USER MOD reduce.3.24.130724 H: found=0, std=0, add=502, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 503 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 397 SER OG : rot -37:sc= 0.484 USER MOD Set 1.2: A 438 MET CE :methyl 170:sc= 0 (180deg=-0.0583) USER MOD Single : A 376 GLN : amide:sc= -1.62! C(o=-1.6!,f=-6!) USER MOD Single : A 378 SER OG : rot 180:sc= 0 USER MOD Single : A 396 LYS NZ :NH3+ -157:sc= 0.749 (180deg=0.391) USER MOD Single : A 399 SER OG : rot 180:sc= 0 USER MOD Single : A 406 THR OG1 : rot 80:sc= -2.58! USER MOD Single : A 414 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 420 ASN : amide:sc= -1.01! C(o=-1!,f=-2.3!) USER MOD Single : A 421 ASN : amide:sc= 0.422 X(o=0.42,f=-0.034) USER MOD Single : A 426 SER OG : rot 5:sc= 1.09 USER MOD Single : A 433 SER OG : rot 180:sc= -0.0514 USER MOD Single : A 436 ASN :FLIP amide:sc= 1.4 F(o=0.011,f=1.4) USER MOD Single : A 440 THR OG1 : rot 180:sc= 0 USER MOD Single : A 442 SER OG : rot 180:sc= 0 USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 449 ASN : amide:sc= -0.789 X(o=-0.79,f=-0.52) USER MOD Single : A 451 SER OG : rot 180:sc= 0 USER MOD Single : A 453 THR OG1 : rot 37:sc= 1.65 USER MOD ----------------------------------------------------------------- ATOM 52 N GLN A 376 125.297 -12.358 6.465 1.00 0.00 N ATOM 53 CA GLN A 376 124.722 -11.135 5.974 1.00 0.00 C ATOM 54 C GLN A 376 125.804 -10.082 5.743 1.00 0.00 C ATOM 55 O GLN A 376 126.056 -9.758 4.607 1.00 0.00 O ATOM 56 CB GLN A 376 123.546 -10.600 6.811 1.00 0.00 C ATOM 57 CG GLN A 376 122.258 -11.414 6.720 1.00 0.00 C ATOM 58 CD GLN A 376 121.603 -11.359 5.343 1.00 0.00 C ATOM 59 OE1 GLN A 376 122.260 -11.229 4.322 1.00 0.00 O ATOM 60 NE2 GLN A 376 120.302 -11.430 5.312 1.00 0.00 N ATOM 0 HA GLN A 376 124.271 -11.379 5.012 1.00 0.00 H new ATOM 0 HB2 GLN A 376 123.855 -10.555 7.855 1.00 0.00 H new ATOM 0 HB3 GLN A 376 123.334 -9.578 6.497 1.00 0.00 H new ATOM 0 HG2 GLN A 376 122.475 -12.453 6.970 1.00 0.00 H new ATOM 0 HG3 GLN A 376 121.552 -11.048 7.465 1.00 0.00 H new ATOM 0 HE21 GLN A 376 119.776 -11.539 6.179 1.00 0.00 H new ATOM 0 HE22 GLN A 376 119.809 -11.377 4.420 1.00 0.00 H new ATOM 69 N PRO A 377 126.505 -9.524 6.799 1.00 0.00 N ATOM 70 CA PRO A 377 127.571 -8.542 6.575 1.00 0.00 C ATOM 71 C PRO A 377 128.820 -9.191 5.932 1.00 0.00 C ATOM 72 O PRO A 377 129.854 -9.426 6.585 1.00 0.00 O ATOM 73 CB PRO A 377 127.885 -7.996 7.974 1.00 0.00 C ATOM 74 CG PRO A 377 127.460 -9.070 8.907 1.00 0.00 C ATOM 75 CD PRO A 377 126.307 -9.776 8.247 1.00 0.00 C ATOM 0 HA PRO A 377 127.266 -7.758 5.881 1.00 0.00 H new ATOM 0 HB2 PRO A 377 128.947 -7.775 8.083 1.00 0.00 H new ATOM 0 HB3 PRO A 377 127.345 -7.069 8.167 1.00 0.00 H new ATOM 0 HG2 PRO A 377 128.279 -9.762 9.101 1.00 0.00 H new ATOM 0 HG3 PRO A 377 127.161 -8.653 9.869 1.00 0.00 H new ATOM 0 HD2 PRO A 377 126.313 -10.843 8.470 1.00 0.00 H new ATOM 0 HD3 PRO A 377 125.350 -9.384 8.592 1.00 0.00 H new ATOM 83 N SER A 378 128.678 -9.528 4.679 1.00 0.00 N ATOM 84 CA SER A 378 129.700 -10.170 3.919 1.00 0.00 C ATOM 85 C SER A 378 130.168 -9.263 2.794 1.00 0.00 C ATOM 86 O SER A 378 131.333 -9.294 2.420 1.00 0.00 O ATOM 87 CB SER A 378 129.160 -11.490 3.371 1.00 0.00 C ATOM 88 OG SER A 378 128.572 -12.245 4.415 1.00 0.00 O ATOM 0 H SER A 378 127.823 -9.356 4.150 1.00 0.00 H new ATOM 0 HA SER A 378 130.559 -10.377 4.558 1.00 0.00 H new ATOM 0 HB2 SER A 378 128.422 -11.295 2.592 1.00 0.00 H new ATOM 0 HB3 SER A 378 129.967 -12.059 2.910 1.00 0.00 H new ATOM 0 HG SER A 378 128.227 -13.088 4.054 1.00 0.00 H new ATOM 94 N ASP A 379 129.262 -8.437 2.245 1.00 0.00 N ATOM 95 CA ASP A 379 129.690 -7.491 1.199 1.00 0.00 C ATOM 96 C ASP A 379 130.357 -6.318 1.886 1.00 0.00 C ATOM 97 O ASP A 379 131.565 -6.173 1.835 1.00 0.00 O ATOM 98 CB ASP A 379 128.507 -7.002 0.328 1.00 0.00 C ATOM 99 CG ASP A 379 128.958 -6.288 -0.927 1.00 0.00 C ATOM 100 OD1 ASP A 379 129.222 -5.083 -0.870 1.00 0.00 O ATOM 101 OD2 ASP A 379 129.040 -6.929 -1.990 1.00 0.00 O ATOM 0 H ASP A 379 128.273 -8.402 2.492 1.00 0.00 H new ATOM 0 HA ASP A 379 130.381 -7.996 0.523 1.00 0.00 H new ATOM 0 HB2 ASP A 379 127.888 -7.856 0.052 1.00 0.00 H new ATOM 0 HB3 ASP A 379 127.881 -6.331 0.917 1.00 0.00 H new ATOM 106 N CYS A 380 129.547 -5.507 2.548 1.00 0.00 N ATOM 107 CA CYS A 380 130.002 -4.431 3.398 1.00 0.00 C ATOM 108 C CYS A 380 128.802 -3.733 3.966 1.00 0.00 C ATOM 109 O CYS A 380 128.561 -3.786 5.166 1.00 0.00 O ATOM 110 CB CYS A 380 130.903 -3.419 2.688 1.00 0.00 C ATOM 111 SG CYS A 380 131.430 -2.051 3.775 1.00 0.00 S ATOM 0 H CYS A 380 128.531 -5.585 2.504 1.00 0.00 H new ATOM 0 HA CYS A 380 130.614 -4.876 4.182 1.00 0.00 H new ATOM 0 HB2 CYS A 380 131.785 -3.932 2.305 1.00 0.00 H new ATOM 0 HB3 CYS A 380 130.373 -3.009 1.828 1.00 0.00 H new ATOM 116 N GLY A 381 128.015 -3.130 3.100 1.00 0.00 N ATOM 117 CA GLY A 381 126.868 -2.429 3.557 1.00 0.00 C ATOM 118 C GLY A 381 125.656 -2.628 2.696 1.00 0.00 C ATOM 119 O GLY A 381 124.631 -2.013 2.923 1.00 0.00 O ATOM 0 H GLY A 381 128.158 -3.119 2.090 1.00 0.00 H new ATOM 0 HA2 GLY A 381 126.638 -2.750 4.573 1.00 0.00 H new ATOM 0 HA3 GLY A 381 127.098 -1.365 3.604 1.00 0.00 H new ATOM 123 N GLU A 382 125.764 -3.470 1.700 1.00 0.00 N ATOM 124 CA GLU A 382 124.594 -3.815 0.917 1.00 0.00 C ATOM 125 C GLU A 382 123.839 -4.890 1.661 1.00 0.00 C ATOM 126 O GLU A 382 122.617 -4.940 1.679 1.00 0.00 O ATOM 127 CB GLU A 382 124.991 -4.309 -0.465 1.00 0.00 C ATOM 128 CG GLU A 382 123.808 -4.732 -1.312 1.00 0.00 C ATOM 129 CD GLU A 382 124.170 -5.133 -2.705 1.00 0.00 C ATOM 130 OE1 GLU A 382 124.821 -6.177 -2.890 1.00 0.00 O ATOM 131 OE2 GLU A 382 123.760 -4.438 -3.648 1.00 0.00 O ATOM 0 H GLU A 382 126.630 -3.925 1.412 1.00 0.00 H new ATOM 0 HA GLU A 382 123.967 -2.934 0.780 1.00 0.00 H new ATOM 0 HB2 GLU A 382 125.536 -3.520 -0.983 1.00 0.00 H new ATOM 0 HB3 GLU A 382 125.674 -5.152 -0.360 1.00 0.00 H new ATOM 0 HG2 GLU A 382 123.305 -5.567 -0.824 1.00 0.00 H new ATOM 0 HG3 GLU A 382 123.093 -3.910 -1.356 1.00 0.00 H new ATOM 138 N VAL A 383 124.586 -5.723 2.314 1.00 0.00 N ATOM 139 CA VAL A 383 124.016 -6.763 3.091 1.00 0.00 C ATOM 140 C VAL A 383 124.121 -6.500 4.567 1.00 0.00 C ATOM 141 O VAL A 383 124.918 -7.097 5.257 1.00 0.00 O ATOM 142 CB VAL A 383 124.495 -8.171 2.732 1.00 0.00 C ATOM 143 CG1 VAL A 383 123.467 -8.864 1.865 1.00 0.00 C ATOM 144 CG2 VAL A 383 125.830 -8.109 2.025 1.00 0.00 C ATOM 0 H VAL A 383 125.606 -5.697 2.320 1.00 0.00 H new ATOM 0 HA VAL A 383 122.960 -6.747 2.823 1.00 0.00 H new ATOM 0 HB VAL A 383 124.620 -8.744 3.651 1.00 0.00 H new ATOM 0 HG11 VAL A 383 123.817 -9.865 1.615 1.00 0.00 H new ATOM 0 HG12 VAL A 383 122.523 -8.934 2.406 1.00 0.00 H new ATOM 0 HG13 VAL A 383 123.319 -8.292 0.949 1.00 0.00 H new ATOM 0 HG21 VAL A 383 126.157 -9.119 1.776 1.00 0.00 H new ATOM 0 HG22 VAL A 383 125.731 -7.524 1.111 1.00 0.00 H new ATOM 0 HG23 VAL A 383 126.566 -7.640 2.678 1.00 0.00 H new ATOM 154 N ILE A 384 123.385 -5.509 5.018 1.00 0.00 N ATOM 155 CA ILE A 384 123.322 -5.162 6.432 1.00 0.00 C ATOM 156 C ILE A 384 121.893 -4.740 6.807 1.00 0.00 C ATOM 157 O ILE A 384 121.559 -3.551 6.869 1.00 0.00 O ATOM 158 CB ILE A 384 124.338 -4.045 6.852 1.00 0.00 C ATOM 159 CG1 ILE A 384 124.237 -2.823 5.914 1.00 0.00 C ATOM 160 CG2 ILE A 384 125.771 -4.580 6.925 1.00 0.00 C ATOM 161 CD1 ILE A 384 125.002 -1.604 6.406 1.00 0.00 C ATOM 0 H ILE A 384 122.810 -4.916 4.419 1.00 0.00 H new ATOM 0 HA ILE A 384 123.608 -6.059 6.981 1.00 0.00 H new ATOM 0 HB ILE A 384 124.069 -3.717 7.856 1.00 0.00 H new ATOM 0 HG12 ILE A 384 124.611 -3.101 4.929 1.00 0.00 H new ATOM 0 HG13 ILE A 384 123.187 -2.556 5.792 1.00 0.00 H new ATOM 0 HG21 ILE A 384 126.445 -3.776 7.219 1.00 0.00 H new ATOM 0 HG22 ILE A 384 125.822 -5.384 7.660 1.00 0.00 H new ATOM 0 HG23 ILE A 384 126.067 -4.962 5.948 1.00 0.00 H new ATOM 0 HD11 ILE A 384 124.883 -0.788 5.694 1.00 0.00 H new ATOM 0 HD12 ILE A 384 124.613 -1.298 7.377 1.00 0.00 H new ATOM 0 HD13 ILE A 384 126.059 -1.852 6.500 1.00 0.00 H new ATOM 173 N GLU A 385 121.031 -5.733 6.937 1.00 0.00 N ATOM 174 CA GLU A 385 119.599 -5.536 7.238 1.00 0.00 C ATOM 175 C GLU A 385 118.862 -4.819 6.130 1.00 0.00 C ATOM 176 O GLU A 385 117.704 -4.433 6.291 1.00 0.00 O ATOM 177 CB GLU A 385 119.349 -4.873 8.598 1.00 0.00 C ATOM 178 CG GLU A 385 119.480 -5.819 9.771 1.00 0.00 C ATOM 179 CD GLU A 385 120.860 -6.422 9.910 1.00 0.00 C ATOM 180 OE1 GLU A 385 121.775 -5.738 10.396 1.00 0.00 O ATOM 181 OE2 GLU A 385 121.051 -7.606 9.548 1.00 0.00 O ATOM 0 H GLU A 385 121.295 -6.713 6.838 1.00 0.00 H new ATOM 0 HA GLU A 385 119.184 -6.542 7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 385 120.053 -4.051 8.726 1.00 0.00 H new ATOM 0 HB3 GLU A 385 118.349 -4.440 8.602 1.00 0.00 H new ATOM 0 HG2 GLU A 385 119.232 -5.284 10.688 1.00 0.00 H new ATOM 0 HG3 GLU A 385 118.751 -6.622 9.663 1.00 0.00 H new ATOM 188 N GLU A 386 119.530 -4.645 5.008 1.00 0.00 N ATOM 189 CA GLU A 386 118.890 -4.122 3.855 1.00 0.00 C ATOM 190 C GLU A 386 118.076 -5.288 3.344 1.00 0.00 C ATOM 191 O GLU A 386 118.618 -6.268 2.834 1.00 0.00 O ATOM 192 CB GLU A 386 119.903 -3.700 2.781 1.00 0.00 C ATOM 193 CG GLU A 386 119.513 -2.499 1.909 1.00 0.00 C ATOM 194 CD GLU A 386 120.547 -2.192 0.827 1.00 0.00 C ATOM 195 OE1 GLU A 386 120.529 -2.853 -0.252 1.00 0.00 O ATOM 196 OE2 GLU A 386 121.377 -1.285 1.019 1.00 0.00 O ATOM 0 H GLU A 386 120.519 -4.864 4.886 1.00 0.00 H new ATOM 0 HA GLU A 386 118.303 -3.233 4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 386 120.848 -3.472 3.274 1.00 0.00 H new ATOM 0 HB3 GLU A 386 120.083 -4.553 2.127 1.00 0.00 H new ATOM 0 HG2 GLU A 386 118.549 -2.695 1.439 1.00 0.00 H new ATOM 0 HG3 GLU A 386 119.386 -1.622 2.543 1.00 0.00 H new ATOM 203 N CYS A 387 116.804 -5.206 3.553 1.00 0.00 N ATOM 204 CA CYS A 387 115.850 -6.218 3.143 1.00 0.00 C ATOM 205 C CYS A 387 115.725 -6.482 1.610 1.00 0.00 C ATOM 206 O CYS A 387 115.400 -7.612 1.268 1.00 0.00 O ATOM 207 CB CYS A 387 114.493 -5.834 3.655 1.00 0.00 C ATOM 208 SG CYS A 387 114.006 -4.175 3.175 1.00 0.00 S ATOM 0 H CYS A 387 116.373 -4.413 4.028 1.00 0.00 H new ATOM 0 HA CYS A 387 116.236 -7.145 3.566 1.00 0.00 H new ATOM 0 HB2 CYS A 387 113.756 -6.545 3.283 1.00 0.00 H new ATOM 0 HB3 CYS A 387 114.487 -5.908 4.742 1.00 0.00 H new ATOM 213 N PRO A 388 115.982 -5.458 0.670 1.00 0.00 N ATOM 214 CA PRO A 388 115.714 -5.544 -0.768 1.00 0.00 C ATOM 215 C PRO A 388 115.855 -6.958 -1.419 1.00 0.00 C ATOM 216 O PRO A 388 114.882 -7.734 -1.440 1.00 0.00 O ATOM 217 CB PRO A 388 116.682 -4.480 -1.382 1.00 0.00 C ATOM 218 CG PRO A 388 117.529 -4.101 -0.246 1.00 0.00 C ATOM 219 CD PRO A 388 116.617 -4.172 0.901 1.00 0.00 C ATOM 0 HA PRO A 388 114.661 -5.348 -0.971 1.00 0.00 H new ATOM 0 HB2 PRO A 388 117.269 -4.895 -2.201 1.00 0.00 H new ATOM 0 HB3 PRO A 388 116.138 -3.624 -1.782 1.00 0.00 H new ATOM 0 HG2 PRO A 388 118.373 -4.781 -0.130 1.00 0.00 H new ATOM 0 HG3 PRO A 388 117.941 -3.100 -0.369 1.00 0.00 H new ATOM 0 HD2 PRO A 388 117.148 -4.139 1.853 1.00 0.00 H new ATOM 0 HD3 PRO A 388 115.898 -3.352 0.908 1.00 0.00 H new ATOM 227 N ILE A 389 117.030 -7.266 -1.983 1.00 0.00 N ATOM 228 CA ILE A 389 117.316 -8.577 -2.598 1.00 0.00 C ATOM 229 C ILE A 389 116.393 -8.812 -3.842 1.00 0.00 C ATOM 230 O ILE A 389 115.511 -7.988 -4.189 1.00 0.00 O ATOM 231 CB ILE A 389 117.152 -9.758 -1.529 1.00 0.00 C ATOM 232 CG1 ILE A 389 117.858 -9.410 -0.204 1.00 0.00 C ATOM 233 CG2 ILE A 389 117.720 -11.096 -2.039 1.00 0.00 C ATOM 234 CD1 ILE A 389 119.360 -9.232 -0.337 1.00 0.00 C ATOM 0 H ILE A 389 117.813 -6.614 -2.028 1.00 0.00 H new ATOM 0 HA ILE A 389 118.352 -8.578 -2.938 1.00 0.00 H new ATOM 0 HB ILE A 389 116.079 -9.867 -1.369 1.00 0.00 H new ATOM 0 HG12 ILE A 389 117.427 -8.492 0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 389 117.658 -10.199 0.521 1.00 0.00 H new ATOM 0 HG21 ILE A 389 117.584 -11.863 -1.277 1.00 0.00 H new ATOM 0 HG22 ILE A 389 117.196 -11.391 -2.948 1.00 0.00 H new ATOM 0 HG23 ILE A 389 118.783 -10.982 -2.253 1.00 0.00 H new ATOM 0 HD11 ILE A 389 119.785 -8.989 0.637 1.00 0.00 H new ATOM 0 HD12 ILE A 389 119.805 -10.156 -0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 389 119.570 -8.423 -1.037 1.00 0.00 H new ATOM 246 N ASP A 390 116.569 -9.916 -4.496 1.00 0.00 N ATOM 247 CA ASP A 390 115.767 -10.282 -5.626 1.00 0.00 C ATOM 248 C ASP A 390 114.323 -10.585 -5.210 1.00 0.00 C ATOM 249 O ASP A 390 113.457 -10.750 -6.052 1.00 0.00 O ATOM 250 CB ASP A 390 116.395 -11.459 -6.328 1.00 0.00 C ATOM 251 CG ASP A 390 116.196 -12.783 -5.617 1.00 0.00 C ATOM 252 OD1 ASP A 390 116.997 -13.100 -4.730 1.00 0.00 O ATOM 253 OD2 ASP A 390 115.262 -13.533 -5.963 1.00 0.00 O ATOM 0 H ASP A 390 117.285 -10.602 -4.258 1.00 0.00 H new ATOM 0 HA ASP A 390 115.727 -9.440 -6.318 1.00 0.00 H new ATOM 0 HB2 ASP A 390 115.980 -11.533 -7.333 1.00 0.00 H new ATOM 0 HB3 ASP A 390 117.464 -11.275 -6.438 1.00 0.00 H new ATOM 258 N ALA A 391 114.074 -10.590 -3.903 1.00 0.00 N ATOM 259 CA ALA A 391 112.745 -10.727 -3.363 1.00 0.00 C ATOM 260 C ALA A 391 112.015 -9.410 -3.594 1.00 0.00 C ATOM 261 O ALA A 391 110.797 -9.370 -3.798 1.00 0.00 O ATOM 262 CB ALA A 391 112.803 -11.052 -1.875 1.00 0.00 C ATOM 0 H ALA A 391 114.801 -10.498 -3.193 1.00 0.00 H new ATOM 0 HA ALA A 391 112.218 -11.544 -3.856 1.00 0.00 H new ATOM 0 HB1 ALA A 391 111.790 -11.152 -1.485 1.00 0.00 H new ATOM 0 HB2 ALA A 391 113.342 -11.988 -1.728 1.00 0.00 H new ATOM 0 HB3 ALA A 391 113.318 -10.249 -1.347 1.00 0.00 H new ATOM 268 N CYS A 392 112.801 -8.332 -3.609 1.00 0.00 N ATOM 269 CA CYS A 392 112.319 -6.984 -3.897 1.00 0.00 C ATOM 270 C CYS A 392 112.166 -6.809 -5.398 1.00 0.00 C ATOM 271 O CYS A 392 111.697 -5.775 -5.862 1.00 0.00 O ATOM 272 CB CYS A 392 113.311 -5.959 -3.373 1.00 0.00 C ATOM 273 SG CYS A 392 112.795 -4.216 -3.466 1.00 0.00 S ATOM 0 H CYS A 392 113.802 -8.373 -3.419 1.00 0.00 H new ATOM 0 HA CYS A 392 111.355 -6.838 -3.409 1.00 0.00 H new ATOM 0 HB2 CYS A 392 113.530 -6.196 -2.332 1.00 0.00 H new ATOM 0 HB3 CYS A 392 114.243 -6.070 -3.928 1.00 0.00 H new ATOM 278 N PHE A 393 112.675 -7.820 -6.118 1.00 0.00 N ATOM 279 CA PHE A 393 112.612 -7.986 -7.577 1.00 0.00 C ATOM 280 C PHE A 393 113.920 -7.564 -8.180 1.00 0.00 C ATOM 281 O PHE A 393 114.106 -6.397 -8.416 1.00 0.00 O ATOM 282 CB PHE A 393 111.436 -7.243 -8.275 1.00 0.00 C ATOM 283 CG PHE A 393 110.054 -7.797 -7.998 1.00 0.00 C ATOM 284 CD1 PHE A 393 109.583 -8.893 -8.695 1.00 0.00 C ATOM 285 CD2 PHE A 393 109.230 -7.214 -7.046 1.00 0.00 C ATOM 286 CE1 PHE A 393 108.323 -9.398 -8.446 1.00 0.00 C ATOM 287 CE2 PHE A 393 107.971 -7.713 -6.793 1.00 0.00 C ATOM 288 CZ PHE A 393 107.515 -8.806 -7.494 1.00 0.00 C ATOM 0 H PHE A 393 113.172 -8.590 -5.670 1.00 0.00 H new ATOM 0 HA PHE A 393 112.419 -9.045 -7.750 1.00 0.00 H new ATOM 0 HB2 PHE A 393 111.457 -6.198 -7.967 1.00 0.00 H new ATOM 0 HB3 PHE A 393 111.606 -7.262 -9.351 1.00 0.00 H new ATOM 0 HD1 PHE A 393 110.207 -9.359 -9.443 1.00 0.00 H new ATOM 0 HD2 PHE A 393 109.581 -6.355 -6.494 1.00 0.00 H new ATOM 0 HE1 PHE A 393 107.968 -10.257 -8.996 1.00 0.00 H new ATOM 0 HE2 PHE A 393 107.344 -7.248 -6.047 1.00 0.00 H new ATOM 0 HZ PHE A 393 106.528 -9.200 -7.301 1.00 0.00 H new ATOM 298 N LEU A 394 114.887 -8.519 -8.311 1.00 0.00 N ATOM 299 CA LEU A 394 116.220 -8.239 -8.888 1.00 0.00 C ATOM 300 C LEU A 394 117.079 -7.518 -7.832 1.00 0.00 C ATOM 301 O LEU A 394 116.542 -7.011 -6.846 1.00 0.00 O ATOM 302 CB LEU A 394 116.163 -7.370 -10.201 1.00 0.00 C ATOM 303 CG LEU A 394 115.697 -8.010 -11.527 1.00 0.00 C ATOM 304 CD1 LEU A 394 114.266 -8.526 -11.464 1.00 0.00 C ATOM 305 CD2 LEU A 394 115.835 -6.985 -12.634 1.00 0.00 C ATOM 0 H LEU A 394 114.759 -9.489 -8.022 1.00 0.00 H new ATOM 0 HA LEU A 394 116.658 -9.197 -9.168 1.00 0.00 H new ATOM 0 HB2 LEU A 394 115.507 -6.522 -10.001 1.00 0.00 H new ATOM 0 HB3 LEU A 394 117.162 -6.968 -10.368 1.00 0.00 H new ATOM 0 HG LEU A 394 116.328 -8.877 -11.722 1.00 0.00 H new ATOM 0 HD11 LEU A 394 113.995 -8.965 -12.424 1.00 0.00 H new ATOM 0 HD12 LEU A 394 114.186 -9.283 -10.684 1.00 0.00 H new ATOM 0 HD13 LEU A 394 113.591 -7.700 -11.239 1.00 0.00 H new ATOM 0 HD21 LEU A 394 115.509 -7.423 -13.578 1.00 0.00 H new ATOM 0 HD22 LEU A 394 115.218 -6.116 -12.405 1.00 0.00 H new ATOM 0 HD23 LEU A 394 116.877 -6.677 -12.717 1.00 0.00 H new ATOM 317 N PRO A 395 118.422 -7.533 -7.959 1.00 0.00 N ATOM 318 CA PRO A 395 119.330 -6.746 -7.094 1.00 0.00 C ATOM 319 C PRO A 395 119.152 -5.233 -7.238 1.00 0.00 C ATOM 320 O PRO A 395 120.106 -4.515 -7.454 1.00 0.00 O ATOM 321 CB PRO A 395 120.729 -7.134 -7.562 1.00 0.00 C ATOM 322 CG PRO A 395 120.542 -7.823 -8.867 1.00 0.00 C ATOM 323 CD PRO A 395 119.183 -8.427 -8.838 1.00 0.00 C ATOM 0 HA PRO A 395 119.130 -6.962 -6.044 1.00 0.00 H new ATOM 0 HB2 PRO A 395 121.363 -6.254 -7.671 1.00 0.00 H new ATOM 0 HB3 PRO A 395 121.215 -7.790 -6.840 1.00 0.00 H new ATOM 0 HG2 PRO A 395 120.635 -7.119 -9.694 1.00 0.00 H new ATOM 0 HG3 PRO A 395 121.303 -8.589 -9.013 1.00 0.00 H new ATOM 0 HD2 PRO A 395 118.745 -8.476 -9.835 1.00 0.00 H new ATOM 0 HD3 PRO A 395 119.206 -9.445 -8.450 1.00 0.00 H new ATOM 331 N LYS A 396 117.923 -4.793 -7.033 1.00 0.00 N ATOM 332 CA LYS A 396 117.453 -3.396 -6.991 1.00 0.00 C ATOM 333 C LYS A 396 118.166 -2.324 -7.845 1.00 0.00 C ATOM 334 O LYS A 396 117.616 -1.851 -8.864 1.00 0.00 O ATOM 335 CB LYS A 396 117.094 -3.002 -5.558 1.00 0.00 C ATOM 336 CG LYS A 396 118.020 -3.569 -4.508 1.00 0.00 C ATOM 337 CD LYS A 396 119.235 -2.663 -4.299 1.00 0.00 C ATOM 338 CE LYS A 396 120.550 -3.429 -4.378 1.00 0.00 C ATOM 339 NZ LYS A 396 121.037 -3.908 -3.063 1.00 0.00 N ATOM 0 H LYS A 396 117.156 -5.447 -6.878 1.00 0.00 H new ATOM 0 HA LYS A 396 116.540 -3.403 -7.587 1.00 0.00 H new ATOM 0 HB2 LYS A 396 117.098 -1.915 -5.481 1.00 0.00 H new ATOM 0 HB3 LYS A 396 116.077 -3.333 -5.346 1.00 0.00 H new ATOM 0 HG2 LYS A 396 117.482 -3.683 -3.567 1.00 0.00 H new ATOM 0 HG3 LYS A 396 118.351 -4.563 -4.809 1.00 0.00 H new ATOM 0 HD2 LYS A 396 119.231 -1.875 -5.052 1.00 0.00 H new ATOM 0 HD3 LYS A 396 119.159 -2.176 -3.327 1.00 0.00 H new ATOM 0 HE2 LYS A 396 120.424 -4.284 -5.043 1.00 0.00 H new ATOM 0 HE3 LYS A 396 121.309 -2.787 -4.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 396 122.065 -4.061 -3.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 396 120.824 -3.197 -2.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 396 120.564 -4.803 -2.823 1.00 0.00 H new ATOM 353 N SER A 397 119.369 -2.006 -7.463 1.00 0.00 N ATOM 354 CA SER A 397 120.226 -1.039 -8.107 1.00 0.00 C ATOM 355 C SER A 397 120.844 -1.645 -9.379 1.00 0.00 C ATOM 356 O SER A 397 121.784 -1.096 -9.941 1.00 0.00 O ATOM 357 CB SER A 397 121.312 -0.621 -7.102 1.00 0.00 C ATOM 358 OG SER A 397 122.140 0.408 -7.598 1.00 0.00 O ATOM 0 H SER A 397 119.807 -2.436 -6.649 1.00 0.00 H new ATOM 0 HA SER A 397 119.656 -0.161 -8.410 1.00 0.00 H new ATOM 0 HB2 SER A 397 120.839 -0.289 -6.178 1.00 0.00 H new ATOM 0 HB3 SER A 397 121.925 -1.487 -6.853 1.00 0.00 H new ATOM 0 HG SER A 397 122.296 0.270 -8.556 1.00 0.00 H new ATOM 364 N ASP A 398 120.295 -2.782 -9.794 1.00 0.00 N ATOM 365 CA ASP A 398 120.663 -3.466 -11.027 1.00 0.00 C ATOM 366 C ASP A 398 120.630 -2.537 -12.251 1.00 0.00 C ATOM 367 O ASP A 398 121.638 -1.962 -12.620 1.00 0.00 O ATOM 368 CB ASP A 398 119.819 -4.768 -11.189 1.00 0.00 C ATOM 369 CG ASP A 398 119.919 -5.423 -12.550 1.00 0.00 C ATOM 370 OD1 ASP A 398 119.116 -5.102 -13.446 1.00 0.00 O ATOM 371 OD2 ASP A 398 120.792 -6.280 -12.739 1.00 0.00 O ATOM 0 H ASP A 398 119.565 -3.264 -9.270 1.00 0.00 H new ATOM 0 HA ASP A 398 121.707 -3.772 -10.958 1.00 0.00 H new ATOM 0 HB2 ASP A 398 120.135 -5.486 -10.432 1.00 0.00 H new ATOM 0 HB3 ASP A 398 118.773 -4.534 -10.990 1.00 0.00 H new ATOM 376 N SER A 399 119.508 -2.382 -12.846 1.00 0.00 N ATOM 377 CA SER A 399 119.338 -1.486 -13.956 1.00 0.00 C ATOM 378 C SER A 399 117.963 -0.864 -13.872 1.00 0.00 C ATOM 379 O SER A 399 117.330 -0.602 -14.902 1.00 0.00 O ATOM 380 CB SER A 399 119.490 -2.212 -15.313 1.00 0.00 C ATOM 381 OG SER A 399 120.739 -2.891 -15.406 1.00 0.00 O ATOM 0 H SER A 399 118.657 -2.878 -12.580 1.00 0.00 H new ATOM 0 HA SER A 399 120.114 -0.723 -13.901 1.00 0.00 H new ATOM 0 HB2 SER A 399 118.676 -2.927 -15.437 1.00 0.00 H new ATOM 0 HB3 SER A 399 119.406 -1.489 -16.125 1.00 0.00 H new ATOM 0 HG SER A 399 120.803 -3.341 -16.274 1.00 0.00 H new ATOM 387 N ALA A 400 117.523 -0.637 -12.619 1.00 0.00 N ATOM 388 CA ALA A 400 116.255 -0.004 -12.285 1.00 0.00 C ATOM 389 C ALA A 400 115.107 -0.997 -12.281 1.00 0.00 C ATOM 390 O ALA A 400 114.386 -1.133 -13.263 1.00 0.00 O ATOM 391 CB ALA A 400 115.941 1.226 -13.159 1.00 0.00 C ATOM 0 H ALA A 400 118.064 -0.901 -11.795 1.00 0.00 H new ATOM 0 HA ALA A 400 116.369 0.369 -11.267 1.00 0.00 H new ATOM 0 HB1 ALA A 400 114.983 1.651 -12.859 1.00 0.00 H new ATOM 0 HB2 ALA A 400 116.725 1.973 -13.031 1.00 0.00 H new ATOM 0 HB3 ALA A 400 115.893 0.926 -14.206 1.00 0.00 H new ATOM 397 N ARG A 401 114.996 -1.770 -11.212 1.00 0.00 N ATOM 398 CA ARG A 401 113.885 -2.720 -11.090 1.00 0.00 C ATOM 399 C ARG A 401 112.591 -2.007 -10.715 1.00 0.00 C ATOM 400 O ARG A 401 112.655 -0.829 -10.312 1.00 0.00 O ATOM 401 CB ARG A 401 114.242 -3.868 -10.113 1.00 0.00 C ATOM 402 CG ARG A 401 114.696 -3.489 -8.695 1.00 0.00 C ATOM 403 CD ARG A 401 113.582 -3.141 -7.681 1.00 0.00 C ATOM 404 NE ARG A 401 113.239 -1.705 -7.590 1.00 0.00 N ATOM 405 CZ ARG A 401 113.118 -1.004 -6.429 1.00 0.00 C ATOM 406 NH1 ARG A 401 113.386 -1.580 -5.263 1.00 0.00 N ATOM 407 NH2 ARG A 401 112.694 0.261 -6.452 1.00 0.00 N ATOM 0 H ARG A 401 115.645 -1.765 -10.426 1.00 0.00 H new ATOM 0 HA ARG A 401 113.715 -3.179 -12.064 1.00 0.00 H new ATOM 0 HB2 ARG A 401 113.369 -4.515 -10.023 1.00 0.00 H new ATOM 0 HB3 ARG A 401 115.033 -4.462 -10.570 1.00 0.00 H new ATOM 0 HG2 ARG A 401 115.278 -4.317 -8.291 1.00 0.00 H new ATOM 0 HG3 ARG A 401 115.368 -2.634 -8.770 1.00 0.00 H new ATOM 0 HD2 ARG A 401 112.683 -3.697 -7.948 1.00 0.00 H new ATOM 0 HD3 ARG A 401 113.890 -3.488 -6.694 1.00 0.00 H new ATOM 0 HE ARG A 401 113.081 -1.202 -8.463 1.00 0.00 H new ATOM 0 HH11 ARG A 401 113.685 -2.555 -5.232 1.00 0.00 H new ATOM 0 HH12 ARG A 401 113.293 -1.048 -4.398 1.00 0.00 H new ATOM 0 HH21 ARG A 401 112.460 0.704 -7.340 1.00 0.00 H new ATOM 0 HH22 ARG A 401 112.604 0.785 -5.581 1.00 0.00 H new ATOM 421 N PRO A 402 111.407 -2.693 -10.876 1.00 0.00 N ATOM 422 CA PRO A 402 110.068 -2.188 -10.514 1.00 0.00 C ATOM 423 C PRO A 402 110.041 -1.215 -9.293 1.00 0.00 C ATOM 424 O PRO A 402 110.810 -1.345 -8.383 1.00 0.00 O ATOM 425 CB PRO A 402 109.290 -3.474 -10.183 1.00 0.00 C ATOM 426 CG PRO A 402 110.081 -4.613 -10.770 1.00 0.00 C ATOM 427 CD PRO A 402 111.256 -4.020 -11.503 1.00 0.00 C ATOM 0 HA PRO A 402 109.653 -1.590 -11.325 1.00 0.00 H new ATOM 0 HB2 PRO A 402 109.178 -3.594 -9.105 1.00 0.00 H new ATOM 0 HB3 PRO A 402 108.286 -3.440 -10.606 1.00 0.00 H new ATOM 0 HG2 PRO A 402 110.421 -5.288 -9.985 1.00 0.00 H new ATOM 0 HG3 PRO A 402 109.462 -5.199 -11.449 1.00 0.00 H new ATOM 0 HD2 PRO A 402 112.154 -4.627 -11.383 1.00 0.00 H new ATOM 0 HD3 PRO A 402 111.065 -3.941 -12.573 1.00 0.00 H new ATOM 435 N PRO A 403 109.115 -0.264 -9.276 1.00 0.00 N ATOM 436 CA PRO A 403 109.052 0.789 -8.238 1.00 0.00 C ATOM 437 C PRO A 403 108.651 0.283 -6.832 1.00 0.00 C ATOM 438 O PRO A 403 108.266 -0.869 -6.648 1.00 0.00 O ATOM 439 CB PRO A 403 107.991 1.738 -8.776 1.00 0.00 C ATOM 440 CG PRO A 403 107.157 0.906 -9.686 1.00 0.00 C ATOM 441 CD PRO A 403 108.032 -0.156 -10.244 1.00 0.00 C ATOM 0 HA PRO A 403 110.034 1.235 -8.081 1.00 0.00 H new ATOM 0 HB2 PRO A 403 107.393 2.160 -7.968 1.00 0.00 H new ATOM 0 HB3 PRO A 403 108.443 2.574 -9.309 1.00 0.00 H new ATOM 0 HG2 PRO A 403 106.319 0.467 -9.145 1.00 0.00 H new ATOM 0 HG3 PRO A 403 106.736 1.516 -10.485 1.00 0.00 H new ATOM 0 HD2 PRO A 403 107.496 -1.099 -10.351 1.00 0.00 H new ATOM 0 HD3 PRO A 403 108.405 0.112 -11.232 1.00 0.00 H new ATOM 449 N ASP A 404 108.701 1.176 -5.861 1.00 0.00 N ATOM 450 CA ASP A 404 108.399 0.871 -4.429 1.00 0.00 C ATOM 451 C ASP A 404 106.905 0.985 -4.050 1.00 0.00 C ATOM 452 O ASP A 404 106.567 1.532 -3.009 1.00 0.00 O ATOM 453 CB ASP A 404 109.187 1.803 -3.502 1.00 0.00 C ATOM 454 CG ASP A 404 110.687 1.526 -3.406 1.00 0.00 C ATOM 455 OD1 ASP A 404 111.393 1.633 -4.443 1.00 0.00 O ATOM 456 OD2 ASP A 404 111.200 1.285 -2.303 1.00 0.00 O ATOM 0 H ASP A 404 108.953 2.151 -6.021 1.00 0.00 H new ATOM 0 HA ASP A 404 108.694 -0.171 -4.302 1.00 0.00 H new ATOM 0 HB2 ASP A 404 109.046 2.829 -3.843 1.00 0.00 H new ATOM 0 HB3 ASP A 404 108.759 1.738 -2.502 1.00 0.00 H new ATOM 461 N CYS A 405 106.042 0.533 -4.905 1.00 0.00 N ATOM 462 CA CYS A 405 104.581 0.382 -4.587 1.00 0.00 C ATOM 463 C CYS A 405 103.839 1.656 -4.272 1.00 0.00 C ATOM 464 O CYS A 405 103.154 2.154 -5.125 1.00 0.00 O ATOM 465 CB CYS A 405 104.317 -0.634 -3.508 1.00 0.00 C ATOM 466 SG CYS A 405 104.258 -2.355 -4.083 1.00 0.00 S ATOM 0 H CYS A 405 106.289 0.248 -5.853 1.00 0.00 H new ATOM 0 HA CYS A 405 104.177 0.023 -5.534 1.00 0.00 H new ATOM 0 HB2 CYS A 405 105.093 -0.546 -2.748 1.00 0.00 H new ATOM 0 HB3 CYS A 405 103.369 -0.394 -3.026 1.00 0.00 H new ATOM 471 N THR A 406 103.888 2.154 -3.019 1.00 0.00 N ATOM 472 CA THR A 406 103.329 3.486 -2.668 1.00 0.00 C ATOM 473 C THR A 406 103.845 4.509 -3.689 1.00 0.00 C ATOM 474 O THR A 406 103.159 5.440 -4.107 1.00 0.00 O ATOM 475 CB THR A 406 103.826 3.889 -1.253 1.00 0.00 C ATOM 476 OG1 THR A 406 103.171 3.152 -0.227 1.00 0.00 O ATOM 477 CG2 THR A 406 103.736 5.373 -1.025 1.00 0.00 C ATOM 0 H THR A 406 104.307 1.659 -2.232 1.00 0.00 H new ATOM 0 HA THR A 406 102.240 3.454 -2.678 1.00 0.00 H new ATOM 0 HB THR A 406 104.883 3.626 -1.204 1.00 0.00 H new ATOM 0 HG1 THR A 406 103.581 2.265 -0.149 1.00 0.00 H new ATOM 0 HG21 THR A 406 104.094 5.610 -0.023 1.00 0.00 H new ATOM 0 HG22 THR A 406 104.350 5.892 -1.761 1.00 0.00 H new ATOM 0 HG23 THR A 406 102.699 5.694 -1.125 1.00 0.00 H new ATOM 485 N ALA A 407 105.059 4.272 -4.051 1.00 0.00 N ATOM 486 CA ALA A 407 105.779 4.935 -5.103 1.00 0.00 C ATOM 487 C ALA A 407 104.946 5.054 -6.435 1.00 0.00 C ATOM 488 O ALA A 407 105.220 5.924 -7.259 1.00 0.00 O ATOM 489 CB ALA A 407 107.039 4.143 -5.268 1.00 0.00 C ATOM 0 H ALA A 407 105.623 3.558 -3.590 1.00 0.00 H new ATOM 0 HA ALA A 407 105.993 5.973 -4.849 1.00 0.00 H new ATOM 0 HB1 ALA A 407 107.647 4.587 -6.057 1.00 0.00 H new ATOM 0 HB2 ALA A 407 107.598 4.149 -4.332 1.00 0.00 H new ATOM 0 HB3 ALA A 407 106.791 3.116 -5.536 1.00 0.00 H new ATOM 495 N VAL A 408 103.955 4.188 -6.628 1.00 0.00 N ATOM 496 CA VAL A 408 103.042 4.263 -7.760 1.00 0.00 C ATOM 497 C VAL A 408 101.613 4.529 -7.238 1.00 0.00 C ATOM 498 O VAL A 408 100.770 5.050 -7.948 1.00 0.00 O ATOM 499 CB VAL A 408 103.039 2.936 -8.607 1.00 0.00 C ATOM 500 CG1 VAL A 408 104.433 2.435 -8.812 1.00 0.00 C ATOM 501 CG2 VAL A 408 102.173 1.829 -8.010 1.00 0.00 C ATOM 0 H VAL A 408 103.763 3.409 -5.997 1.00 0.00 H new ATOM 0 HA VAL A 408 103.379 5.073 -8.407 1.00 0.00 H new ATOM 0 HB VAL A 408 102.594 3.199 -9.567 1.00 0.00 H new ATOM 0 HG11 VAL A 408 104.407 1.517 -9.400 1.00 0.00 H new ATOM 0 HG12 VAL A 408 105.016 3.188 -9.341 1.00 0.00 H new ATOM 0 HG13 VAL A 408 104.893 2.233 -7.845 1.00 0.00 H new ATOM 0 HG21 VAL A 408 102.220 0.946 -8.648 1.00 0.00 H new ATOM 0 HG22 VAL A 408 102.539 1.578 -7.015 1.00 0.00 H new ATOM 0 HG23 VAL A 408 101.141 2.172 -7.941 1.00 0.00 H new ATOM 511 N GLY A 409 101.375 4.186 -5.968 1.00 0.00 N ATOM 512 CA GLY A 409 100.059 4.290 -5.434 1.00 0.00 C ATOM 513 C GLY A 409 99.578 3.059 -4.687 1.00 0.00 C ATOM 514 O GLY A 409 98.383 2.853 -4.552 1.00 0.00 O ATOM 0 H GLY A 409 102.081 3.841 -5.317 1.00 0.00 H new ATOM 0 HA2 GLY A 409 100.022 5.145 -4.759 1.00 0.00 H new ATOM 0 HA3 GLY A 409 99.366 4.497 -6.249 1.00 0.00 H new ATOM 518 N ARG A 410 100.478 2.175 -4.316 1.00 0.00 N ATOM 519 CA ARG A 410 100.153 1.040 -3.447 1.00 0.00 C ATOM 520 C ARG A 410 100.568 1.340 -2.020 1.00 0.00 C ATOM 521 O ARG A 410 101.617 0.852 -1.578 1.00 0.00 O ATOM 522 CB ARG A 410 100.901 -0.229 -3.877 1.00 0.00 C ATOM 523 CG ARG A 410 100.270 -1.016 -4.994 1.00 0.00 C ATOM 524 CD ARG A 410 98.723 -0.999 -4.919 1.00 0.00 C ATOM 525 NE ARG A 410 98.073 0.193 -5.517 1.00 0.00 N ATOM 526 CZ ARG A 410 97.044 0.139 -6.391 1.00 0.00 C ATOM 527 NH1 ARG A 410 96.617 -1.037 -6.866 1.00 0.00 N ATOM 528 NH2 ARG A 410 96.450 1.258 -6.798 1.00 0.00 N ATOM 0 H ARG A 410 101.456 2.213 -4.602 1.00 0.00 H new ATOM 0 HA ARG A 410 99.077 0.881 -3.522 1.00 0.00 H new ATOM 0 HB2 ARG A 410 101.909 0.052 -4.181 1.00 0.00 H new ATOM 0 HB3 ARG A 410 101.000 -0.881 -3.009 1.00 0.00 H new ATOM 0 HG2 ARG A 410 100.590 -0.606 -5.952 1.00 0.00 H new ATOM 0 HG3 ARG A 410 100.623 -2.047 -4.955 1.00 0.00 H new ATOM 0 HD2 ARG A 410 98.342 -1.890 -5.419 1.00 0.00 H new ATOM 0 HD3 ARG A 410 98.425 -1.068 -3.873 1.00 0.00 H new ATOM 0 HE ARG A 410 98.426 1.112 -5.251 1.00 0.00 H new ATOM 0 HH11 ARG A 410 97.069 -1.902 -6.569 1.00 0.00 H new ATOM 0 HH12 ARG A 410 95.840 -1.069 -7.525 1.00 0.00 H new ATOM 0 HH21 ARG A 410 96.771 2.161 -6.450 1.00 0.00 H new ATOM 0 HH22 ARG A 410 95.674 1.212 -7.458 1.00 0.00 H new ATOM 542 N PRO A 411 99.784 2.124 -1.247 1.00 0.00 N ATOM 543 CA PRO A 411 100.179 2.497 0.114 1.00 0.00 C ATOM 544 C PRO A 411 100.001 1.318 1.032 1.00 0.00 C ATOM 545 O PRO A 411 100.525 1.266 2.128 1.00 0.00 O ATOM 546 CB PRO A 411 99.194 3.603 0.475 1.00 0.00 C ATOM 547 CG PRO A 411 97.969 3.269 -0.300 1.00 0.00 C ATOM 548 CD PRO A 411 98.447 2.688 -1.590 1.00 0.00 C ATOM 0 HA PRO A 411 101.219 2.811 0.196 1.00 0.00 H new ATOM 0 HB2 PRO A 411 98.994 3.624 1.546 1.00 0.00 H new ATOM 0 HB3 PRO A 411 99.581 4.585 0.204 1.00 0.00 H new ATOM 0 HG2 PRO A 411 97.346 2.557 0.242 1.00 0.00 H new ATOM 0 HG3 PRO A 411 97.362 4.157 -0.473 1.00 0.00 H new ATOM 0 HD2 PRO A 411 97.769 1.918 -1.958 1.00 0.00 H new ATOM 0 HD3 PRO A 411 98.520 3.447 -2.369 1.00 0.00 H new ATOM 556 N ASP A 412 99.322 0.342 0.514 1.00 0.00 N ATOM 557 CA ASP A 412 98.982 -0.856 1.250 1.00 0.00 C ATOM 558 C ASP A 412 100.235 -1.728 1.343 1.00 0.00 C ATOM 559 O ASP A 412 100.500 -2.421 2.332 1.00 0.00 O ATOM 560 CB ASP A 412 97.839 -1.558 0.501 1.00 0.00 C ATOM 561 CG ASP A 412 97.068 -2.543 1.328 1.00 0.00 C ATOM 562 OD1 ASP A 412 97.168 -2.519 2.570 1.00 0.00 O ATOM 563 OD2 ASP A 412 96.292 -3.308 0.744 1.00 0.00 O ATOM 0 H ASP A 412 98.979 0.346 -0.447 1.00 0.00 H new ATOM 0 HA ASP A 412 98.646 -0.640 2.264 1.00 0.00 H new ATOM 0 HB2 ASP A 412 97.151 -0.802 0.123 1.00 0.00 H new ATOM 0 HB3 ASP A 412 98.252 -2.074 -0.365 1.00 0.00 H new ATOM 568 N CYS A 413 101.072 -1.548 0.366 1.00 0.00 N ATOM 569 CA CYS A 413 102.291 -2.298 0.283 1.00 0.00 C ATOM 570 C CYS A 413 103.384 -1.602 1.026 1.00 0.00 C ATOM 571 O CYS A 413 104.451 -2.114 1.132 1.00 0.00 O ATOM 572 CB CYS A 413 102.678 -2.521 -1.132 1.00 0.00 C ATOM 573 SG CYS A 413 101.419 -3.369 -2.072 1.00 0.00 S ATOM 0 H CYS A 413 100.931 -0.881 -0.393 1.00 0.00 H new ATOM 0 HA CYS A 413 102.126 -3.271 0.745 1.00 0.00 H new ATOM 0 HB2 CYS A 413 102.889 -1.560 -1.601 1.00 0.00 H new ATOM 0 HB3 CYS A 413 103.600 -3.101 -1.164 1.00 0.00 H new ATOM 578 N ASN A 414 103.127 -0.347 1.449 1.00 0.00 N ATOM 579 CA ASN A 414 104.019 0.326 2.420 1.00 0.00 C ATOM 580 C ASN A 414 104.428 -0.626 3.591 1.00 0.00 C ATOM 581 O ASN A 414 105.498 -0.471 4.227 1.00 0.00 O ATOM 582 CB ASN A 414 103.391 1.640 2.925 1.00 0.00 C ATOM 583 CG ASN A 414 104.227 2.412 3.958 1.00 0.00 C ATOM 584 OD1 ASN A 414 105.069 3.238 3.597 1.00 0.00 O ATOM 585 ND2 ASN A 414 103.948 2.220 5.228 1.00 0.00 N ATOM 0 H ASN A 414 102.330 0.211 1.143 1.00 0.00 H new ATOM 0 HA ASN A 414 104.942 0.586 1.901 1.00 0.00 H new ATOM 0 HB2 ASN A 414 103.211 2.290 2.069 1.00 0.00 H new ATOM 0 HB3 ASN A 414 102.419 1.414 3.364 1.00 0.00 H new ATOM 0 HD21 ASN A 414 104.433 2.761 5.944 1.00 0.00 H new ATOM 0 HD22 ASN A 414 103.247 1.530 5.497 1.00 0.00 H new ATOM 592 N VAL A 415 103.604 -1.625 3.865 1.00 0.00 N ATOM 593 CA VAL A 415 104.008 -2.588 4.814 1.00 0.00 C ATOM 594 C VAL A 415 105.083 -3.523 4.261 1.00 0.00 C ATOM 595 O VAL A 415 104.875 -4.227 3.270 1.00 0.00 O ATOM 596 CB VAL A 415 102.875 -3.381 5.426 1.00 0.00 C ATOM 597 CG1 VAL A 415 103.462 -4.553 6.184 1.00 0.00 C ATOM 598 CG2 VAL A 415 102.095 -2.496 6.367 1.00 0.00 C ATOM 0 H VAL A 415 102.685 -1.769 3.447 1.00 0.00 H new ATOM 0 HA VAL A 415 104.437 -2.002 5.627 1.00 0.00 H new ATOM 0 HB VAL A 415 102.204 -3.745 4.648 1.00 0.00 H new ATOM 0 HG11 VAL A 415 102.658 -5.136 6.632 1.00 0.00 H new ATOM 0 HG12 VAL A 415 104.028 -5.183 5.498 1.00 0.00 H new ATOM 0 HG13 VAL A 415 104.123 -4.185 6.968 1.00 0.00 H new ATOM 0 HG21 VAL A 415 101.278 -3.066 6.809 1.00 0.00 H new ATOM 0 HG22 VAL A 415 102.754 -2.134 7.156 1.00 0.00 H new ATOM 0 HG23 VAL A 415 101.689 -1.648 5.816 1.00 0.00 H new ATOM 608 N LEU A 416 106.209 -3.450 4.916 1.00 0.00 N ATOM 609 CA LEU A 416 107.410 -4.274 4.685 1.00 0.00 C ATOM 610 C LEU A 416 107.077 -5.794 4.412 1.00 0.00 C ATOM 611 O LEU A 416 107.372 -6.265 3.307 1.00 0.00 O ATOM 612 CB LEU A 416 108.390 -4.083 5.873 1.00 0.00 C ATOM 613 CG LEU A 416 109.888 -4.445 5.667 1.00 0.00 C ATOM 614 CD1 LEU A 416 110.121 -5.944 5.480 1.00 0.00 C ATOM 615 CD2 LEU A 416 110.459 -3.677 4.499 1.00 0.00 C ATOM 0 H LEU A 416 106.342 -2.781 5.674 1.00 0.00 H new ATOM 0 HA LEU A 416 107.891 -3.931 3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 416 108.341 -3.038 6.178 1.00 0.00 H new ATOM 0 HB3 LEU A 416 108.018 -4.676 6.708 1.00 0.00 H new ATOM 0 HG LEU A 416 110.407 -4.158 6.582 1.00 0.00 H new ATOM 0 HD11 LEU A 416 111.186 -6.132 5.341 1.00 0.00 H new ATOM 0 HD12 LEU A 416 109.770 -6.480 6.362 1.00 0.00 H new ATOM 0 HD13 LEU A 416 109.574 -6.291 4.603 1.00 0.00 H new ATOM 0 HD21 LEU A 416 111.508 -3.941 4.368 1.00 0.00 H new ATOM 0 HD22 LEU A 416 109.906 -3.927 3.594 1.00 0.00 H new ATOM 0 HD23 LEU A 416 110.376 -2.607 4.691 1.00 0.00 H new ATOM 627 N PRO A 417 106.536 -6.619 5.419 1.00 0.00 N ATOM 628 CA PRO A 417 106.114 -7.995 5.126 1.00 0.00 C ATOM 629 C PRO A 417 105.162 -8.002 3.940 1.00 0.00 C ATOM 630 O PRO A 417 104.138 -7.305 3.960 1.00 0.00 O ATOM 631 CB PRO A 417 105.383 -8.463 6.397 1.00 0.00 C ATOM 632 CG PRO A 417 105.339 -7.292 7.323 1.00 0.00 C ATOM 633 CD PRO A 417 106.369 -6.309 6.854 1.00 0.00 C ATOM 0 HA PRO A 417 106.953 -8.643 4.873 1.00 0.00 H new ATOM 0 HB2 PRO A 417 104.376 -8.807 6.160 1.00 0.00 H new ATOM 0 HB3 PRO A 417 105.906 -9.301 6.858 1.00 0.00 H new ATOM 0 HG2 PRO A 417 104.348 -6.839 7.322 1.00 0.00 H new ATOM 0 HG3 PRO A 417 105.545 -7.605 8.347 1.00 0.00 H new ATOM 0 HD2 PRO A 417 106.037 -5.282 7.004 1.00 0.00 H new ATOM 0 HD3 PRO A 417 107.306 -6.424 7.398 1.00 0.00 H new ATOM 641 N PHE A 418 105.465 -8.801 2.941 1.00 0.00 N ATOM 642 CA PHE A 418 104.746 -8.720 1.700 1.00 0.00 C ATOM 643 C PHE A 418 103.410 -9.432 1.762 1.00 0.00 C ATOM 644 O PHE A 418 103.347 -10.638 2.045 1.00 0.00 O ATOM 645 CB PHE A 418 105.561 -9.298 0.554 1.00 0.00 C ATOM 646 CG PHE A 418 105.509 -8.431 -0.666 1.00 0.00 C ATOM 647 CD1 PHE A 418 105.798 -7.079 -0.579 1.00 0.00 C ATOM 648 CD2 PHE A 418 105.148 -8.951 -1.881 1.00 0.00 C ATOM 649 CE1 PHE A 418 105.726 -6.278 -1.692 1.00 0.00 C ATOM 650 CE2 PHE A 418 105.074 -8.156 -2.996 1.00 0.00 C ATOM 651 CZ PHE A 418 105.363 -6.816 -2.898 1.00 0.00 C ATOM 0 H PHE A 418 106.200 -9.508 2.968 1.00 0.00 H new ATOM 0 HA PHE A 418 104.565 -7.660 1.523 1.00 0.00 H new ATOM 0 HB2 PHE A 418 106.597 -9.417 0.870 1.00 0.00 H new ATOM 0 HB3 PHE A 418 105.187 -10.292 0.308 1.00 0.00 H new ATOM 0 HD1 PHE A 418 106.082 -6.652 0.371 1.00 0.00 H new ATOM 0 HD2 PHE A 418 104.918 -10.003 -1.962 1.00 0.00 H new ATOM 0 HE1 PHE A 418 105.955 -5.225 -1.616 1.00 0.00 H new ATOM 0 HE2 PHE A 418 104.790 -8.581 -3.947 1.00 0.00 H new ATOM 0 HZ PHE A 418 105.304 -6.186 -3.773 1.00 0.00 H new ATOM 661 N PRO A 419 102.302 -8.695 1.569 1.00 0.00 N ATOM 662 CA PRO A 419 101.001 -9.308 1.491 1.00 0.00 C ATOM 663 C PRO A 419 100.808 -10.003 0.166 1.00 0.00 C ATOM 664 O PRO A 419 100.398 -11.155 0.131 1.00 0.00 O ATOM 665 CB PRO A 419 100.002 -8.154 1.594 1.00 0.00 C ATOM 666 CG PRO A 419 100.802 -6.899 1.801 1.00 0.00 C ATOM 667 CD PRO A 419 102.239 -7.218 1.485 1.00 0.00 C ATOM 0 HA PRO A 419 100.874 -10.054 2.276 1.00 0.00 H new ATOM 0 HB2 PRO A 419 99.400 -8.083 0.688 1.00 0.00 H new ATOM 0 HB3 PRO A 419 99.313 -8.313 2.423 1.00 0.00 H new ATOM 0 HG2 PRO A 419 100.436 -6.101 1.155 1.00 0.00 H new ATOM 0 HG3 PRO A 419 100.705 -6.548 2.828 1.00 0.00 H new ATOM 0 HD2 PRO A 419 102.519 -6.862 0.494 1.00 0.00 H new ATOM 0 HD3 PRO A 419 102.918 -6.748 2.196 1.00 0.00 H new ATOM 675 N ASN A 420 101.048 -9.243 -0.943 1.00 0.00 N ATOM 676 CA ASN A 420 100.862 -9.709 -2.353 1.00 0.00 C ATOM 677 C ASN A 420 99.535 -10.362 -2.574 1.00 0.00 C ATOM 678 O ASN A 420 99.343 -11.183 -3.459 1.00 0.00 O ATOM 679 CB ASN A 420 102.074 -10.470 -3.025 1.00 0.00 C ATOM 680 CG ASN A 420 102.848 -11.566 -2.252 1.00 0.00 C ATOM 681 OD1 ASN A 420 104.044 -11.709 -2.461 1.00 0.00 O ATOM 682 ND2 ASN A 420 102.227 -12.379 -1.463 1.00 0.00 N ATOM 0 H ASN A 420 101.379 -8.280 -0.883 1.00 0.00 H new ATOM 0 HA ASN A 420 100.857 -8.778 -2.920 1.00 0.00 H new ATOM 0 HB2 ASN A 420 101.697 -10.928 -3.939 1.00 0.00 H new ATOM 0 HB3 ASN A 420 102.801 -9.715 -3.323 1.00 0.00 H new ATOM 0 HD21 ASN A 420 102.735 -13.141 -1.014 1.00 0.00 H new ATOM 0 HD22 ASN A 420 101.229 -12.259 -1.289 1.00 0.00 H new ATOM 689 N ASN A 421 98.606 -9.937 -1.764 1.00 0.00 N ATOM 690 CA ASN A 421 97.282 -10.464 -1.753 1.00 0.00 C ATOM 691 C ASN A 421 96.216 -9.386 -1.532 1.00 0.00 C ATOM 692 O ASN A 421 95.044 -9.699 -1.278 1.00 0.00 O ATOM 693 CB ASN A 421 97.164 -11.527 -0.659 1.00 0.00 C ATOM 694 CG ASN A 421 97.087 -12.950 -1.174 1.00 0.00 C ATOM 695 OD1 ASN A 421 96.440 -13.801 -0.567 1.00 0.00 O ATOM 696 ND2 ASN A 421 97.760 -13.235 -2.266 1.00 0.00 N ATOM 0 H ASN A 421 98.758 -9.197 -1.079 1.00 0.00 H new ATOM 0 HA ASN A 421 97.102 -10.901 -2.735 1.00 0.00 H new ATOM 0 HB2 ASN A 421 98.022 -11.441 0.008 1.00 0.00 H new ATOM 0 HB3 ASN A 421 96.275 -11.321 -0.063 1.00 0.00 H new ATOM 0 HD21 ASN A 421 97.756 -14.186 -2.634 1.00 0.00 H new ATOM 0 HD22 ASN A 421 98.287 -12.505 -2.746 1.00 0.00 H new ATOM 703 N ILE A 422 96.597 -8.127 -1.675 1.00 0.00 N ATOM 704 CA ILE A 422 95.687 -7.001 -1.405 1.00 0.00 C ATOM 705 C ILE A 422 95.932 -5.824 -2.361 1.00 0.00 C ATOM 706 O ILE A 422 95.009 -5.362 -3.027 1.00 0.00 O ATOM 707 CB ILE A 422 95.781 -6.494 0.068 1.00 0.00 C ATOM 708 CG1 ILE A 422 97.236 -6.402 0.497 1.00 0.00 C ATOM 709 CG2 ILE A 422 94.952 -7.326 1.051 1.00 0.00 C ATOM 710 CD1 ILE A 422 97.429 -6.033 1.927 1.00 0.00 C ATOM 0 H ILE A 422 97.531 -7.848 -1.977 1.00 0.00 H new ATOM 0 HA ILE A 422 94.683 -7.392 -1.570 1.00 0.00 H new ATOM 0 HB ILE A 422 95.342 -5.497 0.092 1.00 0.00 H new ATOM 0 HG12 ILE A 422 97.719 -7.362 0.313 1.00 0.00 H new ATOM 0 HG13 ILE A 422 97.741 -5.666 -0.128 1.00 0.00 H new ATOM 0 HG21 ILE A 422 95.063 -6.919 2.056 1.00 0.00 H new ATOM 0 HG22 ILE A 422 93.902 -7.293 0.760 1.00 0.00 H new ATOM 0 HG23 ILE A 422 95.300 -8.359 1.038 1.00 0.00 H new ATOM 0 HD11 ILE A 422 98.495 -5.989 2.151 1.00 0.00 H new ATOM 0 HD12 ILE A 422 96.978 -5.059 2.115 1.00 0.00 H new ATOM 0 HD13 ILE A 422 96.955 -6.781 2.563 1.00 0.00 H new ATOM 722 N GLY A 423 97.167 -5.357 -2.445 1.00 0.00 N ATOM 723 CA GLY A 423 97.467 -4.210 -3.277 1.00 0.00 C ATOM 724 C GLY A 423 98.511 -4.517 -4.334 1.00 0.00 C ATOM 725 O GLY A 423 98.179 -4.540 -5.512 1.00 0.00 O ATOM 0 H GLY A 423 97.968 -5.751 -1.952 1.00 0.00 H new ATOM 0 HA2 GLY A 423 96.553 -3.868 -3.762 1.00 0.00 H new ATOM 0 HA3 GLY A 423 97.820 -3.392 -2.649 1.00 0.00 H new ATOM 729 N CYS A 424 99.754 -4.691 -3.908 1.00 0.00 N ATOM 730 CA CYS A 424 100.961 -5.043 -4.709 1.00 0.00 C ATOM 731 C CYS A 424 100.692 -5.807 -6.013 1.00 0.00 C ATOM 732 O CYS A 424 100.318 -6.979 -5.984 1.00 0.00 O ATOM 733 CB CYS A 424 101.884 -5.876 -3.820 1.00 0.00 C ATOM 734 SG CYS A 424 102.015 -5.310 -2.070 1.00 0.00 S ATOM 0 H CYS A 424 99.983 -4.586 -2.920 1.00 0.00 H new ATOM 0 HA CYS A 424 101.407 -4.100 -5.024 1.00 0.00 H new ATOM 0 HB2 CYS A 424 101.532 -6.908 -3.825 1.00 0.00 H new ATOM 0 HB3 CYS A 424 102.881 -5.877 -4.260 1.00 0.00 H new ATOM 739 N PRO A 425 100.830 -5.121 -7.170 1.00 0.00 N ATOM 740 CA PRO A 425 100.691 -5.733 -8.483 1.00 0.00 C ATOM 741 C PRO A 425 102.023 -6.270 -9.046 1.00 0.00 C ATOM 742 O PRO A 425 102.023 -7.249 -9.785 1.00 0.00 O ATOM 743 CB PRO A 425 100.225 -4.559 -9.366 1.00 0.00 C ATOM 744 CG PRO A 425 100.195 -3.352 -8.480 1.00 0.00 C ATOM 745 CD PRO A 425 101.006 -3.678 -7.288 1.00 0.00 C ATOM 0 HA PRO A 425 100.017 -6.589 -8.446 1.00 0.00 H new ATOM 0 HB2 PRO A 425 100.905 -4.409 -10.204 1.00 0.00 H new ATOM 0 HB3 PRO A 425 99.239 -4.757 -9.787 1.00 0.00 H new ATOM 0 HG2 PRO A 425 100.600 -2.482 -8.997 1.00 0.00 H new ATOM 0 HG3 PRO A 425 99.172 -3.106 -8.196 1.00 0.00 H new ATOM 0 HD2 PRO A 425 102.053 -3.407 -7.423 1.00 0.00 H new ATOM 0 HD3 PRO A 425 100.653 -3.152 -6.401 1.00 0.00 H new ATOM 753 N SER A 426 103.152 -5.714 -8.571 1.00 0.00 N ATOM 754 CA SER A 426 104.491 -5.912 -9.174 1.00 0.00 C ATOM 755 C SER A 426 105.581 -5.069 -8.478 1.00 0.00 C ATOM 756 O SER A 426 106.736 -5.144 -8.848 1.00 0.00 O ATOM 757 CB SER A 426 104.541 -5.575 -10.693 1.00 0.00 C ATOM 758 OG SER A 426 103.789 -6.471 -11.504 1.00 0.00 O ATOM 0 H SER A 426 103.165 -5.108 -7.750 1.00 0.00 H new ATOM 0 HA SER A 426 104.687 -6.975 -9.034 1.00 0.00 H new ATOM 0 HB2 SER A 426 104.167 -4.562 -10.844 1.00 0.00 H new ATOM 0 HB3 SER A 426 105.579 -5.584 -11.024 1.00 0.00 H new ATOM 0 HG SER A 426 103.310 -7.106 -10.932 1.00 0.00 H new ATOM 764 N CYS A 427 105.232 -4.279 -7.497 1.00 0.00 N ATOM 765 CA CYS A 427 106.209 -3.403 -6.902 1.00 0.00 C ATOM 766 C CYS A 427 106.773 -3.947 -5.552 1.00 0.00 C ATOM 767 O CYS A 427 106.336 -5.005 -5.093 1.00 0.00 O ATOM 768 CB CYS A 427 105.546 -2.072 -6.764 1.00 0.00 C ATOM 769 SG CYS A 427 103.881 -2.172 -6.051 1.00 0.00 S ATOM 0 H CYS A 427 104.295 -4.223 -7.098 1.00 0.00 H new ATOM 0 HA CYS A 427 107.093 -3.327 -7.535 1.00 0.00 H new ATOM 0 HB2 CYS A 427 106.164 -1.429 -6.138 1.00 0.00 H new ATOM 0 HB3 CYS A 427 105.486 -1.600 -7.745 1.00 0.00 H new ATOM 774 N CYS A 428 107.755 -3.229 -4.949 1.00 0.00 N ATOM 775 CA CYS A 428 108.385 -3.637 -3.667 1.00 0.00 C ATOM 776 C CYS A 428 107.709 -2.817 -2.541 1.00 0.00 C ATOM 777 O CYS A 428 107.096 -1.809 -2.861 1.00 0.00 O ATOM 778 CB CYS A 428 109.900 -3.301 -3.739 1.00 0.00 C ATOM 779 SG CYS A 428 110.976 -4.233 -2.586 1.00 0.00 S ATOM 0 H CYS A 428 108.129 -2.361 -5.333 1.00 0.00 H new ATOM 0 HA CYS A 428 108.265 -4.704 -3.477 1.00 0.00 H new ATOM 0 HB2 CYS A 428 110.246 -3.483 -4.757 1.00 0.00 H new ATOM 0 HB3 CYS A 428 110.027 -2.236 -3.545 1.00 0.00 H new ATOM 784 N PRO A 429 107.761 -3.231 -1.222 1.00 0.00 N ATOM 785 CA PRO A 429 107.123 -2.464 -0.141 1.00 0.00 C ATOM 786 C PRO A 429 107.815 -1.102 0.168 1.00 0.00 C ATOM 787 O PRO A 429 108.014 -0.286 -0.731 1.00 0.00 O ATOM 788 CB PRO A 429 107.165 -3.433 1.055 1.00 0.00 C ATOM 789 CG PRO A 429 108.305 -4.321 0.792 1.00 0.00 C ATOM 790 CD PRO A 429 108.385 -4.471 -0.691 1.00 0.00 C ATOM 0 HA PRO A 429 106.113 -2.155 -0.409 1.00 0.00 H new ATOM 0 HB2 PRO A 429 107.294 -2.894 1.994 1.00 0.00 H new ATOM 0 HB3 PRO A 429 106.236 -3.998 1.137 1.00 0.00 H new ATOM 0 HG2 PRO A 429 109.227 -3.898 1.190 1.00 0.00 H new ATOM 0 HG3 PRO A 429 108.164 -5.288 1.274 1.00 0.00 H new ATOM 0 HD2 PRO A 429 109.418 -4.571 -1.025 1.00 0.00 H new ATOM 0 HD3 PRO A 429 107.853 -5.360 -1.030 1.00 0.00 H new ATOM 798 N PHE A 430 108.222 -0.879 1.412 1.00 0.00 N ATOM 799 CA PHE A 430 108.694 0.427 1.826 1.00 0.00 C ATOM 800 C PHE A 430 109.361 0.315 3.188 1.00 0.00 C ATOM 801 O PHE A 430 109.508 -0.794 3.734 1.00 0.00 O ATOM 802 CB PHE A 430 107.492 1.374 1.940 1.00 0.00 C ATOM 803 CG PHE A 430 107.599 2.671 1.182 1.00 0.00 C ATOM 804 CD1 PHE A 430 107.339 2.714 -0.174 1.00 0.00 C ATOM 805 CD2 PHE A 430 107.929 3.842 1.822 1.00 0.00 C ATOM 806 CE1 PHE A 430 107.410 3.899 -0.874 1.00 0.00 C ATOM 807 CE2 PHE A 430 108.006 5.027 1.132 1.00 0.00 C ATOM 808 CZ PHE A 430 107.745 5.057 -0.220 1.00 0.00 C ATOM 0 H PHE A 430 108.233 -1.587 2.146 1.00 0.00 H new ATOM 0 HA PHE A 430 109.409 0.808 1.097 1.00 0.00 H new ATOM 0 HB2 PHE A 430 106.604 0.845 1.593 1.00 0.00 H new ATOM 0 HB3 PHE A 430 107.335 1.604 2.994 1.00 0.00 H new ATOM 0 HD1 PHE A 430 107.076 1.805 -0.694 1.00 0.00 H new ATOM 0 HD2 PHE A 430 108.131 3.830 2.883 1.00 0.00 H new ATOM 0 HE1 PHE A 430 107.203 3.916 -1.934 1.00 0.00 H new ATOM 0 HE2 PHE A 430 108.272 5.937 1.650 1.00 0.00 H new ATOM 0 HZ PHE A 430 107.804 5.989 -0.763 1.00 0.00 H new ATOM 818 N GLU A 431 109.767 1.457 3.725 1.00 0.00 N ATOM 819 CA GLU A 431 110.332 1.553 5.056 1.00 0.00 C ATOM 820 C GLU A 431 111.653 0.787 5.166 1.00 0.00 C ATOM 821 O GLU A 431 112.674 1.255 4.665 1.00 0.00 O ATOM 822 CB GLU A 431 109.301 1.114 6.121 1.00 0.00 C ATOM 823 CG GLU A 431 108.053 1.977 6.162 1.00 0.00 C ATOM 824 CD GLU A 431 108.312 3.391 6.611 1.00 0.00 C ATOM 825 OE1 GLU A 431 108.343 3.632 7.838 1.00 0.00 O ATOM 826 OE2 GLU A 431 108.468 4.294 5.764 1.00 0.00 O ATOM 0 H GLU A 431 109.711 2.352 3.239 1.00 0.00 H new ATOM 0 HA GLU A 431 110.570 2.599 5.250 1.00 0.00 H new ATOM 0 HB2 GLU A 431 109.011 0.081 5.927 1.00 0.00 H new ATOM 0 HB3 GLU A 431 109.776 1.133 7.102 1.00 0.00 H new ATOM 0 HG2 GLU A 431 107.602 1.997 5.170 1.00 0.00 H new ATOM 0 HG3 GLU A 431 107.327 1.519 6.833 1.00 0.00 H new ATOM 833 N CYS A 432 111.601 -0.409 5.759 1.00 0.00 N ATOM 834 CA CYS A 432 112.759 -1.333 5.957 1.00 0.00 C ATOM 835 C CYS A 432 113.888 -0.784 6.872 1.00 0.00 C ATOM 836 O CYS A 432 114.360 -1.477 7.782 1.00 0.00 O ATOM 837 CB CYS A 432 113.351 -1.747 4.621 1.00 0.00 C ATOM 838 SG CYS A 432 114.608 -3.021 4.698 1.00 0.00 S ATOM 0 H CYS A 432 110.731 -0.788 6.132 1.00 0.00 H new ATOM 0 HA CYS A 432 112.338 -2.193 6.478 1.00 0.00 H new ATOM 0 HB2 CYS A 432 112.543 -2.096 3.978 1.00 0.00 H new ATOM 0 HB3 CYS A 432 113.780 -0.866 4.144 1.00 0.00 H new ATOM 843 N SER A 433 114.299 0.425 6.634 1.00 0.00 N ATOM 844 CA SER A 433 115.412 1.071 7.292 1.00 0.00 C ATOM 845 C SER A 433 115.238 2.578 7.040 1.00 0.00 C ATOM 846 O SER A 433 114.390 2.943 6.220 1.00 0.00 O ATOM 847 CB SER A 433 116.747 0.558 6.688 1.00 0.00 C ATOM 848 OG SER A 433 116.916 -0.856 6.885 1.00 0.00 O ATOM 0 H SER A 433 113.849 1.024 5.942 1.00 0.00 H new ATOM 0 HA SER A 433 115.437 0.856 8.360 1.00 0.00 H new ATOM 0 HB2 SER A 433 116.773 0.782 5.621 1.00 0.00 H new ATOM 0 HB3 SER A 433 117.581 1.091 7.145 1.00 0.00 H new ATOM 0 HG SER A 433 117.766 -1.142 6.490 1.00 0.00 H new ATOM 854 N PRO A 434 115.979 3.469 7.739 1.00 0.00 N ATOM 855 CA PRO A 434 115.867 4.919 7.531 1.00 0.00 C ATOM 856 C PRO A 434 116.090 5.335 6.086 1.00 0.00 C ATOM 857 O PRO A 434 117.183 5.123 5.527 1.00 0.00 O ATOM 858 CB PRO A 434 116.973 5.493 8.401 1.00 0.00 C ATOM 859 CG PRO A 434 117.157 4.483 9.476 1.00 0.00 C ATOM 860 CD PRO A 434 116.955 3.155 8.810 1.00 0.00 C ATOM 0 HA PRO A 434 114.866 5.272 7.780 1.00 0.00 H new ATOM 0 HB2 PRO A 434 117.891 5.640 7.832 1.00 0.00 H new ATOM 0 HB3 PRO A 434 116.693 6.464 8.811 1.00 0.00 H new ATOM 0 HG2 PRO A 434 118.151 4.555 9.917 1.00 0.00 H new ATOM 0 HG3 PRO A 434 116.439 4.632 10.283 1.00 0.00 H new ATOM 0 HD2 PRO A 434 117.887 2.760 8.405 1.00 0.00 H new ATOM 0 HD3 PRO A 434 116.568 2.409 9.504 1.00 0.00 H new ATOM 868 N ASP A 435 115.039 5.897 5.504 1.00 0.00 N ATOM 869 CA ASP A 435 115.033 6.443 4.123 1.00 0.00 C ATOM 870 C ASP A 435 115.220 5.343 3.077 1.00 0.00 C ATOM 871 O ASP A 435 116.338 4.885 2.808 1.00 0.00 O ATOM 872 CB ASP A 435 116.106 7.524 3.979 1.00 0.00 C ATOM 873 CG ASP A 435 116.013 8.276 2.673 1.00 0.00 C ATOM 874 OD1 ASP A 435 115.111 9.127 2.532 1.00 0.00 O ATOM 875 OD2 ASP A 435 116.847 8.051 1.772 1.00 0.00 O ATOM 0 H ASP A 435 114.140 5.996 5.976 1.00 0.00 H new ATOM 0 HA ASP A 435 114.056 6.892 3.944 1.00 0.00 H new ATOM 0 HB2 ASP A 435 116.017 8.229 4.805 1.00 0.00 H new ATOM 0 HB3 ASP A 435 117.091 7.064 4.058 1.00 0.00 H new ATOM 880 N ASN A 436 114.118 4.912 2.486 1.00 0.00 N ATOM 881 CA ASN A 436 114.154 3.820 1.507 1.00 0.00 C ATOM 882 C ASN A 436 114.201 4.222 -0.020 1.00 0.00 C ATOM 883 O ASN A 436 114.215 3.303 -0.852 1.00 0.00 O ATOM 884 CB ASN A 436 113.008 2.820 1.734 1.00 0.00 C ATOM 885 CG ASN A 436 111.640 3.316 1.305 1.00 0.00 C ATOM 886 OD1 ASN A 436 111.191 2.947 0.123 1.00 0.00 O flip ATOM 887 ND2 ASN A 436 110.959 3.972 2.077 1.00 0.00 N flip ATOM 0 H ASN A 436 113.189 5.294 2.661 1.00 0.00 H new ATOM 0 HA ASN A 436 115.124 3.363 1.706 1.00 0.00 H new ATOM 0 HB2 ASN A 436 113.233 1.901 1.192 1.00 0.00 H new ATOM 0 HB3 ASN A 436 112.971 2.565 2.793 1.00 0.00 H new ATOM 0 HD21 ASN A 436 111.335 4.242 2.986 1.00 0.00 H new ATOM 0 HD22 ASN A 436 110.014 4.250 1.813 1.00 0.00 H new ATOM 894 N PRO A 437 114.217 5.540 -0.464 1.00 0.00 N ATOM 895 CA PRO A 437 114.296 5.847 -1.886 1.00 0.00 C ATOM 896 C PRO A 437 115.640 5.434 -2.486 1.00 0.00 C ATOM 897 O PRO A 437 116.652 5.289 -1.771 1.00 0.00 O ATOM 898 CB PRO A 437 114.128 7.374 -1.958 1.00 0.00 C ATOM 899 CG PRO A 437 113.540 7.734 -0.657 1.00 0.00 C ATOM 900 CD PRO A 437 114.151 6.782 0.304 1.00 0.00 C ATOM 0 HA PRO A 437 113.539 5.306 -2.454 1.00 0.00 H new ATOM 0 HB2 PRO A 437 115.084 7.873 -2.115 1.00 0.00 H new ATOM 0 HB3 PRO A 437 113.478 7.665 -2.783 1.00 0.00 H new ATOM 0 HG2 PRO A 437 113.767 8.766 -0.391 1.00 0.00 H new ATOM 0 HG3 PRO A 437 112.454 7.640 -0.673 1.00 0.00 H new ATOM 0 HD2 PRO A 437 115.139 7.111 0.626 1.00 0.00 H new ATOM 0 HD3 PRO A 437 113.544 6.670 1.203 1.00 0.00 H new ATOM 908 N MET A 438 115.640 5.283 -3.769 1.00 0.00 N ATOM 909 CA MET A 438 116.795 4.870 -4.517 1.00 0.00 C ATOM 910 C MET A 438 116.600 5.226 -5.967 1.00 0.00 C ATOM 911 O MET A 438 115.529 4.994 -6.534 1.00 0.00 O ATOM 912 CB MET A 438 117.047 3.356 -4.371 1.00 0.00 C ATOM 913 CG MET A 438 118.259 2.857 -5.151 1.00 0.00 C ATOM 914 SD MET A 438 119.776 3.705 -4.671 1.00 0.00 S ATOM 915 CE MET A 438 120.949 2.985 -5.819 1.00 0.00 C ATOM 0 H MET A 438 114.816 5.447 -4.348 1.00 0.00 H new ATOM 0 HA MET A 438 117.668 5.390 -4.123 1.00 0.00 H new ATOM 0 HB2 MET A 438 117.183 3.120 -3.316 1.00 0.00 H new ATOM 0 HB3 MET A 438 116.162 2.815 -4.707 1.00 0.00 H new ATOM 0 HG2 MET A 438 118.377 1.786 -4.989 1.00 0.00 H new ATOM 0 HG3 MET A 438 118.087 3.001 -6.218 1.00 0.00 H new ATOM 0 HE1 MET A 438 121.890 3.533 -5.769 1.00 0.00 H new ATOM 0 HE2 MET A 438 121.122 1.941 -5.556 1.00 0.00 H new ATOM 0 HE3 MET A 438 120.549 3.043 -6.831 1.00 0.00 H new ATOM 925 N PHE A 439 117.618 5.763 -6.558 1.00 0.00 N ATOM 926 CA PHE A 439 117.594 6.163 -7.924 1.00 0.00 C ATOM 927 C PHE A 439 119.020 6.109 -8.418 1.00 0.00 C ATOM 928 O PHE A 439 119.940 6.144 -7.599 1.00 0.00 O ATOM 929 CB PHE A 439 116.987 7.582 -8.047 1.00 0.00 C ATOM 930 CG PHE A 439 116.828 8.083 -9.452 1.00 0.00 C ATOM 931 CD1 PHE A 439 115.936 7.476 -10.315 1.00 0.00 C ATOM 932 CD2 PHE A 439 117.577 9.150 -9.910 1.00 0.00 C ATOM 933 CE1 PHE A 439 115.791 7.925 -11.606 1.00 0.00 C ATOM 934 CE2 PHE A 439 117.437 9.603 -11.200 1.00 0.00 C ATOM 935 CZ PHE A 439 116.543 8.990 -12.048 1.00 0.00 C ATOM 0 H PHE A 439 118.508 5.939 -6.092 1.00 0.00 H new ATOM 0 HA PHE A 439 116.970 5.506 -8.530 1.00 0.00 H new ATOM 0 HB2 PHE A 439 116.010 7.586 -7.563 1.00 0.00 H new ATOM 0 HB3 PHE A 439 117.619 8.280 -7.497 1.00 0.00 H new ATOM 0 HD1 PHE A 439 115.346 6.639 -9.971 1.00 0.00 H new ATOM 0 HD2 PHE A 439 118.280 9.633 -9.247 1.00 0.00 H new ATOM 0 HE1 PHE A 439 115.089 7.444 -12.271 1.00 0.00 H new ATOM 0 HE2 PHE A 439 118.027 10.438 -11.547 1.00 0.00 H new ATOM 0 HZ PHE A 439 116.431 9.345 -13.062 1.00 0.00 H new ATOM 945 N THR A 440 119.193 6.037 -9.729 1.00 0.00 N ATOM 946 CA THR A 440 120.493 5.898 -10.371 1.00 0.00 C ATOM 947 C THR A 440 121.073 4.490 -10.107 1.00 0.00 C ATOM 948 O THR A 440 121.791 4.262 -9.133 1.00 0.00 O ATOM 949 CB THR A 440 121.487 7.011 -9.947 1.00 0.00 C ATOM 950 OG1 THR A 440 120.846 8.294 -10.113 1.00 0.00 O ATOM 951 CG2 THR A 440 122.750 6.977 -10.809 1.00 0.00 C ATOM 0 H THR A 440 118.418 6.074 -10.391 1.00 0.00 H new ATOM 0 HA THR A 440 120.343 6.017 -11.444 1.00 0.00 H new ATOM 0 HB THR A 440 121.770 6.848 -8.907 1.00 0.00 H new ATOM 0 HG1 THR A 440 121.465 9.006 -9.846 1.00 0.00 H new ATOM 0 HG21 THR A 440 123.429 7.768 -10.490 1.00 0.00 H new ATOM 0 HG22 THR A 440 123.241 6.010 -10.698 1.00 0.00 H new ATOM 0 HG23 THR A 440 122.481 7.129 -11.854 1.00 0.00 H new ATOM 959 N PRO A 441 120.689 3.518 -10.948 1.00 0.00 N ATOM 960 CA PRO A 441 121.138 2.150 -10.824 1.00 0.00 C ATOM 961 C PRO A 441 122.463 1.913 -11.578 1.00 0.00 C ATOM 962 O PRO A 441 123.287 2.846 -11.683 1.00 0.00 O ATOM 963 CB PRO A 441 119.958 1.374 -11.432 1.00 0.00 C ATOM 964 CG PRO A 441 119.353 2.295 -12.439 1.00 0.00 C ATOM 965 CD PRO A 441 119.784 3.692 -12.095 1.00 0.00 C ATOM 0 HA PRO A 441 121.369 1.846 -9.803 1.00 0.00 H new ATOM 0 HB2 PRO A 441 120.295 0.449 -11.899 1.00 0.00 H new ATOM 0 HB3 PRO A 441 119.233 1.099 -10.666 1.00 0.00 H new ATOM 0 HG2 PRO A 441 119.680 2.030 -13.445 1.00 0.00 H new ATOM 0 HG3 PRO A 441 118.266 2.216 -12.426 1.00 0.00 H new ATOM 0 HD2 PRO A 441 120.291 4.170 -12.933 1.00 0.00 H new ATOM 0 HD3 PRO A 441 118.931 4.320 -11.838 1.00 0.00 H new ATOM 973 N SER A 442 122.621 0.699 -12.138 1.00 0.00 N ATOM 974 CA SER A 442 123.844 0.182 -12.752 1.00 0.00 C ATOM 975 C SER A 442 124.749 -0.409 -11.675 1.00 0.00 C ATOM 976 O SER A 442 124.972 0.220 -10.642 1.00 0.00 O ATOM 977 CB SER A 442 124.621 1.224 -13.599 1.00 0.00 C ATOM 978 OG SER A 442 123.776 1.838 -14.580 1.00 0.00 O ATOM 0 H SER A 442 121.857 0.024 -12.173 1.00 0.00 H new ATOM 0 HA SER A 442 123.531 -0.591 -13.454 1.00 0.00 H new ATOM 0 HB2 SER A 442 125.036 1.990 -12.944 1.00 0.00 H new ATOM 0 HB3 SER A 442 125.462 0.738 -14.094 1.00 0.00 H new ATOM 0 HG SER A 442 124.294 2.490 -15.096 1.00 0.00 H new ATOM 984 N PRO A 443 125.260 -1.641 -11.879 1.00 0.00 N ATOM 985 CA PRO A 443 126.247 -2.278 -10.962 1.00 0.00 C ATOM 986 C PRO A 443 127.486 -1.394 -10.761 1.00 0.00 C ATOM 987 O PRO A 443 128.183 -1.472 -9.746 1.00 0.00 O ATOM 988 CB PRO A 443 126.647 -3.521 -11.740 1.00 0.00 C ATOM 989 CG PRO A 443 125.416 -3.874 -12.497 1.00 0.00 C ATOM 990 CD PRO A 443 124.862 -2.565 -12.967 1.00 0.00 C ATOM 0 HA PRO A 443 125.840 -2.463 -9.968 1.00 0.00 H new ATOM 0 HB2 PRO A 443 127.485 -3.323 -12.408 1.00 0.00 H new ATOM 0 HB3 PRO A 443 126.954 -4.328 -11.075 1.00 0.00 H new ATOM 0 HG2 PRO A 443 125.644 -4.531 -13.337 1.00 0.00 H new ATOM 0 HG3 PRO A 443 124.701 -4.401 -11.865 1.00 0.00 H new ATOM 0 HD2 PRO A 443 125.283 -2.267 -13.927 1.00 0.00 H new ATOM 0 HD3 PRO A 443 123.780 -2.603 -13.092 1.00 0.00 H new ATOM 998 N ASP A 444 127.717 -0.549 -11.733 1.00 0.00 N ATOM 999 CA ASP A 444 128.850 0.390 -11.719 1.00 0.00 C ATOM 1000 C ASP A 444 128.329 1.814 -11.655 1.00 0.00 C ATOM 1001 O ASP A 444 129.049 2.768 -11.944 1.00 0.00 O ATOM 1002 CB ASP A 444 129.804 0.226 -12.952 1.00 0.00 C ATOM 1003 CG ASP A 444 130.499 -1.108 -13.030 1.00 0.00 C ATOM 1004 OD1 ASP A 444 129.862 -2.109 -13.439 1.00 0.00 O ATOM 1005 OD2 ASP A 444 131.710 -1.176 -12.741 1.00 0.00 O ATOM 0 H ASP A 444 127.133 -0.479 -12.566 1.00 0.00 H new ATOM 0 HA ASP A 444 129.443 0.160 -10.834 1.00 0.00 H new ATOM 0 HB2 ASP A 444 129.227 0.375 -13.865 1.00 0.00 H new ATOM 0 HB3 ASP A 444 130.558 1.013 -12.920 1.00 0.00 H new ATOM 1010 N GLY A 445 127.065 1.942 -11.243 1.00 0.00 N ATOM 1011 CA GLY A 445 126.385 3.241 -11.121 1.00 0.00 C ATOM 1012 C GLY A 445 127.132 4.271 -10.275 1.00 0.00 C ATOM 1013 O GLY A 445 127.079 5.472 -10.557 1.00 0.00 O ATOM 0 H GLY A 445 126.480 1.148 -10.983 1.00 0.00 H new ATOM 0 HA2 GLY A 445 126.232 3.652 -12.119 1.00 0.00 H new ATOM 0 HA3 GLY A 445 125.398 3.081 -10.687 1.00 0.00 H new ATOM 1017 N SER A 446 127.799 3.817 -9.246 1.00 0.00 N ATOM 1018 CA SER A 446 128.565 4.673 -8.357 1.00 0.00 C ATOM 1019 C SER A 446 129.744 3.936 -7.830 1.00 0.00 C ATOM 1020 O SER A 446 129.769 2.714 -7.940 1.00 0.00 O ATOM 1021 CB SER A 446 127.704 5.027 -7.131 1.00 0.00 C ATOM 1022 OG SER A 446 126.718 5.978 -7.460 1.00 0.00 O ATOM 0 H SER A 446 127.830 2.830 -8.992 1.00 0.00 H new ATOM 0 HA SER A 446 128.869 5.559 -8.915 1.00 0.00 H new ATOM 0 HB2 SER A 446 127.229 4.125 -6.744 1.00 0.00 H new ATOM 0 HB3 SER A 446 128.340 5.418 -6.337 1.00 0.00 H new ATOM 0 HG SER A 446 126.184 6.184 -6.665 1.00 0.00 H new ATOM 1028 N PRO A 447 130.774 4.675 -7.303 1.00 0.00 N ATOM 1029 CA PRO A 447 131.875 4.074 -6.567 1.00 0.00 C ATOM 1030 C PRO A 447 131.289 3.285 -5.403 1.00 0.00 C ATOM 1031 O PRO A 447 130.732 3.869 -4.458 1.00 0.00 O ATOM 1032 CB PRO A 447 132.686 5.281 -6.039 1.00 0.00 C ATOM 1033 CG PRO A 447 131.811 6.468 -6.256 1.00 0.00 C ATOM 1034 CD PRO A 447 130.950 6.134 -7.430 1.00 0.00 C ATOM 0 HA PRO A 447 132.490 3.401 -7.164 1.00 0.00 H new ATOM 0 HB2 PRO A 447 132.930 5.160 -4.984 1.00 0.00 H new ATOM 0 HB3 PRO A 447 133.630 5.385 -6.574 1.00 0.00 H new ATOM 0 HG2 PRO A 447 131.205 6.673 -5.373 1.00 0.00 H new ATOM 0 HG3 PRO A 447 132.405 7.361 -6.449 1.00 0.00 H new ATOM 0 HD2 PRO A 447 129.996 6.661 -7.395 1.00 0.00 H new ATOM 0 HD3 PRO A 447 131.428 6.403 -8.372 1.00 0.00 H new ATOM 1042 N PRO A 448 131.329 1.958 -5.492 1.00 0.00 N ATOM 1043 CA PRO A 448 130.691 1.077 -4.528 1.00 0.00 C ATOM 1044 C PRO A 448 131.246 1.200 -3.111 1.00 0.00 C ATOM 1045 O PRO A 448 130.553 0.851 -2.159 1.00 0.00 O ATOM 1046 CB PRO A 448 130.981 -0.328 -5.062 1.00 0.00 C ATOM 1047 CG PRO A 448 131.295 -0.135 -6.495 1.00 0.00 C ATOM 1048 CD PRO A 448 131.960 1.200 -6.579 1.00 0.00 C ATOM 0 HA PRO A 448 129.633 1.324 -4.438 1.00 0.00 H new ATOM 0 HB2 PRO A 448 131.816 -0.787 -4.533 1.00 0.00 H new ATOM 0 HB3 PRO A 448 130.121 -0.985 -4.931 1.00 0.00 H new ATOM 0 HG2 PRO A 448 131.950 -0.924 -6.863 1.00 0.00 H new ATOM 0 HG3 PRO A 448 130.390 -0.162 -7.103 1.00 0.00 H new ATOM 0 HD2 PRO A 448 133.039 1.122 -6.442 1.00 0.00 H new ATOM 0 HD3 PRO A 448 131.795 1.672 -7.548 1.00 0.00 H new ATOM 1056 N ASN A 449 132.497 1.677 -3.002 1.00 0.00 N ATOM 1057 CA ASN A 449 133.257 1.816 -1.735 1.00 0.00 C ATOM 1058 C ASN A 449 133.421 0.474 -1.015 1.00 0.00 C ATOM 1059 O ASN A 449 133.063 -0.565 -1.572 1.00 0.00 O ATOM 1060 CB ASN A 449 132.758 2.976 -0.786 1.00 0.00 C ATOM 1061 CG ASN A 449 131.384 2.780 -0.120 1.00 0.00 C ATOM 1062 OD1 ASN A 449 130.355 3.238 -0.642 1.00 0.00 O ATOM 1063 ND2 ASN A 449 131.344 2.130 1.023 1.00 0.00 N ATOM 0 H ASN A 449 133.029 1.988 -3.815 1.00 0.00 H new ATOM 0 HA ASN A 449 134.253 2.141 -2.035 1.00 0.00 H new ATOM 0 HB2 ASN A 449 133.500 3.116 -0.000 1.00 0.00 H new ATOM 0 HB3 ASN A 449 132.728 3.900 -1.364 1.00 0.00 H new ATOM 0 HD21 ASN A 449 130.453 1.993 1.501 1.00 0.00 H new ATOM 0 HD22 ASN A 449 132.204 1.763 1.431 1.00 0.00 H new ATOM 1070 N CYS A 450 134.044 0.481 0.169 1.00 0.00 N ATOM 1071 CA CYS A 450 134.231 -0.747 0.967 1.00 0.00 C ATOM 1072 C CYS A 450 135.181 -1.747 0.295 1.00 0.00 C ATOM 1073 O CYS A 450 135.000 -2.968 0.424 1.00 0.00 O ATOM 1074 CB CYS A 450 132.880 -1.406 1.256 1.00 0.00 C ATOM 1075 SG CYS A 450 131.860 -0.561 2.489 1.00 0.00 S ATOM 0 H CYS A 450 134.429 1.321 0.600 1.00 0.00 H new ATOM 0 HA CYS A 450 134.695 -0.449 1.907 1.00 0.00 H new ATOM 0 HB2 CYS A 450 132.318 -1.469 0.324 1.00 0.00 H new ATOM 0 HB3 CYS A 450 133.056 -2.428 1.592 1.00 0.00 H new ATOM 1080 N SER A 451 136.226 -1.191 -0.333 1.00 0.00 N ATOM 1081 CA SER A 451 137.268 -1.885 -1.106 1.00 0.00 C ATOM 1082 C SER A 451 137.112 -1.723 -2.621 1.00 0.00 C ATOM 1083 O SER A 451 138.051 -1.265 -3.259 1.00 0.00 O ATOM 1084 CB SER A 451 137.611 -3.330 -0.658 1.00 0.00 C ATOM 1085 OG SER A 451 138.699 -3.868 -1.392 1.00 0.00 O ATOM 0 H SER A 451 136.377 -0.182 -0.314 1.00 0.00 H new ATOM 0 HA SER A 451 138.173 -1.341 -0.837 1.00 0.00 H new ATOM 0 HB2 SER A 451 137.854 -3.332 0.405 1.00 0.00 H new ATOM 0 HB3 SER A 451 136.736 -3.967 -0.787 1.00 0.00 H new ATOM 0 HG SER A 451 138.886 -4.778 -1.080 1.00 0.00 H new ATOM 1091 N PRO A 452 135.971 -2.083 -3.270 1.00 0.00 N ATOM 1092 CA PRO A 452 135.798 -1.778 -4.676 1.00 0.00 C ATOM 1093 C PRO A 452 135.552 -0.272 -4.872 1.00 0.00 C ATOM 1094 O PRO A 452 134.419 0.173 -4.952 1.00 0.00 O ATOM 1095 CB PRO A 452 134.582 -2.615 -5.122 1.00 0.00 C ATOM 1096 CG PRO A 452 134.333 -3.561 -3.993 1.00 0.00 C ATOM 1097 CD PRO A 452 134.836 -2.871 -2.760 1.00 0.00 C ATOM 0 HA PRO A 452 136.682 -2.019 -5.266 1.00 0.00 H new ATOM 0 HB2 PRO A 452 133.713 -1.983 -5.307 1.00 0.00 H new ATOM 0 HB3 PRO A 452 134.789 -3.151 -6.048 1.00 0.00 H new ATOM 0 HG2 PRO A 452 133.272 -3.793 -3.905 1.00 0.00 H new ATOM 0 HG3 PRO A 452 134.854 -4.505 -4.152 1.00 0.00 H new ATOM 0 HD2 PRO A 452 134.072 -2.237 -2.311 1.00 0.00 H new ATOM 0 HD3 PRO A 452 135.148 -3.583 -1.996 1.00 0.00 H new ATOM 1105 N THR A 453 136.661 0.458 -4.863 1.00 0.00 N ATOM 1106 CA THR A 453 136.830 1.925 -4.957 1.00 0.00 C ATOM 1107 C THR A 453 138.268 2.252 -4.476 1.00 0.00 C ATOM 1108 O THR A 453 138.838 3.303 -4.812 1.00 0.00 O ATOM 1109 CB THR A 453 135.759 2.763 -4.138 1.00 0.00 C ATOM 1110 OG1 THR A 453 134.476 2.669 -4.760 1.00 0.00 O ATOM 1111 CG2 THR A 453 136.114 4.242 -4.009 1.00 0.00 C ATOM 0 H THR A 453 137.568 -0.001 -4.781 1.00 0.00 H new ATOM 0 HA THR A 453 136.669 2.220 -5.994 1.00 0.00 H new ATOM 0 HB THR A 453 135.748 2.330 -3.138 1.00 0.00 H new ATOM 0 HG1 THR A 453 134.356 1.768 -5.127 1.00 0.00 H new ATOM 0 HG21 THR A 453 135.339 4.754 -3.438 1.00 0.00 H new ATOM 0 HG22 THR A 453 137.070 4.343 -3.495 1.00 0.00 H new ATOM 0 HG23 THR A 453 136.187 4.687 -5.002 1.00 0.00 H new