USER MOD reduce.3.24.130724 H: found=0, std=0, add=703, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 704 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 375 GLN : amide:sc= -7.47! C(o=-19!,f=-12!) USER MOD Set 1.2: A 381 ASN : amide:sc= -0.772 K(o=-19,f=-14!) USER MOD Set 1.3: A 394 GLN : amide:sc= -10.4! C(o=-19!,f=-12!) USER MOD Set 2.1: A 366 ASN : amide:sc= -4.13! K(o=-4.5!,f=-0.35) USER MOD Set 2.2: A 367 ASN : amide:sc= -0.319 K(o=-4.5,f=-0.35) USER MOD Set 3.1: A 321 SER OG : rot -140:sc= 1.21 USER MOD Set 3.2: A 325 THR OG1 : rot 180:sc= 1.18 USER MOD Set 4.1: A 311 LYS NZ :NH3+ 153:sc= 1.21 (180deg=0) USER MOD Set 4.2: A 335 THR OG1 : rot -40:sc= 0.993 USER MOD Single : A 303 THR OG1 : rot -58:sc= 0.254 USER MOD Single : A 304 TYR OH : rot 180:sc= 0 USER MOD Single : A 305 THR OG1 : rot 180:sc= 0.00814 USER MOD Single : A 309 LYS NZ :NH3+ 164:sc= 1.31 (180deg=1.17) USER MOD Single : A 310 THR OG1 : rot -38:sc= 0.476 USER MOD Single : A 313 THR OG1 : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ -135:sc= 1.05 (180deg=-0.701) USER MOD Single : A 319 THR OG1 : rot 69:sc= 1.86 USER MOD Single : A 323 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 328 MET CE :methyl 136:sc= -1.77 (180deg=-4.09!) USER MOD Single : A 333 SER OG : rot 70:sc= 1.18 USER MOD Single : A 347 HIS : no HE2:sc= -0.317 K(o=-0.32,f=-3.9!) USER MOD Single : A 353 ASN : amide:sc= 0.579 K(o=0.58,f=-6.8!) USER MOD Single : A 356 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 359 THR OG1 : rot 150:sc= 1.23 USER MOD Single : A 361 ASN : amide:sc= -1.16! K(o=-1.2!,f=-0.027) USER MOD Single : A 363 THR OG1 : rot 180:sc= 0 USER MOD Single : A 364 MET CE :methyl -161:sc= -2.67 (180deg=-4.32!) USER MOD Single : A 374 MET CE :methyl -137:sc= -3.02 (180deg=-9.22!) USER MOD Single : A 384 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= 0.159 X(o=0.16,f=-0.013) USER MOD Single : A 390 HIS : no HE2:sc= 0.26 K(o=0.26,f=-1) USER MOD Single : A 391 GLN : amide:sc= -3.36! C(o=-3.4!,f=-4.6!) USER MOD Single : A 395 LYS NZ :NH3+ -167:sc= -0.0432 (180deg=-0.235) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 303 18.776 -4.380 -1.624 1.00 0.00 N ATOM 2 CA THR A 303 18.225 -5.084 -2.770 1.00 0.00 C ATOM 3 C THR A 303 16.898 -4.470 -3.238 1.00 0.00 C ATOM 4 O THR A 303 15.833 -5.075 -3.098 1.00 0.00 O ATOM 5 CB THR A 303 18.028 -6.578 -2.421 1.00 0.00 C ATOM 6 OG1 THR A 303 17.361 -7.271 -3.486 1.00 0.00 O ATOM 7 CG2 THR A 303 17.250 -6.733 -1.117 1.00 0.00 C ATOM 0 HA THR A 303 18.935 -4.990 -3.592 1.00 0.00 H new ATOM 0 HB THR A 303 19.015 -7.022 -2.289 1.00 0.00 H new ATOM 0 HG1 THR A 303 16.495 -6.846 -3.661 1.00 0.00 H new ATOM 0 HG21 THR A 303 17.124 -7.792 -0.892 1.00 0.00 H new ATOM 0 HG22 THR A 303 17.799 -6.253 -0.307 1.00 0.00 H new ATOM 0 HG23 THR A 303 16.271 -6.265 -1.220 1.00 0.00 H new ATOM 15 N TYR A 304 16.962 -3.260 -3.789 1.00 0.00 N ATOM 16 CA TYR A 304 15.770 -2.614 -4.334 1.00 0.00 C ATOM 17 C TYR A 304 15.178 -3.458 -5.469 1.00 0.00 C ATOM 18 O TYR A 304 15.886 -3.863 -6.394 1.00 0.00 O ATOM 19 CB TYR A 304 16.092 -1.196 -4.832 1.00 0.00 C ATOM 20 CG TYR A 304 16.890 -1.150 -6.118 1.00 0.00 C ATOM 21 CD1 TYR A 304 16.290 -0.766 -7.311 1.00 0.00 C ATOM 22 CD2 TYR A 304 18.233 -1.502 -6.143 1.00 0.00 C ATOM 23 CE1 TYR A 304 17.004 -0.736 -8.491 1.00 0.00 C ATOM 24 CE2 TYR A 304 18.955 -1.471 -7.319 1.00 0.00 C ATOM 25 CZ TYR A 304 18.335 -1.089 -8.489 1.00 0.00 C ATOM 26 OH TYR A 304 19.048 -1.066 -9.665 1.00 0.00 O ATOM 0 H TYR A 304 17.818 -2.711 -3.870 1.00 0.00 H new ATOM 0 HA TYR A 304 15.032 -2.533 -3.536 1.00 0.00 H new ATOM 0 HB2 TYR A 304 15.157 -0.655 -4.979 1.00 0.00 H new ATOM 0 HB3 TYR A 304 16.647 -0.669 -4.056 1.00 0.00 H new ATOM 0 HD1 TYR A 304 15.247 -0.486 -7.315 1.00 0.00 H new ATOM 0 HD2 TYR A 304 18.720 -1.805 -5.228 1.00 0.00 H new ATOM 0 HE1 TYR A 304 16.522 -0.438 -9.410 1.00 0.00 H new ATOM 0 HE2 TYR A 304 20.000 -1.745 -7.322 1.00 0.00 H new ATOM 0 HH TYR A 304 19.973 -1.341 -9.492 1.00 0.00 H new ATOM 36 N THR A 305 13.885 -3.731 -5.382 1.00 0.00 N ATOM 37 CA THR A 305 13.202 -4.555 -6.369 1.00 0.00 C ATOM 38 C THR A 305 11.714 -4.611 -6.049 1.00 0.00 C ATOM 39 O THR A 305 11.247 -3.873 -5.187 1.00 0.00 O ATOM 40 CB THR A 305 13.804 -5.982 -6.403 1.00 0.00 C ATOM 41 OG1 THR A 305 13.322 -6.703 -7.541 1.00 0.00 O ATOM 42 CG2 THR A 305 13.474 -6.751 -5.130 1.00 0.00 C ATOM 0 H THR A 305 13.283 -3.391 -4.632 1.00 0.00 H new ATOM 0 HA THR A 305 13.338 -4.109 -7.354 1.00 0.00 H new ATOM 0 HB THR A 305 14.887 -5.881 -6.475 1.00 0.00 H new ATOM 0 HG1 THR A 305 13.713 -7.602 -7.549 1.00 0.00 H new ATOM 0 HG21 THR A 305 13.910 -7.748 -5.184 1.00 0.00 H new ATOM 0 HG22 THR A 305 13.883 -6.222 -4.269 1.00 0.00 H new ATOM 0 HG23 THR A 305 12.392 -6.833 -5.025 1.00 0.00 H new ATOM 50 N VAL A 306 10.964 -5.442 -6.756 1.00 0.00 N ATOM 51 CA VAL A 306 9.573 -5.672 -6.406 1.00 0.00 C ATOM 52 C VAL A 306 9.531 -6.436 -5.093 1.00 0.00 C ATOM 53 O VAL A 306 9.927 -7.602 -5.032 1.00 0.00 O ATOM 54 CB VAL A 306 8.816 -6.459 -7.499 1.00 0.00 C ATOM 55 CG1 VAL A 306 7.371 -6.708 -7.082 1.00 0.00 C ATOM 56 CG2 VAL A 306 8.869 -5.710 -8.822 1.00 0.00 C ATOM 0 H VAL A 306 11.292 -5.964 -7.569 1.00 0.00 H new ATOM 0 HA VAL A 306 9.076 -4.707 -6.311 1.00 0.00 H new ATOM 0 HB VAL A 306 9.304 -7.425 -7.627 1.00 0.00 H new ATOM 0 HG11 VAL A 306 6.857 -7.264 -7.866 1.00 0.00 H new ATOM 0 HG12 VAL A 306 7.353 -7.285 -6.157 1.00 0.00 H new ATOM 0 HG13 VAL A 306 6.868 -5.754 -6.924 1.00 0.00 H new ATOM 0 HG21 VAL A 306 8.332 -6.276 -9.583 1.00 0.00 H new ATOM 0 HG22 VAL A 306 8.406 -4.730 -8.704 1.00 0.00 H new ATOM 0 HG23 VAL A 306 9.908 -5.586 -9.128 1.00 0.00 H new ATOM 66 N CYS A 307 9.082 -5.767 -4.044 1.00 0.00 N ATOM 67 CA CYS A 307 9.150 -6.329 -2.702 1.00 0.00 C ATOM 68 C CYS A 307 8.209 -7.511 -2.528 1.00 0.00 C ATOM 69 O CYS A 307 7.052 -7.483 -2.946 1.00 0.00 O ATOM 70 CB CYS A 307 8.835 -5.269 -1.645 1.00 0.00 C ATOM 71 SG CYS A 307 8.336 -3.653 -2.315 1.00 0.00 S ATOM 0 H CYS A 307 8.667 -4.836 -4.094 1.00 0.00 H new ATOM 0 HA CYS A 307 10.172 -6.683 -2.566 1.00 0.00 H new ATOM 0 HB2 CYS A 307 8.038 -5.642 -1.002 1.00 0.00 H new ATOM 0 HB3 CYS A 307 9.714 -5.130 -1.016 1.00 0.00 H new ATOM 76 N ASP A 308 8.751 -8.554 -1.914 1.00 0.00 N ATOM 77 CA ASP A 308 7.998 -9.756 -1.589 1.00 0.00 C ATOM 78 C ASP A 308 6.884 -9.458 -0.601 1.00 0.00 C ATOM 79 O ASP A 308 7.029 -8.631 0.301 1.00 0.00 O ATOM 80 CB ASP A 308 8.923 -10.831 -1.028 1.00 0.00 C ATOM 81 CG ASP A 308 8.164 -12.089 -0.668 1.00 0.00 C ATOM 82 OD1 ASP A 308 7.987 -12.349 0.535 1.00 0.00 O ATOM 83 OD2 ASP A 308 7.716 -12.802 -1.589 1.00 0.00 O ATOM 0 H ASP A 308 9.729 -8.590 -1.627 1.00 0.00 H new ATOM 0 HA ASP A 308 7.546 -10.124 -2.510 1.00 0.00 H new ATOM 0 HB2 ASP A 308 9.693 -11.068 -1.762 1.00 0.00 H new ATOM 0 HB3 ASP A 308 9.433 -10.448 -0.144 1.00 0.00 H new ATOM 88 N LYS A 309 5.800 -10.188 -0.769 1.00 0.00 N ATOM 89 CA LYS A 309 4.533 -9.904 -0.125 1.00 0.00 C ATOM 90 C LYS A 309 4.546 -10.079 1.399 1.00 0.00 C ATOM 91 O LYS A 309 3.625 -9.627 2.073 1.00 0.00 O ATOM 92 CB LYS A 309 3.468 -10.796 -0.761 1.00 0.00 C ATOM 93 CG LYS A 309 3.830 -12.278 -0.778 1.00 0.00 C ATOM 94 CD LYS A 309 3.576 -12.928 0.575 1.00 0.00 C ATOM 95 CE LYS A 309 3.539 -14.441 0.489 1.00 0.00 C ATOM 96 NZ LYS A 309 2.851 -15.038 1.667 1.00 0.00 N ATOM 0 H LYS A 309 5.774 -11.012 -1.369 1.00 0.00 H new ATOM 0 HA LYS A 309 4.314 -8.848 -0.282 1.00 0.00 H new ATOM 0 HB2 LYS A 309 2.531 -10.668 -0.220 1.00 0.00 H new ATOM 0 HB3 LYS A 309 3.294 -10.463 -1.784 1.00 0.00 H new ATOM 0 HG2 LYS A 309 3.245 -12.788 -1.544 1.00 0.00 H new ATOM 0 HG3 LYS A 309 4.880 -12.395 -1.048 1.00 0.00 H new ATOM 0 HD2 LYS A 309 4.356 -12.625 1.273 1.00 0.00 H new ATOM 0 HD3 LYS A 309 2.630 -12.566 0.978 1.00 0.00 H new ATOM 0 HE2 LYS A 309 3.026 -14.742 -0.424 1.00 0.00 H new ATOM 0 HE3 LYS A 309 4.556 -14.828 0.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 309 2.601 -16.026 1.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 309 3.484 -15.007 2.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 309 1.986 -14.499 1.874 1.00 0.00 H new ATOM 110 N THR A 310 5.560 -10.735 1.949 1.00 0.00 N ATOM 111 CA THR A 310 5.568 -10.984 3.386 1.00 0.00 C ATOM 112 C THR A 310 6.574 -10.090 4.108 1.00 0.00 C ATOM 113 O THR A 310 6.778 -10.220 5.317 1.00 0.00 O ATOM 114 CB THR A 310 5.856 -12.469 3.710 1.00 0.00 C ATOM 115 OG1 THR A 310 5.563 -12.739 5.080 1.00 0.00 O ATOM 116 CG2 THR A 310 7.305 -12.825 3.424 1.00 0.00 C ATOM 0 H THR A 310 6.367 -11.096 1.440 1.00 0.00 H new ATOM 0 HA THR A 310 4.569 -10.741 3.747 1.00 0.00 H new ATOM 0 HB THR A 310 5.217 -13.078 3.071 1.00 0.00 H new ATOM 0 HG1 THR A 310 5.826 -11.970 5.628 1.00 0.00 H new ATOM 0 HG21 THR A 310 7.475 -13.875 3.662 1.00 0.00 H new ATOM 0 HG22 THR A 310 7.521 -12.652 2.370 1.00 0.00 H new ATOM 0 HG23 THR A 310 7.960 -12.204 4.035 1.00 0.00 H new ATOM 124 N LYS A 311 7.192 -9.171 3.377 1.00 0.00 N ATOM 125 CA LYS A 311 8.164 -8.274 3.982 1.00 0.00 C ATOM 126 C LYS A 311 7.496 -7.018 4.503 1.00 0.00 C ATOM 127 O LYS A 311 8.052 -6.324 5.353 1.00 0.00 O ATOM 128 CB LYS A 311 9.271 -7.916 3.002 1.00 0.00 C ATOM 129 CG LYS A 311 10.126 -9.105 2.623 1.00 0.00 C ATOM 130 CD LYS A 311 11.349 -8.681 1.839 1.00 0.00 C ATOM 131 CE LYS A 311 10.974 -7.895 0.599 1.00 0.00 C ATOM 132 NZ LYS A 311 12.050 -7.969 -0.421 1.00 0.00 N ATOM 0 H LYS A 311 7.040 -9.029 2.378 1.00 0.00 H new ATOM 0 HA LYS A 311 8.613 -8.800 4.824 1.00 0.00 H new ATOM 0 HB2 LYS A 311 8.829 -7.490 2.101 1.00 0.00 H new ATOM 0 HB3 LYS A 311 9.904 -7.145 3.441 1.00 0.00 H new ATOM 0 HG2 LYS A 311 10.436 -9.634 3.524 1.00 0.00 H new ATOM 0 HG3 LYS A 311 9.537 -9.804 2.030 1.00 0.00 H new ATOM 0 HD2 LYS A 311 11.996 -8.074 2.473 1.00 0.00 H new ATOM 0 HD3 LYS A 311 11.921 -9.563 1.552 1.00 0.00 H new ATOM 0 HE2 LYS A 311 10.045 -8.286 0.183 1.00 0.00 H new ATOM 0 HE3 LYS A 311 10.791 -6.854 0.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 11.639 -7.848 -1.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 12.746 -7.216 -0.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 12.520 -8.895 -0.363 1.00 0.00 H new ATOM 146 N PHE A 312 6.318 -6.712 3.985 1.00 0.00 N ATOM 147 CA PHE A 312 5.535 -5.633 4.530 1.00 0.00 C ATOM 148 C PHE A 312 4.521 -6.171 5.519 1.00 0.00 C ATOM 149 O PHE A 312 4.040 -7.293 5.390 1.00 0.00 O ATOM 150 CB PHE A 312 4.841 -4.805 3.444 1.00 0.00 C ATOM 151 CG PHE A 312 4.755 -5.449 2.091 1.00 0.00 C ATOM 152 CD1 PHE A 312 5.714 -5.181 1.129 1.00 0.00 C ATOM 153 CD2 PHE A 312 3.709 -6.292 1.771 1.00 0.00 C ATOM 154 CE1 PHE A 312 5.632 -5.744 -0.127 1.00 0.00 C ATOM 155 CE2 PHE A 312 3.626 -6.861 0.517 1.00 0.00 C ATOM 156 CZ PHE A 312 4.587 -6.585 -0.434 1.00 0.00 C ATOM 0 H PHE A 312 5.892 -7.195 3.194 1.00 0.00 H new ATOM 0 HA PHE A 312 6.223 -4.963 5.046 1.00 0.00 H new ATOM 0 HB2 PHE A 312 3.831 -4.572 3.780 1.00 0.00 H new ATOM 0 HB3 PHE A 312 5.369 -3.857 3.342 1.00 0.00 H new ATOM 0 HD1 PHE A 312 6.537 -4.523 1.365 1.00 0.00 H new ATOM 0 HD2 PHE A 312 2.950 -6.508 2.508 1.00 0.00 H new ATOM 0 HE1 PHE A 312 6.386 -5.525 -0.868 1.00 0.00 H new ATOM 0 HE2 PHE A 312 2.807 -7.524 0.279 1.00 0.00 H new ATOM 0 HZ PHE A 312 4.519 -7.028 -1.417 1.00 0.00 H new ATOM 166 N THR A 313 4.236 -5.371 6.522 1.00 0.00 N ATOM 167 CA THR A 313 3.270 -5.719 7.539 1.00 0.00 C ATOM 168 C THR A 313 2.337 -4.540 7.778 1.00 0.00 C ATOM 169 O THR A 313 2.709 -3.388 7.529 1.00 0.00 O ATOM 170 CB THR A 313 3.984 -6.117 8.850 1.00 0.00 C ATOM 171 OG1 THR A 313 3.033 -6.342 9.900 1.00 0.00 O ATOM 172 CG2 THR A 313 4.980 -5.047 9.276 1.00 0.00 C ATOM 0 H THR A 313 4.669 -4.457 6.655 1.00 0.00 H new ATOM 0 HA THR A 313 2.686 -6.574 7.198 1.00 0.00 H new ATOM 0 HB THR A 313 4.527 -7.043 8.662 1.00 0.00 H new ATOM 0 HG1 THR A 313 3.505 -6.595 10.721 1.00 0.00 H new ATOM 0 HG21 THR A 313 5.468 -5.352 10.201 1.00 0.00 H new ATOM 0 HG22 THR A 313 5.730 -4.917 8.496 1.00 0.00 H new ATOM 0 HG23 THR A 313 4.456 -4.105 9.436 1.00 0.00 H new ATOM 180 N TRP A 314 1.123 -4.839 8.228 1.00 0.00 N ATOM 181 CA TRP A 314 0.116 -3.816 8.487 1.00 0.00 C ATOM 182 C TRP A 314 0.573 -2.858 9.564 1.00 0.00 C ATOM 183 O TRP A 314 0.487 -3.154 10.757 1.00 0.00 O ATOM 184 CB TRP A 314 -1.212 -4.445 8.918 1.00 0.00 C ATOM 185 CG TRP A 314 -1.811 -5.384 7.917 1.00 0.00 C ATOM 186 CD1 TRP A 314 -2.600 -5.056 6.852 1.00 0.00 C ATOM 187 CD2 TRP A 314 -1.685 -6.812 7.900 1.00 0.00 C ATOM 188 NE1 TRP A 314 -2.971 -6.192 6.174 1.00 0.00 N ATOM 189 CE2 TRP A 314 -2.420 -7.281 6.796 1.00 0.00 C ATOM 190 CE3 TRP A 314 -1.020 -7.740 8.710 1.00 0.00 C ATOM 191 CZ2 TRP A 314 -2.508 -8.634 6.481 1.00 0.00 C ATOM 192 CZ3 TRP A 314 -1.109 -9.084 8.394 1.00 0.00 C ATOM 193 CH2 TRP A 314 -1.848 -9.518 7.287 1.00 0.00 C ATOM 0 H TRP A 314 0.811 -5.790 8.422 1.00 0.00 H new ATOM 0 HA TRP A 314 -0.027 -3.269 7.555 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -1.058 -4.982 9.854 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -1.927 -3.648 9.122 1.00 0.00 H new ATOM 0 HD1 TRP A 314 -2.890 -4.051 6.582 1.00 0.00 H new ATOM 0 HE1 TRP A 314 -3.561 -6.220 5.342 1.00 0.00 H new ATOM 0 HE3 TRP A 314 -0.448 -7.413 9.566 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -3.078 -8.973 5.629 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 -0.600 -9.810 9.011 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -1.897 -10.574 7.065 1.00 0.00 H new ATOM 204 N LYS A 315 1.069 -1.719 9.137 1.00 0.00 N ATOM 205 CA LYS A 315 1.380 -0.654 10.053 1.00 0.00 C ATOM 206 C LYS A 315 0.103 0.136 10.303 1.00 0.00 C ATOM 207 O LYS A 315 -0.213 0.498 11.438 1.00 0.00 O ATOM 208 CB LYS A 315 2.476 0.238 9.480 1.00 0.00 C ATOM 209 CG LYS A 315 3.054 1.186 10.497 1.00 0.00 C ATOM 210 CD LYS A 315 4.171 2.029 9.904 1.00 0.00 C ATOM 211 CE LYS A 315 4.744 3.000 10.922 1.00 0.00 C ATOM 212 NZ LYS A 315 3.699 3.888 11.495 1.00 0.00 N ATOM 0 H LYS A 315 1.265 -1.509 8.158 1.00 0.00 H new ATOM 0 HA LYS A 315 1.753 -1.058 10.994 1.00 0.00 H new ATOM 0 HB2 LYS A 315 3.274 -0.388 9.080 1.00 0.00 H new ATOM 0 HB3 LYS A 315 2.071 0.811 8.646 1.00 0.00 H new ATOM 0 HG2 LYS A 315 2.267 1.838 10.876 1.00 0.00 H new ATOM 0 HG3 LYS A 315 3.436 0.620 11.347 1.00 0.00 H new ATOM 0 HD2 LYS A 315 4.964 1.377 9.537 1.00 0.00 H new ATOM 0 HD3 LYS A 315 3.792 2.584 9.046 1.00 0.00 H new ATOM 0 HE2 LYS A 315 5.225 2.441 11.725 1.00 0.00 H new ATOM 0 HE3 LYS A 315 5.516 3.607 10.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 4.049 4.867 11.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 2.842 3.840 10.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 3.473 3.579 12.462 1.00 0.00 H new ATOM 226 N ARG A 316 -0.635 0.377 9.224 1.00 0.00 N ATOM 227 CA ARG A 316 -1.971 0.941 9.302 1.00 0.00 C ATOM 228 C ARG A 316 -2.770 0.562 8.053 1.00 0.00 C ATOM 229 O ARG A 316 -2.330 0.787 6.925 1.00 0.00 O ATOM 230 CB ARG A 316 -1.920 2.461 9.466 1.00 0.00 C ATOM 231 CG ARG A 316 -3.298 3.074 9.662 1.00 0.00 C ATOM 232 CD ARG A 316 -3.242 4.573 9.911 1.00 0.00 C ATOM 233 NE ARG A 316 -4.586 5.133 10.077 1.00 0.00 N ATOM 234 CZ ARG A 316 -4.870 6.225 10.790 1.00 0.00 C ATOM 235 NH1 ARG A 316 -3.911 6.887 11.422 1.00 0.00 N ATOM 236 NH2 ARG A 316 -6.125 6.648 10.876 1.00 0.00 N ATOM 0 H ARG A 316 -0.321 0.186 8.273 1.00 0.00 H new ATOM 0 HA ARG A 316 -2.468 0.529 10.180 1.00 0.00 H new ATOM 0 HB2 ARG A 316 -1.291 2.710 10.321 1.00 0.00 H new ATOM 0 HB3 ARG A 316 -1.452 2.902 8.586 1.00 0.00 H new ATOM 0 HG2 ARG A 316 -3.907 2.879 8.779 1.00 0.00 H new ATOM 0 HG3 ARG A 316 -3.791 2.588 10.504 1.00 0.00 H new ATOM 0 HD2 ARG A 316 -2.649 4.774 10.803 1.00 0.00 H new ATOM 0 HD3 ARG A 316 -2.741 5.064 9.077 1.00 0.00 H new ATOM 0 HE ARG A 316 -5.359 4.654 9.615 1.00 0.00 H new ATOM 0 HH11 ARG A 316 -2.945 6.563 11.366 1.00 0.00 H new ATOM 0 HH12 ARG A 316 -4.139 7.720 11.964 1.00 0.00 H new ATOM 0 HH21 ARG A 316 -6.869 6.139 10.398 1.00 0.00 H new ATOM 0 HH22 ARG A 316 -6.346 7.482 11.420 1.00 0.00 H new ATOM 250 N ALA A 317 -3.935 -0.037 8.276 1.00 0.00 N ATOM 251 CA ALA A 317 -4.817 -0.486 7.198 1.00 0.00 C ATOM 252 C ALA A 317 -5.377 0.697 6.412 1.00 0.00 C ATOM 253 O ALA A 317 -5.246 1.840 6.856 1.00 0.00 O ATOM 254 CB ALA A 317 -5.947 -1.318 7.789 1.00 0.00 C ATOM 0 H ALA A 317 -4.297 -0.226 9.210 1.00 0.00 H new ATOM 0 HA ALA A 317 -4.240 -1.096 6.503 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -6.607 -1.655 6.990 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -5.530 -2.183 8.305 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -6.513 -0.712 8.496 1.00 0.00 H new ATOM 260 N PRO A 318 -5.993 0.442 5.229 1.00 0.00 N ATOM 261 CA PRO A 318 -6.614 1.486 4.415 1.00 0.00 C ATOM 262 C PRO A 318 -7.371 2.508 5.267 1.00 0.00 C ATOM 263 O PRO A 318 -8.259 2.164 6.047 1.00 0.00 O ATOM 264 CB PRO A 318 -7.567 0.721 3.477 1.00 0.00 C ATOM 265 CG PRO A 318 -7.368 -0.743 3.757 1.00 0.00 C ATOM 266 CD PRO A 318 -6.114 -0.871 4.582 1.00 0.00 C ATOM 0 HA PRO A 318 -5.872 2.071 3.871 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -8.602 1.012 3.656 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -7.348 0.949 2.434 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -8.225 -1.152 4.293 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -7.276 -1.304 2.827 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -6.196 -1.673 5.315 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -5.246 -1.094 3.961 1.00 0.00 H new ATOM 274 N THR A 319 -6.973 3.757 5.126 1.00 0.00 N ATOM 275 CA THR A 319 -7.457 4.839 5.953 1.00 0.00 C ATOM 276 C THR A 319 -7.794 6.057 5.101 1.00 0.00 C ATOM 277 O THR A 319 -7.059 6.389 4.183 1.00 0.00 O ATOM 278 CB THR A 319 -6.374 5.223 6.980 1.00 0.00 C ATOM 279 OG1 THR A 319 -6.193 4.161 7.930 1.00 0.00 O ATOM 280 CG2 THR A 319 -6.720 6.517 7.695 1.00 0.00 C ATOM 0 H THR A 319 -6.295 4.050 4.423 1.00 0.00 H new ATOM 0 HA THR A 319 -8.359 4.508 6.467 1.00 0.00 H new ATOM 0 HB THR A 319 -5.441 5.381 6.440 1.00 0.00 H new ATOM 0 HG1 THR A 319 -5.780 3.392 7.486 1.00 0.00 H new ATOM 0 HG21 THR A 319 -5.935 6.758 8.412 1.00 0.00 H new ATOM 0 HG22 THR A 319 -6.806 7.323 6.967 1.00 0.00 H new ATOM 0 HG23 THR A 319 -7.668 6.400 8.221 1.00 0.00 H new ATOM 288 N ASP A 320 -8.924 6.688 5.394 1.00 0.00 N ATOM 289 CA ASP A 320 -9.313 7.945 4.751 1.00 0.00 C ATOM 290 C ASP A 320 -8.144 8.926 4.708 1.00 0.00 C ATOM 291 O ASP A 320 -7.543 9.238 5.736 1.00 0.00 O ATOM 292 CB ASP A 320 -10.485 8.567 5.510 1.00 0.00 C ATOM 293 CG ASP A 320 -10.781 9.991 5.079 1.00 0.00 C ATOM 294 OD1 ASP A 320 -10.350 10.932 5.781 1.00 0.00 O ATOM 295 OD2 ASP A 320 -11.460 10.174 4.050 1.00 0.00 O ATOM 0 H ASP A 320 -9.597 6.348 6.081 1.00 0.00 H new ATOM 0 HA ASP A 320 -9.612 7.729 3.725 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -11.374 7.955 5.359 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -10.267 8.554 6.578 1.00 0.00 H new ATOM 300 N SER A 321 -7.827 9.390 3.503 1.00 0.00 N ATOM 301 CA SER A 321 -6.686 10.264 3.280 1.00 0.00 C ATOM 302 C SER A 321 -6.898 11.610 3.956 1.00 0.00 C ATOM 303 O SER A 321 -5.955 12.221 4.463 1.00 0.00 O ATOM 304 CB SER A 321 -6.472 10.481 1.780 1.00 0.00 C ATOM 305 OG SER A 321 -7.563 11.195 1.213 1.00 0.00 O ATOM 0 H SER A 321 -8.354 9.170 2.658 1.00 0.00 H new ATOM 0 HA SER A 321 -5.806 9.786 3.709 1.00 0.00 H new ATOM 0 HB2 SER A 321 -5.546 11.032 1.616 1.00 0.00 H new ATOM 0 HB3 SER A 321 -6.362 9.518 1.281 1.00 0.00 H new ATOM 0 HG SER A 321 -7.781 10.816 0.336 1.00 0.00 H new ATOM 311 N GLY A 322 -8.138 12.072 3.940 1.00 0.00 N ATOM 312 CA GLY A 322 -8.464 13.343 4.538 1.00 0.00 C ATOM 313 C GLY A 322 -9.269 14.202 3.596 1.00 0.00 C ATOM 314 O GLY A 322 -9.791 15.243 3.984 1.00 0.00 O ATOM 0 H GLY A 322 -8.928 11.583 3.519 1.00 0.00 H new ATOM 0 HA2 GLY A 322 -9.027 13.181 5.457 1.00 0.00 H new ATOM 0 HA3 GLY A 322 -7.547 13.863 4.814 1.00 0.00 H new ATOM 318 N HIS A 323 -9.354 13.774 2.343 1.00 0.00 N ATOM 319 CA HIS A 323 -10.141 14.504 1.356 1.00 0.00 C ATOM 320 C HIS A 323 -11.325 13.669 0.884 1.00 0.00 C ATOM 321 O HIS A 323 -12.456 13.878 1.320 1.00 0.00 O ATOM 322 CB HIS A 323 -9.284 14.922 0.154 1.00 0.00 C ATOM 323 CG HIS A 323 -8.154 15.843 0.495 1.00 0.00 C ATOM 324 ND1 HIS A 323 -6.936 15.801 -0.146 1.00 0.00 N ATOM 325 CD2 HIS A 323 -8.058 16.831 1.416 1.00 0.00 C ATOM 326 CE1 HIS A 323 -6.140 16.720 0.366 1.00 0.00 C ATOM 327 NE2 HIS A 323 -6.797 17.360 1.316 1.00 0.00 N ATOM 0 H HIS A 323 -8.894 12.936 1.988 1.00 0.00 H new ATOM 0 HA HIS A 323 -10.514 15.406 1.840 1.00 0.00 H new ATOM 0 HB2 HIS A 323 -8.878 14.027 -0.317 1.00 0.00 H new ATOM 0 HB3 HIS A 323 -9.924 15.408 -0.583 1.00 0.00 H new ATOM 0 HD2 HIS A 323 -8.831 17.144 2.102 1.00 0.00 H new ATOM 0 HE1 HIS A 323 -5.123 16.916 0.060 1.00 0.00 H new ATOM 0 HE2 HIS A 323 -6.427 18.123 1.883 1.00 0.00 H new ATOM 336 N ASP A 324 -11.052 12.718 -0.002 1.00 0.00 N ATOM 337 CA ASP A 324 -12.098 11.872 -0.585 1.00 0.00 C ATOM 338 C ASP A 324 -11.544 10.492 -0.887 1.00 0.00 C ATOM 339 O ASP A 324 -12.252 9.624 -1.391 1.00 0.00 O ATOM 340 CB ASP A 324 -12.627 12.457 -1.906 1.00 0.00 C ATOM 341 CG ASP A 324 -13.131 13.880 -1.799 1.00 0.00 C ATOM 342 OD1 ASP A 324 -14.314 14.074 -1.457 1.00 0.00 O ATOM 343 OD2 ASP A 324 -12.346 14.812 -2.084 1.00 0.00 O ATOM 0 H ASP A 324 -10.111 12.509 -0.337 1.00 0.00 H new ATOM 0 HA ASP A 324 -12.908 11.819 0.143 1.00 0.00 H new ATOM 0 HB2 ASP A 324 -11.832 12.421 -2.650 1.00 0.00 H new ATOM 0 HB3 ASP A 324 -13.435 11.824 -2.272 1.00 0.00 H new ATOM 348 N THR A 325 -10.274 10.303 -0.578 1.00 0.00 N ATOM 349 CA THR A 325 -9.549 9.125 -1.011 1.00 0.00 C ATOM 350 C THR A 325 -9.030 8.330 0.181 1.00 0.00 C ATOM 351 O THR A 325 -9.349 8.644 1.327 1.00 0.00 O ATOM 352 CB THR A 325 -8.386 9.539 -1.930 1.00 0.00 C ATOM 353 OG1 THR A 325 -7.632 10.606 -1.334 1.00 0.00 O ATOM 354 CG2 THR A 325 -8.918 9.988 -3.283 1.00 0.00 C ATOM 0 H THR A 325 -9.721 10.957 -0.024 1.00 0.00 H new ATOM 0 HA THR A 325 -10.233 8.483 -1.566 1.00 0.00 H new ATOM 0 HB THR A 325 -7.735 8.676 -2.068 1.00 0.00 H new ATOM 0 HG1 THR A 325 -6.895 10.858 -1.929 1.00 0.00 H new ATOM 0 HG21 THR A 325 -8.085 10.278 -3.923 1.00 0.00 H new ATOM 0 HG22 THR A 325 -9.466 9.169 -3.749 1.00 0.00 H new ATOM 0 HG23 THR A 325 -9.585 10.839 -3.147 1.00 0.00 H new ATOM 362 N VAL A 326 -8.249 7.291 -0.088 1.00 0.00 N ATOM 363 CA VAL A 326 -7.737 6.434 0.970 1.00 0.00 C ATOM 364 C VAL A 326 -6.219 6.333 0.900 1.00 0.00 C ATOM 365 O VAL A 326 -5.620 6.504 -0.162 1.00 0.00 O ATOM 366 CB VAL A 326 -8.325 5.006 0.899 1.00 0.00 C ATOM 367 CG1 VAL A 326 -8.470 4.424 2.284 1.00 0.00 C ATOM 368 CG2 VAL A 326 -9.656 4.988 0.184 1.00 0.00 C ATOM 0 H VAL A 326 -7.958 7.023 -1.028 1.00 0.00 H new ATOM 0 HA VAL A 326 -8.041 6.894 1.910 1.00 0.00 H new ATOM 0 HB VAL A 326 -7.629 4.392 0.327 1.00 0.00 H new ATOM 0 HG11 VAL A 326 -8.885 3.419 2.215 1.00 0.00 H new ATOM 0 HG12 VAL A 326 -7.493 4.380 2.765 1.00 0.00 H new ATOM 0 HG13 VAL A 326 -9.137 5.052 2.875 1.00 0.00 H new ATOM 0 HG21 VAL A 326 -10.039 3.968 0.153 1.00 0.00 H new ATOM 0 HG22 VAL A 326 -10.363 5.625 0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 326 -9.528 5.358 -0.833 1.00 0.00 H new ATOM 378 N VAL A 327 -5.617 6.067 2.044 1.00 0.00 N ATOM 379 CA VAL A 327 -4.183 5.871 2.164 1.00 0.00 C ATOM 380 C VAL A 327 -3.907 4.634 3.003 1.00 0.00 C ATOM 381 O VAL A 327 -4.798 4.139 3.688 1.00 0.00 O ATOM 382 CB VAL A 327 -3.500 7.100 2.802 1.00 0.00 C ATOM 383 CG1 VAL A 327 -3.504 8.273 1.838 1.00 0.00 C ATOM 384 CG2 VAL A 327 -4.189 7.480 4.105 1.00 0.00 C ATOM 0 H VAL A 327 -6.117 5.980 2.929 1.00 0.00 H new ATOM 0 HA VAL A 327 -3.771 5.738 1.164 1.00 0.00 H new ATOM 0 HB VAL A 327 -2.465 6.839 3.023 1.00 0.00 H new ATOM 0 HG11 VAL A 327 -3.018 9.130 2.305 1.00 0.00 H new ATOM 0 HG12 VAL A 327 -2.964 8.000 0.931 1.00 0.00 H new ATOM 0 HG13 VAL A 327 -4.532 8.532 1.585 1.00 0.00 H new ATOM 0 HG21 VAL A 327 -3.693 8.348 4.539 1.00 0.00 H new ATOM 0 HG22 VAL A 327 -5.234 7.720 3.908 1.00 0.00 H new ATOM 0 HG23 VAL A 327 -4.134 6.644 4.803 1.00 0.00 H new ATOM 394 N MET A 328 -2.689 4.129 2.943 1.00 0.00 N ATOM 395 CA MET A 328 -2.334 2.929 3.688 1.00 0.00 C ATOM 396 C MET A 328 -0.877 2.977 4.119 1.00 0.00 C ATOM 397 O MET A 328 -0.056 3.629 3.472 1.00 0.00 O ATOM 398 CB MET A 328 -2.633 1.683 2.845 1.00 0.00 C ATOM 399 CG MET A 328 -1.433 0.808 2.519 1.00 0.00 C ATOM 400 SD MET A 328 -1.149 -0.467 3.763 1.00 0.00 S ATOM 401 CE MET A 328 -2.677 -1.396 3.673 1.00 0.00 C ATOM 0 H MET A 328 -1.930 4.527 2.390 1.00 0.00 H new ATOM 0 HA MET A 328 -2.939 2.879 4.593 1.00 0.00 H new ATOM 0 HB2 MET A 328 -3.369 1.077 3.373 1.00 0.00 H new ATOM 0 HB3 MET A 328 -3.093 2.001 1.910 1.00 0.00 H new ATOM 0 HG2 MET A 328 -1.584 0.336 1.548 1.00 0.00 H new ATOM 0 HG3 MET A 328 -0.544 1.433 2.435 1.00 0.00 H new ATOM 0 HE1 MET A 328 -2.455 -2.463 3.684 1.00 0.00 H new ATOM 0 HE2 MET A 328 -3.305 -1.147 4.529 1.00 0.00 H new ATOM 0 HE3 MET A 328 -3.202 -1.144 2.752 1.00 0.00 H new ATOM 411 N GLU A 329 -0.566 2.281 5.202 1.00 0.00 N ATOM 412 CA GLU A 329 0.754 2.348 5.799 1.00 0.00 C ATOM 413 C GLU A 329 1.311 0.944 6.031 1.00 0.00 C ATOM 414 O GLU A 329 0.740 0.151 6.784 1.00 0.00 O ATOM 415 CB GLU A 329 0.659 3.116 7.113 1.00 0.00 C ATOM 416 CG GLU A 329 1.981 3.653 7.614 1.00 0.00 C ATOM 417 CD GLU A 329 1.834 4.547 8.830 1.00 0.00 C ATOM 418 OE1 GLU A 329 2.029 5.771 8.705 1.00 0.00 O ATOM 419 OE2 GLU A 329 1.539 4.029 9.925 1.00 0.00 O ATOM 0 H GLU A 329 -1.216 1.661 5.686 1.00 0.00 H new ATOM 0 HA GLU A 329 1.436 2.865 5.124 1.00 0.00 H new ATOM 0 HB2 GLU A 329 -0.033 3.948 6.985 1.00 0.00 H new ATOM 0 HB3 GLU A 329 0.234 2.461 7.874 1.00 0.00 H new ATOM 0 HG2 GLU A 329 2.636 2.818 7.861 1.00 0.00 H new ATOM 0 HG3 GLU A 329 2.466 4.213 6.814 1.00 0.00 H new ATOM 426 N VAL A 330 2.424 0.639 5.378 1.00 0.00 N ATOM 427 CA VAL A 330 3.051 -0.677 5.493 1.00 0.00 C ATOM 428 C VAL A 330 4.492 -0.570 5.980 1.00 0.00 C ATOM 429 O VAL A 330 5.175 0.420 5.717 1.00 0.00 O ATOM 430 CB VAL A 330 3.032 -1.452 4.154 1.00 0.00 C ATOM 431 CG1 VAL A 330 1.679 -2.101 3.931 1.00 0.00 C ATOM 432 CG2 VAL A 330 3.376 -0.538 2.985 1.00 0.00 C ATOM 0 H VAL A 330 2.915 1.285 4.760 1.00 0.00 H new ATOM 0 HA VAL A 330 2.460 -1.227 6.225 1.00 0.00 H new ATOM 0 HB VAL A 330 3.790 -2.233 4.211 1.00 0.00 H new ATOM 0 HG11 VAL A 330 1.686 -2.641 2.984 1.00 0.00 H new ATOM 0 HG12 VAL A 330 1.471 -2.797 4.744 1.00 0.00 H new ATOM 0 HG13 VAL A 330 0.907 -1.332 3.904 1.00 0.00 H new ATOM 0 HG21 VAL A 330 3.355 -1.110 2.057 1.00 0.00 H new ATOM 0 HG22 VAL A 330 2.648 0.271 2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 330 4.372 -0.120 3.131 1.00 0.00 H new ATOM 442 N GLY A 331 4.955 -1.600 6.679 1.00 0.00 N ATOM 443 CA GLY A 331 6.318 -1.602 7.189 1.00 0.00 C ATOM 444 C GLY A 331 7.153 -2.702 6.560 1.00 0.00 C ATOM 445 O GLY A 331 6.678 -3.822 6.425 1.00 0.00 O ATOM 0 H GLY A 331 4.413 -2.435 6.903 1.00 0.00 H new ATOM 0 HA2 GLY A 331 6.782 -0.636 6.991 1.00 0.00 H new ATOM 0 HA3 GLY A 331 6.301 -1.732 8.271 1.00 0.00 H new ATOM 449 N PHE A 332 8.389 -2.392 6.174 1.00 0.00 N ATOM 450 CA PHE A 332 9.246 -3.367 5.490 1.00 0.00 C ATOM 451 C PHE A 332 10.085 -4.155 6.483 1.00 0.00 C ATOM 452 O PHE A 332 10.013 -3.949 7.695 1.00 0.00 O ATOM 453 CB PHE A 332 10.194 -2.702 4.482 1.00 0.00 C ATOM 454 CG PHE A 332 11.319 -1.927 5.124 1.00 0.00 C ATOM 455 CD1 PHE A 332 11.078 -0.999 6.125 1.00 0.00 C ATOM 456 CD2 PHE A 332 12.628 -2.152 4.734 1.00 0.00 C ATOM 457 CE1 PHE A 332 12.119 -0.316 6.721 1.00 0.00 C ATOM 458 CE2 PHE A 332 13.673 -1.468 5.323 1.00 0.00 C ATOM 459 CZ PHE A 332 13.418 -0.551 6.319 1.00 0.00 C ATOM 0 H PHE A 332 8.821 -1.480 6.321 1.00 0.00 H new ATOM 0 HA PHE A 332 8.571 -4.035 4.956 1.00 0.00 H new ATOM 0 HB2 PHE A 332 10.617 -3.470 3.834 1.00 0.00 H new ATOM 0 HB3 PHE A 332 9.619 -2.030 3.845 1.00 0.00 H new ATOM 0 HD1 PHE A 332 10.064 -0.808 6.442 1.00 0.00 H new ATOM 0 HD2 PHE A 332 12.835 -2.873 3.957 1.00 0.00 H new ATOM 0 HE1 PHE A 332 11.917 0.402 7.502 1.00 0.00 H new ATOM 0 HE2 PHE A 332 14.688 -1.652 5.003 1.00 0.00 H new ATOM 0 HZ PHE A 332 14.233 -0.017 6.784 1.00 0.00 H new ATOM 469 N SER A 333 10.894 -5.048 5.939 1.00 0.00 N ATOM 470 CA SER A 333 11.738 -5.918 6.742 1.00 0.00 C ATOM 471 C SER A 333 13.229 -5.716 6.435 1.00 0.00 C ATOM 472 O SER A 333 14.073 -5.978 7.292 1.00 0.00 O ATOM 473 CB SER A 333 11.343 -7.380 6.515 1.00 0.00 C ATOM 474 OG SER A 333 9.982 -7.597 6.849 1.00 0.00 O ATOM 0 H SER A 333 10.985 -5.191 4.933 1.00 0.00 H new ATOM 0 HA SER A 333 11.584 -5.657 7.789 1.00 0.00 H new ATOM 0 HB2 SER A 333 11.512 -7.648 5.472 1.00 0.00 H new ATOM 0 HB3 SER A 333 11.977 -8.030 7.118 1.00 0.00 H new ATOM 0 HG SER A 333 9.409 -7.149 6.192 1.00 0.00 H new ATOM 480 N GLY A 334 13.563 -5.252 5.226 1.00 0.00 N ATOM 481 CA GLY A 334 14.974 -5.085 4.886 1.00 0.00 C ATOM 482 C GLY A 334 15.248 -4.443 3.527 1.00 0.00 C ATOM 483 O GLY A 334 16.348 -3.960 3.292 1.00 0.00 O ATOM 0 H GLY A 334 12.902 -4.995 4.493 1.00 0.00 H new ATOM 0 HA2 GLY A 334 15.447 -4.478 5.658 1.00 0.00 H new ATOM 0 HA3 GLY A 334 15.455 -6.063 4.911 1.00 0.00 H new ATOM 487 N THR A 335 14.276 -4.455 2.625 1.00 0.00 N ATOM 488 CA THR A 335 14.463 -3.895 1.287 1.00 0.00 C ATOM 489 C THR A 335 14.443 -2.359 1.286 1.00 0.00 C ATOM 490 O THR A 335 13.583 -1.745 1.913 1.00 0.00 O ATOM 491 CB THR A 335 13.344 -4.393 0.368 1.00 0.00 C ATOM 492 OG1 THR A 335 13.142 -5.787 0.596 1.00 0.00 O ATOM 493 CG2 THR A 335 13.686 -4.161 -1.093 1.00 0.00 C ATOM 0 H THR A 335 13.349 -4.846 2.792 1.00 0.00 H new ATOM 0 HA THR A 335 15.441 -4.222 0.935 1.00 0.00 H new ATOM 0 HB THR A 335 12.435 -3.836 0.594 1.00 0.00 H new ATOM 0 HG1 THR A 335 14.009 -6.228 0.715 1.00 0.00 H new ATOM 0 HG21 THR A 335 12.872 -4.525 -1.720 1.00 0.00 H new ATOM 0 HG22 THR A 335 13.830 -3.095 -1.268 1.00 0.00 H new ATOM 0 HG23 THR A 335 14.602 -4.696 -1.342 1.00 0.00 H new ATOM 501 N ARG A 336 15.396 -1.747 0.575 1.00 0.00 N ATOM 502 CA ARG A 336 15.379 -0.302 0.352 1.00 0.00 C ATOM 503 C ARG A 336 14.365 0.010 -0.750 1.00 0.00 C ATOM 504 O ARG A 336 13.869 -0.937 -1.358 1.00 0.00 O ATOM 505 CB ARG A 336 16.782 0.205 -0.024 1.00 0.00 C ATOM 506 CG ARG A 336 17.178 -0.007 -1.484 1.00 0.00 C ATOM 507 CD ARG A 336 17.403 1.333 -2.178 1.00 0.00 C ATOM 508 NE ARG A 336 17.848 1.203 -3.567 1.00 0.00 N ATOM 509 CZ ARG A 336 19.037 1.621 -4.005 1.00 0.00 C ATOM 510 NH1 ARG A 336 19.947 2.053 -3.140 1.00 0.00 N ATOM 511 NH2 ARG A 336 19.322 1.587 -5.303 1.00 0.00 N ATOM 0 H ARG A 336 16.185 -2.230 0.146 1.00 0.00 H new ATOM 0 HA ARG A 336 15.085 0.211 1.268 1.00 0.00 H new ATOM 0 HB2 ARG A 336 16.839 1.270 0.201 1.00 0.00 H new ATOM 0 HB3 ARG A 336 17.514 -0.294 0.611 1.00 0.00 H new ATOM 0 HG2 ARG A 336 18.086 -0.607 -1.537 1.00 0.00 H new ATOM 0 HG3 ARG A 336 16.397 -0.564 -2.001 1.00 0.00 H new ATOM 0 HD2 ARG A 336 16.476 1.906 -2.154 1.00 0.00 H new ATOM 0 HD3 ARG A 336 18.145 1.903 -1.619 1.00 0.00 H new ATOM 0 HE ARG A 336 17.214 0.769 -4.237 1.00 0.00 H new ATOM 0 HH11 ARG A 336 19.737 2.065 -2.142 1.00 0.00 H new ATOM 0 HH12 ARG A 336 20.856 2.373 -3.474 1.00 0.00 H new ATOM 0 HH21 ARG A 336 18.631 1.240 -5.968 1.00 0.00 H new ATOM 0 HH22 ARG A 336 20.232 1.907 -5.634 1.00 0.00 H new ATOM 525 N PRO A 337 14.073 1.311 -1.050 1.00 0.00 N ATOM 526 CA PRO A 337 13.017 1.722 -1.986 1.00 0.00 C ATOM 527 C PRO A 337 12.667 0.689 -3.043 1.00 0.00 C ATOM 528 O PRO A 337 13.307 0.573 -4.090 1.00 0.00 O ATOM 529 CB PRO A 337 13.623 2.965 -2.593 1.00 0.00 C ATOM 530 CG PRO A 337 14.278 3.625 -1.427 1.00 0.00 C ATOM 531 CD PRO A 337 14.725 2.515 -0.492 1.00 0.00 C ATOM 0 HA PRO A 337 12.058 1.869 -1.489 1.00 0.00 H new ATOM 0 HB2 PRO A 337 14.342 2.722 -3.375 1.00 0.00 H new ATOM 0 HB3 PRO A 337 12.864 3.604 -3.045 1.00 0.00 H new ATOM 0 HG2 PRO A 337 15.129 4.225 -1.750 1.00 0.00 H new ATOM 0 HG3 PRO A 337 13.585 4.299 -0.924 1.00 0.00 H new ATOM 0 HD2 PRO A 337 15.810 2.414 -0.479 1.00 0.00 H new ATOM 0 HD3 PRO A 337 14.410 2.703 0.534 1.00 0.00 H new ATOM 539 N CYS A 338 11.629 -0.063 -2.729 1.00 0.00 N ATOM 540 CA CYS A 338 11.203 -1.178 -3.554 1.00 0.00 C ATOM 541 C CYS A 338 9.875 -0.864 -4.221 1.00 0.00 C ATOM 542 O CYS A 338 9.197 0.094 -3.852 1.00 0.00 O ATOM 543 CB CYS A 338 11.067 -2.439 -2.695 1.00 0.00 C ATOM 544 SG CYS A 338 9.694 -2.380 -1.510 1.00 0.00 S ATOM 0 H CYS A 338 11.058 0.081 -1.896 1.00 0.00 H new ATOM 0 HA CYS A 338 11.953 -1.348 -4.327 1.00 0.00 H new ATOM 0 HB2 CYS A 338 10.931 -3.300 -3.350 1.00 0.00 H new ATOM 0 HB3 CYS A 338 11.998 -2.597 -2.150 1.00 0.00 H new ATOM 549 N ARG A 339 9.510 -1.674 -5.200 1.00 0.00 N ATOM 550 CA ARG A 339 8.263 -1.487 -5.927 1.00 0.00 C ATOM 551 C ARG A 339 7.169 -2.332 -5.292 1.00 0.00 C ATOM 552 O ARG A 339 7.147 -3.553 -5.454 1.00 0.00 O ATOM 553 CB ARG A 339 8.426 -1.859 -7.408 1.00 0.00 C ATOM 554 CG ARG A 339 9.319 -0.912 -8.203 1.00 0.00 C ATOM 555 CD ARG A 339 10.790 -1.089 -7.858 1.00 0.00 C ATOM 556 NE ARG A 339 11.651 -0.186 -8.621 1.00 0.00 N ATOM 557 CZ ARG A 339 12.770 -0.566 -9.241 1.00 0.00 C ATOM 558 NH1 ARG A 339 13.128 -1.845 -9.249 1.00 0.00 N ATOM 559 NH2 ARG A 339 13.516 0.329 -9.878 1.00 0.00 N ATOM 0 H ARG A 339 10.062 -2.473 -5.512 1.00 0.00 H new ATOM 0 HA ARG A 339 7.986 -0.434 -5.873 1.00 0.00 H new ATOM 0 HB2 ARG A 339 8.837 -2.866 -7.473 1.00 0.00 H new ATOM 0 HB3 ARG A 339 7.441 -1.886 -7.873 1.00 0.00 H new ATOM 0 HG2 ARG A 339 9.173 -1.086 -9.269 1.00 0.00 H new ATOM 0 HG3 ARG A 339 9.022 0.118 -8.005 1.00 0.00 H new ATOM 0 HD2 ARG A 339 10.935 -0.912 -6.792 1.00 0.00 H new ATOM 0 HD3 ARG A 339 11.085 -2.120 -8.053 1.00 0.00 H new ATOM 0 HE ARG A 339 11.379 0.795 -8.683 1.00 0.00 H new ATOM 0 HH11 ARG A 339 12.547 -2.540 -8.780 1.00 0.00 H new ATOM 0 HH12 ARG A 339 13.984 -2.132 -9.724 1.00 0.00 H new ATOM 0 HH21 ARG A 339 13.234 1.309 -9.894 1.00 0.00 H new ATOM 0 HH22 ARG A 339 14.371 0.036 -10.351 1.00 0.00 H new ATOM 573 N ILE A 340 6.279 -1.680 -4.557 1.00 0.00 N ATOM 574 CA ILE A 340 5.229 -2.381 -3.826 1.00 0.00 C ATOM 575 C ILE A 340 4.124 -2.848 -4.768 1.00 0.00 C ATOM 576 O ILE A 340 3.543 -2.042 -5.498 1.00 0.00 O ATOM 577 CB ILE A 340 4.586 -1.485 -2.746 1.00 0.00 C ATOM 578 CG1 ILE A 340 5.634 -0.608 -2.063 1.00 0.00 C ATOM 579 CG2 ILE A 340 3.873 -2.346 -1.714 1.00 0.00 C ATOM 580 CD1 ILE A 340 5.040 0.384 -1.081 1.00 0.00 C ATOM 0 H ILE A 340 6.262 -0.666 -4.450 1.00 0.00 H new ATOM 0 HA ILE A 340 5.707 -3.237 -3.351 1.00 0.00 H new ATOM 0 HB ILE A 340 3.862 -0.831 -3.232 1.00 0.00 H new ATOM 0 HG12 ILE A 340 6.345 -1.246 -1.539 1.00 0.00 H new ATOM 0 HG13 ILE A 340 6.194 -0.064 -2.824 1.00 0.00 H new ATOM 0 HG21 ILE A 340 3.422 -1.706 -0.955 1.00 0.00 H new ATOM 0 HG22 ILE A 340 3.095 -2.932 -2.204 1.00 0.00 H new ATOM 0 HG23 ILE A 340 4.590 -3.018 -1.242 1.00 0.00 H new ATOM 0 HD11 ILE A 340 5.839 0.974 -0.632 1.00 0.00 H new ATOM 0 HD12 ILE A 340 4.350 1.046 -1.605 1.00 0.00 H new ATOM 0 HD13 ILE A 340 4.504 -0.154 -0.300 1.00 0.00 H new ATOM 592 N PRO A 341 3.820 -4.154 -4.779 1.00 0.00 N ATOM 593 CA PRO A 341 2.711 -4.690 -5.561 1.00 0.00 C ATOM 594 C PRO A 341 1.372 -4.503 -4.845 1.00 0.00 C ATOM 595 O PRO A 341 0.856 -5.417 -4.208 1.00 0.00 O ATOM 596 CB PRO A 341 3.065 -6.172 -5.686 1.00 0.00 C ATOM 597 CG PRO A 341 3.851 -6.485 -4.456 1.00 0.00 C ATOM 598 CD PRO A 341 4.544 -5.209 -4.043 1.00 0.00 C ATOM 0 HA PRO A 341 2.590 -4.190 -6.522 1.00 0.00 H new ATOM 0 HB2 PRO A 341 2.168 -6.788 -5.749 1.00 0.00 H new ATOM 0 HB3 PRO A 341 3.648 -6.364 -6.587 1.00 0.00 H new ATOM 0 HG2 PRO A 341 3.198 -6.844 -3.661 1.00 0.00 H new ATOM 0 HG3 PRO A 341 4.578 -7.273 -4.652 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.487 -5.055 -2.965 1.00 0.00 H new ATOM 0 HD3 PRO A 341 5.601 -5.226 -4.307 1.00 0.00 H new ATOM 606 N VAL A 342 0.811 -3.311 -4.961 1.00 0.00 N ATOM 607 CA VAL A 342 -0.434 -2.979 -4.282 1.00 0.00 C ATOM 608 C VAL A 342 -1.624 -3.059 -5.225 1.00 0.00 C ATOM 609 O VAL A 342 -1.578 -2.580 -6.359 1.00 0.00 O ATOM 610 CB VAL A 342 -0.376 -1.579 -3.649 1.00 0.00 C ATOM 611 CG1 VAL A 342 0.560 -1.597 -2.458 1.00 0.00 C ATOM 612 CG2 VAL A 342 0.069 -0.535 -4.663 1.00 0.00 C ATOM 0 H VAL A 342 1.199 -2.552 -5.522 1.00 0.00 H new ATOM 0 HA VAL A 342 -0.563 -3.718 -3.491 1.00 0.00 H new ATOM 0 HB VAL A 342 -1.377 -1.308 -3.314 1.00 0.00 H new ATOM 0 HG11 VAL A 342 0.599 -0.604 -2.011 1.00 0.00 H new ATOM 0 HG12 VAL A 342 0.197 -2.313 -1.720 1.00 0.00 H new ATOM 0 HG13 VAL A 342 1.559 -1.888 -2.784 1.00 0.00 H new ATOM 0 HG21 VAL A 342 0.101 0.445 -4.186 1.00 0.00 H new ATOM 0 HG22 VAL A 342 1.061 -0.789 -5.036 1.00 0.00 H new ATOM 0 HG23 VAL A 342 -0.636 -0.512 -5.494 1.00 0.00 H new ATOM 622 N ARG A 343 -2.672 -3.699 -4.754 1.00 0.00 N ATOM 623 CA ARG A 343 -3.942 -3.729 -5.450 1.00 0.00 C ATOM 624 C ARG A 343 -5.043 -3.677 -4.411 1.00 0.00 C ATOM 625 O ARG A 343 -4.752 -3.540 -3.232 1.00 0.00 O ATOM 626 CB ARG A 343 -4.076 -4.994 -6.294 1.00 0.00 C ATOM 627 CG ARG A 343 -4.232 -6.266 -5.472 1.00 0.00 C ATOM 628 CD ARG A 343 -4.254 -7.501 -6.361 1.00 0.00 C ATOM 629 NE ARG A 343 -4.590 -8.722 -5.623 1.00 0.00 N ATOM 630 CZ ARG A 343 -4.127 -9.934 -5.947 1.00 0.00 C ATOM 631 NH1 ARG A 343 -3.242 -10.070 -6.924 1.00 0.00 N ATOM 632 NH2 ARG A 343 -4.540 -11.014 -5.295 1.00 0.00 N ATOM 0 H ARG A 343 -2.668 -4.215 -3.874 1.00 0.00 H new ATOM 0 HA ARG A 343 -4.010 -2.877 -6.126 1.00 0.00 H new ATOM 0 HB2 ARG A 343 -4.938 -4.890 -6.953 1.00 0.00 H new ATOM 0 HB3 ARG A 343 -3.197 -5.090 -6.931 1.00 0.00 H new ATOM 0 HG2 ARG A 343 -3.411 -6.343 -4.759 1.00 0.00 H new ATOM 0 HG3 ARG A 343 -5.154 -6.216 -4.893 1.00 0.00 H new ATOM 0 HD2 ARG A 343 -4.978 -7.354 -7.162 1.00 0.00 H new ATOM 0 HD3 ARG A 343 -3.278 -7.622 -6.832 1.00 0.00 H new ATOM 0 HE ARG A 343 -5.211 -8.643 -4.818 1.00 0.00 H new ATOM 0 HH11 ARG A 343 -2.912 -9.249 -7.431 1.00 0.00 H new ATOM 0 HH12 ARG A 343 -2.891 -10.996 -7.169 1.00 0.00 H new ATOM 0 HH21 ARG A 343 -5.218 -10.925 -4.538 1.00 0.00 H new ATOM 0 HH22 ARG A 343 -4.180 -11.933 -5.551 1.00 0.00 H new ATOM 646 N ALA A 344 -6.293 -3.784 -4.818 1.00 0.00 N ATOM 647 CA ALA A 344 -7.379 -3.776 -3.859 1.00 0.00 C ATOM 648 C ALA A 344 -8.616 -4.449 -4.417 1.00 0.00 C ATOM 649 O ALA A 344 -8.922 -4.338 -5.599 1.00 0.00 O ATOM 650 CB ALA A 344 -7.692 -2.355 -3.427 1.00 0.00 C ATOM 0 H ALA A 344 -6.579 -3.876 -5.793 1.00 0.00 H new ATOM 0 HA ALA A 344 -7.059 -4.345 -2.986 1.00 0.00 H new ATOM 0 HB1 ALA A 344 -8.510 -2.366 -2.707 1.00 0.00 H new ATOM 0 HB2 ALA A 344 -6.809 -1.912 -2.967 1.00 0.00 H new ATOM 0 HB3 ALA A 344 -7.982 -1.766 -4.297 1.00 0.00 H new ATOM 656 N VAL A 345 -9.317 -5.153 -3.556 1.00 0.00 N ATOM 657 CA VAL A 345 -10.551 -5.810 -3.928 1.00 0.00 C ATOM 658 C VAL A 345 -11.698 -5.180 -3.156 1.00 0.00 C ATOM 659 O VAL A 345 -11.478 -4.343 -2.280 1.00 0.00 O ATOM 660 CB VAL A 345 -10.493 -7.332 -3.656 1.00 0.00 C ATOM 661 CG1 VAL A 345 -9.272 -7.951 -4.317 1.00 0.00 C ATOM 662 CG2 VAL A 345 -10.502 -7.631 -2.166 1.00 0.00 C ATOM 0 H VAL A 345 -9.049 -5.286 -2.581 1.00 0.00 H new ATOM 0 HA VAL A 345 -10.705 -5.679 -4.999 1.00 0.00 H new ATOM 0 HB VAL A 345 -11.387 -7.779 -4.091 1.00 0.00 H new ATOM 0 HG11 VAL A 345 -9.251 -9.021 -4.113 1.00 0.00 H new ATOM 0 HG12 VAL A 345 -9.319 -7.788 -5.394 1.00 0.00 H new ATOM 0 HG13 VAL A 345 -8.369 -7.488 -3.919 1.00 0.00 H new ATOM 0 HG21 VAL A 345 -10.460 -8.709 -2.011 1.00 0.00 H new ATOM 0 HG22 VAL A 345 -9.637 -7.163 -1.696 1.00 0.00 H new ATOM 0 HG23 VAL A 345 -11.415 -7.235 -1.721 1.00 0.00 H new ATOM 672 N ALA A 346 -12.910 -5.561 -3.479 1.00 0.00 N ATOM 673 CA ALA A 346 -14.067 -4.981 -2.834 1.00 0.00 C ATOM 674 C ALA A 346 -14.616 -5.941 -1.795 1.00 0.00 C ATOM 675 O ALA A 346 -15.068 -7.026 -2.138 1.00 0.00 O ATOM 676 CB ALA A 346 -15.115 -4.650 -3.878 1.00 0.00 C ATOM 0 H ALA A 346 -13.123 -6.268 -4.183 1.00 0.00 H new ATOM 0 HA ALA A 346 -13.781 -4.060 -2.326 1.00 0.00 H new ATOM 0 HB1 ALA A 346 -15.987 -4.213 -3.392 1.00 0.00 H new ATOM 0 HB2 ALA A 346 -14.704 -3.938 -4.594 1.00 0.00 H new ATOM 0 HB3 ALA A 346 -15.409 -5.561 -4.400 1.00 0.00 H new ATOM 682 N HIS A 347 -14.561 -5.525 -0.527 1.00 0.00 N ATOM 683 CA HIS A 347 -14.986 -6.349 0.619 1.00 0.00 C ATOM 684 C HIS A 347 -14.625 -7.831 0.462 1.00 0.00 C ATOM 685 O HIS A 347 -15.500 -8.693 0.386 1.00 0.00 O ATOM 686 CB HIS A 347 -16.489 -6.172 0.949 1.00 0.00 C ATOM 687 CG HIS A 347 -17.447 -6.241 -0.208 1.00 0.00 C ATOM 688 ND1 HIS A 347 -18.205 -5.164 -0.612 1.00 0.00 N ATOM 689 CD2 HIS A 347 -17.792 -7.264 -1.023 1.00 0.00 C ATOM 690 CE1 HIS A 347 -18.970 -5.520 -1.624 1.00 0.00 C ATOM 691 NE2 HIS A 347 -18.739 -6.790 -1.894 1.00 0.00 N ATOM 0 H HIS A 347 -14.219 -4.602 -0.260 1.00 0.00 H new ATOM 0 HA HIS A 347 -14.416 -5.975 1.470 1.00 0.00 H new ATOM 0 HB2 HIS A 347 -16.771 -6.938 1.671 1.00 0.00 H new ATOM 0 HB3 HIS A 347 -16.618 -5.208 1.441 1.00 0.00 H new ATOM 0 HD1 HIS A 347 -18.178 -4.235 -0.193 1.00 0.00 H new ATOM 0 HD2 HIS A 347 -17.395 -8.268 -0.993 1.00 0.00 H new ATOM 0 HE1 HIS A 347 -19.668 -4.880 -2.144 1.00 0.00 H new ATOM 700 N GLY A 348 -13.325 -8.114 0.432 1.00 0.00 N ATOM 701 CA GLY A 348 -12.847 -9.487 0.321 1.00 0.00 C ATOM 702 C GLY A 348 -13.171 -10.164 -1.006 1.00 0.00 C ATOM 703 O GLY A 348 -12.918 -11.358 -1.170 1.00 0.00 O ATOM 0 H GLY A 348 -12.587 -7.412 0.483 1.00 0.00 H new ATOM 0 HA2 GLY A 348 -11.766 -9.495 0.464 1.00 0.00 H new ATOM 0 HA3 GLY A 348 -13.280 -10.076 1.130 1.00 0.00 H new ATOM 707 N VAL A 349 -13.724 -9.421 -1.957 1.00 0.00 N ATOM 708 CA VAL A 349 -14.101 -9.996 -3.243 1.00 0.00 C ATOM 709 C VAL A 349 -13.288 -9.394 -4.383 1.00 0.00 C ATOM 710 O VAL A 349 -13.399 -8.200 -4.678 1.00 0.00 O ATOM 711 CB VAL A 349 -15.598 -9.787 -3.551 1.00 0.00 C ATOM 712 CG1 VAL A 349 -15.987 -10.509 -4.834 1.00 0.00 C ATOM 713 CG2 VAL A 349 -16.459 -10.257 -2.391 1.00 0.00 C ATOM 0 H VAL A 349 -13.921 -8.425 -1.863 1.00 0.00 H new ATOM 0 HA VAL A 349 -13.895 -11.064 -3.167 1.00 0.00 H new ATOM 0 HB VAL A 349 -15.770 -8.720 -3.691 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -17.047 -10.350 -5.034 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -15.398 -10.119 -5.664 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -15.795 -11.576 -4.723 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -17.510 -10.100 -2.631 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -16.282 -11.318 -2.213 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -16.203 -9.691 -1.495 1.00 0.00 H new ATOM 723 N PRO A 350 -12.442 -10.209 -5.024 1.00 0.00 N ATOM 724 CA PRO A 350 -11.728 -9.822 -6.239 1.00 0.00 C ATOM 725 C PRO A 350 -12.656 -9.815 -7.451 1.00 0.00 C ATOM 726 O PRO A 350 -12.552 -10.660 -8.341 1.00 0.00 O ATOM 727 CB PRO A 350 -10.644 -10.903 -6.393 1.00 0.00 C ATOM 728 CG PRO A 350 -10.677 -11.683 -5.120 1.00 0.00 C ATOM 729 CD PRO A 350 -12.079 -11.564 -4.605 1.00 0.00 C ATOM 0 HA PRO A 350 -11.318 -8.814 -6.173 1.00 0.00 H new ATOM 0 HB2 PRO A 350 -10.847 -11.543 -7.251 1.00 0.00 H new ATOM 0 HB3 PRO A 350 -9.663 -10.456 -6.554 1.00 0.00 H new ATOM 0 HG2 PRO A 350 -10.411 -12.726 -5.293 1.00 0.00 H new ATOM 0 HG3 PRO A 350 -9.961 -11.287 -4.400 1.00 0.00 H new ATOM 0 HD2 PRO A 350 -12.738 -12.316 -5.039 1.00 0.00 H new ATOM 0 HD3 PRO A 350 -12.128 -11.683 -3.523 1.00 0.00 H new ATOM 737 N GLU A 351 -13.578 -8.865 -7.466 1.00 0.00 N ATOM 738 CA GLU A 351 -14.533 -8.732 -8.554 1.00 0.00 C ATOM 739 C GLU A 351 -13.987 -7.719 -9.532 1.00 0.00 C ATOM 740 O GLU A 351 -13.923 -7.950 -10.740 1.00 0.00 O ATOM 741 CB GLU A 351 -15.885 -8.255 -8.014 1.00 0.00 C ATOM 742 CG GLU A 351 -16.947 -8.077 -9.080 1.00 0.00 C ATOM 743 CD GLU A 351 -18.187 -7.378 -8.558 1.00 0.00 C ATOM 744 OE1 GLU A 351 -18.956 -8.001 -7.797 1.00 0.00 O ATOM 745 OE2 GLU A 351 -18.404 -6.204 -8.919 1.00 0.00 O ATOM 0 H GLU A 351 -13.685 -8.168 -6.729 1.00 0.00 H new ATOM 0 HA GLU A 351 -14.680 -9.695 -9.044 1.00 0.00 H new ATOM 0 HB2 GLU A 351 -16.243 -8.972 -7.275 1.00 0.00 H new ATOM 0 HB3 GLU A 351 -15.743 -7.307 -7.495 1.00 0.00 H new ATOM 0 HG2 GLU A 351 -16.532 -7.502 -9.908 1.00 0.00 H new ATOM 0 HG3 GLU A 351 -17.225 -9.053 -9.477 1.00 0.00 H new ATOM 752 N VAL A 352 -13.580 -6.601 -8.966 1.00 0.00 N ATOM 753 CA VAL A 352 -12.960 -5.524 -9.696 1.00 0.00 C ATOM 754 C VAL A 352 -11.927 -4.866 -8.795 1.00 0.00 C ATOM 755 O VAL A 352 -12.200 -4.596 -7.624 1.00 0.00 O ATOM 756 CB VAL A 352 -14.011 -4.486 -10.161 1.00 0.00 C ATOM 757 CG1 VAL A 352 -14.835 -3.988 -8.984 1.00 0.00 C ATOM 758 CG2 VAL A 352 -13.348 -3.321 -10.885 1.00 0.00 C ATOM 0 H VAL A 352 -13.675 -6.416 -7.967 1.00 0.00 H new ATOM 0 HA VAL A 352 -12.480 -5.922 -10.590 1.00 0.00 H new ATOM 0 HB VAL A 352 -14.682 -4.981 -10.863 1.00 0.00 H new ATOM 0 HG11 VAL A 352 -15.567 -3.260 -9.334 1.00 0.00 H new ATOM 0 HG12 VAL A 352 -15.352 -4.828 -8.521 1.00 0.00 H new ATOM 0 HG13 VAL A 352 -14.178 -3.518 -8.252 1.00 0.00 H new ATOM 0 HG21 VAL A 352 -14.110 -2.608 -11.200 1.00 0.00 H new ATOM 0 HG22 VAL A 352 -12.645 -2.828 -10.214 1.00 0.00 H new ATOM 0 HG23 VAL A 352 -12.815 -3.693 -11.760 1.00 0.00 H new ATOM 768 N ASN A 353 -10.732 -4.673 -9.318 1.00 0.00 N ATOM 769 CA ASN A 353 -9.674 -4.004 -8.575 1.00 0.00 C ATOM 770 C ASN A 353 -10.110 -2.590 -8.204 1.00 0.00 C ATOM 771 O ASN A 353 -10.193 -1.709 -9.061 1.00 0.00 O ATOM 772 CB ASN A 353 -8.384 -3.961 -9.405 1.00 0.00 C ATOM 773 CG ASN A 353 -7.237 -3.271 -8.685 1.00 0.00 C ATOM 774 OD1 ASN A 353 -7.131 -3.319 -7.462 1.00 0.00 O ATOM 775 ND2 ASN A 353 -6.365 -2.624 -9.442 1.00 0.00 N ATOM 0 H ASN A 353 -10.466 -4.970 -10.257 1.00 0.00 H new ATOM 0 HA ASN A 353 -9.479 -4.564 -7.661 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -8.087 -4.979 -9.658 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -8.580 -3.444 -10.344 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -5.574 -2.144 -9.013 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -6.484 -2.605 -10.455 1.00 0.00 H new ATOM 782 N VAL A 354 -10.392 -2.379 -6.926 1.00 0.00 N ATOM 783 CA VAL A 354 -10.853 -1.081 -6.455 1.00 0.00 C ATOM 784 C VAL A 354 -9.675 -0.169 -6.160 1.00 0.00 C ATOM 785 O VAL A 354 -9.844 0.967 -5.719 1.00 0.00 O ATOM 786 CB VAL A 354 -11.742 -1.188 -5.196 1.00 0.00 C ATOM 787 CG1 VAL A 354 -13.002 -1.989 -5.489 1.00 0.00 C ATOM 788 CG2 VAL A 354 -10.977 -1.804 -4.043 1.00 0.00 C ATOM 0 H VAL A 354 -10.310 -3.089 -6.198 1.00 0.00 H new ATOM 0 HA VAL A 354 -11.458 -0.659 -7.258 1.00 0.00 H new ATOM 0 HB VAL A 354 -12.037 -0.179 -4.908 1.00 0.00 H new ATOM 0 HG11 VAL A 354 -13.612 -2.051 -4.588 1.00 0.00 H new ATOM 0 HG12 VAL A 354 -13.570 -1.497 -6.279 1.00 0.00 H new ATOM 0 HG13 VAL A 354 -12.728 -2.994 -5.811 1.00 0.00 H new ATOM 0 HG21 VAL A 354 -11.625 -1.868 -3.169 1.00 0.00 H new ATOM 0 HG22 VAL A 354 -10.643 -2.804 -4.321 1.00 0.00 H new ATOM 0 HG23 VAL A 354 -10.112 -1.184 -3.808 1.00 0.00 H new ATOM 798 N ALA A 355 -8.473 -0.670 -6.402 1.00 0.00 N ATOM 799 CA ALA A 355 -7.282 0.121 -6.186 1.00 0.00 C ATOM 800 C ALA A 355 -7.052 1.063 -7.352 1.00 0.00 C ATOM 801 O ALA A 355 -6.283 0.766 -8.267 1.00 0.00 O ATOM 802 CB ALA A 355 -6.066 -0.769 -5.979 1.00 0.00 C ATOM 0 H ALA A 355 -8.302 -1.615 -6.746 1.00 0.00 H new ATOM 0 HA ALA A 355 -7.429 0.712 -5.282 1.00 0.00 H new ATOM 0 HB1 ALA A 355 -5.184 -0.149 -5.819 1.00 0.00 H new ATOM 0 HB2 ALA A 355 -6.225 -1.406 -5.109 1.00 0.00 H new ATOM 0 HB3 ALA A 355 -5.916 -1.391 -6.861 1.00 0.00 H new ATOM 808 N MET A 356 -7.729 2.194 -7.323 1.00 0.00 N ATOM 809 CA MET A 356 -7.446 3.250 -8.258 1.00 0.00 C ATOM 810 C MET A 356 -6.552 4.214 -7.528 1.00 0.00 C ATOM 811 O MET A 356 -7.013 5.079 -6.779 1.00 0.00 O ATOM 812 CB MET A 356 -8.723 3.927 -8.752 1.00 0.00 C ATOM 813 CG MET A 356 -8.774 4.088 -10.262 1.00 0.00 C ATOM 814 SD MET A 356 -7.382 5.029 -10.920 1.00 0.00 S ATOM 815 CE MET A 356 -7.759 4.988 -12.672 1.00 0.00 C ATOM 0 H MET A 356 -8.477 2.399 -6.661 1.00 0.00 H new ATOM 0 HA MET A 356 -6.962 2.863 -9.155 1.00 0.00 H new ATOM 0 HB2 MET A 356 -9.584 3.343 -8.427 1.00 0.00 H new ATOM 0 HB3 MET A 356 -8.809 4.909 -8.286 1.00 0.00 H new ATOM 0 HG2 MET A 356 -8.790 3.102 -10.726 1.00 0.00 H new ATOM 0 HG3 MET A 356 -9.704 4.585 -10.537 1.00 0.00 H new ATOM 0 HE1 MET A 356 -6.989 5.529 -13.223 1.00 0.00 H new ATOM 0 HE2 MET A 356 -7.790 3.953 -13.013 1.00 0.00 H new ATOM 0 HE3 MET A 356 -8.727 5.457 -12.847 1.00 0.00 H new ATOM 825 N LEU A 357 -5.268 3.993 -7.686 1.00 0.00 N ATOM 826 CA LEU A 357 -4.286 4.605 -6.830 1.00 0.00 C ATOM 827 C LEU A 357 -4.173 6.095 -7.080 1.00 0.00 C ATOM 828 O LEU A 357 -3.952 6.542 -8.206 1.00 0.00 O ATOM 829 CB LEU A 357 -2.937 3.917 -7.009 1.00 0.00 C ATOM 830 CG LEU A 357 -2.940 2.412 -6.729 1.00 0.00 C ATOM 831 CD1 LEU A 357 -1.518 1.884 -6.670 1.00 0.00 C ATOM 832 CD2 LEU A 357 -3.684 2.105 -5.438 1.00 0.00 C ATOM 0 H LEU A 357 -4.879 3.387 -8.408 1.00 0.00 H new ATOM 0 HA LEU A 357 -4.612 4.479 -5.798 1.00 0.00 H new ATOM 0 HB2 LEU A 357 -2.594 4.081 -8.031 1.00 0.00 H new ATOM 0 HB3 LEU A 357 -2.212 4.393 -6.349 1.00 0.00 H new ATOM 0 HG LEU A 357 -3.461 1.910 -7.545 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.536 0.813 -6.470 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -1.022 2.067 -7.623 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -0.974 2.393 -5.874 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -3.674 1.030 -5.259 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -3.197 2.616 -4.607 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -4.715 2.449 -5.522 1.00 0.00 H new ATOM 844 N ILE A 358 -4.344 6.853 -6.003 1.00 0.00 N ATOM 845 CA ILE A 358 -4.196 8.300 -6.034 1.00 0.00 C ATOM 846 C ILE A 358 -2.719 8.618 -6.233 1.00 0.00 C ATOM 847 O ILE A 358 -2.338 9.699 -6.687 1.00 0.00 O ATOM 848 CB ILE A 358 -4.708 8.959 -4.724 1.00 0.00 C ATOM 849 CG1 ILE A 358 -5.997 8.273 -4.230 1.00 0.00 C ATOM 850 CG2 ILE A 358 -4.951 10.448 -4.937 1.00 0.00 C ATOM 851 CD1 ILE A 358 -7.058 8.126 -5.306 1.00 0.00 C ATOM 0 H ILE A 358 -4.589 6.481 -5.086 1.00 0.00 H new ATOM 0 HA ILE A 358 -4.795 8.703 -6.851 1.00 0.00 H new ATOM 0 HB ILE A 358 -3.940 8.835 -3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 358 -5.747 7.286 -3.841 1.00 0.00 H new ATOM 0 HG13 ILE A 358 -6.410 8.848 -3.401 1.00 0.00 H new ATOM 0 HG21 ILE A 358 -5.309 10.894 -4.009 1.00 0.00 H new ATOM 0 HG22 ILE A 358 -4.020 10.930 -5.235 1.00 0.00 H new ATOM 0 HG23 ILE A 358 -5.698 10.587 -5.719 1.00 0.00 H new ATOM 0 HD11 ILE A 358 -7.936 7.635 -4.886 1.00 0.00 H new ATOM 0 HD12 ILE A 358 -7.337 9.111 -5.679 1.00 0.00 H new ATOM 0 HD13 ILE A 358 -6.664 7.526 -6.126 1.00 0.00 H new ATOM 863 N THR A 359 -1.903 7.631 -5.885 1.00 0.00 N ATOM 864 CA THR A 359 -0.475 7.656 -6.119 1.00 0.00 C ATOM 865 C THR A 359 -0.037 6.281 -6.626 1.00 0.00 C ATOM 866 O THR A 359 0.196 5.356 -5.845 1.00 0.00 O ATOM 867 CB THR A 359 0.285 8.046 -4.833 1.00 0.00 C ATOM 868 OG1 THR A 359 0.075 9.435 -4.562 1.00 0.00 O ATOM 869 CG2 THR A 359 1.777 7.766 -4.945 1.00 0.00 C ATOM 0 H THR A 359 -2.226 6.780 -5.425 1.00 0.00 H new ATOM 0 HA THR A 359 -0.239 8.409 -6.871 1.00 0.00 H new ATOM 0 HB THR A 359 -0.103 7.438 -4.016 1.00 0.00 H new ATOM 0 HG1 THR A 359 0.107 9.588 -3.595 1.00 0.00 H new ATOM 0 HG21 THR A 359 2.272 8.055 -4.018 1.00 0.00 H new ATOM 0 HG22 THR A 359 1.935 6.703 -5.124 1.00 0.00 H new ATOM 0 HG23 THR A 359 2.194 8.339 -5.773 1.00 0.00 H new ATOM 877 N PRO A 360 0.041 6.123 -7.956 1.00 0.00 N ATOM 878 CA PRO A 360 0.284 4.838 -8.598 1.00 0.00 C ATOM 879 C PRO A 360 1.765 4.498 -8.723 1.00 0.00 C ATOM 880 O PRO A 360 2.209 3.978 -9.748 1.00 0.00 O ATOM 881 CB PRO A 360 -0.349 5.008 -9.989 1.00 0.00 C ATOM 882 CG PRO A 360 -0.745 6.453 -10.106 1.00 0.00 C ATOM 883 CD PRO A 360 -0.107 7.181 -8.954 1.00 0.00 C ATOM 0 HA PRO A 360 -0.135 4.017 -8.016 1.00 0.00 H new ATOM 0 HB2 PRO A 360 0.358 4.735 -10.773 1.00 0.00 H new ATOM 0 HB3 PRO A 360 -1.217 4.358 -10.102 1.00 0.00 H new ATOM 0 HG2 PRO A 360 -0.411 6.868 -11.057 1.00 0.00 H new ATOM 0 HG3 PRO A 360 -1.829 6.559 -10.076 1.00 0.00 H new ATOM 0 HD2 PRO A 360 0.854 7.616 -9.230 1.00 0.00 H new ATOM 0 HD3 PRO A 360 -0.733 7.996 -8.592 1.00 0.00 H new ATOM 891 N ASN A 361 2.519 4.787 -7.676 1.00 0.00 N ATOM 892 CA ASN A 361 3.936 4.451 -7.638 1.00 0.00 C ATOM 893 C ASN A 361 4.441 4.438 -6.198 1.00 0.00 C ATOM 894 O ASN A 361 5.182 5.330 -5.780 1.00 0.00 O ATOM 895 CB ASN A 361 4.760 5.439 -8.471 1.00 0.00 C ATOM 896 CG ASN A 361 6.198 4.986 -8.655 1.00 0.00 C ATOM 897 OD1 ASN A 361 7.117 5.802 -8.697 1.00 0.00 O ATOM 898 ND2 ASN A 361 6.400 3.686 -8.791 1.00 0.00 N ATOM 0 H ASN A 361 2.174 5.255 -6.838 1.00 0.00 H new ATOM 0 HA ASN A 361 4.056 3.456 -8.067 1.00 0.00 H new ATOM 0 HB2 ASN A 361 4.294 5.563 -9.448 1.00 0.00 H new ATOM 0 HB3 ASN A 361 4.749 6.415 -7.987 1.00 0.00 H new ATOM 0 HD21 ASN A 361 7.344 3.329 -8.937 1.00 0.00 H new ATOM 0 HD22 ASN A 361 5.611 3.040 -8.750 1.00 0.00 H new ATOM 905 N PRO A 362 4.023 3.440 -5.409 1.00 0.00 N ATOM 906 CA PRO A 362 4.456 3.303 -4.024 1.00 0.00 C ATOM 907 C PRO A 362 5.817 2.625 -3.904 1.00 0.00 C ATOM 908 O PRO A 362 6.081 1.602 -4.547 1.00 0.00 O ATOM 909 CB PRO A 362 3.366 2.433 -3.410 1.00 0.00 C ATOM 910 CG PRO A 362 2.888 1.575 -4.531 1.00 0.00 C ATOM 911 CD PRO A 362 3.085 2.368 -5.798 1.00 0.00 C ATOM 0 HA PRO A 362 4.582 4.268 -3.533 1.00 0.00 H new ATOM 0 HB2 PRO A 362 3.756 1.831 -2.589 1.00 0.00 H new ATOM 0 HB3 PRO A 362 2.557 3.040 -3.004 1.00 0.00 H new ATOM 0 HG2 PRO A 362 3.447 0.640 -4.569 1.00 0.00 H new ATOM 0 HG3 PRO A 362 1.838 1.313 -4.398 1.00 0.00 H new ATOM 0 HD2 PRO A 362 3.495 1.749 -6.596 1.00 0.00 H new ATOM 0 HD3 PRO A 362 2.143 2.776 -6.164 1.00 0.00 H new ATOM 919 N THR A 363 6.677 3.207 -3.086 1.00 0.00 N ATOM 920 CA THR A 363 7.988 2.648 -2.820 1.00 0.00 C ATOM 921 C THR A 363 8.226 2.556 -1.318 1.00 0.00 C ATOM 922 O THR A 363 7.822 3.445 -0.562 1.00 0.00 O ATOM 923 CB THR A 363 9.101 3.493 -3.472 1.00 0.00 C ATOM 924 OG1 THR A 363 8.825 4.888 -3.303 1.00 0.00 O ATOM 925 CG2 THR A 363 9.241 3.169 -4.954 1.00 0.00 C ATOM 0 H THR A 363 6.486 4.077 -2.590 1.00 0.00 H new ATOM 0 HA THR A 363 8.018 1.649 -3.254 1.00 0.00 H new ATOM 0 HB THR A 363 10.042 3.249 -2.978 1.00 0.00 H new ATOM 0 HG1 THR A 363 9.539 5.415 -3.719 1.00 0.00 H new ATOM 0 HG21 THR A 363 10.033 3.780 -5.387 1.00 0.00 H new ATOM 0 HG22 THR A 363 9.490 2.115 -5.074 1.00 0.00 H new ATOM 0 HG23 THR A 363 8.301 3.380 -5.463 1.00 0.00 H new ATOM 933 N MET A 364 8.864 1.481 -0.883 1.00 0.00 N ATOM 934 CA MET A 364 9.115 1.280 0.535 1.00 0.00 C ATOM 935 C MET A 364 10.497 1.759 0.888 1.00 0.00 C ATOM 936 O MET A 364 11.465 1.396 0.234 1.00 0.00 O ATOM 937 CB MET A 364 8.984 -0.181 0.942 1.00 0.00 C ATOM 938 CG MET A 364 7.627 -0.783 0.639 1.00 0.00 C ATOM 939 SD MET A 364 7.394 -2.403 1.386 1.00 0.00 S ATOM 940 CE MET A 364 7.133 -1.937 3.089 1.00 0.00 C ATOM 0 H MET A 364 9.216 0.738 -1.487 1.00 0.00 H new ATOM 0 HA MET A 364 8.362 1.854 1.075 1.00 0.00 H new ATOM 0 HB2 MET A 364 9.751 -0.761 0.429 1.00 0.00 H new ATOM 0 HB3 MET A 364 9.179 -0.269 2.011 1.00 0.00 H new ATOM 0 HG2 MET A 364 6.849 -0.109 0.996 1.00 0.00 H new ATOM 0 HG3 MET A 364 7.505 -0.866 -0.441 1.00 0.00 H new ATOM 0 HE1 MET A 364 7.307 -2.799 3.733 1.00 0.00 H new ATOM 0 HE2 MET A 364 7.824 -1.138 3.358 1.00 0.00 H new ATOM 0 HE3 MET A 364 6.108 -1.589 3.218 1.00 0.00 H new ATOM 950 N GLU A 365 10.565 2.557 1.930 1.00 0.00 N ATOM 951 CA GLU A 365 11.799 3.167 2.369 1.00 0.00 C ATOM 952 C GLU A 365 12.302 2.555 3.665 1.00 0.00 C ATOM 953 O GLU A 365 11.791 1.534 4.124 1.00 0.00 O ATOM 954 CB GLU A 365 11.580 4.663 2.550 1.00 0.00 C ATOM 955 CG GLU A 365 11.932 5.458 1.319 1.00 0.00 C ATOM 956 CD GLU A 365 13.427 5.645 1.182 1.00 0.00 C ATOM 957 OE1 GLU A 365 13.852 6.448 0.330 1.00 0.00 O ATOM 958 OE2 GLU A 365 14.184 5.007 1.950 1.00 0.00 O ATOM 0 H GLU A 365 9.757 2.803 2.502 1.00 0.00 H new ATOM 0 HA GLU A 365 12.558 2.988 1.608 1.00 0.00 H new ATOM 0 HB2 GLU A 365 10.537 4.844 2.808 1.00 0.00 H new ATOM 0 HB3 GLU A 365 12.181 5.015 3.388 1.00 0.00 H new ATOM 0 HG2 GLU A 365 11.546 4.950 0.435 1.00 0.00 H new ATOM 0 HG3 GLU A 365 11.446 6.433 1.364 1.00 0.00 H new ATOM 965 N ASN A 366 13.292 3.206 4.256 1.00 0.00 N ATOM 966 CA ASN A 366 13.904 2.742 5.498 1.00 0.00 C ATOM 967 C ASN A 366 12.965 2.886 6.703 1.00 0.00 C ATOM 968 O ASN A 366 13.304 2.467 7.811 1.00 0.00 O ATOM 969 CB ASN A 366 15.229 3.474 5.756 1.00 0.00 C ATOM 970 CG ASN A 366 15.145 4.982 5.565 1.00 0.00 C ATOM 971 OD1 ASN A 366 16.125 5.621 5.184 1.00 0.00 O ATOM 972 ND2 ASN A 366 13.981 5.561 5.817 1.00 0.00 N ATOM 0 H ASN A 366 13.695 4.069 3.892 1.00 0.00 H new ATOM 0 HA ASN A 366 14.105 1.678 5.375 1.00 0.00 H new ATOM 0 HB2 ASN A 366 15.557 3.264 6.774 1.00 0.00 H new ATOM 0 HB3 ASN A 366 15.991 3.074 5.087 1.00 0.00 H new ATOM 0 HD21 ASN A 366 13.876 6.568 5.697 1.00 0.00 H new ATOM 0 HD22 ASN A 366 13.190 5.000 6.131 1.00 0.00 H new ATOM 979 N ASN A 367 11.802 3.500 6.500 1.00 0.00 N ATOM 980 CA ASN A 367 10.765 3.519 7.535 1.00 0.00 C ATOM 981 C ASN A 367 9.560 2.719 7.073 1.00 0.00 C ATOM 982 O ASN A 367 8.501 2.736 7.699 1.00 0.00 O ATOM 983 CB ASN A 367 10.324 4.942 7.892 1.00 0.00 C ATOM 984 CG ASN A 367 11.421 5.747 8.553 1.00 0.00 C ATOM 985 OD1 ASN A 367 11.663 5.624 9.754 1.00 0.00 O ATOM 986 ND2 ASN A 367 12.069 6.600 7.781 1.00 0.00 N ATOM 0 H ASN A 367 11.553 3.987 5.639 1.00 0.00 H new ATOM 0 HA ASN A 367 11.195 3.071 8.431 1.00 0.00 H new ATOM 0 HB2 ASN A 367 9.999 5.455 6.987 1.00 0.00 H new ATOM 0 HB3 ASN A 367 9.463 4.894 8.558 1.00 0.00 H new ATOM 0 HD21 ASN A 367 12.802 7.189 8.175 1.00 0.00 H new ATOM 0 HD22 ASN A 367 11.836 6.670 6.790 1.00 0.00 H new ATOM 993 N GLY A 368 9.732 2.024 5.964 1.00 0.00 N ATOM 994 CA GLY A 368 8.656 1.228 5.409 1.00 0.00 C ATOM 995 C GLY A 368 8.015 1.921 4.226 1.00 0.00 C ATOM 996 O GLY A 368 8.552 2.901 3.719 1.00 0.00 O ATOM 0 H GLY A 368 10.602 1.995 5.433 1.00 0.00 H new ATOM 0 HA2 GLY A 368 9.041 0.257 5.099 1.00 0.00 H new ATOM 0 HA3 GLY A 368 7.904 1.043 6.176 1.00 0.00 H new ATOM 1000 N GLY A 369 6.849 1.449 3.812 1.00 0.00 N ATOM 1001 CA GLY A 369 6.211 1.973 2.615 1.00 0.00 C ATOM 1002 C GLY A 369 5.683 3.382 2.793 1.00 0.00 C ATOM 1003 O GLY A 369 5.340 4.048 1.815 1.00 0.00 O ATOM 0 H GLY A 369 6.329 0.709 4.284 1.00 0.00 H new ATOM 0 HA2 GLY A 369 6.927 1.961 1.793 1.00 0.00 H new ATOM 0 HA3 GLY A 369 5.389 1.316 2.331 1.00 0.00 H new ATOM 1007 N GLY A 370 5.626 3.837 4.036 1.00 0.00 N ATOM 1008 CA GLY A 370 5.071 5.142 4.316 1.00 0.00 C ATOM 1009 C GLY A 370 3.584 5.164 4.058 1.00 0.00 C ATOM 1010 O GLY A 370 2.838 4.398 4.665 1.00 0.00 O ATOM 0 H GLY A 370 5.955 3.325 4.855 1.00 0.00 H new ATOM 0 HA2 GLY A 370 5.268 5.410 5.354 1.00 0.00 H new ATOM 0 HA3 GLY A 370 5.563 5.891 3.695 1.00 0.00 H new ATOM 1014 N PHE A 371 3.153 6.009 3.140 1.00 0.00 N ATOM 1015 CA PHE A 371 1.750 6.069 2.779 1.00 0.00 C ATOM 1016 C PHE A 371 1.542 5.803 1.301 1.00 0.00 C ATOM 1017 O PHE A 371 2.217 6.370 0.440 1.00 0.00 O ATOM 1018 CB PHE A 371 1.135 7.418 3.137 1.00 0.00 C ATOM 1019 CG PHE A 371 0.706 7.526 4.572 1.00 0.00 C ATOM 1020 CD1 PHE A 371 1.496 8.180 5.502 1.00 0.00 C ATOM 1021 CD2 PHE A 371 -0.493 6.969 4.988 1.00 0.00 C ATOM 1022 CE1 PHE A 371 1.096 8.281 6.821 1.00 0.00 C ATOM 1023 CE2 PHE A 371 -0.897 7.065 6.305 1.00 0.00 C ATOM 1024 CZ PHE A 371 -0.102 7.721 7.223 1.00 0.00 C ATOM 0 H PHE A 371 3.752 6.661 2.633 1.00 0.00 H new ATOM 0 HA PHE A 371 1.251 5.289 3.353 1.00 0.00 H new ATOM 0 HB2 PHE A 371 1.858 8.205 2.923 1.00 0.00 H new ATOM 0 HB3 PHE A 371 0.272 7.595 2.495 1.00 0.00 H new ATOM 0 HD1 PHE A 371 2.435 8.616 5.193 1.00 0.00 H new ATOM 0 HD2 PHE A 371 -1.119 6.454 4.274 1.00 0.00 H new ATOM 0 HE1 PHE A 371 1.719 8.797 7.537 1.00 0.00 H new ATOM 0 HE2 PHE A 371 -1.834 6.627 6.616 1.00 0.00 H new ATOM 0 HZ PHE A 371 -0.416 7.797 8.254 1.00 0.00 H new ATOM 1034 N ILE A 372 0.605 4.922 1.021 1.00 0.00 N ATOM 1035 CA ILE A 372 0.160 4.674 -0.334 1.00 0.00 C ATOM 1036 C ILE A 372 -1.208 5.303 -0.497 1.00 0.00 C ATOM 1037 O ILE A 372 -1.891 5.523 0.496 1.00 0.00 O ATOM 1038 CB ILE A 372 0.061 3.171 -0.627 1.00 0.00 C ATOM 1039 CG1 ILE A 372 1.095 2.411 0.202 1.00 0.00 C ATOM 1040 CG2 ILE A 372 0.265 2.922 -2.111 1.00 0.00 C ATOM 1041 CD1 ILE A 372 1.008 0.911 0.056 1.00 0.00 C ATOM 0 H ILE A 372 0.131 4.358 1.726 1.00 0.00 H new ATOM 0 HA ILE A 372 0.881 5.103 -1.030 1.00 0.00 H new ATOM 0 HB ILE A 372 -0.930 2.811 -0.351 1.00 0.00 H new ATOM 0 HG12 ILE A 372 2.093 2.738 -0.090 1.00 0.00 H new ATOM 0 HG13 ILE A 372 0.968 2.673 1.253 1.00 0.00 H new ATOM 0 HG21 ILE A 372 0.194 1.853 -2.314 1.00 0.00 H new ATOM 0 HG22 ILE A 372 -0.502 3.451 -2.677 1.00 0.00 H new ATOM 0 HG23 ILE A 372 1.250 3.283 -2.409 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.773 0.440 0.674 1.00 0.00 H new ATOM 0 HD12 ILE A 372 0.023 0.571 0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 372 1.165 0.637 -0.987 1.00 0.00 H new ATOM 1053 N GLU A 373 -1.615 5.601 -1.719 1.00 0.00 N ATOM 1054 CA GLU A 373 -2.900 6.247 -1.922 1.00 0.00 C ATOM 1055 C GLU A 373 -3.745 5.471 -2.923 1.00 0.00 C ATOM 1056 O GLU A 373 -3.287 5.141 -4.014 1.00 0.00 O ATOM 1057 CB GLU A 373 -2.699 7.698 -2.358 1.00 0.00 C ATOM 1058 CG GLU A 373 -1.938 8.520 -1.327 1.00 0.00 C ATOM 1059 CD GLU A 373 -1.691 9.949 -1.755 1.00 0.00 C ATOM 1060 OE1 GLU A 373 -0.568 10.246 -2.210 1.00 0.00 O ATOM 1061 OE2 GLU A 373 -2.608 10.785 -1.613 1.00 0.00 O ATOM 0 H GLU A 373 -1.086 5.411 -2.570 1.00 0.00 H new ATOM 0 HA GLU A 373 -3.443 6.253 -0.977 1.00 0.00 H new ATOM 0 HB2 GLU A 373 -2.158 7.717 -3.304 1.00 0.00 H new ATOM 0 HB3 GLU A 373 -3.671 8.157 -2.538 1.00 0.00 H new ATOM 0 HG2 GLU A 373 -2.497 8.521 -0.391 1.00 0.00 H new ATOM 0 HG3 GLU A 373 -0.981 8.039 -1.126 1.00 0.00 H new ATOM 1068 N MET A 374 -4.978 5.187 -2.527 1.00 0.00 N ATOM 1069 CA MET A 374 -5.889 4.325 -3.280 1.00 0.00 C ATOM 1070 C MET A 374 -7.323 4.793 -3.070 1.00 0.00 C ATOM 1071 O MET A 374 -7.599 5.461 -2.081 1.00 0.00 O ATOM 1072 CB MET A 374 -5.746 2.865 -2.807 1.00 0.00 C ATOM 1073 CG MET A 374 -5.936 2.674 -1.310 1.00 0.00 C ATOM 1074 SD MET A 374 -4.498 3.193 -0.349 1.00 0.00 S ATOM 1075 CE MET A 374 -3.225 2.157 -1.069 1.00 0.00 C ATOM 0 H MET A 374 -5.382 5.551 -1.664 1.00 0.00 H new ATOM 0 HA MET A 374 -5.639 4.381 -4.340 1.00 0.00 H new ATOM 0 HB2 MET A 374 -6.474 2.250 -3.336 1.00 0.00 H new ATOM 0 HB3 MET A 374 -4.758 2.499 -3.086 1.00 0.00 H new ATOM 0 HG2 MET A 374 -6.808 3.240 -0.984 1.00 0.00 H new ATOM 0 HG3 MET A 374 -6.143 1.624 -1.106 1.00 0.00 H new ATOM 0 HE1 MET A 374 -2.596 1.751 -0.277 1.00 0.00 H new ATOM 0 HE2 MET A 374 -3.690 1.339 -1.619 1.00 0.00 H new ATOM 0 HE3 MET A 374 -2.614 2.751 -1.749 1.00 0.00 H new ATOM 1085 N GLN A 375 -8.223 4.475 -4.003 1.00 0.00 N ATOM 1086 CA GLN A 375 -9.646 4.791 -3.832 1.00 0.00 C ATOM 1087 C GLN A 375 -10.466 4.270 -5.014 1.00 0.00 C ATOM 1088 O GLN A 375 -9.963 4.172 -6.130 1.00 0.00 O ATOM 1089 CB GLN A 375 -9.833 6.314 -3.688 1.00 0.00 C ATOM 1090 CG GLN A 375 -11.265 6.769 -3.435 1.00 0.00 C ATOM 1091 CD GLN A 375 -11.819 6.244 -2.124 1.00 0.00 C ATOM 1092 OE1 GLN A 375 -11.671 6.862 -1.074 1.00 0.00 O ATOM 1093 NE2 GLN A 375 -12.488 5.115 -2.181 1.00 0.00 N ATOM 0 H GLN A 375 -7.996 4.003 -4.878 1.00 0.00 H new ATOM 0 HA GLN A 375 -10.001 4.299 -2.927 1.00 0.00 H new ATOM 0 HB2 GLN A 375 -9.207 6.665 -2.868 1.00 0.00 H new ATOM 0 HB3 GLN A 375 -9.470 6.796 -4.596 1.00 0.00 H new ATOM 0 HG2 GLN A 375 -11.301 7.858 -3.431 1.00 0.00 H new ATOM 0 HG3 GLN A 375 -11.900 6.432 -4.255 1.00 0.00 H new ATOM 0 HE21 GLN A 375 -12.591 4.628 -3.071 1.00 0.00 H new ATOM 0 HE22 GLN A 375 -12.904 4.726 -1.335 1.00 0.00 H new ATOM 1102 N LEU A 376 -11.700 3.862 -4.733 1.00 0.00 N ATOM 1103 CA LEU A 376 -12.716 3.659 -5.763 1.00 0.00 C ATOM 1104 C LEU A 376 -14.073 4.054 -5.171 1.00 0.00 C ATOM 1105 O LEU A 376 -14.205 4.038 -3.953 1.00 0.00 O ATOM 1106 CB LEU A 376 -12.737 2.197 -6.241 1.00 0.00 C ATOM 1107 CG LEU A 376 -13.280 1.981 -7.660 1.00 0.00 C ATOM 1108 CD1 LEU A 376 -12.320 2.548 -8.696 1.00 0.00 C ATOM 1109 CD2 LEU A 376 -13.538 0.509 -7.926 1.00 0.00 C ATOM 0 H LEU A 376 -12.024 3.663 -3.787 1.00 0.00 H new ATOM 0 HA LEU A 376 -12.489 4.276 -6.633 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -11.722 1.801 -6.193 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -13.340 1.613 -5.546 1.00 0.00 H new ATOM 0 HG LEU A 376 -14.228 2.512 -7.740 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -12.724 2.384 -9.695 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -12.192 3.617 -8.527 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -11.355 2.049 -8.609 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -13.922 0.384 -8.938 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -12.607 -0.049 -7.820 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -14.270 0.133 -7.211 1.00 0.00 H new ATOM 1121 N PRO A 377 -15.067 4.459 -6.000 1.00 0.00 N ATOM 1122 CA PRO A 377 -16.421 4.831 -5.558 1.00 0.00 C ATOM 1123 C PRO A 377 -16.888 4.165 -4.254 1.00 0.00 C ATOM 1124 O PRO A 377 -16.756 2.951 -4.081 1.00 0.00 O ATOM 1125 CB PRO A 377 -17.261 4.353 -6.734 1.00 0.00 C ATOM 1126 CG PRO A 377 -16.398 4.570 -7.937 1.00 0.00 C ATOM 1127 CD PRO A 377 -14.961 4.625 -7.458 1.00 0.00 C ATOM 0 HA PRO A 377 -16.489 5.892 -5.320 1.00 0.00 H new ATOM 0 HB2 PRO A 377 -17.531 3.302 -6.626 1.00 0.00 H new ATOM 0 HB3 PRO A 377 -18.192 4.915 -6.809 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -16.532 3.763 -8.657 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -16.670 5.496 -8.443 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -14.360 3.835 -7.907 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -14.489 5.572 -7.719 1.00 0.00 H new ATOM 1135 N PRO A 378 -17.464 4.989 -3.342 1.00 0.00 N ATOM 1136 CA PRO A 378 -17.902 4.588 -1.997 1.00 0.00 C ATOM 1137 C PRO A 378 -18.473 3.178 -1.896 1.00 0.00 C ATOM 1138 O PRO A 378 -19.378 2.791 -2.635 1.00 0.00 O ATOM 1139 CB PRO A 378 -18.984 5.614 -1.691 1.00 0.00 C ATOM 1140 CG PRO A 378 -18.530 6.858 -2.374 1.00 0.00 C ATOM 1141 CD PRO A 378 -17.679 6.434 -3.547 1.00 0.00 C ATOM 0 HA PRO A 378 -17.060 4.565 -1.305 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -19.955 5.289 -2.065 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -19.091 5.768 -0.617 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -19.384 7.447 -2.710 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -17.959 7.486 -1.691 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -18.182 6.630 -4.494 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -16.734 6.977 -3.569 1.00 0.00 H new ATOM 1149 N GLY A 379 -17.931 2.442 -0.941 1.00 0.00 N ATOM 1150 CA GLY A 379 -18.268 1.054 -0.740 1.00 0.00 C ATOM 1151 C GLY A 379 -17.281 0.415 0.211 1.00 0.00 C ATOM 1152 O GLY A 379 -16.913 1.019 1.220 1.00 0.00 O ATOM 0 H GLY A 379 -17.240 2.799 -0.281 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -19.278 0.971 -0.339 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -18.260 0.527 -1.694 1.00 0.00 H new ATOM 1156 N ASP A 380 -16.812 -0.776 -0.117 1.00 0.00 N ATOM 1157 CA ASP A 380 -15.837 -1.457 0.727 1.00 0.00 C ATOM 1158 C ASP A 380 -14.556 -1.711 -0.050 1.00 0.00 C ATOM 1159 O ASP A 380 -14.480 -2.656 -0.836 1.00 0.00 O ATOM 1160 CB ASP A 380 -16.370 -2.803 1.227 1.00 0.00 C ATOM 1161 CG ASP A 380 -17.730 -2.724 1.887 1.00 0.00 C ATOM 1162 OD1 ASP A 380 -18.699 -3.257 1.303 1.00 0.00 O ATOM 1163 OD2 ASP A 380 -17.836 -2.153 2.990 1.00 0.00 O ATOM 0 H ASP A 380 -17.086 -1.291 -0.954 1.00 0.00 H new ATOM 0 HA ASP A 380 -15.643 -0.809 1.582 1.00 0.00 H new ATOM 0 HB2 ASP A 380 -16.426 -3.494 0.386 1.00 0.00 H new ATOM 0 HB3 ASP A 380 -15.657 -3.222 1.937 1.00 0.00 H new ATOM 1168 N ASN A 381 -13.542 -0.891 0.167 1.00 0.00 N ATOM 1169 CA ASN A 381 -12.263 -1.105 -0.495 1.00 0.00 C ATOM 1170 C ASN A 381 -11.282 -1.745 0.471 1.00 0.00 C ATOM 1171 O ASN A 381 -11.042 -1.236 1.559 1.00 0.00 O ATOM 1172 CB ASN A 381 -11.645 0.195 -1.033 1.00 0.00 C ATOM 1173 CG ASN A 381 -12.485 0.923 -2.076 1.00 0.00 C ATOM 1174 OD1 ASN A 381 -12.259 2.105 -2.343 1.00 0.00 O ATOM 1175 ND2 ASN A 381 -13.462 0.248 -2.659 1.00 0.00 N ATOM 0 H ASN A 381 -13.575 -0.082 0.787 1.00 0.00 H new ATOM 0 HA ASN A 381 -12.458 -1.760 -1.344 1.00 0.00 H new ATOM 0 HB2 ASN A 381 -11.468 0.870 -0.195 1.00 0.00 H new ATOM 0 HB3 ASN A 381 -10.672 -0.035 -1.468 1.00 0.00 H new ATOM 0 HD21 ASN A 381 -14.055 0.705 -3.352 1.00 0.00 H new ATOM 0 HD22 ASN A 381 -13.623 -0.729 -2.415 1.00 0.00 H new ATOM 1182 N ILE A 382 -10.722 -2.863 0.071 1.00 0.00 N ATOM 1183 CA ILE A 382 -9.717 -3.544 0.865 1.00 0.00 C ATOM 1184 C ILE A 382 -8.465 -3.728 0.030 1.00 0.00 C ATOM 1185 O ILE A 382 -8.530 -4.222 -1.091 1.00 0.00 O ATOM 1186 CB ILE A 382 -10.254 -4.895 1.420 1.00 0.00 C ATOM 1187 CG1 ILE A 382 -9.136 -5.876 1.809 1.00 0.00 C ATOM 1188 CG2 ILE A 382 -11.190 -5.538 0.435 1.00 0.00 C ATOM 1189 CD1 ILE A 382 -8.585 -6.694 0.667 1.00 0.00 C ATOM 0 H ILE A 382 -10.946 -3.327 -0.809 1.00 0.00 H new ATOM 0 HA ILE A 382 -9.468 -2.935 1.734 1.00 0.00 H new ATOM 0 HB ILE A 382 -10.796 -4.657 2.335 1.00 0.00 H new ATOM 0 HG12 ILE A 382 -8.319 -5.313 2.261 1.00 0.00 H new ATOM 0 HG13 ILE A 382 -9.517 -6.554 2.573 1.00 0.00 H new ATOM 0 HG21 ILE A 382 -11.554 -6.481 0.842 1.00 0.00 H new ATOM 0 HG22 ILE A 382 -12.034 -4.874 0.248 1.00 0.00 H new ATOM 0 HG23 ILE A 382 -10.662 -5.726 -0.500 1.00 0.00 H new ATOM 0 HD11 ILE A 382 -7.802 -7.356 1.038 1.00 0.00 H new ATOM 0 HD12 ILE A 382 -9.385 -7.289 0.227 1.00 0.00 H new ATOM 0 HD13 ILE A 382 -8.169 -6.029 -0.090 1.00 0.00 H new ATOM 1201 N ILE A 383 -7.332 -3.331 0.573 1.00 0.00 N ATOM 1202 CA ILE A 383 -6.094 -3.345 -0.191 1.00 0.00 C ATOM 1203 C ILE A 383 -5.362 -4.660 0.000 1.00 0.00 C ATOM 1204 O ILE A 383 -5.198 -5.138 1.129 1.00 0.00 O ATOM 1205 CB ILE A 383 -5.164 -2.178 0.210 1.00 0.00 C ATOM 1206 CG1 ILE A 383 -5.950 -0.865 0.250 1.00 0.00 C ATOM 1207 CG2 ILE A 383 -3.995 -2.056 -0.757 1.00 0.00 C ATOM 1208 CD1 ILE A 383 -5.240 0.218 1.019 1.00 0.00 C ATOM 0 H ILE A 383 -7.239 -2.997 1.532 1.00 0.00 H new ATOM 0 HA ILE A 383 -6.363 -3.228 -1.241 1.00 0.00 H new ATOM 0 HB ILE A 383 -4.767 -2.387 1.203 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -6.129 -0.523 -0.769 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -6.926 -1.045 0.702 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -3.356 -1.227 -0.452 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -3.418 -2.981 -0.749 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -4.373 -1.872 -1.763 1.00 0.00 H new ATOM 0 HD11 ILE A 383 -5.845 1.125 1.013 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -5.085 -0.108 2.047 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -4.276 0.422 0.554 1.00 0.00 H new ATOM 1220 N TYR A 384 -4.976 -5.247 -1.123 1.00 0.00 N ATOM 1221 CA TYR A 384 -4.083 -6.383 -1.148 1.00 0.00 C ATOM 1222 C TYR A 384 -2.680 -5.898 -1.465 1.00 0.00 C ATOM 1223 O TYR A 384 -2.311 -5.749 -2.632 1.00 0.00 O ATOM 1224 CB TYR A 384 -4.511 -7.410 -2.201 1.00 0.00 C ATOM 1225 CG TYR A 384 -5.331 -8.561 -1.662 1.00 0.00 C ATOM 1226 CD1 TYR A 384 -6.670 -8.399 -1.348 1.00 0.00 C ATOM 1227 CD2 TYR A 384 -4.765 -9.819 -1.479 1.00 0.00 C ATOM 1228 CE1 TYR A 384 -7.427 -9.451 -0.869 1.00 0.00 C ATOM 1229 CE2 TYR A 384 -5.515 -10.877 -0.998 1.00 0.00 C ATOM 1230 CZ TYR A 384 -6.847 -10.688 -0.695 1.00 0.00 C ATOM 1231 OH TYR A 384 -7.605 -11.739 -0.226 1.00 0.00 O ATOM 0 H TYR A 384 -5.280 -4.941 -2.048 1.00 0.00 H new ATOM 0 HA TYR A 384 -4.113 -6.866 -0.172 1.00 0.00 H new ATOM 0 HB2 TYR A 384 -5.088 -6.900 -2.973 1.00 0.00 H new ATOM 0 HB3 TYR A 384 -3.619 -7.811 -2.682 1.00 0.00 H new ATOM 0 HD1 TYR A 384 -7.132 -7.432 -1.480 1.00 0.00 H new ATOM 0 HD2 TYR A 384 -3.723 -9.972 -1.717 1.00 0.00 H new ATOM 0 HE1 TYR A 384 -8.470 -9.304 -0.632 1.00 0.00 H new ATOM 0 HE2 TYR A 384 -5.060 -11.847 -0.860 1.00 0.00 H new ATOM 0 HH TYR A 384 -7.047 -12.542 -0.161 1.00 0.00 H new ATOM 1241 N VAL A 385 -1.917 -5.620 -0.428 1.00 0.00 N ATOM 1242 CA VAL A 385 -0.526 -5.254 -0.593 1.00 0.00 C ATOM 1243 C VAL A 385 0.269 -6.531 -0.803 1.00 0.00 C ATOM 1244 O VAL A 385 0.792 -7.113 0.147 1.00 0.00 O ATOM 1245 CB VAL A 385 0.014 -4.487 0.633 1.00 0.00 C ATOM 1246 CG1 VAL A 385 1.379 -3.887 0.339 1.00 0.00 C ATOM 1247 CG2 VAL A 385 -0.960 -3.400 1.056 1.00 0.00 C ATOM 0 H VAL A 385 -2.238 -5.641 0.540 1.00 0.00 H new ATOM 0 HA VAL A 385 -0.428 -4.589 -1.451 1.00 0.00 H new ATOM 0 HB VAL A 385 0.121 -5.196 1.454 1.00 0.00 H new ATOM 0 HG11 VAL A 385 1.738 -3.352 1.218 1.00 0.00 H new ATOM 0 HG12 VAL A 385 2.080 -4.683 0.087 1.00 0.00 H new ATOM 0 HG13 VAL A 385 1.299 -3.195 -0.500 1.00 0.00 H new ATOM 0 HG21 VAL A 385 -0.561 -2.871 1.922 1.00 0.00 H new ATOM 0 HG22 VAL A 385 -1.101 -2.698 0.234 1.00 0.00 H new ATOM 0 HG23 VAL A 385 -1.918 -3.851 1.316 1.00 0.00 H new ATOM 1257 N GLY A 386 0.314 -6.980 -2.047 1.00 0.00 N ATOM 1258 CA GLY A 386 0.883 -8.270 -2.358 1.00 0.00 C ATOM 1259 C GLY A 386 0.048 -9.397 -1.786 1.00 0.00 C ATOM 1260 O GLY A 386 -0.834 -9.929 -2.459 1.00 0.00 O ATOM 0 H GLY A 386 -0.038 -6.466 -2.854 1.00 0.00 H new ATOM 0 HA2 GLY A 386 0.959 -8.384 -3.439 1.00 0.00 H new ATOM 0 HA3 GLY A 386 1.896 -8.328 -1.960 1.00 0.00 H new ATOM 1264 N ASP A 387 0.318 -9.745 -0.535 1.00 0.00 N ATOM 1265 CA ASP A 387 -0.430 -10.785 0.163 1.00 0.00 C ATOM 1266 C ASP A 387 -1.156 -10.175 1.356 1.00 0.00 C ATOM 1267 O ASP A 387 -2.120 -10.740 1.877 1.00 0.00 O ATOM 1268 CB ASP A 387 0.525 -11.886 0.619 1.00 0.00 C ATOM 1269 CG ASP A 387 -0.170 -13.160 1.052 1.00 0.00 C ATOM 1270 OD1 ASP A 387 0.370 -13.854 1.944 1.00 0.00 O ATOM 1271 OD2 ASP A 387 -1.231 -13.492 0.483 1.00 0.00 O ATOM 0 H ASP A 387 1.057 -9.318 0.023 1.00 0.00 H new ATOM 0 HA ASP A 387 -1.168 -11.222 -0.509 1.00 0.00 H new ATOM 0 HB2 ASP A 387 1.212 -12.117 -0.195 1.00 0.00 H new ATOM 0 HB3 ASP A 387 1.126 -11.512 1.448 1.00 0.00 H new ATOM 1276 N LEU A 388 -0.677 -9.003 1.776 1.00 0.00 N ATOM 1277 CA LEU A 388 -1.325 -8.232 2.828 1.00 0.00 C ATOM 1278 C LEU A 388 -2.746 -7.901 2.401 1.00 0.00 C ATOM 1279 O LEU A 388 -2.994 -7.632 1.229 1.00 0.00 O ATOM 1280 CB LEU A 388 -0.572 -6.921 3.076 1.00 0.00 C ATOM 1281 CG LEU A 388 -0.015 -6.710 4.485 1.00 0.00 C ATOM 1282 CD1 LEU A 388 1.142 -7.649 4.769 1.00 0.00 C ATOM 1283 CD2 LEU A 388 0.426 -5.273 4.662 1.00 0.00 C ATOM 0 H LEU A 388 0.164 -8.568 1.398 1.00 0.00 H new ATOM 0 HA LEU A 388 -1.327 -8.824 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 388 0.256 -6.864 2.370 1.00 0.00 H new ATOM 0 HB3 LEU A 388 -1.243 -6.093 2.847 1.00 0.00 H new ATOM 0 HG LEU A 388 -0.811 -6.932 5.196 1.00 0.00 H new ATOM 0 HD11 LEU A 388 1.514 -7.473 5.778 1.00 0.00 H new ATOM 0 HD12 LEU A 388 0.803 -8.681 4.682 1.00 0.00 H new ATOM 0 HD13 LEU A 388 1.942 -7.469 4.051 1.00 0.00 H new ATOM 0 HD21 LEU A 388 0.821 -5.135 5.669 1.00 0.00 H new ATOM 0 HD22 LEU A 388 1.201 -5.038 3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 388 -0.426 -4.610 4.512 1.00 0.00 H new ATOM 1295 N ASN A 389 -3.673 -7.917 3.334 1.00 0.00 N ATOM 1296 CA ASN A 389 -5.057 -7.588 3.019 1.00 0.00 C ATOM 1297 C ASN A 389 -5.763 -7.021 4.232 1.00 0.00 C ATOM 1298 O ASN A 389 -5.552 -7.477 5.353 1.00 0.00 O ATOM 1299 CB ASN A 389 -5.823 -8.812 2.494 1.00 0.00 C ATOM 1300 CG ASN A 389 -5.852 -9.972 3.477 1.00 0.00 C ATOM 1301 OD1 ASN A 389 -6.746 -10.066 4.320 1.00 0.00 O ATOM 1302 ND2 ASN A 389 -4.877 -10.864 3.373 1.00 0.00 N ATOM 0 H ASN A 389 -3.501 -8.152 4.312 1.00 0.00 H new ATOM 0 HA ASN A 389 -5.039 -6.834 2.232 1.00 0.00 H new ATOM 0 HB2 ASN A 389 -6.846 -8.518 2.259 1.00 0.00 H new ATOM 0 HB3 ASN A 389 -5.366 -9.146 1.563 1.00 0.00 H new ATOM 0 HD21 ASN A 389 -4.848 -11.664 4.005 1.00 0.00 H new ATOM 0 HD22 ASN A 389 -4.155 -10.750 2.661 1.00 0.00 H new ATOM 1309 N HIS A 390 -6.564 -5.993 4.008 1.00 0.00 N ATOM 1310 CA HIS A 390 -7.401 -5.438 5.068 1.00 0.00 C ATOM 1311 C HIS A 390 -8.466 -4.533 4.473 1.00 0.00 C ATOM 1312 O HIS A 390 -8.156 -3.632 3.689 1.00 0.00 O ATOM 1313 CB HIS A 390 -6.569 -4.654 6.079 1.00 0.00 C ATOM 1314 CG HIS A 390 -7.220 -4.568 7.426 1.00 0.00 C ATOM 1315 ND1 HIS A 390 -8.341 -3.800 7.689 1.00 0.00 N ATOM 1316 CD2 HIS A 390 -6.899 -5.169 8.593 1.00 0.00 C ATOM 1317 CE1 HIS A 390 -8.673 -3.936 8.960 1.00 0.00 C ATOM 1318 NE2 HIS A 390 -7.814 -4.761 9.527 1.00 0.00 N ATOM 0 H HIS A 390 -6.655 -5.525 3.107 1.00 0.00 H new ATOM 0 HA HIS A 390 -7.877 -6.270 5.587 1.00 0.00 H new ATOM 0 HB2 HIS A 390 -5.592 -5.126 6.182 1.00 0.00 H new ATOM 0 HB3 HIS A 390 -6.398 -3.647 5.699 1.00 0.00 H new ATOM 0 HD1 HIS A 390 -8.833 -3.221 7.009 1.00 0.00 H new ATOM 0 HD2 HIS A 390 -6.074 -5.846 8.759 1.00 0.00 H new ATOM 0 HE1 HIS A 390 -9.505 -3.454 9.451 1.00 0.00 H new ATOM 1327 N GLN A 391 -9.717 -4.806 4.818 1.00 0.00 N ATOM 1328 CA GLN A 391 -10.852 -4.075 4.282 1.00 0.00 C ATOM 1329 C GLN A 391 -11.039 -2.728 4.973 1.00 0.00 C ATOM 1330 O GLN A 391 -10.641 -2.547 6.128 1.00 0.00 O ATOM 1331 CB GLN A 391 -12.109 -4.930 4.431 1.00 0.00 C ATOM 1332 CG GLN A 391 -13.273 -4.488 3.566 1.00 0.00 C ATOM 1333 CD GLN A 391 -14.508 -5.337 3.789 1.00 0.00 C ATOM 1334 OE1 GLN A 391 -15.631 -4.853 3.684 1.00 0.00 O ATOM 1335 NE2 GLN A 391 -14.311 -6.616 4.070 1.00 0.00 N ATOM 0 H GLN A 391 -9.971 -5.541 5.478 1.00 0.00 H new ATOM 0 HA GLN A 391 -10.664 -3.869 3.228 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -11.862 -5.963 4.186 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -12.422 -4.916 5.475 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -13.508 -3.445 3.781 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -12.983 -4.540 2.516 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -13.362 -6.980 4.149 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -15.109 -7.237 4.207 1.00 0.00 H new ATOM 1344 N TRP A 392 -11.612 -1.788 4.234 1.00 0.00 N ATOM 1345 CA TRP A 392 -11.951 -0.473 4.747 1.00 0.00 C ATOM 1346 C TRP A 392 -13.205 0.047 4.053 1.00 0.00 C ATOM 1347 O TRP A 392 -13.251 0.162 2.827 1.00 0.00 O ATOM 1348 CB TRP A 392 -10.780 0.496 4.535 1.00 0.00 C ATOM 1349 CG TRP A 392 -11.164 1.948 4.555 1.00 0.00 C ATOM 1350 CD1 TRP A 392 -11.257 2.777 3.474 1.00 0.00 C ATOM 1351 CD2 TRP A 392 -11.501 2.743 5.699 1.00 0.00 C ATOM 1352 NE1 TRP A 392 -11.631 4.037 3.873 1.00 0.00 N ATOM 1353 CE2 TRP A 392 -11.785 4.043 5.234 1.00 0.00 C ATOM 1354 CE3 TRP A 392 -11.590 2.483 7.069 1.00 0.00 C ATOM 1355 CZ2 TRP A 392 -12.155 5.075 6.089 1.00 0.00 C ATOM 1356 CZ3 TRP A 392 -11.957 3.510 7.918 1.00 0.00 C ATOM 1357 CH2 TRP A 392 -12.233 4.793 7.425 1.00 0.00 C ATOM 0 H TRP A 392 -11.856 -1.921 3.253 1.00 0.00 H new ATOM 0 HA TRP A 392 -12.148 -0.548 5.816 1.00 0.00 H new ATOM 0 HB2 TRP A 392 -10.034 0.320 5.310 1.00 0.00 H new ATOM 0 HB3 TRP A 392 -10.307 0.271 3.579 1.00 0.00 H new ATOM 0 HD1 TRP A 392 -11.064 2.484 2.452 1.00 0.00 H new ATOM 0 HE1 TRP A 392 -11.771 4.837 3.256 1.00 0.00 H new ATOM 0 HE3 TRP A 392 -11.376 1.498 7.457 1.00 0.00 H new ATOM 0 HZ2 TRP A 392 -12.373 6.063 5.712 1.00 0.00 H new ATOM 0 HZ3 TRP A 392 -12.032 3.321 8.979 1.00 0.00 H new ATOM 0 HH2 TRP A 392 -12.513 5.575 8.115 1.00 0.00 H new ATOM 1368 N PHE A 393 -14.233 0.324 4.835 1.00 0.00 N ATOM 1369 CA PHE A 393 -15.425 0.961 4.308 1.00 0.00 C ATOM 1370 C PHE A 393 -15.135 2.429 4.037 1.00 0.00 C ATOM 1371 O PHE A 393 -14.890 3.205 4.964 1.00 0.00 O ATOM 1372 CB PHE A 393 -16.589 0.827 5.288 1.00 0.00 C ATOM 1373 CG PHE A 393 -17.863 1.446 4.791 1.00 0.00 C ATOM 1374 CD1 PHE A 393 -18.672 0.768 3.897 1.00 0.00 C ATOM 1375 CD2 PHE A 393 -18.245 2.709 5.213 1.00 0.00 C ATOM 1376 CE1 PHE A 393 -19.840 1.337 3.431 1.00 0.00 C ATOM 1377 CE2 PHE A 393 -19.412 3.283 4.751 1.00 0.00 C ATOM 1378 CZ PHE A 393 -20.210 2.596 3.858 1.00 0.00 C ATOM 0 H PHE A 393 -14.266 0.119 5.834 1.00 0.00 H new ATOM 0 HA PHE A 393 -15.707 0.468 3.378 1.00 0.00 H new ATOM 0 HB2 PHE A 393 -16.763 -0.230 5.491 1.00 0.00 H new ATOM 0 HB3 PHE A 393 -16.313 1.293 6.234 1.00 0.00 H new ATOM 0 HD1 PHE A 393 -18.387 -0.218 3.560 1.00 0.00 H new ATOM 0 HD2 PHE A 393 -17.623 3.250 5.911 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -20.463 0.798 2.733 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -19.700 4.268 5.087 1.00 0.00 H new ATOM 0 HZ PHE A 393 -21.123 3.044 3.494 1.00 0.00 H new ATOM 1388 N GLN A 394 -15.169 2.804 2.772 1.00 0.00 N ATOM 1389 CA GLN A 394 -14.861 4.170 2.377 1.00 0.00 C ATOM 1390 C GLN A 394 -16.105 4.870 1.844 1.00 0.00 C ATOM 1391 O GLN A 394 -16.959 4.250 1.205 1.00 0.00 O ATOM 1392 CB GLN A 394 -13.699 4.239 1.358 1.00 0.00 C ATOM 1393 CG GLN A 394 -13.679 3.153 0.293 1.00 0.00 C ATOM 1394 CD GLN A 394 -14.724 3.362 -0.774 1.00 0.00 C ATOM 1395 OE1 GLN A 394 -15.235 2.411 -1.352 1.00 0.00 O ATOM 1396 NE2 GLN A 394 -15.039 4.618 -1.044 1.00 0.00 N ATOM 0 H GLN A 394 -15.407 2.183 1.998 1.00 0.00 H new ATOM 0 HA GLN A 394 -14.525 4.697 3.270 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -13.736 5.208 0.860 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -12.758 4.199 1.907 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -12.693 3.124 -0.171 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -13.838 2.184 0.766 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -14.586 5.378 -0.536 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -15.735 4.827 -1.760 1.00 0.00 H new ATOM 1405 N LYS A 395 -16.210 6.154 2.136 1.00 0.00 N ATOM 1406 CA LYS A 395 -17.335 6.958 1.698 1.00 0.00 C ATOM 1407 C LYS A 395 -16.911 8.417 1.612 1.00 0.00 C ATOM 1408 O LYS A 395 -16.653 8.901 0.493 1.00 0.00 O ATOM 1409 CB LYS A 395 -18.512 6.807 2.670 1.00 0.00 C ATOM 1410 CG LYS A 395 -19.736 7.623 2.284 1.00 0.00 C ATOM 1411 CD LYS A 395 -20.830 7.539 3.339 1.00 0.00 C ATOM 1412 CE LYS A 395 -21.398 6.133 3.464 1.00 0.00 C ATOM 1413 NZ LYS A 395 -22.028 5.672 2.198 1.00 0.00 N ATOM 1414 OXT LYS A 395 -16.811 9.059 2.675 1.00 0.00 O ATOM 0 H LYS A 395 -15.519 6.667 2.683 1.00 0.00 H new ATOM 0 HA LYS A 395 -17.656 6.616 0.714 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -18.791 5.755 2.727 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -18.188 7.105 3.667 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -19.448 8.665 2.142 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -20.124 7.267 1.330 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -20.429 7.854 4.302 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -21.632 8.232 3.085 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -20.601 5.444 3.744 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -22.136 6.110 4.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -22.589 4.816 2.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -22.648 6.420 1.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -21.288 5.458 1.500 1.00 0.00 H new