USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=37 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 -1:sc= 1.14 USER MOD Set 1.2: A 147 THR OG1 : rot -61:sc= 2.16 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 77:sc= 0.396 USER MOD Single : A 25 MET CE :methyl -142:sc= -2.74! (180deg=-4.35!) USER MOD Single : A 26 MET CE :methyl -174:sc= -2.71 (180deg=-2.8) USER MOD Single : A 27 THR OG1 : rot -79:sc= 0.558 USER MOD Single : A 29 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0221) USER MOD Single : A 30 ASN : amide:sc= -0.239 K(o=-0.24,f=-2!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl -158:sc= 0 (180deg=-0.0996) USER MOD Single : A 41 MET CE :methyl 164:sc= 0 (180deg=-0.343) USER MOD Single : A 42 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -1.04 K(o=-1,f=-4.1!) USER MOD Single : A 47 SER OG : rot 180:sc= -0.0657 USER MOD Single : A 51 HIS : no HD1:sc=-0.00489 X(o=-0.0049,f=-0.039) USER MOD Single : A 52 SER OG : rot -78:sc= 1.08 USER MOD Single : A 54 SER OG : rot 140:sc= 0.248 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 63:sc= -0.293 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS :FLIP no HD1:sc=-0.00221 F(o=-0.81,f=-0.0022) USER MOD Single : A 77 SER OG : rot 147:sc= 0.962 USER MOD Single : A 78 LYS NZ :NH3+ -142:sc= 0.333 (180deg=0.0101) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.0681 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=0.16) 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= -0.0186 USER MOD Single : A 100 LYS NZ :NH3+ -155:sc= -0.167 (180deg=-0.888) USER MOD Single : A 103 GLN : amide:sc= -0.179 K(o=-0.18,f=-1.8!) USER MOD Single : A 106 THR OG1 : rot -71:sc= -0.604 USER MOD Single : A 107 THR OG1 : rot 170:sc= -0.176 USER MOD Single : A 110 SER OG : rot -83:sc= 0.834 USER MOD Single : A 112 LYS NZ :NH3+ 150:sc= 1.11 (180deg=0.516) USER MOD Single : A 117 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0265) USER MOD Single : A 126 ASN : amide:sc= -0.263 X(o=-0.26,f=-0.73) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -2.36 K(o=-2.4,f=-3.1!) USER MOD Single : A 141 CYS SG : rot 73:sc= 0.42 USER MOD Single : A 142 TYR OH : rot 30:sc= -0.758 USER MOD Single : A 144 GLN : amide:sc= -0.024 X(o=-0.024,f=-0.35) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot -165:sc= -4.42! USER MOD Single : A 148 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 196 N ALA A 16 9.100 -3.690 4.303 1.00 0.00 N ATOM 197 CA ALA A 16 8.583 -2.372 3.958 1.00 0.00 C ATOM 198 C ALA A 16 9.075 -1.932 2.583 1.00 0.00 C ATOM 199 O ALA A 16 10.121 -2.380 2.115 1.00 0.00 O ATOM 200 CB ALA A 16 8.985 -1.355 5.015 1.00 0.00 C ATOM 0 HA ALA A 16 7.495 -2.433 3.923 1.00 0.00 H new ATOM 0 HB1 ALA A 16 8.592 -0.375 4.745 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.579 -1.655 5.981 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.072 -1.306 5.078 1.00 0.00 H new ATOM 206 N ILE A 17 8.314 -1.051 1.942 1.00 0.00 N ATOM 207 CA ILE A 17 8.673 -0.550 0.620 1.00 0.00 C ATOM 208 C ILE A 17 8.839 0.967 0.635 1.00 0.00 C ATOM 209 O ILE A 17 8.221 1.662 1.441 1.00 0.00 O ATOM 210 CB ILE A 17 7.613 -0.934 -0.432 1.00 0.00 C ATOM 211 CG1 ILE A 17 8.058 -0.489 -1.827 1.00 0.00 C ATOM 212 CG2 ILE A 17 6.265 -0.320 -0.080 1.00 0.00 C ATOM 213 CD1 ILE A 17 7.201 -1.047 -2.942 1.00 0.00 C ATOM 0 H ILE A 17 7.445 -0.669 2.316 1.00 0.00 H new ATOM 0 HA ILE A 17 9.623 -1.012 0.351 1.00 0.00 H new ATOM 0 HB ILE A 17 7.506 -2.019 -0.434 1.00 0.00 H new ATOM 0 HG12 ILE A 17 8.039 0.600 -1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 17 9.092 -0.797 -1.985 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.529 -0.602 -0.833 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.943 -0.684 0.896 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.356 0.766 -0.050 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.575 -0.690 -3.902 1.00 0.00 H new ATOM 0 HD12 ILE A 17 7.239 -2.136 -2.920 1.00 0.00 H new ATOM 0 HD13 ILE A 17 6.171 -0.718 -2.809 1.00 0.00 H new ATOM 225 N THR A 18 9.680 1.473 -0.262 1.00 0.00 N ATOM 226 CA THR A 18 9.928 2.907 -0.352 1.00 0.00 C ATOM 227 C THR A 18 8.897 3.580 -1.253 1.00 0.00 C ATOM 228 O THR A 18 8.275 2.931 -2.095 1.00 0.00 O ATOM 229 CB THR A 18 11.337 3.172 -0.885 1.00 0.00 C ATOM 230 OG1 THR A 18 11.503 2.603 -2.171 1.00 0.00 O ATOM 231 CG2 THR A 18 12.427 2.616 0.007 1.00 0.00 C ATOM 0 H THR A 18 10.200 0.911 -0.936 1.00 0.00 H new ATOM 0 HA THR A 18 9.842 3.328 0.650 1.00 0.00 H new ATOM 0 HB THR A 18 11.434 4.257 -0.919 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.410 2.785 -2.495 1.00 0.00 H new ATOM 0 HG21 THR A 18 13.402 2.838 -0.428 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.358 3.073 0.994 1.00 0.00 H new ATOM 0 HG23 THR A 18 12.308 1.536 0.098 1.00 0.00 H new ATOM 239 N ALA A 19 8.719 4.885 -1.069 1.00 0.00 N ATOM 240 CA ALA A 19 7.762 5.645 -1.865 1.00 0.00 C ATOM 241 C ALA A 19 8.204 5.731 -3.322 1.00 0.00 C ATOM 242 O ALA A 19 7.375 5.782 -4.230 1.00 0.00 O ATOM 243 CB ALA A 19 7.582 7.039 -1.282 1.00 0.00 C ATOM 0 H ALA A 19 9.225 5.437 -0.376 1.00 0.00 H new ATOM 0 HA ALA A 19 6.805 5.123 -1.834 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.865 7.596 -1.885 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.212 6.961 -0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.539 7.560 -1.283 1.00 0.00 H new ATOM 249 N LYS A 20 9.516 5.748 -3.537 1.00 0.00 N ATOM 250 CA LYS A 20 10.067 5.827 -4.885 1.00 0.00 C ATOM 251 C LYS A 20 9.726 4.576 -5.688 1.00 0.00 C ATOM 252 O LYS A 20 9.457 4.650 -6.886 1.00 0.00 O ATOM 253 CB LYS A 20 11.584 6.015 -4.828 1.00 0.00 C ATOM 254 CG LYS A 20 12.110 7.030 -5.831 1.00 0.00 C ATOM 255 CD LYS A 20 11.468 8.393 -5.632 1.00 0.00 C ATOM 256 CE LYS A 20 12.477 9.517 -5.806 1.00 0.00 C ATOM 257 NZ LYS A 20 12.956 10.040 -4.496 1.00 0.00 N ATOM 0 H LYS A 20 10.216 5.708 -2.796 1.00 0.00 H new ATOM 0 HA LYS A 20 9.620 6.687 -5.383 1.00 0.00 H new ATOM 0 HB2 LYS A 20 11.865 6.330 -3.823 1.00 0.00 H new ATOM 0 HB3 LYS A 20 12.068 5.055 -5.008 1.00 0.00 H new ATOM 0 HG2 LYS A 20 13.192 7.118 -5.729 1.00 0.00 H new ATOM 0 HG3 LYS A 20 11.913 6.678 -6.844 1.00 0.00 H new ATOM 0 HD2 LYS A 20 10.654 8.520 -6.346 1.00 0.00 H new ATOM 0 HD3 LYS A 20 11.030 8.448 -4.635 1.00 0.00 H new ATOM 0 HE2 LYS A 20 13.327 9.156 -6.385 1.00 0.00 H new ATOM 0 HE3 LYS A 20 12.023 10.327 -6.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 13.642 10.805 -4.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 12.149 10.408 -3.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 13.412 9.273 -3.962 1.00 0.00 H new ATOM 271 N GLU A 21 9.737 3.429 -5.017 1.00 0.00 N ATOM 272 CA GLU A 21 9.427 2.161 -5.668 1.00 0.00 C ATOM 273 C GLU A 21 7.942 2.072 -6.006 1.00 0.00 C ATOM 274 O GLU A 21 7.561 1.520 -7.037 1.00 0.00 O ATOM 275 CB GLU A 21 9.828 0.990 -4.768 1.00 0.00 C ATOM 276 CG GLU A 21 11.276 0.562 -4.936 1.00 0.00 C ATOM 277 CD GLU A 21 11.592 -0.728 -4.204 1.00 0.00 C ATOM 278 OE1 GLU A 21 11.008 -0.955 -3.123 1.00 0.00 O ATOM 279 OE2 GLU A 21 12.422 -1.511 -4.711 1.00 0.00 O ATOM 0 H GLU A 21 9.957 3.351 -4.024 1.00 0.00 H new ATOM 0 HA GLU A 21 9.996 2.109 -6.596 1.00 0.00 H new ATOM 0 HB2 GLU A 21 9.658 1.267 -3.728 1.00 0.00 H new ATOM 0 HB3 GLU A 21 9.180 0.140 -4.981 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.493 0.436 -5.997 1.00 0.00 H new ATOM 0 HG3 GLU A 21 11.930 1.353 -4.569 1.00 0.00 H new ATOM 286 N LEU A 22 7.108 2.619 -5.128 1.00 0.00 N ATOM 287 CA LEU A 22 5.665 2.603 -5.331 1.00 0.00 C ATOM 288 C LEU A 22 5.276 3.438 -6.547 1.00 0.00 C ATOM 289 O LEU A 22 4.397 3.054 -7.320 1.00 0.00 O ATOM 290 CB LEU A 22 4.946 3.129 -4.086 1.00 0.00 C ATOM 291 CG LEU A 22 3.429 2.937 -4.086 1.00 0.00 C ATOM 292 CD1 LEU A 22 3.054 1.651 -3.367 1.00 0.00 C ATOM 293 CD2 LEU A 22 2.741 4.131 -3.441 1.00 0.00 C ATOM 0 H LEU A 22 7.408 3.079 -4.268 1.00 0.00 H new ATOM 0 HA LEU A 22 5.361 1.571 -5.509 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.360 2.632 -3.209 1.00 0.00 H new ATOM 0 HB3 LEU A 22 5.163 4.192 -3.982 1.00 0.00 H new ATOM 0 HG LEU A 22 3.091 2.863 -5.120 1.00 0.00 H new ATOM 0 HD11 LEU A 22 1.971 1.531 -3.377 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.518 0.803 -3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 22 3.405 1.695 -2.336 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.662 3.977 -3.450 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.084 4.237 -2.412 1.00 0.00 H new ATOM 0 HD23 LEU A 22 2.983 5.036 -3.999 1.00 0.00 H new ATOM 305 N TYR A 23 5.935 4.580 -6.710 1.00 0.00 N ATOM 306 CA TYR A 23 5.656 5.468 -7.833 1.00 0.00 C ATOM 307 C TYR A 23 5.954 4.776 -9.160 1.00 0.00 C ATOM 308 O TYR A 23 5.185 4.885 -10.114 1.00 0.00 O ATOM 309 CB TYR A 23 6.484 6.749 -7.716 1.00 0.00 C ATOM 310 CG TYR A 23 6.107 7.808 -8.727 1.00 0.00 C ATOM 311 CD1 TYR A 23 4.901 8.490 -8.630 1.00 0.00 C ATOM 312 CD2 TYR A 23 6.957 8.127 -9.778 1.00 0.00 C ATOM 313 CE1 TYR A 23 4.552 9.458 -9.552 1.00 0.00 C ATOM 314 CE2 TYR A 23 6.617 9.095 -10.704 1.00 0.00 C ATOM 315 CZ TYR A 23 5.413 9.757 -10.586 1.00 0.00 C ATOM 316 OH TYR A 23 5.070 10.721 -11.507 1.00 0.00 O ATOM 0 H TYR A 23 6.665 4.912 -6.080 1.00 0.00 H new ATOM 0 HA TYR A 23 4.597 5.725 -7.807 1.00 0.00 H new ATOM 0 HB2 TYR A 23 6.365 7.158 -6.713 1.00 0.00 H new ATOM 0 HB3 TYR A 23 7.539 6.502 -7.837 1.00 0.00 H new ATOM 0 HD1 TYR A 23 4.225 8.260 -7.820 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.900 7.610 -9.873 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.609 9.978 -9.463 1.00 0.00 H new ATOM 0 HE2 TYR A 23 7.290 9.331 -11.515 1.00 0.00 H new ATOM 0 HH TYR A 23 5.787 10.810 -12.169 1.00 0.00 H new ATOM 326 N THR A 24 7.075 4.065 -9.212 1.00 0.00 N ATOM 327 CA THR A 24 7.475 3.355 -10.421 1.00 0.00 C ATOM 328 C THR A 24 6.529 2.194 -10.708 1.00 0.00 C ATOM 329 O THR A 24 6.163 1.947 -11.858 1.00 0.00 O ATOM 330 CB THR A 24 8.908 2.837 -10.283 1.00 0.00 C ATOM 331 OG1 THR A 24 9.732 3.802 -9.655 1.00 0.00 O ATOM 332 CG2 THR A 24 9.545 2.482 -11.609 1.00 0.00 C ATOM 0 H THR A 24 7.723 3.965 -8.431 1.00 0.00 H new ATOM 0 HA THR A 24 7.427 4.055 -11.256 1.00 0.00 H new ATOM 0 HB THR A 24 8.832 1.932 -9.681 1.00 0.00 H new ATOM 0 HG1 THR A 24 9.555 3.806 -8.691 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.560 2.122 -11.440 1.00 0.00 H new ATOM 0 HG22 THR A 24 8.960 1.703 -12.097 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.575 3.366 -12.246 1.00 0.00 H new ATOM 340 N MET A 25 6.135 1.484 -9.655 1.00 0.00 N ATOM 341 CA MET A 25 5.232 0.348 -9.793 1.00 0.00 C ATOM 342 C MET A 25 3.824 0.811 -10.154 1.00 0.00 C ATOM 343 O MET A 25 3.147 0.192 -10.975 1.00 0.00 O ATOM 344 CB MET A 25 5.197 -0.462 -8.496 1.00 0.00 C ATOM 345 CG MET A 25 6.459 -1.274 -8.252 1.00 0.00 C ATOM 346 SD MET A 25 6.790 -1.533 -6.498 1.00 0.00 S ATOM 347 CE MET A 25 5.941 -3.084 -6.218 1.00 0.00 C ATOM 0 H MET A 25 6.427 1.676 -8.697 1.00 0.00 H new ATOM 0 HA MET A 25 5.605 -0.284 -10.599 1.00 0.00 H new ATOM 0 HB2 MET A 25 5.044 0.217 -7.657 1.00 0.00 H new ATOM 0 HB3 MET A 25 4.341 -1.136 -8.521 1.00 0.00 H new ATOM 0 HG2 MET A 25 6.366 -2.241 -8.747 1.00 0.00 H new ATOM 0 HG3 MET A 25 7.308 -0.764 -8.707 1.00 0.00 H new ATOM 0 HE1 MET A 25 5.465 -3.067 -5.237 1.00 0.00 H new ATOM 0 HE2 MET A 25 5.182 -3.227 -6.987 1.00 0.00 H new ATOM 0 HE3 MET A 25 6.658 -3.904 -6.259 1.00 0.00 H new ATOM 357 N MET A 26 3.388 1.904 -9.534 1.00 0.00 N ATOM 358 CA MET A 26 2.060 2.449 -9.789 1.00 0.00 C ATOM 359 C MET A 26 1.902 2.832 -11.257 1.00 0.00 C ATOM 360 O MET A 26 0.954 2.412 -11.920 1.00 0.00 O ATOM 361 CB MET A 26 1.806 3.667 -8.900 1.00 0.00 C ATOM 362 CG MET A 26 1.264 3.314 -7.524 1.00 0.00 C ATOM 363 SD MET A 26 0.033 4.493 -6.938 1.00 0.00 S ATOM 364 CE MET A 26 1.058 5.931 -6.639 1.00 0.00 C ATOM 0 H MET A 26 3.935 2.429 -8.852 1.00 0.00 H new ATOM 0 HA MET A 26 1.326 1.678 -9.553 1.00 0.00 H new ATOM 0 HB2 MET A 26 2.737 4.222 -8.783 1.00 0.00 H new ATOM 0 HB3 MET A 26 1.100 4.330 -9.400 1.00 0.00 H new ATOM 0 HG2 MET A 26 0.821 2.319 -7.557 1.00 0.00 H new ATOM 0 HG3 MET A 26 2.089 3.272 -6.813 1.00 0.00 H new ATOM 0 HE1 MET A 26 0.460 6.713 -6.172 1.00 0.00 H new ATOM 0 HE2 MET A 26 1.881 5.660 -5.978 1.00 0.00 H new ATOM 0 HE3 MET A 26 1.458 6.296 -7.585 1.00 0.00 H new ATOM 374 N THR A 27 2.836 3.633 -11.759 1.00 0.00 N ATOM 375 CA THR A 27 2.800 4.071 -13.149 1.00 0.00 C ATOM 376 C THR A 27 3.039 2.901 -14.100 1.00 0.00 C ATOM 377 O THR A 27 2.630 2.940 -15.260 1.00 0.00 O ATOM 378 CB THR A 27 3.847 5.161 -13.390 1.00 0.00 C ATOM 379 OG1 THR A 27 5.144 4.691 -13.068 1.00 0.00 O ATOM 380 CG2 THR A 27 3.600 6.418 -12.585 1.00 0.00 C ATOM 0 H THR A 27 3.627 3.992 -11.224 1.00 0.00 H new ATOM 0 HA THR A 27 1.808 4.477 -13.347 1.00 0.00 H new ATOM 0 HB THR A 27 3.768 5.407 -14.449 1.00 0.00 H new ATOM 0 HG1 THR A 27 5.268 4.714 -12.096 1.00 0.00 H new ATOM 0 HG21 THR A 27 4.379 7.149 -12.804 1.00 0.00 H new ATOM 0 HG22 THR A 27 2.628 6.834 -12.849 1.00 0.00 H new ATOM 0 HG23 THR A 27 3.616 6.178 -11.522 1.00 0.00 H new ATOM 388 N ASP A 28 3.703 1.861 -13.602 1.00 0.00 N ATOM 389 CA ASP A 28 3.994 0.680 -14.408 1.00 0.00 C ATOM 390 C ASP A 28 2.718 0.101 -15.012 1.00 0.00 C ATOM 391 O ASP A 28 1.612 0.433 -14.587 1.00 0.00 O ATOM 392 CB ASP A 28 4.699 -0.380 -13.559 1.00 0.00 C ATOM 393 CG ASP A 28 5.943 -0.928 -14.233 1.00 0.00 C ATOM 394 OD1 ASP A 28 5.837 -1.388 -15.389 1.00 0.00 O ATOM 395 OD2 ASP A 28 7.021 -0.896 -13.605 1.00 0.00 O ATOM 0 H ASP A 28 4.049 1.813 -12.644 1.00 0.00 H new ATOM 0 HA ASP A 28 4.653 0.981 -15.223 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.971 0.052 -12.596 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.008 -1.198 -13.357 1.00 0.00 H new ATOM 400 N LYS A 29 2.880 -0.767 -16.005 1.00 0.00 N ATOM 401 CA LYS A 29 1.741 -1.393 -16.669 1.00 0.00 C ATOM 402 C LYS A 29 1.747 -2.902 -16.454 1.00 0.00 C ATOM 403 O LYS A 29 0.762 -3.478 -15.991 1.00 0.00 O ATOM 404 CB LYS A 29 1.762 -1.080 -18.166 1.00 0.00 C ATOM 405 CG LYS A 29 1.456 0.374 -18.487 1.00 0.00 C ATOM 406 CD LYS A 29 1.190 0.572 -19.971 1.00 0.00 C ATOM 407 CE LYS A 29 0.178 1.680 -20.212 1.00 0.00 C ATOM 408 NZ LYS A 29 0.651 2.989 -19.680 1.00 0.00 N ATOM 0 H LYS A 29 3.789 -1.053 -16.368 1.00 0.00 H new ATOM 0 HA LYS A 29 0.829 -0.986 -16.232 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.743 -1.334 -18.568 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.036 -1.716 -18.672 1.00 0.00 H new ATOM 0 HG2 LYS A 29 0.588 0.699 -17.914 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.294 1.000 -18.180 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.123 0.813 -20.480 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.822 -0.359 -20.403 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.014 1.770 -21.281 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.768 1.417 -19.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.009 3.739 -19.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.696 2.946 -18.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 1.597 3.197 -20.059 1.00 0.00 H new ATOM 422 N ASN A 30 2.864 -3.538 -16.792 1.00 0.00 N ATOM 423 CA ASN A 30 2.998 -4.983 -16.638 1.00 0.00 C ATOM 424 C ASN A 30 2.901 -5.385 -15.169 1.00 0.00 C ATOM 425 O ASN A 30 2.119 -6.264 -14.806 1.00 0.00 O ATOM 426 CB ASN A 30 4.330 -5.457 -17.221 1.00 0.00 C ATOM 427 CG ASN A 30 4.239 -6.853 -17.808 1.00 0.00 C ATOM 428 OD1 ASN A 30 3.165 -7.299 -18.213 1.00 0.00 O ATOM 429 ND2 ASN A 30 5.368 -7.549 -17.857 1.00 0.00 N ATOM 0 H ASN A 30 3.689 -3.076 -17.174 1.00 0.00 H new ATOM 0 HA ASN A 30 2.181 -5.459 -17.181 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.653 -4.761 -17.995 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.091 -5.443 -16.441 1.00 0.00 H new ATOM 0 HD21 ASN A 30 5.369 -8.494 -18.242 1.00 0.00 H new ATOM 0 HD22 ASN A 30 6.235 -7.139 -17.510 1.00 0.00 H new ATOM 436 N ILE A 31 3.701 -4.736 -14.329 1.00 0.00 N ATOM 437 CA ILE A 31 3.705 -5.027 -12.900 1.00 0.00 C ATOM 438 C ILE A 31 2.538 -4.345 -12.196 1.00 0.00 C ATOM 439 O ILE A 31 2.503 -3.120 -12.077 1.00 0.00 O ATOM 440 CB ILE A 31 5.022 -4.579 -12.239 1.00 0.00 C ATOM 441 CG1 ILE A 31 6.221 -5.083 -13.045 1.00 0.00 C ATOM 442 CG2 ILE A 31 5.092 -5.080 -10.805 1.00 0.00 C ATOM 443 CD1 ILE A 31 7.553 -4.588 -12.523 1.00 0.00 C ATOM 0 H ILE A 31 4.354 -4.006 -14.613 1.00 0.00 H new ATOM 0 HA ILE A 31 3.605 -6.108 -12.798 1.00 0.00 H new ATOM 0 HB ILE A 31 5.051 -3.489 -12.224 1.00 0.00 H new ATOM 0 HG12 ILE A 31 6.220 -6.173 -13.039 1.00 0.00 H new ATOM 0 HG13 ILE A 31 6.108 -4.770 -14.083 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.028 -4.755 -10.351 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.254 -4.675 -10.237 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.044 -6.169 -10.797 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.357 -4.985 -13.143 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.574 -3.499 -12.555 1.00 0.00 H new ATOM 0 HD13 ILE A 31 7.688 -4.923 -11.495 1.00 0.00 H new ATOM 455 N SER A 32 1.586 -5.145 -11.729 1.00 0.00 N ATOM 456 CA SER A 32 0.417 -4.618 -11.034 1.00 0.00 C ATOM 457 C SER A 32 0.742 -4.325 -9.573 1.00 0.00 C ATOM 458 O SER A 32 1.820 -4.667 -9.086 1.00 0.00 O ATOM 459 CB SER A 32 -0.746 -5.609 -11.123 1.00 0.00 C ATOM 460 OG SER A 32 -1.594 -5.303 -12.216 1.00 0.00 O ATOM 0 H SER A 32 1.601 -6.161 -11.819 1.00 0.00 H new ATOM 0 HA SER A 32 0.126 -3.685 -11.517 1.00 0.00 H new ATOM 0 HB2 SER A 32 -0.358 -6.622 -11.232 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.319 -5.586 -10.196 1.00 0.00 H new ATOM 0 HG SER A 32 -2.328 -5.951 -12.252 1.00 0.00 H new ATOM 466 N LEU A 33 -0.196 -3.691 -8.878 1.00 0.00 N ATOM 467 CA LEU A 33 -0.008 -3.353 -7.471 1.00 0.00 C ATOM 468 C LEU A 33 -1.256 -2.688 -6.899 1.00 0.00 C ATOM 469 O LEU A 33 -1.936 -1.925 -7.585 1.00 0.00 O ATOM 470 CB LEU A 33 1.199 -2.427 -7.307 1.00 0.00 C ATOM 471 CG LEU A 33 1.465 -1.958 -5.875 1.00 0.00 C ATOM 472 CD1 LEU A 33 2.401 -2.923 -5.163 1.00 0.00 C ATOM 473 CD2 LEU A 33 2.046 -0.551 -5.875 1.00 0.00 C ATOM 0 H LEU A 33 -1.094 -3.401 -9.265 1.00 0.00 H new ATOM 0 HA LEU A 33 0.172 -4.277 -6.921 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.086 -2.943 -7.675 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.054 -1.551 -7.939 1.00 0.00 H new ATOM 0 HG LEU A 33 0.518 -1.939 -5.336 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.579 -2.574 -4.146 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.948 -3.914 -5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.348 -2.974 -5.700 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.229 -0.233 -4.849 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.984 -0.545 -6.430 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.341 0.134 -6.347 1.00 0.00 H new ATOM 485 N ILE A 34 -1.550 -2.981 -5.637 1.00 0.00 N ATOM 486 CA ILE A 34 -2.715 -2.411 -4.970 1.00 0.00 C ATOM 487 C ILE A 34 -2.327 -1.766 -3.644 1.00 0.00 C ATOM 488 O ILE A 34 -1.417 -2.232 -2.958 1.00 0.00 O ATOM 489 CB ILE A 34 -3.795 -3.480 -4.712 1.00 0.00 C ATOM 490 CG1 ILE A 34 -4.089 -4.259 -5.995 1.00 0.00 C ATOM 491 CG2 ILE A 34 -5.064 -2.831 -4.175 1.00 0.00 C ATOM 492 CD1 ILE A 34 -5.122 -5.350 -5.816 1.00 0.00 C ATOM 0 H ILE A 34 -0.997 -3.610 -5.055 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.121 -1.650 -5.637 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.423 -4.179 -3.963 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -4.435 -3.565 -6.761 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -3.163 -4.703 -6.361 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.818 -3.598 -3.997 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.842 -2.317 -3.240 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.441 -2.113 -4.903 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.280 -5.861 -6.766 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.770 -6.066 -5.073 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.061 -4.910 -5.479 1.00 0.00 H new ATOM 504 N ILE A 35 -3.023 -0.692 -3.288 1.00 0.00 N ATOM 505 CA ILE A 35 -2.753 0.018 -2.043 1.00 0.00 C ATOM 506 C ILE A 35 -3.961 -0.022 -1.116 1.00 0.00 C ATOM 507 O ILE A 35 -5.106 -0.020 -1.570 1.00 0.00 O ATOM 508 CB ILE A 35 -2.369 1.488 -2.306 1.00 0.00 C ATOM 509 CG1 ILE A 35 -1.271 1.573 -3.369 1.00 0.00 C ATOM 510 CG2 ILE A 35 -1.918 2.156 -1.014 1.00 0.00 C ATOM 511 CD1 ILE A 35 -1.548 2.604 -4.442 1.00 0.00 C ATOM 0 H ILE A 35 -3.779 -0.294 -3.845 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.914 -0.488 -1.565 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.247 2.015 -2.679 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -0.324 1.810 -2.884 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.153 0.596 -3.837 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.650 3.193 -1.215 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.729 2.125 -0.286 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -1.052 1.628 -0.615 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.729 2.610 -5.161 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.478 2.356 -4.953 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.637 3.590 -3.985 1.00 0.00 H new ATOM 523 N MET A 36 -3.700 -0.059 0.187 1.00 0.00 N ATOM 524 CA MET A 36 -4.769 -0.099 1.179 1.00 0.00 C ATOM 525 C MET A 36 -4.509 0.903 2.299 1.00 0.00 C ATOM 526 O MET A 36 -3.370 1.087 2.730 1.00 0.00 O ATOM 527 CB MET A 36 -4.900 -1.507 1.760 1.00 0.00 C ATOM 528 CG MET A 36 -5.127 -2.581 0.710 1.00 0.00 C ATOM 529 SD MET A 36 -5.429 -4.207 1.430 1.00 0.00 S ATOM 530 CE MET A 36 -5.637 -5.199 -0.046 1.00 0.00 C ATOM 0 H MET A 36 -2.759 -0.062 0.580 1.00 0.00 H new ATOM 0 HA MET A 36 -5.702 0.171 0.683 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.996 -1.745 2.321 1.00 0.00 H new ATOM 0 HB3 MET A 36 -5.728 -1.523 2.468 1.00 0.00 H new ATOM 0 HG2 MET A 36 -5.977 -2.301 0.087 1.00 0.00 H new ATOM 0 HG3 MET A 36 -4.256 -2.634 0.056 1.00 0.00 H new ATOM 0 HE1 MET A 36 -6.198 -6.101 0.198 1.00 0.00 H new ATOM 0 HE2 MET A 36 -6.181 -4.625 -0.797 1.00 0.00 H new ATOM 0 HE3 MET A 36 -4.659 -5.476 -0.439 1.00 0.00 H new ATOM 540 N ASP A 37 -5.572 1.548 2.767 1.00 0.00 N ATOM 541 CA ASP A 37 -5.460 2.532 3.837 1.00 0.00 C ATOM 542 C ASP A 37 -5.726 1.889 5.195 1.00 0.00 C ATOM 543 O ASP A 37 -6.877 1.720 5.597 1.00 0.00 O ATOM 544 CB ASP A 37 -6.439 3.684 3.604 1.00 0.00 C ATOM 545 CG ASP A 37 -5.800 4.842 2.861 1.00 0.00 C ATOM 546 OD1 ASP A 37 -4.990 5.567 3.476 1.00 0.00 O ATOM 547 OD2 ASP A 37 -6.114 5.026 1.666 1.00 0.00 O ATOM 0 H ASP A 37 -6.521 1.407 2.422 1.00 0.00 H new ATOM 0 HA ASP A 37 -4.443 2.924 3.833 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.296 3.320 3.037 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.818 4.036 4.564 1.00 0.00 H new ATOM 552 N ALA A 38 -4.654 1.534 5.897 1.00 0.00 N ATOM 553 CA ALA A 38 -4.773 0.910 7.209 1.00 0.00 C ATOM 554 C ALA A 38 -5.093 1.945 8.282 1.00 0.00 C ATOM 555 O ALA A 38 -4.313 2.157 9.210 1.00 0.00 O ATOM 556 CB ALA A 38 -3.495 0.161 7.555 1.00 0.00 C ATOM 0 H ALA A 38 -3.694 1.668 5.579 1.00 0.00 H new ATOM 0 HA ALA A 38 -5.598 0.198 7.173 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -3.598 -0.300 8.537 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -3.313 -0.612 6.809 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -2.657 0.858 7.567 1.00 0.00 H new ATOM 562 N ARG A 39 -6.250 2.585 8.148 1.00 0.00 N ATOM 563 CA ARG A 39 -6.680 3.596 9.105 1.00 0.00 C ATOM 564 C ARG A 39 -8.190 3.532 9.318 1.00 0.00 C ATOM 565 O ARG A 39 -8.857 2.623 8.827 1.00 0.00 O ATOM 566 CB ARG A 39 -6.280 4.990 8.618 1.00 0.00 C ATOM 567 CG ARG A 39 -4.803 5.121 8.286 1.00 0.00 C ATOM 568 CD ARG A 39 -4.553 4.986 6.793 1.00 0.00 C ATOM 569 NE ARG A 39 -5.320 5.961 6.020 1.00 0.00 N ATOM 570 CZ ARG A 39 -5.005 7.250 5.932 1.00 0.00 C ATOM 571 NH1 ARG A 39 -3.941 7.726 6.566 1.00 0.00 N ATOM 572 NH2 ARG A 39 -5.757 8.067 5.207 1.00 0.00 N ATOM 0 H ARG A 39 -6.907 2.421 7.385 1.00 0.00 H new ATOM 0 HA ARG A 39 -6.187 3.396 10.057 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -6.866 5.238 7.733 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -6.537 5.721 9.385 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -4.436 6.087 8.631 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -4.240 4.356 8.821 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -3.490 5.117 6.590 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -4.817 3.979 6.471 1.00 0.00 H new ATOM 0 HE ARG A 39 -6.146 5.633 5.518 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -3.359 7.102 7.125 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -3.705 8.716 6.494 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -6.576 7.707 4.718 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -5.516 9.056 5.139 1.00 0.00 H new ATOM 586 N ARG A 40 -8.721 4.504 10.053 1.00 0.00 N ATOM 587 CA ARG A 40 -10.151 4.557 10.328 1.00 0.00 C ATOM 588 C ARG A 40 -10.949 4.682 9.034 1.00 0.00 C ATOM 589 O ARG A 40 -10.386 4.630 7.940 1.00 0.00 O ATOM 590 CB ARG A 40 -10.471 5.731 11.256 1.00 0.00 C ATOM 591 CG ARG A 40 -10.588 5.334 12.719 1.00 0.00 C ATOM 592 CD ARG A 40 -10.013 6.403 13.634 1.00 0.00 C ATOM 593 NE ARG A 40 -9.743 5.888 14.974 1.00 0.00 N ATOM 594 CZ ARG A 40 -8.792 4.998 15.248 1.00 0.00 C ATOM 595 NH1 ARG A 40 -8.018 4.524 14.279 1.00 0.00 N ATOM 596 NH2 ARG A 40 -8.613 4.583 16.495 1.00 0.00 N ATOM 0 H ARG A 40 -8.183 5.264 10.468 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.436 3.627 10.821 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -9.692 6.487 11.154 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -11.406 6.192 10.937 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.635 5.165 12.969 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.065 4.392 12.884 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.091 6.792 13.202 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -10.711 7.238 13.700 1.00 0.00 H new ATOM 0 HE ARG A 40 -10.317 6.230 15.745 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -8.151 4.842 13.319 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.291 3.842 14.495 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -9.204 4.946 17.243 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -7.884 3.901 16.706 1.00 0.00 H new ATOM 610 N MET A 41 -12.261 4.846 9.165 1.00 0.00 N ATOM 611 CA MET A 41 -13.135 4.978 8.004 1.00 0.00 C ATOM 612 C MET A 41 -13.261 6.437 7.582 1.00 0.00 C ATOM 613 O MET A 41 -13.424 6.740 6.399 1.00 0.00 O ATOM 614 CB MET A 41 -14.518 4.402 8.313 1.00 0.00 C ATOM 615 CG MET A 41 -15.161 3.697 7.131 1.00 0.00 C ATOM 616 SD MET A 41 -16.489 2.581 7.625 1.00 0.00 S ATOM 617 CE MET A 41 -16.514 1.450 6.237 1.00 0.00 C ATOM 0 H MET A 41 -12.743 4.891 10.063 1.00 0.00 H new ATOM 0 HA MET A 41 -12.692 4.418 7.181 1.00 0.00 H new ATOM 0 HB2 MET A 41 -14.433 3.699 9.142 1.00 0.00 H new ATOM 0 HB3 MET A 41 -15.172 5.208 8.644 1.00 0.00 H new ATOM 0 HG2 MET A 41 -15.556 4.442 6.440 1.00 0.00 H new ATOM 0 HG3 MET A 41 -14.400 3.133 6.591 1.00 0.00 H new ATOM 0 HE1 MET A 41 -17.069 0.552 6.509 1.00 0.00 H new ATOM 0 HE2 MET A 41 -16.996 1.930 5.385 1.00 0.00 H new ATOM 0 HE3 MET A 41 -15.493 1.179 5.970 1.00 0.00 H new ATOM 627 N GLN A 42 -13.187 7.338 8.555 1.00 0.00 N ATOM 628 CA GLN A 42 -13.294 8.767 8.285 1.00 0.00 C ATOM 629 C GLN A 42 -12.048 9.281 7.570 1.00 0.00 C ATOM 630 O GLN A 42 -12.118 10.222 6.780 1.00 0.00 O ATOM 631 CB GLN A 42 -13.502 9.539 9.589 1.00 0.00 C ATOM 632 CG GLN A 42 -13.755 11.024 9.382 1.00 0.00 C ATOM 633 CD GLN A 42 -13.719 11.807 10.680 1.00 0.00 C ATOM 634 OE1 GLN A 42 -13.362 11.274 11.731 1.00 0.00 O ATOM 635 NE2 GLN A 42 -14.088 13.081 10.613 1.00 0.00 N ATOM 0 H GLN A 42 -13.053 7.104 9.539 1.00 0.00 H new ATOM 0 HA GLN A 42 -14.155 8.925 7.635 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -14.345 9.107 10.127 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -12.623 9.413 10.221 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -13.006 11.425 8.699 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -14.726 11.161 8.906 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -14.377 13.482 9.721 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -14.083 13.658 11.454 1.00 0.00 H new ATOM 644 N ASP A 43 -10.910 8.658 7.853 1.00 0.00 N ATOM 645 CA ASP A 43 -9.648 9.053 7.237 1.00 0.00 C ATOM 646 C ASP A 43 -9.719 8.926 5.718 1.00 0.00 C ATOM 647 O ASP A 43 -9.291 9.821 4.990 1.00 0.00 O ATOM 648 CB ASP A 43 -8.502 8.198 7.778 1.00 0.00 C ATOM 649 CG ASP A 43 -7.979 8.705 9.109 1.00 0.00 C ATOM 650 OD1 ASP A 43 -7.267 9.730 9.114 1.00 0.00 O ATOM 651 OD2 ASP A 43 -8.282 8.076 10.144 1.00 0.00 O ATOM 0 H ASP A 43 -10.835 7.877 8.505 1.00 0.00 H new ATOM 0 HA ASP A 43 -9.463 10.097 7.488 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -8.843 7.169 7.893 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -7.689 8.185 7.053 1.00 0.00 H new ATOM 656 N TYR A 44 -10.263 7.808 5.248 1.00 0.00 N ATOM 657 CA TYR A 44 -10.388 7.564 3.815 1.00 0.00 C ATOM 658 C TYR A 44 -11.336 8.572 3.173 1.00 0.00 C ATOM 659 O TYR A 44 -11.013 9.178 2.150 1.00 0.00 O ATOM 660 CB TYR A 44 -10.890 6.141 3.561 1.00 0.00 C ATOM 661 CG TYR A 44 -11.032 5.801 2.095 1.00 0.00 C ATOM 662 CD1 TYR A 44 -9.922 5.770 1.259 1.00 0.00 C ATOM 663 CD2 TYR A 44 -12.274 5.511 1.546 1.00 0.00 C ATOM 664 CE1 TYR A 44 -10.047 5.460 -0.083 1.00 0.00 C ATOM 665 CE2 TYR A 44 -12.408 5.199 0.206 1.00 0.00 C ATOM 666 CZ TYR A 44 -11.292 5.175 -0.604 1.00 0.00 C ATOM 667 OH TYR A 44 -11.421 4.867 -1.938 1.00 0.00 O ATOM 0 H TYR A 44 -10.624 7.058 5.837 1.00 0.00 H new ATOM 0 HA TYR A 44 -9.403 7.680 3.364 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -10.202 5.434 4.024 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -11.856 6.013 4.050 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -8.946 5.992 1.664 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -13.150 5.530 2.177 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -9.175 5.441 -0.720 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -13.382 4.975 -0.204 1.00 0.00 H new ATOM 0 HH TYR A 44 -12.363 4.691 -2.144 1.00 0.00 H new ATOM 677 N GLN A 45 -12.505 8.748 3.779 1.00 0.00 N ATOM 678 CA GLN A 45 -13.499 9.683 3.266 1.00 0.00 C ATOM 679 C GLN A 45 -12.938 11.101 3.210 1.00 0.00 C ATOM 680 O GLN A 45 -13.329 11.901 2.361 1.00 0.00 O ATOM 681 CB GLN A 45 -14.756 9.653 4.138 1.00 0.00 C ATOM 682 CG GLN A 45 -15.352 8.265 4.298 1.00 0.00 C ATOM 683 CD GLN A 45 -15.861 7.693 2.989 1.00 0.00 C ATOM 684 OE1 GLN A 45 -15.124 7.610 2.007 1.00 0.00 O ATOM 685 NE2 GLN A 45 -17.129 7.298 2.969 1.00 0.00 N ATOM 0 H GLN A 45 -12.787 8.255 4.626 1.00 0.00 H new ATOM 0 HA GLN A 45 -13.760 9.376 2.253 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -14.514 10.051 5.123 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -15.506 10.313 3.703 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.598 7.596 4.714 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -16.172 8.306 5.015 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -17.704 7.385 3.807 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -17.528 6.907 2.116 1.00 0.00 H new ATOM 694 N ASP A 46 -12.021 11.405 4.123 1.00 0.00 N ATOM 695 CA ASP A 46 -11.406 12.726 4.177 1.00 0.00 C ATOM 696 C ASP A 46 -10.188 12.799 3.261 1.00 0.00 C ATOM 697 O ASP A 46 -10.163 13.576 2.307 1.00 0.00 O ATOM 698 CB ASP A 46 -11.000 13.064 5.613 1.00 0.00 C ATOM 699 CG ASP A 46 -11.238 14.522 5.952 1.00 0.00 C ATOM 700 OD1 ASP A 46 -12.347 14.850 6.424 1.00 0.00 O ATOM 701 OD2 ASP A 46 -10.314 15.337 5.746 1.00 0.00 O ATOM 0 H ASP A 46 -11.688 10.755 4.835 1.00 0.00 H new ATOM 0 HA ASP A 46 -12.140 13.455 3.833 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.563 12.436 6.304 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.945 12.828 5.755 1.00 0.00 H new ATOM 706 N SER A 47 -9.180 11.986 3.559 1.00 0.00 N ATOM 707 CA SER A 47 -7.958 11.959 2.764 1.00 0.00 C ATOM 708 C SER A 47 -7.618 10.535 2.337 1.00 0.00 C ATOM 709 O SER A 47 -7.624 9.613 3.152 1.00 0.00 O ATOM 710 CB SER A 47 -6.796 12.558 3.556 1.00 0.00 C ATOM 711 OG SER A 47 -6.657 13.943 3.290 1.00 0.00 O ATOM 0 H SER A 47 -9.185 11.337 4.346 1.00 0.00 H new ATOM 0 HA SER A 47 -8.124 12.557 1.868 1.00 0.00 H new ATOM 0 HB2 SER A 47 -6.961 12.404 4.622 1.00 0.00 H new ATOM 0 HB3 SER A 47 -5.872 12.041 3.299 1.00 0.00 H new ATOM 0 HG SER A 47 -5.908 14.302 3.810 1.00 0.00 H new ATOM 717 N CYS A 48 -7.319 10.363 1.053 1.00 0.00 N ATOM 718 CA CYS A 48 -6.975 9.050 0.517 1.00 0.00 C ATOM 719 C CYS A 48 -6.195 9.183 -0.787 1.00 0.00 C ATOM 720 O CYS A 48 -6.431 10.100 -1.573 1.00 0.00 O ATOM 721 CB CYS A 48 -8.240 8.222 0.286 1.00 0.00 C ATOM 722 SG CYS A 48 -9.545 9.100 -0.607 1.00 0.00 S ATOM 0 H CYS A 48 -7.308 11.116 0.365 1.00 0.00 H new ATOM 0 HA CYS A 48 -6.345 8.541 1.247 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -7.976 7.323 -0.270 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -8.630 7.897 1.251 1.00 0.00 H new ATOM 0 HG CYS A 48 -9.148 10.308 -0.878 1.00 0.00 H new ATOM 728 N ILE A 49 -5.264 8.261 -1.009 1.00 0.00 N ATOM 729 CA ILE A 49 -4.447 8.275 -2.218 1.00 0.00 C ATOM 730 C ILE A 49 -5.251 7.813 -3.429 1.00 0.00 C ATOM 731 O ILE A 49 -6.073 6.903 -3.330 1.00 0.00 O ATOM 732 CB ILE A 49 -3.204 7.377 -2.067 1.00 0.00 C ATOM 733 CG1 ILE A 49 -2.479 7.688 -0.757 1.00 0.00 C ATOM 734 CG2 ILE A 49 -2.270 7.563 -3.253 1.00 0.00 C ATOM 735 CD1 ILE A 49 -1.290 6.789 -0.496 1.00 0.00 C ATOM 0 H ILE A 49 -5.056 7.495 -0.368 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.125 9.305 -2.370 1.00 0.00 H new ATOM 0 HB ILE A 49 -3.527 6.336 -2.043 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -2.143 8.725 -0.774 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.183 7.595 0.070 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -1.397 6.922 -3.132 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -2.792 7.296 -4.172 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -1.952 8.604 -3.306 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -0.824 7.067 0.450 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -1.622 5.752 -0.446 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -0.566 6.900 -1.303 1.00 0.00 H new ATOM 747 N LEU A 50 -5.006 8.445 -4.571 1.00 0.00 N ATOM 748 CA LEU A 50 -5.706 8.099 -5.803 1.00 0.00 C ATOM 749 C LEU A 50 -5.348 6.686 -6.254 1.00 0.00 C ATOM 750 O LEU A 50 -4.214 6.239 -6.083 1.00 0.00 O ATOM 751 CB LEU A 50 -5.364 9.102 -6.906 1.00 0.00 C ATOM 752 CG LEU A 50 -5.783 10.545 -6.621 1.00 0.00 C ATOM 753 CD1 LEU A 50 -4.784 11.521 -7.222 1.00 0.00 C ATOM 754 CD2 LEU A 50 -7.181 10.810 -7.161 1.00 0.00 C ATOM 0 H LEU A 50 -4.328 9.200 -4.670 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.777 8.137 -5.606 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.288 9.079 -7.076 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.840 8.778 -7.831 1.00 0.00 H new ATOM 0 HG LEU A 50 -5.797 10.692 -5.541 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.100 12.542 -7.009 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.799 11.347 -6.788 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.736 11.374 -8.301 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.463 11.841 -6.950 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.192 10.644 -8.238 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.890 10.134 -6.682 1.00 0.00 H new ATOM 766 N HIS A 51 -6.322 5.990 -6.829 1.00 0.00 N ATOM 767 CA HIS A 51 -6.110 4.628 -7.305 1.00 0.00 C ATOM 768 C HIS A 51 -5.698 3.709 -6.159 1.00 0.00 C ATOM 769 O HIS A 51 -4.893 2.797 -6.342 1.00 0.00 O ATOM 770 CB HIS A 51 -5.042 4.608 -8.399 1.00 0.00 C ATOM 771 CG HIS A 51 -5.233 5.666 -9.443 1.00 0.00 C ATOM 772 ND1 HIS A 51 -6.458 6.015 -9.966 1.00 0.00 N ATOM 773 CD2 HIS A 51 -4.322 6.459 -10.061 1.00 0.00 C ATOM 774 CE1 HIS A 51 -6.257 6.986 -10.867 1.00 0.00 C ATOM 775 NE2 HIS A 51 -4.978 7.293 -10.962 1.00 0.00 N ATOM 0 H HIS A 51 -7.266 6.346 -6.977 1.00 0.00 H new ATOM 0 HA HIS A 51 -7.050 4.264 -7.719 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -4.061 4.735 -7.940 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -5.045 3.630 -8.880 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -3.257 6.445 -9.882 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -7.041 7.457 -11.441 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -4.557 7.996 -11.570 1.00 0.00 H new ATOM 783 N SER A 52 -6.255 3.957 -4.979 1.00 0.00 N ATOM 784 CA SER A 52 -5.944 3.152 -3.802 1.00 0.00 C ATOM 785 C SER A 52 -7.212 2.547 -3.207 1.00 0.00 C ATOM 786 O SER A 52 -8.316 3.038 -3.441 1.00 0.00 O ATOM 787 CB SER A 52 -5.230 4.003 -2.751 1.00 0.00 C ATOM 788 OG SER A 52 -6.154 4.780 -2.009 1.00 0.00 O ATOM 0 H SER A 52 -6.924 4.708 -4.811 1.00 0.00 H new ATOM 0 HA SER A 52 -5.285 2.340 -4.111 1.00 0.00 H new ATOM 0 HB2 SER A 52 -4.669 3.357 -2.076 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.508 4.658 -3.239 1.00 0.00 H new ATOM 0 HG SER A 52 -6.428 5.557 -2.539 1.00 0.00 H new ATOM 794 N LEU A 53 -7.044 1.477 -2.436 1.00 0.00 N ATOM 795 CA LEU A 53 -8.173 0.804 -1.805 1.00 0.00 C ATOM 796 C LEU A 53 -8.409 1.340 -0.397 1.00 0.00 C ATOM 797 O LEU A 53 -7.542 1.993 0.183 1.00 0.00 O ATOM 798 CB LEU A 53 -7.931 -0.706 -1.756 1.00 0.00 C ATOM 799 CG LEU A 53 -9.172 -1.550 -1.466 1.00 0.00 C ATOM 800 CD1 LEU A 53 -10.283 -1.223 -2.453 1.00 0.00 C ATOM 801 CD2 LEU A 53 -8.831 -3.032 -1.518 1.00 0.00 C ATOM 0 H LEU A 53 -6.136 1.058 -2.233 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.063 1.003 -2.403 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -7.510 -1.022 -2.710 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.182 -0.914 -0.992 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.524 -1.312 -0.462 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.158 -1.833 -2.231 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.545 -0.168 -2.369 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.942 -1.433 -3.467 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.726 -3.619 -1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -8.455 -3.284 -2.509 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -8.068 -3.256 -0.773 1.00 0.00 H new ATOM 813 N SER A 54 -9.590 1.060 0.148 1.00 0.00 N ATOM 814 CA SER A 54 -9.940 1.514 1.489 1.00 0.00 C ATOM 815 C SER A 54 -10.142 0.330 2.429 1.00 0.00 C ATOM 816 O SER A 54 -10.491 -0.768 1.995 1.00 0.00 O ATOM 817 CB SER A 54 -11.209 2.367 1.446 1.00 0.00 C ATOM 818 OG SER A 54 -11.775 2.508 2.737 1.00 0.00 O ATOM 0 H SER A 54 -10.320 0.521 -0.319 1.00 0.00 H new ATOM 0 HA SER A 54 -9.116 2.119 1.867 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.976 3.351 1.039 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.936 1.909 0.775 1.00 0.00 H new ATOM 0 HG SER A 54 -12.100 3.425 2.853 1.00 0.00 H new ATOM 824 N VAL A 55 -9.922 0.561 3.719 1.00 0.00 N ATOM 825 CA VAL A 55 -10.080 -0.484 4.722 1.00 0.00 C ATOM 826 C VAL A 55 -10.008 0.097 6.136 1.00 0.00 C ATOM 827 O VAL A 55 -8.944 0.525 6.583 1.00 0.00 O ATOM 828 CB VAL A 55 -9.002 -1.577 4.566 1.00 0.00 C ATOM 829 CG1 VAL A 55 -7.610 -0.993 4.753 1.00 0.00 C ATOM 830 CG2 VAL A 55 -9.247 -2.718 5.545 1.00 0.00 C ATOM 0 H VAL A 55 -9.633 1.464 4.094 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.062 -0.931 4.567 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.067 -1.978 3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.866 -1.782 4.639 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.437 -0.219 4.005 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.528 -0.559 5.750 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.476 -3.478 5.418 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -9.215 -2.335 6.565 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -10.225 -3.158 5.353 1.00 0.00 H new ATOM 840 N PRO A 56 -11.142 0.124 6.860 1.00 0.00 N ATOM 841 CA PRO A 56 -11.191 0.659 8.225 1.00 0.00 C ATOM 842 C PRO A 56 -10.416 -0.205 9.213 1.00 0.00 C ATOM 843 O PRO A 56 -10.124 -1.370 8.940 1.00 0.00 O ATOM 844 CB PRO A 56 -12.684 0.652 8.562 1.00 0.00 C ATOM 845 CG PRO A 56 -13.269 -0.393 7.677 1.00 0.00 C ATOM 846 CD PRO A 56 -12.461 -0.362 6.411 1.00 0.00 C ATOM 0 HA PRO A 56 -10.734 1.646 8.291 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -12.851 0.419 9.614 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -13.136 1.626 8.376 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -13.220 -1.375 8.147 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -14.320 -0.189 7.474 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -12.391 -1.349 5.954 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -12.903 0.302 5.668 1.00 0.00 H new ATOM 854 N GLU A 57 -10.083 0.373 10.364 1.00 0.00 N ATOM 855 CA GLU A 57 -9.339 -0.343 11.393 1.00 0.00 C ATOM 856 C GLU A 57 -10.271 -1.197 12.246 1.00 0.00 C ATOM 857 O GLU A 57 -9.875 -2.247 12.753 1.00 0.00 O ATOM 858 CB GLU A 57 -8.580 0.645 12.282 1.00 0.00 C ATOM 859 CG GLU A 57 -7.751 -0.024 13.366 1.00 0.00 C ATOM 860 CD GLU A 57 -7.809 0.720 14.686 1.00 0.00 C ATOM 861 OE1 GLU A 57 -7.985 1.957 14.663 1.00 0.00 O ATOM 862 OE2 GLU A 57 -7.678 0.067 15.742 1.00 0.00 O ATOM 0 H GLU A 57 -10.317 1.336 10.606 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.625 -1.001 10.897 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -7.925 1.253 11.658 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -9.294 1.323 12.749 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.106 -1.044 13.512 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.714 -0.091 13.036 1.00 0.00 H new ATOM 869 N GLU A 58 -11.511 -0.743 12.401 1.00 0.00 N ATOM 870 CA GLU A 58 -12.496 -1.468 13.194 1.00 0.00 C ATOM 871 C GLU A 58 -12.721 -2.870 12.635 1.00 0.00 C ATOM 872 O GLU A 58 -13.014 -3.805 13.380 1.00 0.00 O ATOM 873 CB GLU A 58 -13.821 -0.700 13.229 1.00 0.00 C ATOM 874 CG GLU A 58 -14.506 -0.603 11.875 1.00 0.00 C ATOM 875 CD GLU A 58 -15.452 0.578 11.784 1.00 0.00 C ATOM 876 OE1 GLU A 58 -14.972 1.729 11.846 1.00 0.00 O ATOM 877 OE2 GLU A 58 -16.674 0.351 11.652 1.00 0.00 O ATOM 0 H GLU A 58 -11.857 0.123 11.988 1.00 0.00 H new ATOM 0 HA GLU A 58 -12.111 -1.560 14.210 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -14.495 -1.187 13.933 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.638 0.306 13.607 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -13.750 -0.519 11.094 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -15.059 -1.523 11.685 1.00 0.00 H new ATOM 884 N ALA A 59 -12.580 -3.008 11.322 1.00 0.00 N ATOM 885 CA ALA A 59 -12.767 -4.295 10.664 1.00 0.00 C ATOM 886 C ALA A 59 -11.568 -5.209 10.897 1.00 0.00 C ATOM 887 O ALA A 59 -11.707 -6.430 10.953 1.00 0.00 O ATOM 888 CB ALA A 59 -13.000 -4.096 9.174 1.00 0.00 C ATOM 0 H ALA A 59 -12.337 -2.244 10.692 1.00 0.00 H new ATOM 0 HA ALA A 59 -13.645 -4.774 11.097 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.138 -5.065 8.695 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -13.891 -3.486 9.023 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -12.138 -3.594 8.735 1.00 0.00 H new ATOM 894 N ILE A 60 -10.390 -4.609 11.032 1.00 0.00 N ATOM 895 CA ILE A 60 -9.166 -5.368 11.259 1.00 0.00 C ATOM 896 C ILE A 60 -8.869 -5.493 12.749 1.00 0.00 C ATOM 897 O ILE A 60 -9.075 -4.552 13.515 1.00 0.00 O ATOM 898 CB ILE A 60 -7.960 -4.714 10.558 1.00 0.00 C ATOM 899 CG1 ILE A 60 -8.281 -4.437 9.088 1.00 0.00 C ATOM 900 CG2 ILE A 60 -6.730 -5.602 10.678 1.00 0.00 C ATOM 901 CD1 ILE A 60 -7.625 -3.185 8.551 1.00 0.00 C ATOM 0 H ILE A 60 -10.257 -3.599 10.988 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.325 -6.360 10.837 1.00 0.00 H new ATOM 0 HB ILE A 60 -7.748 -3.764 11.049 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.963 -5.290 8.488 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -9.361 -4.350 8.971 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.887 -5.126 10.178 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.490 -5.751 11.731 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.931 -6.567 10.212 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.897 -3.052 7.504 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.962 -2.322 9.126 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.542 -3.277 8.636 1.00 0.00 H new ATOM 913 N SER A 61 -8.383 -6.662 13.155 1.00 0.00 N ATOM 914 CA SER A 61 -8.058 -6.910 14.554 1.00 0.00 C ATOM 915 C SER A 61 -6.820 -7.795 14.677 1.00 0.00 C ATOM 916 O SER A 61 -6.399 -8.426 13.708 1.00 0.00 O ATOM 917 CB SER A 61 -9.243 -7.566 15.267 1.00 0.00 C ATOM 918 OG SER A 61 -10.033 -6.601 15.939 1.00 0.00 O ATOM 0 H SER A 61 -8.206 -7.452 12.534 1.00 0.00 H new ATOM 0 HA SER A 61 -7.845 -5.951 15.027 1.00 0.00 H new ATOM 0 HB2 SER A 61 -9.856 -8.101 14.542 1.00 0.00 H new ATOM 0 HB3 SER A 61 -8.878 -8.303 15.982 1.00 0.00 H new ATOM 0 HG SER A 61 -10.784 -7.046 16.385 1.00 0.00 H new ATOM 924 N PRO A 62 -6.219 -7.853 15.878 1.00 0.00 N ATOM 925 CA PRO A 62 -5.024 -8.667 16.124 1.00 0.00 C ATOM 926 C PRO A 62 -5.323 -10.162 16.080 1.00 0.00 C ATOM 927 O PRO A 62 -5.762 -10.747 17.070 1.00 0.00 O ATOM 928 CB PRO A 62 -4.592 -8.250 17.533 1.00 0.00 C ATOM 929 CG PRO A 62 -5.839 -7.760 18.183 1.00 0.00 C ATOM 930 CD PRO A 62 -6.657 -7.132 17.089 1.00 0.00 C ATOM 0 HA PRO A 62 -4.259 -8.506 15.364 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -4.164 -9.090 18.080 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -3.831 -7.471 17.499 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -6.381 -8.580 18.654 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -5.613 -7.036 18.966 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -7.726 -7.255 17.265 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -6.468 -6.061 17.010 1.00 0.00 H new ATOM 938 N GLY A 63 -5.084 -10.773 14.924 1.00 0.00 N ATOM 939 CA GLY A 63 -5.334 -12.194 14.772 1.00 0.00 C ATOM 940 C GLY A 63 -6.633 -12.480 14.045 1.00 0.00 C ATOM 941 O GLY A 63 -7.557 -13.062 14.615 1.00 0.00 O ATOM 0 H GLY A 63 -4.722 -10.310 14.091 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.508 -12.649 14.225 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -5.361 -12.662 15.756 1.00 0.00 H new ATOM 945 N VAL A 64 -6.705 -12.069 12.783 1.00 0.00 N ATOM 946 CA VAL A 64 -7.900 -12.284 11.976 1.00 0.00 C ATOM 947 C VAL A 64 -7.543 -12.838 10.602 1.00 0.00 C ATOM 948 O VAL A 64 -6.371 -13.056 10.294 1.00 0.00 O ATOM 949 CB VAL A 64 -8.701 -10.980 11.799 1.00 0.00 C ATOM 950 CG1 VAL A 64 -9.250 -10.504 13.134 1.00 0.00 C ATOM 951 CG2 VAL A 64 -7.837 -9.906 11.155 1.00 0.00 C ATOM 0 H VAL A 64 -5.950 -11.585 12.297 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.515 -13.010 12.509 1.00 0.00 H new ATOM 0 HB VAL A 64 -9.544 -11.180 11.138 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.813 -9.582 12.988 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -9.907 -11.268 13.550 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.425 -10.321 13.822 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.420 -8.992 11.038 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -6.972 -9.707 11.788 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -7.499 -10.249 10.177 1.00 0.00 H new ATOM 961 N THR A 65 -8.561 -13.065 9.778 1.00 0.00 N ATOM 962 CA THR A 65 -8.355 -13.595 8.435 1.00 0.00 C ATOM 963 C THR A 65 -8.966 -12.670 7.386 1.00 0.00 C ATOM 964 O THR A 65 -9.589 -11.662 7.720 1.00 0.00 O ATOM 965 CB THR A 65 -8.965 -14.992 8.317 1.00 0.00 C ATOM 966 OG1 THR A 65 -8.876 -15.466 6.985 1.00 0.00 O ATOM 967 CG2 THR A 65 -10.420 -15.046 8.729 1.00 0.00 C ATOM 0 H THR A 65 -9.537 -12.890 10.017 1.00 0.00 H new ATOM 0 HA THR A 65 -7.282 -13.659 8.257 1.00 0.00 H new ATOM 0 HB THR A 65 -8.389 -15.618 8.998 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.933 -15.552 6.731 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.791 -16.065 8.621 1.00 0.00 H new ATOM 0 HG22 THR A 65 -10.516 -14.733 9.769 1.00 0.00 H new ATOM 0 HG23 THR A 65 -11.003 -14.379 8.094 1.00 0.00 H new ATOM 975 N ALA A 66 -8.783 -13.021 6.117 1.00 0.00 N ATOM 976 CA ALA A 66 -9.317 -12.222 5.021 1.00 0.00 C ATOM 977 C ALA A 66 -10.837 -12.137 5.093 1.00 0.00 C ATOM 978 O ALA A 66 -11.426 -11.095 4.803 1.00 0.00 O ATOM 979 CB ALA A 66 -8.882 -12.805 3.684 1.00 0.00 C ATOM 0 H ALA A 66 -8.270 -13.852 5.823 1.00 0.00 H new ATOM 0 HA ALA A 66 -8.919 -11.212 5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.287 -12.199 2.874 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -7.794 -12.808 3.625 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -9.253 -13.826 3.594 1.00 0.00 H new ATOM 985 N SER A 67 -11.469 -13.239 5.484 1.00 0.00 N ATOM 986 CA SER A 67 -12.922 -13.289 5.596 1.00 0.00 C ATOM 987 C SER A 67 -13.427 -12.260 6.604 1.00 0.00 C ATOM 988 O SER A 67 -14.486 -11.661 6.417 1.00 0.00 O ATOM 989 CB SER A 67 -13.376 -14.690 6.010 1.00 0.00 C ATOM 990 OG SER A 67 -13.663 -15.490 4.875 1.00 0.00 O ATOM 0 H SER A 67 -10.997 -14.110 5.729 1.00 0.00 H new ATOM 0 HA SER A 67 -13.344 -13.052 4.619 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.598 -15.166 6.607 1.00 0.00 H new ATOM 0 HB3 SER A 67 -14.262 -14.617 6.641 1.00 0.00 H new ATOM 0 HG SER A 67 -13.949 -16.381 5.167 1.00 0.00 H new ATOM 996 N TRP A 68 -12.661 -12.061 7.671 1.00 0.00 N ATOM 997 CA TRP A 68 -13.028 -11.105 8.709 1.00 0.00 C ATOM 998 C TRP A 68 -13.148 -9.697 8.135 1.00 0.00 C ATOM 999 O TRP A 68 -14.188 -9.051 8.259 1.00 0.00 O ATOM 1000 CB TRP A 68 -11.995 -11.123 9.837 1.00 0.00 C ATOM 1001 CG TRP A 68 -12.449 -10.406 11.071 1.00 0.00 C ATOM 1002 CD1 TRP A 68 -12.925 -9.129 11.149 1.00 0.00 C ATOM 1003 CD2 TRP A 68 -12.471 -10.925 12.406 1.00 0.00 C ATOM 1004 NE1 TRP A 68 -13.240 -8.822 12.450 1.00 0.00 N ATOM 1005 CE2 TRP A 68 -12.971 -9.908 13.242 1.00 0.00 C ATOM 1006 CE3 TRP A 68 -12.116 -12.151 12.977 1.00 0.00 C ATOM 1007 CZ2 TRP A 68 -13.125 -10.079 14.615 1.00 0.00 C ATOM 1008 CZ3 TRP A 68 -12.268 -12.320 14.340 1.00 0.00 C ATOM 1009 CH2 TRP A 68 -12.770 -11.290 15.145 1.00 0.00 C ATOM 0 H TRP A 68 -11.782 -12.549 7.840 1.00 0.00 H new ATOM 0 HA TRP A 68 -13.998 -11.397 9.110 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -11.764 -12.157 10.091 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -11.071 -10.668 9.481 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -13.037 -8.458 10.310 1.00 0.00 H new ATOM 0 HE1 TRP A 68 -13.614 -7.930 12.774 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -11.730 -12.952 12.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -13.510 -9.286 15.239 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -11.995 -13.262 14.792 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -12.879 -11.455 16.207 1.00 0.00 H new ATOM 1020 N ILE A 69 -12.075 -9.227 7.507 1.00 0.00 N ATOM 1021 CA ILE A 69 -12.058 -7.896 6.914 1.00 0.00 C ATOM 1022 C ILE A 69 -12.966 -7.828 5.690 1.00 0.00 C ATOM 1023 O ILE A 69 -13.688 -6.851 5.493 1.00 0.00 O ATOM 1024 CB ILE A 69 -10.632 -7.479 6.506 1.00 0.00 C ATOM 1025 CG1 ILE A 69 -9.658 -7.695 7.666 1.00 0.00 C ATOM 1026 CG2 ILE A 69 -10.612 -6.025 6.055 1.00 0.00 C ATOM 1027 CD1 ILE A 69 -8.359 -8.352 7.251 1.00 0.00 C ATOM 0 H ILE A 69 -11.206 -9.749 7.396 1.00 0.00 H new ATOM 0 HA ILE A 69 -12.425 -7.207 7.675 1.00 0.00 H new ATOM 0 HB ILE A 69 -10.315 -8.103 5.671 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -9.438 -6.733 8.128 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -10.141 -8.310 8.425 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.597 -5.746 5.770 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -11.276 -5.900 5.200 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -10.948 -5.386 6.872 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.718 -8.474 8.124 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.568 -9.329 6.815 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.854 -7.727 6.514 1.00 0.00 H new ATOM 1039 N GLU A 70 -12.923 -8.874 4.869 1.00 0.00 N ATOM 1040 CA GLU A 70 -13.741 -8.935 3.663 1.00 0.00 C ATOM 1041 C GLU A 70 -15.220 -8.759 3.992 1.00 0.00 C ATOM 1042 O GLU A 70 -16.002 -8.301 3.158 1.00 0.00 O ATOM 1043 CB GLU A 70 -13.523 -10.266 2.942 1.00 0.00 C ATOM 1044 CG GLU A 70 -14.101 -10.299 1.536 1.00 0.00 C ATOM 1045 CD GLU A 70 -14.540 -11.689 1.120 1.00 0.00 C ATOM 1046 OE1 GLU A 70 -13.662 -12.544 0.880 1.00 0.00 O ATOM 1047 OE2 GLU A 70 -15.764 -11.924 1.032 1.00 0.00 O ATOM 0 H GLU A 70 -12.330 -9.691 5.018 1.00 0.00 H new ATOM 0 HA GLU A 70 -13.436 -8.118 3.009 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.454 -10.471 2.891 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.973 -11.066 3.530 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.953 -9.621 1.481 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.355 -9.931 0.831 1.00 0.00 H new ATOM 1054 N ALA A 71 -15.600 -9.126 5.212 1.00 0.00 N ATOM 1055 CA ALA A 71 -16.985 -9.009 5.649 1.00 0.00 C ATOM 1056 C ALA A 71 -17.322 -7.574 6.044 1.00 0.00 C ATOM 1057 O ALA A 71 -18.472 -7.146 5.942 1.00 0.00 O ATOM 1058 CB ALA A 71 -17.253 -9.954 6.810 1.00 0.00 C ATOM 0 H ALA A 71 -14.967 -9.507 5.915 1.00 0.00 H new ATOM 0 HA ALA A 71 -17.626 -9.285 4.812 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -18.291 -9.856 7.126 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -17.065 -10.980 6.495 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -16.595 -9.704 7.642 1.00 0.00 H new ATOM 1064 N HIS A 72 -16.314 -6.835 6.499 1.00 0.00 N ATOM 1065 CA HIS A 72 -16.510 -5.449 6.912 1.00 0.00 C ATOM 1066 C HIS A 72 -15.677 -4.498 6.058 1.00 0.00 C ATOM 1067 O HIS A 72 -14.538 -4.179 6.396 1.00 0.00 O ATOM 1068 CB HIS A 72 -16.144 -5.281 8.388 1.00 0.00 C ATOM 1069 CG HIS A 72 -17.089 -5.971 9.320 1.00 0.00 C ATOM 1070 ND1 HIS A 72 -17.593 -7.231 9.280 1.00 0.00 N flip ATOM 1071 CD2 HIS A 72 -17.629 -5.382 10.443 1.00 0.00 C flip ATOM 1072 CE1 HIS A 72 -18.438 -7.420 10.370 1.00 0.00 C flip ATOM 1073 NE2 HIS A 72 -18.425 -6.282 11.036 1.00 0.00 N flip ATOM 0 H HIS A 72 -15.356 -7.172 6.591 1.00 0.00 H new ATOM 0 HA HIS A 72 -17.562 -5.201 6.772 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -15.138 -5.668 8.551 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -16.119 -4.218 8.629 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -17.444 -4.374 10.784 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -18.990 -8.314 10.619 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -18.953 -6.109 11.892 1.00 0.00 H new ATOM 1081 N LEU A 73 -16.257 -4.046 4.951 1.00 0.00 N ATOM 1082 CA LEU A 73 -15.572 -3.127 4.047 1.00 0.00 C ATOM 1083 C LEU A 73 -16.579 -2.289 3.262 1.00 0.00 C ATOM 1084 O LEU A 73 -17.766 -2.613 3.218 1.00 0.00 O ATOM 1085 CB LEU A 73 -14.674 -3.900 3.080 1.00 0.00 C ATOM 1086 CG LEU A 73 -13.307 -4.301 3.636 1.00 0.00 C ATOM 1087 CD1 LEU A 73 -12.588 -5.228 2.667 1.00 0.00 C ATOM 1088 CD2 LEU A 73 -12.462 -3.067 3.919 1.00 0.00 C ATOM 0 H LEU A 73 -17.200 -4.301 4.658 1.00 0.00 H new ATOM 0 HA LEU A 73 -14.955 -2.459 4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.199 -4.802 2.765 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -14.521 -3.293 2.188 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.461 -4.835 4.574 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -11.617 -5.503 3.079 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.185 -6.127 2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.446 -4.719 1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.493 -3.372 4.314 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.317 -2.506 2.996 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.970 -2.438 4.650 1.00 0.00 H new ATOM 1100 N PRO A 74 -16.117 -1.196 2.630 1.00 0.00 N ATOM 1101 CA PRO A 74 -16.985 -0.310 1.844 1.00 0.00 C ATOM 1102 C PRO A 74 -17.744 -1.061 0.754 1.00 0.00 C ATOM 1103 O PRO A 74 -17.870 -2.284 0.800 1.00 0.00 O ATOM 1104 CB PRO A 74 -16.009 0.691 1.218 1.00 0.00 C ATOM 1105 CG PRO A 74 -14.811 0.667 2.104 1.00 0.00 C ATOM 1106 CD PRO A 74 -14.717 -0.735 2.636 1.00 0.00 C ATOM 0 HA PRO A 74 -17.753 0.155 2.462 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -15.751 0.406 0.198 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -16.444 1.689 1.170 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.911 0.935 1.551 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.912 1.387 2.916 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -14.085 -1.362 2.007 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -14.291 -0.757 3.639 1.00 0.00 H new ATOM 1114 N ASP A 75 -18.250 -0.318 -0.225 1.00 0.00 N ATOM 1115 CA ASP A 75 -18.999 -0.913 -1.326 1.00 0.00 C ATOM 1116 C ASP A 75 -18.076 -1.291 -2.481 1.00 0.00 C ATOM 1117 O ASP A 75 -17.953 -2.465 -2.832 1.00 0.00 O ATOM 1118 CB ASP A 75 -20.076 0.055 -1.818 1.00 0.00 C ATOM 1119 CG ASP A 75 -21.313 0.037 -0.940 1.00 0.00 C ATOM 1120 OD1 ASP A 75 -21.249 0.571 0.186 1.00 0.00 O ATOM 1121 OD2 ASP A 75 -22.346 -0.510 -1.382 1.00 0.00 O ATOM 0 H ASP A 75 -18.155 0.696 -0.278 1.00 0.00 H new ATOM 0 HA ASP A 75 -19.473 -1.822 -0.955 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -19.668 1.065 -1.846 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -20.355 -0.204 -2.839 1.00 0.00 H new ATOM 1126 N ASP A 76 -17.432 -0.289 -3.071 1.00 0.00 N ATOM 1127 CA ASP A 76 -16.524 -0.516 -4.190 1.00 0.00 C ATOM 1128 C ASP A 76 -15.209 -1.129 -3.719 1.00 0.00 C ATOM 1129 O ASP A 76 -14.555 -1.862 -4.461 1.00 0.00 O ATOM 1130 CB ASP A 76 -16.251 0.799 -4.925 1.00 0.00 C ATOM 1131 CG ASP A 76 -16.032 0.596 -6.411 1.00 0.00 C ATOM 1132 OD1 ASP A 76 -16.758 -0.224 -7.012 1.00 0.00 O ATOM 1133 OD2 ASP A 76 -15.133 1.255 -6.974 1.00 0.00 O ATOM 0 H ASP A 76 -17.522 0.688 -2.793 1.00 0.00 H new ATOM 0 HA ASP A 76 -17.003 -1.218 -4.873 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -17.090 1.478 -4.774 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -15.372 1.278 -4.493 1.00 0.00 H new ATOM 1138 N SER A 77 -14.823 -0.822 -2.485 1.00 0.00 N ATOM 1139 CA SER A 77 -13.583 -1.344 -1.920 1.00 0.00 C ATOM 1140 C SER A 77 -13.579 -2.869 -1.914 1.00 0.00 C ATOM 1141 O SER A 77 -12.523 -3.497 -2.009 1.00 0.00 O ATOM 1142 CB SER A 77 -13.386 -0.818 -0.497 1.00 0.00 C ATOM 1143 OG SER A 77 -12.344 -1.513 0.165 1.00 0.00 O ATOM 0 H SER A 77 -15.350 -0.215 -1.857 1.00 0.00 H new ATOM 0 HA SER A 77 -12.760 -1.002 -2.547 1.00 0.00 H new ATOM 0 HB2 SER A 77 -13.154 0.247 -0.529 1.00 0.00 H new ATOM 0 HB3 SER A 77 -14.314 -0.926 0.065 1.00 0.00 H new ATOM 0 HG SER A 77 -11.883 -0.904 0.779 1.00 0.00 H new ATOM 1149 N LYS A 78 -14.763 -3.461 -1.801 1.00 0.00 N ATOM 1150 CA LYS A 78 -14.893 -4.913 -1.782 1.00 0.00 C ATOM 1151 C LYS A 78 -14.434 -5.521 -3.104 1.00 0.00 C ATOM 1152 O LYS A 78 -13.932 -6.645 -3.140 1.00 0.00 O ATOM 1153 CB LYS A 78 -16.343 -5.313 -1.501 1.00 0.00 C ATOM 1154 CG LYS A 78 -16.940 -4.622 -0.285 1.00 0.00 C ATOM 1155 CD LYS A 78 -17.105 -5.584 0.881 1.00 0.00 C ATOM 1156 CE LYS A 78 -18.499 -6.192 0.906 1.00 0.00 C ATOM 1157 NZ LYS A 78 -18.672 -7.135 2.045 1.00 0.00 N ATOM 0 H LYS A 78 -15.646 -2.957 -1.721 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.255 -5.297 -0.986 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -16.951 -5.081 -2.375 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -16.392 -6.392 -1.356 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -16.299 -3.793 0.014 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -17.909 -4.197 -0.547 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -16.362 -6.378 0.808 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -16.919 -5.058 1.818 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -19.241 -5.397 0.977 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -18.683 -6.717 -0.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -19.247 -7.946 1.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -17.740 -7.471 2.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -19.150 -6.648 2.830 1.00 0.00 H new ATOM 1171 N ASP A 79 -14.611 -4.773 -4.188 1.00 0.00 N ATOM 1172 CA ASP A 79 -14.216 -5.242 -5.512 1.00 0.00 C ATOM 1173 C ASP A 79 -12.708 -5.461 -5.586 1.00 0.00 C ATOM 1174 O ASP A 79 -12.243 -6.587 -5.767 1.00 0.00 O ATOM 1175 CB ASP A 79 -14.650 -4.237 -6.580 1.00 0.00 C ATOM 1176 CG ASP A 79 -16.129 -4.334 -6.898 1.00 0.00 C ATOM 1177 OD1 ASP A 79 -16.605 -5.456 -7.169 1.00 0.00 O ATOM 1178 OD2 ASP A 79 -16.812 -3.288 -6.876 1.00 0.00 O ATOM 0 H ASP A 79 -15.025 -3.841 -4.176 1.00 0.00 H new ATOM 0 HA ASP A 79 -14.711 -6.195 -5.695 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -14.420 -3.227 -6.240 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -14.074 -4.406 -7.490 1.00 0.00 H new ATOM 1183 N THR A 80 -11.949 -4.379 -5.449 1.00 0.00 N ATOM 1184 CA THR A 80 -10.493 -4.453 -5.503 1.00 0.00 C ATOM 1185 C THR A 80 -9.952 -5.395 -4.431 1.00 0.00 C ATOM 1186 O THR A 80 -8.916 -6.034 -4.618 1.00 0.00 O ATOM 1187 CB THR A 80 -9.885 -3.061 -5.327 1.00 0.00 C ATOM 1188 OG1 THR A 80 -10.780 -2.063 -5.782 1.00 0.00 O ATOM 1189 CG2 THR A 80 -8.579 -2.880 -6.072 1.00 0.00 C ATOM 0 H THR A 80 -12.318 -3.440 -5.300 1.00 0.00 H new ATOM 0 HA THR A 80 -10.212 -4.846 -6.480 1.00 0.00 H new ATOM 0 HB THR A 80 -9.692 -2.962 -4.259 1.00 0.00 H new ATOM 0 HG1 THR A 80 -10.374 -1.179 -5.660 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.202 -1.871 -5.905 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.850 -3.605 -5.710 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.744 -3.034 -7.138 1.00 0.00 H new ATOM 1197 N TRP A 81 -10.659 -5.476 -3.309 1.00 0.00 N ATOM 1198 CA TRP A 81 -10.249 -6.339 -2.207 1.00 0.00 C ATOM 1199 C TRP A 81 -10.185 -7.797 -2.651 1.00 0.00 C ATOM 1200 O TRP A 81 -9.318 -8.553 -2.212 1.00 0.00 O ATOM 1201 CB TRP A 81 -11.216 -6.193 -1.031 1.00 0.00 C ATOM 1202 CG TRP A 81 -10.824 -7.009 0.164 1.00 0.00 C ATOM 1203 CD1 TRP A 81 -11.254 -8.268 0.472 1.00 0.00 C ATOM 1204 CD2 TRP A 81 -9.926 -6.623 1.210 1.00 0.00 C ATOM 1205 NE1 TRP A 81 -10.678 -8.688 1.646 1.00 0.00 N ATOM 1206 CE2 TRP A 81 -9.859 -7.696 2.118 1.00 0.00 C ATOM 1207 CE3 TRP A 81 -9.171 -5.475 1.467 1.00 0.00 C ATOM 1208 CZ2 TRP A 81 -9.067 -7.654 3.264 1.00 0.00 C ATOM 1209 CZ3 TRP A 81 -8.386 -5.434 2.603 1.00 0.00 C ATOM 1210 CH2 TRP A 81 -8.339 -6.518 3.490 1.00 0.00 C ATOM 0 H TRP A 81 -11.519 -4.954 -3.139 1.00 0.00 H new ATOM 0 HA TRP A 81 -9.253 -6.032 -1.889 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -11.271 -5.143 -0.743 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -12.215 -6.488 -1.352 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -11.946 -8.848 -0.121 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -10.834 -9.591 2.094 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -9.201 -4.635 0.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -9.029 -8.488 3.949 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -7.799 -4.552 2.811 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -7.716 -6.455 4.370 1.00 0.00 H new ATOM 1221 N LYS A 82 -11.110 -8.186 -3.523 1.00 0.00 N ATOM 1222 CA LYS A 82 -11.159 -9.555 -4.025 1.00 0.00 C ATOM 1223 C LYS A 82 -10.202 -9.748 -5.199 1.00 0.00 C ATOM 1224 O LYS A 82 -9.809 -10.872 -5.512 1.00 0.00 O ATOM 1225 CB LYS A 82 -12.585 -9.913 -4.448 1.00 0.00 C ATOM 1226 CG LYS A 82 -13.377 -10.634 -3.368 1.00 0.00 C ATOM 1227 CD LYS A 82 -14.682 -9.919 -3.057 1.00 0.00 C ATOM 1228 CE LYS A 82 -15.710 -10.126 -4.159 1.00 0.00 C ATOM 1229 NZ LYS A 82 -16.980 -10.695 -3.635 1.00 0.00 N ATOM 0 H LYS A 82 -11.835 -7.573 -3.896 1.00 0.00 H new ATOM 0 HA LYS A 82 -10.847 -10.219 -3.219 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -13.113 -9.001 -4.726 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -12.544 -10.541 -5.338 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -13.588 -11.653 -3.691 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -12.776 -10.705 -2.462 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -15.082 -10.286 -2.112 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -14.492 -8.853 -2.931 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -15.914 -9.174 -4.648 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -15.300 -10.793 -4.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -17.653 -10.820 -4.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -16.790 -11.616 -3.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -17.386 -10.047 -2.930 1.00 0.00 H new ATOM 1243 N LYS A 83 -9.827 -8.646 -5.846 1.00 0.00 N ATOM 1244 CA LYS A 83 -8.916 -8.703 -6.984 1.00 0.00 C ATOM 1245 C LYS A 83 -7.457 -8.765 -6.530 1.00 0.00 C ATOM 1246 O LYS A 83 -6.545 -8.781 -7.356 1.00 0.00 O ATOM 1247 CB LYS A 83 -9.125 -7.487 -7.889 1.00 0.00 C ATOM 1248 CG LYS A 83 -10.538 -7.377 -8.441 1.00 0.00 C ATOM 1249 CD LYS A 83 -10.538 -7.226 -9.955 1.00 0.00 C ATOM 1250 CE LYS A 83 -10.687 -5.772 -10.373 1.00 0.00 C ATOM 1251 NZ LYS A 83 -9.606 -5.348 -11.305 1.00 0.00 N ATOM 0 H LYS A 83 -10.140 -7.706 -5.601 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.137 -9.613 -7.541 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -8.891 -6.582 -7.328 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.422 -7.537 -8.720 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -11.108 -8.264 -8.163 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.040 -6.521 -7.989 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -9.610 -7.629 -10.361 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.353 -7.812 -10.380 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.656 -5.630 -10.852 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -10.673 -5.137 -9.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -9.744 -4.351 -11.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -8.683 -5.460 -10.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -9.635 -5.937 -12.162 1.00 0.00 H new ATOM 1265 N ARG A 84 -7.240 -8.804 -5.217 1.00 0.00 N ATOM 1266 CA ARG A 84 -5.889 -8.865 -4.667 1.00 0.00 C ATOM 1267 C ARG A 84 -5.147 -10.098 -5.175 1.00 0.00 C ATOM 1268 O ARG A 84 -3.917 -10.111 -5.237 1.00 0.00 O ATOM 1269 CB ARG A 84 -5.939 -8.881 -3.139 1.00 0.00 C ATOM 1270 CG ARG A 84 -6.686 -10.076 -2.567 1.00 0.00 C ATOM 1271 CD ARG A 84 -5.734 -11.199 -2.184 1.00 0.00 C ATOM 1272 NE ARG A 84 -5.769 -11.482 -0.751 1.00 0.00 N ATOM 1273 CZ ARG A 84 -6.751 -12.151 -0.152 1.00 0.00 C ATOM 1274 NH1 ARG A 84 -7.779 -12.608 -0.855 1.00 0.00 N ATOM 1275 NH2 ARG A 84 -6.704 -12.366 1.156 1.00 0.00 N ATOM 0 H ARG A 84 -7.981 -8.794 -4.516 1.00 0.00 H new ATOM 0 HA ARG A 84 -5.350 -7.978 -4.998 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -4.921 -8.880 -2.750 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -6.415 -7.965 -2.790 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -7.255 -9.765 -1.691 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -7.405 -10.442 -3.300 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -5.996 -12.101 -2.738 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.719 -10.929 -2.475 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.996 -11.147 -0.176 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.820 -12.447 -1.861 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -8.528 -13.120 -0.389 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -5.916 -12.019 1.702 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -7.456 -12.879 1.616 1.00 0.00 H new ATOM 1289 N GLY A 85 -5.900 -11.133 -5.536 1.00 0.00 N ATOM 1290 CA GLY A 85 -5.291 -12.354 -6.031 1.00 0.00 C ATOM 1291 C GLY A 85 -5.055 -12.330 -7.531 1.00 0.00 C ATOM 1292 O GLY A 85 -4.718 -13.354 -8.126 1.00 0.00 O ATOM 0 H GLY A 85 -6.919 -11.148 -5.495 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.341 -12.513 -5.521 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.931 -13.200 -5.782 1.00 0.00 H new ATOM 1296 N ASN A 86 -5.230 -11.163 -8.145 1.00 0.00 N ATOM 1297 CA ASN A 86 -5.030 -11.022 -9.583 1.00 0.00 C ATOM 1298 C ASN A 86 -3.755 -10.240 -9.880 1.00 0.00 C ATOM 1299 O ASN A 86 -3.096 -10.468 -10.895 1.00 0.00 O ATOM 1300 CB ASN A 86 -6.232 -10.322 -10.221 1.00 0.00 C ATOM 1301 CG ASN A 86 -6.436 -10.728 -11.668 1.00 0.00 C ATOM 1302 OD1 ASN A 86 -5.479 -11.029 -12.381 1.00 0.00 O ATOM 1303 ND2 ASN A 86 -7.688 -10.733 -12.110 1.00 0.00 N ATOM 0 H ASN A 86 -5.509 -10.304 -7.671 1.00 0.00 H new ATOM 0 HA ASN A 86 -4.931 -12.020 -10.010 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.131 -10.557 -9.650 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -6.092 -9.242 -10.166 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -7.887 -10.994 -13.076 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -8.451 -10.476 -11.484 1.00 0.00 H new ATOM 1310 N VAL A 87 -3.412 -9.316 -8.987 1.00 0.00 N ATOM 1311 CA VAL A 87 -2.215 -8.500 -9.155 1.00 0.00 C ATOM 1312 C VAL A 87 -0.965 -9.265 -8.733 1.00 0.00 C ATOM 1313 O VAL A 87 -1.038 -10.436 -8.362 1.00 0.00 O ATOM 1314 CB VAL A 87 -2.308 -7.194 -8.341 1.00 0.00 C ATOM 1315 CG1 VAL A 87 -3.493 -6.360 -8.803 1.00 0.00 C ATOM 1316 CG2 VAL A 87 -2.409 -7.493 -6.851 1.00 0.00 C ATOM 0 H VAL A 87 -3.945 -9.114 -8.141 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.144 -8.254 -10.214 1.00 0.00 H new ATOM 0 HB VAL A 87 -1.397 -6.620 -8.511 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.542 -5.442 -8.217 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.374 -6.111 -9.858 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -4.413 -6.928 -8.666 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -2.474 -6.557 -6.296 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -3.300 -8.091 -6.659 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.526 -8.045 -6.530 1.00 0.00 H new ATOM 1326 N GLU A 88 0.183 -8.596 -8.795 1.00 0.00 N ATOM 1327 CA GLU A 88 1.449 -9.215 -8.422 1.00 0.00 C ATOM 1328 C GLU A 88 1.939 -8.688 -7.076 1.00 0.00 C ATOM 1329 O GLU A 88 1.883 -9.389 -6.065 1.00 0.00 O ATOM 1330 CB GLU A 88 2.505 -8.960 -9.500 1.00 0.00 C ATOM 1331 CG GLU A 88 2.695 -10.132 -10.451 1.00 0.00 C ATOM 1332 CD GLU A 88 2.533 -9.736 -11.906 1.00 0.00 C ATOM 1333 OE1 GLU A 88 1.379 -9.674 -12.379 1.00 0.00 O ATOM 1334 OE2 GLU A 88 3.560 -9.488 -12.572 1.00 0.00 O ATOM 0 H GLU A 88 0.261 -7.626 -9.100 1.00 0.00 H new ATOM 0 HA GLU A 88 1.286 -10.289 -8.332 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.221 -8.078 -10.074 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.457 -8.734 -9.019 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.687 -10.558 -10.303 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.974 -10.912 -10.208 1.00 0.00 H new ATOM 1341 N TYR A 89 2.421 -7.449 -7.072 1.00 0.00 N ATOM 1342 CA TYR A 89 2.923 -6.829 -5.850 1.00 0.00 C ATOM 1343 C TYR A 89 1.783 -6.231 -5.031 1.00 0.00 C ATOM 1344 O TYR A 89 0.655 -6.115 -5.510 1.00 0.00 O ATOM 1345 CB TYR A 89 3.946 -5.743 -6.188 1.00 0.00 C ATOM 1346 CG TYR A 89 5.272 -6.288 -6.668 1.00 0.00 C ATOM 1347 CD1 TYR A 89 5.427 -6.746 -7.971 1.00 0.00 C ATOM 1348 CD2 TYR A 89 6.369 -6.344 -5.818 1.00 0.00 C ATOM 1349 CE1 TYR A 89 6.637 -7.244 -8.412 1.00 0.00 C ATOM 1350 CE2 TYR A 89 7.584 -6.843 -6.253 1.00 0.00 C ATOM 1351 CZ TYR A 89 7.711 -7.291 -7.550 1.00 0.00 C ATOM 1352 OH TYR A 89 8.919 -7.787 -7.987 1.00 0.00 O ATOM 0 H TYR A 89 2.475 -6.855 -7.900 1.00 0.00 H new ATOM 0 HA TYR A 89 3.406 -7.603 -5.254 1.00 0.00 H new ATOM 0 HB2 TYR A 89 3.531 -5.091 -6.957 1.00 0.00 H new ATOM 0 HB3 TYR A 89 4.114 -5.127 -5.305 1.00 0.00 H new ATOM 0 HD1 TYR A 89 4.587 -6.712 -8.650 1.00 0.00 H new ATOM 0 HD2 TYR A 89 6.272 -5.992 -4.801 1.00 0.00 H new ATOM 0 HE1 TYR A 89 6.741 -7.595 -9.428 1.00 0.00 H new ATOM 0 HE2 TYR A 89 8.428 -6.881 -5.580 1.00 0.00 H new ATOM 0 HH TYR A 89 9.572 -7.749 -7.257 1.00 0.00 H new ATOM 1362 N VAL A 90 2.087 -5.855 -3.793 1.00 0.00 N ATOM 1363 CA VAL A 90 1.090 -5.269 -2.905 1.00 0.00 C ATOM 1364 C VAL A 90 1.742 -4.337 -1.890 1.00 0.00 C ATOM 1365 O VAL A 90 2.767 -4.670 -1.295 1.00 0.00 O ATOM 1366 CB VAL A 90 0.299 -6.356 -2.151 1.00 0.00 C ATOM 1367 CG1 VAL A 90 -0.860 -5.739 -1.385 1.00 0.00 C ATOM 1368 CG2 VAL A 90 -0.197 -7.421 -3.118 1.00 0.00 C ATOM 0 H VAL A 90 3.016 -5.946 -3.382 1.00 0.00 H new ATOM 0 HA VAL A 90 0.403 -4.700 -3.532 1.00 0.00 H new ATOM 0 HB VAL A 90 0.965 -6.832 -1.432 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.406 -6.522 -0.859 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.476 -5.017 -0.664 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.529 -5.235 -2.082 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.753 -8.181 -2.569 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.848 -6.962 -3.862 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.654 -7.885 -3.617 1.00 0.00 H new ATOM 1378 N VAL A 91 1.142 -3.166 -1.697 1.00 0.00 N ATOM 1379 CA VAL A 91 1.667 -2.185 -0.755 1.00 0.00 C ATOM 1380 C VAL A 91 0.586 -1.720 0.216 1.00 0.00 C ATOM 1381 O VAL A 91 -0.596 -1.682 -0.127 1.00 0.00 O ATOM 1382 CB VAL A 91 2.247 -0.959 -1.485 1.00 0.00 C ATOM 1383 CG1 VAL A 91 2.957 -0.039 -0.503 1.00 0.00 C ATOM 1384 CG2 VAL A 91 3.187 -1.394 -2.600 1.00 0.00 C ATOM 0 H VAL A 91 0.293 -2.874 -2.180 1.00 0.00 H new ATOM 0 HA VAL A 91 2.464 -2.678 -0.198 1.00 0.00 H new ATOM 0 HB VAL A 91 1.424 -0.404 -1.935 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.360 0.821 -1.037 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.250 0.302 0.253 1.00 0.00 H new ATOM 0 HG13 VAL A 91 3.771 -0.580 -0.020 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.586 -0.514 -3.104 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.008 -1.974 -2.178 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.641 -2.006 -3.318 1.00 0.00 H new ATOM 1394 N LEU A 92 0.999 -1.368 1.430 1.00 0.00 N ATOM 1395 CA LEU A 92 0.067 -0.904 2.451 1.00 0.00 C ATOM 1396 C LEU A 92 0.333 0.555 2.807 1.00 0.00 C ATOM 1397 O LEU A 92 1.320 1.142 2.365 1.00 0.00 O ATOM 1398 CB LEU A 92 0.176 -1.775 3.705 1.00 0.00 C ATOM 1399 CG LEU A 92 0.055 -3.280 3.461 1.00 0.00 C ATOM 1400 CD1 LEU A 92 0.680 -4.058 4.609 1.00 0.00 C ATOM 1401 CD2 LEU A 92 -1.403 -3.674 3.280 1.00 0.00 C ATOM 0 H LEU A 92 1.973 -1.395 1.730 1.00 0.00 H new ATOM 0 HA LEU A 92 -0.943 -0.983 2.049 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.134 -1.576 4.185 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -0.601 -1.473 4.407 1.00 0.00 H new ATOM 0 HG LEU A 92 0.594 -3.526 2.546 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.585 -5.127 4.419 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.735 -3.797 4.694 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.169 -3.808 5.539 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.471 -4.748 3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.964 -3.415 4.178 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.820 -3.142 2.425 1.00 0.00 H new ATOM 1413 N LEU A 93 -0.556 1.134 3.608 1.00 0.00 N ATOM 1414 CA LEU A 93 -0.416 2.525 4.024 1.00 0.00 C ATOM 1415 C LEU A 93 -0.557 2.659 5.536 1.00 0.00 C ATOM 1416 O LEU A 93 -0.870 1.691 6.229 1.00 0.00 O ATOM 1417 CB LEU A 93 -1.463 3.394 3.323 1.00 0.00 C ATOM 1418 CG LEU A 93 -1.492 3.272 1.799 1.00 0.00 C ATOM 1419 CD1 LEU A 93 -2.575 4.165 1.213 1.00 0.00 C ATOM 1420 CD2 LEU A 93 -0.133 3.622 1.212 1.00 0.00 C ATOM 0 H LEU A 93 -1.380 0.662 3.981 1.00 0.00 H new ATOM 0 HA LEU A 93 0.580 2.865 3.740 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.448 3.134 3.712 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -1.282 4.436 3.585 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.723 2.239 1.539 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.581 4.065 0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.546 3.868 1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.375 5.203 1.481 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.171 3.530 0.127 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.127 4.646 1.481 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.621 2.941 1.608 1.00 0.00 H new ATOM 1432 N ASP A 94 -0.325 3.866 6.042 1.00 0.00 N ATOM 1433 CA ASP A 94 -0.427 4.129 7.474 1.00 0.00 C ATOM 1434 C ASP A 94 -0.180 5.603 7.774 1.00 0.00 C ATOM 1435 O ASP A 94 0.159 6.381 6.881 1.00 0.00 O ATOM 1436 CB ASP A 94 0.574 3.265 8.245 1.00 0.00 C ATOM 1437 CG ASP A 94 2.001 3.476 7.777 1.00 0.00 C ATOM 1438 OD1 ASP A 94 2.612 4.489 8.176 1.00 0.00 O ATOM 1439 OD2 ASP A 94 2.506 2.627 7.012 1.00 0.00 O ATOM 0 H ASP A 94 -0.065 4.678 5.482 1.00 0.00 H new ATOM 0 HA ASP A 94 -1.438 3.875 7.794 1.00 0.00 H new ATOM 0 HB2 ASP A 94 0.505 3.495 9.308 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.308 2.214 8.129 1.00 0.00 H new ATOM 1444 N TRP A 95 -0.351 5.983 9.036 1.00 0.00 N ATOM 1445 CA TRP A 95 -0.146 7.366 9.453 1.00 0.00 C ATOM 1446 C TRP A 95 1.263 7.565 9.999 1.00 0.00 C ATOM 1447 O TRP A 95 1.981 8.474 9.579 1.00 0.00 O ATOM 1448 CB TRP A 95 -1.178 7.759 10.511 1.00 0.00 C ATOM 1449 CG TRP A 95 -2.391 8.426 9.939 1.00 0.00 C ATOM 1450 CD1 TRP A 95 -3.694 8.068 10.135 1.00 0.00 C ATOM 1451 CD2 TRP A 95 -2.414 9.567 9.073 1.00 0.00 C ATOM 1452 NE1 TRP A 95 -4.525 8.917 9.445 1.00 0.00 N ATOM 1453 CE2 TRP A 95 -3.763 9.845 8.786 1.00 0.00 C ATOM 1454 CE3 TRP A 95 -1.424 10.381 8.514 1.00 0.00 C ATOM 1455 CZ2 TRP A 95 -4.147 10.902 7.964 1.00 0.00 C ATOM 1456 CZ3 TRP A 95 -1.806 11.430 7.699 1.00 0.00 C ATOM 1457 CH2 TRP A 95 -3.158 11.682 7.431 1.00 0.00 C ATOM 0 H TRP A 95 -0.631 5.353 9.788 1.00 0.00 H new ATOM 0 HA TRP A 95 -0.271 8.006 8.580 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -1.486 6.867 11.057 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -0.711 8.429 11.233 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -4.023 7.239 10.743 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -5.543 8.865 9.426 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.380 10.193 8.715 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -5.188 11.099 7.755 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.050 12.066 7.262 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.425 12.509 6.790 1.00 0.00 H new ATOM 1468 N PHE A 96 1.655 6.713 10.940 1.00 0.00 N ATOM 1469 CA PHE A 96 2.979 6.796 11.545 1.00 0.00 C ATOM 1470 C PHE A 96 3.459 5.420 11.995 1.00 0.00 C ATOM 1471 O PHE A 96 3.423 5.097 13.182 1.00 0.00 O ATOM 1472 CB PHE A 96 2.959 7.758 12.734 1.00 0.00 C ATOM 1473 CG PHE A 96 2.954 9.206 12.335 1.00 0.00 C ATOM 1474 CD1 PHE A 96 3.964 9.722 11.538 1.00 0.00 C ATOM 1475 CD2 PHE A 96 1.940 10.051 12.757 1.00 0.00 C ATOM 1476 CE1 PHE A 96 3.962 11.054 11.170 1.00 0.00 C ATOM 1477 CE2 PHE A 96 1.933 11.384 12.392 1.00 0.00 C ATOM 1478 CZ PHE A 96 2.945 11.886 11.597 1.00 0.00 C ATOM 0 H PHE A 96 1.074 5.956 11.301 1.00 0.00 H new ATOM 0 HA PHE A 96 3.672 7.173 10.793 1.00 0.00 H new ATOM 0 HB2 PHE A 96 2.077 7.554 13.341 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.829 7.565 13.361 1.00 0.00 H new ATOM 0 HD1 PHE A 96 4.761 9.076 11.201 1.00 0.00 H new ATOM 0 HD2 PHE A 96 1.146 9.663 13.378 1.00 0.00 H new ATOM 0 HE1 PHE A 96 4.755 11.444 10.549 1.00 0.00 H new ATOM 0 HE2 PHE A 96 1.137 12.032 12.728 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.941 12.927 11.310 1.00 0.00 H new ATOM 1488 N SER A 97 3.908 4.612 11.039 1.00 0.00 N ATOM 1489 CA SER A 97 4.395 3.271 11.338 1.00 0.00 C ATOM 1490 C SER A 97 4.979 2.613 10.093 1.00 0.00 C ATOM 1491 O SER A 97 4.633 2.972 8.968 1.00 0.00 O ATOM 1492 CB SER A 97 3.263 2.409 11.901 1.00 0.00 C ATOM 1493 OG SER A 97 2.214 2.267 10.960 1.00 0.00 O ATOM 0 H SER A 97 3.944 4.863 10.051 1.00 0.00 H new ATOM 0 HA SER A 97 5.184 3.357 12.085 1.00 0.00 H new ATOM 0 HB2 SER A 97 3.650 1.426 12.170 1.00 0.00 H new ATOM 0 HB3 SER A 97 2.877 2.861 12.815 1.00 0.00 H new ATOM 0 HG SER A 97 1.504 1.711 11.343 1.00 0.00 H new ATOM 1499 N SER A 98 5.867 1.646 10.303 1.00 0.00 N ATOM 1500 CA SER A 98 6.499 0.935 9.198 1.00 0.00 C ATOM 1501 C SER A 98 6.707 -0.534 9.548 1.00 0.00 C ATOM 1502 O SER A 98 6.428 -0.962 10.668 1.00 0.00 O ATOM 1503 CB SER A 98 7.840 1.584 8.848 1.00 0.00 C ATOM 1504 OG SER A 98 7.734 2.997 8.832 1.00 0.00 O ATOM 0 H SER A 98 6.165 1.337 11.228 1.00 0.00 H new ATOM 0 HA SER A 98 5.839 0.994 8.333 1.00 0.00 H new ATOM 0 HB2 SER A 98 8.595 1.281 9.574 1.00 0.00 H new ATOM 0 HB3 SER A 98 8.175 1.230 7.873 1.00 0.00 H new ATOM 0 HG SER A 98 8.604 3.388 8.607 1.00 0.00 H new ATOM 1510 N ALA A 99 7.200 -1.304 8.581 1.00 0.00 N ATOM 1511 CA ALA A 99 7.446 -2.728 8.785 1.00 0.00 C ATOM 1512 C ALA A 99 8.356 -2.964 9.987 1.00 0.00 C ATOM 1513 O ALA A 99 8.274 -4.000 10.646 1.00 0.00 O ATOM 1514 CB ALA A 99 8.054 -3.341 7.533 1.00 0.00 C ATOM 0 H ALA A 99 7.437 -0.965 7.649 1.00 0.00 H new ATOM 0 HA ALA A 99 6.490 -3.211 8.988 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.233 -4.403 7.698 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.368 -3.214 6.696 1.00 0.00 H new ATOM 0 HB3 ALA A 99 8.998 -2.845 7.307 1.00 0.00 H new ATOM 1520 N LYS A 100 9.222 -1.995 10.265 1.00 0.00 N ATOM 1521 CA LYS A 100 10.148 -2.096 11.387 1.00 0.00 C ATOM 1522 C LYS A 100 9.478 -1.677 12.693 1.00 0.00 C ATOM 1523 O LYS A 100 9.876 -2.113 13.773 1.00 0.00 O ATOM 1524 CB LYS A 100 11.382 -1.229 11.133 1.00 0.00 C ATOM 1525 CG LYS A 100 11.059 0.246 10.973 1.00 0.00 C ATOM 1526 CD LYS A 100 11.911 0.891 9.891 1.00 0.00 C ATOM 1527 CE LYS A 100 11.306 0.689 8.511 1.00 0.00 C ATOM 1528 NZ LYS A 100 11.804 -0.553 7.860 1.00 0.00 N ATOM 0 H LYS A 100 9.302 -1.131 9.729 1.00 0.00 H new ATOM 0 HA LYS A 100 10.454 -3.138 11.478 1.00 0.00 H new ATOM 0 HB2 LYS A 100 12.081 -1.353 11.960 1.00 0.00 H new ATOM 0 HB3 LYS A 100 11.887 -1.583 10.234 1.00 0.00 H new ATOM 0 HG2 LYS A 100 10.004 0.363 10.725 1.00 0.00 H new ATOM 0 HG3 LYS A 100 11.222 0.760 11.920 1.00 0.00 H new ATOM 0 HD2 LYS A 100 12.011 1.957 10.093 1.00 0.00 H new ATOM 0 HD3 LYS A 100 12.915 0.466 9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 100 10.220 0.644 8.594 1.00 0.00 H new ATOM 0 HE3 LYS A 100 11.542 1.548 7.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 11.731 -0.457 6.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 12.798 -0.709 8.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 11.231 -1.363 8.173 1.00 0.00 H new ATOM 1542 N ASP A 101 8.461 -0.827 12.587 1.00 0.00 N ATOM 1543 CA ASP A 101 7.739 -0.350 13.762 1.00 0.00 C ATOM 1544 C ASP A 101 6.484 -1.182 14.019 1.00 0.00 C ATOM 1545 O ASP A 101 5.566 -0.738 14.708 1.00 0.00 O ATOM 1546 CB ASP A 101 7.358 1.122 13.587 1.00 0.00 C ATOM 1547 CG ASP A 101 7.431 1.897 14.888 1.00 0.00 C ATOM 1548 OD1 ASP A 101 8.542 2.015 15.447 1.00 0.00 O ATOM 1549 OD2 ASP A 101 6.378 2.387 15.346 1.00 0.00 O ATOM 0 H ASP A 101 8.119 -0.455 11.701 1.00 0.00 H new ATOM 0 HA ASP A 101 8.399 -0.453 14.623 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.023 1.582 12.856 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.347 1.187 13.185 1.00 0.00 H new ATOM 1554 N LEU A 102 6.447 -2.390 13.463 1.00 0.00 N ATOM 1555 CA LEU A 102 5.300 -3.275 13.639 1.00 0.00 C ATOM 1556 C LEU A 102 5.362 -3.980 14.990 1.00 0.00 C ATOM 1557 O LEU A 102 6.441 -4.322 15.475 1.00 0.00 O ATOM 1558 CB LEU A 102 5.246 -4.310 12.513 1.00 0.00 C ATOM 1559 CG LEU A 102 4.776 -3.773 11.160 1.00 0.00 C ATOM 1560 CD1 LEU A 102 4.952 -4.826 10.078 1.00 0.00 C ATOM 1561 CD2 LEU A 102 3.323 -3.323 11.239 1.00 0.00 C ATOM 0 H LEU A 102 7.196 -2.777 12.889 1.00 0.00 H new ATOM 0 HA LEU A 102 4.396 -2.667 13.605 1.00 0.00 H new ATOM 0 HB2 LEU A 102 6.239 -4.742 12.390 1.00 0.00 H new ATOM 0 HB3 LEU A 102 4.582 -5.119 12.816 1.00 0.00 H new ATOM 0 HG LEU A 102 5.389 -2.909 10.901 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.612 -4.426 9.123 1.00 0.00 H new ATOM 0 HD12 LEU A 102 6.005 -5.099 10.004 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.365 -5.709 10.331 1.00 0.00 H new ATOM 0 HD21 LEU A 102 3.006 -2.944 10.267 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.695 -4.168 11.521 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.226 -2.534 11.985 1.00 0.00 H new ATOM 1573 N GLN A 103 4.197 -4.196 15.593 1.00 0.00 N ATOM 1574 CA GLN A 103 4.119 -4.861 16.888 1.00 0.00 C ATOM 1575 C GLN A 103 3.078 -5.976 16.867 1.00 0.00 C ATOM 1576 O GLN A 103 2.313 -6.105 15.912 1.00 0.00 O ATOM 1577 CB GLN A 103 3.776 -3.850 17.985 1.00 0.00 C ATOM 1578 CG GLN A 103 4.597 -2.572 17.913 1.00 0.00 C ATOM 1579 CD GLN A 103 5.141 -2.151 19.264 1.00 0.00 C ATOM 1580 OE1 GLN A 103 4.672 -2.609 20.305 1.00 0.00 O ATOM 1581 NE2 GLN A 103 6.137 -1.273 19.253 1.00 0.00 N ATOM 0 H GLN A 103 3.295 -3.920 15.205 1.00 0.00 H new ATOM 0 HA GLN A 103 5.093 -5.302 17.100 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.718 -3.597 17.916 1.00 0.00 H new ATOM 0 HB3 GLN A 103 3.930 -4.316 18.958 1.00 0.00 H new ATOM 0 HG2 GLN A 103 5.426 -2.716 17.220 1.00 0.00 H new ATOM 0 HG3 GLN A 103 3.979 -1.770 17.508 1.00 0.00 H new ATOM 0 HE21 GLN A 103 6.495 -0.919 18.366 1.00 0.00 H new ATOM 0 HE22 GLN A 103 6.544 -0.952 20.132 1.00 0.00 H new ATOM 1590 N ILE A 104 3.056 -6.779 17.926 1.00 0.00 N ATOM 1591 CA ILE A 104 2.109 -7.882 18.028 1.00 0.00 C ATOM 1592 C ILE A 104 0.708 -7.375 18.359 1.00 0.00 C ATOM 1593 O ILE A 104 0.186 -7.624 19.446 1.00 0.00 O ATOM 1594 CB ILE A 104 2.545 -8.899 19.101 1.00 0.00 C ATOM 1595 CG1 ILE A 104 4.017 -9.269 18.918 1.00 0.00 C ATOM 1596 CG2 ILE A 104 1.669 -10.141 19.041 1.00 0.00 C ATOM 1597 CD1 ILE A 104 4.309 -9.946 17.597 1.00 0.00 C ATOM 0 H ILE A 104 3.683 -6.686 18.725 1.00 0.00 H new ATOM 0 HA ILE A 104 2.092 -8.377 17.057 1.00 0.00 H new ATOM 0 HB ILE A 104 2.426 -8.441 20.083 1.00 0.00 H new ATOM 0 HG12 ILE A 104 4.623 -8.366 18.996 1.00 0.00 H new ATOM 0 HG13 ILE A 104 4.321 -9.929 19.731 1.00 0.00 H new ATOM 0 HG21 ILE A 104 1.989 -10.850 19.805 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.630 -9.862 19.218 1.00 0.00 H new ATOM 0 HG23 ILE A 104 1.759 -10.602 18.058 1.00 0.00 H new ATOM 0 HD11 ILE A 104 5.372 -10.180 17.535 1.00 0.00 H new ATOM 0 HD12 ILE A 104 3.730 -10.867 17.524 1.00 0.00 H new ATOM 0 HD13 ILE A 104 4.036 -9.280 16.779 1.00 0.00 H new ATOM 1609 N GLY A 105 0.105 -6.662 17.414 1.00 0.00 N ATOM 1610 CA GLY A 105 -1.228 -6.130 17.624 1.00 0.00 C ATOM 1611 C GLY A 105 -1.438 -4.798 16.931 1.00 0.00 C ATOM 1612 O GLY A 105 -1.992 -3.867 17.516 1.00 0.00 O ATOM 0 H GLY A 105 0.516 -6.443 16.506 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.963 -6.846 17.258 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.404 -6.011 18.693 1.00 0.00 H new ATOM 1616 N THR A 106 -0.994 -4.707 15.682 1.00 0.00 N ATOM 1617 CA THR A 106 -1.135 -3.479 14.908 1.00 0.00 C ATOM 1618 C THR A 106 -2.057 -3.693 13.712 1.00 0.00 C ATOM 1619 O THR A 106 -2.395 -4.827 13.372 1.00 0.00 O ATOM 1620 CB THR A 106 0.235 -2.992 14.431 1.00 0.00 C ATOM 1621 OG1 THR A 106 1.128 -4.080 14.279 1.00 0.00 O ATOM 1622 CG2 THR A 106 0.878 -1.998 15.374 1.00 0.00 C ATOM 0 H THR A 106 -0.534 -5.469 15.184 1.00 0.00 H new ATOM 0 HA THR A 106 -1.578 -2.720 15.554 1.00 0.00 H new ATOM 0 HB THR A 106 0.050 -2.497 13.478 1.00 0.00 H new ATOM 0 HG1 THR A 106 1.372 -4.429 15.162 1.00 0.00 H new ATOM 0 HG21 THR A 106 1.846 -1.693 14.977 1.00 0.00 H new ATOM 0 HG22 THR A 106 0.235 -1.123 15.474 1.00 0.00 H new ATOM 0 HG23 THR A 106 1.016 -2.461 16.351 1.00 0.00 H new ATOM 1630 N THR A 107 -2.462 -2.597 13.079 1.00 0.00 N ATOM 1631 CA THR A 107 -3.346 -2.665 11.922 1.00 0.00 C ATOM 1632 C THR A 107 -2.603 -3.191 10.697 1.00 0.00 C ATOM 1633 O THR A 107 -3.195 -3.830 9.827 1.00 0.00 O ATOM 1634 CB THR A 107 -3.934 -1.286 11.621 1.00 0.00 C ATOM 1635 OG1 THR A 107 -4.358 -0.651 12.814 1.00 0.00 O ATOM 1636 CG2 THR A 107 -5.118 -1.333 10.679 1.00 0.00 C ATOM 0 H THR A 107 -2.192 -1.651 13.348 1.00 0.00 H new ATOM 0 HA THR A 107 -4.156 -3.355 12.157 1.00 0.00 H new ATOM 0 HB THR A 107 -3.131 -0.727 11.141 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.580 0.285 12.625 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.487 -0.322 10.508 1.00 0.00 H new ATOM 0 HG22 THR A 107 -4.811 -1.773 9.730 1.00 0.00 H new ATOM 0 HG23 THR A 107 -5.910 -1.938 11.120 1.00 0.00 H new ATOM 1644 N LEU A 108 -1.304 -2.918 10.637 1.00 0.00 N ATOM 1645 CA LEU A 108 -0.480 -3.363 9.519 1.00 0.00 C ATOM 1646 C LEU A 108 -0.107 -4.835 9.667 1.00 0.00 C ATOM 1647 O LEU A 108 -0.155 -5.599 8.703 1.00 0.00 O ATOM 1648 CB LEU A 108 0.787 -2.511 9.421 1.00 0.00 C ATOM 1649 CG LEU A 108 0.616 -1.181 8.685 1.00 0.00 C ATOM 1650 CD1 LEU A 108 1.891 -0.356 8.773 1.00 0.00 C ATOM 1651 CD2 LEU A 108 0.234 -1.422 7.232 1.00 0.00 C ATOM 0 H LEU A 108 -0.799 -2.391 11.349 1.00 0.00 H new ATOM 0 HA LEU A 108 -1.061 -3.245 8.604 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.149 -2.307 10.429 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.559 -3.092 8.916 1.00 0.00 H new ATOM 0 HG LEU A 108 -0.188 -0.622 9.164 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.752 0.587 8.244 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.123 -0.155 9.819 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.714 -0.908 8.319 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.116 -0.465 6.723 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.017 -2.000 6.741 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -0.705 -1.973 7.189 1.00 0.00 H new ATOM 1663 N ARG A 109 0.265 -5.226 10.882 1.00 0.00 N ATOM 1664 CA ARG A 109 0.648 -6.607 11.157 1.00 0.00 C ATOM 1665 C ARG A 109 -0.504 -7.563 10.856 1.00 0.00 C ATOM 1666 O ARG A 109 -0.359 -8.494 10.065 1.00 0.00 O ATOM 1667 CB ARG A 109 1.081 -6.756 12.617 1.00 0.00 C ATOM 1668 CG ARG A 109 2.585 -6.667 12.817 1.00 0.00 C ATOM 1669 CD ARG A 109 3.207 -8.043 12.993 1.00 0.00 C ATOM 1670 NE ARG A 109 4.651 -8.025 12.772 1.00 0.00 N ATOM 1671 CZ ARG A 109 5.378 -9.114 12.531 1.00 0.00 C ATOM 1672 NH1 ARG A 109 4.801 -10.308 12.478 1.00 0.00 N ATOM 1673 NH2 ARG A 109 6.686 -9.008 12.341 1.00 0.00 N ATOM 0 H ARG A 109 0.309 -4.607 11.691 1.00 0.00 H new ATOM 0 HA ARG A 109 1.486 -6.861 10.508 1.00 0.00 H new ATOM 0 HB2 ARG A 109 0.597 -5.981 13.212 1.00 0.00 H new ATOM 0 HB3 ARG A 109 0.729 -7.715 12.996 1.00 0.00 H new ATOM 0 HG2 ARG A 109 3.038 -6.169 11.960 1.00 0.00 H new ATOM 0 HG3 ARG A 109 2.801 -6.054 13.692 1.00 0.00 H new ATOM 0 HD2 ARG A 109 2.999 -8.409 13.999 1.00 0.00 H new ATOM 0 HD3 ARG A 109 2.743 -8.742 12.297 1.00 0.00 H new ATOM 0 HE ARG A 109 5.130 -7.125 12.804 1.00 0.00 H new ATOM 0 HH11 ARG A 109 3.795 -10.395 12.622 1.00 0.00 H new ATOM 0 HH12 ARG A 109 5.364 -11.138 12.293 1.00 0.00 H new ATOM 0 HH21 ARG A 109 7.134 -8.093 12.380 1.00 0.00 H new ATOM 0 HH22 ARG A 109 7.244 -9.842 12.156 1.00 0.00 H new ATOM 1687 N SER A 110 -1.645 -7.327 11.494 1.00 0.00 N ATOM 1688 CA SER A 110 -2.821 -8.167 11.298 1.00 0.00 C ATOM 1689 C SER A 110 -3.246 -8.183 9.832 1.00 0.00 C ATOM 1690 O SER A 110 -3.602 -9.229 9.290 1.00 0.00 O ATOM 1691 CB SER A 110 -3.977 -7.674 12.169 1.00 0.00 C ATOM 1692 OG SER A 110 -4.163 -6.276 12.028 1.00 0.00 O ATOM 0 H SER A 110 -1.781 -6.560 12.152 1.00 0.00 H new ATOM 0 HA SER A 110 -2.560 -9.184 11.592 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.893 -8.195 11.892 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.777 -7.914 13.213 1.00 0.00 H new ATOM 0 HG SER A 110 -3.533 -5.802 12.610 1.00 0.00 H new ATOM 1698 N LEU A 111 -3.206 -7.016 9.196 1.00 0.00 N ATOM 1699 CA LEU A 111 -3.590 -6.897 7.793 1.00 0.00 C ATOM 1700 C LEU A 111 -2.565 -7.574 6.889 1.00 0.00 C ATOM 1701 O LEU A 111 -2.924 -8.267 5.937 1.00 0.00 O ATOM 1702 CB LEU A 111 -3.736 -5.425 7.407 1.00 0.00 C ATOM 1703 CG LEU A 111 -4.241 -5.176 5.984 1.00 0.00 C ATOM 1704 CD1 LEU A 111 -5.536 -5.933 5.737 1.00 0.00 C ATOM 1705 CD2 LEU A 111 -4.437 -3.687 5.742 1.00 0.00 C ATOM 0 H LEU A 111 -2.912 -6.140 9.629 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.549 -7.397 7.660 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.421 -4.947 8.108 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.768 -4.937 7.524 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.491 -5.543 5.283 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.880 -5.744 4.720 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.364 -7.001 5.869 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.294 -5.598 6.445 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.796 -3.528 4.725 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -5.167 -3.296 6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.488 -3.168 5.877 1.00 0.00 H new ATOM 1717 N LYS A 112 -1.288 -7.366 7.190 1.00 0.00 N ATOM 1718 CA LYS A 112 -0.210 -7.956 6.403 1.00 0.00 C ATOM 1719 C LYS A 112 -0.209 -9.475 6.532 1.00 0.00 C ATOM 1720 O LYS A 112 0.114 -10.189 5.583 1.00 0.00 O ATOM 1721 CB LYS A 112 1.141 -7.393 6.847 1.00 0.00 C ATOM 1722 CG LYS A 112 2.303 -7.846 5.978 1.00 0.00 C ATOM 1723 CD LYS A 112 3.013 -9.048 6.579 1.00 0.00 C ATOM 1724 CE LYS A 112 3.625 -9.929 5.502 1.00 0.00 C ATOM 1725 NZ LYS A 112 2.769 -11.108 5.195 1.00 0.00 N ATOM 0 H LYS A 112 -0.973 -6.793 7.973 1.00 0.00 H new ATOM 0 HA LYS A 112 -0.376 -7.700 5.357 1.00 0.00 H new ATOM 0 HB2 LYS A 112 1.093 -6.304 6.836 1.00 0.00 H new ATOM 0 HB3 LYS A 112 1.330 -7.694 7.878 1.00 0.00 H new ATOM 0 HG2 LYS A 112 1.937 -8.098 4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 112 3.011 -7.026 5.859 1.00 0.00 H new ATOM 0 HD2 LYS A 112 3.794 -8.708 7.260 1.00 0.00 H new ATOM 0 HD3 LYS A 112 2.307 -9.631 7.170 1.00 0.00 H new ATOM 0 HE2 LYS A 112 3.774 -9.343 4.595 1.00 0.00 H new ATOM 0 HE3 LYS A 112 4.608 -10.269 5.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 2.901 -11.384 4.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 3.036 -11.901 5.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 1.771 -10.864 5.357 1.00 0.00 H new ATOM 1739 N ASP A 113 -0.572 -9.963 7.713 1.00 0.00 N ATOM 1740 CA ASP A 113 -0.612 -11.399 7.968 1.00 0.00 C ATOM 1741 C ASP A 113 -1.955 -11.998 7.552 1.00 0.00 C ATOM 1742 O ASP A 113 -2.076 -13.211 7.383 1.00 0.00 O ATOM 1743 CB ASP A 113 -0.354 -11.681 9.449 1.00 0.00 C ATOM 1744 CG ASP A 113 1.125 -11.723 9.779 1.00 0.00 C ATOM 1745 OD1 ASP A 113 1.880 -12.392 9.042 1.00 0.00 O ATOM 1746 OD2 ASP A 113 1.530 -11.086 10.775 1.00 0.00 O ATOM 0 H ASP A 113 -0.843 -9.386 8.509 1.00 0.00 H new ATOM 0 HA ASP A 113 0.171 -11.867 7.370 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -0.837 -10.912 10.052 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -0.811 -12.632 9.720 1.00 0.00 H new ATOM 1751 N ALA A 114 -2.961 -11.143 7.388 1.00 0.00 N ATOM 1752 CA ALA A 114 -4.291 -11.597 6.993 1.00 0.00 C ATOM 1753 C ALA A 114 -4.475 -11.536 5.478 1.00 0.00 C ATOM 1754 O ALA A 114 -5.603 -11.518 4.984 1.00 0.00 O ATOM 1755 CB ALA A 114 -5.357 -10.764 7.687 1.00 0.00 C ATOM 0 H ALA A 114 -2.881 -10.135 7.522 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.395 -12.638 7.300 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -6.345 -11.112 7.385 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -5.252 -10.865 8.767 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.240 -9.717 7.407 1.00 0.00 H new ATOM 1761 N LEU A 115 -3.367 -11.504 4.743 1.00 0.00 N ATOM 1762 CA LEU A 115 -3.418 -11.446 3.287 1.00 0.00 C ATOM 1763 C LEU A 115 -2.642 -12.604 2.667 1.00 0.00 C ATOM 1764 O LEU A 115 -3.101 -13.229 1.711 1.00 0.00 O ATOM 1765 CB LEU A 115 -2.854 -10.114 2.789 1.00 0.00 C ATOM 1766 CG LEU A 115 -3.732 -8.894 3.071 1.00 0.00 C ATOM 1767 CD1 LEU A 115 -2.949 -7.610 2.849 1.00 0.00 C ATOM 1768 CD2 LEU A 115 -4.976 -8.920 2.196 1.00 0.00 C ATOM 0 H LEU A 115 -2.424 -11.517 5.132 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.461 -11.528 2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -1.879 -9.955 3.249 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -2.691 -10.185 1.714 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.045 -8.928 4.115 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -3.590 -6.753 3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -2.089 -7.588 3.518 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -2.606 -7.567 1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -5.589 -8.045 2.410 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.683 -8.910 1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -5.548 -9.824 2.404 1.00 0.00 H new ATOM 1780 N PHE A 116 -1.463 -12.883 3.213 1.00 0.00 N ATOM 1781 CA PHE A 116 -0.624 -13.964 2.709 1.00 0.00 C ATOM 1782 C PHE A 116 -0.629 -15.152 3.668 1.00 0.00 C ATOM 1783 O PHE A 116 -0.940 -16.276 3.277 1.00 0.00 O ATOM 1784 CB PHE A 116 0.808 -13.470 2.499 1.00 0.00 C ATOM 1785 CG PHE A 116 1.548 -14.213 1.423 1.00 0.00 C ATOM 1786 CD1 PHE A 116 1.660 -15.593 1.468 1.00 0.00 C ATOM 1787 CD2 PHE A 116 2.132 -13.530 0.369 1.00 0.00 C ATOM 1788 CE1 PHE A 116 2.339 -16.278 0.479 1.00 0.00 C ATOM 1789 CE2 PHE A 116 2.813 -14.210 -0.623 1.00 0.00 C ATOM 1790 CZ PHE A 116 2.917 -15.586 -0.567 1.00 0.00 C ATOM 0 H PHE A 116 -1.067 -12.376 4.004 1.00 0.00 H new ATOM 0 HA PHE A 116 -1.033 -14.291 1.753 1.00 0.00 H new ATOM 0 HB2 PHE A 116 0.785 -12.410 2.247 1.00 0.00 H new ATOM 0 HB3 PHE A 116 1.357 -13.563 3.436 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.212 -16.139 2.285 1.00 0.00 H new ATOM 0 HD2 PHE A 116 2.054 -12.454 0.322 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.418 -17.354 0.524 1.00 0.00 H new ATOM 0 HE2 PHE A 116 3.263 -13.666 -1.440 1.00 0.00 H new ATOM 0 HZ PHE A 116 3.450 -16.120 -1.340 1.00 0.00 H new ATOM 1800 N LYS A 117 -0.279 -14.893 4.925 1.00 0.00 N ATOM 1801 CA LYS A 117 -0.242 -15.942 5.939 1.00 0.00 C ATOM 1802 C LYS A 117 -1.605 -16.612 6.084 1.00 0.00 C ATOM 1803 O LYS A 117 -1.766 -17.790 5.767 1.00 0.00 O ATOM 1804 CB LYS A 117 0.203 -15.364 7.283 1.00 0.00 C ATOM 1805 CG LYS A 117 0.759 -16.407 8.240 1.00 0.00 C ATOM 1806 CD LYS A 117 0.010 -16.411 9.562 1.00 0.00 C ATOM 1807 CE LYS A 117 0.313 -17.664 10.370 1.00 0.00 C ATOM 1808 NZ LYS A 117 1.758 -17.767 10.713 1.00 0.00 N ATOM 0 H LYS A 117 -0.017 -13.968 5.265 1.00 0.00 H new ATOM 0 HA LYS A 117 0.477 -16.696 5.619 1.00 0.00 H new ATOM 0 HB2 LYS A 117 0.963 -14.602 7.108 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -0.645 -14.866 7.754 1.00 0.00 H new ATOM 0 HG2 LYS A 117 0.693 -17.394 7.781 1.00 0.00 H new ATOM 0 HG3 LYS A 117 1.816 -16.209 8.421 1.00 0.00 H new ATOM 0 HD2 LYS A 117 0.285 -15.529 10.140 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.062 -16.348 9.374 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -0.278 -17.657 11.286 1.00 0.00 H new ATOM 0 HE3 LYS A 117 0.011 -18.544 9.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 1.910 -18.587 11.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 2.314 -17.884 9.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 2.061 -16.901 11.203 1.00 0.00 H new ATOM 1822 N TRP A 118 -2.584 -15.853 6.565 1.00 0.00 N ATOM 1823 CA TRP A 118 -3.932 -16.375 6.752 1.00 0.00 C ATOM 1824 C TRP A 118 -4.690 -16.413 5.429 1.00 0.00 C ATOM 1825 O TRP A 118 -5.221 -15.400 4.976 1.00 0.00 O ATOM 1826 CB TRP A 118 -4.697 -15.521 7.766 1.00 0.00 C ATOM 1827 CG TRP A 118 -3.955 -15.318 9.052 1.00 0.00 C ATOM 1828 CD1 TRP A 118 -3.484 -14.136 9.548 1.00 0.00 C ATOM 1829 CD2 TRP A 118 -3.597 -16.326 10.003 1.00 0.00 C ATOM 1830 NE1 TRP A 118 -2.856 -14.348 10.751 1.00 0.00 N ATOM 1831 CE2 TRP A 118 -2.912 -15.684 11.053 1.00 0.00 C ATOM 1832 CE3 TRP A 118 -3.790 -17.708 10.071 1.00 0.00 C ATOM 1833 CZ2 TRP A 118 -2.419 -16.378 12.155 1.00 0.00 C ATOM 1834 CZ3 TRP A 118 -3.300 -18.396 11.167 1.00 0.00 C ATOM 1835 CH2 TRP A 118 -2.623 -17.731 12.196 1.00 0.00 C ATOM 0 H TRP A 118 -2.469 -14.875 6.832 1.00 0.00 H new ATOM 0 HA TRP A 118 -3.850 -17.393 7.133 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -4.913 -14.549 7.322 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -5.656 -15.994 7.979 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -3.590 -13.176 9.065 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -2.419 -13.628 11.326 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -4.312 -18.230 9.283 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -1.894 -15.867 12.949 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -3.442 -19.465 11.230 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -2.254 -18.297 13.039 1.00 0.00 H new ATOM 1924 N LEU A 124 -0.836 -14.843 -2.751 1.00 0.00 N ATOM 1925 CA LEU A 124 -0.204 -13.686 -3.376 1.00 0.00 C ATOM 1926 C LEU A 124 1.217 -14.017 -3.817 1.00 0.00 C ATOM 1927 O LEU A 124 1.846 -14.933 -3.285 1.00 0.00 O ATOM 1928 CB LEU A 124 -0.188 -12.502 -2.407 1.00 0.00 C ATOM 1929 CG LEU A 124 -1.532 -11.794 -2.228 1.00 0.00 C ATOM 1930 CD1 LEU A 124 -1.557 -11.020 -0.919 1.00 0.00 C ATOM 1931 CD2 LEU A 124 -1.807 -10.868 -3.403 1.00 0.00 C ATOM 0 HA LEU A 124 -0.786 -13.416 -4.258 1.00 0.00 H new ATOM 0 HB2 LEU A 124 0.153 -12.854 -1.433 1.00 0.00 H new ATOM 0 HB3 LEU A 124 0.545 -11.775 -2.758 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.318 -12.549 -2.195 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.521 -10.523 -0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -1.406 -11.708 -0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.762 -10.274 -0.922 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.767 -10.373 -3.259 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.018 -10.119 -3.468 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -1.833 -11.448 -4.325 1.00 0.00 H new ATOM 1943 N ARG A 125 1.719 -13.267 -4.792 1.00 0.00 N ATOM 1944 CA ARG A 125 3.068 -13.481 -5.305 1.00 0.00 C ATOM 1945 C ARG A 125 4.109 -13.227 -4.220 1.00 0.00 C ATOM 1946 O ARG A 125 5.076 -13.976 -4.085 1.00 0.00 O ATOM 1947 CB ARG A 125 3.332 -12.569 -6.505 1.00 0.00 C ATOM 1948 CG ARG A 125 2.285 -12.688 -7.600 1.00 0.00 C ATOM 1949 CD ARG A 125 2.362 -14.033 -8.303 1.00 0.00 C ATOM 1950 NE ARG A 125 1.405 -14.994 -7.754 1.00 0.00 N ATOM 1951 CZ ARG A 125 1.746 -16.114 -7.117 1.00 0.00 C ATOM 1952 NH1 ARG A 125 3.024 -16.430 -6.936 1.00 0.00 N ATOM 1953 NH2 ARG A 125 0.802 -16.924 -6.657 1.00 0.00 N ATOM 0 H ARG A 125 1.212 -12.505 -5.243 1.00 0.00 H new ATOM 0 HA ARG A 125 3.147 -14.520 -5.624 1.00 0.00 H new ATOM 0 HB2 ARG A 125 3.372 -11.535 -6.163 1.00 0.00 H new ATOM 0 HB3 ARG A 125 4.311 -12.805 -6.922 1.00 0.00 H new ATOM 0 HG2 ARG A 125 1.292 -12.558 -7.170 1.00 0.00 H new ATOM 0 HG3 ARG A 125 2.425 -11.888 -8.327 1.00 0.00 H new ATOM 0 HD2 ARG A 125 2.169 -13.897 -9.367 1.00 0.00 H new ATOM 0 HD3 ARG A 125 3.372 -14.433 -8.210 1.00 0.00 H new ATOM 0 HE ARG A 125 0.411 -14.794 -7.866 1.00 0.00 H new ATOM 0 HH11 ARG A 125 3.757 -15.813 -7.286 1.00 0.00 H new ATOM 0 HH12 ARG A 125 3.272 -17.290 -6.447 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -0.181 -16.689 -6.791 1.00 0.00 H new ATOM 0 HH22 ARG A 125 1.059 -17.782 -6.169 1.00 0.00 H new ATOM 1967 N ASN A 126 3.904 -12.165 -3.449 1.00 0.00 N ATOM 1968 CA ASN A 126 4.824 -11.810 -2.375 1.00 0.00 C ATOM 1969 C ASN A 126 4.064 -11.290 -1.160 1.00 0.00 C ATOM 1970 O ASN A 126 2.864 -11.025 -1.231 1.00 0.00 O ATOM 1971 CB ASN A 126 5.823 -10.756 -2.857 1.00 0.00 C ATOM 1972 CG ASN A 126 5.158 -9.640 -3.638 1.00 0.00 C ATOM 1973 OD1 ASN A 126 4.609 -8.702 -3.058 1.00 0.00 O ATOM 1974 ND2 ASN A 126 5.202 -9.736 -4.961 1.00 0.00 N ATOM 0 H ASN A 126 3.108 -11.535 -3.548 1.00 0.00 H new ATOM 0 HA ASN A 126 5.368 -12.708 -2.084 1.00 0.00 H new ATOM 0 HB2 ASN A 126 6.343 -10.333 -1.997 1.00 0.00 H new ATOM 0 HB3 ASN A 126 6.577 -11.234 -3.483 1.00 0.00 H new ATOM 0 HD21 ASN A 126 4.770 -9.015 -5.539 1.00 0.00 H new ATOM 0 HD22 ASN A 126 5.668 -10.531 -5.399 1.00 0.00 H new ATOM 1981 N GLU A 127 4.771 -11.146 -0.044 1.00 0.00 N ATOM 1982 CA GLU A 127 4.163 -10.658 1.188 1.00 0.00 C ATOM 1983 C GLU A 127 3.890 -9.157 1.103 1.00 0.00 C ATOM 1984 O GLU A 127 4.761 -8.384 0.702 1.00 0.00 O ATOM 1985 CB GLU A 127 5.072 -10.957 2.382 1.00 0.00 C ATOM 1986 CG GLU A 127 5.379 -12.435 2.559 1.00 0.00 C ATOM 1987 CD GLU A 127 6.580 -12.676 3.452 1.00 0.00 C ATOM 1988 OE1 GLU A 127 6.874 -11.808 4.301 1.00 0.00 O ATOM 1989 OE2 GLU A 127 7.227 -13.735 3.302 1.00 0.00 O ATOM 0 H GLU A 127 5.765 -11.360 0.032 1.00 0.00 H new ATOM 0 HA GLU A 127 3.213 -11.174 1.325 1.00 0.00 H new ATOM 0 HB2 GLU A 127 6.008 -10.412 2.260 1.00 0.00 H new ATOM 0 HB3 GLU A 127 4.600 -10.581 3.290 1.00 0.00 H new ATOM 0 HG2 GLU A 127 4.509 -12.935 2.984 1.00 0.00 H new ATOM 0 HG3 GLU A 127 5.560 -12.885 1.583 1.00 0.00 H new ATOM 1996 N PRO A 128 2.675 -8.718 1.483 1.00 0.00 N ATOM 1997 CA PRO A 128 2.303 -7.299 1.445 1.00 0.00 C ATOM 1998 C PRO A 128 3.286 -6.423 2.213 1.00 0.00 C ATOM 1999 O PRO A 128 3.477 -6.595 3.417 1.00 0.00 O ATOM 2000 CB PRO A 128 0.927 -7.269 2.115 1.00 0.00 C ATOM 2001 CG PRO A 128 0.384 -8.644 1.936 1.00 0.00 C ATOM 2002 CD PRO A 128 1.572 -9.565 1.977 1.00 0.00 C ATOM 0 HA PRO A 128 2.304 -6.907 0.428 1.00 0.00 H new ATOM 0 HB2 PRO A 128 1.007 -7.010 3.171 1.00 0.00 H new ATOM 0 HB3 PRO A 128 0.279 -6.525 1.653 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -0.327 -8.889 2.725 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -0.147 -8.734 0.989 1.00 0.00 H new ATOM 0 HD2 PRO A 128 1.765 -9.928 2.986 1.00 0.00 H new ATOM 0 HD3 PRO A 128 1.424 -10.441 1.346 1.00 0.00 H new ATOM 2010 N LEU A 129 3.909 -5.483 1.509 1.00 0.00 N ATOM 2011 CA LEU A 129 4.873 -4.579 2.125 1.00 0.00 C ATOM 2012 C LEU A 129 4.213 -3.256 2.503 1.00 0.00 C ATOM 2013 O LEU A 129 3.210 -2.860 1.908 1.00 0.00 O ATOM 2014 CB LEU A 129 6.045 -4.325 1.177 1.00 0.00 C ATOM 2015 CG LEU A 129 6.643 -5.580 0.537 1.00 0.00 C ATOM 2016 CD1 LEU A 129 7.036 -5.309 -0.907 1.00 0.00 C ATOM 2017 CD2 LEU A 129 7.845 -6.063 1.337 1.00 0.00 C ATOM 0 H LEU A 129 3.763 -5.328 0.511 1.00 0.00 H new ATOM 0 HA LEU A 129 5.247 -5.051 3.034 1.00 0.00 H new ATOM 0 HB2 LEU A 129 5.713 -3.654 0.385 1.00 0.00 H new ATOM 0 HB3 LEU A 129 6.831 -3.806 1.726 1.00 0.00 H new ATOM 0 HG LEU A 129 5.886 -6.364 0.544 1.00 0.00 H new ATOM 0 HD11 LEU A 129 7.459 -6.213 -1.345 1.00 0.00 H new ATOM 0 HD12 LEU A 129 6.154 -5.010 -1.474 1.00 0.00 H new ATOM 0 HD13 LEU A 129 7.776 -4.510 -0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.259 -6.956 0.869 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.604 -5.281 1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 129 7.534 -6.298 2.355 1.00 0.00 H new ATOM 2029 N VAL A 130 4.780 -2.578 3.495 1.00 0.00 N ATOM 2030 CA VAL A 130 4.246 -1.300 3.949 1.00 0.00 C ATOM 2031 C VAL A 130 5.108 -0.140 3.460 1.00 0.00 C ATOM 2032 O VAL A 130 6.336 -0.190 3.537 1.00 0.00 O ATOM 2033 CB VAL A 130 4.150 -1.248 5.487 1.00 0.00 C ATOM 2034 CG1 VAL A 130 5.528 -1.385 6.121 1.00 0.00 C ATOM 2035 CG2 VAL A 130 3.471 0.038 5.936 1.00 0.00 C ATOM 0 H VAL A 130 5.609 -2.892 4.000 1.00 0.00 H new ATOM 0 HA VAL A 130 3.245 -1.205 3.528 1.00 0.00 H new ATOM 0 HB VAL A 130 3.542 -2.089 5.821 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.435 -1.345 7.206 1.00 0.00 H new ATOM 0 HG12 VAL A 130 5.970 -2.338 5.829 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.167 -0.570 5.782 1.00 0.00 H new ATOM 0 HG21 VAL A 130 3.412 0.057 7.024 1.00 0.00 H new ATOM 0 HG22 VAL A 130 4.048 0.895 5.589 1.00 0.00 H new ATOM 0 HG23 VAL A 130 2.466 0.084 5.517 1.00 0.00 H new ATOM 2045 N LEU A 131 4.456 0.903 2.956 1.00 0.00 N ATOM 2046 CA LEU A 131 5.162 2.076 2.454 1.00 0.00 C ATOM 2047 C LEU A 131 5.998 2.721 3.555 1.00 0.00 C ATOM 2048 O LEU A 131 5.653 2.648 4.734 1.00 0.00 O ATOM 2049 CB LEU A 131 4.169 3.093 1.890 1.00 0.00 C ATOM 2050 CG LEU A 131 4.795 4.382 1.357 1.00 0.00 C ATOM 2051 CD1 LEU A 131 5.661 4.092 0.142 1.00 0.00 C ATOM 2052 CD2 LEU A 131 3.714 5.396 1.015 1.00 0.00 C ATOM 0 H LEU A 131 3.440 0.960 2.884 1.00 0.00 H new ATOM 0 HA LEU A 131 5.831 1.752 1.657 1.00 0.00 H new ATOM 0 HB2 LEU A 131 3.606 2.620 1.085 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.453 3.351 2.671 1.00 0.00 H new ATOM 0 HG LEU A 131 5.429 4.805 2.136 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.098 5.021 -0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.457 3.401 0.419 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.050 3.646 -0.642 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.177 6.308 0.637 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.054 4.981 0.253 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.135 5.627 1.910 1.00 0.00 H new ATOM 2064 N GLU A 132 7.100 3.352 3.161 1.00 0.00 N ATOM 2065 CA GLU A 132 7.986 4.011 4.114 1.00 0.00 C ATOM 2066 C GLU A 132 7.323 5.252 4.704 1.00 0.00 C ATOM 2067 O GLU A 132 7.382 6.335 4.122 1.00 0.00 O ATOM 2068 CB GLU A 132 9.304 4.391 3.437 1.00 0.00 C ATOM 2069 CG GLU A 132 10.532 4.078 4.278 1.00 0.00 C ATOM 2070 CD GLU A 132 11.557 3.249 3.527 1.00 0.00 C ATOM 2071 OE1 GLU A 132 11.358 2.021 3.412 1.00 0.00 O ATOM 2072 OE2 GLU A 132 12.558 3.828 3.055 1.00 0.00 O ATOM 0 H GLU A 132 7.400 3.421 2.189 1.00 0.00 H new ATOM 0 HA GLU A 132 8.192 3.313 4.925 1.00 0.00 H new ATOM 0 HB2 GLU A 132 9.380 3.863 2.487 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.292 5.457 3.209 1.00 0.00 H new ATOM 0 HG2 GLU A 132 10.992 5.011 4.603 1.00 0.00 H new ATOM 0 HG3 GLU A 132 10.226 3.543 5.177 1.00 0.00 H new ATOM 2079 N GLY A 133 6.692 5.086 5.862 1.00 0.00 N ATOM 2080 CA GLY A 133 6.027 6.201 6.510 1.00 0.00 C ATOM 2081 C GLY A 133 4.519 6.139 6.369 1.00 0.00 C ATOM 2082 O GLY A 133 3.787 6.498 7.292 1.00 0.00 O ATOM 0 H GLY A 133 6.629 4.200 6.363 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.290 6.211 7.568 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.391 7.135 6.082 1.00 0.00 H new ATOM 2086 N GLY A 134 4.054 5.682 5.212 1.00 0.00 N ATOM 2087 CA GLY A 134 2.626 5.581 4.974 1.00 0.00 C ATOM 2088 C GLY A 134 2.074 6.784 4.236 1.00 0.00 C ATOM 2089 O GLY A 134 2.785 7.430 3.468 1.00 0.00 O ATOM 0 H GLY A 134 4.640 5.379 4.434 1.00 0.00 H new ATOM 0 HA2 GLY A 134 2.420 4.679 4.397 1.00 0.00 H new ATOM 0 HA3 GLY A 134 2.109 5.475 5.928 1.00 0.00 H new ATOM 2093 N TYR A 135 0.800 7.087 4.471 1.00 0.00 N ATOM 2094 CA TYR A 135 0.151 8.221 3.823 1.00 0.00 C ATOM 2095 C TYR A 135 0.856 9.526 4.177 1.00 0.00 C ATOM 2096 O TYR A 135 1.012 10.408 3.333 1.00 0.00 O ATOM 2097 CB TYR A 135 -1.321 8.295 4.231 1.00 0.00 C ATOM 2098 CG TYR A 135 -2.127 9.281 3.417 1.00 0.00 C ATOM 2099 CD1 TYR A 135 -2.174 10.624 3.767 1.00 0.00 C ATOM 2100 CD2 TYR A 135 -2.843 8.868 2.300 1.00 0.00 C ATOM 2101 CE1 TYR A 135 -2.910 11.529 3.025 1.00 0.00 C ATOM 2102 CE2 TYR A 135 -3.580 9.766 1.553 1.00 0.00 C ATOM 2103 CZ TYR A 135 -3.611 11.095 1.920 1.00 0.00 C ATOM 2104 OH TYR A 135 -4.346 11.993 1.179 1.00 0.00 O ATOM 0 H TYR A 135 0.198 6.563 5.105 1.00 0.00 H new ATOM 0 HA TYR A 135 0.214 8.076 2.745 1.00 0.00 H new ATOM 0 HB2 TYR A 135 -1.767 7.305 4.132 1.00 0.00 H new ATOM 0 HB3 TYR A 135 -1.384 8.569 5.284 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -1.627 10.967 4.633 1.00 0.00 H new ATOM 0 HD2 TYR A 135 -2.823 7.828 2.011 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -2.936 12.571 3.309 1.00 0.00 H new ATOM 0 HE2 TYR A 135 -4.129 9.429 0.686 1.00 0.00 H new ATOM 0 HH TYR A 135 -4.778 11.526 0.434 1.00 0.00 H new ATOM 2114 N GLU A 136 1.278 9.643 5.432 1.00 0.00 N ATOM 2115 CA GLU A 136 1.966 10.841 5.898 1.00 0.00 C ATOM 2116 C GLU A 136 3.245 11.080 5.102 1.00 0.00 C ATOM 2117 O GLU A 136 3.658 12.222 4.901 1.00 0.00 O ATOM 2118 CB GLU A 136 2.294 10.721 7.388 1.00 0.00 C ATOM 2119 CG GLU A 136 2.538 12.058 8.068 1.00 0.00 C ATOM 2120 CD GLU A 136 1.250 12.791 8.389 1.00 0.00 C ATOM 2121 OE1 GLU A 136 0.495 12.311 9.260 1.00 0.00 O ATOM 2122 OE2 GLU A 136 0.997 13.846 7.770 1.00 0.00 O ATOM 0 H GLU A 136 1.156 8.923 6.144 1.00 0.00 H new ATOM 0 HA GLU A 136 1.301 11.692 5.747 1.00 0.00 H new ATOM 0 HB2 GLU A 136 1.473 10.211 7.892 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.179 10.096 7.507 1.00 0.00 H new ATOM 0 HG2 GLU A 136 3.099 11.897 8.988 1.00 0.00 H new ATOM 0 HG3 GLU A 136 3.156 12.682 7.423 1.00 0.00 H new ATOM 2129 N ASN A 137 3.867 9.995 4.652 1.00 0.00 N ATOM 2130 CA ASN A 137 5.100 10.088 3.878 1.00 0.00 C ATOM 2131 C ASN A 137 4.797 10.307 2.398 1.00 0.00 C ATOM 2132 O ASN A 137 5.565 10.955 1.687 1.00 0.00 O ATOM 2133 CB ASN A 137 5.937 8.818 4.060 1.00 0.00 C ATOM 2134 CG ASN A 137 7.240 9.086 4.788 1.00 0.00 C ATOM 2135 OD1 ASN A 137 7.269 9.201 6.014 1.00 0.00 O ATOM 2136 ND2 ASN A 137 8.329 9.187 4.034 1.00 0.00 N ATOM 0 H ASN A 137 3.538 9.042 4.810 1.00 0.00 H new ATOM 0 HA ASN A 137 5.668 10.944 4.244 1.00 0.00 H new ATOM 0 HB2 ASN A 137 5.358 8.081 4.616 1.00 0.00 H new ATOM 0 HB3 ASN A 137 6.152 8.384 3.083 1.00 0.00 H new ATOM 0 HD21 ASN A 137 9.235 9.367 4.468 1.00 0.00 H new ATOM 0 HD22 ASN A 137 8.260 9.085 3.021 1.00 0.00 H new ATOM 2143 N TRP A 138 3.674 9.764 1.942 1.00 0.00 N ATOM 2144 CA TRP A 138 3.270 9.901 0.548 1.00 0.00 C ATOM 2145 C TRP A 138 3.081 11.368 0.178 1.00 0.00 C ATOM 2146 O TRP A 138 3.437 11.792 -0.921 1.00 0.00 O ATOM 2147 CB TRP A 138 1.975 9.129 0.291 1.00 0.00 C ATOM 2148 CG TRP A 138 1.581 9.093 -1.154 1.00 0.00 C ATOM 2149 CD1 TRP A 138 0.468 9.651 -1.715 1.00 0.00 C ATOM 2150 CD2 TRP A 138 2.298 8.465 -2.223 1.00 0.00 C ATOM 2151 NE1 TRP A 138 0.450 9.408 -3.067 1.00 0.00 N ATOM 2152 CE2 TRP A 138 1.563 8.683 -3.403 1.00 0.00 C ATOM 2153 CE3 TRP A 138 3.492 7.741 -2.297 1.00 0.00 C ATOM 2154 CZ2 TRP A 138 1.982 8.202 -4.641 1.00 0.00 C ATOM 2155 CZ3 TRP A 138 3.907 7.264 -3.527 1.00 0.00 C ATOM 2156 CH2 TRP A 138 3.153 7.497 -4.684 1.00 0.00 C ATOM 0 H TRP A 138 3.027 9.225 2.518 1.00 0.00 H new ATOM 0 HA TRP A 138 4.062 9.486 -0.075 1.00 0.00 H new ATOM 0 HB2 TRP A 138 2.091 8.108 0.654 1.00 0.00 H new ATOM 0 HB3 TRP A 138 1.169 9.583 0.868 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -0.287 10.203 -1.175 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.274 9.717 -3.715 1.00 0.00 H new ATOM 0 HE3 TRP A 138 4.080 7.558 -1.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 1.403 8.379 -5.535 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 4.827 6.703 -3.596 1.00 0.00 H new ATOM 0 HH2 TRP A 138 3.504 7.112 -5.630 1.00 0.00 H new ATOM 2167 N LEU A 139 2.520 12.140 1.103 1.00 0.00 N ATOM 2168 CA LEU A 139 2.286 13.560 0.873 1.00 0.00 C ATOM 2169 C LEU A 139 3.605 14.319 0.766 1.00 0.00 C ATOM 2170 O LEU A 139 3.703 15.315 0.048 1.00 0.00 O ATOM 2171 CB LEU A 139 1.437 14.147 2.003 1.00 0.00 C ATOM 2172 CG LEU A 139 0.147 13.384 2.308 1.00 0.00 C ATOM 2173 CD1 LEU A 139 -0.428 13.821 3.646 1.00 0.00 C ATOM 2174 CD2 LEU A 139 -0.869 13.591 1.196 1.00 0.00 C ATOM 0 H LEU A 139 2.219 11.806 2.019 1.00 0.00 H new ATOM 0 HA LEU A 139 1.749 13.666 -0.070 1.00 0.00 H new ATOM 0 HB2 LEU A 139 2.042 14.184 2.909 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.181 15.175 1.748 1.00 0.00 H new ATOM 0 HG LEU A 139 0.381 12.321 2.367 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -1.345 13.267 3.846 1.00 0.00 H new ATOM 0 HD12 LEU A 139 0.296 13.621 4.436 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -0.647 14.888 3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -1.781 13.041 1.429 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -1.099 14.653 1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.457 13.228 0.255 1.00 0.00 H new ATOM 2186 N LEU A 140 4.617 13.841 1.483 1.00 0.00 N ATOM 2187 CA LEU A 140 5.930 14.473 1.468 1.00 0.00 C ATOM 2188 C LEU A 140 6.680 14.141 0.182 1.00 0.00 C ATOM 2189 O LEU A 140 7.476 14.941 -0.309 1.00 0.00 O ATOM 2190 CB LEU A 140 6.749 14.023 2.680 1.00 0.00 C ATOM 2191 CG LEU A 140 6.585 14.890 3.931 1.00 0.00 C ATOM 2192 CD1 LEU A 140 6.543 14.025 5.180 1.00 0.00 C ATOM 2193 CD2 LEU A 140 7.711 15.909 4.024 1.00 0.00 C ATOM 0 H LEU A 140 4.552 13.018 2.082 1.00 0.00 H new ATOM 0 HA LEU A 140 5.786 15.552 1.515 1.00 0.00 H new ATOM 0 HB2 LEU A 140 6.471 12.999 2.927 1.00 0.00 H new ATOM 0 HB3 LEU A 140 7.803 14.009 2.402 1.00 0.00 H new ATOM 0 HG LEU A 140 5.640 15.427 3.855 1.00 0.00 H new ATOM 0 HD11 LEU A 140 6.426 14.660 6.058 1.00 0.00 H new ATOM 0 HD12 LEU A 140 5.702 13.335 5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.471 13.459 5.262 1.00 0.00 H new ATOM 0 HD21 LEU A 140 7.579 16.517 4.919 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.668 15.390 4.076 1.00 0.00 H new ATOM 0 HD23 LEU A 140 7.694 16.551 3.144 1.00 0.00 H new ATOM 2205 N CYS A 141 6.420 12.955 -0.359 1.00 0.00 N ATOM 2206 CA CYS A 141 7.070 12.516 -1.589 1.00 0.00 C ATOM 2207 C CYS A 141 6.300 12.998 -2.813 1.00 0.00 C ATOM 2208 O CYS A 141 6.884 13.544 -3.750 1.00 0.00 O ATOM 2209 CB CYS A 141 7.185 10.991 -1.611 1.00 0.00 C ATOM 2210 SG CYS A 141 8.078 10.297 -0.201 1.00 0.00 S ATOM 0 H CYS A 141 5.764 12.281 0.035 1.00 0.00 H new ATOM 0 HA CYS A 141 8.070 12.950 -1.618 1.00 0.00 H new ATOM 0 HB2 CYS A 141 6.183 10.562 -1.639 1.00 0.00 H new ATOM 0 HB3 CYS A 141 7.687 10.689 -2.530 1.00 0.00 H new ATOM 0 HG CYS A 141 7.338 10.380 0.865 1.00 0.00 H new ATOM 2216 N TYR A 142 4.987 12.792 -2.800 1.00 0.00 N ATOM 2217 CA TYR A 142 4.137 13.206 -3.910 1.00 0.00 C ATOM 2218 C TYR A 142 2.818 13.782 -3.402 1.00 0.00 C ATOM 2219 O TYR A 142 1.807 13.082 -3.342 1.00 0.00 O ATOM 2220 CB TYR A 142 3.867 12.021 -4.840 1.00 0.00 C ATOM 2221 CG TYR A 142 5.123 11.326 -5.315 1.00 0.00 C ATOM 2222 CD1 TYR A 142 5.787 11.754 -6.457 1.00 0.00 C ATOM 2223 CD2 TYR A 142 5.645 10.242 -4.619 1.00 0.00 C ATOM 2224 CE1 TYR A 142 6.935 11.121 -6.894 1.00 0.00 C ATOM 2225 CE2 TYR A 142 6.793 9.605 -5.050 1.00 0.00 C ATOM 2226 CZ TYR A 142 7.434 10.049 -6.187 1.00 0.00 C ATOM 2227 OH TYR A 142 8.578 9.417 -6.619 1.00 0.00 O ATOM 0 H TYR A 142 4.489 12.341 -2.033 1.00 0.00 H new ATOM 0 HA TYR A 142 4.660 13.984 -4.466 1.00 0.00 H new ATOM 0 HB2 TYR A 142 3.236 11.299 -4.321 1.00 0.00 H new ATOM 0 HB3 TYR A 142 3.305 12.370 -5.706 1.00 0.00 H new ATOM 0 HD1 TYR A 142 5.400 12.595 -7.013 1.00 0.00 H new ATOM 0 HD2 TYR A 142 5.146 9.892 -3.728 1.00 0.00 H new ATOM 0 HE1 TYR A 142 7.439 11.465 -7.785 1.00 0.00 H new ATOM 0 HE2 TYR A 142 7.186 8.763 -4.499 1.00 0.00 H new ATOM 0 HH TYR A 142 9.152 10.061 -7.084 1.00 0.00 H new ATOM 2237 N PRO A 143 2.812 15.073 -3.028 1.00 0.00 N ATOM 2238 CA PRO A 143 1.608 15.742 -2.522 1.00 0.00 C ATOM 2239 C PRO A 143 0.563 15.963 -3.612 1.00 0.00 C ATOM 2240 O PRO A 143 -0.627 16.094 -3.326 1.00 0.00 O ATOM 2241 CB PRO A 143 2.137 17.084 -2.009 1.00 0.00 C ATOM 2242 CG PRO A 143 3.372 17.333 -2.803 1.00 0.00 C ATOM 2243 CD PRO A 143 3.974 15.980 -3.068 1.00 0.00 C ATOM 0 HA PRO A 143 1.102 15.148 -1.761 1.00 0.00 H new ATOM 0 HB2 PRO A 143 1.406 17.879 -2.154 1.00 0.00 H new ATOM 0 HB3 PRO A 143 2.354 17.042 -0.942 1.00 0.00 H new ATOM 0 HG2 PRO A 143 3.139 17.846 -3.736 1.00 0.00 H new ATOM 0 HG3 PRO A 143 4.067 17.969 -2.254 1.00 0.00 H new ATOM 0 HD2 PRO A 143 4.476 15.946 -4.035 1.00 0.00 H new ATOM 0 HD3 PRO A 143 4.716 15.716 -2.314 1.00 0.00 H new ATOM 2251 N GLN A 144 1.015 16.003 -4.862 1.00 0.00 N ATOM 2252 CA GLN A 144 0.116 16.209 -5.992 1.00 0.00 C ATOM 2253 C GLN A 144 -0.284 14.877 -6.620 1.00 0.00 C ATOM 2254 O GLN A 144 -0.344 14.749 -7.843 1.00 0.00 O ATOM 2255 CB GLN A 144 0.781 17.103 -7.041 1.00 0.00 C ATOM 2256 CG GLN A 144 2.038 16.499 -7.646 1.00 0.00 C ATOM 2257 CD GLN A 144 2.071 16.613 -9.158 1.00 0.00 C ATOM 2258 OE1 GLN A 144 1.618 17.606 -9.727 1.00 0.00 O ATOM 2259 NE2 GLN A 144 2.610 15.595 -9.817 1.00 0.00 N ATOM 0 H GLN A 144 1.997 15.896 -5.117 1.00 0.00 H new ATOM 0 HA GLN A 144 -0.785 16.700 -5.624 1.00 0.00 H new ATOM 0 HB2 GLN A 144 0.066 17.307 -7.838 1.00 0.00 H new ATOM 0 HB3 GLN A 144 1.031 18.060 -6.584 1.00 0.00 H new ATOM 0 HG2 GLN A 144 2.913 16.997 -7.229 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.104 15.448 -7.363 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.974 14.791 -9.305 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.661 15.616 -10.836 1.00 0.00 H new ATOM 2268 N TYR A 145 -0.556 13.888 -5.775 1.00 0.00 N ATOM 2269 CA TYR A 145 -0.950 12.565 -6.247 1.00 0.00 C ATOM 2270 C TYR A 145 -1.958 11.926 -5.299 1.00 0.00 C ATOM 2271 O TYR A 145 -1.983 10.707 -5.133 1.00 0.00 O ATOM 2272 CB TYR A 145 0.279 11.664 -6.389 1.00 0.00 C ATOM 2273 CG TYR A 145 0.268 10.815 -7.640 1.00 0.00 C ATOM 2274 CD1 TYR A 145 0.501 11.380 -8.887 1.00 0.00 C ATOM 2275 CD2 TYR A 145 0.026 9.449 -7.573 1.00 0.00 C ATOM 2276 CE1 TYR A 145 0.493 10.607 -10.033 1.00 0.00 C ATOM 2277 CE2 TYR A 145 0.015 8.670 -8.715 1.00 0.00 C ATOM 2278 CZ TYR A 145 0.249 9.254 -9.942 1.00 0.00 C ATOM 2279 OH TYR A 145 0.239 8.481 -11.079 1.00 0.00 O ATOM 0 H TYR A 145 -0.511 13.977 -4.760 1.00 0.00 H new ATOM 0 HA TYR A 145 -1.421 12.681 -7.223 1.00 0.00 H new ATOM 0 HB2 TYR A 145 1.175 12.284 -6.389 1.00 0.00 H new ATOM 0 HB3 TYR A 145 0.343 11.012 -5.518 1.00 0.00 H new ATOM 0 HD1 TYR A 145 0.692 12.440 -8.963 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -0.156 8.988 -6.614 1.00 0.00 H new ATOM 0 HE1 TYR A 145 0.677 11.062 -10.995 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -0.176 7.609 -8.646 1.00 0.00 H new ATOM 0 HH TYR A 145 0.053 7.549 -10.839 1.00 0.00 H new ATOM 2289 N THR A 146 -2.789 12.758 -4.678 1.00 0.00 N ATOM 2290 CA THR A 146 -3.800 12.274 -3.745 1.00 0.00 C ATOM 2291 C THR A 146 -5.173 12.843 -4.085 1.00 0.00 C ATOM 2292 O THR A 146 -5.297 13.731 -4.928 1.00 0.00 O ATOM 2293 CB THR A 146 -3.421 12.646 -2.310 1.00 0.00 C ATOM 2294 OG1 THR A 146 -2.666 13.845 -2.286 1.00 0.00 O ATOM 2295 CG2 THR A 146 -2.610 11.578 -1.609 1.00 0.00 C ATOM 0 H THR A 146 -2.782 13.770 -4.804 1.00 0.00 H new ATOM 0 HA THR A 146 -3.846 11.188 -3.831 1.00 0.00 H new ATOM 0 HB THR A 146 -4.367 12.765 -1.782 1.00 0.00 H new ATOM 0 HG1 THR A 146 -2.235 13.942 -1.411 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.375 11.906 -0.596 1.00 0.00 H new ATOM 0 HG22 THR A 146 -3.185 10.653 -1.567 1.00 0.00 H new ATOM 0 HG23 THR A 146 -1.685 11.405 -2.158 1.00 0.00 H new ATOM 2303 N THR A 147 -6.202 12.326 -3.422 1.00 0.00 N ATOM 2304 CA THR A 147 -7.566 12.781 -3.654 1.00 0.00 C ATOM 2305 C THR A 147 -7.828 14.103 -2.939 1.00 0.00 C ATOM 2306 O THR A 147 -8.571 14.951 -3.434 1.00 0.00 O ATOM 2307 CB THR A 147 -8.566 11.725 -3.180 1.00 0.00 C ATOM 2308 OG1 THR A 147 -8.505 11.572 -1.774 1.00 0.00 O ATOM 2309 CG2 THR A 147 -8.338 10.364 -3.800 1.00 0.00 C ATOM 0 H THR A 147 -6.116 11.591 -2.720 1.00 0.00 H new ATOM 0 HA THR A 147 -7.693 12.937 -4.725 1.00 0.00 H new ATOM 0 HB THR A 147 -9.543 12.091 -3.495 1.00 0.00 H new ATOM 0 HG1 THR A 147 -7.609 11.271 -1.516 1.00 0.00 H new ATOM 0 HG21 THR A 147 -9.081 9.662 -3.421 1.00 0.00 H new ATOM 0 HG22 THR A 147 -8.428 10.438 -4.884 1.00 0.00 H new ATOM 0 HG23 THR A 147 -7.340 10.009 -3.543 1.00 0.00 H new ATOM 2317 N ASN A 148 -7.214 14.270 -1.773 1.00 0.00 N ATOM 2318 CA ASN A 148 -7.381 15.488 -0.989 1.00 0.00 C ATOM 2319 C ASN A 148 -6.072 16.266 -0.906 1.00 0.00 C ATOM 2320 O ASN A 148 -5.962 17.374 -1.434 1.00 0.00 O ATOM 2321 CB ASN A 148 -7.875 15.150 0.418 1.00 0.00 C ATOM 2322 CG ASN A 148 -8.802 16.212 0.976 1.00 0.00 C ATOM 2323 OD1 ASN A 148 -9.803 16.566 0.355 1.00 0.00 O ATOM 2324 ND2 ASN A 148 -8.471 16.725 2.155 1.00 0.00 N ATOM 0 H ASN A 148 -6.596 13.577 -1.350 1.00 0.00 H new ATOM 0 HA ASN A 148 -8.123 16.112 -1.488 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -8.395 14.192 0.397 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -7.019 15.033 1.082 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -9.057 17.443 2.581 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -7.631 16.401 2.634 1.00 0.00 H new ATOM 2331 N ALA A 149 -5.082 15.681 -0.241 1.00 0.00 N ATOM 2332 CA ALA A 149 -3.780 16.320 -0.089 1.00 0.00 C ATOM 2333 C ALA A 149 -3.902 17.640 0.663 1.00 0.00 C ATOM 2334 O ALA A 149 -3.144 18.578 0.418 1.00 0.00 O ATOM 2335 CB ALA A 149 -3.140 16.543 -1.452 1.00 0.00 C ATOM 0 H ALA A 149 -5.156 14.765 0.202 1.00 0.00 H new ATOM 0 HA ALA A 149 -3.142 15.657 0.495 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -2.169 17.021 -1.324 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -3.010 15.584 -1.954 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -3.783 17.184 -2.055 1.00 0.00 H new