USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 829 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 526 ASN : amide:sc= -3.22! C(o=-3.6!,f=-4.8!) USER MOD Set 1.2: A 529 LYS NZ :NH3+ -156:sc= -0.36 (180deg=-1.26!) USER MOD Set 2.1: A 476 ASN : amide:sc= -11.8! C(o=-21!,f=-28!) USER MOD Set 2.2: A 480 GLN : amide:sc= -9.56! C(o=-21!,f=-19!) USER MOD Set 3.1: A 471 GLN : amide:sc= -0.484 X(o=-8.6,f=-8.7) USER MOD Set 3.2: A 474 MET CE :methyl 151:sc= -6.68! (180deg=-1.47) USER MOD Set 3.3: A 475 SER OG : rot 115:sc= -1.47 USER MOD Set 4.1: A 458 SER OG : rot -127:sc= 0.0987 USER MOD Set 4.2: A 494 SER OG : rot 70:sc= -1.25! USER MOD Set 4.3: A 498 GLN : amide:sc= -0.293 K(o=-1.4,f=-3.3) USER MOD Set 5.1: A 401 HIS : no HD1:sc= -8.07! C(o=-7.3!,f=-10!) USER MOD Set 5.2: A 426 THR OG1 : rot -8:sc= 0.78! USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -9.36! C(o=-9.4!,f=-13!) USER MOD Single : A 407 HIS : no HD1:sc= -1.67 X(o=-1.7,f=-1.7) USER MOD Single : A 415 LYS NZ :NH3+ -166:sc= -3.41! (180deg=-3.97!) USER MOD Single : A 443 GLN : amide:sc= -0.49 X(o=-0.49,f=0) USER MOD Single : A 448 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.081) USER MOD Single : A 449 SER OG : rot 153:sc= -3.65! USER MOD Single : A 457 THR OG1 : rot 175:sc= -1.23 USER MOD Single : A 459 ASN : amide:sc= -0.215 X(o=-0.21,f=0.013) USER MOD Single : A 462 CYS SG : rot 121:sc= -3.5! USER MOD Single : A 465 SER OG : rot 116:sc= -1.81! USER MOD Single : A 467 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 468 GLN : amide:sc= -6.04! C(o=-6!,f=-6.8!) USER MOD Single : A 470 ASN : amide:sc= 0.315 X(o=0.32,f=0) USER MOD Single : A 473 MET CE :methyl -164:sc= -8.95! (180deg=-10.4!) USER MOD Single : A 478 THR OG1 : rot 8:sc= 1.42 USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 485 CYS SG : rot -111:sc= 0.0363 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot -39:sc= 0.00249 USER MOD Single : A 503 THR OG1 : rot -150:sc= 0 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 180:sc= -0.0164 USER MOD Single : A 516 HIS : no HD1:sc= -3.95! C(o=-4!,f=-6.3!) USER MOD Single : A 517 SER OG : rot 180:sc= -0.44 USER MOD Single : A 518 GLN : amide:sc= -1.65 X(o=-1.7,f=-2) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 527 THR OG1 : rot -150:sc= 0 USER MOD Single : A 531 HIS : no HD1:sc= -0.199 X(o=-0.2,f=0) USER MOD ----------------------------------------------------------------- ATOM 125 N TYR A 395 3.681 9.687 2.906 1.00 73.12 N ATOM 126 CA TYR A 395 3.513 8.244 2.915 1.00 71.34 C ATOM 127 C TYR A 395 4.343 7.590 1.808 1.00 11.51 C ATOM 128 O TYR A 395 4.691 8.238 0.823 1.00 13.20 O ATOM 129 CB TYR A 395 2.029 7.991 2.642 1.00 12.12 C ATOM 130 CG TYR A 395 1.110 8.369 3.805 1.00 74.10 C ATOM 131 CD1 TYR A 395 1.315 7.821 5.054 1.00 20.32 C ATOM 132 CD2 TYR A 395 0.075 9.259 3.605 1.00 13.10 C ATOM 133 CE1 TYR A 395 0.450 8.176 6.148 1.00 5.50 C ATOM 134 CE2 TYR A 395 -0.792 9.615 4.698 1.00 61.11 C ATOM 135 CZ TYR A 395 -0.561 9.056 5.917 1.00 51.10 C ATOM 136 OH TYR A 395 -1.379 9.393 6.951 1.00 34.50 O ATOM 0 HA TYR A 395 3.840 7.824 3.866 1.00 71.34 H new ATOM 0 HB2 TYR A 395 1.731 8.556 1.758 1.00 12.12 H new ATOM 0 HB3 TYR A 395 1.888 6.936 2.409 1.00 12.12 H new ATOM 0 HD1 TYR A 395 2.126 7.125 5.211 1.00 20.32 H new ATOM 0 HD2 TYR A 395 -0.085 9.689 2.627 1.00 13.10 H new ATOM 0 HE1 TYR A 395 0.600 7.753 7.130 1.00 5.50 H new ATOM 0 HE2 TYR A 395 -1.607 10.309 4.554 1.00 61.11 H new ATOM 0 HH TYR A 395 -2.055 10.031 6.639 1.00 34.50 H new ATOM 145 N ASN A 396 4.633 6.313 2.007 1.00 31.03 N ATOM 146 CA ASN A 396 5.414 5.562 1.038 1.00 54.14 C ATOM 147 C ASN A 396 4.527 4.502 0.385 1.00 2.33 C ATOM 148 O ASN A 396 4.765 4.103 -0.754 1.00 11.12 O ATOM 149 CB ASN A 396 6.588 4.848 1.711 1.00 43.31 C ATOM 150 CG ASN A 396 6.367 4.733 3.220 1.00 40.14 C ATOM 151 OD1 ASN A 396 6.178 3.659 3.765 1.00 31.41 O ATOM 152 ND2 ASN A 396 6.403 5.897 3.863 1.00 55.22 N ATOM 0 H ASN A 396 4.341 5.779 2.825 1.00 31.03 H new ATOM 0 HA ASN A 396 5.796 6.264 0.297 1.00 54.14 H new ATOM 0 HB2 ASN A 396 6.709 3.854 1.281 1.00 43.31 H new ATOM 0 HB3 ASN A 396 7.511 5.394 1.516 1.00 43.31 H new ATOM 0 HD21 ASN A 396 6.268 5.926 4.874 1.00 55.22 H new ATOM 0 HD22 ASN A 396 6.566 6.761 3.345 1.00 55.22 H new ATOM 158 N PHE A 397 3.522 4.074 1.136 1.00 32.24 N ATOM 159 CA PHE A 397 2.597 3.066 0.644 1.00 53.13 C ATOM 160 C PHE A 397 1.437 2.862 1.621 1.00 71.14 C ATOM 161 O PHE A 397 1.644 2.818 2.833 1.00 50.22 O ATOM 162 CB PHE A 397 3.383 1.758 0.524 1.00 63.23 C ATOM 163 CG PHE A 397 3.759 1.134 1.868 1.00 25.41 C ATOM 164 CD1 PHE A 397 4.848 1.586 2.548 1.00 33.33 C ATOM 165 CD2 PHE A 397 3.006 0.126 2.386 1.00 64.34 C ATOM 166 CE1 PHE A 397 5.198 1.005 3.796 1.00 72.50 C ATOM 167 CE2 PHE A 397 3.356 -0.453 3.634 1.00 25.52 C ATOM 168 CZ PHE A 397 4.445 -0.001 4.313 1.00 32.44 C ATOM 0 H PHE A 397 3.328 4.406 2.081 1.00 32.24 H new ATOM 0 HA PHE A 397 2.180 3.380 -0.313 1.00 53.13 H new ATOM 0 HB2 PHE A 397 2.791 1.041 -0.045 1.00 63.23 H new ATOM 0 HB3 PHE A 397 4.293 1.944 -0.046 1.00 63.23 H new ATOM 0 HD1 PHE A 397 5.446 2.387 2.139 1.00 33.33 H new ATOM 0 HD2 PHE A 397 2.142 -0.234 1.847 1.00 64.34 H new ATOM 0 HE1 PHE A 397 6.063 1.363 4.334 1.00 72.50 H new ATOM 0 HE2 PHE A 397 2.758 -1.253 4.045 1.00 25.52 H new ATOM 0 HZ PHE A 397 4.711 -0.442 5.263 1.00 32.44 H new ATOM 177 N VAL A 398 0.244 2.745 1.059 1.00 35.52 N ATOM 178 CA VAL A 398 -0.947 2.547 1.865 1.00 15.41 C ATOM 179 C VAL A 398 -1.382 1.082 1.775 1.00 75.12 C ATOM 180 O VAL A 398 -1.690 0.588 0.691 1.00 31.01 O ATOM 181 CB VAL A 398 -2.042 3.523 1.427 1.00 43.42 C ATOM 182 CG1 VAL A 398 -2.918 2.910 0.332 1.00 22.50 C ATOM 183 CG2 VAL A 398 -2.888 3.967 2.622 1.00 14.15 C ATOM 0 H VAL A 398 0.077 2.784 0.054 1.00 35.52 H new ATOM 0 HA VAL A 398 -0.738 2.760 2.913 1.00 15.41 H new ATOM 0 HB VAL A 398 -1.558 4.407 1.012 1.00 43.42 H new ATOM 0 HG11 VAL A 398 -3.688 3.624 0.039 1.00 22.50 H new ATOM 0 HG12 VAL A 398 -2.301 2.666 -0.533 1.00 22.50 H new ATOM 0 HG13 VAL A 398 -3.390 2.003 0.709 1.00 22.50 H new ATOM 0 HG21 VAL A 398 -3.659 4.660 2.285 1.00 14.15 H new ATOM 0 HG22 VAL A 398 -3.358 3.096 3.079 1.00 14.15 H new ATOM 0 HG23 VAL A 398 -2.251 4.462 3.355 1.00 14.15 H new ATOM 193 N ILE A 399 -1.393 0.430 2.927 1.00 70.33 N ATOM 194 CA ILE A 399 -1.784 -0.968 2.993 1.00 4.13 C ATOM 195 C ILE A 399 -3.310 -1.068 2.967 1.00 63.35 C ATOM 196 O ILE A 399 -3.997 -0.296 3.636 1.00 4.12 O ATOM 197 CB ILE A 399 -1.143 -1.647 4.205 1.00 5.33 C ATOM 198 CG1 ILE A 399 0.384 -1.594 4.120 1.00 34.13 C ATOM 199 CG2 ILE A 399 -1.659 -3.079 4.367 1.00 21.33 C ATOM 200 CD1 ILE A 399 1.025 -2.408 5.245 1.00 3.43 C ATOM 0 H ILE A 399 -1.137 0.844 3.824 1.00 70.33 H new ATOM 0 HA ILE A 399 -1.414 -1.509 2.122 1.00 4.13 H new ATOM 0 HB ILE A 399 -1.434 -1.096 5.099 1.00 5.33 H new ATOM 0 HG12 ILE A 399 0.712 -1.980 3.155 1.00 34.13 H new ATOM 0 HG13 ILE A 399 0.719 -0.559 4.179 1.00 34.13 H new ATOM 0 HG21 ILE A 399 -1.188 -3.539 5.235 1.00 21.33 H new ATOM 0 HG22 ILE A 399 -2.740 -3.063 4.507 1.00 21.33 H new ATOM 0 HG23 ILE A 399 -1.417 -3.656 3.474 1.00 21.33 H new ATOM 0 HD11 ILE A 399 2.110 -2.353 5.161 1.00 3.43 H new ATOM 0 HD12 ILE A 399 0.715 -2.004 6.209 1.00 3.43 H new ATOM 0 HD13 ILE A 399 0.707 -3.448 5.168 1.00 3.43 H new ATOM 211 N LEU A 400 -3.797 -2.022 2.190 1.00 23.33 N ATOM 212 CA LEU A 400 -5.228 -2.233 2.069 1.00 13.32 C ATOM 213 C LEU A 400 -5.601 -3.568 2.720 1.00 54.32 C ATOM 214 O LEU A 400 -5.432 -4.625 2.115 1.00 31.34 O ATOM 215 CB LEU A 400 -5.665 -2.120 0.607 1.00 43.24 C ATOM 216 CG LEU A 400 -5.255 -0.835 -0.117 1.00 52.41 C ATOM 217 CD1 LEU A 400 -6.104 -0.618 -1.372 1.00 22.44 C ATOM 218 CD2 LEU A 400 -5.311 0.368 0.826 1.00 23.20 C ATOM 0 H LEU A 400 -3.224 -2.659 1.636 1.00 23.33 H new ATOM 0 HA LEU A 400 -5.773 -1.454 2.602 1.00 13.32 H new ATOM 0 HB2 LEU A 400 -5.256 -2.969 0.059 1.00 43.24 H new ATOM 0 HB3 LEU A 400 -6.751 -2.207 0.565 1.00 43.24 H new ATOM 0 HG LEU A 400 -4.220 -0.942 -0.442 1.00 52.41 H new ATOM 0 HD11 LEU A 400 -5.792 0.301 -1.868 1.00 22.44 H new ATOM 0 HD12 LEU A 400 -5.971 -1.460 -2.052 1.00 22.44 H new ATOM 0 HD13 LEU A 400 -7.155 -0.541 -1.092 1.00 22.44 H new ATOM 0 HD21 LEU A 400 -5.015 1.268 0.286 1.00 23.20 H new ATOM 0 HD22 LEU A 400 -6.327 0.488 1.202 1.00 23.20 H new ATOM 0 HD23 LEU A 400 -4.631 0.207 1.662 1.00 23.20 H new ATOM 229 N HIS A 401 -6.101 -3.474 3.943 1.00 33.20 N ATOM 230 CA HIS A 401 -6.498 -4.660 4.681 1.00 64.12 C ATOM 231 C HIS A 401 -7.778 -4.370 5.468 1.00 61.32 C ATOM 232 O HIS A 401 -8.195 -3.219 5.579 1.00 31.11 O ATOM 233 CB HIS A 401 -5.355 -5.154 5.571 1.00 51.04 C ATOM 234 CG HIS A 401 -5.185 -4.366 6.849 1.00 14.13 C ATOM 235 ND1 HIS A 401 -5.849 -4.686 8.020 1.00 10.14 N ATOM 236 CD2 HIS A 401 -4.424 -3.271 7.125 1.00 65.42 C ATOM 237 CE1 HIS A 401 -5.494 -3.815 8.953 1.00 53.24 C ATOM 238 NE2 HIS A 401 -4.611 -2.938 8.396 1.00 43.31 N ATOM 0 H HIS A 401 -6.240 -2.595 4.441 1.00 33.20 H new ATOM 0 HA HIS A 401 -6.716 -5.470 3.985 1.00 64.12 H new ATOM 0 HB2 HIS A 401 -5.530 -6.200 5.822 1.00 51.04 H new ATOM 0 HB3 HIS A 401 -4.424 -5.114 5.005 1.00 51.04 H new ATOM 0 HD2 HIS A 401 -3.777 -2.760 6.427 1.00 65.42 H new ATOM 0 HE1 HIS A 401 -5.843 -3.802 9.975 1.00 53.24 H new ATOM 0 HE2 HIS A 401 -4.167 -2.155 8.877 1.00 43.31 H new ATOM 246 N ALA A 402 -8.366 -5.436 5.992 1.00 41.54 N ATOM 247 CA ALA A 402 -9.590 -5.311 6.765 1.00 54.21 C ATOM 248 C ALA A 402 -9.270 -4.679 8.121 1.00 64.04 C ATOM 249 O ALA A 402 -8.236 -4.033 8.281 1.00 35.10 O ATOM 250 CB ALA A 402 -10.251 -6.683 6.902 1.00 31.41 C ATOM 0 H ALA A 402 -8.017 -6.390 5.896 1.00 41.54 H new ATOM 0 HA ALA A 402 -10.299 -4.658 6.257 1.00 54.21 H new ATOM 0 HB1 ALA A 402 -11.169 -6.588 7.482 1.00 31.41 H new ATOM 0 HB2 ALA A 402 -10.486 -7.074 5.912 1.00 31.41 H new ATOM 0 HB3 ALA A 402 -9.570 -7.366 7.410 1.00 31.41 H new ATOM 256 N ARG A 403 -10.176 -4.889 9.064 1.00 2.50 N ATOM 257 CA ARG A 403 -10.004 -4.347 10.403 1.00 33.23 C ATOM 258 C ARG A 403 -9.455 -5.424 11.342 1.00 41.23 C ATOM 259 O ARG A 403 -9.043 -5.122 12.461 1.00 25.45 O ATOM 260 CB ARG A 403 -11.328 -3.821 10.958 1.00 34.11 C ATOM 261 CG ARG A 403 -11.148 -3.271 12.374 1.00 4.31 C ATOM 262 CD ARG A 403 -9.988 -2.275 12.432 1.00 30.10 C ATOM 263 NE ARG A 403 -10.236 -1.155 11.496 1.00 74.43 N ATOM 264 CZ ARG A 403 -10.937 -0.046 11.811 1.00 71.34 C ATOM 265 NH1 ARG A 403 -11.468 0.101 13.044 1.00 72.54 N ATOM 266 NH2 ARG A 403 -11.096 0.892 10.896 1.00 43.41 N ATOM 0 H ARG A 403 -11.032 -5.427 8.929 1.00 2.50 H new ATOM 0 HA ARG A 403 -9.297 -3.520 10.340 1.00 33.23 H new ATOM 0 HB2 ARG A 403 -11.714 -3.038 10.306 1.00 34.11 H new ATOM 0 HB3 ARG A 403 -12.067 -4.622 10.966 1.00 34.11 H new ATOM 0 HG2 ARG A 403 -12.067 -2.783 12.698 1.00 4.31 H new ATOM 0 HG3 ARG A 403 -10.962 -4.092 13.066 1.00 4.31 H new ATOM 0 HD2 ARG A 403 -9.875 -1.894 13.447 1.00 30.10 H new ATOM 0 HD3 ARG A 403 -9.055 -2.776 12.174 1.00 30.10 H new ATOM 0 HE ARG A 403 -9.853 -1.226 10.553 1.00 74.43 H new ATOM 0 HH11 ARG A 403 -11.340 -0.629 13.745 1.00 72.54 H new ATOM 0 HH12 ARG A 403 -11.997 0.942 13.275 1.00 72.54 H new ATOM 0 HH21 ARG A 403 -10.692 0.772 9.967 1.00 43.41 H new ATOM 0 HH22 ARG A 403 -11.623 1.737 11.118 1.00 43.41 H new ATOM 276 N ALA A 404 -9.468 -6.653 10.853 1.00 2.33 N ATOM 277 CA ALA A 404 -8.977 -7.776 11.635 1.00 22.20 C ATOM 278 C ALA A 404 -7.629 -8.230 11.075 1.00 22.54 C ATOM 279 O ALA A 404 -7.171 -9.335 11.367 1.00 13.32 O ATOM 280 CB ALA A 404 -10.019 -8.896 11.631 1.00 25.01 C ATOM 0 H ALA A 404 -9.811 -6.898 9.924 1.00 2.33 H new ATOM 0 HA ALA A 404 -8.820 -7.482 12.673 1.00 22.20 H new ATOM 0 HB1 ALA A 404 -9.651 -9.738 12.217 1.00 25.01 H new ATOM 0 HB2 ALA A 404 -10.949 -8.530 12.066 1.00 25.01 H new ATOM 0 HB3 ALA A 404 -10.201 -9.220 10.606 1.00 25.01 H new ATOM 286 N ASP A 405 -7.028 -7.357 10.280 1.00 44.52 N ATOM 287 CA ASP A 405 -5.741 -7.655 9.676 1.00 4.35 C ATOM 288 C ASP A 405 -4.741 -6.559 10.046 1.00 32.13 C ATOM 289 O ASP A 405 -3.775 -6.325 9.323 1.00 70.15 O ATOM 290 CB ASP A 405 -5.846 -7.705 8.151 1.00 54.24 C ATOM 291 CG ASP A 405 -5.634 -9.088 7.532 1.00 0.32 C ATOM 292 OD1 ASP A 405 -4.783 -9.268 6.647 1.00 2.52 O ATOM 293 OD2 ASP A 405 -6.397 -10.018 7.999 1.00 42.11 O ATOM 0 H ASP A 405 -7.409 -6.442 10.040 1.00 44.52 H new ATOM 0 HA ASP A 405 -5.413 -8.626 10.047 1.00 4.35 H new ATOM 0 HB2 ASP A 405 -6.830 -7.340 7.858 1.00 54.24 H new ATOM 0 HB3 ASP A 405 -5.112 -7.018 7.729 1.00 54.24 H new ATOM 298 N GLU A 406 -5.009 -5.913 11.173 1.00 14.50 N ATOM 299 CA GLU A 406 -4.147 -4.846 11.646 1.00 62.34 C ATOM 300 C GLU A 406 -2.763 -5.397 11.997 1.00 2.35 C ATOM 301 O GLU A 406 -1.811 -5.226 11.237 1.00 10.42 O ATOM 302 CB GLU A 406 -4.770 -4.128 12.846 1.00 14.15 C ATOM 303 CG GLU A 406 -3.742 -3.240 13.548 1.00 53.23 C ATOM 304 CD GLU A 406 -4.387 -2.455 14.693 1.00 53.23 C ATOM 305 OE1 GLU A 406 -4.644 -3.021 15.765 1.00 13.52 O ATOM 306 OE2 GLU A 406 -4.620 -1.212 14.438 1.00 5.40 O ATOM 0 H GLU A 406 -5.812 -6.110 11.771 1.00 14.50 H new ATOM 0 HA GLU A 406 -4.034 -4.116 10.845 1.00 62.34 H new ATOM 0 HB2 GLU A 406 -5.613 -3.522 12.514 1.00 14.15 H new ATOM 0 HB3 GLU A 406 -5.163 -4.862 13.550 1.00 14.15 H new ATOM 0 HG2 GLU A 406 -2.930 -3.855 13.936 1.00 53.23 H new ATOM 0 HG3 GLU A 406 -3.303 -2.548 12.830 1.00 53.23 H new ATOM 312 N HIS A 407 -2.696 -6.049 13.149 1.00 35.23 N ATOM 313 CA HIS A 407 -1.444 -6.626 13.609 1.00 2.41 C ATOM 314 C HIS A 407 -0.679 -7.208 12.419 1.00 61.13 C ATOM 315 O HIS A 407 0.551 -7.200 12.405 1.00 53.11 O ATOM 316 CB HIS A 407 -1.696 -7.656 14.713 1.00 71.25 C ATOM 317 CG HIS A 407 -2.440 -8.886 14.249 1.00 55.43 C ATOM 318 ND1 HIS A 407 -3.587 -8.820 13.476 1.00 71.52 N ATOM 319 CD2 HIS A 407 -2.189 -10.210 14.453 1.00 33.11 C ATOM 320 CE1 HIS A 407 -4.000 -10.055 13.234 1.00 1.30 C ATOM 321 NE2 HIS A 407 -3.132 -10.916 13.841 1.00 51.31 N ATOM 0 H HIS A 407 -3.487 -6.190 13.777 1.00 35.23 H new ATOM 0 HA HIS A 407 -0.821 -5.849 14.051 1.00 2.41 H new ATOM 0 HB2 HIS A 407 -0.739 -7.961 15.136 1.00 71.25 H new ATOM 0 HB3 HIS A 407 -2.262 -7.182 15.515 1.00 71.25 H new ATOM 0 HD2 HIS A 407 -1.363 -10.616 15.017 1.00 33.11 H new ATOM 0 HE1 HIS A 407 -4.870 -10.332 12.658 1.00 1.30 H new ATOM 0 HE2 HIS A 407 -3.197 -11.934 13.827 1.00 51.31 H new ATOM 328 N ILE A 408 -1.438 -7.697 11.450 1.00 43.42 N ATOM 329 CA ILE A 408 -0.847 -8.281 10.258 1.00 62.12 C ATOM 330 C ILE A 408 -0.057 -7.207 9.509 1.00 71.22 C ATOM 331 O ILE A 408 1.141 -7.364 9.271 1.00 41.42 O ATOM 332 CB ILE A 408 -1.920 -8.962 9.407 1.00 75.31 C ATOM 333 CG1 ILE A 408 -2.403 -10.256 10.065 1.00 53.24 C ATOM 334 CG2 ILE A 408 -1.419 -9.197 7.981 1.00 33.21 C ATOM 335 CD1 ILE A 408 -3.450 -10.955 9.197 1.00 22.41 C ATOM 0 H ILE A 408 -2.458 -7.701 11.466 1.00 43.42 H new ATOM 0 HA ILE A 408 -0.141 -9.067 10.527 1.00 62.12 H new ATOM 0 HB ILE A 408 -2.779 -8.295 9.342 1.00 75.31 H new ATOM 0 HG12 ILE A 408 -1.557 -10.923 10.228 1.00 53.24 H new ATOM 0 HG13 ILE A 408 -2.827 -10.034 11.044 1.00 53.24 H new ATOM 0 HG21 ILE A 408 -2.200 -9.682 7.396 1.00 33.21 H new ATOM 0 HG22 ILE A 408 -1.164 -8.241 7.523 1.00 33.21 H new ATOM 0 HG23 ILE A 408 -0.536 -9.835 8.006 1.00 33.21 H new ATOM 0 HD11 ILE A 408 -3.776 -11.872 9.688 1.00 22.41 H new ATOM 0 HD12 ILE A 408 -4.306 -10.295 9.056 1.00 22.41 H new ATOM 0 HD13 ILE A 408 -3.015 -11.198 8.227 1.00 22.41 H new ATOM 346 N ALA A 409 -0.757 -6.140 9.156 1.00 54.33 N ATOM 347 CA ALA A 409 -0.135 -5.040 8.437 1.00 2.32 C ATOM 348 C ALA A 409 0.954 -4.416 9.313 1.00 22.41 C ATOM 349 O ALA A 409 2.084 -4.229 8.863 1.00 41.13 O ATOM 350 CB ALA A 409 -1.206 -4.026 8.029 1.00 61.10 C ATOM 0 H ALA A 409 -1.749 -6.013 9.354 1.00 54.33 H new ATOM 0 HA ALA A 409 0.340 -5.398 7.524 1.00 2.32 H new ATOM 0 HB1 ALA A 409 -0.740 -3.201 7.490 1.00 61.10 H new ATOM 0 HB2 ALA A 409 -1.940 -4.511 7.386 1.00 61.10 H new ATOM 0 HB3 ALA A 409 -1.702 -3.642 8.920 1.00 61.10 H new ATOM 356 N LEU A 410 0.575 -4.110 10.545 1.00 32.44 N ATOM 357 CA LEU A 410 1.507 -3.512 11.486 1.00 42.54 C ATOM 358 C LEU A 410 2.806 -4.318 11.496 1.00 31.34 C ATOM 359 O LEU A 410 3.879 -3.771 11.745 1.00 33.51 O ATOM 360 CB LEU A 410 0.859 -3.373 12.866 1.00 14.24 C ATOM 361 CG LEU A 410 -0.438 -2.563 12.919 1.00 65.50 C ATOM 362 CD1 LEU A 410 -0.583 -1.851 14.266 1.00 50.00 C ATOM 363 CD2 LEU A 410 -0.525 -1.588 11.743 1.00 23.25 C ATOM 0 H LEU A 410 -0.364 -4.265 10.913 1.00 32.44 H new ATOM 0 HA LEU A 410 1.764 -2.499 11.175 1.00 42.54 H new ATOM 0 HB2 LEU A 410 0.656 -4.372 13.253 1.00 14.24 H new ATOM 0 HB3 LEU A 410 1.581 -2.911 13.540 1.00 14.24 H new ATOM 0 HG LEU A 410 -1.276 -3.253 12.826 1.00 65.50 H new ATOM 0 HD11 LEU A 410 -1.513 -1.282 14.279 1.00 50.00 H new ATOM 0 HD12 LEU A 410 -0.598 -2.589 15.068 1.00 50.00 H new ATOM 0 HD13 LEU A 410 0.259 -1.174 14.412 1.00 50.00 H new ATOM 0 HD21 LEU A 410 -1.456 -1.025 11.805 1.00 23.25 H new ATOM 0 HD22 LEU A 410 0.319 -0.899 11.779 1.00 23.25 H new ATOM 0 HD23 LEU A 410 -0.499 -2.145 10.806 1.00 23.25 H new ATOM 374 N ARG A 411 2.668 -5.607 11.222 1.00 3.32 N ATOM 375 CA ARG A 411 3.817 -6.495 11.195 1.00 73.03 C ATOM 376 C ARG A 411 4.606 -6.302 9.899 1.00 35.51 C ATOM 377 O ARG A 411 5.826 -6.464 9.881 1.00 70.44 O ATOM 378 CB ARG A 411 3.386 -7.959 11.308 1.00 42.03 C ATOM 379 CG ARG A 411 4.570 -8.852 11.685 1.00 12.04 C ATOM 380 CD ARG A 411 4.526 -10.173 10.914 1.00 34.34 C ATOM 381 NE ARG A 411 3.540 -11.088 11.533 1.00 64.13 N ATOM 382 CZ ARG A 411 3.785 -11.833 12.631 1.00 43.14 C ATOM 383 NH1 ARG A 411 4.988 -11.779 13.242 1.00 53.01 N ATOM 384 NH2 ARG A 411 2.831 -12.616 13.100 1.00 72.20 N ATOM 0 H ARG A 411 1.776 -6.058 11.017 1.00 3.32 H new ATOM 0 HA ARG A 411 4.447 -6.247 12.049 1.00 73.03 H new ATOM 0 HB2 ARG A 411 2.601 -8.054 12.058 1.00 42.03 H new ATOM 0 HB3 ARG A 411 2.963 -8.291 10.360 1.00 42.03 H new ATOM 0 HG2 ARG A 411 5.504 -8.333 11.472 1.00 12.04 H new ATOM 0 HG3 ARG A 411 4.554 -9.051 12.757 1.00 12.04 H new ATOM 0 HD2 ARG A 411 4.259 -9.988 9.874 1.00 34.34 H new ATOM 0 HD3 ARG A 411 5.513 -10.636 10.912 1.00 34.34 H new ATOM 0 HE ARG A 411 2.618 -11.160 11.103 1.00 64.13 H new ATOM 0 HH11 ARG A 411 5.720 -11.172 12.874 1.00 53.01 H new ATOM 0 HH12 ARG A 411 5.165 -12.346 14.072 1.00 53.01 H new ATOM 0 HH21 ARG A 411 1.925 -12.651 12.633 1.00 72.20 H new ATOM 0 HH22 ARG A 411 3.000 -13.186 13.929 1.00 72.20 H new ATOM 394 N VAL A 412 3.879 -5.960 8.846 1.00 23.41 N ATOM 395 CA VAL A 412 4.497 -5.743 7.549 1.00 33.32 C ATOM 396 C VAL A 412 5.254 -4.415 7.564 1.00 41.44 C ATOM 397 O VAL A 412 6.437 -4.365 7.231 1.00 24.50 O ATOM 398 CB VAL A 412 3.437 -5.815 6.446 1.00 63.41 C ATOM 399 CG1 VAL A 412 3.873 -5.020 5.215 1.00 54.11 C ATOM 400 CG2 VAL A 412 3.125 -7.267 6.079 1.00 62.22 C ATOM 0 H VAL A 412 2.868 -5.828 8.864 1.00 23.41 H new ATOM 0 HA VAL A 412 5.223 -6.528 7.336 1.00 33.32 H new ATOM 0 HB VAL A 412 2.522 -5.363 6.830 1.00 63.41 H new ATOM 0 HG11 VAL A 412 3.103 -5.087 4.447 1.00 54.11 H new ATOM 0 HG12 VAL A 412 4.021 -3.976 5.490 1.00 54.11 H new ATOM 0 HG13 VAL A 412 4.807 -5.429 4.829 1.00 54.11 H new ATOM 0 HG21 VAL A 412 2.369 -7.289 5.294 1.00 62.22 H new ATOM 0 HG22 VAL A 412 4.032 -7.756 5.724 1.00 62.22 H new ATOM 0 HG23 VAL A 412 2.751 -7.792 6.958 1.00 62.22 H new ATOM 410 N ARG A 413 4.541 -3.368 7.953 1.00 61.15 N ATOM 411 CA ARG A 413 5.131 -2.042 8.016 1.00 44.55 C ATOM 412 C ARG A 413 6.572 -2.125 8.522 1.00 3.20 C ATOM 413 O ARG A 413 7.488 -1.604 7.888 1.00 21.42 O ATOM 414 CB ARG A 413 4.326 -1.124 8.940 1.00 1.15 C ATOM 415 CG ARG A 413 2.824 -1.269 8.683 1.00 63.23 C ATOM 416 CD ARG A 413 2.078 0.012 9.059 1.00 54.33 C ATOM 417 NE ARG A 413 2.619 0.562 10.323 1.00 34.34 N ATOM 418 CZ ARG A 413 1.911 1.332 11.176 1.00 61.34 C ATOM 419 NH1 ARG A 413 0.627 1.652 10.908 1.00 25.42 N ATOM 420 NH2 ARG A 413 2.495 1.769 12.277 1.00 53.53 N ATOM 0 H ARG A 413 3.560 -3.411 8.228 1.00 61.15 H new ATOM 0 HA ARG A 413 5.119 -1.626 7.008 1.00 44.55 H new ATOM 0 HB2 ARG A 413 4.546 -1.365 9.980 1.00 1.15 H new ATOM 0 HB3 ARG A 413 4.627 -0.088 8.783 1.00 1.15 H new ATOM 0 HG2 ARG A 413 2.652 -1.499 7.632 1.00 63.23 H new ATOM 0 HG3 ARG A 413 2.432 -2.106 9.261 1.00 63.23 H new ATOM 0 HD2 ARG A 413 2.177 0.748 8.261 1.00 54.33 H new ATOM 0 HD3 ARG A 413 1.014 -0.196 9.170 1.00 54.33 H new ATOM 0 HE ARG A 413 3.586 0.346 10.564 1.00 34.34 H new ATOM 0 HH11 ARG A 413 0.184 1.311 10.055 1.00 25.42 H new ATOM 0 HH12 ARG A 413 0.100 2.234 11.559 1.00 25.42 H new ATOM 0 HH21 ARG A 413 3.466 1.524 12.471 1.00 53.53 H new ATOM 0 HH22 ARG A 413 1.975 2.352 12.933 1.00 53.53 H new ATOM 430 N GLU A 414 6.728 -2.784 9.661 1.00 51.01 N ATOM 431 CA GLU A 414 8.043 -2.943 10.260 1.00 44.53 C ATOM 432 C GLU A 414 8.929 -3.816 9.371 1.00 0.14 C ATOM 433 O GLU A 414 10.048 -3.432 9.034 1.00 3.32 O ATOM 434 CB GLU A 414 7.936 -3.527 11.671 1.00 72.20 C ATOM 435 CG GLU A 414 7.317 -2.515 12.637 1.00 23.21 C ATOM 436 CD GLU A 414 7.744 -2.803 14.078 1.00 71.34 C ATOM 437 OE1 GLU A 414 7.828 -3.973 14.478 1.00 65.43 O ATOM 438 OE2 GLU A 414 7.995 -1.756 14.791 1.00 23.43 O ATOM 0 H GLU A 414 5.966 -3.214 10.185 1.00 51.01 H new ATOM 0 HA GLU A 414 8.504 -1.959 10.344 1.00 44.53 H new ATOM 0 HB2 GLU A 414 7.329 -4.432 11.649 1.00 72.20 H new ATOM 0 HB3 GLU A 414 8.926 -3.815 12.025 1.00 72.20 H new ATOM 0 HG2 GLU A 414 7.622 -1.506 12.358 1.00 23.21 H new ATOM 0 HG3 GLU A 414 6.230 -2.552 12.561 1.00 23.21 H new ATOM 444 N LYS A 415 8.395 -4.976 9.015 1.00 32.31 N ATOM 445 CA LYS A 415 9.124 -5.908 8.170 1.00 22.40 C ATOM 446 C LYS A 415 9.705 -5.155 6.971 1.00 5.01 C ATOM 447 O LYS A 415 10.767 -5.514 6.465 1.00 15.22 O ATOM 448 CB LYS A 415 8.233 -7.089 7.782 1.00 51.13 C ATOM 449 CG LYS A 415 8.591 -8.337 8.592 1.00 44.04 C ATOM 450 CD LYS A 415 9.915 -8.939 8.114 1.00 11.50 C ATOM 451 CE LYS A 415 9.888 -9.190 6.605 1.00 32.12 C ATOM 452 NZ LYS A 415 8.527 -9.578 6.167 1.00 63.34 N ATOM 0 H LYS A 415 7.467 -5.292 9.296 1.00 32.31 H new ATOM 0 HA LYS A 415 9.965 -6.339 8.714 1.00 22.40 H new ATOM 0 HB2 LYS A 415 7.187 -6.830 7.949 1.00 51.13 H new ATOM 0 HB3 LYS A 415 8.343 -7.298 6.718 1.00 51.13 H new ATOM 0 HG2 LYS A 415 8.664 -8.081 9.649 1.00 44.04 H new ATOM 0 HG3 LYS A 415 7.796 -9.077 8.498 1.00 44.04 H new ATOM 0 HD2 LYS A 415 10.735 -8.265 8.360 1.00 11.50 H new ATOM 0 HD3 LYS A 415 10.104 -9.875 8.639 1.00 11.50 H new ATOM 0 HE2 LYS A 415 10.204 -8.291 6.075 1.00 32.12 H new ATOM 0 HE3 LYS A 415 10.597 -9.977 6.349 1.00 32.12 H new ATOM 0 HZ1 LYS A 415 8.571 -9.970 5.205 1.00 63.34 H new ATOM 0 HZ2 LYS A 415 8.144 -10.295 6.816 1.00 63.34 H new ATOM 0 HZ3 LYS A 415 7.909 -8.741 6.172 1.00 63.34 H new ATOM 461 N LEU A 416 8.983 -4.127 6.552 1.00 51.11 N ATOM 462 CA LEU A 416 9.414 -3.321 5.422 1.00 0.15 C ATOM 463 C LEU A 416 10.593 -2.444 5.847 1.00 61.24 C ATOM 464 O LEU A 416 11.521 -2.227 5.070 1.00 54.43 O ATOM 465 CB LEU A 416 8.236 -2.533 4.847 1.00 11.41 C ATOM 466 CG LEU A 416 7.062 -3.365 4.326 1.00 55.33 C ATOM 467 CD1 LEU A 416 5.822 -2.493 4.120 1.00 53.32 C ATOM 468 CD2 LEU A 416 7.449 -4.121 3.054 1.00 13.24 C ATOM 0 H LEU A 416 8.102 -3.833 6.974 1.00 51.11 H new ATOM 0 HA LEU A 416 9.767 -3.958 4.611 1.00 0.15 H new ATOM 0 HB2 LEU A 416 7.864 -1.860 5.619 1.00 11.41 H new ATOM 0 HB3 LEU A 416 8.604 -1.911 4.032 1.00 11.41 H new ATOM 0 HG LEU A 416 6.810 -4.111 5.080 1.00 55.33 H new ATOM 0 HD11 LEU A 416 5.002 -3.108 3.749 1.00 53.32 H new ATOM 0 HD12 LEU A 416 5.535 -2.039 5.068 1.00 53.32 H new ATOM 0 HD13 LEU A 416 6.044 -1.710 3.395 1.00 53.32 H new ATOM 0 HD21 LEU A 416 6.597 -4.704 2.704 1.00 13.24 H new ATOM 0 HD22 LEU A 416 7.742 -3.409 2.283 1.00 13.24 H new ATOM 0 HD23 LEU A 416 8.283 -4.789 3.267 1.00 13.24 H new ATOM 479 N GLU A 417 10.517 -1.963 7.079 1.00 71.34 N ATOM 480 CA GLU A 417 11.566 -1.114 7.617 1.00 61.11 C ATOM 481 C GLU A 417 12.868 -1.905 7.761 1.00 1.01 C ATOM 482 O GLU A 417 13.918 -1.333 8.049 1.00 62.52 O ATOM 483 CB GLU A 417 11.145 -0.502 8.955 1.00 75.42 C ATOM 484 CG GLU A 417 9.817 0.244 8.822 1.00 11.21 C ATOM 485 CD GLU A 417 9.857 1.573 9.580 1.00 74.02 C ATOM 486 OE1 GLU A 417 9.148 1.736 10.584 1.00 13.52 O ATOM 487 OE2 GLU A 417 10.661 2.456 9.092 1.00 31.33 O ATOM 0 H GLU A 417 9.745 -2.145 7.720 1.00 71.34 H new ATOM 0 HA GLU A 417 11.737 -0.295 6.919 1.00 61.11 H new ATOM 0 HB2 GLU A 417 11.052 -1.287 9.705 1.00 75.42 H new ATOM 0 HB3 GLU A 417 11.918 0.183 9.305 1.00 75.42 H new ATOM 0 HG2 GLU A 417 9.603 0.428 7.769 1.00 11.21 H new ATOM 0 HG3 GLU A 417 9.008 -0.375 9.209 1.00 11.21 H new ATOM 493 N ALA A 418 12.757 -3.209 7.555 1.00 22.20 N ATOM 494 CA ALA A 418 13.911 -4.086 7.659 1.00 64.33 C ATOM 495 C ALA A 418 14.504 -4.308 6.266 1.00 42.50 C ATOM 496 O ALA A 418 15.521 -4.985 6.121 1.00 5.03 O ATOM 497 CB ALA A 418 13.499 -5.395 8.334 1.00 65.31 C ATOM 0 H ALA A 418 11.884 -3.680 7.316 1.00 22.20 H new ATOM 0 HA ALA A 418 14.685 -3.631 8.278 1.00 64.33 H new ATOM 0 HB1 ALA A 418 14.365 -6.053 8.412 1.00 65.31 H new ATOM 0 HB2 ALA A 418 13.113 -5.184 9.331 1.00 65.31 H new ATOM 0 HB3 ALA A 418 12.725 -5.883 7.741 1.00 65.31 H new ATOM 503 N LEU A 419 13.842 -3.725 5.276 1.00 51.14 N ATOM 504 CA LEU A 419 14.291 -3.852 3.900 1.00 62.14 C ATOM 505 C LEU A 419 14.637 -2.466 3.352 1.00 22.31 C ATOM 506 O LEU A 419 15.664 -2.293 2.698 1.00 51.34 O ATOM 507 CB LEU A 419 13.251 -4.602 3.065 1.00 22.33 C ATOM 508 CG LEU A 419 12.609 -5.822 3.730 1.00 64.53 C ATOM 509 CD1 LEU A 419 11.203 -6.069 3.180 1.00 22.22 C ATOM 510 CD2 LEU A 419 13.504 -7.055 3.591 1.00 64.13 C ATOM 0 H LEU A 419 12.999 -3.164 5.400 1.00 51.14 H new ATOM 0 HA LEU A 419 15.200 -4.452 3.849 1.00 62.14 H new ATOM 0 HB2 LEU A 419 12.460 -3.903 2.793 1.00 22.33 H new ATOM 0 HB3 LEU A 419 13.723 -4.925 2.137 1.00 22.33 H new ATOM 0 HG LEU A 419 12.506 -5.617 4.796 1.00 64.53 H new ATOM 0 HD11 LEU A 419 10.769 -6.941 3.669 1.00 22.22 H new ATOM 0 HD12 LEU A 419 10.578 -5.197 3.373 1.00 22.22 H new ATOM 0 HD13 LEU A 419 11.258 -6.245 2.106 1.00 22.22 H new ATOM 0 HD21 LEU A 419 13.025 -7.908 4.072 1.00 64.13 H new ATOM 0 HD22 LEU A 419 13.660 -7.274 2.535 1.00 64.13 H new ATOM 0 HD23 LEU A 419 14.465 -6.862 4.067 1.00 64.13 H new ATOM 521 N GLY A 420 13.759 -1.516 3.639 1.00 34.21 N ATOM 522 CA GLY A 420 13.960 -0.151 3.182 1.00 54.54 C ATOM 523 C GLY A 420 12.762 0.731 3.545 1.00 10.25 C ATOM 524 O GLY A 420 12.839 1.538 4.469 1.00 42.01 O ATOM 0 H GLY A 420 12.908 -1.664 4.181 1.00 34.21 H new ATOM 0 HA2 GLY A 420 14.866 0.257 3.631 1.00 54.54 H new ATOM 0 HA3 GLY A 420 14.108 -0.143 2.102 1.00 54.54 H new ATOM 528 N VAL A 421 11.683 0.543 2.798 1.00 43.14 N ATOM 529 CA VAL A 421 10.471 1.310 3.030 1.00 63.32 C ATOM 530 C VAL A 421 10.156 1.319 4.528 1.00 71.11 C ATOM 531 O VAL A 421 10.321 0.306 5.206 1.00 64.44 O ATOM 532 CB VAL A 421 9.328 0.750 2.183 1.00 54.42 C ATOM 533 CG1 VAL A 421 9.403 -0.775 2.098 1.00 30.41 C ATOM 534 CG2 VAL A 421 7.970 1.204 2.725 1.00 72.20 C ATOM 0 H VAL A 421 11.623 -0.129 2.033 1.00 43.14 H new ATOM 0 HA VAL A 421 10.610 2.346 2.721 1.00 63.32 H new ATOM 0 HB VAL A 421 9.435 1.146 1.173 1.00 54.42 H new ATOM 0 HG11 VAL A 421 8.578 -1.147 1.490 1.00 30.41 H new ATOM 0 HG12 VAL A 421 10.350 -1.068 1.644 1.00 30.41 H new ATOM 0 HG13 VAL A 421 9.335 -1.199 3.100 1.00 30.41 H new ATOM 0 HG21 VAL A 421 7.174 0.792 2.104 1.00 72.20 H new ATOM 0 HG22 VAL A 421 7.851 0.851 3.749 1.00 72.20 H new ATOM 0 HG23 VAL A 421 7.917 2.293 2.708 1.00 72.20 H new ATOM 544 N PRO A 422 9.696 2.504 5.012 1.00 23.33 N ATOM 545 CA PRO A 422 9.357 2.658 6.416 1.00 44.11 C ATOM 546 C PRO A 422 8.029 1.972 6.738 1.00 2.44 C ATOM 547 O PRO A 422 7.543 1.154 5.957 1.00 54.30 O ATOM 548 CB PRO A 422 9.323 4.160 6.651 1.00 12.24 C ATOM 549 CG PRO A 422 9.185 4.792 5.275 1.00 5.21 C ATOM 550 CD PRO A 422 9.490 3.724 4.238 1.00 14.40 C ATOM 0 HA PRO A 422 10.080 2.182 7.078 1.00 44.11 H new ATOM 0 HB2 PRO A 422 8.487 4.436 7.294 1.00 12.24 H new ATOM 0 HB3 PRO A 422 10.232 4.499 7.147 1.00 12.24 H new ATOM 0 HG2 PRO A 422 8.178 5.184 5.134 1.00 5.21 H new ATOM 0 HG3 PRO A 422 9.871 5.632 5.171 1.00 5.21 H new ATOM 0 HD2 PRO A 422 8.667 3.611 3.532 1.00 14.40 H new ATOM 0 HD3 PRO A 422 10.376 3.978 3.656 1.00 14.40 H new ATOM 555 N ASP A 423 7.477 2.329 7.888 1.00 64.21 N ATOM 556 CA ASP A 423 6.213 1.758 8.323 1.00 33.32 C ATOM 557 C ASP A 423 5.162 1.968 7.231 1.00 32.21 C ATOM 558 O ASP A 423 4.419 1.047 6.894 1.00 52.22 O ATOM 559 CB ASP A 423 5.711 2.437 9.598 1.00 10.51 C ATOM 560 CG ASP A 423 5.838 3.962 9.612 1.00 3.21 C ATOM 561 OD1 ASP A 423 6.371 4.567 8.670 1.00 72.24 O ATOM 562 OD2 ASP A 423 5.354 4.539 10.659 1.00 51.40 O ATOM 0 H ASP A 423 7.882 3.007 8.533 1.00 64.21 H new ATOM 0 HA ASP A 423 6.372 0.697 8.518 1.00 33.32 H new ATOM 0 HB2 ASP A 423 4.663 2.173 9.744 1.00 10.51 H new ATOM 0 HB3 ASP A 423 6.262 2.034 10.448 1.00 10.51 H new ATOM 567 N GLY A 424 5.134 3.185 6.707 1.00 11.35 N ATOM 568 CA GLY A 424 4.186 3.527 5.661 1.00 53.11 C ATOM 569 C GLY A 424 2.821 3.885 6.252 1.00 1.43 C ATOM 570 O GLY A 424 2.598 5.021 6.668 1.00 24.40 O ATOM 0 H GLY A 424 5.753 3.946 6.988 1.00 11.35 H new ATOM 0 HA2 GLY A 424 4.567 4.368 5.081 1.00 53.11 H new ATOM 0 HA3 GLY A 424 4.080 2.688 4.973 1.00 53.11 H new ATOM 574 N ALA A 425 1.942 2.893 6.270 1.00 22.10 N ATOM 575 CA ALA A 425 0.605 3.089 6.803 1.00 3.42 C ATOM 576 C ALA A 425 -0.304 1.955 6.321 1.00 64.14 C ATOM 577 O ALA A 425 0.139 1.067 5.595 1.00 62.11 O ATOM 578 CB ALA A 425 0.086 4.466 6.390 1.00 53.33 C ATOM 0 H ALA A 425 2.130 1.952 5.924 1.00 22.10 H new ATOM 0 HA ALA A 425 0.620 3.060 7.893 1.00 3.42 H new ATOM 0 HB1 ALA A 425 -0.917 4.612 6.790 1.00 53.33 H new ATOM 0 HB2 ALA A 425 0.749 5.237 6.782 1.00 53.33 H new ATOM 0 HB3 ALA A 425 0.056 4.532 5.302 1.00 53.33 H new ATOM 584 N THR A 426 -1.557 2.022 6.744 1.00 61.12 N ATOM 585 CA THR A 426 -2.530 1.013 6.366 1.00 53.01 C ATOM 586 C THR A 426 -3.939 1.612 6.344 1.00 34.22 C ATOM 587 O THR A 426 -4.496 1.933 7.392 1.00 50.23 O ATOM 588 CB THR A 426 -2.387 -0.167 7.327 1.00 61.12 C ATOM 589 OG1 THR A 426 -3.082 0.251 8.497 1.00 41.42 O ATOM 590 CG2 THR A 426 -0.945 -0.364 7.802 1.00 34.33 C ATOM 0 H THR A 426 -1.921 2.761 7.346 1.00 61.12 H new ATOM 0 HA THR A 426 -2.349 0.650 5.354 1.00 53.01 H new ATOM 0 HB THR A 426 -2.737 -1.076 6.838 1.00 61.12 H new ATOM 0 HG1 THR A 426 -3.337 1.193 8.407 1.00 41.42 H new ATOM 0 HG21 THR A 426 -0.899 -1.215 8.482 1.00 34.33 H new ATOM 0 HG22 THR A 426 -0.301 -0.551 6.943 1.00 34.33 H new ATOM 0 HG23 THR A 426 -0.607 0.533 8.320 1.00 34.33 H new ATOM 598 N PHE A 427 -4.472 1.744 5.138 1.00 61.11 N ATOM 599 CA PHE A 427 -5.804 2.297 4.966 1.00 43.41 C ATOM 600 C PHE A 427 -6.837 1.189 4.759 1.00 30.10 C ATOM 601 O PHE A 427 -6.645 0.305 3.927 1.00 33.32 O ATOM 602 CB PHE A 427 -5.764 3.181 3.717 1.00 20.50 C ATOM 603 CG PHE A 427 -7.131 3.398 3.065 1.00 33.41 C ATOM 604 CD1 PHE A 427 -8.193 3.782 3.823 1.00 71.32 C ATOM 605 CD2 PHE A 427 -7.283 3.209 1.726 1.00 52.43 C ATOM 606 CE1 PHE A 427 -9.461 3.983 3.217 1.00 52.12 C ATOM 607 CE2 PHE A 427 -8.551 3.411 1.121 1.00 72.23 C ATOM 608 CZ PHE A 427 -9.613 3.795 1.879 1.00 31.14 C ATOM 0 H PHE A 427 -4.005 1.477 4.271 1.00 61.11 H new ATOM 0 HA PHE A 427 -6.089 2.860 5.855 1.00 43.41 H new ATOM 0 HB2 PHE A 427 -5.342 4.150 3.983 1.00 20.50 H new ATOM 0 HB3 PHE A 427 -5.092 2.730 2.987 1.00 20.50 H new ATOM 0 HD1 PHE A 427 -8.072 3.934 4.885 1.00 71.32 H new ATOM 0 HD2 PHE A 427 -6.439 2.905 1.124 1.00 52.43 H new ATOM 0 HE1 PHE A 427 -10.305 4.285 3.819 1.00 52.12 H new ATOM 0 HE2 PHE A 427 -8.673 3.260 0.059 1.00 72.23 H new ATOM 0 HZ PHE A 427 -10.577 3.951 1.418 1.00 31.14 H new ATOM 823 N GLN A 443 -7.384 7.528 -3.086 1.00 15.31 N ATOM 824 CA GLN A 443 -6.468 7.894 -4.153 1.00 1.32 C ATOM 825 C GLN A 443 -5.429 8.894 -3.643 1.00 44.42 C ATOM 826 O GLN A 443 -4.500 9.250 -4.363 1.00 60.24 O ATOM 827 CB GLN A 443 -7.228 8.457 -5.358 1.00 65.53 C ATOM 828 CG GLN A 443 -7.872 9.802 -5.019 1.00 1.23 C ATOM 829 CD GLN A 443 -8.829 10.245 -6.127 1.00 42.33 C ATOM 830 OE1 GLN A 443 -9.998 10.515 -5.903 1.00 44.04 O ATOM 831 NE2 GLN A 443 -8.271 10.307 -7.332 1.00 22.40 N ATOM 0 HA GLN A 443 -5.946 6.995 -4.481 1.00 1.32 H new ATOM 0 HB2 GLN A 443 -6.545 8.578 -6.199 1.00 65.53 H new ATOM 0 HB3 GLN A 443 -7.997 7.750 -5.671 1.00 65.53 H new ATOM 0 HG2 GLN A 443 -8.413 9.723 -4.076 1.00 1.23 H new ATOM 0 HG3 GLN A 443 -7.097 10.556 -4.880 1.00 1.23 H new ATOM 0 HE21 GLN A 443 -7.287 10.068 -7.451 1.00 22.40 H new ATOM 0 HE22 GLN A 443 -8.827 10.594 -8.137 1.00 22.40 H new ATOM 838 N ASP A 444 -5.625 9.319 -2.402 1.00 0.05 N ATOM 839 CA ASP A 444 -4.717 10.272 -1.787 1.00 61.42 C ATOM 840 C ASP A 444 -3.409 9.564 -1.428 1.00 24.21 C ATOM 841 O ASP A 444 -2.457 10.200 -0.979 1.00 75.53 O ATOM 842 CB ASP A 444 -5.312 10.846 -0.500 1.00 45.14 C ATOM 843 CG ASP A 444 -4.956 12.308 -0.220 1.00 13.32 C ATOM 844 OD1 ASP A 444 -5.525 13.230 -0.823 1.00 15.33 O ATOM 845 OD2 ASP A 444 -4.042 12.486 0.670 1.00 70.54 O ATOM 0 H ASP A 444 -6.398 9.021 -1.807 1.00 0.05 H new ATOM 0 HA ASP A 444 -4.544 11.081 -2.497 1.00 61.42 H new ATOM 0 HB2 ASP A 444 -6.397 10.754 -0.546 1.00 45.14 H new ATOM 0 HB3 ASP A 444 -4.976 10.238 0.340 1.00 45.14 H new ATOM 850 N ALA A 445 -3.404 8.256 -1.638 1.00 22.13 N ATOM 851 CA ALA A 445 -2.228 7.454 -1.343 1.00 13.40 C ATOM 852 C ALA A 445 -1.502 7.122 -2.648 1.00 23.34 C ATOM 853 O ALA A 445 -0.279 6.986 -2.665 1.00 3.11 O ATOM 854 CB ALA A 445 -2.645 6.201 -0.571 1.00 1.44 C ATOM 0 H ALA A 445 -4.196 7.731 -2.009 1.00 22.13 H new ATOM 0 HA ALA A 445 -1.533 8.008 -0.712 1.00 13.40 H new ATOM 0 HB1 ALA A 445 -1.763 5.600 -0.350 1.00 1.44 H new ATOM 0 HB2 ALA A 445 -3.129 6.492 0.361 1.00 1.44 H new ATOM 0 HB3 ALA A 445 -3.341 5.617 -1.174 1.00 1.44 H new ATOM 860 N ILE A 446 -2.284 6.999 -3.709 1.00 10.41 N ATOM 861 CA ILE A 446 -1.732 6.684 -5.015 1.00 21.03 C ATOM 862 C ILE A 446 -0.985 7.905 -5.554 1.00 34.23 C ATOM 863 O ILE A 446 -0.156 7.782 -6.455 1.00 63.40 O ATOM 864 CB ILE A 446 -2.827 6.170 -5.950 1.00 53.20 C ATOM 865 CG1 ILE A 446 -2.300 5.045 -6.846 1.00 44.35 C ATOM 866 CG2 ILE A 446 -3.434 7.313 -6.766 1.00 74.23 C ATOM 867 CD1 ILE A 446 -3.424 4.081 -7.233 1.00 64.43 C ATOM 0 H ILE A 446 -3.298 7.112 -3.691 1.00 10.41 H new ATOM 0 HA ILE A 446 -1.007 5.874 -4.938 1.00 21.03 H new ATOM 0 HB ILE A 446 -3.626 5.750 -5.340 1.00 53.20 H new ATOM 0 HG12 ILE A 446 -1.855 5.470 -7.745 1.00 44.35 H new ATOM 0 HG13 ILE A 446 -1.512 4.500 -6.327 1.00 44.35 H new ATOM 0 HG21 ILE A 446 -4.210 6.919 -7.422 1.00 74.23 H new ATOM 0 HG22 ILE A 446 -3.869 8.050 -6.092 1.00 74.23 H new ATOM 0 HG23 ILE A 446 -2.656 7.785 -7.366 1.00 74.23 H new ATOM 0 HD11 ILE A 446 -3.023 3.292 -7.869 1.00 64.43 H new ATOM 0 HD12 ILE A 446 -3.851 3.640 -6.332 1.00 64.43 H new ATOM 0 HD13 ILE A 446 -4.199 4.624 -7.773 1.00 64.43 H new ATOM 878 N ASP A 447 -1.306 9.057 -4.983 1.00 23.13 N ATOM 879 CA ASP A 447 -0.676 10.299 -5.395 1.00 73.51 C ATOM 880 C ASP A 447 0.370 10.706 -4.354 1.00 0.04 C ATOM 881 O ASP A 447 1.505 11.029 -4.702 1.00 54.10 O ATOM 882 CB ASP A 447 -1.701 11.428 -5.502 1.00 13.35 C ATOM 883 CG ASP A 447 -2.132 12.039 -4.167 1.00 51.04 C ATOM 884 OD1 ASP A 447 -2.481 11.321 -3.218 1.00 12.24 O ATOM 885 OD2 ASP A 447 -2.097 13.328 -4.120 1.00 22.11 O ATOM 0 H ASP A 447 -1.995 9.156 -4.238 1.00 23.13 H new ATOM 0 HA ASP A 447 -0.217 10.136 -6.370 1.00 73.51 H new ATOM 0 HB2 ASP A 447 -1.286 12.217 -6.128 1.00 13.35 H new ATOM 0 HB3 ASP A 447 -2.586 11.048 -6.013 1.00 13.35 H new ATOM 890 N HIS A 448 -0.050 10.676 -3.099 1.00 44.04 N ATOM 891 CA HIS A 448 0.835 11.039 -2.005 1.00 61.00 C ATOM 892 C HIS A 448 1.822 9.899 -1.745 1.00 5.03 C ATOM 893 O HIS A 448 3.034 10.105 -1.769 1.00 42.33 O ATOM 894 CB HIS A 448 0.033 11.423 -0.760 1.00 3.34 C ATOM 895 CG HIS A 448 0.757 12.366 0.171 1.00 23.43 C ATOM 896 ND1 HIS A 448 0.391 12.539 1.495 1.00 62.34 N ATOM 897 CD2 HIS A 448 1.828 13.181 -0.043 1.00 72.04 C ATOM 898 CE1 HIS A 448 1.213 13.423 2.042 1.00 72.22 C ATOM 899 NE2 HIS A 448 2.102 13.820 1.088 1.00 35.20 N ATOM 0 H HIS A 448 -0.992 10.406 -2.814 1.00 44.04 H new ATOM 0 HA HIS A 448 1.414 11.921 -2.279 1.00 61.00 H new ATOM 0 HB2 HIS A 448 -0.904 11.885 -1.072 1.00 3.34 H new ATOM 0 HB3 HIS A 448 -0.226 10.516 -0.213 1.00 3.34 H new ATOM 0 HD2 HIS A 448 2.363 13.289 -0.975 1.00 72.04 H new ATOM 0 HE1 HIS A 448 1.184 13.768 3.065 1.00 72.22 H new ATOM 0 HE2 HIS A 448 2.854 14.496 1.221 1.00 35.20 H new ATOM 906 N SER A 449 1.266 8.721 -1.503 1.00 41.10 N ATOM 907 CA SER A 449 2.083 7.548 -1.239 1.00 44.35 C ATOM 908 C SER A 449 2.762 7.082 -2.529 1.00 70.21 C ATOM 909 O SER A 449 2.226 7.270 -3.619 1.00 41.24 O ATOM 910 CB SER A 449 1.242 6.417 -0.642 1.00 25.43 C ATOM 911 OG SER A 449 1.866 5.834 0.499 1.00 45.14 O ATOM 0 H SER A 449 0.260 8.553 -1.484 1.00 41.10 H new ATOM 0 HA SER A 449 2.848 7.819 -0.512 1.00 44.35 H new ATOM 0 HB2 SER A 449 0.262 6.803 -0.362 1.00 25.43 H new ATOM 0 HB3 SER A 449 1.078 5.649 -1.398 1.00 25.43 H new ATOM 0 HG SER A 449 1.181 5.458 1.090 1.00 45.14 H new ATOM 916 N ALA A 450 3.931 6.483 -2.359 1.00 31.21 N ATOM 917 CA ALA A 450 4.689 5.989 -3.496 1.00 71.51 C ATOM 918 C ALA A 450 3.850 4.961 -4.256 1.00 11.52 C ATOM 919 O ALA A 450 3.313 5.259 -5.323 1.00 42.32 O ATOM 920 CB ALA A 450 6.021 5.410 -3.010 1.00 52.44 C ATOM 0 H ALA A 450 4.372 6.329 -1.452 1.00 31.21 H new ATOM 0 HA ALA A 450 4.918 6.801 -4.185 1.00 71.51 H new ATOM 0 HB1 ALA A 450 6.590 5.039 -3.863 1.00 52.44 H new ATOM 0 HB2 ALA A 450 6.592 6.188 -2.503 1.00 52.44 H new ATOM 0 HB3 ALA A 450 5.830 4.590 -2.317 1.00 52.44 H new ATOM 926 N PHE A 451 3.762 3.773 -3.680 1.00 23.45 N ATOM 927 CA PHE A 451 2.997 2.698 -4.289 1.00 33.12 C ATOM 928 C PHE A 451 1.987 2.114 -3.298 1.00 12.02 C ATOM 929 O PHE A 451 2.334 1.818 -2.156 1.00 53.12 O ATOM 930 CB PHE A 451 3.994 1.608 -4.687 1.00 41.44 C ATOM 931 CG PHE A 451 5.231 2.132 -5.419 1.00 13.20 C ATOM 932 CD1 PHE A 451 6.328 2.514 -4.713 1.00 21.54 C ATOM 933 CD2 PHE A 451 5.231 2.217 -6.777 1.00 3.23 C ATOM 934 CE1 PHE A 451 7.476 3.000 -5.395 1.00 21.34 C ATOM 935 CE2 PHE A 451 6.378 2.704 -7.458 1.00 2.32 C ATOM 936 CZ PHE A 451 7.476 3.084 -6.752 1.00 74.44 C ATOM 0 H PHE A 451 4.209 3.530 -2.796 1.00 23.45 H new ATOM 0 HA PHE A 451 2.444 3.076 -5.149 1.00 33.12 H new ATOM 0 HB2 PHE A 451 4.313 1.077 -3.790 1.00 41.44 H new ATOM 0 HB3 PHE A 451 3.488 0.882 -5.324 1.00 41.44 H new ATOM 0 HD1 PHE A 451 6.327 2.448 -3.635 1.00 21.54 H new ATOM 0 HD2 PHE A 451 4.359 1.914 -7.337 1.00 3.23 H new ATOM 0 HE1 PHE A 451 8.349 3.303 -4.835 1.00 21.34 H new ATOM 0 HE2 PHE A 451 6.378 2.772 -8.536 1.00 2.32 H new ATOM 0 HZ PHE A 451 8.349 3.453 -7.270 1.00 74.44 H new ATOM 945 N ILE A 452 0.760 1.964 -3.774 1.00 44.21 N ATOM 946 CA ILE A 452 -0.302 1.421 -2.944 1.00 33.25 C ATOM 947 C ILE A 452 -0.102 -0.088 -2.791 1.00 1.23 C ATOM 948 O ILE A 452 0.115 -0.794 -3.776 1.00 54.34 O ATOM 949 CB ILE A 452 -1.672 1.804 -3.508 1.00 23.40 C ATOM 950 CG1 ILE A 452 -1.715 3.288 -3.881 1.00 35.12 C ATOM 951 CG2 ILE A 452 -2.791 1.427 -2.536 1.00 25.02 C ATOM 952 CD1 ILE A 452 -1.458 4.169 -2.657 1.00 74.15 C ATOM 0 H ILE A 452 0.477 2.209 -4.723 1.00 44.21 H new ATOM 0 HA ILE A 452 -0.262 1.853 -1.944 1.00 33.25 H new ATOM 0 HB ILE A 452 -1.835 1.235 -4.423 1.00 23.40 H new ATOM 0 HG12 ILE A 452 -0.967 3.496 -4.647 1.00 35.12 H new ATOM 0 HG13 ILE A 452 -2.687 3.531 -4.310 1.00 35.12 H new ATOM 0 HG21 ILE A 452 -3.754 1.710 -2.962 1.00 25.02 H new ATOM 0 HG22 ILE A 452 -2.774 0.351 -2.361 1.00 25.02 H new ATOM 0 HG23 ILE A 452 -2.644 1.950 -1.591 1.00 25.02 H new ATOM 0 HD11 ILE A 452 -1.494 5.218 -2.950 1.00 74.15 H new ATOM 0 HD12 ILE A 452 -2.221 3.976 -1.903 1.00 74.15 H new ATOM 0 HD13 ILE A 452 -0.475 3.941 -2.245 1.00 74.15 H new ATOM 963 N ILE A 453 -0.181 -0.540 -1.548 1.00 61.13 N ATOM 964 CA ILE A 453 -0.010 -1.954 -1.253 1.00 14.20 C ATOM 965 C ILE A 453 -1.378 -2.579 -0.972 1.00 4.51 C ATOM 966 O ILE A 453 -2.075 -2.166 -0.045 1.00 35.31 O ATOM 967 CB ILE A 453 0.998 -2.146 -0.121 1.00 64.53 C ATOM 968 CG1 ILE A 453 2.428 -2.212 -0.665 1.00 43.33 C ATOM 969 CG2 ILE A 453 0.649 -3.373 0.723 1.00 21.23 C ATOM 970 CD1 ILE A 453 3.443 -1.821 0.411 1.00 73.20 C ATOM 0 H ILE A 453 -0.361 0.047 -0.733 1.00 61.13 H new ATOM 0 HA ILE A 453 0.409 -2.476 -2.113 1.00 14.20 H new ATOM 0 HB ILE A 453 0.943 -1.278 0.536 1.00 64.53 H new ATOM 0 HG12 ILE A 453 2.640 -3.221 -1.020 1.00 43.33 H new ATOM 0 HG13 ILE A 453 2.526 -1.545 -1.522 1.00 43.33 H new ATOM 0 HG21 ILE A 453 1.383 -3.486 1.521 1.00 21.23 H new ATOM 0 HG22 ILE A 453 -0.343 -3.246 1.157 1.00 21.23 H new ATOM 0 HG23 ILE A 453 0.658 -4.263 0.093 1.00 21.23 H new ATOM 0 HD11 ILE A 453 4.450 -1.876 -0.002 1.00 73.20 H new ATOM 0 HD12 ILE A 453 3.244 -0.803 0.746 1.00 73.20 H new ATOM 0 HD13 ILE A 453 3.359 -2.504 1.256 1.00 73.20 H new ATOM 981 N LEU A 454 -1.721 -3.566 -1.787 1.00 62.12 N ATOM 982 CA LEU A 454 -2.992 -4.253 -1.638 1.00 3.33 C ATOM 983 C LEU A 454 -2.785 -5.528 -0.817 1.00 64.23 C ATOM 984 O LEU A 454 -2.458 -6.578 -1.368 1.00 44.34 O ATOM 985 CB LEU A 454 -3.633 -4.499 -3.004 1.00 54.44 C ATOM 986 CG LEU A 454 -3.481 -3.372 -4.028 1.00 63.21 C ATOM 987 CD1 LEU A 454 -4.606 -3.418 -5.065 1.00 44.22 C ATOM 988 CD2 LEU A 454 -3.394 -2.011 -3.337 1.00 44.32 C ATOM 0 H LEU A 454 -1.140 -3.906 -2.553 1.00 62.12 H new ATOM 0 HA LEU A 454 -3.698 -3.630 -1.089 1.00 3.33 H new ATOM 0 HB2 LEU A 454 -3.204 -5.408 -3.426 1.00 54.44 H new ATOM 0 HB3 LEU A 454 -4.696 -4.688 -2.856 1.00 54.44 H new ATOM 0 HG LEU A 454 -2.543 -3.521 -4.563 1.00 63.21 H new ATOM 0 HD11 LEU A 454 -4.474 -2.607 -5.781 1.00 44.22 H new ATOM 0 HD12 LEU A 454 -4.578 -4.373 -5.590 1.00 44.22 H new ATOM 0 HD13 LEU A 454 -5.568 -3.307 -4.564 1.00 44.22 H new ATOM 0 HD21 LEU A 454 -3.286 -1.228 -4.088 1.00 44.32 H new ATOM 0 HD22 LEU A 454 -4.302 -1.838 -2.759 1.00 44.32 H new ATOM 0 HD23 LEU A 454 -2.532 -1.996 -2.671 1.00 44.32 H new ATOM 999 N LEU A 455 -2.983 -5.394 0.487 1.00 73.31 N ATOM 1000 CA LEU A 455 -2.821 -6.522 1.388 1.00 11.02 C ATOM 1001 C LEU A 455 -3.855 -7.597 1.043 1.00 41.15 C ATOM 1002 O LEU A 455 -4.882 -7.710 1.711 1.00 42.42 O ATOM 1003 CB LEU A 455 -2.879 -6.056 2.844 1.00 0.10 C ATOM 1004 CG LEU A 455 -2.280 -7.013 3.877 1.00 4.45 C ATOM 1005 CD1 LEU A 455 -0.900 -7.504 3.436 1.00 71.22 C ATOM 1006 CD2 LEU A 455 -2.243 -6.368 5.264 1.00 4.23 C ATOM 0 H LEU A 455 -3.254 -4.521 0.940 1.00 73.31 H new ATOM 0 HA LEU A 455 -1.837 -6.974 1.261 1.00 11.02 H new ATOM 0 HB2 LEU A 455 -2.361 -5.100 2.920 1.00 0.10 H new ATOM 0 HB3 LEU A 455 -3.922 -5.876 3.106 1.00 0.10 H new ATOM 0 HG LEU A 455 -2.925 -7.889 3.946 1.00 4.45 H new ATOM 0 HD11 LEU A 455 -0.498 -8.182 4.188 1.00 71.22 H new ATOM 0 HD12 LEU A 455 -0.987 -8.028 2.484 1.00 71.22 H new ATOM 0 HD13 LEU A 455 -0.230 -6.652 3.321 1.00 71.22 H new ATOM 0 HD21 LEU A 455 -1.813 -7.069 5.980 1.00 4.23 H new ATOM 0 HD22 LEU A 455 -1.633 -5.465 5.229 1.00 4.23 H new ATOM 0 HD23 LEU A 455 -3.256 -6.110 5.573 1.00 4.23 H new ATOM 1017 N LEU A 456 -3.548 -8.357 0.003 1.00 73.22 N ATOM 1018 CA LEU A 456 -4.438 -9.417 -0.437 1.00 63.11 C ATOM 1019 C LEU A 456 -4.536 -10.481 0.658 1.00 21.04 C ATOM 1020 O LEU A 456 -3.692 -11.372 0.740 1.00 73.11 O ATOM 1021 CB LEU A 456 -3.986 -9.967 -1.791 1.00 1.32 C ATOM 1022 CG LEU A 456 -3.753 -8.931 -2.892 1.00 3.25 C ATOM 1023 CD1 LEU A 456 -3.696 -9.596 -4.269 1.00 23.25 C ATOM 1024 CD2 LEU A 456 -4.806 -7.824 -2.835 1.00 42.12 C ATOM 0 H LEU A 456 -2.695 -8.260 -0.548 1.00 73.22 H new ATOM 0 HA LEU A 456 -5.444 -9.029 -0.596 1.00 63.11 H new ATOM 0 HB2 LEU A 456 -3.062 -10.525 -1.644 1.00 1.32 H new ATOM 0 HB3 LEU A 456 -4.735 -10.677 -2.141 1.00 1.32 H new ATOM 0 HG LEU A 456 -2.784 -8.463 -2.720 1.00 3.25 H new ATOM 0 HD11 LEU A 456 -3.530 -8.837 -5.033 1.00 23.25 H new ATOM 0 HD12 LEU A 456 -2.880 -10.318 -4.291 1.00 23.25 H new ATOM 0 HD13 LEU A 456 -4.638 -10.108 -4.465 1.00 23.25 H new ATOM 0 HD21 LEU A 456 -4.617 -7.101 -3.628 1.00 42.12 H new ATOM 0 HD22 LEU A 456 -5.797 -8.258 -2.968 1.00 42.12 H new ATOM 0 HD23 LEU A 456 -4.756 -7.323 -1.868 1.00 42.12 H new ATOM 1035 N THR A 457 -5.575 -10.354 1.471 1.00 21.45 N ATOM 1036 CA THR A 457 -5.793 -11.295 2.556 1.00 2.41 C ATOM 1037 C THR A 457 -7.245 -11.780 2.557 1.00 31.01 C ATOM 1038 O THR A 457 -8.149 -11.045 2.163 1.00 62.41 O ATOM 1039 CB THR A 457 -5.381 -10.613 3.863 1.00 60.12 C ATOM 1040 OG1 THR A 457 -6.210 -9.456 3.927 1.00 52.12 O ATOM 1041 CG2 THR A 457 -3.960 -10.051 3.806 1.00 32.31 C ATOM 0 H THR A 457 -6.274 -9.615 1.400 1.00 21.45 H new ATOM 0 HA THR A 457 -5.183 -12.190 2.432 1.00 2.41 H new ATOM 0 HB THR A 457 -5.457 -11.326 4.684 1.00 60.12 H new ATOM 0 HG1 THR A 457 -6.065 -8.996 4.780 1.00 52.12 H new ATOM 0 HG21 THR A 457 -3.717 -9.578 4.758 1.00 32.31 H new ATOM 0 HG22 THR A 457 -3.256 -10.861 3.613 1.00 32.31 H new ATOM 0 HG23 THR A 457 -3.892 -9.313 3.006 1.00 32.31 H new ATOM 1049 N SER A 458 -7.422 -13.015 3.002 1.00 73.12 N ATOM 1050 CA SER A 458 -8.748 -13.608 3.059 1.00 73.00 C ATOM 1051 C SER A 458 -9.679 -12.727 3.893 1.00 63.24 C ATOM 1052 O SER A 458 -10.900 -12.838 3.793 1.00 40.02 O ATOM 1053 CB SER A 458 -8.695 -15.022 3.638 1.00 62.22 C ATOM 1054 OG SER A 458 -8.144 -15.041 4.953 1.00 1.12 O ATOM 0 H SER A 458 -6.669 -13.622 3.327 1.00 73.12 H new ATOM 0 HA SER A 458 -9.136 -13.676 2.043 1.00 73.00 H new ATOM 0 HB2 SER A 458 -9.700 -15.442 3.660 1.00 62.22 H new ATOM 0 HB3 SER A 458 -8.098 -15.659 2.985 1.00 62.22 H new ATOM 0 HG SER A 458 -7.413 -15.692 4.992 1.00 1.12 H new ATOM 1059 N ASN A 459 -9.069 -11.871 4.699 1.00 62.54 N ATOM 1060 CA ASN A 459 -9.827 -10.971 5.550 1.00 61.34 C ATOM 1061 C ASN A 459 -10.137 -9.686 4.779 1.00 4.32 C ATOM 1062 O ASN A 459 -11.110 -8.995 5.082 1.00 64.41 O ATOM 1063 CB ASN A 459 -9.030 -10.591 6.800 1.00 11.02 C ATOM 1064 CG ASN A 459 -9.217 -11.632 7.906 1.00 35.21 C ATOM 1065 OD1 ASN A 459 -8.281 -12.274 8.355 1.00 51.31 O ATOM 1066 ND2 ASN A 459 -10.475 -11.762 8.319 1.00 23.35 N ATOM 0 H ASN A 459 -8.056 -11.782 4.781 1.00 62.54 H new ATOM 0 HA ASN A 459 -10.743 -11.481 5.848 1.00 61.34 H new ATOM 0 HB2 ASN A 459 -7.972 -10.507 6.550 1.00 11.02 H new ATOM 0 HB3 ASN A 459 -9.352 -9.613 7.158 1.00 11.02 H new ATOM 0 HD21 ASN A 459 -10.704 -12.431 9.054 1.00 23.35 H new ATOM 0 HD22 ASN A 459 -11.211 -11.193 7.900 1.00 23.35 H new ATOM 1072 N PHE A 460 -9.293 -9.404 3.798 1.00 74.42 N ATOM 1073 CA PHE A 460 -9.465 -8.214 2.981 1.00 5.24 C ATOM 1074 C PHE A 460 -10.058 -8.568 1.616 1.00 72.23 C ATOM 1075 O PHE A 460 -10.092 -9.736 1.233 1.00 12.34 O ATOM 1076 CB PHE A 460 -8.075 -7.606 2.779 1.00 12.32 C ATOM 1077 CG PHE A 460 -8.057 -6.393 1.847 1.00 51.13 C ATOM 1078 CD1 PHE A 460 -8.809 -5.299 2.141 1.00 35.42 C ATOM 1079 CD2 PHE A 460 -7.289 -6.410 0.725 1.00 34.32 C ATOM 1080 CE1 PHE A 460 -8.791 -4.172 1.276 1.00 25.33 C ATOM 1081 CE2 PHE A 460 -7.273 -5.284 -0.140 1.00 34.23 C ATOM 1082 CZ PHE A 460 -8.023 -4.189 0.153 1.00 42.32 C ATOM 0 H PHE A 460 -8.488 -9.979 3.550 1.00 74.42 H new ATOM 0 HA PHE A 460 -10.145 -7.519 3.473 1.00 5.24 H new ATOM 0 HB2 PHE A 460 -7.674 -7.312 3.749 1.00 12.32 H new ATOM 0 HB3 PHE A 460 -7.410 -8.370 2.377 1.00 12.32 H new ATOM 0 HD1 PHE A 460 -9.420 -5.287 3.032 1.00 35.42 H new ATOM 0 HD2 PHE A 460 -6.692 -7.279 0.492 1.00 34.32 H new ATOM 0 HE1 PHE A 460 -9.387 -3.302 1.510 1.00 25.33 H new ATOM 0 HE2 PHE A 460 -6.664 -5.298 -1.032 1.00 34.23 H new ATOM 0 HZ PHE A 460 -8.009 -3.333 -0.505 1.00 42.32 H new ATOM 1091 N ASP A 461 -10.508 -7.536 0.918 1.00 54.12 N ATOM 1092 CA ASP A 461 -11.098 -7.723 -0.398 1.00 33.22 C ATOM 1093 C ASP A 461 -10.176 -7.113 -1.456 1.00 63.21 C ATOM 1094 O ASP A 461 -9.677 -6.002 -1.284 1.00 61.50 O ATOM 1095 CB ASP A 461 -12.457 -7.027 -0.497 1.00 63.24 C ATOM 1096 CG ASP A 461 -13.406 -7.608 -1.545 1.00 70.23 C ATOM 1097 OD1 ASP A 461 -13.027 -7.811 -2.709 1.00 63.52 O ATOM 1098 OD2 ASP A 461 -14.598 -7.858 -1.122 1.00 31.21 O ATOM 0 H ASP A 461 -10.476 -6.568 1.238 1.00 54.12 H new ATOM 0 HA ASP A 461 -11.229 -8.793 -0.560 1.00 33.22 H new ATOM 0 HB2 ASP A 461 -12.944 -7.073 0.477 1.00 63.24 H new ATOM 0 HB3 ASP A 461 -12.293 -5.973 -0.722 1.00 63.24 H new ATOM 1103 N CYS A 462 -9.979 -7.867 -2.527 1.00 34.33 N ATOM 1104 CA CYS A 462 -9.125 -7.414 -3.615 1.00 22.11 C ATOM 1105 C CYS A 462 -10.005 -6.735 -4.665 1.00 41.45 C ATOM 1106 O CYS A 462 -9.727 -5.610 -5.079 1.00 4.51 O ATOM 1107 CB CYS A 462 -8.311 -8.565 -4.210 1.00 15.22 C ATOM 1108 SG CYS A 462 -7.797 -9.719 -2.887 1.00 4.40 S ATOM 0 H CYS A 462 -10.395 -8.788 -2.666 1.00 34.33 H new ATOM 0 HA CYS A 462 -8.396 -6.698 -3.236 1.00 22.11 H new ATOM 0 HB2 CYS A 462 -8.905 -9.094 -4.955 1.00 15.22 H new ATOM 0 HB3 CYS A 462 -7.433 -8.173 -4.723 1.00 15.22 H new ATOM 0 HG CYS A 462 -8.267 -10.905 -3.139 1.00 4.40 H new ATOM 1113 N ARG A 463 -11.050 -7.445 -5.066 1.00 70.34 N ATOM 1114 CA ARG A 463 -11.972 -6.924 -6.060 1.00 63.31 C ATOM 1115 C ARG A 463 -12.179 -5.422 -5.857 1.00 43.52 C ATOM 1116 O ARG A 463 -12.418 -4.689 -6.814 1.00 0.24 O ATOM 1117 CB ARG A 463 -13.325 -7.634 -5.982 1.00 24.44 C ATOM 1118 CG ARG A 463 -13.177 -9.129 -6.275 1.00 5.21 C ATOM 1119 CD ARG A 463 -14.500 -9.726 -6.759 1.00 24.02 C ATOM 1120 NE ARG A 463 -14.702 -9.411 -8.190 1.00 14.34 N ATOM 1121 CZ ARG A 463 -15.659 -9.973 -8.960 1.00 11.31 C ATOM 1122 NH1 ARG A 463 -16.508 -10.884 -8.442 1.00 1.01 N ATOM 1123 NH2 ARG A 463 -15.749 -9.618 -10.229 1.00 72.02 N ATOM 0 H ARG A 463 -11.278 -8.377 -4.720 1.00 70.34 H new ATOM 0 HA ARG A 463 -11.536 -7.104 -7.043 1.00 63.31 H new ATOM 0 HB2 ARG A 463 -13.756 -7.495 -4.991 1.00 24.44 H new ATOM 0 HB3 ARG A 463 -14.016 -7.186 -6.696 1.00 24.44 H new ATOM 0 HG2 ARG A 463 -12.407 -9.281 -7.032 1.00 5.21 H new ATOM 0 HG3 ARG A 463 -12.847 -9.649 -5.376 1.00 5.21 H new ATOM 0 HD2 ARG A 463 -14.497 -10.806 -6.613 1.00 24.02 H new ATOM 0 HD3 ARG A 463 -15.326 -9.327 -6.170 1.00 24.02 H new ATOM 0 HE ARG A 463 -14.080 -8.727 -8.622 1.00 14.34 H new ATOM 0 HH11 ARG A 463 -16.430 -11.154 -7.461 1.00 1.01 H new ATOM 0 HH12 ARG A 463 -17.228 -11.303 -9.031 1.00 1.01 H new ATOM 0 HH21 ARG A 463 -15.102 -8.930 -10.613 1.00 72.02 H new ATOM 0 HH22 ARG A 463 -16.466 -10.032 -10.825 1.00 72.02 H new ATOM 1133 N LEU A 464 -12.080 -5.009 -4.601 1.00 14.30 N ATOM 1134 CA LEU A 464 -12.255 -3.608 -4.259 1.00 73.13 C ATOM 1135 C LEU A 464 -10.890 -2.915 -4.253 1.00 3.22 C ATOM 1136 O LEU A 464 -10.709 -1.885 -4.899 1.00 75.21 O ATOM 1137 CB LEU A 464 -13.022 -3.467 -2.943 1.00 11.02 C ATOM 1138 CG LEU A 464 -13.410 -2.044 -2.540 1.00 73.12 C ATOM 1139 CD1 LEU A 464 -12.301 -1.385 -1.718 1.00 44.54 C ATOM 1140 CD2 LEU A 464 -13.785 -1.210 -3.768 1.00 61.00 C ATOM 0 H LEU A 464 -11.881 -5.620 -3.809 1.00 14.30 H new ATOM 0 HA LEU A 464 -12.865 -3.107 -5.010 1.00 73.13 H new ATOM 0 HB2 LEU A 464 -13.931 -4.065 -3.010 1.00 11.02 H new ATOM 0 HB3 LEU A 464 -12.416 -3.897 -2.145 1.00 11.02 H new ATOM 0 HG LEU A 464 -14.294 -2.098 -1.904 1.00 73.12 H new ATOM 0 HD11 LEU A 464 -12.603 -0.374 -1.445 1.00 44.54 H new ATOM 0 HD12 LEU A 464 -12.123 -1.968 -0.814 1.00 44.54 H new ATOM 0 HD13 LEU A 464 -11.386 -1.343 -2.309 1.00 44.54 H new ATOM 0 HD21 LEU A 464 -14.057 -0.202 -3.454 1.00 61.00 H new ATOM 0 HD22 LEU A 464 -12.935 -1.161 -4.448 1.00 61.00 H new ATOM 0 HD23 LEU A 464 -14.631 -1.672 -4.277 1.00 61.00 H new ATOM 1151 N SER A 465 -9.964 -3.510 -3.514 1.00 12.50 N ATOM 1152 CA SER A 465 -8.621 -2.964 -3.415 1.00 42.41 C ATOM 1153 C SER A 465 -8.161 -2.454 -4.782 1.00 33.13 C ATOM 1154 O SER A 465 -7.719 -1.313 -4.906 1.00 13.15 O ATOM 1155 CB SER A 465 -7.640 -4.008 -2.880 1.00 71.10 C ATOM 1156 OG SER A 465 -6.562 -3.412 -2.165 1.00 44.13 O ATOM 0 H SER A 465 -10.118 -4.364 -2.979 1.00 12.50 H new ATOM 0 HA SER A 465 -8.642 -2.131 -2.712 1.00 42.41 H new ATOM 0 HB2 SER A 465 -8.169 -4.701 -2.226 1.00 71.10 H new ATOM 0 HB3 SER A 465 -7.245 -4.593 -3.711 1.00 71.10 H new ATOM 0 HG SER A 465 -6.597 -3.693 -1.227 1.00 44.13 H new ATOM 1161 N LEU A 466 -8.283 -3.324 -5.773 1.00 70.24 N ATOM 1162 CA LEU A 466 -7.883 -2.977 -7.128 1.00 44.25 C ATOM 1163 C LEU A 466 -8.881 -1.971 -7.704 1.00 75.13 C ATOM 1164 O LEU A 466 -8.493 -0.892 -8.150 1.00 61.55 O ATOM 1165 CB LEU A 466 -7.720 -4.238 -7.978 1.00 73.32 C ATOM 1166 CG LEU A 466 -6.831 -5.334 -7.387 1.00 62.21 C ATOM 1167 CD1 LEU A 466 -7.649 -6.296 -6.522 1.00 40.13 C ATOM 1168 CD2 LEU A 466 -6.060 -6.067 -8.486 1.00 54.24 C ATOM 0 H LEU A 466 -8.653 -4.269 -5.666 1.00 70.24 H new ATOM 0 HA LEU A 466 -6.906 -2.494 -7.127 1.00 44.25 H new ATOM 0 HB2 LEU A 466 -8.709 -4.659 -8.161 1.00 73.32 H new ATOM 0 HB3 LEU A 466 -7.312 -3.949 -8.947 1.00 73.32 H new ATOM 0 HG LEU A 466 -6.094 -4.862 -6.737 1.00 62.21 H new ATOM 0 HD11 LEU A 466 -6.994 -7.065 -6.114 1.00 40.13 H new ATOM 0 HD12 LEU A 466 -8.114 -5.745 -5.705 1.00 40.13 H new ATOM 0 HD13 LEU A 466 -8.423 -6.764 -7.130 1.00 40.13 H new ATOM 0 HD21 LEU A 466 -5.436 -6.841 -8.039 1.00 54.24 H new ATOM 0 HD22 LEU A 466 -6.764 -6.525 -9.181 1.00 54.24 H new ATOM 0 HD23 LEU A 466 -5.430 -5.358 -9.023 1.00 54.24 H new ATOM 1179 N HIS A 467 -10.148 -2.360 -7.680 1.00 62.14 N ATOM 1180 CA HIS A 467 -11.204 -1.505 -8.196 1.00 1.14 C ATOM 1181 C HIS A 467 -10.997 -0.074 -7.694 1.00 60.11 C ATOM 1182 O HIS A 467 -11.433 0.881 -8.335 1.00 21.24 O ATOM 1183 CB HIS A 467 -12.581 -2.066 -7.835 1.00 1.23 C ATOM 1184 CG HIS A 467 -13.734 -1.215 -8.309 1.00 32.11 C ATOM 1185 ND1 HIS A 467 -13.789 -0.670 -9.580 1.00 51.25 N ATOM 1186 CD2 HIS A 467 -14.875 -0.822 -7.672 1.00 33.34 C ATOM 1187 CE1 HIS A 467 -14.916 0.019 -9.691 1.00 71.33 C ATOM 1188 NE2 HIS A 467 -15.587 -0.076 -8.507 1.00 72.42 N ATOM 0 H HIS A 467 -10.467 -3.256 -7.311 1.00 62.14 H new ATOM 0 HA HIS A 467 -11.159 -1.481 -9.285 1.00 1.14 H new ATOM 0 HB2 HIS A 467 -12.679 -3.064 -8.263 1.00 1.23 H new ATOM 0 HB3 HIS A 467 -12.645 -2.176 -6.752 1.00 1.23 H new ATOM 0 HD2 HIS A 467 -15.152 -1.075 -6.659 1.00 33.34 H new ATOM 0 HE1 HIS A 467 -15.245 0.561 -10.565 1.00 71.33 H new ATOM 0 HE2 HIS A 467 -16.487 0.355 -8.298 1.00 72.42 H new ATOM 1195 N GLN A 468 -10.331 0.029 -6.554 1.00 1.51 N ATOM 1196 CA GLN A 468 -10.061 1.327 -5.960 1.00 24.21 C ATOM 1197 C GLN A 468 -8.866 1.988 -6.651 1.00 44.55 C ATOM 1198 O GLN A 468 -9.036 2.926 -7.427 1.00 53.34 O ATOM 1199 CB GLN A 468 -9.823 1.202 -4.454 1.00 0.20 C ATOM 1200 CG GLN A 468 -11.147 1.074 -3.698 1.00 22.23 C ATOM 1201 CD GLN A 468 -10.918 1.075 -2.186 1.00 24.12 C ATOM 1202 OE1 GLN A 468 -10.086 0.354 -1.657 1.00 3.33 O ATOM 1203 NE2 GLN A 468 -11.698 1.921 -1.520 1.00 21.34 N ATOM 0 H GLN A 468 -9.970 -0.765 -6.026 1.00 1.51 H new ATOM 0 HA GLN A 468 -10.936 1.960 -6.105 1.00 24.21 H new ATOM 0 HB2 GLN A 468 -9.199 0.331 -4.252 1.00 0.20 H new ATOM 0 HB3 GLN A 468 -9.278 2.075 -4.095 1.00 0.20 H new ATOM 0 HG2 GLN A 468 -11.806 1.898 -3.970 1.00 22.23 H new ATOM 0 HG3 GLN A 468 -11.650 0.153 -3.992 1.00 22.23 H new ATOM 0 HE21 GLN A 468 -12.374 2.496 -2.023 1.00 21.34 H new ATOM 0 HE22 GLN A 468 -11.621 1.995 -0.506 1.00 21.34 H new ATOM 1210 N VAL A 469 -7.686 1.473 -6.342 1.00 61.31 N ATOM 1211 CA VAL A 469 -6.463 2.003 -6.924 1.00 4.22 C ATOM 1212 C VAL A 469 -6.704 2.328 -8.398 1.00 54.42 C ATOM 1213 O VAL A 469 -6.405 3.432 -8.850 1.00 54.14 O ATOM 1214 CB VAL A 469 -5.314 1.017 -6.709 1.00 31.34 C ATOM 1215 CG1 VAL A 469 -5.275 0.524 -5.261 1.00 62.11 C ATOM 1216 CG2 VAL A 469 -5.408 -0.157 -7.685 1.00 54.33 C ATOM 0 H VAL A 469 -7.549 0.695 -5.697 1.00 61.31 H new ATOM 0 HA VAL A 469 -6.175 2.931 -6.430 1.00 4.22 H new ATOM 0 HB VAL A 469 -4.381 1.544 -6.908 1.00 31.34 H new ATOM 0 HG11 VAL A 469 -4.448 -0.176 -5.137 1.00 62.11 H new ATOM 0 HG12 VAL A 469 -5.136 1.373 -4.591 1.00 62.11 H new ATOM 0 HG13 VAL A 469 -6.213 0.023 -5.022 1.00 62.11 H new ATOM 0 HG21 VAL A 469 -4.579 -0.843 -7.510 1.00 54.33 H new ATOM 0 HG22 VAL A 469 -6.351 -0.682 -7.533 1.00 54.33 H new ATOM 0 HG23 VAL A 469 -5.361 0.216 -8.708 1.00 54.33 H new ATOM 1226 N ASN A 470 -7.244 1.348 -9.107 1.00 13.02 N ATOM 1227 CA ASN A 470 -7.530 1.517 -10.522 1.00 32.12 C ATOM 1228 C ASN A 470 -8.095 2.917 -10.760 1.00 40.41 C ATOM 1229 O ASN A 470 -7.447 3.755 -11.385 1.00 41.21 O ATOM 1230 CB ASN A 470 -8.567 0.500 -11.000 1.00 13.54 C ATOM 1231 CG ASN A 470 -7.895 -0.680 -11.707 1.00 42.10 C ATOM 1232 OD1 ASN A 470 -7.836 -0.754 -12.923 1.00 24.41 O ATOM 1233 ND2 ASN A 470 -7.395 -1.593 -10.879 1.00 43.40 N ATOM 0 H ASN A 470 -7.491 0.434 -8.728 1.00 13.02 H new ATOM 0 HA ASN A 470 -6.601 1.370 -11.073 1.00 32.12 H new ATOM 0 HB2 ASN A 470 -9.145 0.138 -10.150 1.00 13.54 H new ATOM 0 HB3 ASN A 470 -9.269 0.983 -11.679 1.00 13.54 H new ATOM 0 HD21 ASN A 470 -6.927 -2.418 -11.253 1.00 43.40 H new ATOM 0 HD22 ASN A 470 -7.480 -1.468 -9.870 1.00 43.40 H new ATOM 1239 N GLN A 471 -9.300 3.129 -10.249 1.00 0.23 N ATOM 1240 CA GLN A 471 -9.961 4.414 -10.398 1.00 72.12 C ATOM 1241 C GLN A 471 -9.001 5.550 -10.040 1.00 11.02 C ATOM 1242 O GLN A 471 -8.887 6.527 -10.778 1.00 15.31 O ATOM 1243 CB GLN A 471 -11.231 4.480 -9.547 1.00 30.14 C ATOM 1244 CG GLN A 471 -12.225 3.392 -9.959 1.00 74.43 C ATOM 1245 CD GLN A 471 -13.167 3.897 -11.055 1.00 25.53 C ATOM 1246 OE1 GLN A 471 -14.040 4.717 -10.829 1.00 63.35 O ATOM 1247 NE2 GLN A 471 -12.942 3.360 -12.251 1.00 23.21 N ATOM 0 H GLN A 471 -9.835 2.432 -9.731 1.00 0.23 H new ATOM 0 HA GLN A 471 -10.256 4.529 -11.441 1.00 72.12 H new ATOM 0 HB2 GLN A 471 -10.974 4.363 -8.494 1.00 30.14 H new ATOM 0 HB3 GLN A 471 -11.695 5.461 -9.655 1.00 30.14 H new ATOM 0 HG2 GLN A 471 -11.684 2.516 -10.315 1.00 74.43 H new ATOM 0 HG3 GLN A 471 -12.806 3.077 -9.092 1.00 74.43 H new ATOM 0 HE21 GLN A 471 -12.193 2.678 -12.371 1.00 23.21 H new ATOM 0 HE22 GLN A 471 -13.518 3.630 -13.048 1.00 23.21 H new ATOM 1254 N ALA A 472 -8.335 5.383 -8.907 1.00 51.32 N ATOM 1255 CA ALA A 472 -7.388 6.383 -8.441 1.00 10.11 C ATOM 1256 C ALA A 472 -6.430 6.740 -9.579 1.00 55.23 C ATOM 1257 O ALA A 472 -6.181 7.916 -9.840 1.00 1.33 O ATOM 1258 CB ALA A 472 -6.655 5.856 -7.207 1.00 5.13 C ATOM 0 H ALA A 472 -8.432 4.571 -8.298 1.00 51.32 H new ATOM 0 HA ALA A 472 -7.907 7.295 -8.147 1.00 10.11 H new ATOM 0 HB1 ALA A 472 -5.945 6.606 -6.858 1.00 5.13 H new ATOM 0 HB2 ALA A 472 -7.377 5.644 -6.418 1.00 5.13 H new ATOM 0 HB3 ALA A 472 -6.120 4.942 -7.464 1.00 5.13 H new ATOM 1264 N MET A 473 -5.917 5.704 -10.227 1.00 33.23 N ATOM 1265 CA MET A 473 -4.992 5.894 -11.331 1.00 42.31 C ATOM 1266 C MET A 473 -5.627 6.737 -12.438 1.00 73.45 C ATOM 1267 O MET A 473 -5.257 7.894 -12.631 1.00 73.33 O ATOM 1268 CB MET A 473 -4.585 4.532 -11.896 1.00 20.23 C ATOM 1269 CG MET A 473 -3.923 3.668 -10.821 1.00 70.01 C ATOM 1270 SD MET A 473 -3.991 1.947 -11.291 1.00 41.43 S ATOM 1271 CE MET A 473 -2.636 1.307 -10.322 1.00 35.15 C ATOM 0 H MET A 473 -6.125 4.730 -10.008 1.00 33.23 H new ATOM 0 HA MET A 473 -4.113 6.420 -10.958 1.00 42.31 H new ATOM 0 HB2 MET A 473 -5.463 4.020 -12.289 1.00 20.23 H new ATOM 0 HB3 MET A 473 -3.897 4.671 -12.730 1.00 20.23 H new ATOM 0 HG2 MET A 473 -2.886 3.975 -10.684 1.00 70.01 H new ATOM 0 HG3 MET A 473 -4.427 3.812 -9.866 1.00 70.01 H new ATOM 0 HE1 MET A 473 -2.353 0.324 -10.698 1.00 35.15 H new ATOM 0 HE2 MET A 473 -1.784 1.983 -10.396 1.00 35.15 H new ATOM 0 HE3 MET A 473 -2.942 1.223 -9.279 1.00 35.15 H new ATOM 1279 N MET A 474 -6.571 6.124 -13.138 1.00 71.53 N ATOM 1280 CA MET A 474 -7.260 6.804 -14.222 1.00 31.52 C ATOM 1281 C MET A 474 -7.895 8.107 -13.735 1.00 3.44 C ATOM 1282 O MET A 474 -8.254 8.966 -14.539 1.00 22.25 O ATOM 1283 CB MET A 474 -8.343 5.889 -14.792 1.00 3.35 C ATOM 1284 CG MET A 474 -9.451 5.645 -13.765 1.00 12.30 C ATOM 1285 SD MET A 474 -10.663 6.953 -13.852 1.00 55.12 S ATOM 1286 CE MET A 474 -11.615 6.592 -12.388 1.00 11.33 C ATOM 0 H MET A 474 -6.875 5.164 -12.975 1.00 71.53 H new ATOM 0 HA MET A 474 -6.532 7.044 -14.997 1.00 31.52 H new ATOM 0 HB2 MET A 474 -8.767 6.337 -15.690 1.00 3.35 H new ATOM 0 HB3 MET A 474 -7.901 4.938 -15.089 1.00 3.35 H new ATOM 0 HG2 MET A 474 -9.928 4.683 -13.954 1.00 12.30 H new ATOM 0 HG3 MET A 474 -9.025 5.599 -12.763 1.00 12.30 H new ATOM 0 HE1 MET A 474 -12.045 7.514 -11.997 1.00 11.33 H new ATOM 0 HE2 MET A 474 -12.416 5.896 -12.637 1.00 11.33 H new ATOM 0 HE3 MET A 474 -10.967 6.145 -11.634 1.00 11.33 H new ATOM 1294 N SER A 475 -8.017 8.213 -12.420 1.00 42.43 N ATOM 1295 CA SER A 475 -8.605 9.397 -11.816 1.00 33.21 C ATOM 1296 C SER A 475 -7.551 10.501 -11.693 1.00 23.43 C ATOM 1297 O SER A 475 -7.881 11.684 -11.708 1.00 0.21 O ATOM 1298 CB SER A 475 -9.201 9.079 -10.444 1.00 1.05 C ATOM 1299 OG SER A 475 -10.428 8.361 -10.549 1.00 4.31 O ATOM 0 H SER A 475 -7.719 7.499 -11.756 1.00 42.43 H new ATOM 0 HA SER A 475 -9.412 9.743 -12.461 1.00 33.21 H new ATOM 0 HB2 SER A 475 -8.487 8.494 -9.865 1.00 1.05 H new ATOM 0 HB3 SER A 475 -9.369 10.007 -9.898 1.00 1.05 H new ATOM 0 HG SER A 475 -10.314 7.463 -10.174 1.00 4.31 H new ATOM 1304 N ASN A 476 -6.303 10.071 -11.575 1.00 52.41 N ATOM 1305 CA ASN A 476 -5.198 11.006 -11.450 1.00 42.13 C ATOM 1306 C ASN A 476 -3.992 10.472 -12.225 1.00 45.30 C ATOM 1307 O ASN A 476 -3.186 9.720 -11.682 1.00 61.50 O ATOM 1308 CB ASN A 476 -4.783 11.176 -9.987 1.00 44.10 C ATOM 1309 CG ASN A 476 -3.429 11.880 -9.879 1.00 2.22 C ATOM 1310 OD1 ASN A 476 -2.857 12.334 -10.856 1.00 5.02 O ATOM 1311 ND2 ASN A 476 -2.951 11.946 -8.639 1.00 74.12 N ATOM 0 H ASN A 476 -6.033 9.087 -11.563 1.00 52.41 H new ATOM 0 HA ASN A 476 -5.524 11.968 -11.846 1.00 42.13 H new ATOM 0 HB2 ASN A 476 -5.540 11.753 -9.455 1.00 44.10 H new ATOM 0 HB3 ASN A 476 -4.729 10.200 -9.505 1.00 44.10 H new ATOM 0 HD21 ASN A 476 -2.054 12.398 -8.462 1.00 74.12 H new ATOM 0 HD22 ASN A 476 -3.482 11.545 -7.866 1.00 74.12 H new ATOM 1317 N LEU A 477 -3.908 10.882 -13.482 1.00 12.34 N ATOM 1318 CA LEU A 477 -2.814 10.455 -14.338 1.00 63.20 C ATOM 1319 C LEU A 477 -1.949 11.664 -14.695 1.00 13.21 C ATOM 1320 O LEU A 477 -0.815 11.509 -15.144 1.00 62.41 O ATOM 1321 CB LEU A 477 -3.350 9.699 -15.554 1.00 14.12 C ATOM 1322 CG LEU A 477 -4.427 8.649 -15.273 1.00 61.50 C ATOM 1323 CD1 LEU A 477 -5.294 8.407 -16.510 1.00 20.22 C ATOM 1324 CD2 LEU A 477 -3.804 7.354 -14.748 1.00 62.22 C ATOM 0 H LEU A 477 -4.580 11.506 -13.929 1.00 12.34 H new ATOM 0 HA LEU A 477 -2.171 9.749 -13.812 1.00 63.20 H new ATOM 0 HB2 LEU A 477 -3.755 10.426 -16.259 1.00 14.12 H new ATOM 0 HB3 LEU A 477 -2.512 9.207 -16.049 1.00 14.12 H new ATOM 0 HG LEU A 477 -5.083 9.033 -14.491 1.00 61.50 H new ATOM 0 HD11 LEU A 477 -6.051 7.657 -16.283 1.00 20.22 H new ATOM 0 HD12 LEU A 477 -5.781 9.338 -16.800 1.00 20.22 H new ATOM 0 HD13 LEU A 477 -4.668 8.054 -17.330 1.00 20.22 H new ATOM 0 HD21 LEU A 477 -4.590 6.624 -14.556 1.00 62.22 H new ATOM 0 HD22 LEU A 477 -3.112 6.956 -15.490 1.00 62.22 H new ATOM 0 HD23 LEU A 477 -3.265 7.558 -13.823 1.00 62.22 H new ATOM 1335 N THR A 478 -2.518 12.842 -14.482 1.00 61.51 N ATOM 1336 CA THR A 478 -1.812 14.078 -14.777 1.00 13.22 C ATOM 1337 C THR A 478 -0.742 14.346 -13.717 1.00 15.43 C ATOM 1338 O THR A 478 0.007 15.318 -13.818 1.00 4.25 O ATOM 1339 CB THR A 478 -2.848 15.197 -14.893 1.00 12.03 C ATOM 1340 OG1 THR A 478 -2.080 16.393 -14.793 1.00 60.30 O ATOM 1341 CG2 THR A 478 -3.785 15.255 -13.685 1.00 3.41 C ATOM 0 H THR A 478 -3.459 12.967 -14.109 1.00 61.51 H new ATOM 0 HA THR A 478 -1.276 14.013 -15.724 1.00 13.22 H new ATOM 0 HB THR A 478 -3.434 15.056 -15.801 1.00 12.03 H new ATOM 0 HG1 THR A 478 -1.126 16.171 -14.813 1.00 60.30 H new ATOM 0 HG21 THR A 478 -4.501 16.066 -13.818 1.00 3.41 H new ATOM 0 HG22 THR A 478 -4.321 14.310 -13.594 1.00 3.41 H new ATOM 0 HG23 THR A 478 -3.202 15.430 -12.781 1.00 3.41 H new ATOM 1349 N ARG A 479 -0.705 13.469 -12.725 1.00 61.24 N ATOM 1350 CA ARG A 479 0.262 13.601 -11.648 1.00 3.13 C ATOM 1351 C ARG A 479 1.352 12.536 -11.779 1.00 13.44 C ATOM 1352 O ARG A 479 2.489 12.846 -12.131 1.00 74.13 O ATOM 1353 CB ARG A 479 -0.414 13.461 -10.281 1.00 12.45 C ATOM 1354 CG ARG A 479 -1.578 14.445 -10.142 1.00 73.14 C ATOM 1355 CD ARG A 479 -1.096 15.786 -9.580 1.00 24.43 C ATOM 1356 NE ARG A 479 -0.036 16.346 -10.446 1.00 13.24 N ATOM 1357 CZ ARG A 479 -0.244 16.797 -11.702 1.00 44.34 C ATOM 1358 NH1 ARG A 479 -1.478 16.758 -12.248 1.00 32.13 N ATOM 1359 NH2 ARG A 479 0.777 17.278 -12.386 1.00 15.34 N ATOM 0 H ARG A 479 -1.328 12.665 -12.644 1.00 61.24 H new ATOM 0 HA ARG A 479 0.707 14.593 -11.723 1.00 3.13 H new ATOM 0 HB2 ARG A 479 -0.778 12.441 -10.154 1.00 12.45 H new ATOM 0 HB3 ARG A 479 0.315 13.640 -9.491 1.00 12.45 H new ATOM 0 HG2 ARG A 479 -2.046 14.601 -11.114 1.00 73.14 H new ATOM 0 HG3 ARG A 479 -2.339 14.024 -9.486 1.00 73.14 H new ATOM 0 HD2 ARG A 479 -1.931 16.484 -9.516 1.00 24.43 H new ATOM 0 HD3 ARG A 479 -0.716 15.650 -8.568 1.00 24.43 H new ATOM 0 HE ARG A 479 0.911 16.395 -10.071 1.00 13.24 H new ATOM 0 HH11 ARG A 479 -2.262 16.386 -11.711 1.00 32.13 H new ATOM 0 HH12 ARG A 479 -1.627 17.101 -13.197 1.00 32.13 H new ATOM 0 HH21 ARG A 479 1.706 17.305 -11.965 1.00 15.34 H new ATOM 0 HH22 ARG A 479 0.638 17.623 -13.336 1.00 15.34 H new ATOM 1369 N GLN A 480 0.968 11.302 -11.491 1.00 21.02 N ATOM 1370 CA GLN A 480 1.899 10.188 -11.572 1.00 72.25 C ATOM 1371 C GLN A 480 1.449 9.198 -12.648 1.00 62.13 C ATOM 1372 O GLN A 480 2.277 8.607 -13.338 1.00 21.14 O ATOM 1373 CB GLN A 480 2.047 9.497 -10.217 1.00 24.52 C ATOM 1374 CG GLN A 480 0.685 9.062 -9.671 1.00 20.44 C ATOM 1375 CD GLN A 480 0.000 10.212 -8.930 1.00 4.33 C ATOM 1376 OE1 GLN A 480 0.528 11.305 -8.803 1.00 25.03 O ATOM 1377 NE2 GLN A 480 -1.203 9.906 -8.452 1.00 72.14 N ATOM 0 H GLN A 480 0.024 11.048 -11.201 1.00 21.02 H new ATOM 0 HA GLN A 480 2.878 10.577 -11.851 1.00 72.25 H new ATOM 0 HB2 GLN A 480 2.697 8.628 -10.317 1.00 24.52 H new ATOM 0 HB3 GLN A 480 2.527 10.174 -9.510 1.00 24.52 H new ATOM 0 HG2 GLN A 480 0.051 8.724 -10.491 1.00 20.44 H new ATOM 0 HG3 GLN A 480 0.813 8.215 -8.997 1.00 20.44 H new ATOM 0 HE21 GLN A 480 -1.586 8.971 -8.594 1.00 72.14 H new ATOM 0 HE22 GLN A 480 -1.743 10.606 -7.943 1.00 72.14 H new ATOM 1384 N GLY A 481 0.136 9.048 -12.757 1.00 73.41 N ATOM 1385 CA GLY A 481 -0.434 8.140 -13.737 1.00 3.33 C ATOM 1386 C GLY A 481 0.369 6.838 -13.811 1.00 42.52 C ATOM 1387 O GLY A 481 0.767 6.411 -14.894 1.00 50.43 O ATOM 0 H GLY A 481 -0.548 9.540 -12.183 1.00 73.41 H new ATOM 0 HA2 GLY A 481 -1.469 7.919 -13.475 1.00 3.33 H new ATOM 0 HA3 GLY A 481 -0.449 8.619 -14.716 1.00 3.33 H new ATOM 1391 N SER A 482 0.581 6.245 -12.646 1.00 10.42 N ATOM 1392 CA SER A 482 1.328 5.001 -12.565 1.00 25.53 C ATOM 1393 C SER A 482 0.392 3.851 -12.185 1.00 40.03 C ATOM 1394 O SER A 482 0.069 3.672 -11.012 1.00 33.10 O ATOM 1395 CB SER A 482 2.472 5.110 -11.555 1.00 52.35 C ATOM 1396 OG SER A 482 3.618 4.367 -11.961 1.00 53.54 O ATOM 0 H SER A 482 0.249 6.602 -11.750 1.00 10.42 H new ATOM 0 HA SER A 482 1.762 4.799 -13.544 1.00 25.53 H new ATOM 0 HB2 SER A 482 2.746 6.158 -11.429 1.00 52.35 H new ATOM 0 HB3 SER A 482 2.133 4.750 -10.584 1.00 52.35 H new ATOM 0 HG SER A 482 4.326 4.464 -11.290 1.00 53.54 H new ATOM 1401 N PRO A 483 -0.026 3.083 -13.226 1.00 51.41 N ATOM 1402 CA PRO A 483 -0.918 1.957 -13.013 1.00 5.12 C ATOM 1403 C PRO A 483 -0.169 0.773 -12.396 1.00 43.43 C ATOM 1404 O PRO A 483 -0.757 -0.279 -12.149 1.00 34.31 O ATOM 1405 CB PRO A 483 -1.493 1.645 -14.385 1.00 42.24 C ATOM 1406 CG PRO A 483 -0.556 2.300 -15.387 1.00 12.30 C ATOM 1407 CD PRO A 483 0.337 3.266 -14.629 1.00 43.12 C ATOM 0 HA PRO A 483 -1.715 2.180 -12.303 1.00 5.12 H new ATOM 0 HB2 PRO A 483 -1.550 0.569 -14.549 1.00 42.24 H new ATOM 0 HB3 PRO A 483 -2.505 2.037 -14.483 1.00 42.24 H new ATOM 0 HG2 PRO A 483 0.044 1.546 -15.897 1.00 12.30 H new ATOM 0 HG3 PRO A 483 -1.125 2.827 -16.153 1.00 12.30 H new ATOM 0 HD2 PRO A 483 1.391 3.046 -14.797 1.00 43.12 H new ATOM 0 HD3 PRO A 483 0.171 4.294 -14.950 1.00 43.12 H new ATOM 1412 N ASP A 484 1.119 0.985 -12.164 1.00 13.41 N ATOM 1413 CA ASP A 484 1.953 -0.051 -11.580 1.00 45.03 C ATOM 1414 C ASP A 484 2.214 0.280 -10.109 1.00 25.11 C ATOM 1415 O ASP A 484 3.191 -0.192 -9.527 1.00 13.50 O ATOM 1416 CB ASP A 484 3.306 -0.135 -12.292 1.00 54.42 C ATOM 1417 CG ASP A 484 3.276 0.226 -13.778 1.00 54.40 C ATOM 1418 OD1 ASP A 484 2.429 -0.265 -14.539 1.00 54.22 O ATOM 1419 OD2 ASP A 484 4.183 1.063 -14.154 1.00 23.42 O ATOM 0 H ASP A 484 1.604 1.858 -12.370 1.00 13.41 H new ATOM 0 HA ASP A 484 1.431 -1.002 -11.683 1.00 45.03 H new ATOM 0 HB2 ASP A 484 4.008 0.528 -11.786 1.00 54.42 H new ATOM 0 HB3 ASP A 484 3.693 -1.149 -12.187 1.00 54.42 H new ATOM 1424 N CYS A 485 1.325 1.087 -9.549 1.00 14.00 N ATOM 1425 CA CYS A 485 1.448 1.485 -8.158 1.00 51.43 C ATOM 1426 C CYS A 485 0.589 0.543 -7.311 1.00 53.12 C ATOM 1427 O CYS A 485 0.038 0.950 -6.289 1.00 11.22 O ATOM 1428 CB CYS A 485 1.058 2.951 -7.953 1.00 21.34 C ATOM 1429 SG CYS A 485 2.540 4.017 -8.075 1.00 23.11 S ATOM 0 H CYS A 485 0.516 1.476 -10.034 1.00 14.00 H new ATOM 0 HA CYS A 485 2.489 1.406 -7.845 1.00 51.43 H new ATOM 0 HB2 CYS A 485 0.324 3.248 -8.702 1.00 21.34 H new ATOM 0 HB3 CYS A 485 0.588 3.078 -6.978 1.00 21.34 H new ATOM 0 HG CYS A 485 2.818 4.510 -6.904 1.00 23.11 H new ATOM 1434 N VAL A 486 0.505 -0.698 -7.767 1.00 51.33 N ATOM 1435 CA VAL A 486 -0.278 -1.701 -7.064 1.00 71.32 C ATOM 1436 C VAL A 486 0.639 -2.849 -6.640 1.00 22.11 C ATOM 1437 O VAL A 486 1.163 -3.576 -7.483 1.00 1.41 O ATOM 1438 CB VAL A 486 -1.446 -2.161 -7.938 1.00 15.11 C ATOM 1439 CG1 VAL A 486 -2.518 -2.856 -7.098 1.00 11.40 C ATOM 1440 CG2 VAL A 486 -2.038 -0.989 -8.724 1.00 1.13 C ATOM 0 H VAL A 486 0.966 -1.032 -8.614 1.00 51.33 H new ATOM 0 HA VAL A 486 -0.714 -1.280 -6.158 1.00 71.32 H new ATOM 0 HB VAL A 486 -1.062 -2.885 -8.656 1.00 15.11 H new ATOM 0 HG11 VAL A 486 -3.337 -3.173 -7.743 1.00 11.40 H new ATOM 0 HG12 VAL A 486 -2.086 -3.727 -6.605 1.00 11.40 H new ATOM 0 HG13 VAL A 486 -2.896 -2.164 -6.346 1.00 11.40 H new ATOM 0 HG21 VAL A 486 -2.867 -1.344 -9.337 1.00 1.13 H new ATOM 0 HG22 VAL A 486 -2.399 -0.231 -8.029 1.00 1.13 H new ATOM 0 HG23 VAL A 486 -1.270 -0.557 -9.366 1.00 1.13 H new ATOM 1450 N ILE A 487 0.807 -2.977 -5.332 1.00 64.13 N ATOM 1451 CA ILE A 487 1.653 -4.024 -4.783 1.00 1.53 C ATOM 1452 C ILE A 487 0.815 -4.927 -3.875 1.00 32.12 C ATOM 1453 O ILE A 487 0.654 -4.644 -2.690 1.00 40.35 O ATOM 1454 CB ILE A 487 2.875 -3.420 -4.090 1.00 15.15 C ATOM 1455 CG1 ILE A 487 3.282 -2.100 -4.748 1.00 35.21 C ATOM 1456 CG2 ILE A 487 4.032 -4.420 -4.048 1.00 20.11 C ATOM 1457 CD1 ILE A 487 3.837 -2.336 -6.155 1.00 24.24 C ATOM 0 H ILE A 487 0.371 -2.372 -4.636 1.00 64.13 H new ATOM 0 HA ILE A 487 2.048 -4.651 -5.582 1.00 1.53 H new ATOM 0 HB ILE A 487 2.606 -3.196 -3.058 1.00 15.15 H new ATOM 0 HG12 ILE A 487 2.420 -1.435 -4.800 1.00 35.21 H new ATOM 0 HG13 ILE A 487 4.033 -1.601 -4.136 1.00 35.21 H new ATOM 0 HG21 ILE A 487 4.888 -3.965 -3.550 1.00 20.11 H new ATOM 0 HG22 ILE A 487 3.724 -5.310 -3.499 1.00 20.11 H new ATOM 0 HG23 ILE A 487 4.309 -4.698 -5.065 1.00 20.11 H new ATOM 0 HD11 ILE A 487 4.119 -1.382 -6.600 1.00 24.24 H new ATOM 0 HD12 ILE A 487 4.713 -2.982 -6.097 1.00 24.24 H new ATOM 0 HD13 ILE A 487 3.075 -2.813 -6.771 1.00 24.24 H new ATOM 1468 N PRO A 488 0.289 -6.025 -4.483 1.00 13.21 N ATOM 1469 CA PRO A 488 -0.529 -6.970 -3.743 1.00 22.30 C ATOM 1470 C PRO A 488 0.335 -7.846 -2.831 1.00 73.23 C ATOM 1471 O PRO A 488 1.040 -8.734 -3.305 1.00 34.44 O ATOM 1472 CB PRO A 488 -1.268 -7.768 -4.805 1.00 70.24 C ATOM 1473 CG PRO A 488 -0.495 -7.557 -6.097 1.00 21.23 C ATOM 1474 CD PRO A 488 0.458 -6.393 -5.886 1.00 44.44 C ATOM 0 HA PRO A 488 -1.233 -6.480 -3.070 1.00 22.30 H new ATOM 0 HB2 PRO A 488 -1.308 -8.825 -4.542 1.00 70.24 H new ATOM 0 HB3 PRO A 488 -2.298 -7.425 -4.905 1.00 70.24 H new ATOM 0 HG2 PRO A 488 0.057 -8.459 -6.363 1.00 21.23 H new ATOM 0 HG3 PRO A 488 -1.178 -7.347 -6.920 1.00 21.23 H new ATOM 0 HD2 PRO A 488 1.488 -6.681 -6.099 1.00 44.44 H new ATOM 0 HD3 PRO A 488 0.217 -5.559 -6.546 1.00 44.44 H new ATOM 1479 N PHE A 489 0.250 -7.562 -1.540 1.00 22.33 N ATOM 1480 CA PHE A 489 1.015 -8.313 -0.558 1.00 73.11 C ATOM 1481 C PHE A 489 0.292 -9.605 -0.172 1.00 3.43 C ATOM 1482 O PHE A 489 -0.894 -9.766 -0.454 1.00 42.55 O ATOM 1483 CB PHE A 489 1.145 -7.425 0.681 1.00 0.43 C ATOM 1484 CG PHE A 489 2.395 -7.702 1.518 1.00 33.43 C ATOM 1485 CD1 PHE A 489 2.423 -8.761 2.370 1.00 30.33 C ATOM 1486 CD2 PHE A 489 3.480 -6.890 1.406 1.00 64.31 C ATOM 1487 CE1 PHE A 489 3.583 -9.019 3.146 1.00 60.24 C ATOM 1488 CE2 PHE A 489 4.642 -7.146 2.184 1.00 34.31 C ATOM 1489 CZ PHE A 489 4.669 -8.206 3.035 1.00 32.22 C ATOM 0 H PHE A 489 -0.336 -6.823 -1.151 1.00 22.33 H new ATOM 0 HA PHE A 489 1.988 -8.582 -0.970 1.00 73.11 H new ATOM 0 HB2 PHE A 489 1.154 -6.381 0.368 1.00 0.43 H new ATOM 0 HB3 PHE A 489 0.263 -7.562 1.307 1.00 0.43 H new ATOM 0 HD1 PHE A 489 1.562 -9.407 2.456 1.00 30.33 H new ATOM 0 HD2 PHE A 489 3.459 -6.051 0.726 1.00 64.31 H new ATOM 0 HE1 PHE A 489 3.604 -9.860 3.824 1.00 60.24 H new ATOM 0 HE2 PHE A 489 5.503 -6.499 2.099 1.00 34.31 H new ATOM 0 HZ PHE A 489 5.553 -8.403 3.623 1.00 32.22 H new ATOM 1498 N LEU A 490 1.038 -10.494 0.469 1.00 41.23 N ATOM 1499 CA LEU A 490 0.483 -11.766 0.898 1.00 14.11 C ATOM 1500 C LEU A 490 1.126 -12.176 2.224 1.00 22.03 C ATOM 1501 O LEU A 490 2.220 -12.737 2.241 1.00 41.43 O ATOM 1502 CB LEU A 490 0.631 -12.814 -0.207 1.00 34.01 C ATOM 1503 CG LEU A 490 -0.298 -14.026 -0.111 1.00 61.42 C ATOM 1504 CD1 LEU A 490 0.310 -15.114 0.777 1.00 41.35 C ATOM 1505 CD2 LEU A 490 -1.693 -13.611 0.362 1.00 4.13 C ATOM 0 H LEU A 490 2.022 -10.358 0.701 1.00 41.23 H new ATOM 0 HA LEU A 490 -0.588 -11.674 1.077 1.00 14.11 H new ATOM 0 HB2 LEU A 490 0.462 -12.327 -1.167 1.00 34.01 H new ATOM 0 HB3 LEU A 490 1.661 -13.170 -0.207 1.00 34.01 H new ATOM 0 HG LEU A 490 -0.410 -14.451 -1.108 1.00 61.42 H new ATOM 0 HD11 LEU A 490 -0.370 -15.964 0.828 1.00 41.35 H new ATOM 0 HD12 LEU A 490 1.263 -15.436 0.357 1.00 41.35 H new ATOM 0 HD13 LEU A 490 0.471 -14.717 1.779 1.00 41.35 H new ATOM 0 HD21 LEU A 490 -2.334 -14.491 0.422 1.00 4.13 H new ATOM 0 HD22 LEU A 490 -1.621 -13.147 1.346 1.00 4.13 H new ATOM 0 HD23 LEU A 490 -2.120 -12.899 -0.344 1.00 4.13 H new ATOM 1516 N PRO A 491 0.398 -11.875 3.333 1.00 13.33 N ATOM 1517 CA PRO A 491 0.885 -12.206 4.661 1.00 3.34 C ATOM 1518 C PRO A 491 0.748 -13.704 4.937 1.00 20.23 C ATOM 1519 O PRO A 491 -0.031 -14.392 4.279 1.00 24.24 O ATOM 1520 CB PRO A 491 0.061 -11.350 5.608 1.00 53.52 C ATOM 1521 CG PRO A 491 -1.167 -10.921 4.819 1.00 65.21 C ATOM 1522 CD PRO A 491 -0.903 -11.213 3.351 1.00 41.33 C ATOM 0 HA PRO A 491 1.948 -11.999 4.782 1.00 3.34 H new ATOM 0 HB2 PRO A 491 -0.223 -11.913 6.497 1.00 53.52 H new ATOM 0 HB3 PRO A 491 0.630 -10.484 5.947 1.00 53.52 H new ATOM 0 HG2 PRO A 491 -2.049 -11.461 5.163 1.00 65.21 H new ATOM 0 HG3 PRO A 491 -1.365 -9.859 4.968 1.00 65.21 H new ATOM 0 HD2 PRO A 491 -1.678 -11.852 2.929 1.00 41.33 H new ATOM 0 HD3 PRO A 491 -0.889 -10.296 2.761 1.00 41.33 H new ATOM 1527 N LEU A 492 1.519 -14.168 5.911 1.00 11.41 N ATOM 1528 CA LEU A 492 1.492 -15.573 6.283 1.00 53.44 C ATOM 1529 C LEU A 492 0.159 -15.892 6.962 1.00 74.04 C ATOM 1530 O LEU A 492 -0.161 -17.056 7.194 1.00 34.24 O ATOM 1531 CB LEU A 492 2.715 -15.924 7.133 1.00 13.44 C ATOM 1532 CG LEU A 492 4.077 -15.653 6.493 1.00 2.13 C ATOM 1533 CD1 LEU A 492 5.011 -14.940 7.472 1.00 52.50 C ATOM 1534 CD2 LEU A 492 4.694 -16.944 5.950 1.00 21.40 C ATOM 0 H LEU A 492 2.166 -13.596 6.454 1.00 11.41 H new ATOM 0 HA LEU A 492 1.556 -16.203 5.396 1.00 53.44 H new ATOM 0 HB2 LEU A 492 2.657 -15.364 8.066 1.00 13.44 H new ATOM 0 HB3 LEU A 492 2.661 -16.981 7.392 1.00 13.44 H new ATOM 0 HG LEU A 492 3.929 -14.985 5.645 1.00 2.13 H new ATOM 0 HD11 LEU A 492 5.973 -14.759 6.991 1.00 52.50 H new ATOM 0 HD12 LEU A 492 4.569 -13.989 7.769 1.00 52.50 H new ATOM 0 HD13 LEU A 492 5.158 -15.563 8.354 1.00 52.50 H new ATOM 0 HD21 LEU A 492 5.662 -16.723 5.500 1.00 21.40 H new ATOM 0 HD22 LEU A 492 4.826 -17.655 6.765 1.00 21.40 H new ATOM 0 HD23 LEU A 492 4.034 -17.374 5.197 1.00 21.40 H new ATOM 1545 N GLU A 493 -0.584 -14.837 7.261 1.00 40.14 N ATOM 1546 CA GLU A 493 -1.877 -14.989 7.908 1.00 63.35 C ATOM 1547 C GLU A 493 -2.946 -15.357 6.877 1.00 44.44 C ATOM 1548 O GLU A 493 -3.948 -15.985 7.216 1.00 41.24 O ATOM 1549 CB GLU A 493 -2.262 -13.720 8.669 1.00 61.23 C ATOM 1550 CG GLU A 493 -1.657 -13.718 10.075 1.00 44.22 C ATOM 1551 CD GLU A 493 -2.059 -14.977 10.846 1.00 24.00 C ATOM 1552 OE1 GLU A 493 -3.016 -15.663 10.458 1.00 34.12 O ATOM 1553 OE2 GLU A 493 -1.336 -15.234 11.883 1.00 63.01 O ATOM 0 H GLU A 493 -0.315 -13.872 7.067 1.00 40.14 H new ATOM 0 HA GLU A 493 -1.806 -15.799 8.633 1.00 63.35 H new ATOM 0 HB2 GLU A 493 -1.917 -12.844 8.120 1.00 61.23 H new ATOM 0 HB3 GLU A 493 -3.347 -13.647 8.736 1.00 61.23 H new ATOM 0 HG2 GLU A 493 -0.571 -13.660 10.007 1.00 44.22 H new ATOM 0 HG3 GLU A 493 -1.990 -12.833 10.617 1.00 44.22 H new ATOM 1559 N SER A 494 -2.696 -14.952 5.642 1.00 13.03 N ATOM 1560 CA SER A 494 -3.625 -15.231 4.561 1.00 34.15 C ATOM 1561 C SER A 494 -2.905 -15.968 3.429 1.00 1.23 C ATOM 1562 O SER A 494 -1.703 -16.217 3.512 1.00 74.43 O ATOM 1563 CB SER A 494 -4.262 -13.943 4.034 1.00 4.30 C ATOM 1564 OG SER A 494 -5.282 -13.458 4.904 1.00 21.30 O ATOM 0 H SER A 494 -1.863 -14.432 5.365 1.00 13.03 H new ATOM 0 HA SER A 494 -4.421 -15.865 4.951 1.00 34.15 H new ATOM 0 HB2 SER A 494 -3.493 -13.180 3.916 1.00 4.30 H new ATOM 0 HB3 SER A 494 -4.684 -14.125 3.046 1.00 4.30 H new ATOM 0 HG SER A 494 -4.875 -13.123 5.730 1.00 21.30 H new ATOM 1569 N SER A 495 -3.670 -16.295 2.397 1.00 43.14 N ATOM 1570 CA SER A 495 -3.120 -16.997 1.251 1.00 34.55 C ATOM 1571 C SER A 495 -3.846 -16.565 -0.025 1.00 12.04 C ATOM 1572 O SER A 495 -4.911 -15.954 0.040 1.00 31.41 O ATOM 1573 CB SER A 495 -3.222 -18.512 1.433 1.00 1.53 C ATOM 1574 OG SER A 495 -1.995 -19.080 1.881 1.00 34.40 O ATOM 0 H SER A 495 -4.666 -16.086 2.331 1.00 43.14 H new ATOM 0 HA SER A 495 -2.064 -16.739 1.166 1.00 34.55 H new ATOM 0 HB2 SER A 495 -4.010 -18.738 2.151 1.00 1.53 H new ATOM 0 HB3 SER A 495 -3.511 -18.972 0.488 1.00 1.53 H new ATOM 0 HG SER A 495 -2.102 -20.048 1.987 1.00 34.40 H new ATOM 1579 N PRO A 496 -3.224 -16.909 -1.184 1.00 75.34 N ATOM 1580 CA PRO A 496 -3.799 -16.564 -2.473 1.00 20.12 C ATOM 1581 C PRO A 496 -4.989 -17.469 -2.802 1.00 35.41 C ATOM 1582 O PRO A 496 -5.928 -17.045 -3.474 1.00 51.22 O ATOM 1583 CB PRO A 496 -2.656 -16.703 -3.464 1.00 15.11 C ATOM 1584 CG PRO A 496 -1.608 -17.563 -2.776 1.00 13.44 C ATOM 1585 CD PRO A 496 -1.962 -17.634 -1.299 1.00 41.52 C ATOM 0 HA PRO A 496 -4.206 -15.553 -2.495 1.00 20.12 H new ATOM 0 HB2 PRO A 496 -2.996 -17.168 -4.389 1.00 15.11 H new ATOM 0 HB3 PRO A 496 -2.248 -15.727 -3.729 1.00 15.11 H new ATOM 0 HG2 PRO A 496 -1.587 -18.562 -3.212 1.00 13.44 H new ATOM 0 HG3 PRO A 496 -0.614 -17.135 -2.911 1.00 13.44 H new ATOM 0 HD2 PRO A 496 -2.067 -18.667 -0.966 1.00 41.52 H new ATOM 0 HD3 PRO A 496 -1.186 -17.178 -0.684 1.00 41.52 H new ATOM 1590 N ALA A 497 -4.910 -18.697 -2.314 1.00 35.34 N ATOM 1591 CA ALA A 497 -5.969 -19.665 -2.547 1.00 72.42 C ATOM 1592 C ALA A 497 -7.248 -19.194 -1.854 1.00 61.55 C ATOM 1593 O ALA A 497 -8.349 -19.575 -2.246 1.00 73.11 O ATOM 1594 CB ALA A 497 -5.517 -21.044 -2.064 1.00 63.44 C ATOM 0 H ALA A 497 -4.129 -19.045 -1.758 1.00 35.34 H new ATOM 0 HA ALA A 497 -6.184 -19.748 -3.612 1.00 72.42 H new ATOM 0 HB1 ALA A 497 -6.312 -21.769 -2.239 1.00 63.44 H new ATOM 0 HB2 ALA A 497 -4.623 -21.346 -2.610 1.00 63.44 H new ATOM 0 HB3 ALA A 497 -5.293 -21.001 -0.998 1.00 63.44 H new ATOM 1600 N GLN A 498 -7.059 -18.370 -0.832 1.00 31.11 N ATOM 1601 CA GLN A 498 -8.184 -17.843 -0.079 1.00 64.33 C ATOM 1602 C GLN A 498 -8.899 -16.757 -0.884 1.00 45.33 C ATOM 1603 O GLN A 498 -9.978 -16.305 -0.502 1.00 14.54 O ATOM 1604 CB GLN A 498 -7.731 -17.309 1.283 1.00 74.52 C ATOM 1605 CG GLN A 498 -6.538 -18.106 1.814 1.00 21.42 C ATOM 1606 CD GLN A 498 -6.545 -18.147 3.344 1.00 22.13 C ATOM 1607 OE1 GLN A 498 -6.118 -17.223 4.017 1.00 31.05 O ATOM 1608 NE2 GLN A 498 -7.052 -19.266 3.853 1.00 12.11 N ATOM 0 H GLN A 498 -6.144 -18.055 -0.509 1.00 31.11 H new ATOM 0 HA GLN A 498 -8.888 -18.656 0.102 1.00 64.33 H new ATOM 0 HB2 GLN A 498 -7.460 -16.257 1.193 1.00 74.52 H new ATOM 0 HB3 GLN A 498 -8.556 -17.366 1.993 1.00 74.52 H new ATOM 0 HG2 GLN A 498 -6.569 -19.121 1.419 1.00 21.42 H new ATOM 0 HG3 GLN A 498 -5.610 -17.656 1.463 1.00 21.42 H new ATOM 0 HE21 GLN A 498 -7.392 -20.000 3.232 1.00 12.11 H new ATOM 0 HE22 GLN A 498 -7.101 -19.390 4.864 1.00 12.11 H new ATOM 1615 N LEU A 499 -8.268 -16.367 -1.982 1.00 11.42 N ATOM 1616 CA LEU A 499 -8.832 -15.342 -2.844 1.00 61.42 C ATOM 1617 C LEU A 499 -9.543 -16.006 -4.023 1.00 5.11 C ATOM 1618 O LEU A 499 -9.324 -17.185 -4.300 1.00 43.43 O ATOM 1619 CB LEU A 499 -7.751 -14.341 -3.263 1.00 2.15 C ATOM 1620 CG LEU A 499 -6.690 -14.020 -2.208 1.00 43.05 C ATOM 1621 CD1 LEU A 499 -5.828 -12.833 -2.643 1.00 63.44 C ATOM 1622 CD2 LEU A 499 -7.331 -13.791 -0.838 1.00 64.45 C ATOM 0 H LEU A 499 -7.372 -16.742 -2.294 1.00 11.42 H new ATOM 0 HA LEU A 499 -9.582 -14.762 -2.305 1.00 61.42 H new ATOM 0 HB2 LEU A 499 -7.248 -14.729 -4.149 1.00 2.15 H new ATOM 0 HB3 LEU A 499 -8.238 -13.411 -3.554 1.00 2.15 H new ATOM 0 HG LEU A 499 -6.029 -14.882 -2.114 1.00 43.05 H new ATOM 0 HD11 LEU A 499 -5.082 -12.625 -1.876 1.00 63.44 H new ATOM 0 HD12 LEU A 499 -5.327 -13.071 -3.581 1.00 63.44 H new ATOM 0 HD13 LEU A 499 -6.460 -11.956 -2.782 1.00 63.44 H new ATOM 0 HD21 LEU A 499 -6.555 -13.565 -0.107 1.00 64.45 H new ATOM 0 HD22 LEU A 499 -8.028 -12.955 -0.898 1.00 64.45 H new ATOM 0 HD23 LEU A 499 -7.867 -14.690 -0.532 1.00 64.45 H new ATOM 1633 N SER A 500 -10.382 -15.223 -4.685 1.00 2.24 N ATOM 1634 CA SER A 500 -11.128 -15.722 -5.827 1.00 22.23 C ATOM 1635 C SER A 500 -10.167 -16.085 -6.962 1.00 51.11 C ATOM 1636 O SER A 500 -9.085 -15.510 -7.071 1.00 54.30 O ATOM 1637 CB SER A 500 -12.152 -14.693 -6.309 1.00 10.31 C ATOM 1638 OG SER A 500 -13.385 -14.797 -5.603 1.00 41.30 O ATOM 0 H SER A 500 -10.562 -14.246 -4.452 1.00 2.24 H new ATOM 0 HA SER A 500 -11.669 -16.616 -5.517 1.00 22.23 H new ATOM 0 HB2 SER A 500 -11.745 -13.690 -6.182 1.00 10.31 H new ATOM 0 HB3 SER A 500 -12.332 -14.832 -7.375 1.00 10.31 H new ATOM 0 HG SER A 500 -14.012 -14.122 -5.938 1.00 41.30 H new ATOM 1643 N SER A 501 -10.596 -17.036 -7.777 1.00 15.21 N ATOM 1644 CA SER A 501 -9.788 -17.481 -8.900 1.00 30.02 C ATOM 1645 C SER A 501 -9.572 -16.326 -9.880 1.00 64.15 C ATOM 1646 O SER A 501 -8.724 -16.412 -10.767 1.00 41.24 O ATOM 1647 CB SER A 501 -10.441 -18.667 -9.613 1.00 45.33 C ATOM 1648 OG SER A 501 -9.502 -19.405 -10.391 1.00 42.50 O ATOM 0 H SER A 501 -11.493 -17.512 -7.683 1.00 15.21 H new ATOM 0 HA SER A 501 -8.822 -17.809 -8.517 1.00 30.02 H new ATOM 0 HB2 SER A 501 -10.898 -19.326 -8.875 1.00 45.33 H new ATOM 0 HB3 SER A 501 -11.242 -18.306 -10.258 1.00 45.33 H new ATOM 0 HG SER A 501 -8.879 -18.786 -10.826 1.00 42.50 H new ATOM 1653 N ASP A 502 -10.354 -15.275 -9.686 1.00 33.34 N ATOM 1654 CA ASP A 502 -10.258 -14.104 -10.543 1.00 11.14 C ATOM 1655 C ASP A 502 -9.149 -13.187 -10.024 1.00 21.43 C ATOM 1656 O ASP A 502 -8.448 -12.550 -10.809 1.00 44.24 O ATOM 1657 CB ASP A 502 -11.567 -13.311 -10.540 1.00 2.43 C ATOM 1658 CG ASP A 502 -12.709 -13.944 -11.339 1.00 20.41 C ATOM 1659 OD1 ASP A 502 -12.555 -14.270 -12.525 1.00 24.30 O ATOM 1660 OD2 ASP A 502 -13.809 -14.102 -10.684 1.00 33.41 O ATOM 0 H ASP A 502 -11.056 -15.209 -8.949 1.00 33.34 H new ATOM 0 HA ASP A 502 -10.044 -14.444 -11.556 1.00 11.14 H new ATOM 0 HB2 ASP A 502 -11.894 -13.182 -9.508 1.00 2.43 H new ATOM 0 HB3 ASP A 502 -11.372 -12.316 -10.940 1.00 2.43 H new ATOM 1665 N THR A 503 -9.025 -13.149 -8.706 1.00 24.54 N ATOM 1666 CA THR A 503 -8.012 -12.322 -8.072 1.00 74.23 C ATOM 1667 C THR A 503 -6.684 -12.437 -8.823 1.00 64.03 C ATOM 1668 O THR A 503 -6.054 -11.428 -9.137 1.00 74.52 O ATOM 1669 CB THR A 503 -7.918 -12.731 -6.602 1.00 62.12 C ATOM 1670 OG1 THR A 503 -9.160 -12.312 -6.044 1.00 73.34 O ATOM 1671 CG2 THR A 503 -6.871 -11.921 -5.833 1.00 53.32 C ATOM 0 H THR A 503 -9.610 -13.678 -8.059 1.00 24.54 H new ATOM 0 HA THR A 503 -8.281 -11.266 -8.112 1.00 74.23 H new ATOM 0 HB THR A 503 -7.675 -13.792 -6.536 1.00 62.12 H new ATOM 0 HG1 THR A 503 -9.034 -12.087 -5.099 1.00 73.34 H new ATOM 0 HG21 THR A 503 -6.846 -12.252 -4.795 1.00 53.32 H new ATOM 0 HG22 THR A 503 -5.891 -12.071 -6.286 1.00 53.32 H new ATOM 0 HG23 THR A 503 -7.130 -10.863 -5.870 1.00 53.32 H new ATOM 1679 N ALA A 504 -6.295 -13.676 -9.086 1.00 54.00 N ATOM 1680 CA ALA A 504 -5.053 -13.936 -9.793 1.00 21.45 C ATOM 1681 C ALA A 504 -5.020 -13.110 -11.081 1.00 50.22 C ATOM 1682 O ALA A 504 -3.975 -12.582 -11.457 1.00 11.24 O ATOM 1683 CB ALA A 504 -4.923 -15.438 -10.061 1.00 63.43 C ATOM 0 H ALA A 504 -6.818 -14.511 -8.822 1.00 54.00 H new ATOM 0 HA ALA A 504 -4.198 -13.636 -9.188 1.00 21.45 H new ATOM 0 HB1 ALA A 504 -3.991 -15.634 -10.592 1.00 63.43 H new ATOM 0 HB2 ALA A 504 -4.922 -15.978 -9.114 1.00 63.43 H new ATOM 0 HB3 ALA A 504 -5.764 -15.773 -10.668 1.00 63.43 H new ATOM 1689 N SER A 505 -6.177 -13.024 -11.719 1.00 54.05 N ATOM 1690 CA SER A 505 -6.295 -12.271 -12.957 1.00 30.42 C ATOM 1691 C SER A 505 -6.438 -10.780 -12.649 1.00 75.14 C ATOM 1692 O SER A 505 -6.136 -9.936 -13.494 1.00 53.45 O ATOM 1693 CB SER A 505 -7.483 -12.758 -13.788 1.00 22.11 C ATOM 1694 OG SER A 505 -7.486 -12.196 -15.096 1.00 33.31 O ATOM 0 H SER A 505 -7.042 -13.463 -11.403 1.00 54.05 H new ATOM 0 HA SER A 505 -5.389 -12.430 -13.542 1.00 30.42 H new ATOM 0 HB2 SER A 505 -7.453 -13.845 -13.861 1.00 22.11 H new ATOM 0 HB3 SER A 505 -8.412 -12.498 -13.280 1.00 22.11 H new ATOM 0 HG SER A 505 -8.259 -12.533 -15.595 1.00 33.31 H new ATOM 1699 N LEU A 506 -6.896 -10.499 -11.439 1.00 51.45 N ATOM 1700 CA LEU A 506 -7.083 -9.122 -11.010 1.00 62.30 C ATOM 1701 C LEU A 506 -5.717 -8.455 -10.844 1.00 25.32 C ATOM 1702 O LEU A 506 -5.537 -7.297 -11.216 1.00 52.41 O ATOM 1703 CB LEU A 506 -7.952 -9.066 -9.752 1.00 10.12 C ATOM 1704 CG LEU A 506 -9.378 -9.600 -9.898 1.00 3.34 C ATOM 1705 CD1 LEU A 506 -10.071 -9.692 -8.537 1.00 45.52 C ATOM 1706 CD2 LEU A 506 -10.180 -8.759 -10.893 1.00 62.40 C ATOM 0 H LEU A 506 -7.144 -11.201 -10.741 1.00 51.45 H new ATOM 0 HA LEU A 506 -7.624 -8.557 -11.768 1.00 62.30 H new ATOM 0 HB2 LEU A 506 -7.453 -9.630 -8.964 1.00 10.12 H new ATOM 0 HB3 LEU A 506 -8.006 -8.030 -9.417 1.00 10.12 H new ATOM 0 HG LEU A 506 -9.324 -10.611 -10.301 1.00 3.34 H new ATOM 0 HD11 LEU A 506 -11.083 -10.074 -8.669 1.00 45.52 H new ATOM 0 HD12 LEU A 506 -9.511 -10.365 -7.888 1.00 45.52 H new ATOM 0 HD13 LEU A 506 -10.114 -8.702 -8.083 1.00 45.52 H new ATOM 0 HD21 LEU A 506 -11.190 -9.160 -10.978 1.00 62.40 H new ATOM 0 HD22 LEU A 506 -10.228 -7.728 -10.543 1.00 62.40 H new ATOM 0 HD23 LEU A 506 -9.695 -8.789 -11.869 1.00 62.40 H new ATOM 1717 N LEU A 507 -4.786 -9.215 -10.284 1.00 42.31 N ATOM 1718 CA LEU A 507 -3.441 -8.712 -10.064 1.00 42.10 C ATOM 1719 C LEU A 507 -2.441 -9.602 -10.804 1.00 54.42 C ATOM 1720 O LEU A 507 -1.276 -9.686 -10.418 1.00 33.32 O ATOM 1721 CB LEU A 507 -3.156 -8.580 -8.566 1.00 54.52 C ATOM 1722 CG LEU A 507 -3.387 -9.839 -7.727 1.00 1.11 C ATOM 1723 CD1 LEU A 507 -4.859 -9.975 -7.335 1.00 13.44 C ATOM 1724 CD2 LEU A 507 -2.869 -11.084 -8.451 1.00 73.21 C ATOM 0 H LEU A 507 -4.937 -10.176 -9.976 1.00 42.31 H new ATOM 0 HA LEU A 507 -3.339 -7.707 -10.474 1.00 42.10 H new ATOM 0 HB2 LEU A 507 -2.119 -8.268 -8.439 1.00 54.52 H new ATOM 0 HB3 LEU A 507 -3.780 -7.781 -8.166 1.00 54.52 H new ATOM 0 HG LEU A 507 -2.816 -9.743 -6.804 1.00 1.11 H new ATOM 0 HD11 LEU A 507 -4.995 -10.878 -6.740 1.00 13.44 H new ATOM 0 HD12 LEU A 507 -5.162 -9.106 -6.751 1.00 13.44 H new ATOM 0 HD13 LEU A 507 -5.471 -10.038 -8.235 1.00 13.44 H new ATOM 0 HD21 LEU A 507 -3.046 -11.964 -7.833 1.00 73.21 H new ATOM 0 HD22 LEU A 507 -3.392 -11.197 -9.401 1.00 73.21 H new ATOM 0 HD23 LEU A 507 -1.800 -10.979 -8.636 1.00 73.21 H new ATOM 1735 N SER A 508 -2.933 -10.242 -11.856 1.00 64.42 N ATOM 1736 CA SER A 508 -2.096 -11.122 -12.653 1.00 13.22 C ATOM 1737 C SER A 508 -0.881 -10.356 -13.179 1.00 40.34 C ATOM 1738 O SER A 508 -1.002 -9.548 -14.099 1.00 54.41 O ATOM 1739 CB SER A 508 -2.885 -11.728 -13.815 1.00 52.24 C ATOM 1740 OG SER A 508 -2.095 -11.842 -14.995 1.00 30.21 O ATOM 0 H SER A 508 -3.899 -10.168 -12.174 1.00 64.42 H new ATOM 0 HA SER A 508 -1.754 -11.938 -12.016 1.00 13.22 H new ATOM 0 HB2 SER A 508 -3.253 -12.713 -13.529 1.00 52.24 H new ATOM 0 HB3 SER A 508 -3.758 -11.109 -14.022 1.00 52.24 H new ATOM 0 HG SER A 508 -2.634 -12.234 -15.713 1.00 30.21 H new ATOM 1745 N GLY A 509 0.263 -10.634 -12.571 1.00 52.35 N ATOM 1746 CA GLY A 509 1.499 -9.981 -12.967 1.00 24.11 C ATOM 1747 C GLY A 509 2.060 -9.131 -11.824 1.00 24.53 C ATOM 1748 O GLY A 509 3.254 -9.187 -11.533 1.00 2.14 O ATOM 0 H GLY A 509 0.360 -11.303 -11.807 1.00 52.35 H new ATOM 0 HA2 GLY A 509 2.233 -10.731 -13.261 1.00 24.11 H new ATOM 0 HA3 GLY A 509 1.319 -9.352 -13.839 1.00 24.11 H new ATOM 1752 N LEU A 510 1.172 -8.367 -11.205 1.00 60.35 N ATOM 1753 CA LEU A 510 1.565 -7.508 -10.102 1.00 22.20 C ATOM 1754 C LEU A 510 2.559 -8.254 -9.209 1.00 22.20 C ATOM 1755 O LEU A 510 2.327 -9.404 -8.840 1.00 10.44 O ATOM 1756 CB LEU A 510 0.330 -6.999 -9.354 1.00 34.41 C ATOM 1757 CG LEU A 510 -0.594 -6.068 -10.142 1.00 23.13 C ATOM 1758 CD1 LEU A 510 -1.690 -5.495 -9.242 1.00 51.24 C ATOM 1759 CD2 LEU A 510 0.206 -4.968 -10.843 1.00 14.41 C ATOM 0 H LEU A 510 0.182 -8.325 -11.447 1.00 60.35 H new ATOM 0 HA LEU A 510 2.074 -6.619 -10.474 1.00 22.20 H new ATOM 0 HB2 LEU A 510 -0.251 -7.860 -9.023 1.00 34.41 H new ATOM 0 HB3 LEU A 510 0.663 -6.475 -8.458 1.00 34.41 H new ATOM 0 HG LEU A 510 -1.088 -6.652 -10.919 1.00 23.13 H new ATOM 0 HD11 LEU A 510 -2.333 -4.837 -9.826 1.00 51.24 H new ATOM 0 HD12 LEU A 510 -2.284 -6.310 -8.829 1.00 51.24 H new ATOM 0 HD13 LEU A 510 -1.235 -4.930 -8.429 1.00 51.24 H new ATOM 0 HD21 LEU A 510 -0.474 -4.320 -11.396 1.00 14.41 H new ATOM 0 HD22 LEU A 510 0.744 -4.380 -10.100 1.00 14.41 H new ATOM 0 HD23 LEU A 510 0.918 -5.420 -11.533 1.00 14.41 H new ATOM 1770 N VAL A 511 3.647 -7.569 -8.888 1.00 60.41 N ATOM 1771 CA VAL A 511 4.677 -8.153 -8.045 1.00 75.25 C ATOM 1772 C VAL A 511 4.082 -8.488 -6.677 1.00 60.11 C ATOM 1773 O VAL A 511 4.097 -7.659 -5.768 1.00 34.52 O ATOM 1774 CB VAL A 511 5.879 -7.209 -7.961 1.00 42.14 C ATOM 1775 CG1 VAL A 511 6.690 -7.469 -6.690 1.00 22.40 C ATOM 1776 CG2 VAL A 511 6.759 -7.328 -9.207 1.00 40.42 C ATOM 0 H VAL A 511 3.838 -6.616 -9.196 1.00 60.41 H new ATOM 0 HA VAL A 511 5.042 -9.085 -8.476 1.00 75.25 H new ATOM 0 HB VAL A 511 5.501 -6.188 -7.916 1.00 42.14 H new ATOM 0 HG11 VAL A 511 7.538 -6.786 -6.654 1.00 22.40 H new ATOM 0 HG12 VAL A 511 6.058 -7.310 -5.816 1.00 22.40 H new ATOM 0 HG13 VAL A 511 7.052 -8.497 -6.693 1.00 22.40 H new ATOM 0 HG21 VAL A 511 7.605 -6.647 -9.121 1.00 40.42 H new ATOM 0 HG22 VAL A 511 7.124 -8.351 -9.298 1.00 40.42 H new ATOM 0 HG23 VAL A 511 6.175 -7.071 -10.091 1.00 40.42 H new ATOM 1786 N ARG A 512 3.572 -9.707 -6.572 1.00 62.15 N ATOM 1787 CA ARG A 512 2.973 -10.162 -5.329 1.00 33.31 C ATOM 1788 C ARG A 512 4.037 -10.273 -4.236 1.00 72.01 C ATOM 1789 O ARG A 512 5.057 -10.935 -4.421 1.00 10.23 O ATOM 1790 CB ARG A 512 2.295 -11.522 -5.511 1.00 21.41 C ATOM 1791 CG ARG A 512 1.197 -11.732 -4.466 1.00 61.23 C ATOM 1792 CD ARG A 512 0.492 -13.073 -4.674 1.00 31.21 C ATOM 1793 NE ARG A 512 1.215 -14.143 -3.953 1.00 25.21 N ATOM 1794 CZ ARG A 512 2.243 -14.846 -4.473 1.00 1.25 C ATOM 1795 NH1 ARG A 512 2.679 -14.598 -5.727 1.00 42.55 N ATOM 1796 NH2 ARG A 512 2.817 -15.781 -3.739 1.00 41.52 N ATOM 0 H ARG A 512 3.561 -10.393 -7.327 1.00 62.15 H new ATOM 0 HA ARG A 512 2.221 -9.429 -5.035 1.00 33.31 H new ATOM 0 HB2 ARG A 512 1.867 -11.588 -6.511 1.00 21.41 H new ATOM 0 HB3 ARG A 512 3.037 -12.316 -5.429 1.00 21.41 H new ATOM 0 HG2 ARG A 512 1.630 -11.696 -3.466 1.00 61.23 H new ATOM 0 HG3 ARG A 512 0.471 -10.922 -4.528 1.00 61.23 H new ATOM 0 HD2 ARG A 512 -0.536 -13.012 -4.316 1.00 31.21 H new ATOM 0 HD3 ARG A 512 0.445 -13.307 -5.737 1.00 31.21 H new ATOM 0 HE ARG A 512 0.918 -14.364 -3.003 1.00 25.21 H new ATOM 0 HH11 ARG A 512 2.231 -13.874 -6.289 1.00 42.55 H new ATOM 0 HH12 ARG A 512 3.457 -15.134 -6.112 1.00 42.55 H new ATOM 0 HH21 ARG A 512 2.482 -15.964 -2.793 1.00 41.52 H new ATOM 0 HH22 ARG A 512 3.595 -16.321 -4.118 1.00 41.52 H new ATOM 1806 N LEU A 513 3.764 -9.613 -3.119 1.00 13.12 N ATOM 1807 CA LEU A 513 4.685 -9.628 -1.996 1.00 35.31 C ATOM 1808 C LEU A 513 4.298 -10.758 -1.040 1.00 31.33 C ATOM 1809 O LEU A 513 3.115 -10.999 -0.805 1.00 41.03 O ATOM 1810 CB LEU A 513 4.742 -8.251 -1.331 1.00 11.13 C ATOM 1811 CG LEU A 513 5.802 -7.288 -1.871 1.00 31.25 C ATOM 1812 CD1 LEU A 513 6.082 -7.555 -3.351 1.00 22.33 C ATOM 1813 CD2 LEU A 513 5.402 -5.835 -1.617 1.00 45.21 C ATOM 0 H LEU A 513 2.917 -9.064 -2.969 1.00 13.12 H new ATOM 0 HA LEU A 513 5.700 -9.833 -2.338 1.00 35.31 H new ATOM 0 HB2 LEU A 513 3.765 -7.779 -1.434 1.00 11.13 H new ATOM 0 HB3 LEU A 513 4.917 -8.392 -0.264 1.00 11.13 H new ATOM 0 HG LEU A 513 6.732 -7.465 -1.330 1.00 31.25 H new ATOM 0 HD11 LEU A 513 6.839 -6.857 -3.710 1.00 22.33 H new ATOM 0 HD12 LEU A 513 6.442 -8.576 -3.475 1.00 22.33 H new ATOM 0 HD13 LEU A 513 5.165 -7.422 -3.925 1.00 22.33 H new ATOM 0 HD21 LEU A 513 6.172 -5.172 -2.010 1.00 45.21 H new ATOM 0 HD22 LEU A 513 4.455 -5.626 -2.114 1.00 45.21 H new ATOM 0 HD23 LEU A 513 5.293 -5.670 -0.545 1.00 45.21 H new ATOM 1824 N ASP A 514 5.318 -11.419 -0.515 1.00 4.33 N ATOM 1825 CA ASP A 514 5.099 -12.519 0.412 1.00 53.20 C ATOM 1826 C ASP A 514 6.179 -12.490 1.495 1.00 51.34 C ATOM 1827 O ASP A 514 7.308 -12.074 1.240 1.00 41.01 O ATOM 1828 CB ASP A 514 5.185 -13.869 -0.306 1.00 51.45 C ATOM 1829 CG ASP A 514 4.043 -14.155 -1.281 1.00 53.20 C ATOM 1830 OD1 ASP A 514 3.564 -15.295 -1.387 1.00 50.22 O ATOM 1831 OD2 ASP A 514 3.638 -13.137 -1.963 1.00 74.41 O ATOM 0 H ASP A 514 6.298 -11.216 -0.712 1.00 4.33 H new ATOM 0 HA ASP A 514 4.106 -12.403 0.845 1.00 53.20 H new ATOM 0 HB2 ASP A 514 6.128 -13.915 -0.851 1.00 51.45 H new ATOM 0 HB3 ASP A 514 5.211 -14.661 0.443 1.00 51.45 H new ATOM 1836 N GLU A 515 5.792 -12.936 2.681 1.00 61.21 N ATOM 1837 CA GLU A 515 6.713 -12.966 3.805 1.00 21.30 C ATOM 1838 C GLU A 515 7.550 -14.246 3.772 1.00 14.24 C ATOM 1839 O GLU A 515 8.695 -14.257 4.220 1.00 54.43 O ATOM 1840 CB GLU A 515 5.964 -12.835 5.132 1.00 12.24 C ATOM 1841 CG GLU A 515 5.013 -11.638 5.108 1.00 43.33 C ATOM 1842 CD GLU A 515 5.788 -10.320 5.161 1.00 52.32 C ATOM 1843 OE1 GLU A 515 6.727 -10.120 4.375 1.00 22.34 O ATOM 1844 OE2 GLU A 515 5.385 -9.485 6.058 1.00 44.43 O ATOM 0 H GLU A 515 4.854 -13.279 2.888 1.00 61.21 H new ATOM 0 HA GLU A 515 7.386 -12.113 3.720 1.00 21.30 H new ATOM 0 HB2 GLU A 515 5.401 -13.748 5.328 1.00 12.24 H new ATOM 0 HB3 GLU A 515 6.678 -12.720 5.947 1.00 12.24 H new ATOM 0 HG2 GLU A 515 4.405 -11.670 4.204 1.00 43.33 H new ATOM 0 HG3 GLU A 515 4.329 -11.696 5.954 1.00 43.33 H new ATOM 1850 N HIS A 516 6.945 -15.298 3.236 1.00 41.15 N ATOM 1851 CA HIS A 516 7.620 -16.580 3.140 1.00 55.40 C ATOM 1852 C HIS A 516 8.452 -16.626 1.855 1.00 65.13 C ATOM 1853 O HIS A 516 9.030 -17.660 1.524 1.00 50.04 O ATOM 1854 CB HIS A 516 6.615 -17.730 3.235 1.00 22.21 C ATOM 1855 CG HIS A 516 5.329 -17.487 2.484 1.00 11.31 C ATOM 1856 ND1 HIS A 516 4.089 -17.850 2.980 1.00 22.24 N ATOM 1857 CD2 HIS A 516 5.102 -16.912 1.267 1.00 25.03 C ATOM 1858 CE1 HIS A 516 3.166 -17.507 2.095 1.00 33.12 C ATOM 1859 NE2 HIS A 516 3.796 -16.927 1.033 1.00 55.24 N ATOM 0 H HIS A 516 5.995 -15.287 2.864 1.00 41.15 H new ATOM 0 HA HIS A 516 8.304 -16.700 3.980 1.00 55.40 H new ATOM 0 HB2 HIS A 516 7.081 -18.638 2.852 1.00 22.21 H new ATOM 0 HB3 HIS A 516 6.382 -17.909 4.285 1.00 22.21 H new ATOM 0 HD2 HIS A 516 5.857 -16.513 0.607 1.00 25.03 H new ATOM 0 HE1 HIS A 516 2.102 -17.660 2.196 1.00 33.12 H new ATOM 0 HE2 HIS A 516 3.338 -16.564 0.197 1.00 55.24 H new ATOM 1866 N SER A 517 8.486 -15.493 1.171 1.00 13.11 N ATOM 1867 CA SER A 517 9.238 -15.392 -0.070 1.00 64.40 C ATOM 1868 C SER A 517 10.635 -14.834 0.211 1.00 43.24 C ATOM 1869 O SER A 517 10.775 -13.716 0.703 1.00 52.24 O ATOM 1870 CB SER A 517 8.508 -14.510 -1.085 1.00 62.35 C ATOM 1871 OG SER A 517 9.374 -14.069 -2.127 1.00 33.15 O ATOM 0 H SER A 517 8.006 -14.637 1.451 1.00 13.11 H new ATOM 0 HA SER A 517 9.331 -16.390 -0.498 1.00 64.40 H new ATOM 0 HB2 SER A 517 7.675 -15.066 -1.516 1.00 62.35 H new ATOM 0 HB3 SER A 517 8.084 -13.645 -0.575 1.00 62.35 H new ATOM 0 HG SER A 517 8.871 -13.510 -2.756 1.00 33.15 H new ATOM 1876 N GLN A 518 11.635 -15.641 -0.113 1.00 44.24 N ATOM 1877 CA GLN A 518 13.016 -15.243 0.098 1.00 54.33 C ATOM 1878 C GLN A 518 13.440 -14.218 -0.956 1.00 31.02 C ATOM 1879 O GLN A 518 14.567 -13.727 -0.933 1.00 20.00 O ATOM 1880 CB GLN A 518 13.945 -16.458 0.087 1.00 34.43 C ATOM 1881 CG GLN A 518 14.018 -17.079 -1.310 1.00 73.00 C ATOM 1882 CD GLN A 518 12.945 -18.156 -1.489 1.00 34.40 C ATOM 1883 OE1 GLN A 518 12.647 -18.925 -0.591 1.00 50.32 O ATOM 1884 NE2 GLN A 518 12.385 -18.166 -2.696 1.00 41.43 N ATOM 0 H GLN A 518 11.516 -16.569 -0.520 1.00 44.24 H new ATOM 0 HA GLN A 518 13.093 -14.778 1.081 1.00 54.33 H new ATOM 0 HB2 GLN A 518 14.943 -16.160 0.409 1.00 34.43 H new ATOM 0 HB3 GLN A 518 13.588 -17.200 0.801 1.00 34.43 H new ATOM 0 HG2 GLN A 518 13.888 -16.303 -2.064 1.00 73.00 H new ATOM 0 HG3 GLN A 518 15.005 -17.514 -1.467 1.00 73.00 H new ATOM 0 HE21 GLN A 518 12.683 -17.493 -3.402 1.00 41.43 H new ATOM 0 HE22 GLN A 518 11.658 -18.847 -2.915 1.00 41.43 H new ATOM 1891 N ILE A 519 12.514 -13.927 -1.857 1.00 61.02 N ATOM 1892 CA ILE A 519 12.777 -12.969 -2.918 1.00 34.13 C ATOM 1893 C ILE A 519 11.956 -11.702 -2.673 1.00 52.03 C ATOM 1894 O ILE A 519 12.344 -10.614 -3.096 1.00 61.41 O ATOM 1895 CB ILE A 519 12.531 -13.606 -4.288 1.00 72.51 C ATOM 1896 CG1 ILE A 519 11.842 -12.622 -5.235 1.00 51.13 C ATOM 1897 CG2 ILE A 519 11.749 -14.914 -4.152 1.00 61.24 C ATOM 1898 CD1 ILE A 519 12.790 -11.490 -5.635 1.00 13.22 C ATOM 0 H ILE A 519 11.580 -14.337 -1.875 1.00 61.02 H new ATOM 0 HA ILE A 519 13.826 -12.674 -2.912 1.00 34.13 H new ATOM 0 HB ILE A 519 13.497 -13.853 -4.728 1.00 72.51 H new ATOM 0 HG12 ILE A 519 11.502 -13.148 -6.127 1.00 51.13 H new ATOM 0 HG13 ILE A 519 10.957 -12.207 -4.753 1.00 51.13 H new ATOM 0 HG21 ILE A 519 11.588 -15.346 -5.140 1.00 61.24 H new ATOM 0 HG22 ILE A 519 12.315 -15.614 -3.538 1.00 61.24 H new ATOM 0 HG23 ILE A 519 10.786 -14.715 -3.681 1.00 61.24 H new ATOM 0 HD11 ILE A 519 12.275 -10.805 -6.308 1.00 13.22 H new ATOM 0 HD12 ILE A 519 13.109 -10.951 -4.743 1.00 13.22 H new ATOM 0 HD13 ILE A 519 13.662 -11.907 -6.139 1.00 13.22 H new ATOM 1909 N PHE A 520 10.835 -11.885 -1.989 1.00 31.30 N ATOM 1910 CA PHE A 520 9.955 -10.771 -1.683 1.00 63.54 C ATOM 1911 C PHE A 520 10.759 -9.529 -1.292 1.00 75.35 C ATOM 1912 O PHE A 520 10.361 -8.405 -1.598 1.00 23.24 O ATOM 1913 CB PHE A 520 9.092 -11.197 -0.495 1.00 2.44 C ATOM 1914 CG PHE A 520 8.694 -10.046 0.433 1.00 32.50 C ATOM 1915 CD1 PHE A 520 7.685 -9.206 0.080 1.00 73.32 C ATOM 1916 CD2 PHE A 520 9.352 -9.863 1.608 1.00 65.34 C ATOM 1917 CE1 PHE A 520 7.317 -8.138 0.940 1.00 52.20 C ATOM 1918 CE2 PHE A 520 8.985 -8.795 2.469 1.00 55.24 C ATOM 1919 CZ PHE A 520 7.975 -7.954 2.115 1.00 4.45 C ATOM 0 H PHE A 520 10.517 -12.789 -1.639 1.00 31.30 H new ATOM 0 HA PHE A 520 9.352 -10.522 -2.557 1.00 63.54 H new ATOM 0 HB2 PHE A 520 8.188 -11.676 -0.870 1.00 2.44 H new ATOM 0 HB3 PHE A 520 9.633 -11.946 0.084 1.00 2.44 H new ATOM 0 HD1 PHE A 520 7.163 -9.351 -0.855 1.00 73.32 H new ATOM 0 HD2 PHE A 520 10.154 -10.530 1.887 1.00 65.34 H new ATOM 0 HE1 PHE A 520 6.514 -7.472 0.661 1.00 52.20 H new ATOM 0 HE2 PHE A 520 9.507 -8.650 3.404 1.00 55.24 H new ATOM 0 HZ PHE A 520 7.696 -7.140 2.768 1.00 4.45 H new ATOM 1928 N ALA A 521 11.877 -9.772 -0.623 1.00 43.42 N ATOM 1929 CA ALA A 521 12.740 -8.688 -0.187 1.00 74.52 C ATOM 1930 C ALA A 521 13.157 -7.855 -1.402 1.00 24.13 C ATOM 1931 O ALA A 521 13.097 -6.627 -1.367 1.00 12.05 O ATOM 1932 CB ALA A 521 13.942 -9.262 0.565 1.00 21.11 C ATOM 0 H ALA A 521 12.205 -10.705 -0.372 1.00 43.42 H new ATOM 0 HA ALA A 521 12.210 -8.029 0.501 1.00 74.52 H new ATOM 0 HB1 ALA A 521 14.589 -8.448 0.892 1.00 21.11 H new ATOM 0 HB2 ALA A 521 13.595 -9.821 1.434 1.00 21.11 H new ATOM 0 HB3 ALA A 521 14.500 -9.927 -0.094 1.00 21.11 H new ATOM 1938 N ARG A 522 13.571 -8.557 -2.447 1.00 20.13 N ATOM 1939 CA ARG A 522 13.998 -7.899 -3.669 1.00 50.32 C ATOM 1940 C ARG A 522 12.789 -7.342 -4.423 1.00 12.33 C ATOM 1941 O ARG A 522 12.919 -6.409 -5.213 1.00 20.43 O ATOM 1942 CB ARG A 522 14.757 -8.865 -4.580 1.00 52.24 C ATOM 1943 CG ARG A 522 16.134 -9.199 -4.001 1.00 42.33 C ATOM 1944 CD ARG A 522 16.019 -10.223 -2.870 1.00 4.01 C ATOM 1945 NE ARG A 522 17.368 -10.675 -2.458 1.00 15.43 N ATOM 1946 CZ ARG A 522 18.090 -11.601 -3.123 1.00 14.15 C ATOM 1947 NH1 ARG A 522 17.599 -12.182 -4.239 1.00 74.25 N ATOM 1948 NH2 ARG A 522 19.285 -11.931 -2.666 1.00 54.11 N ATOM 0 H ARG A 522 13.620 -9.576 -2.472 1.00 20.13 H new ATOM 0 HA ARG A 522 14.664 -7.083 -3.389 1.00 50.32 H new ATOM 0 HB2 ARG A 522 14.180 -9.781 -4.706 1.00 52.24 H new ATOM 0 HB3 ARG A 522 14.872 -8.422 -5.569 1.00 52.24 H new ATOM 0 HG2 ARG A 522 16.778 -9.592 -4.788 1.00 42.33 H new ATOM 0 HG3 ARG A 522 16.606 -8.290 -3.627 1.00 42.33 H new ATOM 0 HD2 ARG A 522 15.499 -9.782 -2.020 1.00 4.01 H new ATOM 0 HD3 ARG A 522 15.425 -11.076 -3.199 1.00 4.01 H new ATOM 0 HE ARG A 522 17.776 -10.261 -1.620 1.00 15.43 H new ATOM 0 HH11 ARG A 522 16.676 -11.922 -4.585 1.00 74.25 H new ATOM 0 HH12 ARG A 522 18.152 -12.881 -4.735 1.00 74.25 H new ATOM 0 HH21 ARG A 522 19.649 -11.488 -1.822 1.00 54.11 H new ATOM 0 HH22 ARG A 522 19.844 -12.629 -3.157 1.00 54.11 H new ATOM 1958 N LYS A 523 11.638 -7.941 -4.152 1.00 14.43 N ATOM 1959 CA LYS A 523 10.405 -7.517 -4.795 1.00 12.22 C ATOM 1960 C LYS A 523 9.990 -6.152 -4.244 1.00 72.23 C ATOM 1961 O LYS A 523 9.621 -5.257 -5.005 1.00 62.12 O ATOM 1962 CB LYS A 523 9.326 -8.592 -4.648 1.00 4.13 C ATOM 1963 CG LYS A 523 9.853 -9.960 -5.086 1.00 70.11 C ATOM 1964 CD LYS A 523 10.427 -9.899 -6.503 1.00 65.44 C ATOM 1965 CE LYS A 523 9.387 -9.378 -7.494 1.00 54.24 C ATOM 1966 NZ LYS A 523 9.720 -9.807 -8.870 1.00 15.10 N ATOM 0 H LYS A 523 11.533 -8.716 -3.497 1.00 14.43 H new ATOM 0 HA LYS A 523 10.558 -7.396 -5.867 1.00 12.22 H new ATOM 0 HB2 LYS A 523 8.995 -8.641 -3.611 1.00 4.13 H new ATOM 0 HB3 LYS A 523 8.456 -8.324 -5.248 1.00 4.13 H new ATOM 0 HG2 LYS A 523 10.623 -10.296 -4.392 1.00 70.11 H new ATOM 0 HG3 LYS A 523 9.047 -10.693 -5.047 1.00 70.11 H new ATOM 0 HD2 LYS A 523 11.304 -9.251 -6.516 1.00 65.44 H new ATOM 0 HD3 LYS A 523 10.759 -10.891 -6.807 1.00 65.44 H new ATOM 0 HE2 LYS A 523 8.399 -9.748 -7.221 1.00 54.24 H new ATOM 0 HE3 LYS A 523 9.344 -8.290 -7.447 1.00 54.24 H new ATOM 0 HZ1 LYS A 523 9.003 -9.444 -9.530 1.00 15.10 H new ATOM 0 HZ2 LYS A 523 10.654 -9.433 -9.134 1.00 15.10 H new ATOM 0 HZ3 LYS A 523 9.738 -10.846 -8.915 1.00 15.10 H new ATOM 1975 N VAL A 524 10.066 -6.032 -2.928 1.00 24.25 N ATOM 1976 CA VAL A 524 9.703 -4.790 -2.266 1.00 61.33 C ATOM 1977 C VAL A 524 10.822 -3.766 -2.466 1.00 52.01 C ATOM 1978 O VAL A 524 10.555 -2.597 -2.745 1.00 33.23 O ATOM 1979 CB VAL A 524 9.393 -5.054 -0.791 1.00 33.44 C ATOM 1980 CG1 VAL A 524 10.671 -5.048 0.048 1.00 24.13 C ATOM 1981 CG2 VAL A 524 8.380 -4.041 -0.255 1.00 62.12 C ATOM 0 H VAL A 524 10.374 -6.775 -2.301 1.00 24.25 H new ATOM 0 HA VAL A 524 8.797 -4.374 -2.706 1.00 61.33 H new ATOM 0 HB VAL A 524 8.948 -6.046 -0.714 1.00 33.44 H new ATOM 0 HG11 VAL A 524 10.422 -5.238 1.092 1.00 24.13 H new ATOM 0 HG12 VAL A 524 11.346 -5.825 -0.311 1.00 24.13 H new ATOM 0 HG13 VAL A 524 11.158 -4.077 -0.038 1.00 24.13 H new ATOM 0 HG21 VAL A 524 8.177 -4.251 0.795 1.00 62.12 H new ATOM 0 HG22 VAL A 524 8.786 -3.034 -0.352 1.00 62.12 H new ATOM 0 HG23 VAL A 524 7.454 -4.115 -0.826 1.00 62.12 H new ATOM 1991 N ALA A 525 12.050 -4.240 -2.316 1.00 52.11 N ATOM 1992 CA ALA A 525 13.210 -3.380 -2.477 1.00 53.52 C ATOM 1993 C ALA A 525 13.345 -2.983 -3.949 1.00 64.24 C ATOM 1994 O ALA A 525 14.157 -2.126 -4.293 1.00 72.40 O ATOM 1995 CB ALA A 525 14.454 -4.096 -1.950 1.00 72.15 C ATOM 0 H ALA A 525 12.267 -5.209 -2.085 1.00 52.11 H new ATOM 0 HA ALA A 525 13.092 -2.464 -1.898 1.00 53.52 H new ATOM 0 HB1 ALA A 525 15.324 -3.451 -2.071 1.00 72.15 H new ATOM 0 HB2 ALA A 525 14.319 -4.329 -0.894 1.00 72.15 H new ATOM 0 HB3 ALA A 525 14.607 -5.019 -2.509 1.00 72.15 H new ATOM 2001 N ASN A 526 12.535 -3.626 -4.778 1.00 24.33 N ATOM 2002 CA ASN A 526 12.555 -3.351 -6.206 1.00 63.31 C ATOM 2003 C ASN A 526 11.612 -2.185 -6.508 1.00 11.53 C ATOM 2004 O ASN A 526 12.012 -1.206 -7.136 1.00 73.20 O ATOM 2005 CB ASN A 526 12.078 -4.564 -7.006 1.00 12.52 C ATOM 2006 CG ASN A 526 13.263 -5.352 -7.565 1.00 32.13 C ATOM 2007 OD1 ASN A 526 14.337 -4.824 -7.801 1.00 23.14 O ATOM 2008 ND2 ASN A 526 13.010 -6.643 -7.768 1.00 45.35 N ATOM 0 H ASN A 526 11.862 -4.336 -4.489 1.00 24.33 H new ATOM 0 HA ASN A 526 13.580 -3.112 -6.490 1.00 63.31 H new ATOM 0 HB2 ASN A 526 11.475 -5.210 -6.368 1.00 12.52 H new ATOM 0 HB3 ASN A 526 11.437 -4.235 -7.824 1.00 12.52 H new ATOM 0 HD21 ASN A 526 13.737 -7.253 -8.142 1.00 45.35 H new ATOM 0 HD22 ASN A 526 12.089 -7.023 -7.549 1.00 45.35 H new ATOM 2014 N THR A 527 10.378 -2.329 -6.049 1.00 62.03 N ATOM 2015 CA THR A 527 9.375 -1.299 -6.263 1.00 42.32 C ATOM 2016 C THR A 527 9.595 -0.131 -5.298 1.00 14.33 C ATOM 2017 O THR A 527 9.692 1.020 -5.722 1.00 31.03 O ATOM 2018 CB THR A 527 7.995 -1.946 -6.127 1.00 22.54 C ATOM 2019 OG1 THR A 527 7.085 -0.894 -6.431 1.00 73.54 O ATOM 2020 CG2 THR A 527 7.663 -2.320 -4.681 1.00 35.14 C ATOM 0 H THR A 527 10.049 -3.143 -5.530 1.00 62.03 H new ATOM 0 HA THR A 527 9.454 -0.873 -7.263 1.00 42.32 H new ATOM 0 HB THR A 527 7.951 -2.838 -6.752 1.00 22.54 H new ATOM 0 HG1 THR A 527 6.249 -1.032 -5.939 1.00 73.54 H new ATOM 0 HG21 THR A 527 6.673 -2.775 -4.641 1.00 35.14 H new ATOM 0 HG22 THR A 527 8.403 -3.028 -4.309 1.00 35.14 H new ATOM 0 HG23 THR A 527 7.675 -1.423 -4.061 1.00 35.14 H new ATOM 2028 N PHE A 528 9.669 -0.468 -4.019 1.00 50.44 N ATOM 2029 CA PHE A 528 9.874 0.538 -2.991 1.00 20.45 C ATOM 2030 C PHE A 528 11.366 0.787 -2.761 1.00 63.03 C ATOM 2031 O PHE A 528 11.850 0.684 -1.634 1.00 33.12 O ATOM 2032 CB PHE A 528 9.256 -0.007 -1.702 1.00 10.51 C ATOM 2033 CG PHE A 528 7.725 -0.026 -1.707 1.00 73.13 C ATOM 2034 CD1 PHE A 528 7.031 1.139 -1.804 1.00 13.24 C ATOM 2035 CD2 PHE A 528 7.061 -1.210 -1.613 1.00 70.23 C ATOM 2036 CE1 PHE A 528 5.611 1.121 -1.809 1.00 4.32 C ATOM 2037 CE2 PHE A 528 5.641 -1.228 -1.617 1.00 53.05 C ATOM 2038 CZ PHE A 528 4.946 -0.063 -1.715 1.00 13.42 C ATOM 0 H PHE A 528 9.591 -1.424 -3.671 1.00 50.44 H new ATOM 0 HA PHE A 528 9.417 1.480 -3.294 1.00 20.45 H new ATOM 0 HB2 PHE A 528 9.621 -1.020 -1.536 1.00 10.51 H new ATOM 0 HB3 PHE A 528 9.599 0.597 -0.862 1.00 10.51 H new ATOM 0 HD1 PHE A 528 7.559 2.078 -1.877 1.00 13.24 H new ATOM 0 HD2 PHE A 528 7.613 -2.135 -1.535 1.00 70.23 H new ATOM 0 HE1 PHE A 528 5.059 2.046 -1.887 1.00 4.32 H new ATOM 0 HE2 PHE A 528 5.113 -2.167 -1.542 1.00 53.05 H new ATOM 0 HZ PHE A 528 3.866 -0.077 -1.718 1.00 13.42 H new ATOM 2047 N LYS A 529 12.054 1.112 -3.846 1.00 32.12 N ATOM 2048 CA LYS A 529 13.481 1.378 -3.776 1.00 23.21 C ATOM 2049 C LYS A 529 13.725 2.605 -2.895 1.00 34.53 C ATOM 2050 O LYS A 529 12.824 3.418 -2.695 1.00 43.11 O ATOM 2051 CB LYS A 529 14.072 1.502 -5.181 1.00 21.33 C ATOM 2052 CG LYS A 529 14.229 0.128 -5.834 1.00 4.22 C ATOM 2053 CD LYS A 529 14.319 0.249 -7.356 1.00 54.31 C ATOM 2054 CE LYS A 529 14.802 -1.058 -7.984 1.00 24.24 C ATOM 2055 NZ LYS A 529 15.943 -1.611 -7.220 1.00 22.00 N ATOM 0 H LYS A 529 11.650 1.197 -4.779 1.00 32.12 H new ATOM 0 HA LYS A 529 14.002 0.542 -3.309 1.00 23.21 H new ATOM 0 HB2 LYS A 529 13.427 2.129 -5.796 1.00 21.33 H new ATOM 0 HB3 LYS A 529 15.042 1.997 -5.129 1.00 21.33 H new ATOM 0 HG2 LYS A 529 15.125 -0.360 -5.451 1.00 4.22 H new ATOM 0 HG3 LYS A 529 13.383 -0.504 -5.566 1.00 4.22 H new ATOM 0 HD2 LYS A 529 13.342 0.512 -7.761 1.00 54.31 H new ATOM 0 HD3 LYS A 529 15.001 1.057 -7.620 1.00 54.31 H new ATOM 0 HE2 LYS A 529 13.987 -1.781 -8.005 1.00 24.24 H new ATOM 0 HE3 LYS A 529 15.100 -0.883 -9.018 1.00 24.24 H new ATOM 0 HZ1 LYS A 529 16.507 -2.229 -7.838 1.00 22.00 H new ATOM 0 HZ2 LYS A 529 16.538 -0.832 -6.872 1.00 22.00 H new ATOM 0 HZ3 LYS A 529 15.586 -2.161 -6.413 1.00 22.00 H new ATOM 2064 N PRO A 530 14.979 2.702 -2.380 1.00 70.33 N ATOM 2065 CA PRO A 530 15.352 3.817 -1.525 1.00 30.51 C ATOM 2066 C PRO A 530 15.552 5.095 -2.345 1.00 31.15 C ATOM 2067 O PRO A 530 15.219 6.186 -1.890 1.00 73.43 O ATOM 2068 CB PRO A 530 16.618 3.363 -0.817 1.00 73.53 C ATOM 2069 CG PRO A 530 17.164 2.206 -1.639 1.00 31.22 C ATOM 2070 CD PRO A 530 16.072 1.759 -2.596 1.00 32.45 C ATOM 0 HA PRO A 530 14.576 4.071 -0.803 1.00 30.51 H new ATOM 0 HB2 PRO A 530 17.343 4.174 -0.755 1.00 73.53 H new ATOM 0 HB3 PRO A 530 16.403 3.049 0.204 1.00 73.53 H new ATOM 0 HG2 PRO A 530 18.052 2.515 -2.190 1.00 31.22 H new ATOM 0 HG3 PRO A 530 17.463 1.383 -0.989 1.00 31.22 H new ATOM 0 HD2 PRO A 530 16.417 1.783 -3.630 1.00 32.45 H new ATOM 0 HD3 PRO A 530 15.759 0.736 -2.389 1.00 32.45 H new ATOM 2075 N HIS A 531 16.096 4.913 -3.541 1.00 44.12 N ATOM 2076 CA HIS A 531 16.343 6.036 -4.428 1.00 42.44 C ATOM 2077 C HIS A 531 15.037 6.451 -5.107 1.00 12.43 C ATOM 2078 O HIS A 531 15.011 7.407 -5.881 1.00 13.14 O ATOM 2079 CB HIS A 531 17.452 5.705 -5.428 1.00 25.53 C ATOM 2080 CG HIS A 531 16.957 5.078 -6.710 1.00 51.23 C ATOM 2081 ND1 HIS A 531 16.780 3.714 -6.858 1.00 24.20 N ATOM 2082 CD2 HIS A 531 16.601 5.645 -7.899 1.00 21.13 C ATOM 2083 CE1 HIS A 531 16.339 3.481 -8.086 1.00 0.53 C ATOM 2084 NE2 HIS A 531 16.229 4.679 -8.729 1.00 20.42 N ATOM 0 H HIS A 531 16.372 4.005 -3.915 1.00 44.12 H new ATOM 0 HA HIS A 531 16.698 6.889 -3.850 1.00 42.44 H new ATOM 0 HB2 HIS A 531 17.995 6.619 -5.669 1.00 25.53 H new ATOM 0 HB3 HIS A 531 18.163 5.027 -4.955 1.00 25.53 H new ATOM 0 HD2 HIS A 531 16.619 6.701 -8.126 1.00 21.13 H new ATOM 0 HE1 HIS A 531 16.107 2.513 -8.504 1.00 0.53 H new ATOM 0 HE2 HIS A 531 15.913 4.811 -9.690 1.00 20.42 H new ATOM 2091 N ARG A 532 13.984 5.712 -4.793 1.00 35.23 N ATOM 2092 CA ARG A 532 12.676 5.991 -5.365 1.00 70.50 C ATOM 2093 C ARG A 532 11.839 6.821 -4.390 1.00 3.53 C ATOM 2094 O ARG A 532 11.172 7.773 -4.794 1.00 14.14 O ATOM 2095 CB ARG A 532 11.931 4.696 -5.692 1.00 13.14 C ATOM 2096 CG ARG A 532 12.486 4.050 -6.965 1.00 41.44 C ATOM 2097 CD ARG A 532 12.079 4.847 -8.205 1.00 40.41 C ATOM 2098 NE ARG A 532 10.792 4.341 -8.733 1.00 33.20 N ATOM 2099 CZ ARG A 532 10.193 4.814 -9.846 1.00 5.12 C ATOM 2100 NH1 ARG A 532 10.758 5.811 -10.559 1.00 75.40 N ATOM 2101 NH2 ARG A 532 9.044 4.287 -10.227 1.00 0.43 N ATOM 0 H ARG A 532 14.009 4.920 -4.150 1.00 35.23 H new ATOM 0 HA ARG A 532 12.829 6.551 -6.288 1.00 70.50 H new ATOM 0 HB2 ARG A 532 12.021 4.000 -4.858 1.00 13.14 H new ATOM 0 HB3 ARG A 532 10.869 4.905 -5.819 1.00 13.14 H new ATOM 0 HG2 ARG A 532 13.573 3.994 -6.905 1.00 41.44 H new ATOM 0 HG3 ARG A 532 12.118 3.027 -7.048 1.00 41.44 H new ATOM 0 HD2 ARG A 532 11.988 5.904 -7.954 1.00 40.41 H new ATOM 0 HD3 ARG A 532 12.852 4.766 -8.969 1.00 40.41 H new ATOM 0 HE ARG A 532 10.329 3.588 -8.224 1.00 33.20 H new ATOM 0 HH11 ARG A 532 11.645 6.214 -10.258 1.00 75.40 H new ATOM 0 HH12 ARG A 532 10.298 6.162 -11.399 1.00 75.40 H new ATOM 0 HH21 ARG A 532 8.623 3.534 -9.683 1.00 0.43 H new ATOM 0 HH22 ARG A 532 8.578 4.633 -11.066 1.00 0.43 H new ATOM 2111 N LEU A 533 11.899 6.430 -3.126 1.00 61.02 N ATOM 2112 CA LEU A 533 11.153 7.127 -2.091 1.00 3.24 C ATOM 2113 C LEU A 533 11.653 8.569 -1.990 1.00 71.52 C ATOM 2114 O LEU A 533 10.879 9.512 -2.142 1.00 4.24 O ATOM 2115 CB LEU A 533 11.224 6.359 -0.770 1.00 23.14 C ATOM 2116 CG LEU A 533 10.209 5.227 -0.597 1.00 22.42 C ATOM 2117 CD1 LEU A 533 8.783 5.732 -0.822 1.00 22.44 C ATOM 2118 CD2 LEU A 533 10.549 4.043 -1.503 1.00 14.43 C ATOM 0 H LEU A 533 12.452 5.640 -2.794 1.00 61.02 H new ATOM 0 HA LEU A 533 10.095 7.173 -2.351 1.00 3.24 H new ATOM 0 HB2 LEU A 533 12.226 5.941 -0.669 1.00 23.14 H new ATOM 0 HB3 LEU A 533 11.091 7.068 0.047 1.00 23.14 H new ATOM 0 HG LEU A 533 10.265 4.870 0.431 1.00 22.42 H new ATOM 0 HD11 LEU A 533 8.081 4.908 -0.693 1.00 22.44 H new ATOM 0 HD12 LEU A 533 8.557 6.517 -0.101 1.00 22.44 H new ATOM 0 HD13 LEU A 533 8.693 6.131 -1.833 1.00 22.44 H new ATOM 0 HD21 LEU A 533 9.812 3.252 -1.360 1.00 14.43 H new ATOM 0 HD22 LEU A 533 10.538 4.366 -2.544 1.00 14.43 H new ATOM 0 HD23 LEU A 533 11.540 3.665 -1.251 1.00 14.43 H new