USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 760 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 58 TYR OH : rot 17:sc= -1.78 USER MOD Set 1.2: A 124 SER OG : rot 28:sc= -0.0356 USER MOD Set 2.1: A 106 THR OG1 : rot 165:sc= 1.26 USER MOD Set 2.2: A 110 SER OG : rot 180:sc= 0.685 USER MOD Set 3.1: A 70 TYR OH : rot -168:sc= 0.568 USER MOD Set 3.2: A 90 SER OG : rot 144:sc= 1.67 USER MOD Set 4.1: A 60 ASN : amide:sc= -1.7 K(o=-1.9,f=-6.8!) USER MOD Set 4.2: A 131 ASN :FLIP amide:sc= -0.218 F(o=-3.9,f=-1.9) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 157:sc= -0.0201 (180deg=-0.238) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 177:sc= -1.33! USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 73:sc= -0.531 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -1.66 K(o=-1.7,f=-4.9!) USER MOD Single : A 96 ASN : amide:sc= -3.67 K(o=-3.7,f=-10!) USER MOD Single : A 99 GLN : amide:sc= -0.312 K(o=-0.31,f=-1.2) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 139:sc= -1.39 (180deg=-3.49!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl 140:sc= -1.91 (180deg=-3.21!) USER MOD Single : A 125 TYR OH : rot 113:sc= -0.259 USER MOD Single : A 127 CYS SG : rot -29:sc= -6.83! USER MOD Single : A 128 SER OG : rot -156:sc= -0.183 USER MOD Single : A 129 SER OG : rot 180:sc= -1 USER MOD Single : A 134 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00313) USER MOD Single : A 135 LYS NZ :NH3+ 135:sc= -0.155 (180deg=-0.705) USER MOD Single : A 138 TYR OH : rot 147:sc= -0.133 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 ASN : amide:sc=-0.00112 X(o=-0.0011,f=-0.0011) USER MOD Single : A 143 ASN : amide:sc= -0.0159 X(o=-0.016,f=-0.26) USER MOD Single : A 145 ASN : amide:sc= -0.496 K(o=-0.5,f=-2.9!) USER MOD Single : A 147 SER OG : rot -61:sc= -1.92 USER MOD ----------------------------------------------------------------- ATOM 211 N ALA A 52 -1.417 -13.055 -0.776 1.00 0.00 N ATOM 212 CA ALA A 52 -1.507 -11.623 -1.034 1.00 0.00 C ATOM 213 C ALA A 52 -0.128 -11.017 -1.264 1.00 0.00 C ATOM 214 O ALA A 52 0.890 -11.613 -0.911 1.00 0.00 O ATOM 215 CB ALA A 52 -2.205 -10.924 0.122 1.00 0.00 C ATOM 0 HA ALA A 52 -2.093 -11.479 -1.942 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.266 -9.855 -0.083 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -3.210 -11.329 0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.640 -11.086 1.040 1.00 0.00 H new ATOM 221 N LYS A 53 -0.102 -9.827 -1.853 1.00 0.00 N ATOM 222 CA LYS A 53 1.152 -9.134 -2.126 1.00 0.00 C ATOM 223 C LYS A 53 1.471 -8.140 -1.014 1.00 0.00 C ATOM 224 O LYS A 53 0.588 -7.428 -0.535 1.00 0.00 O ATOM 225 CB LYS A 53 1.077 -8.409 -3.470 1.00 0.00 C ATOM 226 CG LYS A 53 0.856 -9.340 -4.652 1.00 0.00 C ATOM 227 CD LYS A 53 -0.287 -8.863 -5.537 1.00 0.00 C ATOM 228 CE LYS A 53 -1.540 -9.699 -5.331 1.00 0.00 C ATOM 229 NZ LYS A 53 -1.571 -10.884 -6.231 1.00 0.00 N ATOM 0 H LYS A 53 -0.936 -9.321 -2.151 1.00 0.00 H new ATOM 0 HA LYS A 53 1.950 -9.876 -2.168 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.267 -7.680 -3.436 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.001 -7.852 -3.625 1.00 0.00 H new ATOM 0 HG2 LYS A 53 1.771 -9.404 -5.241 1.00 0.00 H new ATOM 0 HG3 LYS A 53 0.640 -10.345 -4.289 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -0.506 -7.818 -5.318 1.00 0.00 H new ATOM 0 HD3 LYS A 53 0.016 -8.913 -6.583 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -1.589 -10.030 -4.294 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.421 -9.083 -5.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -2.441 -11.428 -6.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -1.550 -10.568 -7.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -0.744 -11.485 -6.042 1.00 0.00 H new ATOM 243 N LYS A 54 2.735 -8.092 -0.611 1.00 0.00 N ATOM 244 CA LYS A 54 3.164 -7.188 0.435 1.00 0.00 C ATOM 245 C LYS A 54 3.653 -5.878 -0.160 1.00 0.00 C ATOM 246 O LYS A 54 4.575 -5.845 -0.979 1.00 0.00 O ATOM 247 CB LYS A 54 4.269 -7.827 1.280 1.00 0.00 C ATOM 248 CG LYS A 54 4.008 -7.758 2.776 1.00 0.00 C ATOM 249 CD LYS A 54 2.741 -8.507 3.156 1.00 0.00 C ATOM 250 CE LYS A 54 3.058 -9.857 3.782 1.00 0.00 C ATOM 251 NZ LYS A 54 3.713 -9.713 5.111 1.00 0.00 N ATOM 0 H LYS A 54 3.479 -8.673 -0.998 1.00 0.00 H new ATOM 0 HA LYS A 54 2.309 -6.982 1.078 1.00 0.00 H new ATOM 0 HB2 LYS A 54 4.381 -8.871 0.987 1.00 0.00 H new ATOM 0 HB3 LYS A 54 5.215 -7.331 1.061 1.00 0.00 H new ATOM 0 HG2 LYS A 54 4.857 -8.180 3.314 1.00 0.00 H new ATOM 0 HG3 LYS A 54 3.922 -6.716 3.084 1.00 0.00 H new ATOM 0 HD2 LYS A 54 2.159 -7.908 3.856 1.00 0.00 H new ATOM 0 HD3 LYS A 54 2.123 -8.652 2.270 1.00 0.00 H new ATOM 0 HE2 LYS A 54 2.138 -10.431 3.891 1.00 0.00 H new ATOM 0 HE3 LYS A 54 3.710 -10.422 3.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 3.565 -10.580 5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 4.733 -9.555 4.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 3.299 -8.903 5.616 1.00 0.00 H new ATOM 265 N VAL A 55 3.026 -4.804 0.261 1.00 0.00 N ATOM 266 CA VAL A 55 3.385 -3.477 -0.215 1.00 0.00 C ATOM 267 C VAL A 55 3.561 -2.500 0.932 1.00 0.00 C ATOM 268 O VAL A 55 2.912 -2.616 1.972 1.00 0.00 O ATOM 269 CB VAL A 55 2.312 -2.886 -1.145 1.00 0.00 C ATOM 270 CG1 VAL A 55 2.215 -3.652 -2.447 1.00 0.00 C ATOM 271 CG2 VAL A 55 0.971 -2.846 -0.434 1.00 0.00 C ATOM 0 H VAL A 55 2.261 -4.818 0.935 1.00 0.00 H new ATOM 0 HA VAL A 55 4.322 -3.608 -0.756 1.00 0.00 H new ATOM 0 HB VAL A 55 2.606 -1.867 -1.396 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.446 -3.204 -3.076 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.174 -3.615 -2.963 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.955 -4.690 -2.240 1.00 0.00 H new ATOM 0 HG21 VAL A 55 0.218 -2.426 -1.101 1.00 0.00 H new ATOM 0 HG22 VAL A 55 0.680 -3.857 -0.149 1.00 0.00 H new ATOM 0 HG23 VAL A 55 1.051 -2.226 0.459 1.00 0.00 H new ATOM 281 N ARG A 56 4.394 -1.503 0.705 1.00 0.00 N ATOM 282 CA ARG A 56 4.611 -0.453 1.676 1.00 0.00 C ATOM 283 C ARG A 56 3.894 0.787 1.175 1.00 0.00 C ATOM 284 O ARG A 56 4.314 1.400 0.192 1.00 0.00 O ATOM 285 CB ARG A 56 6.105 -0.179 1.870 1.00 0.00 C ATOM 286 CG ARG A 56 6.566 -0.353 3.308 1.00 0.00 C ATOM 287 CD ARG A 56 7.639 0.658 3.679 1.00 0.00 C ATOM 288 NE ARG A 56 8.138 0.451 5.036 1.00 0.00 N ATOM 289 CZ ARG A 56 7.431 0.711 6.135 1.00 0.00 C ATOM 290 NH1 ARG A 56 6.198 1.194 6.042 1.00 0.00 N ATOM 291 NH2 ARG A 56 7.960 0.489 7.331 1.00 0.00 N ATOM 0 H ARG A 56 4.936 -1.400 -0.153 1.00 0.00 H new ATOM 0 HA ARG A 56 4.219 -0.753 2.648 1.00 0.00 H new ATOM 0 HB2 ARG A 56 6.677 -0.850 1.229 1.00 0.00 H new ATOM 0 HB3 ARG A 56 6.326 0.838 1.545 1.00 0.00 H new ATOM 0 HG2 ARG A 56 5.714 -0.243 3.979 1.00 0.00 H new ATOM 0 HG3 ARG A 56 6.953 -1.362 3.447 1.00 0.00 H new ATOM 0 HD2 ARG A 56 8.466 0.585 2.973 1.00 0.00 H new ATOM 0 HD3 ARG A 56 7.234 1.666 3.591 1.00 0.00 H new ATOM 0 HE ARG A 56 9.084 0.086 5.149 1.00 0.00 H new ATOM 0 HH11 ARG A 56 5.786 1.368 5.125 1.00 0.00 H new ATOM 0 HH12 ARG A 56 5.662 1.391 6.887 1.00 0.00 H new ATOM 0 HH21 ARG A 56 8.908 0.119 7.409 1.00 0.00 H new ATOM 0 HH22 ARG A 56 7.419 0.688 8.173 1.00 0.00 H new ATOM 305 N PHE A 57 2.788 1.131 1.814 1.00 0.00 N ATOM 306 CA PHE A 57 2.000 2.270 1.376 1.00 0.00 C ATOM 307 C PHE A 57 2.479 3.568 2.015 1.00 0.00 C ATOM 308 O PHE A 57 2.638 3.673 3.231 1.00 0.00 O ATOM 309 CB PHE A 57 0.520 2.040 1.687 1.00 0.00 C ATOM 310 CG PHE A 57 -0.151 1.000 0.819 1.00 0.00 C ATOM 311 CD1 PHE A 57 0.376 0.628 -0.416 1.00 0.00 C ATOM 312 CD2 PHE A 57 -1.326 0.399 1.242 1.00 0.00 C ATOM 313 CE1 PHE A 57 -0.258 -0.317 -1.198 1.00 0.00 C ATOM 314 CE2 PHE A 57 -1.962 -0.546 0.459 1.00 0.00 C ATOM 315 CZ PHE A 57 -1.428 -0.902 -0.762 1.00 0.00 C ATOM 0 H PHE A 57 2.418 0.643 2.630 1.00 0.00 H new ATOM 0 HA PHE A 57 2.129 2.367 0.298 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.424 1.740 2.731 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.012 2.985 1.576 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.291 1.084 -0.766 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -1.751 0.673 2.197 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.163 -0.598 -2.152 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -2.877 -1.006 0.803 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.926 -1.638 -1.376 1.00 0.00 H new ATOM 325 N TYR A 58 2.705 4.548 1.150 1.00 0.00 N ATOM 326 CA TYR A 58 3.170 5.871 1.537 1.00 0.00 C ATOM 327 C TYR A 58 2.149 6.917 1.146 1.00 0.00 C ATOM 328 O TYR A 58 1.464 6.776 0.139 1.00 0.00 O ATOM 329 CB TYR A 58 4.499 6.216 0.883 1.00 0.00 C ATOM 330 CG TYR A 58 5.580 5.178 1.084 1.00 0.00 C ATOM 331 CD1 TYR A 58 5.672 4.068 0.253 1.00 0.00 C ATOM 332 CD2 TYR A 58 6.512 5.310 2.106 1.00 0.00 C ATOM 333 CE1 TYR A 58 6.661 3.121 0.434 1.00 0.00 C ATOM 334 CE2 TYR A 58 7.505 4.365 2.294 1.00 0.00 C ATOM 335 CZ TYR A 58 7.574 3.274 1.456 1.00 0.00 C ATOM 336 OH TYR A 58 8.561 2.332 1.637 1.00 0.00 O ATOM 0 H TYR A 58 2.568 4.443 0.145 1.00 0.00 H new ATOM 0 HA TYR A 58 3.307 5.861 2.618 1.00 0.00 H new ATOM 0 HB2 TYR A 58 4.339 6.355 -0.186 1.00 0.00 H new ATOM 0 HB3 TYR A 58 4.849 7.169 1.279 1.00 0.00 H new ATOM 0 HD1 TYR A 58 4.958 3.944 -0.548 1.00 0.00 H new ATOM 0 HD2 TYR A 58 6.460 6.164 2.765 1.00 0.00 H new ATOM 0 HE1 TYR A 58 6.719 2.265 -0.222 1.00 0.00 H new ATOM 0 HE2 TYR A 58 8.222 4.482 3.093 1.00 0.00 H new ATOM 0 HH TYR A 58 8.648 1.790 0.825 1.00 0.00 H new ATOM 346 N ARG A 59 2.046 7.958 1.943 1.00 0.00 N ATOM 347 CA ARG A 59 1.094 9.025 1.667 1.00 0.00 C ATOM 348 C ARG A 59 1.789 10.164 0.934 1.00 0.00 C ATOM 349 O ARG A 59 2.708 10.794 1.458 1.00 0.00 O ATOM 350 CB ARG A 59 0.480 9.541 2.970 1.00 0.00 C ATOM 351 CG ARG A 59 0.082 8.437 3.938 1.00 0.00 C ATOM 352 CD ARG A 59 0.707 8.642 5.308 1.00 0.00 C ATOM 353 NE ARG A 59 0.416 9.965 5.854 1.00 0.00 N ATOM 354 CZ ARG A 59 0.543 10.281 7.140 1.00 0.00 C ATOM 355 NH1 ARG A 59 0.955 9.374 8.016 1.00 0.00 N ATOM 356 NH2 ARG A 59 0.257 11.508 7.553 1.00 0.00 N ATOM 0 H ARG A 59 2.605 8.093 2.785 1.00 0.00 H new ATOM 0 HA ARG A 59 0.297 8.628 1.038 1.00 0.00 H new ATOM 0 HB2 ARG A 59 1.194 10.202 3.461 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -0.400 10.140 2.735 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -1.003 8.410 4.033 1.00 0.00 H new ATOM 0 HG3 ARG A 59 0.391 7.472 3.537 1.00 0.00 H new ATOM 0 HD2 ARG A 59 0.337 7.879 5.992 1.00 0.00 H new ATOM 0 HD3 ARG A 59 1.787 8.510 5.237 1.00 0.00 H new ATOM 0 HE ARG A 59 0.096 10.690 5.211 1.00 0.00 H new ATOM 0 HH11 ARG A 59 1.176 8.428 7.705 1.00 0.00 H new ATOM 0 HH12 ARG A 59 1.050 9.622 9.001 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -0.061 12.210 6.885 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.354 11.750 8.539 1.00 0.00 H new ATOM 370 N ASN A 60 1.346 10.406 -0.300 1.00 0.00 N ATOM 371 CA ASN A 60 1.917 11.449 -1.146 1.00 0.00 C ATOM 372 C ASN A 60 2.135 12.747 -0.374 1.00 0.00 C ATOM 373 O ASN A 60 1.289 13.169 0.413 1.00 0.00 O ATOM 374 CB ASN A 60 1.006 11.691 -2.352 1.00 0.00 C ATOM 375 CG ASN A 60 1.439 12.877 -3.193 1.00 0.00 C ATOM 376 OD1 ASN A 60 2.578 13.335 -3.104 1.00 0.00 O ATOM 377 ND2 ASN A 60 0.527 13.378 -4.016 1.00 0.00 N ATOM 0 H ASN A 60 0.585 9.886 -0.738 1.00 0.00 H new ATOM 0 HA ASN A 60 2.893 11.109 -1.491 1.00 0.00 H new ATOM 0 HB2 ASN A 60 0.992 10.797 -2.975 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -0.014 11.853 -2.003 1.00 0.00 H new ATOM 0 HD21 ASN A 60 0.758 14.176 -4.608 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -0.405 12.966 -4.056 1.00 0.00 H new ATOM 384 N GLY A 61 3.284 13.375 -0.612 1.00 0.00 N ATOM 385 CA GLY A 61 3.608 14.619 0.060 1.00 0.00 C ATOM 386 C GLY A 61 3.597 14.483 1.568 1.00 0.00 C ATOM 387 O GLY A 61 2.699 14.994 2.236 1.00 0.00 O ATOM 0 H GLY A 61 3.997 13.042 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 61 4.592 14.958 -0.264 1.00 0.00 H new ATOM 0 HA3 GLY A 61 2.893 15.386 -0.238 1.00 0.00 H new ATOM 391 N ASP A 62 4.597 13.793 2.105 1.00 0.00 N ATOM 392 CA ASP A 62 4.695 13.594 3.546 1.00 0.00 C ATOM 393 C ASP A 62 6.152 13.602 4.001 1.00 0.00 C ATOM 394 O ASP A 62 6.499 14.263 4.980 1.00 0.00 O ATOM 395 CB ASP A 62 4.033 12.275 3.946 1.00 0.00 C ATOM 396 CG ASP A 62 3.755 12.195 5.434 1.00 0.00 C ATOM 397 OD1 ASP A 62 3.434 13.242 6.036 1.00 0.00 O ATOM 398 OD2 ASP A 62 3.858 11.086 5.999 1.00 0.00 O ATOM 0 H ASP A 62 5.349 13.363 1.566 1.00 0.00 H new ATOM 0 HA ASP A 62 4.176 14.418 4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.098 12.160 3.398 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.677 11.445 3.655 1.00 0.00 H new ATOM 403 N ARG A 63 6.996 12.860 3.281 1.00 0.00 N ATOM 404 CA ARG A 63 8.426 12.765 3.594 1.00 0.00 C ATOM 405 C ARG A 63 8.680 12.800 5.100 1.00 0.00 C ATOM 406 O ARG A 63 9.673 13.364 5.561 1.00 0.00 O ATOM 407 CB ARG A 63 9.208 13.883 2.902 1.00 0.00 C ATOM 408 CG ARG A 63 8.801 15.283 3.329 1.00 0.00 C ATOM 409 CD ARG A 63 9.155 16.305 2.263 1.00 0.00 C ATOM 410 NE ARG A 63 10.435 16.956 2.529 1.00 0.00 N ATOM 411 CZ ARG A 63 10.909 17.977 1.818 1.00 0.00 C ATOM 412 NH1 ARG A 63 10.211 18.467 0.801 1.00 0.00 N ATOM 413 NH2 ARG A 63 12.084 18.508 2.124 1.00 0.00 N ATOM 0 H ARG A 63 6.712 12.311 2.470 1.00 0.00 H new ATOM 0 HA ARG A 63 8.775 11.803 3.218 1.00 0.00 H new ATOM 0 HB2 ARG A 63 10.270 13.748 3.105 1.00 0.00 H new ATOM 0 HB3 ARG A 63 9.075 13.791 1.824 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.728 15.310 3.521 1.00 0.00 H new ATOM 0 HG3 ARG A 63 9.299 15.541 4.264 1.00 0.00 H new ATOM 0 HD2 ARG A 63 9.193 15.815 1.290 1.00 0.00 H new ATOM 0 HD3 ARG A 63 8.370 17.059 2.209 1.00 0.00 H new ATOM 0 HE ARG A 63 10.999 16.608 3.305 1.00 0.00 H new ATOM 0 HH11 ARG A 63 9.307 18.061 0.561 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.579 19.249 0.260 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.625 18.134 2.904 1.00 0.00 H new ATOM 0 HH22 ARG A 63 12.448 19.290 1.580 1.00 0.00 H new ATOM 427 N TYR A 64 7.773 12.195 5.860 1.00 0.00 N ATOM 428 CA TYR A 64 7.889 12.153 7.311 1.00 0.00 C ATOM 429 C TYR A 64 7.196 10.913 7.868 1.00 0.00 C ATOM 430 O TYR A 64 6.660 10.929 8.975 1.00 0.00 O ATOM 431 CB TYR A 64 7.275 13.412 7.922 1.00 0.00 C ATOM 432 CG TYR A 64 8.298 14.419 8.398 1.00 0.00 C ATOM 433 CD1 TYR A 64 8.931 15.270 7.501 1.00 0.00 C ATOM 434 CD2 TYR A 64 8.631 14.518 9.744 1.00 0.00 C ATOM 435 CE1 TYR A 64 9.867 16.192 7.930 1.00 0.00 C ATOM 436 CE2 TYR A 64 9.566 15.438 10.181 1.00 0.00 C ATOM 437 CZ TYR A 64 10.180 16.272 9.270 1.00 0.00 C ATOM 438 OH TYR A 64 11.111 17.190 9.702 1.00 0.00 O ATOM 0 H TYR A 64 6.946 11.725 5.492 1.00 0.00 H new ATOM 0 HA TYR A 64 8.946 12.108 7.573 1.00 0.00 H new ATOM 0 HB2 TYR A 64 6.629 13.886 7.183 1.00 0.00 H new ATOM 0 HB3 TYR A 64 6.642 13.126 8.762 1.00 0.00 H new ATOM 0 HD1 TYR A 64 8.688 15.210 6.450 1.00 0.00 H new ATOM 0 HD2 TYR A 64 8.152 13.866 10.459 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.350 16.846 7.219 1.00 0.00 H new ATOM 0 HE2 TYR A 64 9.814 15.503 11.230 1.00 0.00 H new ATOM 0 HH TYR A 64 11.215 17.118 10.674 1.00 0.00 H new ATOM 448 N PHE A 65 7.210 9.841 7.084 1.00 0.00 N ATOM 449 CA PHE A 65 6.581 8.589 7.486 1.00 0.00 C ATOM 450 C PHE A 65 7.105 7.429 6.644 1.00 0.00 C ATOM 451 O PHE A 65 7.293 7.562 5.434 1.00 0.00 O ATOM 452 CB PHE A 65 5.062 8.699 7.343 1.00 0.00 C ATOM 453 CG PHE A 65 4.322 7.456 7.751 1.00 0.00 C ATOM 454 CD1 PHE A 65 4.562 6.860 8.978 1.00 0.00 C ATOM 455 CD2 PHE A 65 3.384 6.888 6.905 1.00 0.00 C ATOM 456 CE1 PHE A 65 3.878 5.718 9.353 1.00 0.00 C ATOM 457 CE2 PHE A 65 2.698 5.748 7.275 1.00 0.00 C ATOM 458 CZ PHE A 65 2.944 5.162 8.501 1.00 0.00 C ATOM 0 H PHE A 65 7.651 9.814 6.165 1.00 0.00 H new ATOM 0 HA PHE A 65 6.828 8.395 8.530 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.709 9.535 7.947 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.820 8.931 6.306 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.290 7.291 9.649 1.00 0.00 H new ATOM 0 HD2 PHE A 65 3.187 7.342 5.945 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.074 5.261 10.312 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.969 5.315 6.606 1.00 0.00 H new ATOM 0 HZ PHE A 65 2.407 4.271 8.793 1.00 0.00 H new ATOM 468 N LYS A 66 7.347 6.294 7.293 1.00 0.00 N ATOM 469 CA LYS A 66 7.860 5.113 6.605 1.00 0.00 C ATOM 470 C LYS A 66 6.764 4.414 5.804 1.00 0.00 C ATOM 471 O LYS A 66 7.054 3.639 4.892 1.00 0.00 O ATOM 472 CB LYS A 66 8.470 4.138 7.613 1.00 0.00 C ATOM 473 CG LYS A 66 9.653 4.712 8.375 1.00 0.00 C ATOM 474 CD LYS A 66 10.967 4.414 7.669 1.00 0.00 C ATOM 475 CE LYS A 66 11.542 3.074 8.098 1.00 0.00 C ATOM 476 NZ LYS A 66 12.840 3.228 8.809 1.00 0.00 N ATOM 0 H LYS A 66 7.196 6.167 8.294 1.00 0.00 H new ATOM 0 HA LYS A 66 8.631 5.442 5.908 1.00 0.00 H new ATOM 0 HB2 LYS A 66 7.702 3.836 8.325 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.789 3.238 7.088 1.00 0.00 H new ATOM 0 HG2 LYS A 66 9.531 5.790 8.480 1.00 0.00 H new ATOM 0 HG3 LYS A 66 9.676 4.294 9.382 1.00 0.00 H new ATOM 0 HD2 LYS A 66 10.809 4.414 6.590 1.00 0.00 H new ATOM 0 HD3 LYS A 66 11.685 5.205 7.886 1.00 0.00 H new ATOM 0 HE2 LYS A 66 10.830 2.565 8.748 1.00 0.00 H new ATOM 0 HE3 LYS A 66 11.681 2.442 7.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.198 2.291 9.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 13.527 3.690 8.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.703 3.810 9.660 1.00 0.00 H new ATOM 490 N GLY A 67 5.508 4.685 6.147 1.00 0.00 N ATOM 491 CA GLY A 67 4.402 4.062 5.442 1.00 0.00 C ATOM 492 C GLY A 67 3.808 2.899 6.213 1.00 0.00 C ATOM 493 O GLY A 67 4.298 2.540 7.283 1.00 0.00 O ATOM 0 H GLY A 67 5.237 5.322 6.897 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.627 4.806 5.257 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.746 3.712 4.469 1.00 0.00 H new ATOM 497 N ILE A 68 2.753 2.303 5.665 1.00 0.00 N ATOM 498 CA ILE A 68 2.100 1.168 6.306 1.00 0.00 C ATOM 499 C ILE A 68 2.070 -0.037 5.368 1.00 0.00 C ATOM 500 O ILE A 68 1.830 0.105 4.169 1.00 0.00 O ATOM 501 CB ILE A 68 0.661 1.520 6.754 1.00 0.00 C ATOM 502 CG1 ILE A 68 -0.024 0.298 7.374 1.00 0.00 C ATOM 503 CG2 ILE A 68 -0.155 2.057 5.586 1.00 0.00 C ATOM 504 CD1 ILE A 68 -0.943 0.642 8.526 1.00 0.00 C ATOM 0 H ILE A 68 2.333 2.587 4.780 1.00 0.00 H new ATOM 0 HA ILE A 68 2.682 0.916 7.193 1.00 0.00 H new ATOM 0 HB ILE A 68 0.723 2.301 7.511 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.597 -0.217 6.603 1.00 0.00 H new ATOM 0 HG13 ILE A 68 0.739 -0.398 7.723 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -1.162 2.297 5.926 1.00 0.00 H new ATOM 0 HG22 ILE A 68 0.320 2.956 5.194 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -0.207 1.302 4.801 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.394 -0.270 8.917 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.371 1.130 9.315 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.727 1.314 8.178 1.00 0.00 H new ATOM 516 N VAL A 69 2.325 -1.221 5.919 1.00 0.00 N ATOM 517 CA VAL A 69 2.338 -2.447 5.127 1.00 0.00 C ATOM 518 C VAL A 69 0.944 -3.053 5.013 1.00 0.00 C ATOM 519 O VAL A 69 0.223 -3.175 6.004 1.00 0.00 O ATOM 520 CB VAL A 69 3.297 -3.499 5.719 1.00 0.00 C ATOM 521 CG1 VAL A 69 3.516 -4.641 4.735 1.00 0.00 C ATOM 522 CG2 VAL A 69 4.623 -2.859 6.109 1.00 0.00 C ATOM 0 H VAL A 69 2.525 -1.357 6.910 1.00 0.00 H new ATOM 0 HA VAL A 69 2.689 -2.167 4.134 1.00 0.00 H new ATOM 0 HB VAL A 69 2.840 -3.910 6.620 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.196 -5.373 5.172 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.562 -5.119 4.514 1.00 0.00 H new ATOM 0 HG13 VAL A 69 3.948 -4.250 3.814 1.00 0.00 H new ATOM 0 HG21 VAL A 69 5.285 -3.618 6.525 1.00 0.00 H new ATOM 0 HG22 VAL A 69 5.087 -2.416 5.227 1.00 0.00 H new ATOM 0 HG23 VAL A 69 4.447 -2.083 6.855 1.00 0.00 H new ATOM 532 N TYR A 70 0.576 -3.438 3.796 1.00 0.00 N ATOM 533 CA TYR A 70 -0.716 -4.038 3.534 1.00 0.00 C ATOM 534 C TYR A 70 -0.590 -5.214 2.580 1.00 0.00 C ATOM 535 O TYR A 70 0.214 -5.199 1.648 1.00 0.00 O ATOM 536 CB TYR A 70 -1.686 -3.005 2.950 1.00 0.00 C ATOM 537 CG TYR A 70 -2.745 -2.547 3.925 1.00 0.00 C ATOM 538 CD1 TYR A 70 -2.406 -1.921 5.116 1.00 0.00 C ATOM 539 CD2 TYR A 70 -4.092 -2.752 3.650 1.00 0.00 C ATOM 540 CE1 TYR A 70 -3.380 -1.512 6.009 1.00 0.00 C ATOM 541 CE2 TYR A 70 -5.071 -2.344 4.535 1.00 0.00 C ATOM 542 CZ TYR A 70 -4.710 -1.726 5.714 1.00 0.00 C ATOM 543 OH TYR A 70 -5.683 -1.322 6.599 1.00 0.00 O ATOM 0 H TYR A 70 1.166 -3.341 2.970 1.00 0.00 H new ATOM 0 HA TYR A 70 -1.109 -4.399 4.485 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -1.119 -2.139 2.610 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -2.172 -3.432 2.073 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -1.365 -1.750 5.349 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -4.378 -3.238 2.729 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -3.100 -1.027 6.933 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -6.113 -2.508 4.305 1.00 0.00 H new ATOM 0 HH TYR A 70 -6.544 -1.711 6.338 1.00 0.00 H new ATOM 553 N ALA A 71 -1.412 -6.219 2.816 1.00 0.00 N ATOM 554 CA ALA A 71 -1.438 -7.406 1.980 1.00 0.00 C ATOM 555 C ALA A 71 -2.642 -7.354 1.054 1.00 0.00 C ATOM 556 O ALA A 71 -3.788 -7.364 1.505 1.00 0.00 O ATOM 557 CB ALA A 71 -1.472 -8.666 2.824 1.00 0.00 C ATOM 0 H ALA A 71 -2.078 -6.237 3.589 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.527 -7.430 1.382 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.491 -9.540 2.173 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -0.585 -8.704 3.457 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -2.364 -8.661 3.450 1.00 0.00 H new ATOM 563 N VAL A 72 -2.375 -7.279 -0.239 1.00 0.00 N ATOM 564 CA VAL A 72 -3.428 -7.203 -1.231 1.00 0.00 C ATOM 565 C VAL A 72 -3.708 -8.562 -1.848 1.00 0.00 C ATOM 566 O VAL A 72 -2.827 -9.198 -2.425 1.00 0.00 O ATOM 567 CB VAL A 72 -3.093 -6.195 -2.346 1.00 0.00 C ATOM 568 CG1 VAL A 72 -4.369 -5.693 -3.002 1.00 0.00 C ATOM 569 CG2 VAL A 72 -2.282 -5.031 -1.795 1.00 0.00 C ATOM 0 H VAL A 72 -1.431 -7.269 -0.625 1.00 0.00 H new ATOM 0 HA VAL A 72 -4.320 -6.859 -0.708 1.00 0.00 H new ATOM 0 HB VAL A 72 -2.490 -6.702 -3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -4.118 -4.981 -3.788 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -4.911 -6.534 -3.434 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -4.994 -5.203 -2.255 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -2.057 -4.331 -2.600 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -2.856 -4.521 -1.021 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -1.351 -5.406 -1.369 1.00 0.00 H new ATOM 579 N SER A 73 -4.948 -8.986 -1.714 1.00 0.00 N ATOM 580 CA SER A 73 -5.393 -10.267 -2.248 1.00 0.00 C ATOM 581 C SER A 73 -6.892 -10.242 -2.530 1.00 0.00 C ATOM 582 O SER A 73 -7.623 -9.420 -1.980 1.00 0.00 O ATOM 583 CB SER A 73 -5.065 -11.397 -1.270 1.00 0.00 C ATOM 584 OG SER A 73 -5.278 -10.989 0.071 1.00 0.00 O ATOM 0 H SER A 73 -5.677 -8.458 -1.234 1.00 0.00 H new ATOM 0 HA SER A 73 -4.865 -10.446 -3.185 1.00 0.00 H new ATOM 0 HB2 SER A 73 -5.685 -12.266 -1.492 1.00 0.00 H new ATOM 0 HB3 SER A 73 -4.027 -11.704 -1.399 1.00 0.00 H new ATOM 0 HG SER A 73 -5.109 -11.743 0.673 1.00 0.00 H new ATOM 590 N SER A 74 -7.340 -11.144 -3.397 1.00 0.00 N ATOM 591 CA SER A 74 -8.752 -11.222 -3.761 1.00 0.00 C ATOM 592 C SER A 74 -9.616 -11.655 -2.577 1.00 0.00 C ATOM 593 O SER A 74 -10.840 -11.539 -2.620 1.00 0.00 O ATOM 594 CB SER A 74 -8.942 -12.195 -4.926 1.00 0.00 C ATOM 595 OG SER A 74 -8.036 -11.914 -5.978 1.00 0.00 O ATOM 0 H SER A 74 -6.747 -11.832 -3.861 1.00 0.00 H new ATOM 0 HA SER A 74 -9.072 -10.225 -4.063 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.794 -13.217 -4.578 1.00 0.00 H new ATOM 0 HB3 SER A 74 -9.965 -12.129 -5.296 1.00 0.00 H new ATOM 0 HG SER A 74 -8.177 -12.551 -6.710 1.00 0.00 H new ATOM 601 N ASP A 75 -8.979 -12.155 -1.522 1.00 0.00 N ATOM 602 CA ASP A 75 -9.693 -12.603 -0.342 1.00 0.00 C ATOM 603 C ASP A 75 -10.031 -11.431 0.576 1.00 0.00 C ATOM 604 O ASP A 75 -11.068 -11.429 1.240 1.00 0.00 O ATOM 605 CB ASP A 75 -8.844 -13.630 0.404 1.00 0.00 C ATOM 606 CG ASP A 75 -9.359 -15.046 0.230 1.00 0.00 C ATOM 607 OD1 ASP A 75 -9.966 -15.331 -0.824 1.00 0.00 O ATOM 608 OD2 ASP A 75 -9.155 -15.868 1.147 1.00 0.00 O ATOM 0 H ASP A 75 -7.966 -12.258 -1.465 1.00 0.00 H new ATOM 0 HA ASP A 75 -10.631 -13.061 -0.655 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -7.816 -13.574 0.047 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -8.827 -13.381 1.465 1.00 0.00 H new ATOM 613 N ARG A 76 -9.149 -10.437 0.612 1.00 0.00 N ATOM 614 CA ARG A 76 -9.356 -9.262 1.452 1.00 0.00 C ATOM 615 C ARG A 76 -10.024 -8.135 0.670 1.00 0.00 C ATOM 616 O ARG A 76 -10.917 -7.458 1.180 1.00 0.00 O ATOM 617 CB ARG A 76 -8.022 -8.779 2.025 1.00 0.00 C ATOM 618 CG ARG A 76 -8.170 -7.918 3.268 1.00 0.00 C ATOM 619 CD ARG A 76 -7.061 -8.194 4.271 1.00 0.00 C ATOM 620 NE ARG A 76 -7.382 -9.317 5.149 1.00 0.00 N ATOM 621 CZ ARG A 76 -6.640 -9.677 6.193 1.00 0.00 C ATOM 622 NH1 ARG A 76 -5.535 -9.006 6.493 1.00 0.00 N ATOM 623 NH2 ARG A 76 -7.004 -10.711 6.939 1.00 0.00 N ATOM 0 H ARG A 76 -8.285 -10.421 0.070 1.00 0.00 H new ATOM 0 HA ARG A 76 -10.017 -9.548 2.271 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -7.404 -9.645 2.264 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -7.492 -8.211 1.261 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -8.154 -6.865 2.987 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -9.138 -8.110 3.732 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -6.134 -8.405 3.737 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.887 -7.302 4.873 1.00 0.00 H new ATOM 0 HE ARG A 76 -8.224 -9.857 4.950 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -5.251 -8.210 5.922 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -4.970 -9.286 7.295 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -7.852 -11.230 6.712 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -6.436 -10.988 7.740 1.00 0.00 H new ATOM 637 N PHE A 77 -9.583 -7.935 -0.567 1.00 0.00 N ATOM 638 CA PHE A 77 -10.135 -6.885 -1.415 1.00 0.00 C ATOM 639 C PHE A 77 -10.514 -7.435 -2.785 1.00 0.00 C ATOM 640 O PHE A 77 -9.668 -7.951 -3.516 1.00 0.00 O ATOM 641 CB PHE A 77 -9.127 -5.743 -1.566 1.00 0.00 C ATOM 642 CG PHE A 77 -8.416 -5.404 -0.287 1.00 0.00 C ATOM 643 CD1 PHE A 77 -9.033 -4.626 0.679 1.00 0.00 C ATOM 644 CD2 PHE A 77 -7.132 -5.868 -0.049 1.00 0.00 C ATOM 645 CE1 PHE A 77 -8.384 -4.316 1.859 1.00 0.00 C ATOM 646 CE2 PHE A 77 -6.477 -5.562 1.129 1.00 0.00 C ATOM 647 CZ PHE A 77 -7.104 -4.785 2.084 1.00 0.00 C ATOM 0 H PHE A 77 -8.845 -8.486 -1.005 1.00 0.00 H new ATOM 0 HA PHE A 77 -11.037 -6.502 -0.939 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -8.390 -6.016 -2.322 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -9.645 -4.856 -1.931 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -10.034 -4.257 0.508 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -6.638 -6.476 -0.792 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -8.876 -3.708 2.604 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -5.477 -5.930 1.303 1.00 0.00 H new ATOM 0 HZ PHE A 77 -6.594 -4.545 3.005 1.00 0.00 H new ATOM 657 N ARG A 78 -11.793 -7.321 -3.125 1.00 0.00 N ATOM 658 CA ARG A 78 -12.295 -7.800 -4.397 1.00 0.00 C ATOM 659 C ARG A 78 -11.734 -6.984 -5.560 1.00 0.00 C ATOM 660 O ARG A 78 -11.669 -7.465 -6.691 1.00 0.00 O ATOM 661 CB ARG A 78 -13.821 -7.737 -4.393 1.00 0.00 C ATOM 662 CG ARG A 78 -14.486 -9.096 -4.250 1.00 0.00 C ATOM 663 CD ARG A 78 -15.111 -9.551 -5.559 1.00 0.00 C ATOM 664 NE ARG A 78 -15.422 -10.979 -5.550 1.00 0.00 N ATOM 665 CZ ARG A 78 -16.409 -11.520 -4.840 1.00 0.00 C ATOM 666 NH1 ARG A 78 -17.187 -10.756 -4.083 1.00 0.00 N ATOM 667 NH2 ARG A 78 -16.620 -12.828 -4.888 1.00 0.00 N ATOM 0 H ARG A 78 -12.503 -6.896 -2.528 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.970 -8.832 -4.533 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -14.148 -7.094 -3.575 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -14.159 -7.272 -5.319 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.750 -9.830 -3.923 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -15.253 -9.047 -3.477 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -16.023 -8.983 -5.742 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -14.429 -9.334 -6.381 1.00 0.00 H new ATOM 0 HE ARG A 78 -14.848 -11.598 -6.122 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -17.030 -9.749 -4.043 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -17.942 -11.176 -3.541 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -16.026 -13.419 -5.469 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -17.376 -13.243 -4.344 1.00 0.00 H new ATOM 681 N SER A 79 -11.331 -5.748 -5.277 1.00 0.00 N ATOM 682 CA SER A 79 -10.778 -4.875 -6.308 1.00 0.00 C ATOM 683 C SER A 79 -10.043 -3.688 -5.691 1.00 0.00 C ATOM 684 O SER A 79 -10.017 -3.525 -4.471 1.00 0.00 O ATOM 685 CB SER A 79 -11.891 -4.374 -7.230 1.00 0.00 C ATOM 686 OG SER A 79 -11.449 -4.310 -8.575 1.00 0.00 O ATOM 0 H SER A 79 -11.377 -5.330 -4.348 1.00 0.00 H new ATOM 0 HA SER A 79 -10.062 -5.456 -6.890 1.00 0.00 H new ATOM 0 HB2 SER A 79 -12.753 -5.037 -7.158 1.00 0.00 H new ATOM 0 HB3 SER A 79 -12.220 -3.387 -6.905 1.00 0.00 H new ATOM 0 HG SER A 79 -12.179 -3.989 -9.144 1.00 0.00 H new ATOM 692 N PHE A 80 -9.449 -2.862 -6.546 1.00 0.00 N ATOM 693 CA PHE A 80 -8.712 -1.688 -6.095 1.00 0.00 C ATOM 694 C PHE A 80 -9.619 -0.732 -5.326 1.00 0.00 C ATOM 695 O PHE A 80 -9.181 -0.063 -4.390 1.00 0.00 O ATOM 696 CB PHE A 80 -8.076 -0.963 -7.284 1.00 0.00 C ATOM 697 CG PHE A 80 -6.663 -0.519 -7.026 1.00 0.00 C ATOM 698 CD1 PHE A 80 -5.682 -1.441 -6.704 1.00 0.00 C ATOM 699 CD2 PHE A 80 -6.316 0.821 -7.102 1.00 0.00 C ATOM 700 CE1 PHE A 80 -4.383 -1.037 -6.463 1.00 0.00 C ATOM 701 CE2 PHE A 80 -5.020 1.231 -6.863 1.00 0.00 C ATOM 702 CZ PHE A 80 -4.052 0.300 -6.543 1.00 0.00 C ATOM 0 H PHE A 80 -9.464 -2.985 -7.558 1.00 0.00 H new ATOM 0 HA PHE A 80 -7.923 -2.028 -5.424 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.089 -1.623 -8.152 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -8.682 -0.093 -7.536 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -5.935 -2.489 -6.640 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -7.069 1.553 -7.351 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -3.628 -1.767 -6.212 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -4.764 2.278 -6.926 1.00 0.00 H new ATOM 0 HZ PHE A 80 -3.037 0.618 -6.356 1.00 0.00 H new ATOM 712 N ASP A 81 -10.886 -0.670 -5.727 1.00 0.00 N ATOM 713 CA ASP A 81 -11.850 0.206 -5.073 1.00 0.00 C ATOM 714 C ASP A 81 -12.010 -0.183 -3.610 1.00 0.00 C ATOM 715 O ASP A 81 -12.041 0.675 -2.726 1.00 0.00 O ATOM 716 CB ASP A 81 -13.202 0.138 -5.784 1.00 0.00 C ATOM 717 CG ASP A 81 -13.080 0.344 -7.281 1.00 0.00 C ATOM 718 OD1 ASP A 81 -12.208 1.132 -7.703 1.00 0.00 O ATOM 719 OD2 ASP A 81 -13.855 -0.285 -8.032 1.00 0.00 O ATOM 0 H ASP A 81 -11.267 -1.215 -6.500 1.00 0.00 H new ATOM 0 HA ASP A 81 -11.478 1.229 -5.127 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.663 -0.830 -5.590 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -13.866 0.896 -5.369 1.00 0.00 H new ATOM 724 N ALA A 82 -12.103 -1.483 -3.363 1.00 0.00 N ATOM 725 CA ALA A 82 -12.249 -1.994 -2.010 1.00 0.00 C ATOM 726 C ALA A 82 -10.972 -1.781 -1.214 1.00 0.00 C ATOM 727 O ALA A 82 -11.013 -1.471 -0.024 1.00 0.00 O ATOM 728 CB ALA A 82 -12.603 -3.465 -2.045 1.00 0.00 C ATOM 0 H ALA A 82 -12.080 -2.203 -4.085 1.00 0.00 H new ATOM 0 HA ALA A 82 -13.054 -1.447 -1.520 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -12.710 -3.838 -1.026 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.542 -3.601 -2.582 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.812 -4.018 -2.552 1.00 0.00 H new ATOM 734 N LEU A 83 -9.836 -1.934 -1.886 1.00 0.00 N ATOM 735 CA LEU A 83 -8.548 -1.741 -1.243 1.00 0.00 C ATOM 736 C LEU A 83 -8.421 -0.291 -0.834 1.00 0.00 C ATOM 737 O LEU A 83 -8.033 0.027 0.290 1.00 0.00 O ATOM 738 CB LEU A 83 -7.416 -2.107 -2.201 1.00 0.00 C ATOM 739 CG LEU A 83 -6.014 -2.091 -1.588 1.00 0.00 C ATOM 740 CD1 LEU A 83 -5.902 -3.117 -0.473 1.00 0.00 C ATOM 741 CD2 LEU A 83 -4.965 -2.346 -2.659 1.00 0.00 C ATOM 0 H LEU A 83 -9.784 -2.190 -2.872 1.00 0.00 H new ATOM 0 HA LEU A 83 -8.480 -2.385 -0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.608 -3.102 -2.602 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -7.435 -1.415 -3.043 1.00 0.00 H new ATOM 0 HG LEU A 83 -5.838 -1.105 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -4.897 -3.088 -0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -6.629 -2.888 0.306 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.099 -4.112 -0.873 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -3.973 -2.332 -2.207 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -5.141 -3.320 -3.117 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.028 -1.570 -3.422 1.00 0.00 H new ATOM 753 N LEU A 84 -8.783 0.583 -1.760 1.00 0.00 N ATOM 754 CA LEU A 84 -8.744 2.012 -1.513 1.00 0.00 C ATOM 755 C LEU A 84 -9.636 2.357 -0.328 1.00 0.00 C ATOM 756 O LEU A 84 -9.343 3.282 0.430 1.00 0.00 O ATOM 757 CB LEU A 84 -9.195 2.781 -2.757 1.00 0.00 C ATOM 758 CG LEU A 84 -8.106 2.996 -3.808 1.00 0.00 C ATOM 759 CD1 LEU A 84 -8.710 3.505 -5.107 1.00 0.00 C ATOM 760 CD2 LEU A 84 -7.057 3.967 -3.289 1.00 0.00 C ATOM 0 H LEU A 84 -9.108 0.325 -2.692 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.719 2.301 -1.281 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -10.024 2.244 -3.218 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -9.578 3.753 -2.447 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.624 2.039 -4.008 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.919 3.652 -5.843 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -9.427 2.776 -5.485 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.218 4.452 -4.926 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.288 4.111 -4.047 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.527 4.924 -3.063 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.603 3.563 -2.384 1.00 0.00 H new ATOM 772 N ALA A 85 -10.724 1.602 -0.160 1.00 0.00 N ATOM 773 CA ALA A 85 -11.633 1.842 0.953 1.00 0.00 C ATOM 774 C ALA A 85 -10.935 1.576 2.277 1.00 0.00 C ATOM 775 O ALA A 85 -11.012 2.377 3.209 1.00 0.00 O ATOM 776 CB ALA A 85 -12.857 0.954 0.824 1.00 0.00 C ATOM 0 H ALA A 85 -10.991 0.831 -0.773 1.00 0.00 H new ATOM 0 HA ALA A 85 -11.945 2.886 0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -13.531 1.140 1.660 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.370 1.175 -0.112 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -12.550 -0.092 0.831 1.00 0.00 H new ATOM 782 N ASP A 86 -10.233 0.450 2.341 1.00 0.00 N ATOM 783 CA ASP A 86 -9.491 0.075 3.536 1.00 0.00 C ATOM 784 C ASP A 86 -8.263 0.958 3.687 1.00 0.00 C ATOM 785 O ASP A 86 -7.860 1.307 4.796 1.00 0.00 O ATOM 786 CB ASP A 86 -9.075 -1.395 3.467 1.00 0.00 C ATOM 787 CG ASP A 86 -9.102 -2.068 4.826 1.00 0.00 C ATOM 788 OD1 ASP A 86 -8.107 -1.940 5.571 1.00 0.00 O ATOM 789 OD2 ASP A 86 -10.117 -2.723 5.144 1.00 0.00 O ATOM 0 H ASP A 86 -10.163 -0.220 1.575 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.136 0.214 4.403 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.741 -1.927 2.788 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.071 -1.466 3.049 1.00 0.00 H new ATOM 794 N LEU A 87 -7.672 1.310 2.550 1.00 0.00 N ATOM 795 CA LEU A 87 -6.481 2.152 2.530 1.00 0.00 C ATOM 796 C LEU A 87 -6.773 3.512 3.136 1.00 0.00 C ATOM 797 O LEU A 87 -5.981 4.038 3.916 1.00 0.00 O ATOM 798 CB LEU A 87 -5.964 2.317 1.094 1.00 0.00 C ATOM 799 CG LEU A 87 -5.346 1.066 0.445 1.00 0.00 C ATOM 800 CD1 LEU A 87 -4.071 1.430 -0.297 1.00 0.00 C ATOM 801 CD2 LEU A 87 -5.065 -0.019 1.479 1.00 0.00 C ATOM 0 H LEU A 87 -8.000 1.024 1.627 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.712 1.664 3.128 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.791 2.654 0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.217 3.110 1.088 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.070 0.669 -0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.646 0.535 -0.751 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -4.298 2.158 -1.076 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.353 1.859 0.402 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.629 -0.888 0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.368 0.362 2.226 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.997 -0.308 1.966 1.00 0.00 H new ATOM 813 N THR A 88 -7.921 4.072 2.787 1.00 0.00 N ATOM 814 CA THR A 88 -8.319 5.362 3.310 1.00 0.00 C ATOM 815 C THR A 88 -8.417 5.279 4.829 1.00 0.00 C ATOM 816 O THR A 88 -8.017 6.197 5.541 1.00 0.00 O ATOM 817 CB THR A 88 -9.661 5.772 2.690 1.00 0.00 C ATOM 818 OG1 THR A 88 -9.465 6.337 1.408 1.00 0.00 O ATOM 819 CG2 THR A 88 -10.443 6.772 3.513 1.00 0.00 C ATOM 0 H THR A 88 -8.591 3.650 2.144 1.00 0.00 H new ATOM 0 HA THR A 88 -7.578 6.119 3.052 1.00 0.00 H new ATOM 0 HB THR A 88 -10.239 4.849 2.641 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.228 5.630 0.772 1.00 0.00 H new ATOM 0 HG21 THR A 88 -11.378 7.009 3.005 1.00 0.00 H new ATOM 0 HG22 THR A 88 -10.660 6.347 4.493 1.00 0.00 H new ATOM 0 HG23 THR A 88 -9.855 7.682 3.635 1.00 0.00 H new ATOM 827 N ARG A 89 -8.949 4.161 5.306 1.00 0.00 N ATOM 828 CA ARG A 89 -9.104 3.926 6.734 1.00 0.00 C ATOM 829 C ARG A 89 -7.759 3.725 7.435 1.00 0.00 C ATOM 830 O ARG A 89 -7.527 4.280 8.509 1.00 0.00 O ATOM 831 CB ARG A 89 -9.998 2.708 6.972 1.00 0.00 C ATOM 832 CG ARG A 89 -11.444 2.924 6.555 1.00 0.00 C ATOM 833 CD ARG A 89 -12.376 1.937 7.240 1.00 0.00 C ATOM 834 NE ARG A 89 -13.069 2.539 8.377 1.00 0.00 N ATOM 835 CZ ARG A 89 -14.184 2.045 8.912 1.00 0.00 C ATOM 836 NH1 ARG A 89 -14.734 0.942 8.418 1.00 0.00 N ATOM 837 NH2 ARG A 89 -14.750 2.655 9.946 1.00 0.00 N ATOM 0 H ARG A 89 -9.283 3.397 4.718 1.00 0.00 H new ATOM 0 HA ARG A 89 -9.569 4.815 7.160 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -9.593 1.858 6.423 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.969 2.447 8.030 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -11.746 3.942 6.801 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -11.531 2.818 5.474 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -13.109 1.571 6.521 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.804 1.074 7.580 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.676 3.387 8.785 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -14.302 0.468 7.624 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -15.588 0.568 8.832 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.331 3.502 10.330 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.604 2.277 10.356 1.00 0.00 H new ATOM 851 N SER A 90 -6.882 2.905 6.847 1.00 0.00 N ATOM 852 CA SER A 90 -5.584 2.623 7.460 1.00 0.00 C ATOM 853 C SER A 90 -4.602 3.780 7.305 1.00 0.00 C ATOM 854 O SER A 90 -3.827 4.071 8.216 1.00 0.00 O ATOM 855 CB SER A 90 -4.975 1.359 6.852 1.00 0.00 C ATOM 856 OG SER A 90 -4.552 0.460 7.862 1.00 0.00 O ATOM 0 H SER A 90 -7.046 2.431 5.959 1.00 0.00 H new ATOM 0 HA SER A 90 -5.764 2.478 8.525 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.708 0.871 6.210 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.127 1.627 6.221 1.00 0.00 H new ATOM 0 HG SER A 90 -4.713 -0.461 7.568 1.00 0.00 H new ATOM 862 N LEU A 91 -4.623 4.426 6.147 1.00 0.00 N ATOM 863 CA LEU A 91 -3.727 5.527 5.877 1.00 0.00 C ATOM 864 C LEU A 91 -4.398 6.878 6.139 1.00 0.00 C ATOM 865 O LEU A 91 -3.779 7.924 5.961 1.00 0.00 O ATOM 866 CB LEU A 91 -3.248 5.437 4.432 1.00 0.00 C ATOM 867 CG LEU A 91 -1.849 4.837 4.240 1.00 0.00 C ATOM 868 CD1 LEU A 91 -1.352 5.093 2.830 1.00 0.00 C ATOM 869 CD2 LEU A 91 -0.870 5.397 5.260 1.00 0.00 C ATOM 0 H LEU A 91 -5.256 4.200 5.380 1.00 0.00 H new ATOM 0 HA LEU A 91 -2.874 5.457 6.552 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -3.962 4.839 3.867 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -3.258 6.438 4.000 1.00 0.00 H new ATOM 0 HG LEU A 91 -1.918 3.760 4.395 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -0.358 4.661 2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.035 4.635 2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -1.305 6.167 2.650 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.114 4.955 5.101 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.804 6.479 5.145 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -1.217 5.159 6.266 1.00 0.00 H new ATOM 881 N SER A 92 -5.671 6.843 6.541 1.00 0.00 N ATOM 882 CA SER A 92 -6.446 8.059 6.808 1.00 0.00 C ATOM 883 C SER A 92 -5.591 9.176 7.402 1.00 0.00 C ATOM 884 O SER A 92 -4.708 8.934 8.225 1.00 0.00 O ATOM 885 CB SER A 92 -7.609 7.747 7.754 1.00 0.00 C ATOM 886 OG SER A 92 -7.233 7.929 9.110 1.00 0.00 O ATOM 0 H SER A 92 -6.191 5.978 6.690 1.00 0.00 H new ATOM 0 HA SER A 92 -6.828 8.409 5.849 1.00 0.00 H new ATOM 0 HB2 SER A 92 -8.455 8.393 7.519 1.00 0.00 H new ATOM 0 HB3 SER A 92 -7.940 6.720 7.601 1.00 0.00 H new ATOM 0 HG SER A 92 -7.995 7.724 9.691 1.00 0.00 H new ATOM 892 N ASP A 93 -5.875 10.402 6.974 1.00 0.00 N ATOM 893 CA ASP A 93 -5.154 11.579 7.446 1.00 0.00 C ATOM 894 C ASP A 93 -6.060 12.814 7.383 1.00 0.00 C ATOM 895 O ASP A 93 -7.262 12.717 7.632 1.00 0.00 O ATOM 896 CB ASP A 93 -3.888 11.797 6.608 1.00 0.00 C ATOM 897 CG ASP A 93 -3.083 10.526 6.417 1.00 0.00 C ATOM 898 OD1 ASP A 93 -2.621 9.958 7.428 1.00 0.00 O ATOM 899 OD2 ASP A 93 -2.913 10.102 5.255 1.00 0.00 O ATOM 0 H ASP A 93 -6.607 10.607 6.294 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.858 11.419 8.483 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -4.168 12.194 5.632 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -3.263 12.548 7.091 1.00 0.00 H new ATOM 904 N ASN A 94 -5.488 13.970 7.050 1.00 0.00 N ATOM 905 CA ASN A 94 -6.259 15.206 6.958 1.00 0.00 C ATOM 906 C ASN A 94 -5.454 16.295 6.255 1.00 0.00 C ATOM 907 O ASN A 94 -5.998 17.076 5.473 1.00 0.00 O ATOM 908 CB ASN A 94 -6.676 15.681 8.349 1.00 0.00 C ATOM 909 CG ASN A 94 -5.487 15.975 9.242 1.00 0.00 C ATOM 910 OD1 ASN A 94 -5.158 17.134 9.497 1.00 0.00 O ATOM 911 ND2 ASN A 94 -4.832 14.924 9.722 1.00 0.00 N ATOM 0 H ASN A 94 -4.495 14.075 6.840 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.155 15.003 6.371 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -7.287 16.579 8.255 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -7.299 14.919 8.818 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -4.022 15.060 10.327 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -5.139 13.980 9.485 1.00 0.00 H new ATOM 918 N ILE A 95 -4.155 16.338 6.535 1.00 0.00 N ATOM 919 CA ILE A 95 -3.275 17.319 5.930 1.00 0.00 C ATOM 920 C ILE A 95 -2.464 16.682 4.803 1.00 0.00 C ATOM 921 O ILE A 95 -2.097 17.347 3.835 1.00 0.00 O ATOM 922 CB ILE A 95 -2.322 17.920 6.986 1.00 0.00 C ATOM 923 CG1 ILE A 95 -3.093 18.845 7.931 1.00 0.00 C ATOM 924 CG2 ILE A 95 -1.180 18.668 6.321 1.00 0.00 C ATOM 925 CD1 ILE A 95 -2.708 18.680 9.385 1.00 0.00 C ATOM 0 H ILE A 95 -3.691 15.699 7.181 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.890 18.119 5.517 1.00 0.00 H new ATOM 0 HB ILE A 95 -1.896 17.103 7.568 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.922 19.880 7.633 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.161 18.654 7.822 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -0.522 19.082 7.085 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.615 17.983 5.689 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.581 19.477 5.711 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.294 19.366 9.997 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -2.905 17.655 9.700 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.647 18.900 9.508 1.00 0.00 H new ATOM 937 N ASN A 96 -2.200 15.385 4.934 1.00 0.00 N ATOM 938 CA ASN A 96 -1.443 14.649 3.928 1.00 0.00 C ATOM 939 C ASN A 96 -2.383 13.982 2.929 1.00 0.00 C ATOM 940 O ASN A 96 -2.056 13.837 1.751 1.00 0.00 O ATOM 941 CB ASN A 96 -0.558 13.594 4.594 1.00 0.00 C ATOM 942 CG ASN A 96 0.800 14.140 4.986 1.00 0.00 C ATOM 943 OD1 ASN A 96 1.793 13.930 4.288 1.00 0.00 O ATOM 944 ND2 ASN A 96 0.852 14.847 6.110 1.00 0.00 N ATOM 0 H ASN A 96 -2.500 14.821 5.729 1.00 0.00 H new ATOM 0 HA ASN A 96 -0.810 15.357 3.393 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -1.061 13.209 5.481 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -0.425 12.753 3.913 1.00 0.00 H new ATOM 0 HD21 ASN A 96 1.739 15.240 6.425 1.00 0.00 H new ATOM 0 HD22 ASN A 96 0.005 14.997 6.658 1.00 0.00 H new ATOM 951 N LEU A 97 -3.555 13.577 3.410 1.00 0.00 N ATOM 952 CA LEU A 97 -4.548 12.925 2.564 1.00 0.00 C ATOM 953 C LEU A 97 -5.951 13.443 2.874 1.00 0.00 C ATOM 954 O LEU A 97 -6.555 13.060 3.876 1.00 0.00 O ATOM 955 CB LEU A 97 -4.501 11.410 2.766 1.00 0.00 C ATOM 956 CG LEU A 97 -3.584 10.653 1.803 1.00 0.00 C ATOM 957 CD1 LEU A 97 -3.159 9.324 2.409 1.00 0.00 C ATOM 958 CD2 LEU A 97 -4.270 10.440 0.459 1.00 0.00 C ATOM 0 H LEU A 97 -3.840 13.689 4.383 1.00 0.00 H new ATOM 0 HA LEU A 97 -4.313 13.157 1.525 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.178 11.205 3.787 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -5.512 11.015 2.666 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.691 11.255 1.634 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.507 8.798 1.712 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -2.623 9.504 3.341 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -4.042 8.717 2.609 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -3.600 9.900 -0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.182 9.861 0.604 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -4.519 11.406 0.021 1.00 0.00 H new ATOM 970 N PRO A 98 -6.493 14.327 2.016 1.00 0.00 N ATOM 971 CA PRO A 98 -7.832 14.896 2.205 1.00 0.00 C ATOM 972 C PRO A 98 -8.877 13.847 2.576 1.00 0.00 C ATOM 973 O PRO A 98 -9.368 13.817 3.705 1.00 0.00 O ATOM 974 CB PRO A 98 -8.140 15.502 0.836 1.00 0.00 C ATOM 975 CG PRO A 98 -6.808 15.893 0.301 1.00 0.00 C ATOM 976 CD PRO A 98 -5.845 14.845 0.793 1.00 0.00 C ATOM 0 HA PRO A 98 -7.860 15.610 3.028 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -8.635 14.782 0.184 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -8.803 16.363 0.922 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -6.820 15.932 -0.788 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -6.521 16.884 0.653 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -5.696 14.058 0.054 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -4.865 15.270 1.008 1.00 0.00 H new ATOM 984 N GLN A 99 -9.220 12.996 1.616 1.00 0.00 N ATOM 985 CA GLN A 99 -10.216 11.953 1.839 1.00 0.00 C ATOM 986 C GLN A 99 -9.556 10.595 2.069 1.00 0.00 C ATOM 987 O GLN A 99 -9.942 9.594 1.465 1.00 0.00 O ATOM 988 CB GLN A 99 -11.172 11.872 0.647 1.00 0.00 C ATOM 989 CG GLN A 99 -12.031 13.113 0.471 1.00 0.00 C ATOM 990 CD GLN A 99 -11.509 14.034 -0.613 1.00 0.00 C ATOM 991 OE1 GLN A 99 -10.946 15.091 -0.328 1.00 0.00 O ATOM 992 NE2 GLN A 99 -11.694 13.638 -1.867 1.00 0.00 N ATOM 0 H GLN A 99 -8.824 13.007 0.676 1.00 0.00 H new ATOM 0 HA GLN A 99 -10.778 12.214 2.736 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -10.593 11.709 -0.262 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -11.821 11.005 0.771 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -13.050 12.813 0.228 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -12.075 13.657 1.415 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -12.166 12.754 -2.058 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -11.364 14.218 -2.639 1.00 0.00 H new ATOM 1001 N GLY A 100 -8.565 10.566 2.955 1.00 0.00 N ATOM 1002 CA GLY A 100 -7.876 9.324 3.259 1.00 0.00 C ATOM 1003 C GLY A 100 -7.038 8.813 2.103 1.00 0.00 C ATOM 1004 O GLY A 100 -5.824 8.987 2.093 1.00 0.00 O ATOM 0 H GLY A 100 -8.227 11.380 3.468 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -7.234 9.474 4.127 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -8.610 8.565 3.532 1.00 0.00 H new ATOM 1008 N VAL A 101 -7.688 8.176 1.133 1.00 0.00 N ATOM 1009 CA VAL A 101 -7.002 7.627 -0.037 1.00 0.00 C ATOM 1010 C VAL A 101 -8.001 7.322 -1.143 1.00 0.00 C ATOM 1011 O VAL A 101 -8.861 6.453 -0.998 1.00 0.00 O ATOM 1012 CB VAL A 101 -6.234 6.325 0.298 1.00 0.00 C ATOM 1013 CG1 VAL A 101 -5.528 5.787 -0.939 1.00 0.00 C ATOM 1014 CG2 VAL A 101 -5.231 6.545 1.420 1.00 0.00 C ATOM 0 H VAL A 101 -8.697 8.026 1.133 1.00 0.00 H new ATOM 0 HA VAL A 101 -6.288 8.383 -0.365 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.964 5.589 0.637 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.994 4.872 -0.684 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -6.264 5.573 -1.714 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.820 6.530 -1.306 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -4.709 5.611 1.630 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.509 7.304 1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -5.755 6.877 2.316 1.00 0.00 H new ATOM 1024 N ARG A 102 -7.876 8.038 -2.251 1.00 0.00 N ATOM 1025 CA ARG A 102 -8.759 7.845 -3.388 1.00 0.00 C ATOM 1026 C ARG A 102 -8.097 7.022 -4.477 1.00 0.00 C ATOM 1027 O ARG A 102 -8.762 6.261 -5.178 1.00 0.00 O ATOM 1028 CB ARG A 102 -9.198 9.194 -3.956 1.00 0.00 C ATOM 1029 CG ARG A 102 -10.640 9.532 -3.638 1.00 0.00 C ATOM 1030 CD ARG A 102 -11.584 8.929 -4.670 1.00 0.00 C ATOM 1031 NE ARG A 102 -11.083 7.661 -5.221 1.00 0.00 N ATOM 1032 CZ ARG A 102 -11.802 6.540 -5.285 1.00 0.00 C ATOM 1033 NH1 ARG A 102 -13.050 6.507 -4.833 1.00 0.00 N ATOM 1034 NH2 ARG A 102 -11.268 5.445 -5.808 1.00 0.00 N ATOM 0 H ARG A 102 -7.168 8.760 -2.385 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.633 7.299 -3.034 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.552 9.976 -3.559 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.063 9.187 -5.038 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.894 9.159 -2.646 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.766 10.614 -3.613 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.559 8.762 -4.212 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.731 9.641 -5.482 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.127 7.638 -5.576 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.469 7.346 -4.431 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.590 5.643 -4.888 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.311 5.462 -6.159 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.815 4.585 -5.859 1.00 0.00 H new ATOM 1048 N TYR A 103 -6.792 7.182 -4.631 1.00 0.00 N ATOM 1049 CA TYR A 103 -6.078 6.443 -5.660 1.00 0.00 C ATOM 1050 C TYR A 103 -4.662 6.083 -5.235 1.00 0.00 C ATOM 1051 O TYR A 103 -4.102 6.676 -4.315 1.00 0.00 O ATOM 1052 CB TYR A 103 -6.046 7.239 -6.965 1.00 0.00 C ATOM 1053 CG TYR A 103 -7.399 7.746 -7.405 1.00 0.00 C ATOM 1054 CD1 TYR A 103 -8.279 6.913 -8.081 1.00 0.00 C ATOM 1055 CD2 TYR A 103 -7.794 9.054 -7.154 1.00 0.00 C ATOM 1056 CE1 TYR A 103 -9.514 7.365 -8.496 1.00 0.00 C ATOM 1057 CE2 TYR A 103 -9.031 9.515 -7.565 1.00 0.00 C ATOM 1058 CZ TYR A 103 -9.887 8.668 -8.236 1.00 0.00 C ATOM 1059 OH TYR A 103 -11.117 9.124 -8.648 1.00 0.00 O ATOM 0 H TYR A 103 -6.214 7.806 -4.068 1.00 0.00 H new ATOM 0 HA TYR A 103 -6.620 5.510 -5.817 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -5.372 8.087 -6.845 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -5.631 6.610 -7.753 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -7.992 5.892 -8.286 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -7.125 9.721 -6.630 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -10.186 6.703 -9.022 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -9.325 10.534 -7.361 1.00 0.00 H new ATOM 0 HH TYR A 103 -11.223 10.062 -8.385 1.00 0.00 H new ATOM 1069 N ILE A 104 -4.095 5.104 -5.929 1.00 0.00 N ATOM 1070 CA ILE A 104 -2.743 4.645 -5.655 1.00 0.00 C ATOM 1071 C ILE A 104 -1.842 4.901 -6.859 1.00 0.00 C ATOM 1072 O ILE A 104 -2.160 4.505 -7.979 1.00 0.00 O ATOM 1073 CB ILE A 104 -2.727 3.143 -5.305 1.00 0.00 C ATOM 1074 CG1 ILE A 104 -3.684 2.868 -4.139 1.00 0.00 C ATOM 1075 CG2 ILE A 104 -1.316 2.683 -4.973 1.00 0.00 C ATOM 1076 CD1 ILE A 104 -3.518 1.497 -3.511 1.00 0.00 C ATOM 0 H ILE A 104 -4.557 4.610 -6.692 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.368 5.205 -4.798 1.00 0.00 H new ATOM 0 HB ILE A 104 -3.065 2.576 -6.172 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -3.533 3.628 -3.372 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -4.710 2.972 -4.493 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.328 1.621 -4.729 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.667 2.851 -5.832 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.941 3.247 -4.119 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.231 1.382 -2.695 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.699 0.728 -4.262 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -2.504 1.394 -3.124 1.00 0.00 H new ATOM 1088 N TYR A 105 -0.732 5.587 -6.623 1.00 0.00 N ATOM 1089 CA TYR A 105 0.200 5.924 -7.686 1.00 0.00 C ATOM 1090 C TYR A 105 1.480 5.114 -7.616 1.00 0.00 C ATOM 1091 O TYR A 105 1.769 4.465 -6.613 1.00 0.00 O ATOM 1092 CB TYR A 105 0.539 7.403 -7.615 1.00 0.00 C ATOM 1093 CG TYR A 105 -0.140 8.189 -8.691 1.00 0.00 C ATOM 1094 CD1 TYR A 105 0.310 8.117 -9.994 1.00 0.00 C ATOM 1095 CD2 TYR A 105 -1.240 8.978 -8.411 1.00 0.00 C ATOM 1096 CE1 TYR A 105 -0.314 8.813 -10.999 1.00 0.00 C ATOM 1097 CE2 TYR A 105 -1.875 9.682 -9.407 1.00 0.00 C ATOM 1098 CZ TYR A 105 -1.409 9.599 -10.705 1.00 0.00 C ATOM 1099 OH TYR A 105 -2.041 10.299 -11.707 1.00 0.00 O ATOM 0 H TYR A 105 -0.456 5.922 -5.700 1.00 0.00 H new ATOM 0 HA TYR A 105 -0.288 5.686 -8.631 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.246 7.795 -6.641 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.618 7.531 -7.699 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.167 7.503 -10.227 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -1.605 9.042 -7.397 1.00 0.00 H new ATOM 0 HE1 TYR A 105 0.050 8.746 -12.014 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -2.733 10.296 -9.176 1.00 0.00 H new ATOM 0 HH TYR A 105 -2.794 10.801 -11.331 1.00 0.00 H new ATOM 1109 N THR A 106 2.247 5.171 -8.700 1.00 0.00 N ATOM 1110 CA THR A 106 3.511 4.449 -8.776 1.00 0.00 C ATOM 1111 C THR A 106 4.556 5.114 -7.891 1.00 0.00 C ATOM 1112 O THR A 106 4.486 6.314 -7.625 1.00 0.00 O ATOM 1113 CB THR A 106 4.006 4.394 -10.222 1.00 0.00 C ATOM 1114 OG1 THR A 106 3.505 5.491 -10.966 1.00 0.00 O ATOM 1115 CG2 THR A 106 3.604 3.127 -10.944 1.00 0.00 C ATOM 0 H THR A 106 2.016 5.708 -9.536 1.00 0.00 H new ATOM 0 HA THR A 106 3.349 3.431 -8.422 1.00 0.00 H new ATOM 0 HB THR A 106 5.094 4.426 -10.156 1.00 0.00 H new ATOM 0 HG1 THR A 106 4.009 5.576 -11.802 1.00 0.00 H new ATOM 0 HG21 THR A 106 3.987 3.152 -11.964 1.00 0.00 H new ATOM 0 HG22 THR A 106 4.018 2.264 -10.422 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.517 3.050 -10.966 1.00 0.00 H new ATOM 1123 N ILE A 107 5.524 4.326 -7.431 1.00 0.00 N ATOM 1124 CA ILE A 107 6.585 4.836 -6.568 1.00 0.00 C ATOM 1125 C ILE A 107 7.155 6.152 -7.096 1.00 0.00 C ATOM 1126 O ILE A 107 7.639 6.983 -6.327 1.00 0.00 O ATOM 1127 CB ILE A 107 7.724 3.809 -6.410 1.00 0.00 C ATOM 1128 CG1 ILE A 107 8.668 4.237 -5.284 1.00 0.00 C ATOM 1129 CG2 ILE A 107 8.483 3.638 -7.718 1.00 0.00 C ATOM 1130 CD1 ILE A 107 7.967 4.436 -3.957 1.00 0.00 C ATOM 0 H ILE A 107 5.595 3.331 -7.642 1.00 0.00 H new ATOM 0 HA ILE A 107 6.135 5.017 -5.592 1.00 0.00 H new ATOM 0 HB ILE A 107 7.288 2.845 -6.148 1.00 0.00 H new ATOM 0 HG12 ILE A 107 9.447 3.483 -5.166 1.00 0.00 H new ATOM 0 HG13 ILE A 107 9.163 5.165 -5.568 1.00 0.00 H new ATOM 0 HG21 ILE A 107 9.282 2.909 -7.583 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.800 3.288 -8.492 1.00 0.00 H new ATOM 0 HG23 ILE A 107 8.912 4.594 -8.018 1.00 0.00 H new ATOM 0 HD11 ILE A 107 8.694 4.738 -3.203 1.00 0.00 H new ATOM 0 HD12 ILE A 107 7.207 5.211 -4.060 1.00 0.00 H new ATOM 0 HD13 ILE A 107 7.495 3.502 -3.651 1.00 0.00 H new ATOM 1142 N ASP A 108 7.090 6.334 -8.411 1.00 0.00 N ATOM 1143 CA ASP A 108 7.594 7.548 -9.041 1.00 0.00 C ATOM 1144 C ASP A 108 6.464 8.550 -9.268 1.00 0.00 C ATOM 1145 O ASP A 108 6.695 9.758 -9.324 1.00 0.00 O ATOM 1146 CB ASP A 108 8.273 7.214 -10.371 1.00 0.00 C ATOM 1147 CG ASP A 108 9.772 7.042 -10.225 1.00 0.00 C ATOM 1148 OD1 ASP A 108 10.219 6.624 -9.136 1.00 0.00 O ATOM 1149 OD2 ASP A 108 10.499 7.325 -11.201 1.00 0.00 O ATOM 0 H ASP A 108 6.693 5.656 -9.061 1.00 0.00 H new ATOM 0 HA ASP A 108 8.327 7.999 -8.372 1.00 0.00 H new ATOM 0 HB2 ASP A 108 7.842 6.298 -10.776 1.00 0.00 H new ATOM 0 HB3 ASP A 108 8.069 8.008 -11.090 1.00 0.00 H new ATOM 1154 N GLY A 109 5.243 8.039 -9.398 1.00 0.00 N ATOM 1155 CA GLY A 109 4.096 8.902 -9.614 1.00 0.00 C ATOM 1156 C GLY A 109 3.767 9.079 -11.084 1.00 0.00 C ATOM 1157 O GLY A 109 3.089 10.035 -11.462 1.00 0.00 O ATOM 0 H GLY A 109 5.028 7.043 -9.358 1.00 0.00 H new ATOM 0 HA2 GLY A 109 3.230 8.485 -9.100 1.00 0.00 H new ATOM 0 HA3 GLY A 109 4.291 9.878 -9.169 1.00 0.00 H new ATOM 1161 N SER A 110 4.245 8.158 -11.914 1.00 0.00 N ATOM 1162 CA SER A 110 3.995 8.223 -13.348 1.00 0.00 C ATOM 1163 C SER A 110 2.519 7.997 -13.656 1.00 0.00 C ATOM 1164 O SER A 110 1.896 8.786 -14.367 1.00 0.00 O ATOM 1165 CB SER A 110 4.845 7.183 -14.081 1.00 0.00 C ATOM 1166 OG SER A 110 4.610 5.882 -13.573 1.00 0.00 O ATOM 0 H SER A 110 4.807 7.359 -11.618 1.00 0.00 H new ATOM 0 HA SER A 110 4.270 9.219 -13.694 1.00 0.00 H new ATOM 0 HB2 SER A 110 4.616 7.207 -15.146 1.00 0.00 H new ATOM 0 HB3 SER A 110 5.901 7.432 -13.976 1.00 0.00 H new ATOM 0 HG SER A 110 5.164 5.236 -14.059 1.00 0.00 H new ATOM 1172 N ARG A 111 1.965 6.912 -13.122 1.00 0.00 N ATOM 1173 CA ARG A 111 0.573 6.578 -13.340 1.00 0.00 C ATOM 1174 C ARG A 111 -0.026 5.926 -12.100 1.00 0.00 C ATOM 1175 O ARG A 111 0.688 5.386 -11.254 1.00 0.00 O ATOM 1176 CB ARG A 111 0.434 5.641 -14.542 1.00 0.00 C ATOM 1177 CG ARG A 111 1.559 4.623 -14.656 1.00 0.00 C ATOM 1178 CD ARG A 111 1.022 3.217 -14.878 1.00 0.00 C ATOM 1179 NE ARG A 111 2.020 2.195 -14.573 1.00 0.00 N ATOM 1180 CZ ARG A 111 1.763 0.889 -14.558 1.00 0.00 C ATOM 1181 NH1 ARG A 111 0.543 0.442 -14.831 1.00 0.00 N ATOM 1182 NH2 ARG A 111 2.727 0.026 -14.271 1.00 0.00 N ATOM 0 H ARG A 111 2.468 6.249 -12.532 1.00 0.00 H new ATOM 0 HA ARG A 111 0.029 7.500 -13.544 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -0.517 5.113 -14.472 1.00 0.00 H new ATOM 0 HB3 ARG A 111 0.401 6.237 -15.454 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.216 4.897 -15.482 1.00 0.00 H new ATOM 0 HG3 ARG A 111 2.162 4.644 -13.748 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.142 3.062 -14.253 1.00 0.00 H new ATOM 0 HD3 ARG A 111 0.700 3.111 -15.914 1.00 0.00 H new ATOM 0 HE ARG A 111 2.970 2.500 -14.359 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -0.203 1.100 -15.054 1.00 0.00 H new ATOM 0 HH12 ARG A 111 0.352 -0.560 -14.818 1.00 0.00 H new ATOM 0 HH21 ARG A 111 3.667 0.362 -14.061 1.00 0.00 H new ATOM 0 HH22 ARG A 111 2.529 -0.975 -14.260 1.00 0.00 H new ATOM 1196 N LYS A 112 -1.342 5.979 -12.014 1.00 0.00 N ATOM 1197 CA LYS A 112 -2.074 5.396 -10.895 1.00 0.00 C ATOM 1198 C LYS A 112 -2.518 3.974 -11.235 1.00 0.00 C ATOM 1199 O LYS A 112 -2.904 3.688 -12.368 1.00 0.00 O ATOM 1200 CB LYS A 112 -3.278 6.286 -10.526 1.00 0.00 C ATOM 1201 CG LYS A 112 -4.394 5.581 -9.758 1.00 0.00 C ATOM 1202 CD LYS A 112 -5.766 6.116 -10.155 1.00 0.00 C ATOM 1203 CE LYS A 112 -5.838 7.631 -10.032 1.00 0.00 C ATOM 1204 NZ LYS A 112 -5.372 8.312 -11.272 1.00 0.00 N ATOM 0 H LYS A 112 -1.936 6.425 -12.713 1.00 0.00 H new ATOM 0 HA LYS A 112 -1.416 5.343 -10.028 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -2.920 7.124 -9.928 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -3.696 6.703 -11.442 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -4.350 4.509 -9.951 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -4.244 5.718 -8.687 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -5.987 5.824 -11.181 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -6.530 5.663 -9.523 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.864 7.929 -9.818 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -5.229 7.956 -9.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -5.994 9.119 -11.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -4.398 8.652 -11.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -5.397 7.642 -12.067 1.00 0.00 H new ATOM 1218 N ILE A 113 -2.451 3.088 -10.247 1.00 0.00 N ATOM 1219 CA ILE A 113 -2.833 1.696 -10.435 1.00 0.00 C ATOM 1220 C ILE A 113 -4.343 1.521 -10.351 1.00 0.00 C ATOM 1221 O ILE A 113 -4.996 2.060 -9.458 1.00 0.00 O ATOM 1222 CB ILE A 113 -2.180 0.797 -9.367 1.00 0.00 C ATOM 1223 CG1 ILE A 113 -0.662 1.000 -9.350 1.00 0.00 C ATOM 1224 CG2 ILE A 113 -2.534 -0.665 -9.607 1.00 0.00 C ATOM 1225 CD1 ILE A 113 0.086 0.131 -10.338 1.00 0.00 C ATOM 0 H ILE A 113 -2.134 3.312 -9.304 1.00 0.00 H new ATOM 0 HA ILE A 113 -2.487 1.404 -11.427 1.00 0.00 H new ATOM 0 HB ILE A 113 -2.570 1.081 -8.390 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.443 2.046 -9.564 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.289 0.795 -8.346 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -2.064 -1.283 -8.843 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -3.616 -0.790 -9.560 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -2.176 -0.969 -10.591 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.154 0.334 -10.265 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -0.101 -0.919 -10.113 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -0.257 0.352 -11.349 1.00 0.00 H new ATOM 1237 N GLY A 114 -4.888 0.753 -11.286 1.00 0.00 N ATOM 1238 CA GLY A 114 -6.315 0.504 -11.306 1.00 0.00 C ATOM 1239 C GLY A 114 -6.642 -0.960 -11.081 1.00 0.00 C ATOM 1240 O GLY A 114 -7.753 -1.298 -10.673 1.00 0.00 O ATOM 0 H GLY A 114 -4.364 0.297 -12.033 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.798 1.105 -10.536 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -6.725 0.823 -12.264 1.00 0.00 H new ATOM 1244 N SER A 115 -5.672 -1.832 -11.348 1.00 0.00 N ATOM 1245 CA SER A 115 -5.866 -3.266 -11.173 1.00 0.00 C ATOM 1246 C SER A 115 -4.836 -3.852 -10.211 1.00 0.00 C ATOM 1247 O SER A 115 -3.685 -3.417 -10.170 1.00 0.00 O ATOM 1248 CB SER A 115 -5.784 -3.982 -12.522 1.00 0.00 C ATOM 1249 OG SER A 115 -4.506 -3.814 -13.112 1.00 0.00 O ATOM 0 H SER A 115 -4.746 -1.569 -11.686 1.00 0.00 H new ATOM 0 HA SER A 115 -6.857 -3.418 -10.745 1.00 0.00 H new ATOM 0 HB2 SER A 115 -5.989 -5.044 -12.387 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.551 -3.592 -13.191 1.00 0.00 H new ATOM 0 HG SER A 115 -4.479 -4.282 -13.972 1.00 0.00 H new ATOM 1255 N MET A 116 -5.265 -4.846 -9.444 1.00 0.00 N ATOM 1256 CA MET A 116 -4.401 -5.513 -8.480 1.00 0.00 C ATOM 1257 C MET A 116 -3.240 -6.210 -9.182 1.00 0.00 C ATOM 1258 O MET A 116 -2.179 -6.419 -8.593 1.00 0.00 O ATOM 1259 CB MET A 116 -5.206 -6.532 -7.671 1.00 0.00 C ATOM 1260 CG MET A 116 -4.928 -6.485 -6.179 1.00 0.00 C ATOM 1261 SD MET A 116 -6.127 -7.432 -5.221 1.00 0.00 S ATOM 1262 CE MET A 116 -7.269 -6.139 -4.736 1.00 0.00 C ATOM 0 H MET A 116 -6.217 -5.211 -9.472 1.00 0.00 H new ATOM 0 HA MET A 116 -3.994 -4.758 -7.807 1.00 0.00 H new ATOM 0 HB2 MET A 116 -6.269 -6.358 -7.839 1.00 0.00 H new ATOM 0 HB3 MET A 116 -4.985 -7.533 -8.041 1.00 0.00 H new ATOM 0 HG2 MET A 116 -3.927 -6.872 -5.987 1.00 0.00 H new ATOM 0 HG3 MET A 116 -4.938 -5.448 -5.844 1.00 0.00 H new ATOM 0 HE1 MET A 116 -8.291 -6.513 -4.800 1.00 0.00 H new ATOM 0 HE2 MET A 116 -7.058 -5.833 -3.711 1.00 0.00 H new ATOM 0 HE3 MET A 116 -7.153 -5.283 -5.401 1.00 0.00 H new ATOM 1272 N ASP A 117 -3.452 -6.570 -10.445 1.00 0.00 N ATOM 1273 CA ASP A 117 -2.440 -7.242 -11.233 1.00 0.00 C ATOM 1274 C ASP A 117 -1.171 -6.402 -11.353 1.00 0.00 C ATOM 1275 O ASP A 117 -0.105 -6.923 -11.677 1.00 0.00 O ATOM 1276 CB ASP A 117 -3.006 -7.553 -12.616 1.00 0.00 C ATOM 1277 CG ASP A 117 -3.336 -9.022 -12.792 1.00 0.00 C ATOM 1278 OD1 ASP A 117 -2.434 -9.862 -12.587 1.00 0.00 O ATOM 1279 OD2 ASP A 117 -4.496 -9.333 -13.136 1.00 0.00 O ATOM 0 H ASP A 117 -4.327 -6.403 -10.942 1.00 0.00 H new ATOM 0 HA ASP A 117 -2.167 -8.169 -10.729 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -3.906 -6.960 -12.778 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -2.285 -7.252 -13.376 1.00 0.00 H new ATOM 1284 N GLU A 118 -1.286 -5.102 -11.090 1.00 0.00 N ATOM 1285 CA GLU A 118 -0.135 -4.210 -11.175 1.00 0.00 C ATOM 1286 C GLU A 118 0.634 -4.173 -9.854 1.00 0.00 C ATOM 1287 O GLU A 118 1.780 -3.724 -9.808 1.00 0.00 O ATOM 1288 CB GLU A 118 -0.586 -2.801 -11.558 1.00 0.00 C ATOM 1289 CG GLU A 118 -1.089 -2.690 -12.989 1.00 0.00 C ATOM 1290 CD GLU A 118 -0.001 -2.957 -14.010 1.00 0.00 C ATOM 1291 OE1 GLU A 118 0.971 -2.176 -14.060 1.00 0.00 O ATOM 1292 OE2 GLU A 118 -0.122 -3.948 -14.761 1.00 0.00 O ATOM 0 H GLU A 118 -2.158 -4.647 -10.819 1.00 0.00 H new ATOM 0 HA GLU A 118 0.532 -4.594 -11.946 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.377 -2.485 -10.878 1.00 0.00 H new ATOM 0 HB3 GLU A 118 0.247 -2.112 -11.420 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -1.905 -3.397 -13.139 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -1.497 -1.692 -13.151 1.00 0.00 H new ATOM 1299 N LEU A 119 0.000 -4.642 -8.782 1.00 0.00 N ATOM 1300 CA LEU A 119 0.632 -4.654 -7.466 1.00 0.00 C ATOM 1301 C LEU A 119 1.540 -5.866 -7.296 1.00 0.00 C ATOM 1302 O LEU A 119 1.067 -6.997 -7.185 1.00 0.00 O ATOM 1303 CB LEU A 119 -0.427 -4.653 -6.360 1.00 0.00 C ATOM 1304 CG LEU A 119 -1.711 -3.895 -6.689 1.00 0.00 C ATOM 1305 CD1 LEU A 119 -2.691 -3.978 -5.529 1.00 0.00 C ATOM 1306 CD2 LEU A 119 -1.402 -2.446 -7.029 1.00 0.00 C ATOM 0 H LEU A 119 -0.948 -5.018 -8.799 1.00 0.00 H new ATOM 0 HA LEU A 119 1.239 -3.752 -7.388 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.684 -5.686 -6.124 1.00 0.00 H new ATOM 0 HB3 LEU A 119 0.011 -4.220 -5.460 1.00 0.00 H new ATOM 0 HG LEU A 119 -2.173 -4.359 -7.560 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.600 -3.432 -5.781 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -2.937 -5.022 -5.334 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.239 -3.539 -4.639 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.329 -1.921 -7.261 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -0.917 -1.968 -6.178 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -0.738 -2.409 -7.893 1.00 0.00 H new ATOM 1318 N GLU A 120 2.845 -5.622 -7.265 1.00 0.00 N ATOM 1319 CA GLU A 120 3.815 -6.692 -7.095 1.00 0.00 C ATOM 1320 C GLU A 120 4.277 -6.767 -5.641 1.00 0.00 C ATOM 1321 O GLU A 120 4.197 -5.784 -4.905 1.00 0.00 O ATOM 1322 CB GLU A 120 5.010 -6.470 -8.018 1.00 0.00 C ATOM 1323 CG GLU A 120 4.620 -6.158 -9.453 1.00 0.00 C ATOM 1324 CD GLU A 120 5.663 -6.614 -10.454 1.00 0.00 C ATOM 1325 OE1 GLU A 120 6.652 -5.878 -10.657 1.00 0.00 O ATOM 1326 OE2 GLU A 120 5.492 -7.705 -11.035 1.00 0.00 O ATOM 0 H GLU A 120 3.254 -4.692 -7.356 1.00 0.00 H new ATOM 0 HA GLU A 120 3.340 -7.637 -7.357 1.00 0.00 H new ATOM 0 HB2 GLU A 120 5.613 -5.650 -7.628 1.00 0.00 H new ATOM 0 HB3 GLU A 120 5.638 -7.361 -8.006 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.669 -6.640 -9.680 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.466 -5.084 -9.558 1.00 0.00 H new ATOM 1333 N GLU A 121 4.745 -7.939 -5.229 1.00 0.00 N ATOM 1334 CA GLU A 121 5.205 -8.140 -3.856 1.00 0.00 C ATOM 1335 C GLU A 121 6.309 -7.161 -3.480 1.00 0.00 C ATOM 1336 O GLU A 121 7.006 -6.627 -4.342 1.00 0.00 O ATOM 1337 CB GLU A 121 5.710 -9.565 -3.653 1.00 0.00 C ATOM 1338 CG GLU A 121 4.602 -10.605 -3.604 1.00 0.00 C ATOM 1339 CD GLU A 121 4.953 -11.867 -4.369 1.00 0.00 C ATOM 1340 OE1 GLU A 121 6.120 -12.306 -4.288 1.00 0.00 O ATOM 1341 OE2 GLU A 121 4.062 -12.415 -5.051 1.00 0.00 O ATOM 0 H GLU A 121 4.817 -8.765 -5.823 1.00 0.00 H new ATOM 0 HA GLU A 121 4.346 -7.962 -3.208 1.00 0.00 H new ATOM 0 HB2 GLU A 121 6.397 -9.816 -4.461 1.00 0.00 H new ATOM 0 HB3 GLU A 121 6.280 -9.610 -2.725 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.394 -10.860 -2.565 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.688 -10.177 -4.016 1.00 0.00 H new ATOM 1348 N GLY A 122 6.463 -6.943 -2.175 1.00 0.00 N ATOM 1349 CA GLY A 122 7.483 -6.043 -1.671 1.00 0.00 C ATOM 1350 C GLY A 122 7.589 -4.760 -2.472 1.00 0.00 C ATOM 1351 O GLY A 122 8.689 -4.280 -2.743 1.00 0.00 O ATOM 0 H GLY A 122 5.891 -7.380 -1.452 1.00 0.00 H new ATOM 0 HA2 GLY A 122 7.263 -5.799 -0.632 1.00 0.00 H new ATOM 0 HA3 GLY A 122 8.447 -6.552 -1.682 1.00 0.00 H new ATOM 1355 N GLU A 123 6.444 -4.209 -2.859 1.00 0.00 N ATOM 1356 CA GLU A 123 6.424 -2.978 -3.645 1.00 0.00 C ATOM 1357 C GLU A 123 6.142 -1.759 -2.776 1.00 0.00 C ATOM 1358 O GLU A 123 5.706 -1.885 -1.635 1.00 0.00 O ATOM 1359 CB GLU A 123 5.379 -3.073 -4.757 1.00 0.00 C ATOM 1360 CG GLU A 123 5.920 -3.675 -6.043 1.00 0.00 C ATOM 1361 CD GLU A 123 5.153 -3.219 -7.268 1.00 0.00 C ATOM 1362 OE1 GLU A 123 3.938 -2.956 -7.145 1.00 0.00 O ATOM 1363 OE2 GLU A 123 5.768 -3.123 -8.351 1.00 0.00 O ATOM 0 H GLU A 123 5.523 -4.591 -2.644 1.00 0.00 H new ATOM 0 HA GLU A 123 7.413 -2.857 -4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 123 4.541 -3.675 -4.407 1.00 0.00 H new ATOM 0 HB3 GLU A 123 4.990 -2.076 -4.966 1.00 0.00 H new ATOM 0 HG2 GLU A 123 6.970 -3.403 -6.154 1.00 0.00 H new ATOM 0 HG3 GLU A 123 5.878 -4.762 -5.977 1.00 0.00 H new ATOM 1370 N SER A 124 6.387 -0.580 -3.337 1.00 0.00 N ATOM 1371 CA SER A 124 6.155 0.676 -2.631 1.00 0.00 C ATOM 1372 C SER A 124 5.175 1.546 -3.412 1.00 0.00 C ATOM 1373 O SER A 124 5.458 1.952 -4.539 1.00 0.00 O ATOM 1374 CB SER A 124 7.474 1.424 -2.428 1.00 0.00 C ATOM 1375 OG SER A 124 8.203 0.886 -1.339 1.00 0.00 O ATOM 0 H SER A 124 6.748 -0.467 -4.284 1.00 0.00 H new ATOM 0 HA SER A 124 5.726 0.451 -1.654 1.00 0.00 H new ATOM 0 HB2 SER A 124 8.074 1.363 -3.336 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.273 2.480 -2.249 1.00 0.00 H new ATOM 0 HG SER A 124 7.981 -0.063 -1.234 1.00 0.00 H new ATOM 1381 N TYR A 125 4.018 1.816 -2.818 1.00 0.00 N ATOM 1382 CA TYR A 125 2.996 2.623 -3.477 1.00 0.00 C ATOM 1383 C TYR A 125 2.752 3.936 -2.763 1.00 0.00 C ATOM 1384 O TYR A 125 3.049 4.094 -1.580 1.00 0.00 O ATOM 1385 CB TYR A 125 1.685 1.865 -3.600 1.00 0.00 C ATOM 1386 CG TYR A 125 1.675 0.899 -4.754 1.00 0.00 C ATOM 1387 CD1 TYR A 125 1.765 1.368 -6.052 1.00 0.00 C ATOM 1388 CD2 TYR A 125 1.591 -0.473 -4.555 1.00 0.00 C ATOM 1389 CE1 TYR A 125 1.772 0.510 -7.122 1.00 0.00 C ATOM 1390 CE2 TYR A 125 1.595 -1.346 -5.624 1.00 0.00 C ATOM 1391 CZ TYR A 125 1.686 -0.849 -6.910 1.00 0.00 C ATOM 1392 OH TYR A 125 1.694 -1.711 -7.981 1.00 0.00 O ATOM 0 H TYR A 125 3.764 1.490 -1.885 1.00 0.00 H new ATOM 0 HA TYR A 125 3.379 2.842 -4.474 1.00 0.00 H new ATOM 0 HB2 TYR A 125 1.498 1.320 -2.675 1.00 0.00 H new ATOM 0 HB3 TYR A 125 0.869 2.577 -3.721 1.00 0.00 H new ATOM 0 HD1 TYR A 125 1.831 2.432 -6.227 1.00 0.00 H new ATOM 0 HD2 TYR A 125 1.522 -0.862 -3.550 1.00 0.00 H new ATOM 0 HE1 TYR A 125 1.845 0.898 -8.127 1.00 0.00 H new ATOM 0 HE2 TYR A 125 1.527 -2.411 -5.456 1.00 0.00 H new ATOM 0 HH TYR A 125 2.515 -2.247 -7.964 1.00 0.00 H new ATOM 1402 N VAL A 126 2.199 4.871 -3.512 1.00 0.00 N ATOM 1403 CA VAL A 126 1.888 6.199 -2.988 1.00 0.00 C ATOM 1404 C VAL A 126 0.387 6.462 -3.035 1.00 0.00 C ATOM 1405 O VAL A 126 -0.278 6.142 -4.014 1.00 0.00 O ATOM 1406 CB VAL A 126 2.639 7.307 -3.771 1.00 0.00 C ATOM 1407 CG1 VAL A 126 1.885 8.631 -3.726 1.00 0.00 C ATOM 1408 CG2 VAL A 126 4.044 7.485 -3.221 1.00 0.00 C ATOM 0 H VAL A 126 1.952 4.739 -4.493 1.00 0.00 H new ATOM 0 HA VAL A 126 2.221 6.224 -1.951 1.00 0.00 H new ATOM 0 HB VAL A 126 2.702 6.992 -4.813 1.00 0.00 H new ATOM 0 HG11 VAL A 126 2.440 9.385 -4.285 1.00 0.00 H new ATOM 0 HG12 VAL A 126 0.898 8.503 -4.171 1.00 0.00 H new ATOM 0 HG13 VAL A 126 1.777 8.953 -2.690 1.00 0.00 H new ATOM 0 HG21 VAL A 126 4.558 8.266 -3.781 1.00 0.00 H new ATOM 0 HG22 VAL A 126 3.990 7.768 -2.170 1.00 0.00 H new ATOM 0 HG23 VAL A 126 4.594 6.549 -3.317 1.00 0.00 H new ATOM 1418 N CYS A 127 -0.139 7.049 -1.968 1.00 0.00 N ATOM 1419 CA CYS A 127 -1.561 7.355 -1.896 1.00 0.00 C ATOM 1420 C CYS A 127 -1.839 8.771 -2.390 1.00 0.00 C ATOM 1421 O CYS A 127 -1.184 9.726 -1.967 1.00 0.00 O ATOM 1422 CB CYS A 127 -2.070 7.183 -0.465 1.00 0.00 C ATOM 1423 SG CYS A 127 -2.512 5.480 -0.050 1.00 0.00 S ATOM 0 H CYS A 127 0.396 7.322 -1.143 1.00 0.00 H new ATOM 0 HA CYS A 127 -2.092 6.658 -2.544 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -1.303 7.529 0.228 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -2.942 7.821 -0.320 1.00 0.00 H new ATOM 0 HG CYS A 127 -2.901 4.859 -1.124 1.00 0.00 H new ATOM 1429 N SER A 128 -2.810 8.896 -3.290 1.00 0.00 N ATOM 1430 CA SER A 128 -3.177 10.191 -3.849 1.00 0.00 C ATOM 1431 C SER A 128 -4.681 10.421 -3.756 1.00 0.00 C ATOM 1432 O SER A 128 -5.453 9.484 -3.552 1.00 0.00 O ATOM 1433 CB SER A 128 -2.733 10.282 -5.309 1.00 0.00 C ATOM 1434 OG SER A 128 -1.334 10.089 -5.431 1.00 0.00 O ATOM 0 H SER A 128 -3.358 8.113 -3.648 1.00 0.00 H new ATOM 0 HA SER A 128 -2.671 10.962 -3.268 1.00 0.00 H new ATOM 0 HB2 SER A 128 -3.259 9.532 -5.900 1.00 0.00 H new ATOM 0 HB3 SER A 128 -3.005 11.256 -5.715 1.00 0.00 H new ATOM 0 HG SER A 128 -1.016 10.511 -6.257 1.00 0.00 H new ATOM 1440 N SER A 129 -5.087 11.674 -3.913 1.00 0.00 N ATOM 1441 CA SER A 129 -6.497 12.039 -3.854 1.00 0.00 C ATOM 1442 C SER A 129 -6.756 13.288 -4.689 1.00 0.00 C ATOM 1443 O SER A 129 -7.650 13.312 -5.535 1.00 0.00 O ATOM 1444 CB SER A 129 -6.925 12.278 -2.404 1.00 0.00 C ATOM 1445 OG SER A 129 -8.161 11.644 -2.125 1.00 0.00 O ATOM 0 H SER A 129 -4.457 12.458 -4.083 1.00 0.00 H new ATOM 0 HA SER A 129 -7.085 11.216 -4.262 1.00 0.00 H new ATOM 0 HB2 SER A 129 -6.158 11.899 -1.728 1.00 0.00 H new ATOM 0 HB3 SER A 129 -7.012 13.349 -2.219 1.00 0.00 H new ATOM 0 HG SER A 129 -8.411 11.811 -1.192 1.00 0.00 H new ATOM 1451 N ASP A 130 -5.958 14.321 -4.444 1.00 0.00 N ATOM 1452 CA ASP A 130 -6.080 15.579 -5.171 1.00 0.00 C ATOM 1453 C ASP A 130 -4.719 16.254 -5.284 1.00 0.00 C ATOM 1454 O ASP A 130 -4.336 16.741 -6.348 1.00 0.00 O ATOM 1455 CB ASP A 130 -7.070 16.508 -4.465 1.00 0.00 C ATOM 1456 CG ASP A 130 -8.507 16.059 -4.636 1.00 0.00 C ATOM 1457 OD1 ASP A 130 -9.092 16.335 -5.704 1.00 0.00 O ATOM 1458 OD2 ASP A 130 -9.047 15.432 -3.702 1.00 0.00 O ATOM 0 H ASP A 130 -5.216 14.311 -3.744 1.00 0.00 H new ATOM 0 HA ASP A 130 -6.453 15.367 -6.173 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.830 16.551 -3.403 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -6.959 17.519 -4.858 1.00 0.00 H new ATOM 1463 N ASN A 131 -3.994 16.273 -4.169 1.00 0.00 N ATOM 1464 CA ASN A 131 -2.667 16.879 -4.112 1.00 0.00 C ATOM 1465 C ASN A 131 -1.796 16.434 -5.285 1.00 0.00 C ATOM 1466 O ASN A 131 -2.075 15.424 -5.931 1.00 0.00 O ATOM 1467 CB ASN A 131 -1.977 16.520 -2.790 1.00 0.00 C ATOM 1468 CG ASN A 131 -2.325 15.124 -2.296 1.00 0.00 C ATOM 1469 OD1 ASN A 131 -2.177 14.127 -3.162 1.00 0.00 O flip ATOM 1470 ND2 ASN A 131 -2.724 14.946 -1.145 1.00 0.00 N flip ATOM 0 H ASN A 131 -4.307 15.872 -3.285 1.00 0.00 H new ATOM 0 HA ASN A 131 -2.795 17.960 -4.175 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.897 16.595 -2.918 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -2.259 17.249 -2.030 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -2.824 15.739 -0.511 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.955 14.005 -0.825 1.00 0.00 H new ATOM 1477 N PHE A 132 -0.735 17.192 -5.547 1.00 0.00 N ATOM 1478 CA PHE A 132 0.184 16.873 -6.633 1.00 0.00 C ATOM 1479 C PHE A 132 1.261 15.908 -6.153 1.00 0.00 C ATOM 1480 O PHE A 132 1.652 15.933 -4.986 1.00 0.00 O ATOM 1481 CB PHE A 132 0.828 18.149 -7.178 1.00 0.00 C ATOM 1482 CG PHE A 132 1.020 18.136 -8.668 1.00 0.00 C ATOM 1483 CD1 PHE A 132 -0.002 17.724 -9.507 1.00 0.00 C ATOM 1484 CD2 PHE A 132 2.223 18.536 -9.228 1.00 0.00 C ATOM 1485 CE1 PHE A 132 0.171 17.710 -10.878 1.00 0.00 C ATOM 1486 CE2 PHE A 132 2.402 18.524 -10.599 1.00 0.00 C ATOM 1487 CZ PHE A 132 1.375 18.111 -11.424 1.00 0.00 C ATOM 0 H PHE A 132 -0.491 18.031 -5.021 1.00 0.00 H new ATOM 0 HA PHE A 132 -0.382 16.396 -7.433 1.00 0.00 H new ATOM 0 HB2 PHE A 132 0.208 19.003 -6.907 1.00 0.00 H new ATOM 0 HB3 PHE A 132 1.795 18.292 -6.697 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -0.945 17.410 -9.085 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.029 18.861 -8.587 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -0.634 17.386 -11.521 1.00 0.00 H new ATOM 0 HE2 PHE A 132 3.344 18.837 -11.024 1.00 0.00 H new ATOM 0 HZ PHE A 132 1.513 18.101 -12.495 1.00 0.00 H new ATOM 1497 N PHE A 133 1.735 15.052 -7.052 1.00 0.00 N ATOM 1498 CA PHE A 133 2.762 14.076 -6.702 1.00 0.00 C ATOM 1499 C PHE A 133 4.127 14.738 -6.556 1.00 0.00 C ATOM 1500 O PHE A 133 4.606 15.410 -7.469 1.00 0.00 O ATOM 1501 CB PHE A 133 2.834 12.970 -7.757 1.00 0.00 C ATOM 1502 CG PHE A 133 3.753 11.843 -7.378 1.00 0.00 C ATOM 1503 CD1 PHE A 133 5.127 12.031 -7.346 1.00 0.00 C ATOM 1504 CD2 PHE A 133 3.245 10.597 -7.048 1.00 0.00 C ATOM 1505 CE1 PHE A 133 5.974 10.998 -6.994 1.00 0.00 C ATOM 1506 CE2 PHE A 133 4.088 9.560 -6.696 1.00 0.00 C ATOM 1507 CZ PHE A 133 5.454 9.761 -6.669 1.00 0.00 C ATOM 0 H PHE A 133 1.427 15.014 -8.024 1.00 0.00 H new ATOM 0 HA PHE A 133 2.487 13.638 -5.742 1.00 0.00 H new ATOM 0 HB2 PHE A 133 1.833 12.572 -7.925 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.168 13.400 -8.701 1.00 0.00 H new ATOM 0 HD1 PHE A 133 5.539 12.996 -7.599 1.00 0.00 H new ATOM 0 HD2 PHE A 133 2.177 10.434 -7.066 1.00 0.00 H new ATOM 0 HE1 PHE A 133 7.042 11.158 -6.973 1.00 0.00 H new ATOM 0 HE2 PHE A 133 3.679 8.593 -6.442 1.00 0.00 H new ATOM 0 HZ PHE A 133 6.114 8.952 -6.394 1.00 0.00 H new ATOM 1517 N LYS A 134 4.751 14.535 -5.400 1.00 0.00 N ATOM 1518 CA LYS A 134 6.066 15.101 -5.128 1.00 0.00 C ATOM 1519 C LYS A 134 7.135 14.014 -5.153 1.00 0.00 C ATOM 1520 O LYS A 134 6.966 12.951 -4.555 1.00 0.00 O ATOM 1521 CB LYS A 134 6.071 15.805 -3.769 1.00 0.00 C ATOM 1522 CG LYS A 134 5.191 17.043 -3.722 1.00 0.00 C ATOM 1523 CD LYS A 134 5.832 18.152 -2.903 1.00 0.00 C ATOM 1524 CE LYS A 134 6.528 19.169 -3.792 1.00 0.00 C ATOM 1525 NZ LYS A 134 7.681 18.572 -4.521 1.00 0.00 N ATOM 0 H LYS A 134 4.365 13.981 -4.635 1.00 0.00 H new ATOM 0 HA LYS A 134 6.291 15.830 -5.906 1.00 0.00 H new ATOM 0 HB2 LYS A 134 5.738 15.103 -3.004 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.094 16.087 -3.519 1.00 0.00 H new ATOM 0 HG2 LYS A 134 5.007 17.398 -4.736 1.00 0.00 H new ATOM 0 HG3 LYS A 134 4.222 16.786 -3.293 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.070 18.651 -2.305 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.552 17.722 -2.207 1.00 0.00 H new ATOM 0 HE2 LYS A 134 5.814 19.572 -4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.876 20.005 -3.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 8.149 19.306 -5.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 8.359 18.179 -3.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 7.341 17.813 -5.146 1.00 0.00 H new ATOM 1539 N LYS A 135 8.235 14.283 -5.850 1.00 0.00 N ATOM 1540 CA LYS A 135 9.327 13.322 -5.949 1.00 0.00 C ATOM 1541 C LYS A 135 10.178 13.333 -4.682 1.00 0.00 C ATOM 1542 O LYS A 135 11.071 14.165 -4.529 1.00 0.00 O ATOM 1543 CB LYS A 135 10.202 13.629 -7.167 1.00 0.00 C ATOM 1544 CG LYS A 135 9.411 13.965 -8.421 1.00 0.00 C ATOM 1545 CD LYS A 135 8.618 12.767 -8.918 1.00 0.00 C ATOM 1546 CE LYS A 135 9.533 11.639 -9.364 1.00 0.00 C ATOM 1547 NZ LYS A 135 9.701 10.606 -8.303 1.00 0.00 N ATOM 0 H LYS A 135 8.393 15.156 -6.353 1.00 0.00 H new ATOM 0 HA LYS A 135 8.892 12.330 -6.066 1.00 0.00 H new ATOM 0 HB2 LYS A 135 10.860 14.465 -6.929 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.840 12.769 -7.371 1.00 0.00 H new ATOM 0 HG2 LYS A 135 8.731 14.791 -8.213 1.00 0.00 H new ATOM 0 HG3 LYS A 135 10.092 14.301 -9.203 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.960 12.411 -8.125 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.981 13.070 -9.749 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.125 11.174 -10.262 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.508 12.047 -9.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 9.612 9.659 -8.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 10.641 10.705 -7.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 8.968 10.733 -7.576 1.00 0.00 H new ATOM 1561 N VAL A 136 9.891 12.404 -3.776 1.00 0.00 N ATOM 1562 CA VAL A 136 10.628 12.305 -2.518 1.00 0.00 C ATOM 1563 C VAL A 136 11.306 10.950 -2.377 1.00 0.00 C ATOM 1564 O VAL A 136 11.095 10.049 -3.190 1.00 0.00 O ATOM 1565 CB VAL A 136 9.715 12.529 -1.292 1.00 0.00 C ATOM 1566 CG1 VAL A 136 9.961 13.901 -0.693 1.00 0.00 C ATOM 1567 CG2 VAL A 136 8.246 12.357 -1.661 1.00 0.00 C ATOM 0 H VAL A 136 9.154 11.708 -3.888 1.00 0.00 H new ATOM 0 HA VAL A 136 11.382 13.092 -2.547 1.00 0.00 H new ATOM 0 HB VAL A 136 9.961 11.775 -0.544 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.310 14.043 0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 136 11.002 13.980 -0.379 1.00 0.00 H new ATOM 0 HG13 VAL A 136 9.748 14.667 -1.439 1.00 0.00 H new ATOM 0 HG21 VAL A 136 7.628 12.521 -0.778 1.00 0.00 H new ATOM 0 HG22 VAL A 136 7.977 13.080 -2.431 1.00 0.00 H new ATOM 0 HG23 VAL A 136 8.081 11.347 -2.037 1.00 0.00 H new ATOM 1577 N GLU A 137 12.119 10.810 -1.333 1.00 0.00 N ATOM 1578 CA GLU A 137 12.821 9.559 -1.082 1.00 0.00 C ATOM 1579 C GLU A 137 11.880 8.540 -0.467 1.00 0.00 C ATOM 1580 O GLU A 137 12.027 8.137 0.686 1.00 0.00 O ATOM 1581 CB GLU A 137 14.032 9.789 -0.177 1.00 0.00 C ATOM 1582 CG GLU A 137 15.163 10.548 -0.853 1.00 0.00 C ATOM 1583 CD GLU A 137 15.576 11.788 -0.083 1.00 0.00 C ATOM 1584 OE1 GLU A 137 14.722 12.675 0.118 1.00 0.00 O ATOM 1585 OE2 GLU A 137 16.757 11.871 0.318 1.00 0.00 O ATOM 0 H GLU A 137 12.306 11.545 -0.651 1.00 0.00 H new ATOM 0 HA GLU A 137 13.179 9.169 -2.035 1.00 0.00 H new ATOM 0 HB2 GLU A 137 13.714 10.340 0.708 1.00 0.00 H new ATOM 0 HB3 GLU A 137 14.407 8.825 0.166 1.00 0.00 H new ATOM 0 HG2 GLU A 137 16.024 9.889 -0.961 1.00 0.00 H new ATOM 0 HG3 GLU A 137 14.853 10.835 -1.858 1.00 0.00 H new ATOM 1592 N TYR A 138 10.909 8.142 -1.266 1.00 0.00 N ATOM 1593 CA TYR A 138 9.906 7.176 -0.863 1.00 0.00 C ATOM 1594 C TYR A 138 10.529 5.851 -0.422 1.00 0.00 C ATOM 1595 O TYR A 138 9.908 5.085 0.314 1.00 0.00 O ATOM 1596 CB TYR A 138 8.966 6.950 -2.036 1.00 0.00 C ATOM 1597 CG TYR A 138 7.925 8.036 -2.188 1.00 0.00 C ATOM 1598 CD1 TYR A 138 7.092 8.382 -1.130 1.00 0.00 C ATOM 1599 CD2 TYR A 138 7.780 8.720 -3.387 1.00 0.00 C ATOM 1600 CE1 TYR A 138 6.144 9.379 -1.266 1.00 0.00 C ATOM 1601 CE2 TYR A 138 6.834 9.717 -3.530 1.00 0.00 C ATOM 1602 CZ TYR A 138 6.020 10.043 -2.467 1.00 0.00 C ATOM 1603 OH TYR A 138 5.077 11.037 -2.605 1.00 0.00 O ATOM 0 H TYR A 138 10.793 8.483 -2.220 1.00 0.00 H new ATOM 0 HA TYR A 138 9.363 7.570 -0.004 1.00 0.00 H new ATOM 0 HB2 TYR A 138 9.551 6.886 -2.954 1.00 0.00 H new ATOM 0 HB3 TYR A 138 8.464 5.991 -1.910 1.00 0.00 H new ATOM 0 HD1 TYR A 138 7.187 7.864 -0.187 1.00 0.00 H new ATOM 0 HD2 TYR A 138 8.417 8.469 -4.222 1.00 0.00 H new ATOM 0 HE1 TYR A 138 5.504 9.636 -0.435 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.733 10.238 -4.470 1.00 0.00 H new ATOM 0 HH TYR A 138 5.416 11.728 -3.212 1.00 0.00 H new ATOM 1613 N THR A 139 11.750 5.578 -0.876 1.00 0.00 N ATOM 1614 CA THR A 139 12.428 4.333 -0.519 1.00 0.00 C ATOM 1615 C THR A 139 13.947 4.500 -0.464 1.00 0.00 C ATOM 1616 O THR A 139 14.679 3.515 -0.371 1.00 0.00 O ATOM 1617 CB THR A 139 12.071 3.226 -1.517 1.00 0.00 C ATOM 1618 OG1 THR A 139 12.914 3.285 -2.655 1.00 0.00 O ATOM 1619 CG2 THR A 139 10.640 3.291 -2.006 1.00 0.00 C ATOM 0 H THR A 139 12.286 6.195 -1.486 1.00 0.00 H new ATOM 0 HA THR A 139 12.084 4.056 0.478 1.00 0.00 H new ATOM 0 HB THR A 139 12.207 2.294 -0.969 1.00 0.00 H new ATOM 0 HG1 THR A 139 12.671 2.569 -3.279 1.00 0.00 H new ATOM 0 HG21 THR A 139 10.458 2.478 -2.709 1.00 0.00 H new ATOM 0 HG22 THR A 139 9.961 3.197 -1.158 1.00 0.00 H new ATOM 0 HG23 THR A 139 10.469 4.246 -2.504 1.00 0.00 H new ATOM 1627 N LYS A 140 14.423 5.741 -0.519 1.00 0.00 N ATOM 1628 CA LYS A 140 15.855 6.004 -0.469 1.00 0.00 C ATOM 1629 C LYS A 140 16.394 5.802 0.936 1.00 0.00 C ATOM 1630 O LYS A 140 15.948 6.442 1.889 1.00 0.00 O ATOM 1631 CB LYS A 140 16.156 7.422 -0.957 1.00 0.00 C ATOM 1632 CG LYS A 140 17.191 7.473 -2.067 1.00 0.00 C ATOM 1633 CD LYS A 140 18.526 6.906 -1.612 1.00 0.00 C ATOM 1634 CE LYS A 140 19.163 6.045 -2.691 1.00 0.00 C ATOM 1635 NZ LYS A 140 20.293 5.234 -2.159 1.00 0.00 N ATOM 0 H LYS A 140 13.841 6.575 -0.598 1.00 0.00 H new ATOM 0 HA LYS A 140 16.353 5.295 -1.130 1.00 0.00 H new ATOM 0 HB2 LYS A 140 15.232 7.880 -1.311 1.00 0.00 H new ATOM 0 HB3 LYS A 140 16.507 8.020 -0.116 1.00 0.00 H new ATOM 0 HG2 LYS A 140 16.830 6.910 -2.928 1.00 0.00 H new ATOM 0 HG3 LYS A 140 17.325 8.504 -2.394 1.00 0.00 H new ATOM 0 HD2 LYS A 140 19.200 7.723 -1.352 1.00 0.00 H new ATOM 0 HD3 LYS A 140 18.382 6.312 -0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 140 18.410 5.383 -3.118 1.00 0.00 H new ATOM 0 HE3 LYS A 140 19.522 6.682 -3.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 20.700 4.661 -2.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 21.023 5.867 -1.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 19.946 4.607 -1.405 1.00 0.00 H new ATOM 1649 N ASN A 141 17.357 4.900 1.051 1.00 0.00 N ATOM 1650 CA ASN A 141 17.975 4.588 2.330 1.00 0.00 C ATOM 1651 C ASN A 141 16.987 3.907 3.274 1.00 0.00 C ATOM 1652 O ASN A 141 17.228 3.817 4.478 1.00 0.00 O ATOM 1653 CB ASN A 141 18.522 5.857 2.983 1.00 0.00 C ATOM 1654 CG ASN A 141 19.413 6.652 2.049 1.00 0.00 C ATOM 1655 OD1 ASN A 141 19.155 7.823 1.772 1.00 0.00 O ATOM 1656 ND2 ASN A 141 20.471 6.017 1.557 1.00 0.00 N ATOM 0 H ASN A 141 17.730 4.367 0.265 1.00 0.00 H new ATOM 0 HA ASN A 141 18.797 3.899 2.139 1.00 0.00 H new ATOM 0 HB2 ASN A 141 17.690 6.483 3.307 1.00 0.00 H new ATOM 0 HB3 ASN A 141 19.085 5.588 3.876 1.00 0.00 H new ATOM 0 HD21 ASN A 141 21.107 6.501 0.923 1.00 0.00 H new ATOM 0 HD22 ASN A 141 20.647 5.046 1.813 1.00 0.00 H new ATOM 1663 N VAL A 142 15.874 3.432 2.725 1.00 0.00 N ATOM 1664 CA VAL A 142 14.853 2.763 3.521 1.00 0.00 C ATOM 1665 C VAL A 142 15.109 1.261 3.597 1.00 0.00 C ATOM 1666 O VAL A 142 14.834 0.626 4.615 1.00 0.00 O ATOM 1667 CB VAL A 142 13.445 3.006 2.946 1.00 0.00 C ATOM 1668 CG1 VAL A 142 12.381 2.424 3.867 1.00 0.00 C ATOM 1669 CG2 VAL A 142 13.209 4.492 2.723 1.00 0.00 C ATOM 0 H VAL A 142 15.656 3.498 1.731 1.00 0.00 H new ATOM 0 HA VAL A 142 14.906 3.187 4.524 1.00 0.00 H new ATOM 0 HB VAL A 142 13.375 2.500 1.983 1.00 0.00 H new ATOM 0 HG11 VAL A 142 11.394 2.606 3.443 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.538 1.351 3.972 1.00 0.00 H new ATOM 0 HG13 VAL A 142 12.448 2.898 4.846 1.00 0.00 H new ATOM 0 HG21 VAL A 142 12.209 4.645 2.316 1.00 0.00 H new ATOM 0 HG22 VAL A 142 13.300 5.021 3.672 1.00 0.00 H new ATOM 0 HG23 VAL A 142 13.949 4.877 2.021 1.00 0.00 H new ATOM 1679 N ASN A 143 15.636 0.696 2.514 1.00 0.00 N ATOM 1680 CA ASN A 143 15.928 -0.733 2.461 1.00 0.00 C ATOM 1681 C ASN A 143 14.638 -1.551 2.525 1.00 0.00 C ATOM 1682 O ASN A 143 13.974 -1.587 3.562 1.00 0.00 O ATOM 1683 CB ASN A 143 16.857 -1.132 3.612 1.00 0.00 C ATOM 1684 CG ASN A 143 18.292 -1.315 3.157 1.00 0.00 C ATOM 1685 OD1 ASN A 143 18.773 -0.604 2.275 1.00 0.00 O ATOM 1686 ND2 ASN A 143 18.985 -2.273 3.762 1.00 0.00 N ATOM 0 H ASN A 143 15.869 1.206 1.662 1.00 0.00 H new ATOM 0 HA ASN A 143 16.427 -0.942 1.515 1.00 0.00 H new ATOM 0 HB2 ASN A 143 16.819 -0.368 4.388 1.00 0.00 H new ATOM 0 HB3 ASN A 143 16.499 -2.059 4.060 1.00 0.00 H new ATOM 0 HD21 ASN A 143 19.956 -2.443 3.500 1.00 0.00 H new ATOM 0 HD22 ASN A 143 18.546 -2.839 4.488 1.00 0.00 H new ATOM 1693 N PRO A 144 14.255 -2.216 1.417 1.00 0.00 N ATOM 1694 CA PRO A 144 13.032 -3.028 1.361 1.00 0.00 C ATOM 1695 C PRO A 144 13.110 -4.281 2.234 1.00 0.00 C ATOM 1696 O PRO A 144 12.921 -5.397 1.751 1.00 0.00 O ATOM 1697 CB PRO A 144 12.917 -3.421 -0.123 1.00 0.00 C ATOM 1698 CG PRO A 144 13.878 -2.538 -0.847 1.00 0.00 C ATOM 1699 CD PRO A 144 14.970 -2.226 0.134 1.00 0.00 C ATOM 0 HA PRO A 144 12.173 -2.473 1.738 1.00 0.00 H new ATOM 0 HB2 PRO A 144 13.163 -4.473 -0.270 1.00 0.00 H new ATOM 0 HB3 PRO A 144 11.900 -3.277 -0.489 1.00 0.00 H new ATOM 0 HG2 PRO A 144 14.277 -3.037 -1.730 1.00 0.00 H new ATOM 0 HG3 PRO A 144 13.389 -1.626 -1.190 1.00 0.00 H new ATOM 0 HD2 PRO A 144 15.759 -2.978 0.115 1.00 0.00 H new ATOM 0 HD3 PRO A 144 15.441 -1.265 -0.075 1.00 0.00 H new ATOM 1707 N ASN A 145 13.381 -4.091 3.522 1.00 0.00 N ATOM 1708 CA ASN A 145 13.472 -5.208 4.457 1.00 0.00 C ATOM 1709 C ASN A 145 12.113 -5.512 5.089 1.00 0.00 C ATOM 1710 O ASN A 145 11.963 -6.501 5.806 1.00 0.00 O ATOM 1711 CB ASN A 145 14.498 -4.903 5.549 1.00 0.00 C ATOM 1712 CG ASN A 145 14.270 -3.552 6.199 1.00 0.00 C ATOM 1713 OD1 ASN A 145 13.153 -3.224 6.602 1.00 0.00 O ATOM 1714 ND2 ASN A 145 15.329 -2.760 6.306 1.00 0.00 N ATOM 0 H ASN A 145 13.541 -3.175 3.942 1.00 0.00 H new ATOM 0 HA ASN A 145 13.793 -6.087 3.898 1.00 0.00 H new ATOM 0 HB2 ASN A 145 14.455 -5.681 6.311 1.00 0.00 H new ATOM 0 HB3 ASN A 145 15.500 -4.932 5.120 1.00 0.00 H new ATOM 0 HD21 ASN A 145 15.236 -1.840 6.736 1.00 0.00 H new ATOM 0 HD22 ASN A 145 16.236 -3.072 5.959 1.00 0.00 H new ATOM 1721 N TRP A 146 11.131 -4.656 4.823 1.00 0.00 N ATOM 1722 CA TRP A 146 9.787 -4.835 5.373 1.00 0.00 C ATOM 1723 C TRP A 146 9.060 -5.995 4.699 1.00 0.00 C ATOM 1724 O TRP A 146 8.103 -6.540 5.251 1.00 0.00 O ATOM 1725 CB TRP A 146 8.961 -3.550 5.226 1.00 0.00 C ATOM 1726 CG TRP A 146 9.257 -2.772 3.977 1.00 0.00 C ATOM 1727 CD1 TRP A 146 10.141 -1.739 3.850 1.00 0.00 C ATOM 1728 CD2 TRP A 146 8.669 -2.960 2.685 1.00 0.00 C ATOM 1729 NE1 TRP A 146 10.140 -1.274 2.558 1.00 0.00 N ATOM 1730 CE2 TRP A 146 9.245 -2.006 1.823 1.00 0.00 C ATOM 1731 CE3 TRP A 146 7.713 -3.841 2.169 1.00 0.00 C ATOM 1732 CZ2 TRP A 146 8.895 -1.909 0.478 1.00 0.00 C ATOM 1733 CZ3 TRP A 146 7.368 -3.743 0.836 1.00 0.00 C ATOM 1734 CH2 TRP A 146 7.957 -2.784 0.004 1.00 0.00 C ATOM 0 H TRP A 146 11.238 -3.832 4.231 1.00 0.00 H new ATOM 0 HA TRP A 146 9.898 -5.066 6.432 1.00 0.00 H new ATOM 0 HB2 TRP A 146 7.902 -3.808 5.238 1.00 0.00 H new ATOM 0 HB3 TRP A 146 9.144 -2.912 6.091 1.00 0.00 H new ATOM 0 HD1 TRP A 146 10.752 -1.345 4.649 1.00 0.00 H new ATOM 0 HE1 TRP A 146 10.713 -0.508 2.203 1.00 0.00 H new ATOM 0 HE3 TRP A 146 7.253 -4.585 2.802 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 9.348 -1.170 -0.167 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 6.631 -4.418 0.428 1.00 0.00 H new ATOM 0 HH2 TRP A 146 7.665 -2.734 -1.034 1.00 0.00 H new ATOM 1745 N SER A 147 9.514 -6.372 3.508 1.00 0.00 N ATOM 1746 CA SER A 147 8.897 -7.469 2.768 1.00 0.00 C ATOM 1747 C SER A 147 9.479 -8.821 3.182 1.00 0.00 C ATOM 1748 O SER A 147 9.516 -9.758 2.386 1.00 0.00 O ATOM 1749 CB SER A 147 9.083 -7.263 1.264 1.00 0.00 C ATOM 1750 OG SER A 147 7.900 -7.589 0.554 1.00 0.00 O ATOM 0 H SER A 147 10.305 -5.936 3.035 1.00 0.00 H new ATOM 0 HA SER A 147 7.833 -7.471 3.005 1.00 0.00 H new ATOM 0 HB2 SER A 147 9.355 -6.226 1.067 1.00 0.00 H new ATOM 0 HB3 SER A 147 9.907 -7.882 0.908 1.00 0.00 H new ATOM 0 HG SER A 147 7.675 -8.531 0.707 1.00 0.00 H new