 C THR A 90 -11.429 11.822 -3.354 1.00 0.00 C ATOM 1508 O THR A 90 -11.904 12.930 -3.108 1.00 0.00 O ATOM 1509 CB THR A 90 -12.235 11.381 -5.753 1.00 0.00 C ATOM 1510 OG1 THR A 90 -13.100 10.298 -5.384 1.00 0.00 O ATOM 1511 CG2 THR A 90 -11.816 11.231 -7.236 1.00 0.00 C ATOM 0 H THR A 90 -10.554 9.463 -5.357 1.00 0.00 H new ATOM 0 HA THR A 90 -10.361 12.263 -5.169 1.00 0.00 H new ATOM 0 HB THR A 90 -12.773 12.323 -5.647 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.601 9.651 -4.843 1.00 0.00 H new ATOM 0 HG21 THR A 90 -12.707 11.182 -7.862 1.00 0.00 H new ATOM 0 HG22 THR A 90 -11.211 12.088 -7.532 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.235 10.317 -7.359 1.00 0.00 H new ATOM 1519 N ILE A 91 -11.281 10.874 -2.414 1.00 0.00 N ATOM 1520 CA ILE A 91 -11.430 11.139 -0.967 1.00 0.00 C ATOM 1521 C ILE A 91 -10.153 11.846 -0.426 1.00 0.00 C ATOM 1522 O ILE A 91 -10.229 12.824 0.327 1.00 0.00 O ATOM 1523 CB ILE A 91 -11.680 9.795 -0.181 1.00 0.00 C ATOM 1524 CG1 ILE A 91 -12.881 9.010 -0.807 1.00 0.00 C ATOM 1525 CG2 ILE A 91 -11.913 10.040 1.335 1.00 0.00 C ATOM 1526 CD1 ILE A 91 -13.124 7.631 -0.206 1.00 0.00 C ATOM 0 H ILE A 91 -11.055 9.903 -2.631 1.00 0.00 H new ATOM 0 HA ILE A 91 -12.291 11.791 -0.817 1.00 0.00 H new ATOM 0 HB ILE A 91 -10.778 9.190 -0.273 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -13.786 9.606 -0.692 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -12.706 8.899 -1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -12.081 9.087 1.836 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.037 10.526 1.764 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -12.785 10.680 1.470 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.974 7.163 -0.702 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -12.237 7.012 -0.345 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -13.334 7.730 0.859 1.00 0.00 H new ATOM 1538 N PHE A 92 -8.979 11.354 -0.872 1.00 0.00 N ATOM 1539 CA PHE A 92 -7.647 11.748 -0.338 1.00 0.00 C ATOM 1540 C PHE A 92 -6.920 12.763 -1.236 1.00 0.00 C ATOM 1541 O PHE A 92 -5.762 13.086 -0.986 1.00 0.00 O ATOM 1542 CB PHE A 92 -6.784 10.483 -0.110 1.00 0.00 C ATOM 1543 CG PHE A 92 -7.476 9.470 0.786 1.00 0.00 C ATOM 1544 CD1 PHE A 92 -7.861 9.813 2.084 1.00 0.00 C ATOM 1545 CD2 PHE A 92 -7.785 8.202 0.323 1.00 0.00 C ATOM 1546 CE1 PHE A 92 -8.525 8.906 2.878 1.00 0.00 C ATOM 1547 CE2 PHE A 92 -8.451 7.305 1.119 1.00 0.00 C ATOM 1548 CZ PHE A 92 -8.823 7.656 2.393 1.00 0.00 C ATOM 0 H PHE A 92 -8.922 10.664 -1.621 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.809 12.253 0.614 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.558 10.021 -1.071 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.832 10.770 0.337 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.636 10.797 2.467 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.498 7.916 -0.678 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.812 9.177 3.883 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.683 6.320 0.742 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.351 6.948 3.015 1.00 0.00 H new ATOM 1558 N GLU A 93 -7.613 13.282 -2.263 1.00 0.00 N ATOM 1559 CA GLU A 93 -7.117 14.421 -3.075 1.00 0.00 C ATOM 1560 C GLU A 93 -7.048 15.692 -2.204 1.00 0.00 C ATOM 1561 O GLU A 93 -6.247 16.593 -2.455 1.00 0.00 O ATOM 1562 CB GLU A 93 -8.047 14.667 -4.289 1.00 0.00 C ATOM 1563 CG GLU A 93 -9.517 14.939 -3.916 1.00 0.00 C ATOM 1564 CD GLU A 93 -10.349 15.493 -5.080 1.00 0.00 C ATOM 1565 OE1 GLU A 93 -10.912 14.703 -5.865 1.00 0.00 O ATOM 1566 OE2 GLU A 93 -10.438 16.730 -5.223 1.00 0.00 O ATOM 0 H GLU A 93 -8.525 12.933 -2.557 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.120 14.180 -3.443 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -7.666 15.515 -4.858 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -8.006 13.798 -4.946 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -9.972 14.013 -3.563 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.549 15.646 -3.087 1.00 0.00 H new ATOM 1573 N LYS A 94 -7.916 15.718 -1.177 1.00 0.00 N ATOM 1574 CA LYS A 94 -8.040 16.815 -0.215 1.00 0.00 C ATOM 1575 C LYS A 94 -6.812 16.883 0.732 1.00 0.00 C ATOM 1576 O LYS A 94 -6.559 17.926 1.350 1.00 0.00 O ATOM 1577 CB LYS A 94 -9.343 16.602 0.607 1.00 0.00 C ATOM 1578 CG LYS A 94 -10.650 16.514 -0.229 1.00 0.00 C ATOM 1579 CD LYS A 94 -11.009 17.839 -0.937 1.00 0.00 C ATOM 1580 CE LYS A 94 -11.307 18.985 0.049 1.00 0.00 C ATOM 1581 NZ LYS A 94 -11.563 20.265 -0.653 1.00 0.00 N ATOM 0 H LYS A 94 -8.566 14.954 -0.993 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.083 17.760 -0.756 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -9.241 15.685 1.188 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.441 17.421 1.319 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.544 15.727 -0.976 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.473 16.224 0.424 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.185 18.132 -1.588 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.878 17.680 -1.575 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.173 18.725 0.657 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -10.465 19.106 0.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -11.759 21.011 0.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.727 20.527 -1.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.383 20.157 -1.284 1.00 0.00 H new ATOM 1595 N LYS A 95 -6.055 15.761 0.839 1.00 0.00 N ATOM 1596 CA LYS A 95 -4.925 15.643 1.779 1.00 0.00 C ATOM 1597 C LYS A 95 -3.675 14.994 1.118 1.00 0.00 C ATOM 1598 O LYS A 95 -2.649 15.674 0.940 1.00 0.00 O ATOM 1599 CB LYS A 95 -5.346 14.913 3.102 1.00 0.00 C ATOM 1600 CG LYS A 95 -6.126 13.573 2.989 1.00 0.00 C ATOM 1601 CD LYS A 95 -7.631 13.731 2.650 1.00 0.00 C ATOM 1602 CE LYS A 95 -8.393 14.669 3.606 1.00 0.00 C ATOM 1603 NZ LYS A 95 -8.307 14.241 5.025 1.00 0.00 N ATOM 0 H LYS A 95 -6.214 14.923 0.279 1.00 0.00 H new ATOM 0 HA LYS A 95 -4.633 16.656 2.055 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -4.441 14.723 3.679 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -5.956 15.604 3.684 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.656 12.958 2.222 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.034 13.033 3.931 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.726 14.111 1.633 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.102 12.748 2.669 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -7.993 15.679 3.511 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.440 14.711 3.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -8.808 14.926 5.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.743 13.303 5.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -7.309 14.193 5.313 1.00 0.00 H new ATOM 1617 N ILE A 96 -3.756 13.700 0.740 1.00 0.00 N ATOM 1618 CA ILE A 96 -2.591 12.947 0.225 1.00 0.00 C ATOM 1619 C ILE A 96 -2.330 13.275 -1.261 1.00 0.00 C ATOM 1620 O ILE A 96 -2.993 12.739 -2.164 1.00 0.00 O ATOM 1621 CB ILE A 96 -2.742 11.388 0.392 1.00 0.00 C ATOM 1622 CG1 ILE A 96 -3.218 10.998 1.828 1.00 0.00 C ATOM 1623 CG2 ILE A 96 -1.400 10.682 0.040 1.00 0.00 C ATOM 1624 CD1 ILE A 96 -2.297 11.437 2.961 1.00 0.00 C ATOM 0 H ILE A 96 -4.617 13.154 0.782 1.00 0.00 H new ATOM 0 HA ILE A 96 -1.742 13.266 0.829 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.513 11.050 -0.301 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.205 11.430 1.996 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.332 9.915 1.874 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -1.514 9.604 0.158 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.130 10.907 -0.992 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.615 11.039 0.707 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.717 11.118 3.915 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.315 10.984 2.827 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.201 12.523 2.952 1.00 0.00 H new ATOM 1636 N GLU A 97 -1.376 14.186 -1.489 1.00 0.00 N ATOM 1637 CA GLU A 97 -0.884 14.526 -2.837 1.00 0.00 C ATOM 1638 C GLU A 97 0.115 13.474 -3.366 1.00 0.00 C ATOM 1639 O GLU A 97 0.266 13.319 -4.579 1.00 0.00 O ATOM 1640 CB GLU A 97 -0.234 15.926 -2.832 1.00 0.00 C ATOM 1641 CG GLU A 97 -1.198 17.060 -2.443 1.00 0.00 C ATOM 1642 CD GLU A 97 -0.574 18.453 -2.598 1.00 0.00 C ATOM 1643 OE1 GLU A 97 -0.576 18.989 -3.725 1.00 0.00 O ATOM 1644 OE2 GLU A 97 -0.059 19.007 -1.604 1.00 0.00 O ATOM 0 H GLU A 97 -0.920 14.712 -0.744 1.00 0.00 H new ATOM 0 HA GLU A 97 -1.742 14.532 -3.509 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.607 15.923 -2.138 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.171 16.131 -3.823 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -2.093 16.997 -3.062 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -1.515 16.922 -1.409 1.00 0.00 H new ATOM 1651 N ASP A 98 0.772 12.737 -2.443 1.00 0.00 N ATOM 1652 CA ASP A 98 1.779 11.685 -2.774 1.00 0.00 C ATOM 1653 C ASP A 98 1.133 10.363 -3.242 1.00 0.00 C ATOM 1654 O ASP A 98 1.791 9.321 -3.217 1.00 0.00 O ATOM 1655 CB ASP A 98 2.685 11.399 -1.536 1.00 0.00 C ATOM 1656 CG ASP A 98 3.730 12.493 -1.266 1.00 0.00 C ATOM 1657 OD1 ASP A 98 3.387 13.517 -0.624 1.00 0.00 O ATOM 1658 OD2 ASP A 98 4.902 12.337 -1.693 1.00 0.00 O ATOM 0 H ASP A 98 0.623 12.850 -1.440 1.00 0.00 H new ATOM 0 HA ASP A 98 2.374 12.074 -3.601 1.00 0.00 H new ATOM 0 HB2 ASP A 98 2.054 11.287 -0.654 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.198 10.449 -1.684 1.00 0.00 H new ATOM 1663 N TYR A 99 -0.125 10.403 -3.706 1.00 0.00 N ATOM 1664 CA TYR A 99 -0.880 9.182 -4.056 1.00 0.00 C ATOM 1665 C TYR A 99 -0.228 8.452 -5.256 1.00 0.00 C ATOM 1666 O TYR A 99 -0.183 7.232 -5.285 1.00 0.00 O ATOM 1667 CB TYR A 99 -2.378 9.523 -4.353 1.00 0.00 C ATOM 1668 CG TYR A 99 -2.692 9.927 -5.799 1.00 0.00 C ATOM 1669 CD1 TYR A 99 -2.358 11.189 -6.288 1.00 0.00 C ATOM 1670 CD2 TYR A 99 -3.320 9.032 -6.679 1.00 0.00 C ATOM 1671 CE1 TYR A 99 -2.634 11.542 -7.595 1.00 0.00 C ATOM 1672 CE2 TYR A 99 -3.593 9.382 -7.986 1.00 0.00 C ATOM 1673 CZ TYR A 99 -3.252 10.640 -8.439 1.00 0.00 C ATOM 1674 OH TYR A 99 -3.508 10.996 -9.746 1.00 0.00 O ATOM 0 H TYR A 99 -0.645 11.268 -3.849 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.850 8.508 -3.200 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.987 8.656 -4.097 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -2.685 10.335 -3.693 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -1.876 11.902 -5.635 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.595 8.049 -6.326 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -2.366 12.524 -7.957 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -4.070 8.676 -8.650 1.00 0.00 H new ATOM 0 HH TYR A 99 -3.946 10.251 -10.208 1.00 0.00 H new ATOM 1684 N ASN A 100 0.294 9.242 -6.223 1.00 0.00 N ATOM 1685 CA ASN A 100 0.853 8.741 -7.504 1.00 0.00 C ATOM 1686 C ASN A 100 2.397 8.837 -7.493 1.00 0.00 C ATOM 1687 O ASN A 100 3.050 8.815 -8.544 1.00 0.00 O ATOM 1688 CB ASN A 100 0.236 9.568 -8.676 1.00 0.00 C ATOM 1689 CG ASN A 100 0.489 9.009 -10.080 1.00 0.00 C ATOM 1690 OD1 ASN A 100 0.618 7.798 -10.275 1.00 0.00 O ATOM 1691 ND2 ASN A 100 0.568 9.891 -11.068 1.00 0.00 N ATOM 0 H ASN A 100 0.340 10.257 -6.136 1.00 0.00 H new ATOM 0 HA ASN A 100 0.597 7.690 -7.639 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -0.840 9.639 -8.520 1.00 0.00 H new ATOM 0 HB3 ASN A 100 0.632 10.582 -8.630 1.00 0.00 H new ATOM 0 HD21 ASN A 100 0.740 9.574 -12.022 1.00 0.00 H new ATOM 0 HD22 ASN A 100 0.457 10.886 -10.873 1.00 0.00 H new ATOM 1698 N PHE A 101 2.973 8.931 -6.278 1.00 0.00 N ATOM 1699 CA PHE A 101 4.434 8.968 -6.079 1.00 0.00 C ATOM 1700 C PHE A 101 5.042 7.622 -6.515 1.00 0.00 C ATOM 1701 O PHE A 101 6.161 7.568 -7.036 1.00 0.00 O ATOM 1702 CB PHE A 101 4.759 9.276 -4.589 1.00 0.00 C ATOM 1703 CG PHE A 101 6.250 9.283 -4.231 1.00 0.00 C ATOM 1704 CD1 PHE A 101 7.050 10.387 -4.521 1.00 0.00 C ATOM 1705 CD2 PHE A 101 6.850 8.185 -3.602 1.00 0.00 C ATOM 1706 CE1 PHE A 101 8.393 10.393 -4.197 1.00 0.00 C ATOM 1707 CE2 PHE A 101 8.194 8.194 -3.278 1.00 0.00 C ATOM 1708 CZ PHE A 101 8.965 9.298 -3.573 1.00 0.00 C ATOM 0 H PHE A 101 2.440 8.983 -5.410 1.00 0.00 H new ATOM 0 HA PHE A 101 4.871 9.759 -6.688 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.337 10.249 -4.336 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.256 8.538 -3.964 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.614 11.249 -5.005 1.00 0.00 H new ATOM 0 HD2 PHE A 101 6.253 7.317 -3.366 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.999 11.256 -4.432 1.00 0.00 H new ATOM 0 HE2 PHE A 101 8.639 7.337 -2.794 1.00 0.00 H new ATOM 0 HZ PHE A 101 10.014 9.308 -3.317 1.00 0.00 H new ATOM 1718 N GLY A 102 4.262 6.547 -6.296 1.00 0.00 N ATOM 1719 CA GLY A 102 4.644 5.205 -6.695 1.00 0.00 C ATOM 1720 C GLY A 102 5.527 4.534 -5.656 1.00 0.00 C ATOM 1721 O GLY A 102 6.615 5.030 -5.339 1.00 0.00 O ATOM 0 H GLY A 102 3.353 6.598 -5.837 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.748 4.604 -6.852 1.00 0.00 H new ATOM 0 HA3 GLY A 102 5.172 5.246 -7.648 1.00 0.00 H new ATOM 1725 N THR A 103 5.040 3.423 -5.097 1.00 0.00 N ATOM 1726 CA THR A 103 5.771 2.638 -4.088 1.00 0.00 C ATOM 1727 C THR A 103 5.560 1.124 -4.330 1.00 0.00 C ATOM 1728 O THR A 103 4.511 0.710 -4.854 1.00 0.00 O ATOM 1729 CB THR A 103 5.310 3.064 -2.647 1.00 0.00 C ATOM 1730 OG1 THR A 103 5.578 4.464 -2.444 1.00 0.00 O ATOM 1731 CG2 THR A 103 5.989 2.262 -1.529 1.00 0.00 C ATOM 0 H THR A 103 4.125 3.038 -5.330 1.00 0.00 H new ATOM 0 HA THR A 103 6.839 2.839 -4.175 1.00 0.00 H new ATOM 0 HB THR A 103 4.241 2.857 -2.592 1.00 0.00 H new ATOM 0 HG1 THR A 103 5.753 4.629 -1.494 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.625 2.607 -0.561 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.756 1.204 -1.648 1.00 0.00 H new ATOM 0 HG23 THR A 103 7.068 2.405 -1.583 1.00 0.00 H new ATOM 1739 N LEU A 104 6.579 0.312 -3.960 1.00 0.00 N ATOM 1740 CA LEU A 104 6.498 -1.157 -4.010 1.00 0.00 C ATOM 1741 C LEU A 104 5.568 -1.631 -2.892 1.00 0.00 C ATOM 1742 O LEU A 104 5.917 -1.543 -1.707 1.00 0.00 O ATOM 1743 CB LEU A 104 7.900 -1.837 -3.843 1.00 0.00 C ATOM 1744 CG LEU A 104 8.917 -1.683 -5.017 1.00 0.00 C ATOM 1745 CD1 LEU A 104 9.417 -0.238 -5.153 1.00 0.00 C ATOM 1746 CD2 LEU A 104 10.103 -2.668 -4.868 1.00 0.00 C ATOM 0 H LEU A 104 7.475 0.661 -3.620 1.00 0.00 H new ATOM 0 HA LEU A 104 6.114 -1.443 -4.989 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.363 -1.437 -2.941 1.00 0.00 H new ATOM 0 HB3 LEU A 104 7.740 -2.902 -3.673 1.00 0.00 H new ATOM 0 HG LEU A 104 8.385 -1.933 -5.935 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.123 -0.174 -5.981 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.572 0.423 -5.344 1.00 0.00 H new ATOM 0 HD13 LEU A 104 9.912 0.064 -4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.793 -2.535 -5.701 1.00 0.00 H new ATOM 0 HD22 LEU A 104 10.624 -2.471 -3.931 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.728 -3.691 -4.867 1.00 0.00 H new ATOM 1758 N LEU A 105 4.380 -2.090 -3.280 1.00 0.00 N ATOM 1759 CA LEU A 105 3.420 -2.687 -2.355 1.00 0.00 C ATOM 1760 C LEU A 105 3.574 -4.199 -2.415 1.00 0.00 C ATOM 1761 O LEU A 105 3.582 -4.792 -3.504 1.00 0.00 O ATOM 1762 CB LEU A 105 1.980 -2.270 -2.723 1.00 0.00 C ATOM 1763 CG LEU A 105 0.813 -2.935 -1.924 1.00 0.00 C ATOM 1764 CD1 LEU A 105 0.935 -2.709 -0.402 1.00 0.00 C ATOM 1765 CD2 LEU A 105 -0.551 -2.446 -2.453 1.00 0.00 C ATOM 0 H LEU A 105 4.056 -2.058 -4.247 1.00 0.00 H new ATOM 0 HA LEU A 105 3.614 -2.336 -1.341 1.00 0.00 H new ATOM 0 HB2 LEU A 105 1.900 -1.190 -2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.828 -2.482 -3.781 1.00 0.00 H new ATOM 0 HG LEU A 105 0.884 -4.011 -2.084 1.00 0.00 H new ATOM 0 HD11 LEU A 105 0.100 -3.191 0.106 1.00 0.00 H new ATOM 0 HD12 LEU A 105 1.872 -3.136 -0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 105 0.920 -1.640 -0.191 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.352 -2.919 -1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.618 -1.364 -2.342 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.648 -2.709 -3.506 1.00 0.00 H new ATOM 1777 N ARG A 106 3.727 -4.798 -1.232 1.00 0.00 N ATOM 1778 CA ARG A 106 3.832 -6.243 -1.080 1.00 0.00 C ATOM 1779 C ARG A 106 2.500 -6.882 -1.504 1.00 0.00 C ATOM 1780 O ARG A 106 1.435 -6.475 -1.017 1.00 0.00 O ATOM 1781 CB ARG A 106 4.139 -6.614 0.391 1.00 0.00 C ATOM 1782 CG ARG A 106 5.214 -5.761 1.090 1.00 0.00 C ATOM 1783 CD ARG A 106 5.277 -6.050 2.603 1.00 0.00 C ATOM 1784 NE ARG A 106 6.145 -5.093 3.307 1.00 0.00 N ATOM 1785 CZ ARG A 106 7.369 -5.364 3.770 1.00 0.00 C ATOM 1786 NH1 ARG A 106 7.898 -6.578 3.601 1.00 0.00 N ATOM 1787 NH2 ARG A 106 8.057 -4.421 4.406 1.00 0.00 N ATOM 0 H ARG A 106 3.781 -4.288 -0.350 1.00 0.00 H new ATOM 0 HA ARG A 106 4.645 -6.612 -1.706 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.215 -6.540 0.964 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.452 -7.657 0.424 1.00 0.00 H new ATOM 0 HG2 ARG A 106 6.187 -5.961 0.641 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.001 -4.704 0.930 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.272 -6.007 3.023 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.647 -7.063 2.764 1.00 0.00 H new ATOM 0 HE ARG A 106 5.785 -4.150 3.453 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.368 -7.303 3.117 1.00 0.00 H new ATOM 0 HH12 ARG A 106 8.833 -6.781 3.956 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.650 -3.495 4.539 1.00 0.00 H new ATOM 0 HH22 ARG A 106 8.992 -4.623 4.761 1.00 0.00 H new ATOM 1801 N THR A 107 2.569 -7.874 -2.397 1.00 0.00 N ATOM 1802 CA THR A 107 1.395 -8.621 -2.877 1.00 0.00 C ATOM 1803 C THR A 107 0.925 -9.672 -1.839 1.00 0.00 C ATOM 1804 O THR A 107 -0.006 -10.435 -2.103 1.00 0.00 O ATOM 1805 CB THR A 107 1.720 -9.293 -4.251 1.00 0.00 C ATOM 1806 OG1 THR A 107 2.859 -10.158 -4.116 1.00 0.00 O ATOM 1807 CG2 THR A 107 2.013 -8.241 -5.333 1.00 0.00 C ATOM 0 H THR A 107 3.447 -8.186 -2.812 1.00 0.00 H new ATOM 0 HA THR A 107 0.573 -7.918 -3.014 1.00 0.00 H new ATOM 0 HB THR A 107 0.846 -9.870 -4.554 1.00 0.00 H new ATOM 0 HG1 THR A 107 3.285 -10.277 -4.991 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.235 -8.741 -6.276 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.143 -7.597 -5.460 1.00 0.00 H new ATOM 0 HG23 THR A 107 2.869 -7.638 -5.032 1.00 0.00 H new ATOM 1815 N ASP A 108 1.599 -9.691 -0.665 1.00 0.00 N ATOM 1816 CA ASP A 108 1.234 -10.514 0.512 1.00 0.00 C ATOM 1817 C ASP A 108 1.818 -9.831 1.780 1.00 0.00 C ATOM 1818 O ASP A 108 2.685 -8.970 1.659 1.00 0.00 O ATOM 1819 CB ASP A 108 1.765 -11.973 0.324 1.00 0.00 C ATOM 1820 CG ASP A 108 1.258 -12.982 1.373 1.00 0.00 C ATOM 1821 OD1 ASP A 108 1.835 -13.044 2.470 1.00 0.00 O ATOM 1822 OD2 ASP A 108 0.285 -13.727 1.102 1.00 0.00 O ATOM 0 H ASP A 108 2.430 -9.122 -0.506 1.00 0.00 H new ATOM 0 HA ASP A 108 0.152 -10.584 0.623 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.478 -12.325 -0.667 1.00 0.00 H new ATOM 0 HB3 ASP A 108 2.854 -11.955 0.353 1.00 0.00 H new ATOM 1827 N ALA A 109 1.338 -10.181 2.988 1.00 0.00 N ATOM 1828 CA ALA A 109 1.890 -9.618 4.251 1.00 0.00 C ATOM 1829 C ALA A 109 3.223 -10.285 4.599 1.00 0.00 C ATOM 1830 O ALA A 109 4.199 -9.614 4.947 1.00 0.00 O ATOM 1831 CB ALA A 109 0.908 -9.779 5.408 1.00 0.00 C ATOM 0 H ALA A 109 0.576 -10.845 3.124 1.00 0.00 H new ATOM 0 HA ALA A 109 2.056 -8.553 4.092 1.00 0.00 H new ATOM 0 HB1 ALA A 109 1.342 -9.358 6.315 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.020 -9.257 5.173 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.699 -10.837 5.564 1.00 0.00 H new ATOM 1837 N SER A 110 3.242 -11.620 4.448 1.00 0.00 N ATOM 1838 CA SER A 110 4.438 -12.462 4.619 1.00 0.00 C ATOM 1839 C SER A 110 5.351 -12.415 3.361 1.00 0.00 C ATOM 1840 O SER A 110 6.243 -13.258 3.198 1.00 0.00 O ATOM 1841 CB SER A 110 4.002 -13.908 4.940 1.00 0.00 C ATOM 1842 OG SER A 110 3.170 -13.948 6.087 1.00 0.00 O ATOM 0 H SER A 110 2.410 -12.155 4.199 1.00 0.00 H new ATOM 0 HA SER A 110 5.026 -12.074 5.451 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.470 -14.329 4.087 1.00 0.00 H new ATOM 0 HB3 SER A 110 4.883 -14.529 5.104 1.00 0.00 H new ATOM 0 HG SER A 110 2.906 -14.874 6.268 1.00 0.00 H new ATOM 1848 N ALA A 111 5.135 -11.397 2.501 1.00 0.00 N ATOM 1849 CA ALA A 111 5.950 -11.139 1.313 1.00 0.00 C ATOM 1850 C ALA A 111 7.230 -10.368 1.676 1.00 0.00 C ATOM 1851 O ALA A 111 7.188 -9.388 2.440 1.00 0.00 O ATOM 1852 CB ALA A 111 5.130 -10.338 0.297 1.00 0.00 C ATOM 0 H ALA A 111 4.376 -10.726 2.622 1.00 0.00 H new ATOM 0 HA ALA A 111 6.243 -12.095 0.879 1.00 0.00 H new ATOM 0 HB1 ALA A 111 5.736 -10.145 -0.588 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.245 -10.907 0.014 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.825 -9.391 0.741 1.00 0.00 H new ATOM 1858 N GLU A 112 8.358 -10.818 1.107 1.00 0.00 N ATOM 1859 CA GLU A 112 9.663 -10.141 1.222 1.00 0.00 C ATOM 1860 C GLU A 112 9.764 -8.973 0.200 1.00 0.00 C ATOM 1861 O GLU A 112 8.743 -8.455 -0.265 1.00 0.00 O ATOM 1862 CB GLU A 112 10.803 -11.187 1.014 1.00 0.00 C ATOM 1863 CG GLU A 112 10.772 -11.904 -0.352 1.00 0.00 C ATOM 1864 CD GLU A 112 12.006 -12.782 -0.612 1.00 0.00 C ATOM 1865 OE1 GLU A 112 11.997 -13.981 -0.243 1.00 0.00 O ATOM 1866 OE2 GLU A 112 12.988 -12.278 -1.204 1.00 0.00 O ATOM 0 H GLU A 112 8.393 -11.670 0.548 1.00 0.00 H new ATOM 0 HA GLU A 112 9.766 -9.708 2.217 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.764 -10.685 1.125 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.741 -11.935 1.804 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.877 -12.524 -0.408 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.693 -11.158 -1.143 1.00 0.00 H new ATOM 1873 N TYR A 113 11.005 -8.565 -0.135 1.00 0.00 N ATOM 1874 CA TYR A 113 11.292 -7.460 -1.080 1.00 0.00 C ATOM 1875 C TYR A 113 11.559 -7.999 -2.511 1.00 0.00 C ATOM 1876 O TYR A 113 12.138 -7.292 -3.345 1.00 0.00 O ATOM 1877 CB TYR A 113 12.509 -6.640 -0.543 1.00 0.00 C ATOM 1878 CG TYR A 113 13.801 -7.462 -0.351 1.00 0.00 C ATOM 1879 CD1 TYR A 113 14.033 -8.187 0.826 1.00 0.00 C ATOM 1880 CD2 TYR A 113 14.782 -7.525 -1.351 1.00 0.00 C ATOM 1881 CE1 TYR A 113 15.180 -8.939 0.992 1.00 0.00 C ATOM 1882 CE2 TYR A 113 15.932 -8.276 -1.183 1.00 0.00 C ATOM 1883 CZ TYR A 113 16.125 -8.981 -0.013 1.00 0.00 C ATOM 1884 OH TYR A 113 17.271 -9.734 0.152 1.00 0.00 O ATOM 0 H TYR A 113 11.847 -8.997 0.246 1.00 0.00 H new ATOM 0 HA TYR A 113 10.422 -6.807 -1.148 1.00 0.00 H new ATOM 0 HB2 TYR A 113 12.713 -5.822 -1.234 1.00 0.00 H new ATOM 0 HB3 TYR A 113 12.235 -6.190 0.411 1.00 0.00 H new ATOM 0 HD1 TYR A 113 13.300 -8.157 1.619 1.00 0.00 H new ATOM 0 HD2 TYR A 113 14.637 -6.977 -2.270 1.00 0.00 H new ATOM 0 HE1 TYR A 113 15.337 -9.493 1.906 1.00 0.00 H new ATOM 0 HE2 TYR A 113 16.676 -8.310 -1.965 1.00 0.00 H new ATOM 0 HH TYR A 113 17.831 -9.657 -0.648 1.00 0.00 H new ATOM 1894 N GLY A 114 11.099 -9.233 -2.793 1.00 0.00 N ATOM 1895 CA GLY A 114 11.397 -9.918 -4.061 1.00 0.00 C ATOM 1896 C GLY A 114 10.463 -9.515 -5.210 1.00 0.00 C ATOM 1897 O GLY A 114 9.485 -8.792 -5.004 1.00 0.00 O ATOM 0 H GLY A 114 10.517 -9.776 -2.155 1.00 0.00 H new ATOM 0 HA2 GLY A 114 12.426 -9.703 -4.348 1.00 0.00 H new ATOM 0 HA3 GLY A 114 11.328 -10.995 -3.908 1.00 0.00 H new ATOM 1901 N GLN A 115 10.760 -10.041 -6.414 1.00 0.00 N ATOM 1902 CA GLN A 115 10.087 -9.668 -7.685 1.00 0.00 C ATOM 1903 C GLN A 115 8.577 -9.993 -7.680 1.00 0.00 C ATOM 1904 O GLN A 115 7.751 -9.171 -8.086 1.00 0.00 O ATOM 1905 CB GLN A 115 10.779 -10.408 -8.869 1.00 0.00 C ATOM 1906 CG GLN A 115 12.282 -10.110 -9.029 1.00 0.00 C ATOM 1907 CD GLN A 115 12.577 -8.628 -9.293 1.00 0.00 C ATOM 1908 OE1 GLN A 115 12.800 -7.854 -8.365 1.00 0.00 O ATOM 1909 NE2 GLN A 115 12.539 -8.214 -10.555 1.00 0.00 N ATOM 0 H GLN A 115 11.484 -10.748 -6.539 1.00 0.00 H new ATOM 0 HA GLN A 115 10.180 -8.588 -7.799 1.00 0.00 H new ATOM 0 HB2 GLN A 115 10.649 -11.482 -8.734 1.00 0.00 H new ATOM 0 HB3 GLN A 115 10.269 -10.139 -9.794 1.00 0.00 H new ATOM 0 HG2 GLN A 115 12.807 -10.423 -8.126 1.00 0.00 H new ATOM 0 HG3 GLN A 115 12.679 -10.705 -9.851 1.00 0.00 H new ATOM 0 HE21 GLN A 115 12.352 -8.880 -11.305 1.00 0.00 H new ATOM 0 HE22 GLN A 115 12.697 -7.230 -10.774 1.00 0.00 H new ATOM 1918 N PHE A 116 8.237 -11.208 -7.235 1.00 0.00 N ATOM 1919 CA PHE A 116 6.844 -11.706 -7.215 1.00 0.00 C ATOM 1920 C PHE A 116 6.132 -11.299 -5.913 1.00 0.00 C ATOM 1921 O PHE A 116 4.897 -11.264 -5.859 1.00 0.00 O ATOM 1922 CB PHE A 116 6.836 -13.250 -7.377 1.00 0.00 C ATOM 1923 CG PHE A 116 7.480 -13.740 -8.678 1.00 0.00 C ATOM 1924 CD1 PHE A 116 6.721 -13.886 -9.842 1.00 0.00 C ATOM 1925 CD2 PHE A 116 8.843 -14.041 -8.744 1.00 0.00 C ATOM 1926 CE1 PHE A 116 7.305 -14.311 -11.023 1.00 0.00 C ATOM 1927 CE2 PHE A 116 9.424 -14.463 -9.928 1.00 0.00 C ATOM 1928 CZ PHE A 116 8.655 -14.600 -11.065 1.00 0.00 C ATOM 0 H PHE A 116 8.916 -11.880 -6.877 1.00 0.00 H new ATOM 0 HA PHE A 116 6.303 -11.256 -8.047 1.00 0.00 H new ATOM 0 HB2 PHE A 116 7.360 -13.697 -6.532 1.00 0.00 H new ATOM 0 HB3 PHE A 116 5.806 -13.605 -7.337 1.00 0.00 H new ATOM 0 HD1 PHE A 116 5.664 -13.664 -9.820 1.00 0.00 H new ATOM 0 HD2 PHE A 116 9.453 -13.943 -7.858 1.00 0.00 H new ATOM 0 HE1 PHE A 116 6.704 -14.417 -11.914 1.00 0.00 H new ATOM 0 HE2 PHE A 116 10.480 -14.685 -9.961 1.00 0.00 H new ATOM 0 HZ PHE A 116 9.108 -14.933 -11.987 1.00 0.00 H new ATOM 1938 N THR A 117 6.926 -11.000 -4.868 1.00 0.00 N ATOM 1939 CA THR A 117 6.408 -10.656 -3.536 1.00 0.00 C ATOM 1940 C THR A 117 6.114 -9.142 -3.392 1.00 0.00 C ATOM 1941 O THR A 117 5.367 -8.747 -2.493 1.00 0.00 O ATOM 1942 CB THR A 117 7.387 -11.151 -2.420 1.00 0.00 C ATOM 1943 OG1 THR A 117 8.718 -10.768 -2.738 1.00 0.00 O ATOM 1944 CG2 THR A 117 7.335 -12.681 -2.224 1.00 0.00 C ATOM 0 H THR A 117 7.944 -10.991 -4.926 1.00 0.00 H new ATOM 0 HA THR A 117 5.456 -11.172 -3.415 1.00 0.00 H new ATOM 0 HB THR A 117 7.068 -10.684 -1.488 1.00 0.00 H new ATOM 0 HG1 THR A 117 9.279 -11.568 -2.817 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.033 -12.971 -1.439 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.325 -12.977 -1.940 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.610 -13.177 -3.155 1.00 0.00 H new ATOM 1952 N THR A 118 6.694 -8.299 -4.274 1.00 0.00 N ATOM 1953 CA THR A 118 6.376 -6.850 -4.337 1.00 0.00 C ATOM 1954 C THR A 118 6.108 -6.440 -5.794 1.00 0.00 C ATOM 1955 O THR A 118 6.809 -6.887 -6.704 1.00 0.00 O ATOM 1956 CB THR A 118 7.518 -5.939 -3.751 1.00 0.00 C ATOM 1957 OG1 THR A 118 8.761 -6.176 -4.430 1.00 0.00 O ATOM 1958 CG2 THR A 118 7.713 -6.140 -2.236 1.00 0.00 C ATOM 0 H THR A 118 7.390 -8.597 -4.958 1.00 0.00 H new ATOM 0 HA THR A 118 5.490 -6.699 -3.720 1.00 0.00 H new ATOM 0 HB THR A 118 7.204 -4.908 -3.914 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.906 -7.141 -4.520 1.00 0.00 H new ATOM 0 HG21 THR A 118 8.512 -5.488 -1.882 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.788 -5.895 -1.714 1.00 0.00 H new ATOM 0 HG23 THR A 118 7.977 -7.179 -2.038 1.00 0.00 H new ATOM 1966 N CYS A 119 5.090 -5.587 -5.998 1.00 0.00 N ATOM 1967 CA CYS A 119 4.737 -5.033 -7.314 1.00 0.00 C ATOM 1968 C CYS A 119 4.607 -3.501 -7.221 1.00 0.00 C ATOM 1969 O CYS A 119 4.142 -2.961 -6.204 1.00 0.00 O ATOM 1970 CB CYS A 119 3.433 -5.684 -7.837 1.00 0.00 C ATOM 1971 SG CYS A 119 3.620 -7.436 -8.246 1.00 0.00 S ATOM 0 H CYS A 119 4.484 -5.260 -5.246 1.00 0.00 H new ATOM 0 HA CYS A 119 5.530 -5.261 -8.027 1.00 0.00 H new ATOM 0 HB2 CYS A 119 2.654 -5.576 -7.083 1.00 0.00 H new ATOM 0 HB3 CYS A 119 3.097 -5.145 -8.723 1.00 0.00 H new ATOM 0 HG CYS A 119 2.485 -7.905 -8.673 1.00 0.00 H new ATOM 1977 N PHE A 120 5.046 -2.820 -8.296 1.00 0.00 N ATOM 1978 CA PHE A 120 5.054 -1.354 -8.391 1.00 0.00 C ATOM 1979 C PHE A 120 3.628 -0.844 -8.646 1.00 0.00 C ATOM 1980 O PHE A 120 3.064 -1.053 -9.730 1.00 0.00 O ATOM 1981 CB PHE A 120 6.000 -0.891 -9.530 1.00 0.00 C ATOM 1982 CG PHE A 120 7.446 -1.382 -9.406 1.00 0.00 C ATOM 1983 CD1 PHE A 120 7.833 -2.621 -9.919 1.00 0.00 C ATOM 1984 CD2 PHE A 120 8.423 -0.594 -8.795 1.00 0.00 C ATOM 1985 CE1 PHE A 120 9.142 -3.056 -9.818 1.00 0.00 C ATOM 1986 CE2 PHE A 120 9.733 -1.029 -8.701 1.00 0.00 C ATOM 1987 CZ PHE A 120 10.092 -2.256 -9.212 1.00 0.00 C ATOM 0 H PHE A 120 5.409 -3.281 -9.131 1.00 0.00 H new ATOM 0 HA PHE A 120 5.419 -0.941 -7.451 1.00 0.00 H new ATOM 0 HB2 PHE A 120 5.595 -1.235 -10.482 1.00 0.00 H new ATOM 0 HB3 PHE A 120 6.003 0.199 -9.560 1.00 0.00 H new ATOM 0 HD1 PHE A 120 7.099 -3.249 -10.402 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.152 0.370 -8.390 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.422 -4.021 -10.213 1.00 0.00 H new ATOM 0 HE2 PHE A 120 10.475 -0.405 -8.226 1.00 0.00 H new ATOM 0 HZ PHE A 120 11.115 -2.593 -9.139 1.00 0.00 H new ATOM 1997 N VAL A 121 3.039 -0.219 -7.622 1.00 0.00 N ATOM 1998 CA VAL A 121 1.710 0.413 -7.695 1.00 0.00 C ATOM 1999 C VAL A 121 1.850 1.893 -7.301 1.00 0.00 C ATOM 2000 O VAL A 121 2.970 2.369 -7.040 1.00 0.00 O ATOM 2001 CB VAL A 121 0.677 -0.315 -6.749 1.00 0.00 C ATOM 2002 CG1 VAL A 121 0.497 -1.809 -7.132 1.00 0.00 C ATOM 2003 CG2 VAL A 121 1.082 -0.157 -5.263 1.00 0.00 C ATOM 0 H VAL A 121 3.475 -0.134 -6.704 1.00 0.00 H new ATOM 0 HA VAL A 121 1.329 0.332 -8.713 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.291 0.168 -6.887 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -0.222 -2.274 -6.457 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.131 -1.881 -8.156 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.455 -2.323 -7.052 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.355 -0.667 -4.631 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.068 -0.594 -5.106 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.109 0.901 -5.004 1.00 0.00 H new ATOM 2013 N VAL A 122 0.723 2.625 -7.263 1.00 0.00 N ATOM 2014 CA VAL A 122 0.710 3.993 -6.726 1.00 0.00 C ATOM 2015 C VAL A 122 0.723 3.943 -5.185 1.00 0.00 C ATOM 2016 O VAL A 122 0.235 2.989 -4.572 1.00 0.00 O ATOM 2017 CB VAL A 122 -0.495 4.852 -7.271 1.00 0.00 C ATOM 2018 CG1 VAL A 122 -0.443 4.947 -8.813 1.00 0.00 C ATOM 2019 CG2 VAL A 122 -1.868 4.336 -6.773 1.00 0.00 C ATOM 0 H VAL A 122 -0.183 2.294 -7.595 1.00 0.00 H new ATOM 0 HA VAL A 122 1.611 4.498 -7.074 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.386 5.857 -6.864 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -1.283 5.544 -9.169 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.492 5.418 -9.117 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.501 3.946 -9.241 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.661 4.964 -7.178 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -2.013 3.308 -7.106 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.897 4.372 -5.684 1.00 0.00 H new ATOM 2029 N ARG A 123 1.275 4.994 -4.581 1.00 0.00 N ATOM 2030 CA ARG A 123 1.600 5.042 -3.145 1.00 0.00 C ATOM 2031 C ARG A 123 0.333 5.040 -2.251 1.00 0.00 C ATOM 2032 O ARG A 123 0.414 4.682 -1.078 1.00 0.00 O ATOM 2033 CB ARG A 123 2.476 6.290 -2.886 1.00 0.00 C ATOM 2034 CG ARG A 123 3.124 6.384 -1.484 1.00 0.00 C ATOM 2035 CD ARG A 123 4.042 7.611 -1.350 1.00 0.00 C ATOM 2036 NE ARG A 123 4.762 7.656 -0.072 1.00 0.00 N ATOM 2037 CZ ARG A 123 5.682 8.583 0.254 1.00 0.00 C ATOM 2038 NH1 ARG A 123 5.965 9.596 -0.566 1.00 0.00 N ATOM 2039 NH2 ARG A 123 6.298 8.500 1.416 1.00 0.00 N ATOM 0 H ARG A 123 1.515 5.852 -5.078 1.00 0.00 H new ATOM 0 HA ARG A 123 2.150 4.140 -2.876 1.00 0.00 H new ATOM 0 HB2 ARG A 123 3.269 6.314 -3.633 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.864 7.178 -3.042 1.00 0.00 H new ATOM 0 HG2 ARG A 123 2.342 6.433 -0.726 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.699 5.479 -1.290 1.00 0.00 H new ATOM 0 HD2 ARG A 123 4.764 7.608 -2.167 1.00 0.00 H new ATOM 0 HD3 ARG A 123 3.445 8.517 -1.456 1.00 0.00 H new ATOM 0 HE ARG A 123 4.551 6.935 0.617 1.00 0.00 H new ATOM 0 HH11 ARG A 123 5.481 9.679 -1.460 1.00 0.00 H new ATOM 0 HH12 ARG A 123 6.666 10.288 -0.299 1.00 0.00 H new ATOM 0 HH21 ARG A 123 6.076 7.739 2.058 1.00 0.00 H new ATOM 0 HH22 ARG A 123 6.997 9.197 1.674 1.00 0.00 H new ATOM 2053 N LEU A 124 -0.836 5.417 -2.818 1.00 0.00 N ATOM 2054 CA LEU A 124 -2.129 5.365 -2.090 1.00 0.00 C ATOM 2055 C LEU A 124 -2.561 3.890 -1.903 1.00 0.00 C ATOM 2056 O LEU A 124 -3.054 3.520 -0.835 1.00 0.00 O ATOM 2057 CB LEU A 124 -3.242 6.186 -2.827 1.00 0.00 C ATOM 2058 CG LEU A 124 -4.260 6.983 -1.927 1.00 0.00 C ATOM 2059 CD1 LEU A 124 -5.063 6.082 -0.982 1.00 0.00 C ATOM 2060 CD2 LEU A 124 -3.550 8.083 -1.127 1.00 0.00 C ATOM 0 H LEU A 124 -0.912 5.760 -3.775 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.991 5.824 -1.111 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.753 6.896 -3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.810 5.499 -3.454 1.00 0.00 H new ATOM 0 HG LEU A 124 -4.971 7.441 -2.615 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -5.745 6.692 -0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.635 5.360 -1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.381 5.552 -0.317 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.278 8.616 -0.515 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -2.794 7.634 -0.483 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.073 8.782 -1.814 1.00 0.00 H new ATOM 2072 N GLN A 125 -2.361 3.061 -2.956 1.00 0.00 N ATOM 2073 CA GLN A 125 -2.620 1.603 -2.886 1.00 0.00 C ATOM 2074 C GLN A 125 -1.700 0.962 -1.839 1.00 0.00 C ATOM 2075 O GLN A 125 -2.151 0.098 -1.059 1.00 0.00 O ATOM 2076 CB GLN A 125 -2.404 0.906 -4.254 1.00 0.00 C ATOM 2077 CG GLN A 125 -3.385 1.314 -5.361 1.00 0.00 C ATOM 2078 CD GLN A 125 -3.093 0.617 -6.695 1.00 0.00 C ATOM 2079 OE1 GLN A 125 -2.336 1.125 -7.524 1.00 0.00 O ATOM 2080 NE2 GLN A 125 -3.669 -0.563 -6.899 1.00 0.00 N ATOM 0 H GLN A 125 -2.021 3.378 -3.864 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.664 1.470 -2.604 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -1.390 1.117 -4.594 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -2.474 -0.172 -4.109 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -4.401 1.077 -5.046 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -3.339 2.394 -5.502 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -4.291 -0.956 -6.192 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -3.489 -1.076 -7.762 1.00 0.00 H new ATOM 2089 N PHE A 126 -0.408 1.393 -1.841 1.00 0.00 N ATOM 2090 CA PHE A 126 0.579 0.953 -0.848 1.00 0.00 C ATOM 2091 C PHE A 126 0.065 1.198 0.573 1.00 0.00 C ATOM 2092 O PHE A 126 0.056 0.279 1.391 1.00 0.00 O ATOM 2093 CB PHE A 126 1.955 1.644 -1.041 1.00 0.00 C ATOM 2094 CG PHE A 126 2.949 1.321 0.080 1.00 0.00 C ATOM 2095 CD1 PHE A 126 3.533 0.057 0.171 1.00 0.00 C ATOM 2096 CD2 PHE A 126 3.270 2.263 1.062 1.00 0.00 C ATOM 2097 CE1 PHE A 126 4.399 -0.255 1.199 1.00 0.00 C ATOM 2098 CE2 PHE A 126 4.141 1.948 2.087 1.00 0.00 C ATOM 2099 CZ PHE A 126 4.703 0.691 2.156 1.00 0.00 C ATOM 0 H PHE A 126 -0.037 2.048 -2.529 1.00 0.00 H new ATOM 0 HA PHE A 126 0.723 -0.117 -0.998 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.380 1.335 -1.996 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.810 2.723 -1.091 1.00 0.00 H new ATOM 0 HD1 PHE A 126 3.303 -0.689 -0.575 1.00 0.00 H new ATOM 0 HD2 PHE A 126 2.832 3.249 1.019 1.00 0.00 H new ATOM 0 HE1 PHE A 126 4.839 -1.240 1.254 1.00 0.00 H new ATOM 0 HE2 PHE A 126 4.382 2.688 2.836 1.00 0.00 H new ATOM 0 HZ PHE A 126 5.382 0.447 2.960 1.00 0.00 H new ATOM 2109 N TYR A 127 -0.362 2.452 0.830 1.00 0.00 N ATOM 2110 CA TYR A 127 -0.903 2.865 2.133 1.00 0.00 C ATOM 2111 C TYR A 127 -2.040 1.920 2.545 1.00 0.00 C ATOM 2112 O TYR A 127 -1.927 1.226 3.544 1.00 0.00 O ATOM 2113 CB TYR A 127 -1.407 4.341 2.093 1.00 0.00 C ATOM 2114 CG TYR A 127 -0.320 5.414 1.941 1.00 0.00 C ATOM 2115 CD1 TYR A 127 0.996 5.194 2.362 1.00 0.00 C ATOM 2116 CD2 TYR A 127 -0.623 6.668 1.402 1.00 0.00 C ATOM 2117 CE1 TYR A 127 1.959 6.177 2.250 1.00 0.00 C ATOM 2118 CE2 TYR A 127 0.340 7.650 1.286 1.00 0.00 C ATOM 2119 CZ TYR A 127 1.627 7.400 1.712 1.00 0.00 C ATOM 2120 OH TYR A 127 2.591 8.378 1.604 1.00 0.00 O ATOM 0 H TYR A 127 -0.340 3.202 0.139 1.00 0.00 H new ATOM 0 HA TYR A 127 -0.104 2.808 2.872 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.110 4.443 1.266 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -1.962 4.540 3.010 1.00 0.00 H new ATOM 0 HD1 TYR A 127 1.264 4.236 2.783 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -1.630 6.872 1.070 1.00 0.00 H new ATOM 0 HE1 TYR A 127 2.969 5.987 2.583 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.086 8.611 0.863 1.00 0.00 H new ATOM 0 HH TYR A 127 2.198 9.182 1.204 1.00 0.00 H new ATOM 2130 N ALA A 128 -3.057 1.830 1.682 1.00 0.00 N ATOM 2131 CA ALA A 128 -4.309 1.092 1.936 1.00 0.00 C ATOM 2132 C ALA A 128 -4.076 -0.327 2.542 1.00 0.00 C ATOM 2133 O ALA A 128 -4.463 -0.599 3.698 1.00 0.00 O ATOM 2134 CB ALA A 128 -5.090 1.019 0.617 1.00 0.00 C ATOM 0 H ALA A 128 -3.037 2.277 0.765 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.883 1.628 2.691 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.022 0.477 0.776 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.311 2.028 0.269 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.492 0.500 -0.132 1.00 0.00 H new ATOM 2140 N PHE A 129 -3.368 -1.192 1.787 1.00 0.00 N ATOM 2141 CA PHE A 129 -3.123 -2.595 2.196 1.00 0.00 C ATOM 2142 C PHE A 129 -2.084 -2.708 3.337 1.00 0.00 C ATOM 2143 O PHE A 129 -2.250 -3.542 4.234 1.00 0.00 O ATOM 2144 CB PHE A 129 -2.672 -3.458 0.989 1.00 0.00 C ATOM 2145 CG PHE A 129 -3.773 -3.732 -0.028 1.00 0.00 C ATOM 2146 CD1 PHE A 129 -4.691 -4.762 0.187 1.00 0.00 C ATOM 2147 CD2 PHE A 129 -3.888 -2.978 -1.193 1.00 0.00 C ATOM 2148 CE1 PHE A 129 -5.688 -5.022 -0.731 1.00 0.00 C ATOM 2149 CE2 PHE A 129 -4.882 -3.242 -2.112 1.00 0.00 C ATOM 2150 CZ PHE A 129 -5.783 -4.265 -1.883 1.00 0.00 C ATOM 0 H PHE A 129 -2.954 -0.945 0.888 1.00 0.00 H new ATOM 0 HA PHE A 129 -4.073 -2.973 2.574 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.845 -2.956 0.486 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -2.290 -4.409 1.359 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.620 -5.362 1.082 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.189 -2.176 -1.379 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -6.395 -5.818 -0.549 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.956 -2.649 -3.011 1.00 0.00 H new ATOM 0 HZ PHE A 129 -6.560 -4.472 -2.604 1.00 0.00 H new ATOM 2160 N GLU A 130 -1.023 -1.864 3.303 1.00 0.00 N ATOM 2161 CA GLU A 130 0.103 -1.969 4.265 1.00 0.00 C ATOM 2162 C GLU A 130 -0.365 -1.578 5.683 1.00 0.00 C ATOM 2163 O GLU A 130 -0.101 -2.300 6.637 1.00 0.00 O ATOM 2164 CB GLU A 130 1.316 -1.094 3.831 1.00 0.00 C ATOM 2165 CG GLU A 130 2.628 -1.367 4.609 1.00 0.00 C ATOM 2166 CD GLU A 130 3.196 -2.788 4.386 1.00 0.00 C ATOM 2167 OE1 GLU A 130 3.840 -3.026 3.333 1.00 0.00 O ATOM 2168 OE2 GLU A 130 2.986 -3.680 5.243 1.00 0.00 O ATOM 0 H GLU A 130 -0.923 -1.108 2.625 1.00 0.00 H new ATOM 0 HA GLU A 130 0.434 -3.007 4.274 1.00 0.00 H new ATOM 0 HB2 GLU A 130 1.500 -1.255 2.769 1.00 0.00 H new ATOM 0 HB3 GLU A 130 1.050 -0.044 3.953 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.377 -0.634 4.310 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.446 -1.220 5.674 1.00 0.00 H new ATOM 2175 N ILE A 131 -1.094 -0.441 5.780 1.00 0.00 N ATOM 2176 CA ILE A 131 -1.700 0.063 7.042 1.00 0.00 C ATOM 2177 C ILE A 131 -2.649 -0.989 7.641 1.00 0.00 C ATOM 2178 O ILE A 131 -2.648 -1.225 8.857 1.00 0.00 O ATOM 2179 CB ILE A 131 -2.518 1.396 6.804 1.00 0.00 C ATOM 2180 CG1 ILE A 131 -1.608 2.531 6.253 1.00 0.00 C ATOM 2181 CG2 ILE A 131 -3.250 1.869 8.089 1.00 0.00 C ATOM 2182 CD1 ILE A 131 -2.364 3.714 5.670 1.00 0.00 C ATOM 0 H ILE A 131 -1.282 0.160 4.978 1.00 0.00 H new ATOM 0 HA ILE A 131 -0.879 0.266 7.730 1.00 0.00 H new ATOM 0 HB ILE A 131 -3.275 1.166 6.055 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.965 2.887 7.058 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -0.957 2.117 5.484 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -3.798 2.787 7.878 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -3.947 1.097 8.416 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -2.519 2.055 8.876 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -1.654 4.458 5.309 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -2.987 3.376 4.842 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -2.995 4.158 6.440 1.00 0.00 H new ATOM 2194 N ALA A 132 -3.461 -1.601 6.759 1.00 0.00 N ATOM 2195 CA ALA A 132 -4.437 -2.627 7.142 1.00 0.00 C ATOM 2196 C ALA A 132 -3.778 -3.797 7.899 1.00 0.00 C ATOM 2197 O ALA A 132 -4.093 -4.059 9.069 1.00 0.00 O ATOM 2198 CB ALA A 132 -5.178 -3.117 5.899 1.00 0.00 C ATOM 0 H ALA A 132 -3.455 -1.395 5.760 1.00 0.00 H new ATOM 0 HA ALA A 132 -5.154 -2.179 7.830 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -5.903 -3.879 6.184 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -5.697 -2.280 5.431 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -4.464 -3.542 5.193 1.00 0.00 H new ATOM 2204 N ARG A 133 -2.833 -4.464 7.226 1.00 0.00 N ATOM 2205 CA ARG A 133 -2.104 -5.627 7.781 1.00 0.00 C ATOM 2206 C ARG A 133 -1.103 -5.213 8.883 1.00 0.00 C ATOM 2207 O ARG A 133 -0.667 -6.054 9.666 1.00 0.00 O ATOM 2208 CB ARG A 133 -1.408 -6.406 6.631 1.00 0.00 C ATOM 2209 CG ARG A 133 -0.371 -5.595 5.830 1.00 0.00 C ATOM 2210 CD ARG A 133 0.001 -6.267 4.503 1.00 0.00 C ATOM 2211 NE ARG A 133 0.933 -5.450 3.708 1.00 0.00 N ATOM 2212 CZ ARG A 133 1.068 -5.514 2.381 1.00 0.00 C ATOM 2213 NH1 ARG A 133 0.331 -6.358 1.648 1.00 0.00 N ATOM 2214 NH2 ARG A 133 1.938 -4.727 1.787 1.00 0.00 N ATOM 0 H ARG A 133 -2.546 -4.218 6.279 1.00 0.00 H new ATOM 0 HA ARG A 133 -2.826 -6.287 8.262 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.915 -7.282 7.052 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.172 -6.769 5.944 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.768 -4.600 5.631 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.528 -5.465 6.432 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.453 -7.239 4.704 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -0.904 -6.450 3.924 1.00 0.00 H new ATOM 0 HE ARG A 133 1.521 -4.784 4.209 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.349 -6.968 2.102 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.450 -6.391 0.635 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.499 -4.078 2.339 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.052 -4.765 0.774 1.00 0.00 H new ATOM 2228 N ASN A 134 -0.746 -3.911 8.929 1.00 0.00 N ATOM 2229 CA ASN A 134 0.136 -3.346 9.976 1.00 0.00 C ATOM 2230 C ASN A 134 -0.585 -3.364 11.338 1.00 0.00 C ATOM 2231 O ASN A 134 -0.016 -3.793 12.352 1.00 0.00 O ATOM 2232 CB ASN A 134 0.571 -1.898 9.601 1.00 0.00 C ATOM 2233 CG ASN A 134 1.605 -1.279 10.549 1.00 0.00 C ATOM 2234 OD1 ASN A 134 2.418 -1.987 11.144 1.00 0.00 O ATOM 2235 ND2 ASN A 134 1.593 0.050 10.674 1.00 0.00 N ATOM 0 H ASN A 134 -1.059 -3.223 8.244 1.00 0.00 H new ATOM 0 HA ASN A 134 1.034 -3.960 10.049 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.981 -1.905 8.591 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -0.313 -1.260 9.581 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.273 0.512 11.278 1.00 0.00 H new ATOM 0 HD22 ASN A 134 0.904 0.604 10.165 1.00 0.00 H new ATOM 2242 N LYS A 135 -1.860 -2.915 11.329 1.00 0.00 N ATOM 2243 CA LYS A 135 -2.730 -2.916 12.528 1.00 0.00 C ATOM 2244 C LYS A 135 -3.060 -4.351 12.952 1.00 0.00 C ATOM 2245 O LYS A 135 -3.080 -4.675 14.139 1.00 0.00 O ATOM 2246 CB LYS A 135 -4.046 -2.133 12.269 1.00 0.00 C ATOM 2247 CG LYS A 135 -3.832 -0.665 11.859 1.00 0.00 C ATOM 2248 CD LYS A 135 -5.139 0.151 11.861 1.00 0.00 C ATOM 2249 CE LYS A 135 -4.908 1.622 11.477 1.00 0.00 C ATOM 2250 NZ LYS A 135 -6.074 2.478 11.804 1.00 0.00 N ATOM 0 H LYS A 135 -2.314 -2.543 10.495 1.00 0.00 H new ATOM 0 HA LYS A 135 -2.184 -2.420 13.331 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.610 -2.640 11.486 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.657 -2.162 13.171 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -3.119 -0.202 12.541 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -3.389 -0.631 10.864 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -5.846 -0.298 11.163 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -5.593 0.103 12.851 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -4.027 1.997 11.998 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -4.699 1.688 10.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -5.766 3.468 11.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -6.786 2.398 11.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -6.490 2.169 12.706 1.00 0.00 H new ATOM 2264 N HIS A 136 -3.305 -5.203 11.946 1.00 0.00 N ATOM 2265 CA HIS A 136 -3.650 -6.626 12.152 1.00 0.00 C ATOM 2266 C HIS A 136 -2.412 -7.488 12.509 1.00 0.00 C ATOM 2267 O HIS A 136 -2.556 -8.687 12.791 1.00 0.00 O ATOM 2268 CB HIS A 136 -4.378 -7.171 10.893 1.00 0.00 C ATOM 2269 CG HIS A 136 -5.758 -6.587 10.690 1.00 0.00 C ATOM 2270 ND1 HIS A 136 -6.133 -5.881 9.567 1.00 0.00 N ATOM 2271 CD2 HIS A 136 -6.855 -6.628 11.483 1.00 0.00 C ATOM 2272 CE1 HIS A 136 -7.397 -5.519 9.675 1.00 0.00 C ATOM 2273 NE2 HIS A 136 -7.860 -5.959 10.827 1.00 0.00 N ATOM 0 H HIS A 136 -3.271 -4.929 10.964 1.00 0.00 H new ATOM 0 HA HIS A 136 -4.321 -6.692 13.009 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -3.771 -6.960 10.013 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -4.460 -8.255 10.972 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -6.927 -7.099 12.452 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -7.957 -4.957 8.943 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -8.809 -5.825 11.175 1.00 0.00 H new ATOM 2282 N GLY A 137 -1.203 -6.868 12.491 1.00 0.00 N ATOM 2283 CA GLY A 137 0.047 -7.536 12.914 1.00 0.00 C ATOM 2284 C GLY A 137 0.478 -8.677 11.995 1.00 0.00 C ATOM 2285 O GLY A 137 1.206 -9.583 12.411 1.00 0.00 O ATOM 0 H GLY A 137 -1.072 -5.903 12.186 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.846 -6.796 12.958 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.084 -7.925 13.924 1.00 0.00 H new ATOM 2289 N LEU A 138 0.028 -8.619 10.736 1.00 0.00 N ATOM 2290 CA LEU A 138 0.343 -9.625 9.706 1.00 0.00 C ATOM 2291 C LEU A 138 1.743 -9.370 9.097 1.00 0.00 C ATOM 2292 O LEU A 138 2.299 -10.226 8.403 1.00 0.00 O ATOM 2293 CB LEU A 138 -0.768 -9.599 8.622 1.00 0.00 C ATOM 2294 CG LEU A 138 -2.221 -9.860 9.137 1.00 0.00 C ATOM 2295 CD1 LEU A 138 -3.267 -9.673 8.019 1.00 0.00 C ATOM 2296 CD2 LEU A 138 -2.338 -11.254 9.790 1.00 0.00 C ATOM 0 H LEU A 138 -0.571 -7.866 10.397 1.00 0.00 H new ATOM 0 HA LEU A 138 0.372 -10.617 10.157 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -0.746 -8.628 8.128 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -0.530 -10.347 7.866 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.434 -9.114 9.903 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.264 -9.863 8.418 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.217 -8.652 7.641 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.061 -10.371 7.208 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.359 -11.408 10.139 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -2.085 -12.021 9.058 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.652 -11.319 10.635 1.00 0.00 H new ATOM 2308 N ASN A 139 2.302 -8.176 9.377 1.00 0.00 N ATOM 2309 CA ASN A 139 3.656 -7.762 8.943 1.00 0.00 C ATOM 2310 C ASN A 139 4.665 -7.848 10.117 1.00 0.00 C ATOM 2311 O ASN A 139 5.808 -7.396 10.000 1.00 0.00 O ATOM 2312 CB ASN A 139 3.599 -6.305 8.387 1.00 0.00 C ATOM 2313 CG ASN A 139 3.275 -5.245 9.454 1.00 0.00 C ATOM 2314 OD1 ASN A 139 2.581 -5.520 10.438 1.00 0.00 O ATOM 2315 ND2 ASN A 139 3.766 -4.029 9.258 1.00 0.00 N ATOM 0 H ASN A 139 1.820 -7.459 9.919 1.00 0.00 H new ATOM 0 HA ASN A 139 3.995 -8.439 8.159 1.00 0.00 H new ATOM 0 HB2 ASN A 139 4.558 -6.064 7.928 1.00 0.00 H new ATOM 0 HB3 ASN A 139 2.847 -6.256 7.599 1.00 0.00 H new ATOM 0 HD21 ASN A 139 3.574 -3.287 9.931 1.00 0.00 H new ATOM 0 HD22 ASN A 139 4.336 -3.836 8.434 1.00 0.00 H new ATOM 2322 N ASP A 140 4.226 -8.439 11.246 1.00 0.00 N ATOM 2323 CA ASP A 140 5.002 -8.445 12.513 1.00 0.00 C ATOM 2324 C ASP A 140 6.272 -9.321 12.413 1.00 0.00 C ATOM 2325 O ASP A 140 7.235 -9.100 13.140 1.00 0.00 O ATOM 2326 CB ASP A 140 4.104 -8.920 13.684 1.00 0.00 C ATOM 2327 CG ASP A 140 4.819 -8.927 15.057 1.00 0.00 C ATOM 2328 OD1 ASP A 140 5.013 -7.840 15.642 1.00 0.00 O ATOM 2329 OD2 ASP A 140 5.184 -10.023 15.555 1.00 0.00 O ATOM 0 H ASP A 140 3.331 -8.924 11.311 1.00 0.00 H new ATOM 0 HA ASP A 140 5.331 -7.424 12.704 1.00 0.00 H new ATOM 0 HB2 ASP A 140 3.229 -8.273 13.744 1.00 0.00 H new ATOM 0 HB3 ASP A 140 3.743 -9.925 13.468 1.00 0.00 H new ATOM 2334 N TRP A 141 6.266 -10.307 11.504 1.00 0.00 N ATOM 2335 CA TRP A 141 7.434 -11.187 11.271 1.00 0.00 C ATOM 2336 C TRP A 141 8.666 -10.382 10.817 1.00 0.00 C ATOM 2337 O TRP A 141 9.785 -10.762 11.124 1.00 0.00 O ATOM 2338 CB TRP A 141 7.101 -12.294 10.227 1.00 0.00 C ATOM 2339 CG TRP A 141 6.751 -11.742 8.865 1.00 0.00 C ATOM 2340 CD1 TRP A 141 5.542 -11.233 8.476 1.00 0.00 C ATOM 2341 CD2 TRP A 141 7.623 -11.613 7.724 1.00 0.00 C ATOM 2342 NE1 TRP A 141 5.620 -10.773 7.198 1.00 0.00 N ATOM 2343 CE2 TRP A 141 6.878 -11.012 6.709 1.00 0.00 C ATOM 2344 CE3 TRP A 141 8.966 -11.946 7.470 1.00 0.00 C ATOM 2345 CZ2 TRP A 141 7.408 -10.720 5.459 1.00 0.00 C ATOM 2346 CZ3 TRP A 141 9.494 -11.665 6.216 1.00 0.00 C ATOM 2347 CH2 TRP A 141 8.713 -11.058 5.227 1.00 0.00 C ATOM 0 H TRP A 141 5.463 -10.520 10.912 1.00 0.00 H new ATOM 0 HA TRP A 141 7.672 -11.665 12.221 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.956 -12.963 10.132 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.267 -12.892 10.595 1.00 0.00 H new ATOM 0 HD1 TRP A 141 4.656 -11.201 9.093 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.863 -10.322 6.685 1.00 0.00 H new ATOM 0 HE3 TRP A 141 9.573 -12.410 8.233 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 6.810 -10.243 4.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 10.522 -11.919 6.002 1.00 0.00 H new ATOM 0 HH2 TRP A 141 9.149 -10.852 4.261 1.00 0.00 H new ATOM 2358 N ILE A 142 8.432 -9.253 10.112 1.00 0.00 N ATOM 2359 CA ILE A 142 9.508 -8.399 9.554 1.00 0.00 C ATOM 2360 C ILE A 142 10.338 -7.764 10.681 1.00 0.00 C ATOM 2361 O ILE A 142 11.546 -7.574 10.533 1.00 0.00 O ATOM 2362 CB ILE A 142 8.918 -7.268 8.626 1.00 0.00 C ATOM 2363 CG1 ILE A 142 7.948 -7.890 7.583 1.00 0.00 C ATOM 2364 CG2 ILE A 142 10.034 -6.443 7.914 1.00 0.00 C ATOM 2365 CD1 ILE A 142 7.050 -6.915 6.861 1.00 0.00 C ATOM 0 H ILE A 142 7.493 -8.907 9.913 1.00 0.00 H new ATOM 0 HA ILE A 142 10.154 -9.039 8.952 1.00 0.00 H new ATOM 0 HB ILE A 142 8.369 -6.574 9.262 1.00 0.00 H new ATOM 0 HG12 ILE A 142 8.538 -8.429 6.842 1.00 0.00 H new ATOM 0 HG13 ILE A 142 7.323 -8.625 8.089 1.00 0.00 H new ATOM 0 HG21 ILE A 142 9.577 -5.677 7.287 1.00 0.00 H new ATOM 0 HG22 ILE A 142 10.669 -5.968 8.662 1.00 0.00 H new ATOM 0 HG23 ILE A 142 10.638 -7.106 7.294 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.416 -7.456 6.158 1.00 0.00 H new ATOM 0 HD12 ILE A 142 6.425 -6.391 7.585 1.00 0.00 H new ATOM 0 HD13 ILE A 142 7.659 -6.193 6.318 1.00 0.00 H new ATOM 2377 N VAL A 143 9.686 -7.502 11.834 1.00 0.00 N ATOM 2378 CA VAL A 143 10.337 -6.842 12.987 1.00 0.00 C ATOM 2379 C VAL A 143 11.391 -7.762 13.657 1.00 0.00 C ATOM 2380 O VAL A 143 12.159 -7.326 14.529 1.00 0.00 O ATOM 2381 CB VAL A 143 9.281 -6.277 14.028 1.00 0.00 C ATOM 2382 CG1 VAL A 143 8.076 -5.632 13.291 1.00 0.00 C ATOM 2383 CG2 VAL A 143 8.821 -7.327 15.073 1.00 0.00 C ATOM 0 H VAL A 143 8.706 -7.738 11.992 1.00 0.00 H new ATOM 0 HA VAL A 143 10.876 -5.978 12.597 1.00 0.00 H new ATOM 0 HB VAL A 143 9.791 -5.503 14.601 1.00 0.00 H new ATOM 0 HG11 VAL A 143 7.364 -5.251 14.023 1.00 0.00 H new ATOM 0 HG12 VAL A 143 8.429 -4.811 12.666 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.589 -6.380 12.666 1.00 0.00 H new ATOM 0 HG21 VAL A 143 8.100 -6.872 15.752 1.00 0.00 H new ATOM 0 HG22 VAL A 143 8.356 -8.170 14.562 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.683 -7.678 15.640 1.00 0.00 H new ATOM 2393 N GLY A 144 11.407 -9.037 13.223 1.00 0.00 N ATOM 2394 CA GLY A 144 12.429 -10.009 13.596 1.00 0.00 C ATOM 2395 C GLY A 144 12.573 -11.079 12.531 1.00 0.00 C ATOM 2396 O GLY A 144 12.619 -12.276 12.853 1.00 0.00 O ATOM 0 H GLY A 144 10.698 -9.416 12.596 1.00 0.00 H new ATOM 0 HA2 GLY A 144 13.383 -9.502 13.739 1.00 0.00 H new ATOM 0 HA3 GLY A 144 12.167 -10.471 14.548 1.00 0.00 H new ATOM 2400 N GLN A 145 12.618 -10.638 11.242 1.00 0.00 N ATOM 2401 CA GLN A 145 12.569 -11.547 10.063 1.00 0.00 C ATOM 2402 C GLN A 145 13.688 -12.606 10.093 1.00 0.00 C ATOM 2403 O GLN A 145 13.426 -13.805 9.926 1.00 0.00 O ATOM 2404 CB GLN A 145 12.515 -10.738 8.717 1.00 0.00 C ATOM 2405 CG GLN A 145 13.479 -9.530 8.591 1.00 0.00 C ATOM 2406 CD GLN A 145 14.921 -9.859 8.179 1.00 0.00 C ATOM 2407 OE1 GLN A 145 15.102 -10.866 7.329 1.00 0.00 O flip ATOM 2408 NE2 GLN A 145 15.862 -9.207 8.620 1.00 0.00 N flip ATOM 0 H GLN A 145 12.689 -9.651 10.994 1.00 0.00 H new ATOM 0 HA GLN A 145 11.637 -12.110 10.122 1.00 0.00 H new ATOM 0 HB2 GLN A 145 12.723 -11.426 7.898 1.00 0.00 H new ATOM 0 HB3 GLN A 145 11.496 -10.376 8.578 1.00 0.00 H new ATOM 0 HG2 GLN A 145 13.064 -8.834 7.862 1.00 0.00 H new ATOM 0 HG3 GLN A 145 13.506 -9.010 9.549 1.00 0.00 H new ATOM 0 HE21 GLN A 145 15.691 -8.440 9.271 1.00 0.00 H new ATOM 0 HE22 GLN A 145 16.816 -9.432 8.336 1.00 0.00 H new ATOM 2417 N LYS A 146 14.923 -12.153 10.342 1.00 0.00 N ATOM 2418 CA LYS A 146 16.089 -13.025 10.584 1.00 0.00 C ATOM 2419 C LYS A 146 16.985 -12.337 11.631 1.00 0.00 C ATOM 2420 O LYS A 146 16.964 -12.731 12.818 1.00 0.00 O ATOM 2421 CB LYS A 146 16.899 -13.356 9.281 1.00 0.00 C ATOM 2422 CG LYS A 146 16.071 -14.018 8.143 1.00 0.00 C ATOM 2423 CD LYS A 146 16.897 -14.921 7.202 1.00 0.00 C ATOM 2424 CE LYS A 146 17.372 -16.209 7.900 1.00 0.00 C ATOM 2425 NZ LYS A 146 18.033 -17.143 6.962 1.00 0.00 N ATOM 2426 OXT LYS A 146 17.646 -11.335 11.279 1.00 0.00 O ATOM 0 H LYS A 146 15.148 -11.159 10.382 1.00 0.00 H new ATOM 0 HA LYS A 146 15.731 -13.987 10.950 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.339 -12.434 8.901 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.724 -14.019 9.542 1.00 0.00 H new ATOM 0 HG2 LYS A 146 15.272 -14.611 8.588 1.00 0.00 H new ATOM 0 HG3 LYS A 146 15.596 -13.235 7.552 1.00 0.00 H new ATOM 0 HD2 LYS A 146 16.295 -15.182 6.331 1.00 0.00 H new ATOM 0 HD3 LYS A 146 17.762 -14.367 6.837 1.00 0.00 H new ATOM 0 HE2 LYS A 146 18.064 -15.951 8.702 1.00 0.00 H new ATOM 0 HE3 LYS A 146 16.519 -16.705 8.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 18.336 -17.995 7.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 17.366 -17.411 6.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 18.863 -16.681 6.539 1.00 0.00 H new