USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1027 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 48 CYS SG : rot 180:sc= 0.964 USER MOD Set 1.2: A 147 THR OG1 : rot -127:sc= 1.44 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 154:sc= -0.0597 (180deg=-0.347) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 MET CE :methyl 173:sc= -1.24 (180deg=-1.26) USER MOD Single : A 26 MET CE :methyl -168:sc= -0.979 (180deg=-1.97) USER MOD Single : A 27 THR OG1 : rot -57:sc= 1.18 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl -153:sc= 0 (180deg=-0.109) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.745 K(o=-0.74,f=-2.7!) USER MOD Single : A 47 SER OG : rot -158:sc= 0.132 USER MOD Single : A 51 HIS : no HD1:sc= -0.679 K(o=-0.68,f=-1.3!) USER MOD Single : A 52 SER OG : rot -74:sc= 1.32 USER MOD Single : A 54 SER OG : rot -164:sc= -0.282 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.0059) USER MOD Single : A 77 SER OG : rot 164:sc= -0.758! USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.0416 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 150:sc= -3.79! (180deg=-6.81!) USER MOD Single : A 103 GLN : amide:sc= -0.0983 K(o=-0.098,f=-2!) USER MOD Single : A 106 THR OG1 : rot 150:sc= -0.807 USER MOD Single : A 107 THR OG1 : rot 130:sc= -0.937 USER MOD Single : A 110 SER OG : rot -17:sc= -1.59! USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 147:sc= 0.68 (180deg=0.32) USER MOD Single : A 126 ASN :FLIP amide:sc= -2.03 F(o=-4.2,f=-2) USER MOD Single : A 135 TYR OH : rot -6:sc= -1.03 USER MOD Single : A 137 ASN : amide:sc=-0.00273 X(o=-0.0027,f=-0.44) USER MOD Single : A 141 CYS SG : rot 140:sc= -0.0142 USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 GLN : amide:sc= -1.61 K(o=-1.6,f=-2.8!) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot 140:sc= 0 USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 196 N ALA A 16 9.618 -3.918 3.698 1.00 0.00 N ATOM 197 CA ALA A 16 9.194 -2.526 3.613 1.00 0.00 C ATOM 198 C ALA A 16 9.327 -1.999 2.188 1.00 0.00 C ATOM 199 O ALA A 16 10.197 -2.433 1.433 1.00 0.00 O ATOM 200 CB ALA A 16 10.005 -1.669 4.572 1.00 0.00 C ATOM 0 HA ALA A 16 8.143 -2.473 3.896 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.678 -0.632 4.498 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.857 -2.025 5.592 1.00 0.00 H new ATOM 0 HB3 ALA A 16 11.062 -1.735 4.314 1.00 0.00 H new ATOM 206 N ILE A 17 8.459 -1.060 1.827 1.00 0.00 N ATOM 207 CA ILE A 17 8.478 -0.473 0.493 1.00 0.00 C ATOM 208 C ILE A 17 8.538 1.050 0.564 1.00 0.00 C ATOM 209 O ILE A 17 7.932 1.665 1.441 1.00 0.00 O ATOM 210 CB ILE A 17 7.240 -0.895 -0.325 1.00 0.00 C ATOM 211 CG1 ILE A 17 7.331 -0.353 -1.753 1.00 0.00 C ATOM 212 CG2 ILE A 17 5.965 -0.413 0.352 1.00 0.00 C ATOM 213 CD1 ILE A 17 6.669 -1.244 -2.782 1.00 0.00 C ATOM 0 H ILE A 17 7.733 -0.689 2.440 1.00 0.00 H new ATOM 0 HA ILE A 17 9.374 -0.844 -0.005 1.00 0.00 H new ATOM 0 HB ILE A 17 7.212 -1.984 -0.373 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.870 0.634 -1.788 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.380 -0.224 -2.018 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.101 -0.719 -0.238 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.896 -0.848 1.349 1.00 0.00 H new ATOM 0 HG23 ILE A 17 5.983 0.674 0.431 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.773 -0.797 -3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 17 7.146 -2.224 -2.775 1.00 0.00 H new ATOM 0 HD13 ILE A 17 5.611 -1.353 -2.542 1.00 0.00 H new ATOM 225 N THR A 18 9.273 1.652 -0.366 1.00 0.00 N ATOM 226 CA THR A 18 9.412 3.103 -0.409 1.00 0.00 C ATOM 227 C THR A 18 8.441 3.713 -1.415 1.00 0.00 C ATOM 228 O THR A 18 7.950 3.029 -2.313 1.00 0.00 O ATOM 229 CB THR A 18 10.847 3.488 -0.770 1.00 0.00 C ATOM 230 OG1 THR A 18 11.193 2.988 -2.049 1.00 0.00 O ATOM 231 CG2 THR A 18 11.871 2.973 0.217 1.00 0.00 C ATOM 0 H THR A 18 9.781 1.158 -1.099 1.00 0.00 H new ATOM 0 HA THR A 18 9.176 3.495 0.580 1.00 0.00 H new ATOM 0 HB THR A 18 10.867 4.578 -0.753 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.114 3.246 -2.263 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.868 3.281 -0.099 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.661 3.381 1.206 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.823 1.885 0.256 1.00 0.00 H new ATOM 239 N ALA A 19 8.169 5.005 -1.259 1.00 0.00 N ATOM 240 CA ALA A 19 7.258 5.706 -2.154 1.00 0.00 C ATOM 241 C ALA A 19 7.765 5.671 -3.592 1.00 0.00 C ATOM 242 O ALA A 19 6.980 5.594 -4.536 1.00 0.00 O ATOM 243 CB ALA A 19 7.071 7.145 -1.695 1.00 0.00 C ATOM 0 H ALA A 19 8.567 5.586 -0.521 1.00 0.00 H new ATOM 0 HA ALA A 19 6.295 5.197 -2.123 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.388 7.657 -2.373 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.657 7.154 -0.687 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.034 7.655 -1.696 1.00 0.00 H new ATOM 249 N LYS A 20 9.083 5.726 -3.750 1.00 0.00 N ATOM 250 CA LYS A 20 9.697 5.701 -5.073 1.00 0.00 C ATOM 251 C LYS A 20 9.394 4.387 -5.786 1.00 0.00 C ATOM 252 O LYS A 20 9.110 4.370 -6.984 1.00 0.00 O ATOM 253 CB LYS A 20 11.211 5.898 -4.959 1.00 0.00 C ATOM 254 CG LYS A 20 11.774 6.875 -5.978 1.00 0.00 C ATOM 255 CD LYS A 20 11.798 6.273 -7.375 1.00 0.00 C ATOM 256 CE LYS A 20 13.086 6.612 -8.106 1.00 0.00 C ATOM 257 NZ LYS A 20 14.274 5.990 -7.456 1.00 0.00 N ATOM 0 H LYS A 20 9.747 5.788 -2.978 1.00 0.00 H new ATOM 0 HA LYS A 20 9.276 6.517 -5.659 1.00 0.00 H new ATOM 0 HB2 LYS A 20 11.449 6.254 -3.957 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.705 4.934 -5.080 1.00 0.00 H new ATOM 0 HG2 LYS A 20 11.172 7.784 -5.983 1.00 0.00 H new ATOM 0 HG3 LYS A 20 12.784 7.163 -5.688 1.00 0.00 H new ATOM 0 HD2 LYS A 20 11.691 5.190 -7.308 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.946 6.643 -7.946 1.00 0.00 H new ATOM 0 HE2 LYS A 20 13.018 6.271 -9.139 1.00 0.00 H new ATOM 0 HE3 LYS A 20 13.213 7.694 -8.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 15.026 5.856 -8.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 14.619 6.611 -6.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 14.007 5.068 -7.055 1.00 0.00 H new ATOM 271 N GLU A 21 9.457 3.287 -5.042 1.00 0.00 N ATOM 272 CA GLU A 21 9.190 1.968 -5.605 1.00 0.00 C ATOM 273 C GLU A 21 7.711 1.811 -5.945 1.00 0.00 C ATOM 274 O GLU A 21 7.353 1.106 -6.888 1.00 0.00 O ATOM 275 CB GLU A 21 9.617 0.875 -4.621 1.00 0.00 C ATOM 276 CG GLU A 21 11.079 0.480 -4.749 1.00 0.00 C ATOM 277 CD GLU A 21 11.551 -0.386 -3.598 1.00 0.00 C ATOM 278 OE1 GLU A 21 10.872 -1.389 -3.291 1.00 0.00 O ATOM 279 OE2 GLU A 21 12.600 -0.061 -3.002 1.00 0.00 O ATOM 0 H GLU A 21 9.690 3.283 -4.049 1.00 0.00 H new ATOM 0 HA GLU A 21 9.769 1.868 -6.523 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.430 1.220 -3.604 1.00 0.00 H new ATOM 0 HB3 GLU A 21 8.996 -0.007 -4.778 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.226 -0.056 -5.687 1.00 0.00 H new ATOM 0 HG3 GLU A 21 11.692 1.380 -4.797 1.00 0.00 H new ATOM 286 N LEU A 22 6.858 2.475 -5.173 1.00 0.00 N ATOM 287 CA LEU A 22 5.417 2.408 -5.394 1.00 0.00 C ATOM 288 C LEU A 22 5.035 3.101 -6.698 1.00 0.00 C ATOM 289 O LEU A 22 4.125 2.665 -7.401 1.00 0.00 O ATOM 290 CB LEU A 22 4.670 3.051 -4.224 1.00 0.00 C ATOM 291 CG LEU A 22 3.263 2.502 -3.975 1.00 0.00 C ATOM 292 CD1 LEU A 22 3.281 1.471 -2.858 1.00 0.00 C ATOM 293 CD2 LEU A 22 2.299 3.632 -3.644 1.00 0.00 C ATOM 0 H LEU A 22 7.138 3.065 -4.390 1.00 0.00 H new ATOM 0 HA LEU A 22 5.133 1.358 -5.464 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.261 2.918 -3.318 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.599 4.124 -4.404 1.00 0.00 H new ATOM 0 HG LEU A 22 2.919 2.014 -4.887 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.272 1.093 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.938 0.646 -3.135 1.00 0.00 H new ATOM 0 HD13 LEU A 22 3.646 1.934 -1.941 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.304 3.222 -3.470 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.640 4.150 -2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 22 2.262 4.334 -4.477 1.00 0.00 H new ATOM 305 N TYR A 23 5.736 4.185 -7.014 1.00 0.00 N ATOM 306 CA TYR A 23 5.471 4.940 -8.233 1.00 0.00 C ATOM 307 C TYR A 23 5.838 4.126 -9.469 1.00 0.00 C ATOM 308 O TYR A 23 5.073 4.060 -10.431 1.00 0.00 O ATOM 309 CB TYR A 23 6.254 6.254 -8.223 1.00 0.00 C ATOM 310 CG TYR A 23 5.754 7.265 -9.231 1.00 0.00 C ATOM 311 CD1 TYR A 23 4.681 8.096 -8.936 1.00 0.00 C ATOM 312 CD2 TYR A 23 6.356 7.388 -10.477 1.00 0.00 C ATOM 313 CE1 TYR A 23 4.220 9.021 -9.854 1.00 0.00 C ATOM 314 CE2 TYR A 23 5.902 8.311 -11.400 1.00 0.00 C ATOM 315 CZ TYR A 23 4.835 9.125 -11.084 1.00 0.00 C ATOM 316 OH TYR A 23 4.381 10.045 -12.001 1.00 0.00 O ATOM 0 H TYR A 23 6.493 4.560 -6.442 1.00 0.00 H new ATOM 0 HA TYR A 23 4.404 5.160 -8.269 1.00 0.00 H new ATOM 0 HB2 TYR A 23 6.201 6.691 -7.226 1.00 0.00 H new ATOM 0 HB3 TYR A 23 7.304 6.043 -8.423 1.00 0.00 H new ATOM 0 HD1 TYR A 23 4.199 8.018 -7.973 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.192 6.752 -10.728 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.383 9.658 -9.609 1.00 0.00 H new ATOM 0 HE2 TYR A 23 6.381 8.394 -12.364 1.00 0.00 H new ATOM 0 HH TYR A 23 4.924 9.990 -12.815 1.00 0.00 H new ATOM 326 N THR A 24 7.013 3.507 -9.437 1.00 0.00 N ATOM 327 CA THR A 24 7.482 2.697 -10.555 1.00 0.00 C ATOM 328 C THR A 24 6.521 1.546 -10.837 1.00 0.00 C ATOM 329 O THR A 24 6.376 1.111 -11.979 1.00 0.00 O ATOM 330 CB THR A 24 8.880 2.148 -10.264 1.00 0.00 C ATOM 331 OG1 THR A 24 9.731 3.173 -9.781 1.00 0.00 O ATOM 332 CG2 THR A 24 9.546 1.533 -11.476 1.00 0.00 C ATOM 0 H THR A 24 7.658 3.551 -8.648 1.00 0.00 H new ATOM 0 HA THR A 24 7.525 3.335 -11.438 1.00 0.00 H new ATOM 0 HB THR A 24 8.734 1.370 -9.515 1.00 0.00 H new ATOM 0 HG1 THR A 24 10.620 2.802 -9.599 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.534 1.164 -11.200 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.939 0.706 -11.844 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.646 2.286 -12.258 1.00 0.00 H new ATOM 340 N MET A 25 5.868 1.057 -9.788 1.00 0.00 N ATOM 341 CA MET A 25 4.920 -0.042 -9.923 1.00 0.00 C ATOM 342 C MET A 25 3.508 0.480 -10.168 1.00 0.00 C ATOM 343 O MET A 25 2.710 -0.157 -10.855 1.00 0.00 O ATOM 344 CB MET A 25 4.942 -0.919 -8.670 1.00 0.00 C ATOM 345 CG MET A 25 6.038 -1.972 -8.683 1.00 0.00 C ATOM 346 SD MET A 25 5.662 -3.378 -7.619 1.00 0.00 S ATOM 347 CE MET A 25 6.013 -2.686 -6.006 1.00 0.00 C ATOM 0 H MET A 25 5.978 1.405 -8.835 1.00 0.00 H new ATOM 0 HA MET A 25 5.219 -0.641 -10.783 1.00 0.00 H new ATOM 0 HB2 MET A 25 5.071 -0.283 -7.794 1.00 0.00 H new ATOM 0 HB3 MET A 25 3.976 -1.413 -8.566 1.00 0.00 H new ATOM 0 HG2 MET A 25 6.187 -2.323 -9.704 1.00 0.00 H new ATOM 0 HG3 MET A 25 6.976 -1.519 -8.362 1.00 0.00 H new ATOM 0 HE1 MET A 25 5.710 -3.393 -5.233 1.00 0.00 H new ATOM 0 HE2 MET A 25 7.082 -2.489 -5.919 1.00 0.00 H new ATOM 0 HE3 MET A 25 5.461 -1.754 -5.882 1.00 0.00 H new ATOM 357 N MET A 26 3.207 1.644 -9.601 1.00 0.00 N ATOM 358 CA MET A 26 1.891 2.252 -9.758 1.00 0.00 C ATOM 359 C MET A 26 1.590 2.526 -11.228 1.00 0.00 C ATOM 360 O MET A 26 0.443 2.436 -11.665 1.00 0.00 O ATOM 361 CB MET A 26 1.808 3.553 -8.956 1.00 0.00 C ATOM 362 CG MET A 26 1.182 3.381 -7.581 1.00 0.00 C ATOM 363 SD MET A 26 0.155 4.784 -7.105 1.00 0.00 S ATOM 364 CE MET A 26 1.319 6.133 -7.287 1.00 0.00 C ATOM 0 H MET A 26 3.856 2.184 -9.029 1.00 0.00 H new ATOM 0 HA MET A 26 1.147 1.552 -9.378 1.00 0.00 H new ATOM 0 HB2 MET A 26 2.811 3.964 -8.841 1.00 0.00 H new ATOM 0 HB3 MET A 26 1.228 4.282 -9.521 1.00 0.00 H new ATOM 0 HG2 MET A 26 0.578 2.474 -7.572 1.00 0.00 H new ATOM 0 HG3 MET A 26 1.971 3.246 -6.841 1.00 0.00 H new ATOM 0 HE1 MET A 26 0.907 7.033 -6.831 1.00 0.00 H new ATOM 0 HE2 MET A 26 2.257 5.873 -6.795 1.00 0.00 H new ATOM 0 HE3 MET A 26 1.503 6.315 -8.346 1.00 0.00 H new ATOM 374 N THR A 27 2.629 2.862 -11.986 1.00 0.00 N ATOM 375 CA THR A 27 2.476 3.149 -13.408 1.00 0.00 C ATOM 376 C THR A 27 3.026 2.008 -14.257 1.00 0.00 C ATOM 377 O THR A 27 3.526 2.227 -15.361 1.00 0.00 O ATOM 378 CB THR A 27 3.188 4.456 -13.765 1.00 0.00 C ATOM 379 OG1 THR A 27 3.053 4.738 -15.147 1.00 0.00 O ATOM 380 CG2 THR A 27 4.666 4.438 -13.443 1.00 0.00 C ATOM 0 H THR A 27 3.585 2.942 -11.640 1.00 0.00 H new ATOM 0 HA THR A 27 1.412 3.253 -13.619 1.00 0.00 H new ATOM 0 HB THR A 27 2.709 5.223 -13.156 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.412 3.991 -15.670 1.00 0.00 H new ATOM 0 HG21 THR A 27 5.110 5.394 -13.720 1.00 0.00 H new ATOM 0 HG22 THR A 27 4.804 4.270 -12.375 1.00 0.00 H new ATOM 0 HG23 THR A 27 5.150 3.637 -14.002 1.00 0.00 H new ATOM 388 N ASP A 28 2.929 0.789 -13.736 1.00 0.00 N ATOM 389 CA ASP A 28 3.417 -0.388 -14.446 1.00 0.00 C ATOM 390 C ASP A 28 2.257 -1.278 -14.881 1.00 0.00 C ATOM 391 O ASP A 28 1.492 -1.767 -14.050 1.00 0.00 O ATOM 392 CB ASP A 28 4.379 -1.181 -13.561 1.00 0.00 C ATOM 393 CG ASP A 28 5.397 -1.962 -14.369 1.00 0.00 C ATOM 394 OD1 ASP A 28 4.986 -2.685 -15.301 1.00 0.00 O ATOM 395 OD2 ASP A 28 6.605 -1.850 -14.070 1.00 0.00 O ATOM 0 H ASP A 28 2.517 0.590 -12.824 1.00 0.00 H new ATOM 0 HA ASP A 28 3.948 -0.051 -15.336 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.899 -0.497 -12.890 1.00 0.00 H new ATOM 0 HB3 ASP A 28 3.810 -1.869 -12.936 1.00 0.00 H new ATOM 400 N LYS A 29 2.133 -1.485 -16.188 1.00 0.00 N ATOM 401 CA LYS A 29 1.067 -2.317 -16.732 1.00 0.00 C ATOM 402 C LYS A 29 1.424 -3.796 -16.627 1.00 0.00 C ATOM 403 O LYS A 29 0.548 -4.645 -16.469 1.00 0.00 O ATOM 404 CB LYS A 29 0.799 -1.947 -18.193 1.00 0.00 C ATOM 405 CG LYS A 29 0.336 -0.512 -18.383 1.00 0.00 C ATOM 406 CD LYS A 29 -1.057 -0.295 -17.817 1.00 0.00 C ATOM 407 CE LYS A 29 -1.884 0.617 -18.707 1.00 0.00 C ATOM 408 NZ LYS A 29 -3.257 0.825 -18.169 1.00 0.00 N ATOM 0 H LYS A 29 2.758 -1.088 -16.890 1.00 0.00 H new ATOM 0 HA LYS A 29 0.165 -2.138 -16.147 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.709 -2.106 -18.772 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.043 -2.620 -18.597 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.037 0.165 -17.895 1.00 0.00 H new ATOM 0 HG3 LYS A 29 0.341 -0.265 -19.445 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -1.561 -1.256 -17.710 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.982 0.138 -16.820 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -1.383 1.580 -18.805 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -1.947 0.188 -19.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.788 1.453 -18.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -3.745 -0.091 -18.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.198 1.258 -17.225 1.00 0.00 H new ATOM 422 N ASN A 30 2.715 -4.096 -16.714 1.00 0.00 N ATOM 423 CA ASN A 30 3.187 -5.473 -16.628 1.00 0.00 C ATOM 424 C ASN A 30 3.211 -5.950 -15.180 1.00 0.00 C ATOM 425 O ASN A 30 2.965 -7.122 -14.898 1.00 0.00 O ATOM 426 CB ASN A 30 4.584 -5.593 -17.239 1.00 0.00 C ATOM 427 CG ASN A 30 4.598 -5.262 -18.719 1.00 0.00 C ATOM 428 OD1 ASN A 30 4.628 -4.094 -19.105 1.00 0.00 O ATOM 429 ND2 ASN A 30 4.578 -6.293 -19.556 1.00 0.00 N ATOM 0 H ASN A 30 3.453 -3.404 -16.844 1.00 0.00 H new ATOM 0 HA ASN A 30 2.497 -6.104 -17.188 1.00 0.00 H new ATOM 0 HB2 ASN A 30 5.266 -4.925 -16.714 1.00 0.00 H new ATOM 0 HB3 ASN A 30 4.956 -6.607 -17.093 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.587 -6.132 -20.563 1.00 0.00 H new ATOM 0 HD22 ASN A 30 4.553 -7.245 -19.192 1.00 0.00 H new ATOM 436 N ILE A 31 3.508 -5.034 -14.264 1.00 0.00 N ATOM 437 CA ILE A 31 3.564 -5.362 -12.844 1.00 0.00 C ATOM 438 C ILE A 31 2.386 -4.752 -12.093 1.00 0.00 C ATOM 439 O ILE A 31 2.281 -3.532 -11.968 1.00 0.00 O ATOM 440 CB ILE A 31 4.876 -4.870 -12.204 1.00 0.00 C ATOM 441 CG1 ILE A 31 6.075 -5.296 -13.052 1.00 0.00 C ATOM 442 CG2 ILE A 31 5.006 -5.404 -10.786 1.00 0.00 C ATOM 443 CD1 ILE A 31 7.389 -4.720 -12.573 1.00 0.00 C ATOM 0 H ILE A 31 3.714 -4.059 -14.480 1.00 0.00 H new ATOM 0 HA ILE A 31 3.517 -6.448 -12.769 1.00 0.00 H new ATOM 0 HB ILE A 31 4.855 -3.781 -12.161 1.00 0.00 H new ATOM 0 HG12 ILE A 31 6.142 -6.384 -13.051 1.00 0.00 H new ATOM 0 HG13 ILE A 31 5.907 -4.988 -14.084 1.00 0.00 H new ATOM 0 HG21 ILE A 31 5.938 -5.048 -10.347 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.166 -5.054 -10.187 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.008 -6.494 -10.806 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.195 -5.064 -13.221 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.341 -3.631 -12.601 1.00 0.00 H new ATOM 0 HD13 ILE A 31 7.579 -5.049 -11.551 1.00 0.00 H new ATOM 455 N SER A 32 1.502 -5.609 -11.593 1.00 0.00 N ATOM 456 CA SER A 32 0.331 -5.154 -10.852 1.00 0.00 C ATOM 457 C SER A 32 0.702 -4.795 -9.418 1.00 0.00 C ATOM 458 O SER A 32 1.699 -5.282 -8.884 1.00 0.00 O ATOM 459 CB SER A 32 -0.753 -6.235 -10.856 1.00 0.00 C ATOM 460 OG SER A 32 -1.626 -6.079 -11.961 1.00 0.00 O ATOM 0 H SER A 32 1.574 -6.622 -11.687 1.00 0.00 H new ATOM 0 HA SER A 32 -0.055 -4.261 -11.343 1.00 0.00 H new ATOM 0 HB2 SER A 32 -0.288 -7.220 -10.892 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.323 -6.186 -9.928 1.00 0.00 H new ATOM 0 HG SER A 32 -2.308 -6.783 -11.941 1.00 0.00 H new ATOM 466 N LEU A 33 -0.105 -3.939 -8.799 1.00 0.00 N ATOM 467 CA LEU A 33 0.141 -3.516 -7.426 1.00 0.00 C ATOM 468 C LEU A 33 -1.075 -2.793 -6.854 1.00 0.00 C ATOM 469 O LEU A 33 -1.644 -1.911 -7.496 1.00 0.00 O ATOM 470 CB LEU A 33 1.367 -2.603 -7.363 1.00 0.00 C ATOM 471 CG LEU A 33 1.747 -2.123 -5.962 1.00 0.00 C ATOM 472 CD1 LEU A 33 2.676 -3.122 -5.289 1.00 0.00 C ATOM 473 CD2 LEU A 33 2.395 -0.749 -6.028 1.00 0.00 C ATOM 0 H LEU A 33 -0.934 -3.525 -9.226 1.00 0.00 H new ATOM 0 HA LEU A 33 0.328 -4.406 -6.826 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.218 -3.133 -7.792 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.184 -1.731 -7.992 1.00 0.00 H new ATOM 0 HG LEU A 33 0.838 -2.046 -5.365 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.936 -2.763 -4.293 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.176 -4.087 -5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.583 -3.232 -5.883 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.659 -0.423 -5.022 1.00 0.00 H new ATOM 0 HD22 LEU A 33 3.295 -0.800 -6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.696 -0.038 -6.468 1.00 0.00 H new ATOM 485 N ILE A 34 -1.466 -3.173 -5.643 1.00 0.00 N ATOM 486 CA ILE A 34 -2.615 -2.563 -4.983 1.00 0.00 C ATOM 487 C ILE A 34 -2.205 -1.891 -3.678 1.00 0.00 C ATOM 488 O ILE A 34 -1.350 -2.396 -2.949 1.00 0.00 O ATOM 489 CB ILE A 34 -3.713 -3.602 -4.690 1.00 0.00 C ATOM 490 CG1 ILE A 34 -4.005 -4.435 -5.940 1.00 0.00 C ATOM 491 CG2 ILE A 34 -4.977 -2.914 -4.196 1.00 0.00 C ATOM 492 CD1 ILE A 34 -5.078 -5.482 -5.732 1.00 0.00 C ATOM 0 H ILE A 34 -1.004 -3.901 -5.098 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.011 -1.812 -5.667 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.359 -4.271 -3.906 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -4.310 -3.769 -6.747 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -3.087 -4.926 -6.262 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.743 -3.662 -3.994 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.758 -2.363 -3.282 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.337 -2.223 -4.959 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.232 -6.034 -6.659 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.767 -6.171 -4.947 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.009 -4.996 -5.440 1.00 0.00 H new ATOM 504 N ILE A 35 -2.819 -0.749 -3.387 1.00 0.00 N ATOM 505 CA ILE A 35 -2.518 -0.006 -2.169 1.00 0.00 C ATOM 506 C ILE A 35 -3.730 0.042 -1.243 1.00 0.00 C ATOM 507 O ILE A 35 -4.854 0.272 -1.688 1.00 0.00 O ATOM 508 CB ILE A 35 -2.069 1.434 -2.485 1.00 0.00 C ATOM 509 CG1 ILE A 35 -0.948 1.427 -3.527 1.00 0.00 C ATOM 510 CG2 ILE A 35 -1.614 2.139 -1.216 1.00 0.00 C ATOM 511 CD1 ILE A 35 -0.972 2.625 -4.450 1.00 0.00 C ATOM 0 H ILE A 35 -3.529 -0.318 -3.979 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.703 -0.530 -1.671 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.918 1.980 -2.896 1.00 0.00 H new ATOM 0 HG12 ILE A 35 0.013 1.393 -3.014 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.023 0.518 -4.123 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.300 3.155 -1.457 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.438 2.173 -0.503 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -0.777 1.595 -0.778 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.149 2.553 -5.162 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.918 2.649 -4.990 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.866 3.538 -3.864 1.00 0.00 H new ATOM 523 N MET A 36 -3.494 -0.179 0.046 1.00 0.00 N ATOM 524 CA MET A 36 -4.567 -0.161 1.034 1.00 0.00 C ATOM 525 C MET A 36 -4.225 0.770 2.193 1.00 0.00 C ATOM 526 O MET A 36 -3.068 0.872 2.600 1.00 0.00 O ATOM 527 CB MET A 36 -4.827 -1.574 1.559 1.00 0.00 C ATOM 528 CG MET A 36 -5.269 -2.551 0.482 1.00 0.00 C ATOM 529 SD MET A 36 -5.321 -4.256 1.068 1.00 0.00 S ATOM 530 CE MET A 36 -5.355 -5.147 -0.485 1.00 0.00 C ATOM 0 H MET A 36 -2.569 -0.373 0.431 1.00 0.00 H new ATOM 0 HA MET A 36 -5.469 0.211 0.548 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.919 -1.951 2.029 1.00 0.00 H new ATOM 0 HB3 MET A 36 -5.592 -1.530 2.334 1.00 0.00 H new ATOM 0 HG2 MET A 36 -6.257 -2.265 0.121 1.00 0.00 H new ATOM 0 HG3 MET A 36 -4.588 -2.483 -0.366 1.00 0.00 H new ATOM 0 HE1 MET A 36 -5.852 -6.107 -0.343 1.00 0.00 H new ATOM 0 HE2 MET A 36 -5.899 -4.563 -1.228 1.00 0.00 H new ATOM 0 HE3 MET A 36 -4.335 -5.314 -0.831 1.00 0.00 H new ATOM 540 N ASP A 37 -5.241 1.444 2.722 1.00 0.00 N ATOM 541 CA ASP A 37 -5.049 2.366 3.836 1.00 0.00 C ATOM 542 C ASP A 37 -5.688 1.821 5.110 1.00 0.00 C ATOM 543 O ASP A 37 -6.888 1.985 5.333 1.00 0.00 O ATOM 544 CB ASP A 37 -5.638 3.739 3.502 1.00 0.00 C ATOM 545 CG ASP A 37 -7.014 3.643 2.873 1.00 0.00 C ATOM 546 OD1 ASP A 37 -7.990 3.400 3.613 1.00 0.00 O ATOM 547 OD2 ASP A 37 -7.116 3.812 1.640 1.00 0.00 O ATOM 0 H ASP A 37 -6.205 1.369 2.398 1.00 0.00 H new ATOM 0 HA ASP A 37 -3.977 2.472 4.004 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.699 4.336 4.412 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -4.967 4.263 2.822 1.00 0.00 H new ATOM 552 N ALA A 38 -4.880 1.172 5.941 1.00 0.00 N ATOM 553 CA ALA A 38 -5.365 0.603 7.191 1.00 0.00 C ATOM 554 C ALA A 38 -5.523 1.678 8.260 1.00 0.00 C ATOM 555 O ALA A 38 -4.704 1.786 9.173 1.00 0.00 O ATOM 556 CB ALA A 38 -4.422 -0.489 7.674 1.00 0.00 C ATOM 0 H ALA A 38 -3.885 1.027 5.770 1.00 0.00 H new ATOM 0 HA ALA A 38 -6.346 0.166 7.005 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -4.796 -0.906 8.609 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -4.363 -1.277 6.923 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.430 -0.068 7.836 1.00 0.00 H new ATOM 562 N ARG A 39 -6.582 2.473 8.141 1.00 0.00 N ATOM 563 CA ARG A 39 -6.848 3.540 9.097 1.00 0.00 C ATOM 564 C ARG A 39 -8.339 3.638 9.403 1.00 0.00 C ATOM 565 O ARG A 39 -9.144 2.874 8.870 1.00 0.00 O ATOM 566 CB ARG A 39 -6.339 4.877 8.557 1.00 0.00 C ATOM 567 CG ARG A 39 -4.865 4.861 8.182 1.00 0.00 C ATOM 568 CD ARG A 39 -4.673 4.857 6.673 1.00 0.00 C ATOM 569 NE ARG A 39 -5.321 6.001 6.036 1.00 0.00 N ATOM 570 CZ ARG A 39 -4.809 7.229 6.021 1.00 0.00 C ATOM 571 NH1 ARG A 39 -3.643 7.477 6.605 1.00 0.00 N ATOM 572 NH2 ARG A 39 -5.465 8.213 5.420 1.00 0.00 N ATOM 0 H ARG A 39 -7.270 2.398 7.391 1.00 0.00 H new ATOM 0 HA ARG A 39 -6.320 3.304 10.021 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -6.925 5.152 7.680 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.506 5.650 9.307 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -4.370 5.733 8.610 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -4.389 3.980 8.613 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -3.608 4.869 6.443 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -5.078 3.934 6.258 1.00 0.00 H new ATOM 0 HE ARG A 39 -6.219 5.849 5.576 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -3.134 6.724 7.069 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -3.256 8.420 6.590 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -6.361 8.028 4.970 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.073 9.155 5.408 1.00 0.00 H new ATOM 586 N ARG A 40 -8.701 4.583 10.265 1.00 0.00 N ATOM 587 CA ARG A 40 -10.096 4.780 10.642 1.00 0.00 C ATOM 588 C ARG A 40 -10.946 5.128 9.423 1.00 0.00 C ATOM 589 O ARG A 40 -10.437 5.633 8.422 1.00 0.00 O ATOM 590 CB ARG A 40 -10.209 5.885 11.695 1.00 0.00 C ATOM 591 CG ARG A 40 -10.933 5.448 12.959 1.00 0.00 C ATOM 592 CD ARG A 40 -10.334 6.097 14.197 1.00 0.00 C ATOM 593 NE ARG A 40 -10.229 5.157 15.311 1.00 0.00 N ATOM 594 CZ ARG A 40 -11.253 4.809 16.086 1.00 0.00 C ATOM 595 NH1 ARG A 40 -12.460 5.318 15.872 1.00 0.00 N ATOM 596 NH2 ARG A 40 -11.069 3.948 17.078 1.00 0.00 N ATOM 0 H ARG A 40 -8.048 5.224 10.715 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.469 3.847 11.065 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -9.209 6.228 11.959 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -10.734 6.737 11.262 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.988 5.710 12.884 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.880 4.363 13.054 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.345 6.489 13.959 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -10.950 6.946 14.495 1.00 0.00 H new ATOM 0 HE ARG A 40 -9.317 4.743 15.506 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -12.607 5.980 15.110 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -13.241 5.047 16.470 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -10.143 3.554 17.246 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -11.853 3.680 17.673 1.00 0.00 H new ATOM 610 N MET A 41 -12.243 4.854 9.515 1.00 0.00 N ATOM 611 CA MET A 41 -13.164 5.137 8.421 1.00 0.00 C ATOM 612 C MET A 41 -13.204 6.631 8.117 1.00 0.00 C ATOM 613 O MET A 41 -13.411 7.038 6.972 1.00 0.00 O ATOM 614 CB MET A 41 -14.567 4.634 8.765 1.00 0.00 C ATOM 615 CG MET A 41 -15.215 3.824 7.654 1.00 0.00 C ATOM 616 SD MET A 41 -16.574 2.798 8.244 1.00 0.00 S ATOM 617 CE MET A 41 -17.260 2.222 6.693 1.00 0.00 C ATOM 0 H MET A 41 -12.680 4.436 10.336 1.00 0.00 H new ATOM 0 HA MET A 41 -12.807 4.615 7.533 1.00 0.00 H new ATOM 0 HB2 MET A 41 -14.513 4.022 9.665 1.00 0.00 H new ATOM 0 HB3 MET A 41 -15.203 5.488 8.998 1.00 0.00 H new ATOM 0 HG2 MET A 41 -15.584 4.501 6.884 1.00 0.00 H new ATOM 0 HG3 MET A 41 -14.462 3.189 7.186 1.00 0.00 H new ATOM 0 HE1 MET A 41 -18.113 1.573 6.891 1.00 0.00 H new ATOM 0 HE2 MET A 41 -17.585 3.076 6.099 1.00 0.00 H new ATOM 0 HE3 MET A 41 -16.501 1.666 6.143 1.00 0.00 H new ATOM 627 N GLN A 42 -13.004 7.445 9.148 1.00 0.00 N ATOM 628 CA GLN A 42 -13.016 8.895 8.992 1.00 0.00 C ATOM 629 C GLN A 42 -11.765 9.376 8.264 1.00 0.00 C ATOM 630 O GLN A 42 -11.799 10.374 7.543 1.00 0.00 O ATOM 631 CB GLN A 42 -13.120 9.575 10.358 1.00 0.00 C ATOM 632 CG GLN A 42 -13.996 10.817 10.355 1.00 0.00 C ATOM 633 CD GLN A 42 -14.276 11.337 11.752 1.00 0.00 C ATOM 634 OE1 GLN A 42 -14.977 10.697 12.535 1.00 0.00 O ATOM 635 NE2 GLN A 42 -13.728 12.503 12.070 1.00 0.00 N ATOM 0 H GLN A 42 -12.832 7.125 10.101 1.00 0.00 H new ATOM 0 HA GLN A 42 -13.887 9.163 8.393 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -13.518 8.862 11.080 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -12.120 9.847 10.696 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -13.510 11.599 9.771 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -14.940 10.590 9.860 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -13.153 12.999 11.389 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -13.881 12.903 12.996 1.00 0.00 H new ATOM 644 N ASP A 43 -10.662 8.659 8.456 1.00 0.00 N ATOM 645 CA ASP A 43 -9.399 9.013 7.818 1.00 0.00 C ATOM 646 C ASP A 43 -9.517 8.937 6.298 1.00 0.00 C ATOM 647 O ASP A 43 -9.063 9.831 5.586 1.00 0.00 O ATOM 648 CB ASP A 43 -8.282 8.087 8.300 1.00 0.00 C ATOM 649 CG ASP A 43 -7.745 8.488 9.661 1.00 0.00 C ATOM 650 OD1 ASP A 43 -7.868 9.677 10.020 1.00 0.00 O ATOM 651 OD2 ASP A 43 -7.201 7.612 10.366 1.00 0.00 O ATOM 0 H ASP A 43 -10.617 7.830 9.048 1.00 0.00 H new ATOM 0 HA ASP A 43 -9.156 10.039 8.096 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -8.657 7.064 8.347 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -7.468 8.095 7.575 1.00 0.00 H new ATOM 656 N TYR A 44 -10.129 7.863 5.811 1.00 0.00 N ATOM 657 CA TYR A 44 -10.306 7.668 4.377 1.00 0.00 C ATOM 658 C TYR A 44 -11.123 8.804 3.770 1.00 0.00 C ATOM 659 O TYR A 44 -10.846 9.256 2.659 1.00 0.00 O ATOM 660 CB TYR A 44 -10.992 6.330 4.103 1.00 0.00 C ATOM 661 CG TYR A 44 -11.105 5.994 2.633 1.00 0.00 C ATOM 662 CD1 TYR A 44 -10.005 6.102 1.791 1.00 0.00 C ATOM 663 CD2 TYR A 44 -12.310 5.570 2.088 1.00 0.00 C ATOM 664 CE1 TYR A 44 -10.104 5.798 0.447 1.00 0.00 C ATOM 665 CE2 TYR A 44 -12.417 5.264 0.745 1.00 0.00 C ATOM 666 CZ TYR A 44 -11.311 5.379 -0.071 1.00 0.00 C ATOM 667 OH TYR A 44 -11.414 5.075 -1.409 1.00 0.00 O ATOM 0 H TYR A 44 -10.511 7.114 6.389 1.00 0.00 H new ATOM 0 HA TYR A 44 -9.320 7.664 3.913 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -10.437 5.538 4.606 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -11.990 6.347 4.540 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -9.058 6.429 2.194 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -13.178 5.478 2.724 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -9.240 5.888 -0.195 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -13.362 4.937 0.336 1.00 0.00 H new ATOM 0 HH TYR A 44 -12.331 4.795 -1.611 1.00 0.00 H new ATOM 677 N GLN A 45 -12.129 9.262 4.506 1.00 0.00 N ATOM 678 CA GLN A 45 -12.987 10.346 4.040 1.00 0.00 C ATOM 679 C GLN A 45 -12.202 11.647 3.917 1.00 0.00 C ATOM 680 O GLN A 45 -12.302 12.351 2.912 1.00 0.00 O ATOM 681 CB GLN A 45 -14.167 10.537 4.994 1.00 0.00 C ATOM 682 CG GLN A 45 -15.012 9.286 5.175 1.00 0.00 C ATOM 683 CD GLN A 45 -15.649 8.821 3.879 1.00 0.00 C ATOM 684 OE1 GLN A 45 -14.956 8.440 2.936 1.00 0.00 O ATOM 685 NE2 GLN A 45 -16.975 8.850 3.828 1.00 0.00 N ATOM 0 H GLN A 45 -12.371 8.900 5.428 1.00 0.00 H new ATOM 0 HA GLN A 45 -13.366 10.077 3.054 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -13.790 10.854 5.966 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.800 11.342 4.619 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.390 8.487 5.577 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -15.793 9.482 5.910 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -17.509 9.174 4.634 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -17.460 8.549 2.983 1.00 0.00 H new ATOM 694 N ASP A 46 -11.422 11.962 4.946 1.00 0.00 N ATOM 695 CA ASP A 46 -10.620 13.181 4.952 1.00 0.00 C ATOM 696 C ASP A 46 -9.543 13.129 3.874 1.00 0.00 C ATOM 697 O ASP A 46 -9.436 14.032 3.045 1.00 0.00 O ATOM 698 CB ASP A 46 -9.976 13.385 6.324 1.00 0.00 C ATOM 699 CG ASP A 46 -10.878 14.142 7.279 1.00 0.00 C ATOM 700 OD1 ASP A 46 -12.003 13.664 7.537 1.00 0.00 O ATOM 701 OD2 ASP A 46 -10.460 15.213 7.768 1.00 0.00 O ATOM 0 H ASP A 46 -11.328 11.391 5.786 1.00 0.00 H new ATOM 0 HA ASP A 46 -11.280 14.022 4.740 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.729 12.414 6.754 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.039 13.929 6.205 1.00 0.00 H new ATOM 706 N SER A 47 -8.745 12.065 3.892 1.00 0.00 N ATOM 707 CA SER A 47 -7.675 11.897 2.917 1.00 0.00 C ATOM 708 C SER A 47 -7.704 10.497 2.311 1.00 0.00 C ATOM 709 O SER A 47 -8.041 9.525 2.988 1.00 0.00 O ATOM 710 CB SER A 47 -6.316 12.153 3.569 1.00 0.00 C ATOM 711 OG SER A 47 -6.014 11.155 4.529 1.00 0.00 O ATOM 0 H SER A 47 -8.820 11.308 4.571 1.00 0.00 H new ATOM 0 HA SER A 47 -7.830 12.623 2.119 1.00 0.00 H new ATOM 0 HB2 SER A 47 -5.540 12.172 2.804 1.00 0.00 H new ATOM 0 HB3 SER A 47 -6.317 13.133 4.047 1.00 0.00 H new ATOM 0 HG SER A 47 -5.345 11.498 5.158 1.00 0.00 H new ATOM 717 N CYS A 48 -7.350 10.402 1.034 1.00 0.00 N ATOM 718 CA CYS A 48 -7.335 9.121 0.338 1.00 0.00 C ATOM 719 C CYS A 48 -6.580 9.229 -0.984 1.00 0.00 C ATOM 720 O CYS A 48 -6.824 10.138 -1.777 1.00 0.00 O ATOM 721 CB CYS A 48 -8.765 8.638 0.084 1.00 0.00 C ATOM 722 SG CYS A 48 -9.841 9.880 -0.669 1.00 0.00 S ATOM 0 H CYS A 48 -7.070 11.197 0.460 1.00 0.00 H new ATOM 0 HA CYS A 48 -6.821 8.398 0.971 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -8.731 7.762 -0.563 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -9.203 8.319 1.030 1.00 0.00 H new ATOM 0 HG CYS A 48 -11.027 9.377 -0.846 1.00 0.00 H new ATOM 728 N ILE A 49 -5.661 8.297 -1.213 1.00 0.00 N ATOM 729 CA ILE A 49 -4.869 8.288 -2.437 1.00 0.00 C ATOM 730 C ILE A 49 -5.704 7.834 -3.629 1.00 0.00 C ATOM 731 O ILE A 49 -6.560 6.957 -3.503 1.00 0.00 O ATOM 732 CB ILE A 49 -3.641 7.366 -2.305 1.00 0.00 C ATOM 733 CG1 ILE A 49 -2.887 7.667 -1.007 1.00 0.00 C ATOM 734 CG2 ILE A 49 -2.724 7.532 -3.507 1.00 0.00 C ATOM 735 CD1 ILE A 49 -1.669 6.794 -0.801 1.00 0.00 C ATOM 0 H ILE A 49 -5.446 7.538 -0.567 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.531 9.311 -2.602 1.00 0.00 H new ATOM 0 HB ILE A 49 -3.983 6.331 -2.273 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.579 8.713 -1.009 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.565 7.536 -0.164 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -1.861 6.875 -3.400 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.266 7.274 -4.417 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -2.387 8.567 -3.567 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.184 7.062 0.138 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -1.973 5.748 -0.767 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.971 6.942 -1.625 1.00 0.00 H new ATOM 747 N LEU A 50 -5.451 8.436 -4.786 1.00 0.00 N ATOM 748 CA LEU A 50 -6.178 8.094 -6.002 1.00 0.00 C ATOM 749 C LEU A 50 -5.765 6.718 -6.514 1.00 0.00 C ATOM 750 O LEU A 50 -4.601 6.330 -6.410 1.00 0.00 O ATOM 751 CB LEU A 50 -5.931 9.148 -7.083 1.00 0.00 C ATOM 752 CG LEU A 50 -6.496 10.536 -6.776 1.00 0.00 C ATOM 753 CD1 LEU A 50 -5.548 11.620 -7.266 1.00 0.00 C ATOM 754 CD2 LEU A 50 -7.870 10.702 -7.407 1.00 0.00 C ATOM 0 H LEU A 50 -4.747 9.164 -4.907 1.00 0.00 H new ATOM 0 HA LEU A 50 -7.242 8.070 -5.764 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.857 9.237 -7.243 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.364 8.795 -8.019 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.599 10.635 -5.695 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.967 12.600 -7.039 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.584 11.513 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.412 11.525 -8.343 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.258 11.695 -7.179 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.791 10.583 -8.488 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -8.547 9.947 -7.007 1.00 0.00 H new ATOM 766 N HIS A 51 -6.725 5.985 -7.068 1.00 0.00 N ATOM 767 CA HIS A 51 -6.461 4.651 -7.598 1.00 0.00 C ATOM 768 C HIS A 51 -5.929 3.729 -6.506 1.00 0.00 C ATOM 769 O HIS A 51 -5.082 2.872 -6.762 1.00 0.00 O ATOM 770 CB HIS A 51 -5.460 4.728 -8.750 1.00 0.00 C ATOM 771 CG HIS A 51 -5.786 5.786 -9.757 1.00 0.00 C ATOM 772 ND1 HIS A 51 -6.978 6.474 -9.789 1.00 0.00 N ATOM 773 CD2 HIS A 51 -5.045 6.273 -10.785 1.00 0.00 C ATOM 774 CE1 HIS A 51 -6.927 7.338 -10.812 1.00 0.00 C ATOM 775 NE2 HIS A 51 -5.775 7.256 -11.449 1.00 0.00 N ATOM 0 H HIS A 51 -7.693 6.292 -7.162 1.00 0.00 H new ATOM 0 HA HIS A 51 -7.400 4.240 -7.969 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -4.466 4.918 -8.345 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -5.420 3.761 -9.251 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -4.048 5.950 -11.046 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -7.726 8.014 -11.080 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -5.480 7.800 -12.260 1.00 0.00 H new ATOM 783 N SER A 52 -6.430 3.908 -5.288 1.00 0.00 N ATOM 784 CA SER A 52 -6.005 3.092 -4.157 1.00 0.00 C ATOM 785 C SER A 52 -7.206 2.474 -3.450 1.00 0.00 C ATOM 786 O SER A 52 -8.341 2.918 -3.628 1.00 0.00 O ATOM 787 CB SER A 52 -5.195 3.934 -3.170 1.00 0.00 C ATOM 788 OG SER A 52 -6.046 4.703 -2.338 1.00 0.00 O ATOM 0 H SER A 52 -7.132 4.612 -5.059 1.00 0.00 H new ATOM 0 HA SER A 52 -5.377 2.287 -4.538 1.00 0.00 H new ATOM 0 HB2 SER A 52 -4.573 3.282 -2.556 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.522 4.594 -3.717 1.00 0.00 H new ATOM 0 HG SER A 52 -6.422 5.447 -2.853 1.00 0.00 H new ATOM 794 N LEU A 53 -6.949 1.445 -2.649 1.00 0.00 N ATOM 795 CA LEU A 53 -8.010 0.765 -1.915 1.00 0.00 C ATOM 796 C LEU A 53 -8.106 1.288 -0.485 1.00 0.00 C ATOM 797 O LEU A 53 -7.180 1.927 0.015 1.00 0.00 O ATOM 798 CB LEU A 53 -7.764 -0.745 -1.903 1.00 0.00 C ATOM 799 CG LEU A 53 -8.991 -1.598 -1.581 1.00 0.00 C ATOM 800 CD1 LEU A 53 -10.143 -1.244 -2.507 1.00 0.00 C ATOM 801 CD2 LEU A 53 -8.653 -3.078 -1.687 1.00 0.00 C ATOM 0 H LEU A 53 -6.016 1.064 -2.492 1.00 0.00 H new ATOM 0 HA LEU A 53 -8.954 0.968 -2.420 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -7.379 -1.043 -2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -6.986 -0.965 -1.172 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.298 -1.389 -0.556 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.008 -1.861 -2.264 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.400 -0.192 -2.382 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.848 -1.425 -3.541 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.538 -3.671 -1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -8.321 -3.304 -2.700 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -7.858 -3.321 -0.982 1.00 0.00 H new ATOM 813 N SER A 54 -9.231 1.014 0.166 1.00 0.00 N ATOM 814 CA SER A 54 -9.446 1.459 1.539 1.00 0.00 C ATOM 815 C SER A 54 -9.956 0.314 2.409 1.00 0.00 C ATOM 816 O SER A 54 -10.673 -0.568 1.936 1.00 0.00 O ATOM 817 CB SER A 54 -10.443 2.619 1.570 1.00 0.00 C ATOM 818 OG SER A 54 -11.772 2.155 1.407 1.00 0.00 O ATOM 0 H SER A 54 -10.007 0.487 -0.234 1.00 0.00 H new ATOM 0 HA SER A 54 -8.490 1.798 1.938 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.355 3.153 2.516 1.00 0.00 H new ATOM 0 HB3 SER A 54 -10.203 3.330 0.779 1.00 0.00 H new ATOM 0 HG SER A 54 -12.354 2.907 1.170 1.00 0.00 H new ATOM 824 N VAL A 55 -9.581 0.335 3.684 1.00 0.00 N ATOM 825 CA VAL A 55 -10.000 -0.699 4.622 1.00 0.00 C ATOM 826 C VAL A 55 -10.069 -0.151 6.048 1.00 0.00 C ATOM 827 O VAL A 55 -9.098 0.416 6.548 1.00 0.00 O ATOM 828 CB VAL A 55 -9.043 -1.907 4.589 1.00 0.00 C ATOM 829 CG1 VAL A 55 -7.637 -1.489 4.992 1.00 0.00 C ATOM 830 CG2 VAL A 55 -9.556 -3.024 5.488 1.00 0.00 C ATOM 0 H VAL A 55 -8.987 1.058 4.091 1.00 0.00 H new ATOM 0 HA VAL A 55 -10.993 -1.026 4.314 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.004 -2.286 3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.977 -2.356 4.962 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.271 -0.730 4.300 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.654 -1.081 6.003 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.866 -3.867 5.450 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -9.630 -2.661 6.513 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.540 -3.344 5.145 1.00 0.00 H new ATOM 840 N PRO A 56 -11.222 -0.312 6.725 1.00 0.00 N ATOM 841 CA PRO A 56 -11.403 0.173 8.097 1.00 0.00 C ATOM 842 C PRO A 56 -10.314 -0.334 9.038 1.00 0.00 C ATOM 843 O PRO A 56 -9.597 -1.282 8.720 1.00 0.00 O ATOM 844 CB PRO A 56 -12.765 -0.394 8.503 1.00 0.00 C ATOM 845 CG PRO A 56 -13.486 -0.606 7.218 1.00 0.00 C ATOM 846 CD PRO A 56 -12.435 -0.974 6.210 1.00 0.00 C ATOM 0 HA PRO A 56 -11.347 1.260 8.153 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -12.656 -1.328 9.055 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -13.305 0.298 9.150 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -14.229 -1.398 7.314 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.018 0.296 6.916 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -12.305 -2.054 6.141 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.693 -0.620 5.212 1.00 0.00 H new ATOM 854 N GLU A 57 -10.198 0.304 10.198 1.00 0.00 N ATOM 855 CA GLU A 57 -9.199 -0.082 11.187 1.00 0.00 C ATOM 856 C GLU A 57 -9.799 -1.023 12.226 1.00 0.00 C ATOM 857 O GLU A 57 -9.118 -1.910 12.742 1.00 0.00 O ATOM 858 CB GLU A 57 -8.626 1.158 11.875 1.00 0.00 C ATOM 859 CG GLU A 57 -7.509 0.846 12.858 1.00 0.00 C ATOM 860 CD GLU A 57 -7.163 2.029 13.740 1.00 0.00 C ATOM 861 OE1 GLU A 57 -8.048 2.489 14.492 1.00 0.00 O ATOM 862 OE2 GLU A 57 -6.007 2.497 13.679 1.00 0.00 O ATOM 0 H GLU A 57 -10.784 1.091 10.476 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.395 -0.605 10.670 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -8.250 1.843 11.116 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -9.428 1.675 12.401 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -7.805 0.005 13.484 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.621 0.536 12.307 1.00 0.00 H new ATOM 869 N GLU A 58 -11.078 -0.827 12.527 1.00 0.00 N ATOM 870 CA GLU A 58 -11.771 -1.658 13.503 1.00 0.00 C ATOM 871 C GLU A 58 -12.105 -3.025 12.914 1.00 0.00 C ATOM 872 O GLU A 58 -12.119 -4.031 13.623 1.00 0.00 O ATOM 873 CB GLU A 58 -13.052 -0.967 13.976 1.00 0.00 C ATOM 874 CG GLU A 58 -12.835 0.467 14.433 1.00 0.00 C ATOM 875 CD GLU A 58 -12.517 0.566 15.912 1.00 0.00 C ATOM 876 OE1 GLU A 58 -11.332 0.411 16.276 1.00 0.00 O ATOM 877 OE2 GLU A 58 -13.452 0.799 16.706 1.00 0.00 O ATOM 0 H GLU A 58 -11.656 -0.099 12.108 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.108 -1.802 14.356 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -13.780 -0.975 13.165 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.483 -1.540 14.797 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -12.019 0.908 13.860 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -13.729 1.052 14.217 1.00 0.00 H new ATOM 884 N ALA A 59 -12.372 -3.053 11.612 1.00 0.00 N ATOM 885 CA ALA A 59 -12.705 -4.296 10.927 1.00 0.00 C ATOM 886 C ALA A 59 -11.529 -5.267 10.951 1.00 0.00 C ATOM 887 O ALA A 59 -11.717 -6.484 10.966 1.00 0.00 O ATOM 888 CB ALA A 59 -13.126 -4.012 9.494 1.00 0.00 C ATOM 0 H ALA A 59 -12.364 -2.229 11.011 1.00 0.00 H new ATOM 0 HA ALA A 59 -13.538 -4.761 11.454 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.372 -4.949 8.994 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -14.000 -3.361 9.494 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -12.308 -3.522 8.965 1.00 0.00 H new ATOM 894 N ILE A 60 -10.317 -4.721 10.957 1.00 0.00 N ATOM 895 CA ILE A 60 -9.111 -5.539 10.979 1.00 0.00 C ATOM 896 C ILE A 60 -8.677 -5.839 12.410 1.00 0.00 C ATOM 897 O ILE A 60 -8.207 -4.955 13.125 1.00 0.00 O ATOM 898 CB ILE A 60 -7.950 -4.850 10.238 1.00 0.00 C ATOM 899 CG1 ILE A 60 -8.415 -4.353 8.867 1.00 0.00 C ATOM 900 CG2 ILE A 60 -6.774 -5.804 10.091 1.00 0.00 C ATOM 901 CD1 ILE A 60 -7.355 -3.580 8.113 1.00 0.00 C ATOM 0 H ILE A 60 -10.145 -3.716 10.947 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.353 -6.472 10.471 1.00 0.00 H new ATOM 0 HB ILE A 60 -7.624 -3.991 10.824 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -8.726 -5.208 8.266 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -9.292 -3.719 8.998 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.962 -5.302 9.565 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.431 -6.113 11.078 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.086 -6.681 9.524 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.754 -3.259 7.151 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.060 -2.706 8.694 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.486 -4.218 7.951 1.00 0.00 H new ATOM 913 N SER A 61 -8.840 -7.092 12.823 1.00 0.00 N ATOM 914 CA SER A 61 -8.466 -7.508 14.169 1.00 0.00 C ATOM 915 C SER A 61 -7.193 -8.350 14.144 1.00 0.00 C ATOM 916 O SER A 61 -6.876 -8.982 13.137 1.00 0.00 O ATOM 917 CB SER A 61 -9.602 -8.302 14.815 1.00 0.00 C ATOM 918 OG SER A 61 -10.522 -7.439 15.464 1.00 0.00 O ATOM 0 H SER A 61 -9.229 -7.837 12.244 1.00 0.00 H new ATOM 0 HA SER A 61 -8.277 -6.611 14.759 1.00 0.00 H new ATOM 0 HB2 SER A 61 -10.120 -8.886 14.054 1.00 0.00 H new ATOM 0 HB3 SER A 61 -9.192 -9.010 15.535 1.00 0.00 H new ATOM 0 HG SER A 61 -11.240 -7.970 15.868 1.00 0.00 H new ATOM 924 N PRO A 62 -6.442 -8.370 15.260 1.00 0.00 N ATOM 925 CA PRO A 62 -5.198 -9.140 15.361 1.00 0.00 C ATOM 926 C PRO A 62 -5.448 -10.644 15.365 1.00 0.00 C ATOM 927 O PRO A 62 -5.906 -11.205 16.360 1.00 0.00 O ATOM 928 CB PRO A 62 -4.608 -8.692 16.700 1.00 0.00 C ATOM 929 CG PRO A 62 -5.780 -8.233 17.497 1.00 0.00 C ATOM 930 CD PRO A 62 -6.747 -7.645 16.508 1.00 0.00 C ATOM 0 HA PRO A 62 -4.539 -8.963 14.511 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -4.088 -9.511 17.197 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -3.883 -7.889 16.564 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -6.233 -9.063 18.039 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -5.482 -7.492 18.239 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -7.781 -7.796 16.818 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -6.602 -6.571 16.394 1.00 0.00 H new ATOM 938 N GLY A 63 -5.144 -11.293 14.244 1.00 0.00 N ATOM 939 CA GLY A 63 -5.343 -12.726 14.140 1.00 0.00 C ATOM 940 C GLY A 63 -6.615 -13.083 13.396 1.00 0.00 C ATOM 941 O GLY A 63 -7.349 -13.983 13.802 1.00 0.00 O ATOM 0 H GLY A 63 -4.764 -10.851 13.407 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.490 -13.172 13.629 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -5.377 -13.158 15.140 1.00 0.00 H new ATOM 945 N VAL A 64 -6.875 -12.376 12.301 1.00 0.00 N ATOM 946 CA VAL A 64 -8.066 -12.623 11.497 1.00 0.00 C ATOM 947 C VAL A 64 -7.698 -13.201 10.134 1.00 0.00 C ATOM 948 O VAL A 64 -6.521 -13.323 9.797 1.00 0.00 O ATOM 949 CB VAL A 64 -8.883 -11.335 11.291 1.00 0.00 C ATOM 950 CG1 VAL A 64 -9.432 -10.832 12.617 1.00 0.00 C ATOM 951 CG2 VAL A 64 -8.037 -10.265 10.617 1.00 0.00 C ATOM 0 H VAL A 64 -6.277 -11.628 11.950 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.672 -13.345 12.044 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.725 -11.564 10.638 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -10.007 -9.921 12.451 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -10.077 -11.593 13.056 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.606 -10.621 13.296 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.633 -9.363 10.480 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -7.173 -10.038 11.241 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.699 -10.627 9.646 1.00 0.00 H new ATOM 961 N THR A 65 -8.715 -13.556 9.355 1.00 0.00 N ATOM 962 CA THR A 65 -8.501 -14.122 8.028 1.00 0.00 C ATOM 963 C THR A 65 -9.072 -13.208 6.948 1.00 0.00 C ATOM 964 O THR A 65 -9.577 -12.125 7.242 1.00 0.00 O ATOM 965 CB THR A 65 -9.143 -15.507 7.932 1.00 0.00 C ATOM 966 OG1 THR A 65 -10.549 -15.417 8.063 1.00 0.00 O ATOM 967 CG2 THR A 65 -8.645 -16.472 8.987 1.00 0.00 C ATOM 0 H THR A 65 -9.695 -13.462 9.620 1.00 0.00 H new ATOM 0 HA THR A 65 -7.427 -14.215 7.869 1.00 0.00 H new ATOM 0 HB THR A 65 -8.861 -15.889 6.951 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.942 -16.312 7.997 1.00 0.00 H new ATOM 0 HG21 THR A 65 -9.140 -17.435 8.862 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.568 -16.602 8.882 1.00 0.00 H new ATOM 0 HG23 THR A 65 -8.868 -16.075 9.977 1.00 0.00 H new ATOM 975 N ALA A 66 -8.990 -13.653 5.699 1.00 0.00 N ATOM 976 CA ALA A 66 -9.501 -12.876 4.577 1.00 0.00 C ATOM 977 C ALA A 66 -11.017 -12.737 4.652 1.00 0.00 C ATOM 978 O ALA A 66 -11.571 -11.689 4.321 1.00 0.00 O ATOM 979 CB ALA A 66 -9.091 -13.519 3.260 1.00 0.00 C ATOM 0 H ALA A 66 -8.575 -14.547 5.439 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.068 -11.877 4.630 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.479 -12.928 2.430 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -8.004 -13.560 3.198 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -9.496 -14.530 3.207 1.00 0.00 H new ATOM 985 N SER A 67 -11.683 -13.801 5.087 1.00 0.00 N ATOM 986 CA SER A 67 -13.136 -13.798 5.207 1.00 0.00 C ATOM 987 C SER A 67 -13.599 -12.714 6.174 1.00 0.00 C ATOM 988 O SER A 67 -14.677 -12.142 6.010 1.00 0.00 O ATOM 989 CB SER A 67 -13.632 -15.165 5.681 1.00 0.00 C ATOM 990 OG SER A 67 -13.019 -16.213 4.950 1.00 0.00 O ATOM 0 H SER A 67 -11.239 -14.677 5.363 1.00 0.00 H new ATOM 0 HA SER A 67 -13.557 -13.587 4.224 1.00 0.00 H new ATOM 0 HB2 SER A 67 -13.418 -15.285 6.743 1.00 0.00 H new ATOM 0 HB3 SER A 67 -14.714 -15.222 5.566 1.00 0.00 H new ATOM 0 HG SER A 67 -13.352 -17.076 5.274 1.00 0.00 H new ATOM 996 N TRP A 68 -12.777 -12.436 7.181 1.00 0.00 N ATOM 997 CA TRP A 68 -13.101 -11.420 8.174 1.00 0.00 C ATOM 998 C TRP A 68 -13.119 -10.030 7.548 1.00 0.00 C ATOM 999 O TRP A 68 -14.129 -9.329 7.594 1.00 0.00 O ATOM 1000 CB TRP A 68 -12.093 -11.462 9.324 1.00 0.00 C ATOM 1001 CG TRP A 68 -12.512 -10.653 10.514 1.00 0.00 C ATOM 1002 CD1 TRP A 68 -12.872 -9.336 10.524 1.00 0.00 C ATOM 1003 CD2 TRP A 68 -12.613 -11.109 11.867 1.00 0.00 C ATOM 1004 NE1 TRP A 68 -13.191 -8.945 11.802 1.00 0.00 N ATOM 1005 CE2 TRP A 68 -13.041 -10.016 12.644 1.00 0.00 C ATOM 1006 CE3 TRP A 68 -12.385 -12.336 12.497 1.00 0.00 C ATOM 1007 CZ2 TRP A 68 -13.243 -10.113 14.018 1.00 0.00 C ATOM 1008 CZ3 TRP A 68 -12.586 -12.432 13.862 1.00 0.00 C ATOM 1009 CH2 TRP A 68 -13.013 -11.326 14.609 1.00 0.00 C ATOM 0 H TRP A 68 -11.881 -12.901 7.330 1.00 0.00 H new ATOM 0 HA TRP A 68 -14.096 -11.634 8.564 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -11.947 -12.498 9.631 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -11.130 -11.097 8.967 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -12.902 -8.696 9.655 1.00 0.00 H new ATOM 0 HE1 TRP A 68 -13.491 -8.010 12.079 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -12.058 -13.194 11.928 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -13.569 -9.262 14.597 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -12.411 -13.374 14.360 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -13.164 -11.433 15.673 1.00 0.00 H new ATOM 1020 N ILE A 69 -11.992 -9.637 6.963 1.00 0.00 N ATOM 1021 CA ILE A 69 -11.876 -8.330 6.328 1.00 0.00 C ATOM 1022 C ILE A 69 -12.878 -8.183 5.187 1.00 0.00 C ATOM 1023 O ILE A 69 -13.584 -7.179 5.095 1.00 0.00 O ATOM 1024 CB ILE A 69 -10.454 -8.093 5.782 1.00 0.00 C ATOM 1025 CG1 ILE A 69 -9.410 -8.394 6.859 1.00 0.00 C ATOM 1026 CG2 ILE A 69 -10.310 -6.663 5.280 1.00 0.00 C ATOM 1027 CD1 ILE A 69 -8.240 -9.211 6.355 1.00 0.00 C ATOM 0 H ILE A 69 -11.146 -10.205 6.916 1.00 0.00 H new ATOM 0 HA ILE A 69 -12.090 -7.586 7.095 1.00 0.00 H new ATOM 0 HB ILE A 69 -10.287 -8.770 4.944 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -9.038 -7.454 7.266 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -9.889 -8.928 7.679 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.301 -6.511 4.898 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -11.031 -6.483 4.482 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -10.495 -5.969 6.100 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.540 -9.386 7.172 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.601 -10.167 5.975 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.736 -8.669 5.555 1.00 0.00 H new ATOM 1039 N GLU A 70 -12.936 -9.191 4.323 1.00 0.00 N ATOM 1040 CA GLU A 70 -13.853 -9.175 3.186 1.00 0.00 C ATOM 1041 C GLU A 70 -15.289 -8.934 3.641 1.00 0.00 C ATOM 1042 O GLU A 70 -16.101 -8.379 2.900 1.00 0.00 O ATOM 1043 CB GLU A 70 -13.765 -10.493 2.416 1.00 0.00 C ATOM 1044 CG GLU A 70 -14.370 -10.426 1.023 1.00 0.00 C ATOM 1045 CD GLU A 70 -13.904 -11.560 0.130 1.00 0.00 C ATOM 1046 OE1 GLU A 70 -13.612 -12.651 0.661 1.00 0.00 O ATOM 1047 OE2 GLU A 70 -13.833 -11.355 -1.100 1.00 0.00 O ATOM 0 H GLU A 70 -12.359 -10.030 4.387 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.560 -8.356 2.529 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.719 -10.787 2.335 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.272 -11.272 2.986 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -15.457 -10.453 1.101 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.107 -9.474 0.562 1.00 0.00 H new ATOM 1054 N ALA A 71 -15.596 -9.353 4.864 1.00 0.00 N ATOM 1055 CA ALA A 71 -16.934 -9.182 5.417 1.00 0.00 C ATOM 1056 C ALA A 71 -17.189 -7.729 5.802 1.00 0.00 C ATOM 1057 O ALA A 71 -18.327 -7.258 5.767 1.00 0.00 O ATOM 1058 CB ALA A 71 -17.127 -10.091 6.621 1.00 0.00 C ATOM 0 H ALA A 71 -14.936 -9.813 5.491 1.00 0.00 H new ATOM 0 HA ALA A 71 -17.656 -9.457 4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -18.130 -9.953 7.024 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -16.998 -11.130 6.317 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -16.391 -9.843 7.386 1.00 0.00 H new ATOM 1064 N HIS A 72 -16.125 -7.022 6.170 1.00 0.00 N ATOM 1065 CA HIS A 72 -16.237 -5.622 6.563 1.00 0.00 C ATOM 1066 C HIS A 72 -15.380 -4.732 5.667 1.00 0.00 C ATOM 1067 O HIS A 72 -14.219 -4.461 5.972 1.00 0.00 O ATOM 1068 CB HIS A 72 -15.819 -5.446 8.024 1.00 0.00 C ATOM 1069 CG HIS A 72 -16.814 -5.996 9.000 1.00 0.00 C ATOM 1070 ND1 HIS A 72 -17.374 -5.262 10.022 1.00 0.00 N ATOM 1071 CD2 HIS A 72 -17.350 -7.240 9.094 1.00 0.00 C ATOM 1072 CE1 HIS A 72 -18.213 -6.064 10.691 1.00 0.00 C ATOM 1073 NE2 HIS A 72 -18.236 -7.275 10.168 1.00 0.00 N ATOM 0 H HIS A 72 -15.176 -7.395 6.204 1.00 0.00 H new ATOM 0 HA HIS A 72 -17.279 -5.323 6.450 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -14.859 -5.937 8.181 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -15.671 -4.385 8.226 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -17.125 -8.070 8.440 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -18.795 -5.759 11.548 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -18.788 -8.072 10.485 1.00 0.00 H new ATOM 1081 N LEU A 73 -15.962 -4.282 4.560 1.00 0.00 N ATOM 1082 CA LEU A 73 -15.254 -3.423 3.618 1.00 0.00 C ATOM 1083 C LEU A 73 -16.239 -2.605 2.785 1.00 0.00 C ATOM 1084 O LEU A 73 -17.378 -3.022 2.570 1.00 0.00 O ATOM 1085 CB LEU A 73 -14.365 -4.262 2.697 1.00 0.00 C ATOM 1086 CG LEU A 73 -12.991 -4.618 3.270 1.00 0.00 C ATOM 1087 CD1 LEU A 73 -12.198 -5.456 2.276 1.00 0.00 C ATOM 1088 CD2 LEU A 73 -12.224 -3.357 3.646 1.00 0.00 C ATOM 0 H LEU A 73 -16.923 -4.498 4.293 1.00 0.00 H new ATOM 0 HA LEU A 73 -14.628 -2.737 4.189 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -14.890 -5.185 2.453 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.222 -3.720 1.762 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.138 -5.209 4.174 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.224 -5.699 2.701 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.741 -6.377 2.062 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.061 -4.893 1.353 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.250 -3.631 4.051 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.087 -2.737 2.760 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.785 -2.800 4.396 1.00 0.00 H new ATOM 1100 N PRO A 74 -15.813 -1.424 2.303 1.00 0.00 N ATOM 1101 CA PRO A 74 -16.666 -0.550 1.491 1.00 0.00 C ATOM 1102 C PRO A 74 -17.302 -1.290 0.319 1.00 0.00 C ATOM 1103 O PRO A 74 -16.998 -2.457 0.069 1.00 0.00 O ATOM 1104 CB PRO A 74 -15.697 0.522 0.986 1.00 0.00 C ATOM 1105 CG PRO A 74 -14.613 0.560 2.006 1.00 0.00 C ATOM 1106 CD PRO A 74 -14.470 -0.850 2.510 1.00 0.00 C ATOM 0 HA PRO A 74 -17.503 -0.150 2.063 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -15.305 0.270 0.001 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -16.189 1.490 0.895 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.679 0.915 1.570 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.865 1.241 2.819 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -13.708 -1.399 1.957 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -14.180 -0.874 3.560 1.00 0.00 H new ATOM 1114 N ASP A 75 -18.190 -0.606 -0.396 1.00 0.00 N ATOM 1115 CA ASP A 75 -18.872 -1.200 -1.540 1.00 0.00 C ATOM 1116 C ASP A 75 -17.990 -1.160 -2.785 1.00 0.00 C ATOM 1117 O ASP A 75 -18.001 -2.087 -3.594 1.00 0.00 O ATOM 1118 CB ASP A 75 -20.188 -0.470 -1.810 1.00 0.00 C ATOM 1119 CG ASP A 75 -21.052 -1.191 -2.825 1.00 0.00 C ATOM 1120 OD1 ASP A 75 -20.898 -2.423 -2.968 1.00 0.00 O ATOM 1121 OD2 ASP A 75 -21.883 -0.525 -3.479 1.00 0.00 O ATOM 0 H ASP A 75 -18.454 0.360 -0.203 1.00 0.00 H new ATOM 0 HA ASP A 75 -19.083 -2.242 -1.302 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -20.740 -0.365 -0.876 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -19.975 0.537 -2.169 1.00 0.00 H new ATOM 1126 N ASP A 76 -17.232 -0.079 -2.933 1.00 0.00 N ATOM 1127 CA ASP A 76 -16.347 0.081 -4.082 1.00 0.00 C ATOM 1128 C ASP A 76 -15.010 -0.615 -3.847 1.00 0.00 C ATOM 1129 O ASP A 76 -14.363 -1.073 -4.789 1.00 0.00 O ATOM 1130 CB ASP A 76 -16.117 1.566 -4.370 1.00 0.00 C ATOM 1131 CG ASP A 76 -17.118 2.126 -5.361 1.00 0.00 C ATOM 1132 OD1 ASP A 76 -16.839 2.078 -6.577 1.00 0.00 O ATOM 1133 OD2 ASP A 76 -18.181 2.610 -4.921 1.00 0.00 O ATOM 0 H ASP A 76 -17.212 0.699 -2.273 1.00 0.00 H new ATOM 0 HA ASP A 76 -16.828 -0.382 -4.944 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -16.180 2.128 -3.438 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -15.108 1.706 -4.759 1.00 0.00 H new ATOM 1138 N SER A 77 -14.601 -0.692 -2.585 1.00 0.00 N ATOM 1139 CA SER A 77 -13.340 -1.332 -2.227 1.00 0.00 C ATOM 1140 C SER A 77 -13.446 -2.851 -2.333 1.00 0.00 C ATOM 1141 O SER A 77 -12.450 -3.537 -2.565 1.00 0.00 O ATOM 1142 CB SER A 77 -12.928 -0.938 -0.808 1.00 0.00 C ATOM 1143 OG SER A 77 -11.897 -1.779 -0.322 1.00 0.00 O ATOM 0 H SER A 77 -15.124 -0.319 -1.793 1.00 0.00 H new ATOM 0 HA SER A 77 -12.579 -0.990 -2.929 1.00 0.00 H new ATOM 0 HB2 SER A 77 -12.590 0.098 -0.799 1.00 0.00 H new ATOM 0 HB3 SER A 77 -13.792 -0.997 -0.146 1.00 0.00 H new ATOM 0 HG SER A 77 -11.473 -1.361 0.456 1.00 0.00 H new ATOM 1149 N LYS A 78 -14.657 -3.371 -2.162 1.00 0.00 N ATOM 1150 CA LYS A 78 -14.891 -4.810 -2.238 1.00 0.00 C ATOM 1151 C LYS A 78 -14.420 -5.373 -3.576 1.00 0.00 C ATOM 1152 O LYS A 78 -14.026 -6.536 -3.666 1.00 0.00 O ATOM 1153 CB LYS A 78 -16.376 -5.117 -2.037 1.00 0.00 C ATOM 1154 CG LYS A 78 -16.774 -5.273 -0.579 1.00 0.00 C ATOM 1155 CD LYS A 78 -18.262 -5.028 -0.380 1.00 0.00 C ATOM 1156 CE LYS A 78 -18.683 -5.299 1.055 1.00 0.00 C ATOM 1157 NZ LYS A 78 -19.889 -4.514 1.439 1.00 0.00 N ATOM 0 H LYS A 78 -15.492 -2.818 -1.970 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.316 -5.287 -1.444 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -16.967 -4.317 -2.482 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -16.625 -6.033 -2.573 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -16.520 -6.276 -0.236 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -16.204 -4.573 0.032 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -18.501 -3.997 -0.642 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -18.831 -5.668 -1.054 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -18.888 -6.362 1.178 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -17.861 -5.053 1.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -20.143 -4.728 2.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -19.686 -3.498 1.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -20.681 -4.767 0.815 1.00 0.00 H new ATOM 1171 N ASP A 79 -14.465 -4.542 -4.612 1.00 0.00 N ATOM 1172 CA ASP A 79 -14.045 -4.961 -5.945 1.00 0.00 C ATOM 1173 C ASP A 79 -12.540 -5.208 -5.992 1.00 0.00 C ATOM 1174 O ASP A 79 -12.093 -6.330 -6.228 1.00 0.00 O ATOM 1175 CB ASP A 79 -14.431 -3.902 -6.980 1.00 0.00 C ATOM 1176 CG ASP A 79 -15.781 -4.177 -7.612 1.00 0.00 C ATOM 1177 OD1 ASP A 79 -16.682 -4.669 -6.900 1.00 0.00 O ATOM 1178 OD2 ASP A 79 -15.938 -3.902 -8.820 1.00 0.00 O ATOM 0 H ASP A 79 -14.787 -3.576 -4.555 1.00 0.00 H new ATOM 0 HA ASP A 79 -14.555 -5.895 -6.181 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -14.449 -2.922 -6.504 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -13.669 -3.864 -7.759 1.00 0.00 H new ATOM 1183 N THR A 80 -11.764 -4.153 -5.767 1.00 0.00 N ATOM 1184 CA THR A 80 -10.308 -4.255 -5.786 1.00 0.00 C ATOM 1185 C THR A 80 -9.815 -5.275 -4.764 1.00 0.00 C ATOM 1186 O THR A 80 -8.759 -5.882 -4.939 1.00 0.00 O ATOM 1187 CB THR A 80 -9.678 -2.890 -5.505 1.00 0.00 C ATOM 1188 OG1 THR A 80 -10.466 -1.850 -6.057 1.00 0.00 O ATOM 1189 CG2 THR A 80 -8.278 -2.751 -6.063 1.00 0.00 C ATOM 0 H THR A 80 -12.118 -3.217 -5.569 1.00 0.00 H new ATOM 0 HA THR A 80 -10.008 -4.591 -6.778 1.00 0.00 H new ATOM 0 HB THR A 80 -9.628 -2.813 -4.419 1.00 0.00 H new ATOM 0 HG1 THR A 80 -10.047 -0.985 -5.865 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.890 -1.760 -5.829 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.632 -3.508 -5.618 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.302 -2.885 -7.144 1.00 0.00 H new ATOM 1197 N TRP A 81 -10.585 -5.459 -3.695 1.00 0.00 N ATOM 1198 CA TRP A 81 -10.224 -6.405 -2.645 1.00 0.00 C ATOM 1199 C TRP A 81 -10.040 -7.809 -3.213 1.00 0.00 C ATOM 1200 O TRP A 81 -9.084 -8.506 -2.874 1.00 0.00 O ATOM 1201 CB TRP A 81 -11.295 -6.420 -1.553 1.00 0.00 C ATOM 1202 CG TRP A 81 -10.965 -7.327 -0.408 1.00 0.00 C ATOM 1203 CD1 TRP A 81 -11.498 -8.560 -0.160 1.00 0.00 C ATOM 1204 CD2 TRP A 81 -10.027 -7.075 0.645 1.00 0.00 C ATOM 1205 NE1 TRP A 81 -10.949 -9.089 0.983 1.00 0.00 N ATOM 1206 CE2 TRP A 81 -10.043 -8.196 1.496 1.00 0.00 C ATOM 1207 CE3 TRP A 81 -9.176 -6.010 0.950 1.00 0.00 C ATOM 1208 CZ2 TRP A 81 -9.242 -8.282 2.630 1.00 0.00 C ATOM 1209 CZ3 TRP A 81 -8.380 -6.095 2.077 1.00 0.00 C ATOM 1210 CH2 TRP A 81 -8.417 -7.225 2.905 1.00 0.00 C ATOM 0 H TRP A 81 -11.463 -4.965 -3.534 1.00 0.00 H new ATOM 0 HA TRP A 81 -9.277 -6.083 -2.212 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -11.433 -5.407 -1.176 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -12.244 -6.729 -1.990 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -12.242 -9.048 -0.773 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -11.178 -9.998 1.385 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -9.141 -5.136 0.317 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -9.270 -9.151 3.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -7.719 -5.277 2.323 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -7.782 -7.263 3.778 1.00 0.00 H new ATOM 1221 N LYS A 82 -10.964 -8.219 -4.077 1.00 0.00 N ATOM 1222 CA LYS A 82 -10.904 -9.540 -4.691 1.00 0.00 C ATOM 1223 C LYS A 82 -9.764 -9.625 -5.704 1.00 0.00 C ATOM 1224 O LYS A 82 -9.253 -10.708 -5.988 1.00 0.00 O ATOM 1225 CB LYS A 82 -12.236 -9.869 -5.370 1.00 0.00 C ATOM 1226 CG LYS A 82 -12.925 -11.096 -4.795 1.00 0.00 C ATOM 1227 CD LYS A 82 -14.429 -11.044 -5.011 1.00 0.00 C ATOM 1228 CE LYS A 82 -15.126 -12.241 -4.384 1.00 0.00 C ATOM 1229 NZ LYS A 82 -16.216 -11.826 -3.457 1.00 0.00 N ATOM 0 H LYS A 82 -11.763 -7.655 -4.367 1.00 0.00 H new ATOM 0 HA LYS A 82 -10.715 -10.270 -3.904 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -12.903 -9.012 -5.278 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -12.063 -10.025 -6.435 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -12.520 -11.994 -5.262 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -12.712 -11.168 -3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -14.827 -10.124 -4.582 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -14.643 -11.016 -6.079 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -15.539 -12.873 -5.170 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -14.397 -12.842 -3.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -16.666 -12.671 -3.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -15.819 -11.243 -2.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -16.925 -11.274 -3.980 1.00 0.00 H new ATOM 1243 N LYS A 83 -9.372 -8.476 -6.248 1.00 0.00 N ATOM 1244 CA LYS A 83 -8.295 -8.425 -7.230 1.00 0.00 C ATOM 1245 C LYS A 83 -6.927 -8.598 -6.571 1.00 0.00 C ATOM 1246 O LYS A 83 -5.910 -8.705 -7.258 1.00 0.00 O ATOM 1247 CB LYS A 83 -8.340 -7.099 -7.993 1.00 0.00 C ATOM 1248 CG LYS A 83 -9.679 -6.825 -8.659 1.00 0.00 C ATOM 1249 CD LYS A 83 -9.581 -6.921 -10.173 1.00 0.00 C ATOM 1250 CE LYS A 83 -9.241 -8.334 -10.621 1.00 0.00 C ATOM 1251 NZ LYS A 83 -10.461 -9.162 -10.823 1.00 0.00 N ATOM 0 H LYS A 83 -9.784 -7.570 -6.025 1.00 0.00 H new ATOM 0 HA LYS A 83 -8.441 -9.251 -7.927 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -8.113 -6.285 -7.304 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -7.559 -7.100 -8.753 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.419 -7.538 -8.296 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.029 -5.831 -8.379 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -10.527 -6.614 -10.620 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.819 -6.230 -10.534 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -8.672 -8.293 -11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -8.601 -8.807 -9.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -10.186 -10.117 -11.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -10.991 -9.223 -9.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -11.060 -8.725 -11.552 1.00 0.00 H new ATOM 1265 N ARG A 84 -6.901 -8.624 -5.240 1.00 0.00 N ATOM 1266 CA ARG A 84 -5.652 -8.784 -4.502 1.00 0.00 C ATOM 1267 C ARG A 84 -4.900 -10.031 -4.960 1.00 0.00 C ATOM 1268 O ARG A 84 -3.671 -10.036 -5.030 1.00 0.00 O ATOM 1269 CB ARG A 84 -5.930 -8.866 -3.000 1.00 0.00 C ATOM 1270 CG ARG A 84 -6.821 -10.034 -2.609 1.00 0.00 C ATOM 1271 CD ARG A 84 -6.009 -11.289 -2.328 1.00 0.00 C ATOM 1272 NE ARG A 84 -5.890 -11.556 -0.897 1.00 0.00 N ATOM 1273 CZ ARG A 84 -6.920 -11.861 -0.112 1.00 0.00 C ATOM 1274 NH1 ARG A 84 -8.147 -11.931 -0.612 1.00 0.00 N ATOM 1275 NH2 ARG A 84 -6.722 -12.093 1.178 1.00 0.00 N ATOM 0 H ARG A 84 -7.730 -8.536 -4.652 1.00 0.00 H new ATOM 0 HA ARG A 84 -5.028 -7.913 -4.704 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -4.982 -8.949 -2.468 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -6.399 -7.937 -2.674 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -7.401 -9.770 -1.725 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -7.533 -10.233 -3.410 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -6.479 -12.142 -2.818 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.014 -11.181 -2.760 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.963 -11.506 -0.475 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -8.305 -11.751 -1.603 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.932 -12.165 -0.005 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -5.781 -12.038 1.568 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -7.511 -12.327 1.781 1.00 0.00 H new ATOM 1289 N GLY A 85 -5.646 -11.086 -5.271 1.00 0.00 N ATOM 1290 CA GLY A 85 -5.032 -12.323 -5.717 1.00 0.00 C ATOM 1291 C GLY A 85 -4.630 -12.280 -7.179 1.00 0.00 C ATOM 1292 O GLY A 85 -3.755 -13.031 -7.609 1.00 0.00 O ATOM 0 H GLY A 85 -6.665 -11.106 -5.222 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.152 -12.528 -5.108 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.728 -13.147 -5.559 1.00 0.00 H new ATOM 1296 N ASN A 86 -5.270 -11.402 -7.944 1.00 0.00 N ATOM 1297 CA ASN A 86 -4.971 -11.267 -9.365 1.00 0.00 C ATOM 1298 C ASN A 86 -3.691 -10.468 -9.579 1.00 0.00 C ATOM 1299 O ASN A 86 -2.902 -10.769 -10.476 1.00 0.00 O ATOM 1300 CB ASN A 86 -6.135 -10.589 -10.090 1.00 0.00 C ATOM 1301 CG ASN A 86 -6.166 -10.916 -11.570 1.00 0.00 C ATOM 1302 OD1 ASN A 86 -6.260 -12.080 -11.958 1.00 0.00 O ATOM 1303 ND2 ASN A 86 -6.086 -9.886 -12.404 1.00 0.00 N ATOM 0 H ASN A 86 -5.998 -10.774 -7.604 1.00 0.00 H new ATOM 0 HA ASN A 86 -4.827 -12.266 -9.776 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.074 -10.900 -9.633 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -6.060 -9.509 -9.961 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -6.101 -10.043 -13.412 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.009 -8.937 -12.037 1.00 0.00 H new ATOM 1310 N VAL A 87 -3.489 -9.450 -8.749 1.00 0.00 N ATOM 1311 CA VAL A 87 -2.303 -8.608 -8.847 1.00 0.00 C ATOM 1312 C VAL A 87 -1.053 -9.368 -8.419 1.00 0.00 C ATOM 1313 O VAL A 87 -1.134 -10.505 -7.953 1.00 0.00 O ATOM 1314 CB VAL A 87 -2.442 -7.342 -7.982 1.00 0.00 C ATOM 1315 CG1 VAL A 87 -3.460 -6.389 -8.589 1.00 0.00 C ATOM 1316 CG2 VAL A 87 -2.825 -7.709 -6.556 1.00 0.00 C ATOM 0 H VAL A 87 -4.131 -9.188 -8.001 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.207 -8.316 -9.893 1.00 0.00 H new ATOM 0 HB VAL A 87 -1.478 -6.835 -7.954 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.544 -5.500 -7.964 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.137 -6.100 -9.589 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -4.430 -6.883 -8.650 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -2.919 -6.802 -5.959 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -3.777 -8.240 -6.560 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.054 -8.348 -6.125 1.00 0.00 H new ATOM 1326 N GLU A 88 0.105 -8.735 -8.581 1.00 0.00 N ATOM 1327 CA GLU A 88 1.372 -9.352 -8.211 1.00 0.00 C ATOM 1328 C GLU A 88 1.821 -8.889 -6.827 1.00 0.00 C ATOM 1329 O GLU A 88 1.661 -9.606 -5.840 1.00 0.00 O ATOM 1330 CB GLU A 88 2.446 -9.023 -9.252 1.00 0.00 C ATOM 1331 CG GLU A 88 2.923 -10.234 -10.036 1.00 0.00 C ATOM 1332 CD GLU A 88 2.372 -10.268 -11.448 1.00 0.00 C ATOM 1333 OE1 GLU A 88 2.532 -9.263 -12.174 1.00 0.00 O ATOM 1334 OE2 GLU A 88 1.777 -11.299 -11.829 1.00 0.00 O ATOM 0 H GLU A 88 0.191 -7.795 -8.966 1.00 0.00 H new ATOM 0 HA GLU A 88 1.228 -10.432 -8.180 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.051 -8.282 -9.948 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.299 -8.566 -8.750 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.012 -10.231 -10.075 1.00 0.00 H new ATOM 0 HG3 GLU A 88 2.625 -11.142 -9.512 1.00 0.00 H new ATOM 1341 N TYR A 89 2.385 -7.687 -6.764 1.00 0.00 N ATOM 1342 CA TYR A 89 2.857 -7.129 -5.502 1.00 0.00 C ATOM 1343 C TYR A 89 1.723 -6.432 -4.755 1.00 0.00 C ATOM 1344 O TYR A 89 0.642 -6.223 -5.305 1.00 0.00 O ATOM 1345 CB TYR A 89 4.000 -6.145 -5.751 1.00 0.00 C ATOM 1346 CG TYR A 89 5.337 -6.812 -5.985 1.00 0.00 C ATOM 1347 CD1 TYR A 89 5.660 -7.345 -7.227 1.00 0.00 C ATOM 1348 CD2 TYR A 89 6.275 -6.906 -4.965 1.00 0.00 C ATOM 1349 CE1 TYR A 89 6.881 -7.955 -7.444 1.00 0.00 C ATOM 1350 CE2 TYR A 89 7.499 -7.513 -5.176 1.00 0.00 C ATOM 1351 CZ TYR A 89 7.796 -8.036 -6.416 1.00 0.00 C ATOM 1352 OH TYR A 89 9.012 -8.642 -6.630 1.00 0.00 O ATOM 0 H TYR A 89 2.526 -7.081 -7.572 1.00 0.00 H new ATOM 0 HA TYR A 89 3.222 -7.950 -4.885 1.00 0.00 H new ATOM 0 HB2 TYR A 89 3.755 -5.529 -6.616 1.00 0.00 H new ATOM 0 HB3 TYR A 89 4.083 -5.475 -4.896 1.00 0.00 H new ATOM 0 HD1 TYR A 89 4.946 -7.282 -8.035 1.00 0.00 H new ATOM 0 HD2 TYR A 89 6.045 -6.498 -3.992 1.00 0.00 H new ATOM 0 HE1 TYR A 89 7.117 -8.366 -8.414 1.00 0.00 H new ATOM 0 HE2 TYR A 89 8.219 -7.577 -4.373 1.00 0.00 H new ATOM 0 HH TYR A 89 9.541 -8.615 -5.805 1.00 0.00 H new ATOM 1362 N VAL A 90 1.981 -6.075 -3.502 1.00 0.00 N ATOM 1363 CA VAL A 90 0.985 -5.399 -2.679 1.00 0.00 C ATOM 1364 C VAL A 90 1.645 -4.421 -1.713 1.00 0.00 C ATOM 1365 O VAL A 90 2.801 -4.597 -1.330 1.00 0.00 O ATOM 1366 CB VAL A 90 0.141 -6.408 -1.875 1.00 0.00 C ATOM 1367 CG1 VAL A 90 -1.010 -5.703 -1.175 1.00 0.00 C ATOM 1368 CG2 VAL A 90 -0.373 -7.515 -2.781 1.00 0.00 C ATOM 0 H VAL A 90 2.872 -6.242 -3.034 1.00 0.00 H new ATOM 0 HA VAL A 90 0.332 -4.851 -3.358 1.00 0.00 H new ATOM 0 HB VAL A 90 0.776 -6.860 -1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.595 -6.431 -0.613 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.615 -4.950 -0.493 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.647 -5.222 -1.917 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.967 -8.218 -2.196 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.992 -7.083 -3.567 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.471 -8.039 -3.230 1.00 0.00 H new ATOM 1378 N VAL A 91 0.902 -3.391 -1.322 1.00 0.00 N ATOM 1379 CA VAL A 91 1.416 -2.386 -0.400 1.00 0.00 C ATOM 1380 C VAL A 91 0.296 -1.798 0.453 1.00 0.00 C ATOM 1381 O VAL A 91 -0.877 -1.864 0.085 1.00 0.00 O ATOM 1382 CB VAL A 91 2.127 -1.245 -1.151 1.00 0.00 C ATOM 1383 CG1 VAL A 91 2.826 -0.314 -0.173 1.00 0.00 C ATOM 1384 CG2 VAL A 91 3.116 -1.808 -2.162 1.00 0.00 C ATOM 0 H VAL A 91 -0.057 -3.231 -1.629 1.00 0.00 H new ATOM 0 HA VAL A 91 2.136 -2.889 0.246 1.00 0.00 H new ATOM 0 HB VAL A 91 1.377 -0.668 -1.692 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.322 0.485 -0.723 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.092 0.116 0.508 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.566 -0.875 0.398 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.609 -0.988 -2.684 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.863 -2.410 -1.644 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.585 -2.430 -2.883 1.00 0.00 H new ATOM 1394 N LEU A 92 0.666 -1.224 1.593 1.00 0.00 N ATOM 1395 CA LEU A 92 -0.307 -0.623 2.498 1.00 0.00 C ATOM 1396 C LEU A 92 0.071 0.816 2.829 1.00 0.00 C ATOM 1397 O LEU A 92 1.088 1.325 2.357 1.00 0.00 O ATOM 1398 CB LEU A 92 -0.412 -1.445 3.785 1.00 0.00 C ATOM 1399 CG LEU A 92 -0.676 -2.938 3.581 1.00 0.00 C ATOM 1400 CD1 LEU A 92 -0.253 -3.727 4.809 1.00 0.00 C ATOM 1401 CD2 LEU A 92 -2.145 -3.180 3.269 1.00 0.00 C ATOM 0 H LEU A 92 1.633 -1.162 1.912 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.275 -0.617 1.998 1.00 0.00 H new ATOM 0 HB2 LEU A 92 0.514 -1.329 4.348 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.212 -1.031 4.398 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.083 -3.281 2.733 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.448 -4.787 4.646 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.812 -3.578 4.988 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.819 -3.383 5.675 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.316 -4.247 3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.757 -2.822 4.097 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -2.417 -2.645 2.359 1.00 0.00 H new ATOM 1413 N LEU A 93 -0.751 1.467 3.645 1.00 0.00 N ATOM 1414 CA LEU A 93 -0.502 2.848 4.040 1.00 0.00 C ATOM 1415 C LEU A 93 -0.690 3.029 5.542 1.00 0.00 C ATOM 1416 O LEU A 93 -1.063 2.092 6.248 1.00 0.00 O ATOM 1417 CB LEU A 93 -1.435 3.794 3.281 1.00 0.00 C ATOM 1418 CG LEU A 93 -1.491 3.575 1.768 1.00 0.00 C ATOM 1419 CD1 LEU A 93 -2.767 4.166 1.191 1.00 0.00 C ATOM 1420 CD2 LEU A 93 -0.268 4.182 1.098 1.00 0.00 C ATOM 0 H LEU A 93 -1.596 1.060 4.046 1.00 0.00 H new ATOM 0 HA LEU A 93 0.531 3.089 3.790 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.442 3.688 3.685 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -1.121 4.820 3.473 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.492 2.503 1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.790 4.001 0.114 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.631 3.685 1.650 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.797 5.236 1.395 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.323 4.017 0.022 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.236 5.253 1.300 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.633 3.712 1.491 1.00 0.00 H new ATOM 1432 N ASP A 94 -0.429 4.239 6.024 1.00 0.00 N ATOM 1433 CA ASP A 94 -0.568 4.544 7.444 1.00 0.00 C ATOM 1434 C ASP A 94 -0.266 6.014 7.716 1.00 0.00 C ATOM 1435 O ASP A 94 0.138 6.752 6.817 1.00 0.00 O ATOM 1436 CB ASP A 94 0.363 3.658 8.272 1.00 0.00 C ATOM 1437 CG ASP A 94 1.804 3.741 7.807 1.00 0.00 C ATOM 1438 OD1 ASP A 94 2.191 2.945 6.926 1.00 0.00 O ATOM 1439 OD2 ASP A 94 2.547 4.602 8.325 1.00 0.00 O ATOM 0 H ASP A 94 -0.120 5.025 5.452 1.00 0.00 H new ATOM 0 HA ASP A 94 -1.600 4.344 7.734 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.304 3.953 9.320 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.024 2.624 8.213 1.00 0.00 H new ATOM 1444 N TRP A 95 -0.466 6.433 8.961 1.00 0.00 N ATOM 1445 CA TRP A 95 -0.213 7.816 9.351 1.00 0.00 C ATOM 1446 C TRP A 95 1.143 7.948 10.036 1.00 0.00 C ATOM 1447 O TRP A 95 1.925 8.844 9.717 1.00 0.00 O ATOM 1448 CB TRP A 95 -1.320 8.314 10.283 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.499 8.881 9.555 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -3.773 8.389 9.548 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -2.515 10.048 8.725 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -4.580 9.179 8.765 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -3.831 10.204 8.249 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.544 10.977 8.339 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -4.199 11.250 7.408 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -1.912 12.015 7.503 1.00 0.00 C ATOM 1457 CH2 TRP A 95 -3.229 12.145 7.046 1.00 0.00 C ATOM 0 H TRP A 95 -0.802 5.836 9.717 1.00 0.00 H new ATOM 0 HA TRP A 95 -0.204 8.427 8.449 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -1.653 7.489 10.913 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -0.911 9.076 10.946 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -4.099 7.508 10.080 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -5.574 9.027 8.596 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.526 10.886 8.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -5.214 11.352 7.054 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.171 12.738 7.197 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.485 12.968 6.395 1.00 0.00 H new ATOM 1468 N PHE A 96 1.414 7.051 10.978 1.00 0.00 N ATOM 1469 CA PHE A 96 2.676 7.067 11.708 1.00 0.00 C ATOM 1470 C PHE A 96 3.024 5.673 12.223 1.00 0.00 C ATOM 1471 O PHE A 96 3.181 5.463 13.425 1.00 0.00 O ATOM 1472 CB PHE A 96 2.600 8.053 12.877 1.00 0.00 C ATOM 1473 CG PHE A 96 2.657 9.494 12.451 1.00 0.00 C ATOM 1474 CD1 PHE A 96 3.632 9.931 11.570 1.00 0.00 C ATOM 1475 CD2 PHE A 96 1.735 10.407 12.934 1.00 0.00 C ATOM 1476 CE1 PHE A 96 3.687 11.255 11.177 1.00 0.00 C ATOM 1477 CE2 PHE A 96 1.785 11.733 12.545 1.00 0.00 C ATOM 1478 CZ PHE A 96 2.761 12.157 11.666 1.00 0.00 C ATOM 0 H PHE A 96 0.777 6.304 11.254 1.00 0.00 H new ATOM 0 HA PHE A 96 3.461 7.387 11.023 1.00 0.00 H new ATOM 0 HB2 PHE A 96 1.675 7.881 13.427 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.422 7.853 13.565 1.00 0.00 H new ATOM 0 HD1 PHE A 96 4.358 9.229 11.186 1.00 0.00 H new ATOM 0 HD2 PHE A 96 0.969 10.080 13.622 1.00 0.00 H new ATOM 0 HE1 PHE A 96 4.452 11.584 10.489 1.00 0.00 H new ATOM 0 HE2 PHE A 96 1.061 12.436 12.929 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.801 13.192 11.361 1.00 0.00 H new ATOM 1488 N SER A 97 3.141 4.722 11.302 1.00 0.00 N ATOM 1489 CA SER A 97 3.470 3.348 11.662 1.00 0.00 C ATOM 1490 C SER A 97 4.156 2.631 10.504 1.00 0.00 C ATOM 1491 O SER A 97 3.510 2.239 9.532 1.00 0.00 O ATOM 1492 CB SER A 97 2.205 2.589 12.067 1.00 0.00 C ATOM 1493 OG SER A 97 2.450 1.195 12.147 1.00 0.00 O ATOM 0 H SER A 97 3.013 4.878 10.302 1.00 0.00 H new ATOM 0 HA SER A 97 4.157 3.375 12.508 1.00 0.00 H new ATOM 0 HB2 SER A 97 1.850 2.955 13.031 1.00 0.00 H new ATOM 0 HB3 SER A 97 1.414 2.781 11.342 1.00 0.00 H new ATOM 0 HG SER A 97 1.627 0.733 12.409 1.00 0.00 H new ATOM 1499 N SER A 98 5.470 2.462 10.614 1.00 0.00 N ATOM 1500 CA SER A 98 6.245 1.791 9.576 1.00 0.00 C ATOM 1501 C SER A 98 6.431 0.314 9.906 1.00 0.00 C ATOM 1502 O SER A 98 6.024 -0.151 10.970 1.00 0.00 O ATOM 1503 CB SER A 98 7.608 2.465 9.412 1.00 0.00 C ATOM 1504 OG SER A 98 7.533 3.847 9.716 1.00 0.00 O ATOM 0 H SER A 98 6.020 2.780 11.411 1.00 0.00 H new ATOM 0 HA SER A 98 5.694 1.869 8.638 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.336 1.985 10.066 1.00 0.00 H new ATOM 0 HB3 SER A 98 7.962 2.333 8.390 1.00 0.00 H new ATOM 0 HG SER A 98 8.417 4.255 9.605 1.00 0.00 H new ATOM 1510 N ALA A 99 7.048 -0.420 8.985 1.00 0.00 N ATOM 1511 CA ALA A 99 7.288 -1.845 9.177 1.00 0.00 C ATOM 1512 C ALA A 99 8.117 -2.102 10.433 1.00 0.00 C ATOM 1513 O ALA A 99 8.037 -3.175 11.032 1.00 0.00 O ATOM 1514 CB ALA A 99 7.981 -2.432 7.958 1.00 0.00 C ATOM 0 H ALA A 99 7.391 -0.051 8.098 1.00 0.00 H new ATOM 0 HA ALA A 99 6.323 -2.335 9.305 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.154 -3.497 8.115 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.351 -2.293 7.079 1.00 0.00 H new ATOM 0 HB3 ALA A 99 8.935 -1.928 7.804 1.00 0.00 H new ATOM 1520 N LYS A 100 8.911 -1.112 10.828 1.00 0.00 N ATOM 1521 CA LYS A 100 9.752 -1.233 12.013 1.00 0.00 C ATOM 1522 C LYS A 100 8.957 -0.939 13.280 1.00 0.00 C ATOM 1523 O LYS A 100 9.284 -1.431 14.360 1.00 0.00 O ATOM 1524 CB LYS A 100 10.947 -0.283 11.916 1.00 0.00 C ATOM 1525 CG LYS A 100 11.909 -0.628 10.790 1.00 0.00 C ATOM 1526 CD LYS A 100 11.619 0.188 9.541 1.00 0.00 C ATOM 1527 CE LYS A 100 11.795 -0.644 8.281 1.00 0.00 C ATOM 1528 NZ LYS A 100 11.044 -1.928 8.353 1.00 0.00 N ATOM 0 H LYS A 100 8.990 -0.217 10.345 1.00 0.00 H new ATOM 0 HA LYS A 100 10.115 -2.260 12.064 1.00 0.00 H new ATOM 0 HB2 LYS A 100 10.581 0.734 11.772 1.00 0.00 H new ATOM 0 HB3 LYS A 100 11.488 -0.296 12.862 1.00 0.00 H new ATOM 0 HG2 LYS A 100 12.933 -0.445 11.116 1.00 0.00 H new ATOM 0 HG3 LYS A 100 11.833 -1.690 10.558 1.00 0.00 H new ATOM 0 HD2 LYS A 100 10.600 0.573 9.585 1.00 0.00 H new ATOM 0 HD3 LYS A 100 12.285 1.050 9.505 1.00 0.00 H new ATOM 0 HE2 LYS A 100 11.454 -0.072 7.418 1.00 0.00 H new ATOM 0 HE3 LYS A 100 12.854 -0.851 8.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 10.756 -2.216 7.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 11.652 -2.663 8.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 10.199 -1.803 8.946 1.00 0.00 H new ATOM 1542 N ASP A 101 7.909 -0.130 13.142 1.00 0.00 N ATOM 1543 CA ASP A 101 7.068 0.231 14.278 1.00 0.00 C ATOM 1544 C ASP A 101 5.847 -0.681 14.375 1.00 0.00 C ATOM 1545 O ASP A 101 4.852 -0.332 15.010 1.00 0.00 O ATOM 1546 CB ASP A 101 6.620 1.689 14.159 1.00 0.00 C ATOM 1547 CG ASP A 101 7.732 2.665 14.493 1.00 0.00 C ATOM 1548 OD1 ASP A 101 8.714 2.731 13.724 1.00 0.00 O ATOM 1549 OD2 ASP A 101 7.620 3.362 15.523 1.00 0.00 O ATOM 0 H ASP A 101 7.623 0.287 12.256 1.00 0.00 H new ATOM 0 HA ASP A 101 7.659 0.107 15.186 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.268 1.876 13.144 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.776 1.862 14.826 1.00 0.00 H new ATOM 1554 N LEU A 102 5.927 -1.850 13.747 1.00 0.00 N ATOM 1555 CA LEU A 102 4.825 -2.805 13.769 1.00 0.00 C ATOM 1556 C LEU A 102 4.889 -3.680 15.016 1.00 0.00 C ATOM 1557 O LEU A 102 5.969 -4.083 15.450 1.00 0.00 O ATOM 1558 CB LEU A 102 4.855 -3.681 12.515 1.00 0.00 C ATOM 1559 CG LEU A 102 4.392 -2.991 11.231 1.00 0.00 C ATOM 1560 CD1 LEU A 102 4.435 -3.959 10.060 1.00 0.00 C ATOM 1561 CD2 LEU A 102 2.991 -2.425 11.408 1.00 0.00 C ATOM 0 H LEU A 102 6.742 -2.158 13.217 1.00 0.00 H new ATOM 0 HA LEU A 102 3.891 -2.243 13.788 1.00 0.00 H new ATOM 0 HB2 LEU A 102 5.872 -4.043 12.368 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.227 -4.555 12.686 1.00 0.00 H new ATOM 0 HG LEU A 102 5.072 -2.166 11.017 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.102 -3.450 9.155 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.455 -4.317 9.921 1.00 0.00 H new ATOM 0 HD13 LEU A 102 3.778 -4.805 10.263 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.676 -1.937 10.485 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.299 -3.233 11.645 1.00 0.00 H new ATOM 0 HD23 LEU A 102 2.992 -1.698 12.220 1.00 0.00 H new ATOM 1573 N GLN A 103 3.725 -3.973 15.589 1.00 0.00 N ATOM 1574 CA GLN A 103 3.649 -4.800 16.787 1.00 0.00 C ATOM 1575 C GLN A 103 2.452 -5.743 16.723 1.00 0.00 C ATOM 1576 O GLN A 103 1.622 -5.648 15.818 1.00 0.00 O ATOM 1577 CB GLN A 103 3.555 -3.923 18.035 1.00 0.00 C ATOM 1578 CG GLN A 103 4.687 -2.915 18.157 1.00 0.00 C ATOM 1579 CD GLN A 103 4.950 -2.506 19.593 1.00 0.00 C ATOM 1580 OE1 GLN A 103 4.328 -3.021 20.522 1.00 0.00 O ATOM 1581 NE2 GLN A 103 5.877 -1.574 19.782 1.00 0.00 N ATOM 0 H GLN A 103 2.822 -3.649 15.242 1.00 0.00 H new ATOM 0 HA GLN A 103 4.558 -5.399 16.841 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.604 -3.390 18.023 1.00 0.00 H new ATOM 0 HB3 GLN A 103 3.551 -4.562 18.918 1.00 0.00 H new ATOM 0 HG2 GLN A 103 5.596 -3.341 17.732 1.00 0.00 H new ATOM 0 HG3 GLN A 103 4.445 -2.030 17.569 1.00 0.00 H new ATOM 0 HE21 GLN A 103 6.368 -1.174 18.983 1.00 0.00 H new ATOM 0 HE22 GLN A 103 6.098 -1.258 20.726 1.00 0.00 H new ATOM 1590 N ILE A 104 2.368 -6.651 17.689 1.00 0.00 N ATOM 1591 CA ILE A 104 1.271 -7.611 17.743 1.00 0.00 C ATOM 1592 C ILE A 104 -0.030 -6.935 18.159 1.00 0.00 C ATOM 1593 O ILE A 104 -0.381 -6.914 19.340 1.00 0.00 O ATOM 1594 CB ILE A 104 1.576 -8.759 18.725 1.00 0.00 C ATOM 1595 CG1 ILE A 104 2.047 -8.201 20.068 1.00 0.00 C ATOM 1596 CG2 ILE A 104 2.622 -9.695 18.137 1.00 0.00 C ATOM 1597 CD1 ILE A 104 1.567 -9.003 21.258 1.00 0.00 C ATOM 0 H ILE A 104 3.046 -6.743 18.445 1.00 0.00 H new ATOM 0 HA ILE A 104 1.160 -8.021 16.739 1.00 0.00 H new ATOM 0 HB ILE A 104 0.661 -9.327 18.891 1.00 0.00 H new ATOM 0 HG12 ILE A 104 3.137 -8.169 20.077 1.00 0.00 H new ATOM 0 HG13 ILE A 104 1.698 -7.173 20.168 1.00 0.00 H new ATOM 0 HG21 ILE A 104 2.827 -10.501 18.842 1.00 0.00 H new ATOM 0 HG22 ILE A 104 2.250 -10.116 17.203 1.00 0.00 H new ATOM 0 HG23 ILE A 104 3.540 -9.140 17.944 1.00 0.00 H new ATOM 0 HD11 ILE A 104 1.939 -8.549 22.177 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.477 -9.013 21.274 1.00 0.00 H new ATOM 0 HD13 ILE A 104 1.939 -10.025 21.182 1.00 0.00 H new ATOM 1609 N GLY A 105 -0.743 -6.383 17.183 1.00 0.00 N ATOM 1610 CA GLY A 105 -1.999 -5.713 17.470 1.00 0.00 C ATOM 1611 C GLY A 105 -2.301 -4.594 16.492 1.00 0.00 C ATOM 1612 O GLY A 105 -3.460 -4.224 16.304 1.00 0.00 O ATOM 0 H GLY A 105 -0.474 -6.387 16.199 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -2.809 -6.442 17.444 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.967 -5.308 18.481 1.00 0.00 H new ATOM 1616 N THR A 106 -1.258 -4.054 15.869 1.00 0.00 N ATOM 1617 CA THR A 106 -1.422 -2.971 14.907 1.00 0.00 C ATOM 1618 C THR A 106 -2.244 -3.427 13.706 1.00 0.00 C ATOM 1619 O THR A 106 -2.205 -4.597 13.323 1.00 0.00 O ATOM 1620 CB THR A 106 -0.056 -2.464 14.442 1.00 0.00 C ATOM 1621 OG1 THR A 106 0.914 -3.494 14.520 1.00 0.00 O ATOM 1622 CG2 THR A 106 0.454 -1.291 15.250 1.00 0.00 C ATOM 0 H THR A 106 -0.292 -4.348 16.013 1.00 0.00 H new ATOM 0 HA THR A 106 -1.956 -2.159 15.401 1.00 0.00 H new ATOM 0 HB THR A 106 -0.204 -2.138 13.413 1.00 0.00 H new ATOM 0 HG1 THR A 106 1.594 -3.356 13.828 1.00 0.00 H new ATOM 0 HG21 THR A 106 1.427 -0.981 14.868 1.00 0.00 H new ATOM 0 HG22 THR A 106 -0.248 -0.461 15.170 1.00 0.00 H new ATOM 0 HG23 THR A 106 0.552 -1.584 16.295 1.00 0.00 H new ATOM 1630 N THR A 107 -2.989 -2.497 13.117 1.00 0.00 N ATOM 1631 CA THR A 107 -3.822 -2.804 11.960 1.00 0.00 C ATOM 1632 C THR A 107 -2.976 -3.332 10.806 1.00 0.00 C ATOM 1633 O THR A 107 -3.362 -4.281 10.124 1.00 0.00 O ATOM 1634 CB THR A 107 -4.590 -1.559 11.515 1.00 0.00 C ATOM 1635 OG1 THR A 107 -4.761 -0.662 12.597 1.00 0.00 O ATOM 1636 CG2 THR A 107 -5.962 -1.871 10.956 1.00 0.00 C ATOM 0 H THR A 107 -3.033 -1.525 13.422 1.00 0.00 H new ATOM 0 HA THR A 107 -4.533 -3.578 12.250 1.00 0.00 H new ATOM 0 HB THR A 107 -3.986 -1.114 10.725 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.480 0.237 12.325 1.00 0.00 H new ATOM 0 HG21 THR A 107 -6.453 -0.944 10.659 1.00 0.00 H new ATOM 0 HG22 THR A 107 -5.862 -2.523 10.088 1.00 0.00 H new ATOM 0 HG23 THR A 107 -6.560 -2.371 11.718 1.00 0.00 H new ATOM 1644 N LEU A 108 -1.819 -2.712 10.595 1.00 0.00 N ATOM 1645 CA LEU A 108 -0.917 -3.120 9.524 1.00 0.00 C ATOM 1646 C LEU A 108 -0.431 -4.550 9.738 1.00 0.00 C ATOM 1647 O LEU A 108 -0.404 -5.353 8.805 1.00 0.00 O ATOM 1648 CB LEU A 108 0.278 -2.169 9.446 1.00 0.00 C ATOM 1649 CG LEU A 108 -0.006 -0.827 8.766 1.00 0.00 C ATOM 1650 CD1 LEU A 108 0.808 0.283 9.413 1.00 0.00 C ATOM 1651 CD2 LEU A 108 0.295 -0.912 7.278 1.00 0.00 C ATOM 0 H LEU A 108 -1.484 -1.925 11.151 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.467 -3.079 8.584 1.00 0.00 H new ATOM 0 HB2 LEU A 108 0.638 -1.978 10.457 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.085 -2.667 8.909 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.063 -0.594 8.892 1.00 0.00 H new ATOM 0 HD11 LEU A 108 0.593 1.229 8.916 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.545 0.359 10.468 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.870 0.057 9.319 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.088 0.050 6.809 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.345 -1.168 7.133 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -0.331 -1.679 6.823 1.00 0.00 H new ATOM 1663 N ARG A 109 -0.046 -4.860 10.971 1.00 0.00 N ATOM 1664 CA ARG A 109 0.439 -6.193 11.308 1.00 0.00 C ATOM 1665 C ARG A 109 -0.655 -7.238 11.111 1.00 0.00 C ATOM 1666 O ARG A 109 -0.463 -8.226 10.401 1.00 0.00 O ATOM 1667 CB ARG A 109 0.941 -6.226 12.754 1.00 0.00 C ATOM 1668 CG ARG A 109 2.456 -6.302 12.870 1.00 0.00 C ATOM 1669 CD ARG A 109 2.924 -7.715 13.176 1.00 0.00 C ATOM 1670 NE ARG A 109 3.934 -8.176 12.226 1.00 0.00 N ATOM 1671 CZ ARG A 109 3.653 -8.625 11.005 1.00 0.00 C ATOM 1672 NH1 ARG A 109 2.396 -8.677 10.582 1.00 0.00 N ATOM 1673 NH2 ARG A 109 4.632 -9.025 10.205 1.00 0.00 N ATOM 0 H ARG A 109 -0.060 -4.206 11.754 1.00 0.00 H new ATOM 0 HA ARG A 109 1.266 -6.431 10.639 1.00 0.00 H new ATOM 0 HB2 ARG A 109 0.589 -5.334 13.273 1.00 0.00 H new ATOM 0 HB3 ARG A 109 0.502 -7.084 13.263 1.00 0.00 H new ATOM 0 HG2 ARG A 109 2.910 -5.961 11.940 1.00 0.00 H new ATOM 0 HG3 ARG A 109 2.795 -5.628 13.656 1.00 0.00 H new ATOM 0 HD2 ARG A 109 3.333 -7.750 14.186 1.00 0.00 H new ATOM 0 HD3 ARG A 109 2.070 -8.392 13.154 1.00 0.00 H new ATOM 0 HE ARG A 109 4.912 -8.152 12.516 1.00 0.00 H new ATOM 0 HH11 ARG A 109 1.639 -8.372 11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 109 2.187 -9.022 9.645 1.00 0.00 H new ATOM 0 HH21 ARG A 109 5.600 -8.988 10.526 1.00 0.00 H new ATOM 0 HH22 ARG A 109 4.417 -9.369 9.269 1.00 0.00 H new ATOM 1687 N SER A 110 -1.802 -7.013 11.742 1.00 0.00 N ATOM 1688 CA SER A 110 -2.927 -7.934 11.635 1.00 0.00 C ATOM 1689 C SER A 110 -3.382 -8.072 10.185 1.00 0.00 C ATOM 1690 O SER A 110 -3.845 -9.133 9.767 1.00 0.00 O ATOM 1691 CB SER A 110 -4.091 -7.454 12.504 1.00 0.00 C ATOM 1692 OG SER A 110 -4.573 -6.198 12.060 1.00 0.00 O ATOM 0 H SER A 110 -1.977 -6.200 12.333 1.00 0.00 H new ATOM 0 HA SER A 110 -2.599 -8.912 11.988 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.897 -8.187 12.476 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.767 -7.377 13.542 1.00 0.00 H new ATOM 0 HG SER A 110 -3.903 -5.776 11.482 1.00 0.00 H new ATOM 1698 N LEU A 111 -3.249 -6.991 9.423 1.00 0.00 N ATOM 1699 CA LEU A 111 -3.648 -6.990 8.021 1.00 0.00 C ATOM 1700 C LEU A 111 -2.559 -7.603 7.145 1.00 0.00 C ATOM 1701 O LEU A 111 -2.846 -8.205 6.110 1.00 0.00 O ATOM 1702 CB LEU A 111 -3.950 -5.564 7.554 1.00 0.00 C ATOM 1703 CG LEU A 111 -4.334 -5.432 6.080 1.00 0.00 C ATOM 1704 CD1 LEU A 111 -5.650 -6.144 5.806 1.00 0.00 C ATOM 1705 CD2 LEU A 111 -4.424 -3.967 5.683 1.00 0.00 C ATOM 0 H LEU A 111 -2.868 -6.104 9.753 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.550 -7.594 7.927 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.761 -5.163 8.162 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.074 -4.943 7.742 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.558 -5.904 5.477 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.908 -6.040 4.752 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.550 -7.201 6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.437 -5.702 6.417 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.698 -3.891 4.631 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -5.180 -3.471 6.292 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.458 -3.487 5.842 1.00 0.00 H new ATOM 1717 N LYS A 112 -1.308 -7.446 7.566 1.00 0.00 N ATOM 1718 CA LYS A 112 -0.177 -7.984 6.819 1.00 0.00 C ATOM 1719 C LYS A 112 -0.085 -9.499 6.985 1.00 0.00 C ATOM 1720 O LYS A 112 0.397 -10.201 6.096 1.00 0.00 O ATOM 1721 CB LYS A 112 1.126 -7.329 7.284 1.00 0.00 C ATOM 1722 CG LYS A 112 2.354 -7.820 6.536 1.00 0.00 C ATOM 1723 CD LYS A 112 3.517 -6.852 6.680 1.00 0.00 C ATOM 1724 CE LYS A 112 4.841 -7.588 6.820 1.00 0.00 C ATOM 1725 NZ LYS A 112 5.990 -6.649 6.930 1.00 0.00 N ATOM 0 H LYS A 112 -1.052 -6.951 8.420 1.00 0.00 H new ATOM 0 HA LYS A 112 -0.332 -7.761 5.763 1.00 0.00 H new ATOM 0 HB2 LYS A 112 1.044 -6.249 7.162 1.00 0.00 H new ATOM 0 HB3 LYS A 112 1.259 -7.520 8.349 1.00 0.00 H new ATOM 0 HG2 LYS A 112 2.645 -8.799 6.915 1.00 0.00 H new ATOM 0 HG3 LYS A 112 2.112 -7.946 5.481 1.00 0.00 H new ATOM 0 HD2 LYS A 112 3.555 -6.195 5.811 1.00 0.00 H new ATOM 0 HD3 LYS A 112 3.358 -6.218 7.552 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.809 -8.227 7.702 1.00 0.00 H new ATOM 0 HE3 LYS A 112 4.986 -8.240 5.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.873 -7.190 7.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 6.036 -6.056 6.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 5.865 -6.044 7.766 1.00 0.00 H new ATOM 1739 N ASP A 113 -0.548 -9.994 8.127 1.00 0.00 N ATOM 1740 CA ASP A 113 -0.515 -11.425 8.408 1.00 0.00 C ATOM 1741 C ASP A 113 -1.828 -12.097 8.008 1.00 0.00 C ATOM 1742 O ASP A 113 -1.878 -13.311 7.813 1.00 0.00 O ATOM 1743 CB ASP A 113 -0.239 -11.668 9.893 1.00 0.00 C ATOM 1744 CG ASP A 113 -1.270 -11.008 10.788 1.00 0.00 C ATOM 1745 OD1 ASP A 113 -2.480 -11.201 10.542 1.00 0.00 O ATOM 1746 OD2 ASP A 113 -0.868 -10.299 11.734 1.00 0.00 O ATOM 0 H ASP A 113 -0.950 -9.426 8.873 1.00 0.00 H new ATOM 0 HA ASP A 113 0.289 -11.863 7.816 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -0.227 -12.741 10.087 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.752 -11.288 10.143 1.00 0.00 H new ATOM 1751 N ALA A 114 -2.889 -11.304 7.887 1.00 0.00 N ATOM 1752 CA ALA A 114 -4.196 -11.831 7.511 1.00 0.00 C ATOM 1753 C ALA A 114 -4.383 -11.844 5.995 1.00 0.00 C ATOM 1754 O ALA A 114 -5.496 -12.038 5.503 1.00 0.00 O ATOM 1755 CB ALA A 114 -5.299 -11.017 8.171 1.00 0.00 C ATOM 0 H ALA A 114 -2.869 -10.296 8.044 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.253 -12.862 7.860 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -6.270 -11.420 7.883 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.191 -11.069 9.254 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.227 -9.978 7.849 1.00 0.00 H new ATOM 1761 N LEU A 115 -3.295 -11.638 5.257 1.00 0.00 N ATOM 1762 CA LEU A 115 -3.354 -11.628 3.799 1.00 0.00 C ATOM 1763 C LEU A 115 -2.543 -12.777 3.204 1.00 0.00 C ATOM 1764 O LEU A 115 -2.803 -13.213 2.082 1.00 0.00 O ATOM 1765 CB LEU A 115 -2.839 -10.293 3.258 1.00 0.00 C ATOM 1766 CG LEU A 115 -3.787 -9.108 3.449 1.00 0.00 C ATOM 1767 CD1 LEU A 115 -3.074 -7.800 3.143 1.00 0.00 C ATOM 1768 CD2 LEU A 115 -5.018 -9.264 2.569 1.00 0.00 C ATOM 0 H LEU A 115 -2.365 -11.476 5.644 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.396 -11.758 3.506 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -1.891 -10.063 3.745 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -2.632 -10.405 2.194 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.109 -9.088 4.490 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.764 -6.968 3.284 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -2.223 -7.684 3.814 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -2.723 -7.810 2.111 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -5.682 -8.412 2.717 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.714 -9.309 1.523 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -5.541 -10.182 2.835 1.00 0.00 H new ATOM 1780 N PHE A 116 -1.559 -13.263 3.956 1.00 0.00 N ATOM 1781 CA PHE A 116 -0.715 -14.358 3.490 1.00 0.00 C ATOM 1782 C PHE A 116 -0.593 -15.447 4.553 1.00 0.00 C ATOM 1783 O PHE A 116 -0.850 -16.620 4.283 1.00 0.00 O ATOM 1784 CB PHE A 116 0.674 -13.836 3.118 1.00 0.00 C ATOM 1785 CG PHE A 116 1.363 -14.660 2.069 1.00 0.00 C ATOM 1786 CD1 PHE A 116 1.706 -15.979 2.319 1.00 0.00 C ATOM 1787 CD2 PHE A 116 1.670 -14.115 0.832 1.00 0.00 C ATOM 1788 CE1 PHE A 116 2.341 -16.740 1.356 1.00 0.00 C ATOM 1789 CE2 PHE A 116 2.304 -14.871 -0.136 1.00 0.00 C ATOM 1790 CZ PHE A 116 2.640 -16.185 0.127 1.00 0.00 C ATOM 0 H PHE A 116 -1.327 -12.917 4.887 1.00 0.00 H new ATOM 0 HA PHE A 116 -1.183 -14.791 2.606 1.00 0.00 H new ATOM 0 HB2 PHE A 116 0.584 -12.810 2.761 1.00 0.00 H new ATOM 0 HB3 PHE A 116 1.295 -13.809 4.013 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.474 -16.418 3.278 1.00 0.00 H new ATOM 0 HD2 PHE A 116 1.411 -13.088 0.622 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.603 -17.767 1.564 1.00 0.00 H new ATOM 0 HE2 PHE A 116 2.536 -14.435 -1.096 1.00 0.00 H new ATOM 0 HZ PHE A 116 3.136 -16.778 -0.628 1.00 0.00 H new ATOM 1800 N LYS A 117 -0.195 -15.052 5.758 1.00 0.00 N ATOM 1801 CA LYS A 117 -0.035 -15.998 6.859 1.00 0.00 C ATOM 1802 C LYS A 117 -1.336 -16.745 7.134 1.00 0.00 C ATOM 1803 O LYS A 117 -1.332 -17.955 7.363 1.00 0.00 O ATOM 1804 CB LYS A 117 0.425 -15.269 8.122 1.00 0.00 C ATOM 1805 CG LYS A 117 1.104 -16.177 9.137 1.00 0.00 C ATOM 1806 CD LYS A 117 0.309 -16.264 10.430 1.00 0.00 C ATOM 1807 CE LYS A 117 0.548 -17.585 11.143 1.00 0.00 C ATOM 1808 NZ LYS A 117 -0.129 -18.719 10.456 1.00 0.00 N ATOM 0 H LYS A 117 0.023 -14.085 5.998 1.00 0.00 H new ATOM 0 HA LYS A 117 0.723 -16.725 6.570 1.00 0.00 H new ATOM 0 HB2 LYS A 117 1.114 -14.473 7.841 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -0.437 -14.794 8.591 1.00 0.00 H new ATOM 0 HG2 LYS A 117 1.221 -17.174 8.713 1.00 0.00 H new ATOM 0 HG3 LYS A 117 2.105 -15.802 9.349 1.00 0.00 H new ATOM 0 HD2 LYS A 117 0.588 -15.440 11.086 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -0.753 -16.153 10.213 1.00 0.00 H new ATOM 0 HE2 LYS A 117 1.619 -17.780 11.196 1.00 0.00 H new ATOM 0 HE3 LYS A 117 0.186 -17.514 12.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 0.440 -19.582 10.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -1.069 -18.867 10.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -0.231 -18.501 9.444 1.00 0.00 H new ATOM 1822 N TRP A 118 -2.448 -16.019 7.112 1.00 0.00 N ATOM 1823 CA TRP A 118 -3.755 -16.615 7.362 1.00 0.00 C ATOM 1824 C TRP A 118 -4.527 -16.800 6.058 1.00 0.00 C ATOM 1825 O TRP A 118 -5.695 -16.423 5.956 1.00 0.00 O ATOM 1826 CB TRP A 118 -4.560 -15.744 8.329 1.00 0.00 C ATOM 1827 CG TRP A 118 -3.873 -15.529 9.644 1.00 0.00 C ATOM 1828 CD1 TRP A 118 -3.466 -14.338 10.169 1.00 0.00 C ATOM 1829 CD2 TRP A 118 -3.515 -16.534 10.599 1.00 0.00 C ATOM 1830 NE1 TRP A 118 -2.874 -14.540 11.393 1.00 0.00 N ATOM 1831 CE2 TRP A 118 -2.893 -15.880 11.679 1.00 0.00 C ATOM 1832 CE3 TRP A 118 -3.660 -17.924 10.646 1.00 0.00 C ATOM 1833 CZ2 TRP A 118 -2.417 -16.568 12.792 1.00 0.00 C ATOM 1834 CZ3 TRP A 118 -3.188 -18.605 11.752 1.00 0.00 C ATOM 1835 CH2 TRP A 118 -2.573 -17.927 12.811 1.00 0.00 C ATOM 0 H TRP A 118 -2.471 -15.017 6.924 1.00 0.00 H new ATOM 0 HA TRP A 118 -3.600 -17.595 7.813 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -4.750 -14.777 7.864 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -5.530 -16.209 8.505 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -3.591 -13.377 9.693 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -2.484 -13.811 11.991 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -4.132 -18.456 9.833 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -1.942 -16.048 13.611 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -3.295 -19.679 11.800 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -2.214 -18.489 13.661 1.00 0.00 H new ATOM 1924 N LEU A 124 -0.948 -14.752 -2.731 1.00 0.00 N ATOM 1925 CA LEU A 124 -0.156 -13.778 -3.473 1.00 0.00 C ATOM 1926 C LEU A 124 1.211 -14.351 -3.832 1.00 0.00 C ATOM 1927 O LEU A 124 1.531 -15.486 -3.478 1.00 0.00 O ATOM 1928 CB LEU A 124 0.015 -12.498 -2.653 1.00 0.00 C ATOM 1929 CG LEU A 124 -1.264 -11.977 -1.994 1.00 0.00 C ATOM 1930 CD1 LEU A 124 -0.961 -11.399 -0.620 1.00 0.00 C ATOM 1931 CD2 LEU A 124 -1.931 -10.932 -2.877 1.00 0.00 C ATOM 0 HA LEU A 124 -0.686 -13.542 -4.396 1.00 0.00 H new ATOM 0 HB2 LEU A 124 0.758 -12.678 -1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 124 0.415 -11.719 -3.302 1.00 0.00 H new ATOM 0 HG LEU A 124 -1.952 -12.814 -1.870 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -1.883 -11.034 -0.168 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.528 -12.173 0.013 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.255 -10.575 -0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.839 -10.572 -2.393 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.248 -10.097 -3.032 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.185 -11.377 -3.839 1.00 0.00 H new ATOM 1943 N ARG A 125 2.012 -13.561 -4.539 1.00 0.00 N ATOM 1944 CA ARG A 125 3.345 -13.993 -4.945 1.00 0.00 C ATOM 1945 C ARG A 125 4.381 -13.627 -3.889 1.00 0.00 C ATOM 1946 O ARG A 125 5.352 -14.353 -3.678 1.00 0.00 O ATOM 1947 CB ARG A 125 3.718 -13.366 -6.292 1.00 0.00 C ATOM 1948 CG ARG A 125 3.938 -11.862 -6.237 1.00 0.00 C ATOM 1949 CD ARG A 125 4.759 -11.377 -7.420 1.00 0.00 C ATOM 1950 NE ARG A 125 6.062 -12.035 -7.487 1.00 0.00 N ATOM 1951 CZ ARG A 125 6.971 -11.788 -8.427 1.00 0.00 C ATOM 1952 NH1 ARG A 125 6.725 -10.899 -9.380 1.00 0.00 N ATOM 1953 NH2 ARG A 125 8.131 -12.432 -8.413 1.00 0.00 N ATOM 0 H ARG A 125 1.762 -12.620 -4.842 1.00 0.00 H new ATOM 0 HA ARG A 125 3.334 -15.078 -5.050 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.626 -13.842 -6.663 1.00 0.00 H new ATOM 0 HB3 ARG A 125 2.928 -13.581 -7.012 1.00 0.00 H new ATOM 0 HG2 ARG A 125 2.975 -11.352 -6.228 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.446 -11.601 -5.309 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.210 -11.564 -8.343 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.900 -10.299 -7.346 1.00 0.00 H new ATOM 0 HE ARG A 125 6.288 -12.725 -6.771 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.835 -10.400 -9.395 1.00 0.00 H new ATOM 0 HH12 ARG A 125 7.426 -10.714 -10.098 1.00 0.00 H new ATOM 0 HH21 ARG A 125 8.326 -13.116 -7.682 1.00 0.00 H new ATOM 0 HH22 ARG A 125 8.828 -12.243 -9.133 1.00 0.00 H new ATOM 1967 N ASN A 126 4.167 -12.494 -3.229 1.00 0.00 N ATOM 1968 CA ASN A 126 5.080 -12.026 -2.193 1.00 0.00 C ATOM 1969 C ASN A 126 4.321 -11.664 -0.921 1.00 0.00 C ATOM 1970 O ASN A 126 3.114 -11.885 -0.822 1.00 0.00 O ATOM 1971 CB ASN A 126 5.872 -10.816 -2.692 1.00 0.00 C ATOM 1972 CG ASN A 126 6.554 -11.077 -4.020 1.00 0.00 C ATOM 1973 OD1 ASN A 126 6.306 -10.211 -4.995 1.00 0.00 O flip ATOM 1974 ND2 ASN A 126 7.296 -12.049 -4.169 1.00 0.00 N flip ATOM 0 H ASN A 126 3.368 -11.882 -3.394 1.00 0.00 H new ATOM 0 HA ASN A 126 5.773 -12.835 -1.961 1.00 0.00 H new ATOM 0 HB2 ASN A 126 5.201 -9.963 -2.793 1.00 0.00 H new ATOM 0 HB3 ASN A 126 6.622 -10.545 -1.949 1.00 0.00 H new ATOM 0 HD21 ASN A 126 7.459 -12.690 -3.392 1.00 0.00 H new ATOM 0 HD22 ASN A 126 7.747 -12.213 -5.069 1.00 0.00 H new ATOM 1981 N GLU A 127 5.037 -11.105 0.049 1.00 0.00 N ATOM 1982 CA GLU A 127 4.430 -10.711 1.316 1.00 0.00 C ATOM 1983 C GLU A 127 4.094 -9.220 1.317 1.00 0.00 C ATOM 1984 O GLU A 127 4.893 -8.397 0.869 1.00 0.00 O ATOM 1985 CB GLU A 127 5.371 -11.038 2.478 1.00 0.00 C ATOM 1986 CG GLU A 127 4.969 -12.280 3.256 1.00 0.00 C ATOM 1987 CD GLU A 127 6.151 -13.171 3.584 1.00 0.00 C ATOM 1988 OE1 GLU A 127 6.944 -13.468 2.667 1.00 0.00 O ATOM 1989 OE2 GLU A 127 6.283 -13.572 4.760 1.00 0.00 O ATOM 0 H GLU A 127 6.037 -10.915 -0.017 1.00 0.00 H new ATOM 0 HA GLU A 127 3.504 -11.273 1.440 1.00 0.00 H new ATOM 0 HB2 GLU A 127 6.380 -11.174 2.090 1.00 0.00 H new ATOM 0 HB3 GLU A 127 5.403 -10.187 3.159 1.00 0.00 H new ATOM 0 HG2 GLU A 127 4.476 -11.981 4.181 1.00 0.00 H new ATOM 0 HG3 GLU A 127 4.241 -12.847 2.676 1.00 0.00 H new ATOM 1996 N PRO A 128 2.903 -8.848 1.825 1.00 0.00 N ATOM 1997 CA PRO A 128 2.474 -7.446 1.880 1.00 0.00 C ATOM 1998 C PRO A 128 3.499 -6.554 2.572 1.00 0.00 C ATOM 1999 O PRO A 128 3.970 -6.865 3.666 1.00 0.00 O ATOM 2000 CB PRO A 128 1.178 -7.499 2.692 1.00 0.00 C ATOM 2001 CG PRO A 128 0.669 -8.886 2.507 1.00 0.00 C ATOM 2002 CD PRO A 128 1.887 -9.759 2.383 1.00 0.00 C ATOM 0 HA PRO A 128 2.350 -7.020 0.884 1.00 0.00 H new ATOM 0 HB2 PRO A 128 1.362 -7.282 3.744 1.00 0.00 H new ATOM 0 HB3 PRO A 128 0.458 -6.763 2.336 1.00 0.00 H new ATOM 0 HG2 PRO A 128 0.053 -9.192 3.353 1.00 0.00 H new ATOM 0 HG3 PRO A 128 0.045 -8.957 1.616 1.00 0.00 H new ATOM 0 HD2 PRO A 128 2.194 -10.160 3.349 1.00 0.00 H new ATOM 0 HD3 PRO A 128 1.706 -10.610 1.727 1.00 0.00 H new ATOM 2010 N LEU A 129 3.838 -5.441 1.929 1.00 0.00 N ATOM 2011 CA LEU A 129 4.807 -4.502 2.485 1.00 0.00 C ATOM 2012 C LEU A 129 4.138 -3.180 2.843 1.00 0.00 C ATOM 2013 O LEU A 129 3.124 -2.805 2.253 1.00 0.00 O ATOM 2014 CB LEU A 129 5.942 -4.257 1.488 1.00 0.00 C ATOM 2015 CG LEU A 129 6.511 -5.517 0.832 1.00 0.00 C ATOM 2016 CD1 LEU A 129 6.931 -5.229 -0.600 1.00 0.00 C ATOM 2017 CD2 LEU A 129 7.685 -6.051 1.636 1.00 0.00 C ATOM 0 H LEU A 129 3.457 -5.167 1.023 1.00 0.00 H new ATOM 0 HA LEU A 129 5.219 -4.940 3.394 1.00 0.00 H new ATOM 0 HB2 LEU A 129 5.580 -3.590 0.705 1.00 0.00 H new ATOM 0 HB3 LEU A 129 6.750 -3.737 2.002 1.00 0.00 H new ATOM 0 HG LEU A 129 5.732 -6.279 0.814 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.333 -6.136 -1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 129 6.066 -4.892 -1.172 1.00 0.00 H new ATOM 0 HD13 LEU A 129 7.695 -4.452 -0.606 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.078 -6.947 1.155 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.467 -5.293 1.685 1.00 0.00 H new ATOM 0 HD23 LEU A 129 7.354 -6.296 2.645 1.00 0.00 H new ATOM 2029 N VAL A 130 4.711 -2.475 3.812 1.00 0.00 N ATOM 2030 CA VAL A 130 4.170 -1.193 4.248 1.00 0.00 C ATOM 2031 C VAL A 130 4.999 -0.034 3.704 1.00 0.00 C ATOM 2032 O VAL A 130 6.228 -0.046 3.784 1.00 0.00 O ATOM 2033 CB VAL A 130 4.115 -1.100 5.787 1.00 0.00 C ATOM 2034 CG1 VAL A 130 5.513 -1.191 6.383 1.00 0.00 C ATOM 2035 CG2 VAL A 130 3.425 0.185 6.222 1.00 0.00 C ATOM 0 H VAL A 130 5.550 -2.770 4.311 1.00 0.00 H new ATOM 0 HA VAL A 130 3.156 -1.125 3.854 1.00 0.00 H new ATOM 0 HB VAL A 130 3.533 -1.943 6.160 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.451 -1.123 7.469 1.00 0.00 H new ATOM 0 HG12 VAL A 130 5.966 -2.142 6.104 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.125 -0.373 6.003 1.00 0.00 H new ATOM 0 HG21 VAL A 130 3.396 0.232 7.311 1.00 0.00 H new ATOM 0 HG22 VAL A 130 3.976 1.043 5.836 1.00 0.00 H new ATOM 0 HG23 VAL A 130 2.408 0.202 5.831 1.00 0.00 H new ATOM 2045 N LEU A 131 4.321 0.964 3.149 1.00 0.00 N ATOM 2046 CA LEU A 131 4.997 2.130 2.590 1.00 0.00 C ATOM 2047 C LEU A 131 5.804 2.856 3.662 1.00 0.00 C ATOM 2048 O LEU A 131 5.471 2.805 4.846 1.00 0.00 O ATOM 2049 CB LEU A 131 3.980 3.086 1.966 1.00 0.00 C ATOM 2050 CG LEU A 131 4.583 4.214 1.127 1.00 0.00 C ATOM 2051 CD1 LEU A 131 5.221 3.657 -0.136 1.00 0.00 C ATOM 2052 CD2 LEU A 131 3.521 5.246 0.779 1.00 0.00 C ATOM 0 H LEU A 131 3.304 0.990 3.074 1.00 0.00 H new ATOM 0 HA LEU A 131 5.682 1.785 1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 131 3.300 2.510 1.338 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.381 3.527 2.763 1.00 0.00 H new ATOM 0 HG LEU A 131 5.358 4.704 1.716 1.00 0.00 H new ATOM 0 HD11 LEU A 131 5.645 4.474 -0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.011 2.956 0.134 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.465 3.141 -0.728 1.00 0.00 H new ATOM 0 HD21 LEU A 131 3.968 6.041 0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.723 4.769 0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.110 5.668 1.696 1.00 0.00 H new ATOM 2064 N GLU A 132 6.866 3.533 3.238 1.00 0.00 N ATOM 2065 CA GLU A 132 7.721 4.271 4.162 1.00 0.00 C ATOM 2066 C GLU A 132 7.017 5.523 4.673 1.00 0.00 C ATOM 2067 O GLU A 132 6.930 6.529 3.969 1.00 0.00 O ATOM 2068 CB GLU A 132 9.036 4.650 3.478 1.00 0.00 C ATOM 2069 CG GLU A 132 10.203 3.755 3.863 1.00 0.00 C ATOM 2070 CD GLU A 132 11.180 4.441 4.799 1.00 0.00 C ATOM 2071 OE1 GLU A 132 10.762 4.836 5.907 1.00 0.00 O ATOM 2072 OE2 GLU A 132 12.363 4.581 4.423 1.00 0.00 O ATOM 0 H GLU A 132 7.155 3.586 2.261 1.00 0.00 H new ATOM 0 HA GLU A 132 7.936 3.627 5.014 1.00 0.00 H new ATOM 0 HB2 GLU A 132 8.899 4.609 2.397 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.282 5.682 3.729 1.00 0.00 H new ATOM 0 HG2 GLU A 132 9.822 2.852 4.340 1.00 0.00 H new ATOM 0 HG3 GLU A 132 10.729 3.442 2.961 1.00 0.00 H new ATOM 2079 N GLY A 133 6.516 5.455 5.902 1.00 0.00 N ATOM 2080 CA GLY A 133 5.827 6.590 6.487 1.00 0.00 C ATOM 2081 C GLY A 133 4.324 6.511 6.310 1.00 0.00 C ATOM 2082 O GLY A 133 3.566 6.866 7.215 1.00 0.00 O ATOM 0 H GLY A 133 6.575 4.633 6.504 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.062 6.645 7.550 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.195 7.509 6.031 1.00 0.00 H new ATOM 2086 N GLY A 134 3.890 6.046 5.144 1.00 0.00 N ATOM 2087 CA GLY A 134 2.469 5.930 4.874 1.00 0.00 C ATOM 2088 C GLY A 134 1.931 7.110 4.089 1.00 0.00 C ATOM 2089 O GLY A 134 2.613 7.645 3.215 1.00 0.00 O ATOM 0 H GLY A 134 4.497 5.747 4.381 1.00 0.00 H new ATOM 0 HA2 GLY A 134 2.282 5.011 4.318 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.928 5.848 5.817 1.00 0.00 H new ATOM 2093 N TYR A 135 0.704 7.516 4.400 1.00 0.00 N ATOM 2094 CA TYR A 135 0.075 8.639 3.717 1.00 0.00 C ATOM 2095 C TYR A 135 0.721 9.959 4.127 1.00 0.00 C ATOM 2096 O TYR A 135 0.835 10.882 3.321 1.00 0.00 O ATOM 2097 CB TYR A 135 -1.424 8.676 4.022 1.00 0.00 C ATOM 2098 CG TYR A 135 -2.208 9.577 3.094 1.00 0.00 C ATOM 2099 CD1 TYR A 135 -2.295 10.943 3.330 1.00 0.00 C ATOM 2100 CD2 TYR A 135 -2.861 9.060 1.981 1.00 0.00 C ATOM 2101 CE1 TYR A 135 -3.010 11.769 2.484 1.00 0.00 C ATOM 2102 CE2 TYR A 135 -3.578 9.880 1.131 1.00 0.00 C ATOM 2103 CZ TYR A 135 -3.649 11.233 1.386 1.00 0.00 C ATOM 2104 OH TYR A 135 -4.362 12.053 0.542 1.00 0.00 O ATOM 0 H TYR A 135 0.126 7.083 5.121 1.00 0.00 H new ATOM 0 HA TYR A 135 0.218 8.503 2.645 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -1.825 7.664 3.957 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -1.569 9.011 5.049 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -1.796 11.366 4.189 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -2.807 8.001 1.778 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -3.068 12.829 2.682 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -4.081 9.463 0.271 1.00 0.00 H new ATOM 0 HH TYR A 135 -4.394 12.958 0.915 1.00 0.00 H new ATOM 2114 N GLU A 136 1.143 10.039 5.385 1.00 0.00 N ATOM 2115 CA GLU A 136 1.779 11.246 5.902 1.00 0.00 C ATOM 2116 C GLU A 136 3.036 11.582 5.105 1.00 0.00 C ATOM 2117 O GLU A 136 3.329 12.750 4.852 1.00 0.00 O ATOM 2118 CB GLU A 136 2.128 11.071 7.381 1.00 0.00 C ATOM 2119 CG GLU A 136 2.428 12.380 8.093 1.00 0.00 C ATOM 2120 CD GLU A 136 1.313 13.396 7.939 1.00 0.00 C ATOM 2121 OE1 GLU A 136 1.343 14.165 6.955 1.00 0.00 O ATOM 2122 OE2 GLU A 136 0.410 13.423 8.801 1.00 0.00 O ATOM 0 H GLU A 136 1.056 9.283 6.065 1.00 0.00 H new ATOM 0 HA GLU A 136 1.074 12.071 5.799 1.00 0.00 H new ATOM 0 HB2 GLU A 136 1.299 10.574 7.885 1.00 0.00 H new ATOM 0 HB3 GLU A 136 2.993 10.414 7.467 1.00 0.00 H new ATOM 0 HG2 GLU A 136 2.592 12.184 9.153 1.00 0.00 H new ATOM 0 HG3 GLU A 136 3.354 12.800 7.699 1.00 0.00 H new ATOM 2129 N ASN A 137 3.775 10.549 4.714 1.00 0.00 N ATOM 2130 CA ASN A 137 5.000 10.733 3.944 1.00 0.00 C ATOM 2131 C ASN A 137 4.697 10.816 2.451 1.00 0.00 C ATOM 2132 O ASN A 137 5.412 11.478 1.698 1.00 0.00 O ATOM 2133 CB ASN A 137 5.975 9.586 4.216 1.00 0.00 C ATOM 2134 CG ASN A 137 7.393 9.920 3.795 1.00 0.00 C ATOM 2135 OD1 ASN A 137 7.683 10.056 2.607 1.00 0.00 O ATOM 2136 ND2 ASN A 137 8.283 10.055 4.770 1.00 0.00 N ATOM 0 H ASN A 137 3.547 9.576 4.918 1.00 0.00 H new ATOM 0 HA ASN A 137 5.458 11.672 4.256 1.00 0.00 H new ATOM 0 HB2 ASN A 137 5.962 9.346 5.279 1.00 0.00 H new ATOM 0 HB3 ASN A 137 5.641 8.695 3.684 1.00 0.00 H new ATOM 0 HD21 ASN A 137 9.253 10.281 4.548 1.00 0.00 H new ATOM 0 HD22 ASN A 137 7.997 9.933 5.742 1.00 0.00 H new ATOM 2143 N TRP A 138 3.633 10.139 2.031 1.00 0.00 N ATOM 2144 CA TRP A 138 3.234 10.136 0.628 1.00 0.00 C ATOM 2145 C TRP A 138 2.941 11.551 0.141 1.00 0.00 C ATOM 2146 O TRP A 138 3.204 11.889 -1.013 1.00 0.00 O ATOM 2147 CB TRP A 138 2.001 9.251 0.430 1.00 0.00 C ATOM 2148 CG TRP A 138 1.591 9.114 -1.005 1.00 0.00 C ATOM 2149 CD1 TRP A 138 0.466 9.620 -1.587 1.00 0.00 C ATOM 2150 CD2 TRP A 138 2.304 8.425 -2.038 1.00 0.00 C ATOM 2151 NE1 TRP A 138 0.434 9.287 -2.920 1.00 0.00 N ATOM 2152 CE2 TRP A 138 1.551 8.553 -3.220 1.00 0.00 C ATOM 2153 CE3 TRP A 138 3.505 7.711 -2.080 1.00 0.00 C ATOM 2154 CZ2 TRP A 138 1.961 7.996 -4.429 1.00 0.00 C ATOM 2155 CZ3 TRP A 138 3.910 7.158 -3.279 1.00 0.00 C ATOM 2156 CH2 TRP A 138 3.141 7.303 -4.440 1.00 0.00 C ATOM 0 H TRP A 138 3.032 9.586 2.642 1.00 0.00 H new ATOM 0 HA TRP A 138 4.061 9.734 0.042 1.00 0.00 H new ATOM 0 HB2 TRP A 138 2.204 8.261 0.838 1.00 0.00 H new ATOM 0 HB3 TRP A 138 1.170 9.666 1.000 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -0.289 10.198 -1.075 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.301 9.544 -3.578 1.00 0.00 H new ATOM 0 HE3 TRP A 138 4.106 7.594 -1.190 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 1.369 8.107 -5.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 4.836 6.604 -3.322 1.00 0.00 H new ATOM 0 HH2 TRP A 138 3.486 6.859 -5.362 1.00 0.00 H new ATOM 2167 N LEU A 139 2.395 12.376 1.029 1.00 0.00 N ATOM 2168 CA LEU A 139 2.067 13.756 0.691 1.00 0.00 C ATOM 2169 C LEU A 139 3.333 14.573 0.457 1.00 0.00 C ATOM 2170 O LEU A 139 3.380 15.423 -0.433 1.00 0.00 O ATOM 2171 CB LEU A 139 1.234 14.393 1.804 1.00 0.00 C ATOM 2172 CG LEU A 139 -0.138 13.756 2.032 1.00 0.00 C ATOM 2173 CD1 LEU A 139 -0.864 14.446 3.176 1.00 0.00 C ATOM 2174 CD2 LEU A 139 -0.969 13.813 0.760 1.00 0.00 C ATOM 0 H LEU A 139 2.170 12.112 1.988 1.00 0.00 H new ATOM 0 HA LEU A 139 1.484 13.749 -0.230 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.800 14.343 2.734 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.093 15.449 1.573 1.00 0.00 H new ATOM 0 HG LEU A 139 0.009 12.710 2.301 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.838 13.979 3.323 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.276 14.353 4.089 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.000 15.501 2.937 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -1.942 13.356 0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -1.106 14.852 0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.455 13.272 -0.035 1.00 0.00 H new ATOM 2186 N LEU A 140 4.358 14.310 1.261 1.00 0.00 N ATOM 2187 CA LEU A 140 5.625 15.021 1.141 1.00 0.00 C ATOM 2188 C LEU A 140 6.400 14.549 -0.085 1.00 0.00 C ATOM 2189 O LEU A 140 7.141 15.317 -0.698 1.00 0.00 O ATOM 2190 CB LEU A 140 6.469 14.818 2.401 1.00 0.00 C ATOM 2191 CG LEU A 140 6.235 15.845 3.510 1.00 0.00 C ATOM 2192 CD1 LEU A 140 6.374 15.197 4.879 1.00 0.00 C ATOM 2193 CD2 LEU A 140 7.204 17.010 3.368 1.00 0.00 C ATOM 0 H LEU A 140 4.336 13.610 2.002 1.00 0.00 H new ATOM 0 HA LEU A 140 5.407 16.083 1.025 1.00 0.00 H new ATOM 0 HB2 LEU A 140 6.267 13.824 2.799 1.00 0.00 H new ATOM 0 HB3 LEU A 140 7.522 14.841 2.122 1.00 0.00 H new ATOM 0 HG LEU A 140 5.219 16.228 3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 140 6.204 15.944 5.654 1.00 0.00 H new ATOM 0 HD12 LEU A 140 5.641 14.397 4.979 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.377 14.785 4.986 1.00 0.00 H new ATOM 0 HD21 LEU A 140 7.024 17.732 4.165 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.228 16.642 3.436 1.00 0.00 H new ATOM 0 HD23 LEU A 140 7.055 17.492 2.402 1.00 0.00 H new ATOM 2205 N CYS A 141 6.223 13.280 -0.439 1.00 0.00 N ATOM 2206 CA CYS A 141 6.905 12.706 -1.592 1.00 0.00 C ATOM 2207 C CYS A 141 6.159 13.028 -2.883 1.00 0.00 C ATOM 2208 O CYS A 141 6.763 13.429 -3.877 1.00 0.00 O ATOM 2209 CB CYS A 141 7.037 11.190 -1.431 1.00 0.00 C ATOM 2210 SG CYS A 141 8.596 10.514 -2.050 1.00 0.00 S ATOM 0 H CYS A 141 5.613 12.630 0.057 1.00 0.00 H new ATOM 0 HA CYS A 141 7.900 13.147 -1.649 1.00 0.00 H new ATOM 0 HB2 CYS A 141 6.938 10.938 -0.375 1.00 0.00 H new ATOM 0 HB3 CYS A 141 6.211 10.707 -1.953 1.00 0.00 H new ATOM 0 HG CYS A 141 9.024 9.595 -1.236 1.00 0.00 H new ATOM 2216 N TYR A 142 4.841 12.852 -2.859 1.00 0.00 N ATOM 2217 CA TYR A 142 4.013 13.124 -4.026 1.00 0.00 C ATOM 2218 C TYR A 142 2.642 13.656 -3.611 1.00 0.00 C ATOM 2219 O TYR A 142 1.662 12.913 -3.582 1.00 0.00 O ATOM 2220 CB TYR A 142 3.847 11.858 -4.868 1.00 0.00 C ATOM 2221 CG TYR A 142 5.125 11.406 -5.539 1.00 0.00 C ATOM 2222 CD1 TYR A 142 5.698 12.155 -6.559 1.00 0.00 C ATOM 2223 CD2 TYR A 142 5.756 10.231 -5.154 1.00 0.00 C ATOM 2224 CE1 TYR A 142 6.865 11.746 -7.175 1.00 0.00 C ATOM 2225 CE2 TYR A 142 6.924 9.815 -5.765 1.00 0.00 C ATOM 2226 CZ TYR A 142 7.474 10.575 -6.775 1.00 0.00 C ATOM 2227 OH TYR A 142 8.636 10.163 -7.386 1.00 0.00 O ATOM 0 H TYR A 142 4.325 12.522 -2.043 1.00 0.00 H new ATOM 0 HA TYR A 142 4.513 13.886 -4.623 1.00 0.00 H new ATOM 0 HB2 TYR A 142 3.477 11.054 -4.232 1.00 0.00 H new ATOM 0 HB3 TYR A 142 3.089 12.036 -5.631 1.00 0.00 H new ATOM 0 HD1 TYR A 142 5.223 13.072 -6.876 1.00 0.00 H new ATOM 0 HD2 TYR A 142 5.327 9.632 -4.364 1.00 0.00 H new ATOM 0 HE1 TYR A 142 7.298 12.340 -7.966 1.00 0.00 H new ATOM 0 HE2 TYR A 142 7.403 8.899 -5.453 1.00 0.00 H new ATOM 0 HH TYR A 142 8.935 9.320 -6.986 1.00 0.00 H new ATOM 2237 N PRO A 143 2.558 14.956 -3.281 1.00 0.00 N ATOM 2238 CA PRO A 143 1.301 15.586 -2.865 1.00 0.00 C ATOM 2239 C PRO A 143 0.312 15.738 -4.020 1.00 0.00 C ATOM 2240 O PRO A 143 -0.863 16.035 -3.805 1.00 0.00 O ATOM 2241 CB PRO A 143 1.742 16.958 -2.356 1.00 0.00 C ATOM 2242 CG PRO A 143 3.006 17.244 -3.090 1.00 0.00 C ATOM 2243 CD PRO A 143 3.680 15.914 -3.288 1.00 0.00 C ATOM 0 HA PRO A 143 0.776 14.988 -2.120 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.986 17.717 -2.558 1.00 0.00 H new ATOM 0 HB3 PRO A 143 1.903 16.948 -1.278 1.00 0.00 H new ATOM 0 HG2 PRO A 143 2.801 17.724 -4.047 1.00 0.00 H new ATOM 0 HG3 PRO A 143 3.642 17.923 -2.522 1.00 0.00 H new ATOM 0 HD2 PRO A 143 4.232 15.879 -4.227 1.00 0.00 H new ATOM 0 HD3 PRO A 143 4.393 15.703 -2.491 1.00 0.00 H new ATOM 2251 N GLN A 144 0.793 15.535 -5.244 1.00 0.00 N ATOM 2252 CA GLN A 144 -0.053 15.653 -6.425 1.00 0.00 C ATOM 2253 C GLN A 144 -0.563 14.287 -6.874 1.00 0.00 C ATOM 2254 O GLN A 144 -0.804 14.062 -8.060 1.00 0.00 O ATOM 2255 CB GLN A 144 0.717 16.321 -7.565 1.00 0.00 C ATOM 2256 CG GLN A 144 1.914 15.516 -8.044 1.00 0.00 C ATOM 2257 CD GLN A 144 1.594 14.656 -9.251 1.00 0.00 C ATOM 2258 OE1 GLN A 144 0.790 15.036 -10.102 1.00 0.00 O ATOM 2259 NE2 GLN A 144 2.224 13.489 -9.329 1.00 0.00 N ATOM 0 H GLN A 144 1.763 15.288 -5.442 1.00 0.00 H new ATOM 0 HA GLN A 144 -0.912 16.271 -6.162 1.00 0.00 H new ATOM 0 HB2 GLN A 144 0.040 16.483 -8.404 1.00 0.00 H new ATOM 0 HB3 GLN A 144 1.058 17.303 -7.236 1.00 0.00 H new ATOM 0 HG2 GLN A 144 2.728 16.196 -8.293 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.267 14.880 -7.233 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.883 13.215 -8.600 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.049 12.867 -10.118 1.00 0.00 H new ATOM 2268 N TYR A 145 -0.728 13.377 -5.918 1.00 0.00 N ATOM 2269 CA TYR A 145 -1.210 12.034 -6.216 1.00 0.00 C ATOM 2270 C TYR A 145 -2.267 11.599 -5.204 1.00 0.00 C ATOM 2271 O TYR A 145 -2.392 10.415 -4.894 1.00 0.00 O ATOM 2272 CB TYR A 145 -0.047 11.040 -6.221 1.00 0.00 C ATOM 2273 CG TYR A 145 -0.072 10.084 -7.393 1.00 0.00 C ATOM 2274 CD1 TYR A 145 -0.992 9.044 -7.446 1.00 0.00 C ATOM 2275 CD2 TYR A 145 0.824 10.222 -8.445 1.00 0.00 C ATOM 2276 CE1 TYR A 145 -1.018 8.169 -8.515 1.00 0.00 C ATOM 2277 CE2 TYR A 145 0.804 9.350 -9.517 1.00 0.00 C ATOM 2278 CZ TYR A 145 -0.118 8.326 -9.548 1.00 0.00 C ATOM 2279 OH TYR A 145 -0.141 7.457 -10.614 1.00 0.00 O ATOM 0 H TYR A 145 -0.535 13.546 -4.931 1.00 0.00 H new ATOM 0 HA TYR A 145 -1.666 12.049 -7.206 1.00 0.00 H new ATOM 0 HB2 TYR A 145 0.892 11.593 -6.234 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -0.066 10.466 -5.294 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -1.698 8.918 -6.639 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.548 11.023 -8.425 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -1.740 7.366 -8.541 1.00 0.00 H new ATOM 0 HE2 TYR A 145 1.508 9.470 -10.327 1.00 0.00 H new ATOM 0 HH TYR A 145 0.557 7.707 -11.255 1.00 0.00 H new ATOM 2289 N THR A 146 -3.023 12.566 -4.694 1.00 0.00 N ATOM 2290 CA THR A 146 -4.068 12.284 -3.718 1.00 0.00 C ATOM 2291 C THR A 146 -5.272 13.193 -3.934 1.00 0.00 C ATOM 2292 O THR A 146 -5.144 14.294 -4.471 1.00 0.00 O ATOM 2293 CB THR A 146 -3.530 12.461 -2.298 1.00 0.00 C ATOM 2294 OG1 THR A 146 -2.567 13.498 -2.252 1.00 0.00 O ATOM 2295 CG2 THR A 146 -2.884 11.210 -1.742 1.00 0.00 C ATOM 0 H THR A 146 -2.931 13.551 -4.941 1.00 0.00 H new ATOM 0 HA THR A 146 -4.386 11.250 -3.852 1.00 0.00 H new ATOM 0 HB THR A 146 -4.400 12.703 -1.688 1.00 0.00 H new ATOM 0 HG1 THR A 146 -2.691 14.024 -1.434 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.524 11.405 -0.732 1.00 0.00 H new ATOM 0 HG22 THR A 146 -3.616 10.403 -1.717 1.00 0.00 H new ATOM 0 HG23 THR A 146 -2.046 10.920 -2.376 1.00 0.00 H new ATOM 2303 N THR A 147 -6.443 12.725 -3.515 1.00 0.00 N ATOM 2304 CA THR A 147 -7.672 13.495 -3.664 1.00 0.00 C ATOM 2305 C THR A 147 -7.680 14.696 -2.724 1.00 0.00 C ATOM 2306 O THR A 147 -8.215 15.754 -3.056 1.00 0.00 O ATOM 2307 CB THR A 147 -8.890 12.611 -3.390 1.00 0.00 C ATOM 2308 OG1 THR A 147 -9.017 12.350 -2.004 1.00 0.00 O ATOM 2309 CG2 THR A 147 -8.835 11.279 -4.106 1.00 0.00 C ATOM 0 H THR A 147 -6.567 11.816 -3.069 1.00 0.00 H new ATOM 0 HA THR A 147 -7.719 13.859 -4.690 1.00 0.00 H new ATOM 0 HB THR A 147 -9.746 13.172 -3.766 1.00 0.00 H new ATOM 0 HG1 THR A 147 -9.078 11.383 -1.857 1.00 0.00 H new ATOM 0 HG21 THR A 147 -9.728 10.701 -3.869 1.00 0.00 H new ATOM 0 HG22 THR A 147 -8.786 11.446 -5.182 1.00 0.00 H new ATOM 0 HG23 THR A 147 -7.951 10.729 -3.784 1.00 0.00 H new ATOM 2317 N ASN A 148 -7.083 14.524 -1.550 1.00 0.00 N ATOM 2318 CA ASN A 148 -7.021 15.594 -0.560 1.00 0.00 C ATOM 2319 C ASN A 148 -5.593 15.792 -0.062 1.00 0.00 C ATOM 2320 O ASN A 148 -5.047 14.944 0.644 1.00 0.00 O ATOM 2321 CB ASN A 148 -7.948 15.281 0.617 1.00 0.00 C ATOM 2322 CG ASN A 148 -8.761 16.485 1.048 1.00 0.00 C ATOM 2323 OD1 ASN A 148 -9.954 16.580 0.758 1.00 0.00 O ATOM 2324 ND2 ASN A 148 -8.118 17.415 1.745 1.00 0.00 N ATOM 0 H ASN A 148 -6.635 13.655 -1.260 1.00 0.00 H new ATOM 0 HA ASN A 148 -7.350 16.517 -1.037 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -8.623 14.471 0.339 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -7.354 14.927 1.459 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -8.613 18.248 2.062 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -7.129 17.296 1.963 1.00 0.00 H new ATOM 2331 N ALA A 149 -4.993 16.919 -0.434 1.00 0.00 N ATOM 2332 CA ALA A 149 -3.629 17.229 -0.025 1.00 0.00 C ATOM 2333 C ALA A 149 -3.615 18.125 1.209 1.00 0.00 C ATOM 2334 O ALA A 149 -2.693 18.063 2.022 1.00 0.00 O ATOM 2335 CB ALA A 149 -2.874 17.891 -1.169 1.00 0.00 C ATOM 0 H ALA A 149 -5.431 17.632 -1.018 1.00 0.00 H new ATOM 0 HA ALA A 149 -3.132 16.294 0.233 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -1.856 18.118 -0.851 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -2.845 17.216 -2.024 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -3.379 18.814 -1.452 1.00 0.00 H new